A0A077Z2P0_TRITR Loading...

Basic region leucine zipper family protein

AlphaFold DB , UniProt , Accession A0A077Z2P0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 181 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M43.5Very low49.3Very low240 Ų240136.4 Ų136.4100%1.18265%0.653SS**  0110.70-159.4170.9172.900107.2D3M1-D3 PolarHBondContact O-N 3.35Å; M1-D3 VanDerWaalsContact O-N 3.12Å
2F43.1Very low49.6Very low185 Ų185131.3 Ų131.381%0.81165%0.651SS**  trans-72.5102.1-176.4-159.1-89.9000108.3Q4 V7F2-Q4 PolarHBondContact O-N 3.39Å; F2-V7 HydrophobicContact CE1-CG2 4.41Å
3D50.7Low49.9Very low80 Ų80126.7 Ų126.743%0.42865%0.646SS.*  trans-90.299.2-177.7-171.44000109.4M1 N5 K6 V7M1-D3 PolarHBondContact O-N 3.35Å; M1-D3 VanDerWaalsContact O-N 3.12Å; D3-N5 PolarHBondContact O-N 3.37Å; D3-N5 VanDerWaalsContact O-N 3.14Å; D3-N5 WeakPolarHBondContact OD1-CB 3.4Å; D3-N5 PolarHBondContact OD1-N 3.39Å; D3-N5 VanDerWaalsContact OD1-N 3.1Å; D3-N5 PolarHBondContact OD1-ND2 2.99Å; D3-K6 HydrophobicContact CB-CB 4Å; D3-K6 WeakPolarHBondContact O-CB 3.38Å; D3-K6 PolarHBondContact O-N 3.39Å; D3-V7 PolarHBondContact O-N 3.44Å
4Q46.9Very low49.8Very low141 Ų141121.1 Ų121.166%0.65964%0.636SS**Hα-helixtrans-54.1-30.6175.4-74.7-176.5-39.600111.6F2 K6 V7 L8F2-Q4 PolarHBondContact O-N 3.39Å; Q4-K6 VanDerWaalsContact C-N 3.28Å; Q4-K6 PolarHBondContact O-N 2.99Å; Q4-V7 PolarHBondContact O-N 3.4Å; Q4-L8 WeakPolarHBondContact O-CD1 3.33Å; Q4-L8 PolarHBondContact O-N 3.33Å
5N53.1Low49.9Very low105 Ų105119.7 Ų119.756%0.56163%0.626SS**Hα-helixtrans-70.8-24.2177.8-66.2-69.2000113.1D3 K9D3-N5 PolarHBondContact O-N 3.37Å; D3-N5 VanDerWaalsContact O-N 3.14Å; D3-N5 WeakPolarHBondContact OD1-CB 3.4Å; D3-N5 PolarHBondContact OD1-N 3.39Å; D3-N5 VanDerWaalsContact OD1-N 3.1Å; D3-N5 PolarHBondContact OD1-ND2 2.99Å; N5-K9 WeakPolarHBondContact O-CB 3.48Å; N5-K9 VanDerWaalsContact O-CG 3.25Å; N5-K9 WeakPolarHBondContact O-CG 3.38Å; N5-K9 PolarHBondContact O-N 3.41Å; N5-K9 VanDerWaalsContact O-N 3.13Å
6K53.5Low50Low141 Ų141119.7 Ų119.761%0.61363%0.633SS**Hα-helixtrans-77.3-34.3177.5-149.4175.9-173.9-173.70111.3D3 Q4 N10D3-K6 HydrophobicContact CB-CB 4Å; D3-K6 WeakPolarHBondContact O-CB 3.38Å; D3-K6 PolarHBondContact O-N 3.39Å; Q4-K6 VanDerWaalsContact C-N 3.28Å; Q4-K6 PolarHBondContact O-N 2.99Å; K6-N10 WeakPolarHBondContact O-CB 3.4Å; K6-N10 VanDerWaalsContact O-CG 3.26Å; K6-N10 PolarHBondContact O-N 3.31Å; K6-N10 VanDerWaalsContact O-N 3.08Å; K6-N10 PolarHBondContact O-ND2 3.29Å
7V50.2Low49.8Very low80 Ų80119.9 Ų119.949%0.48563%0.631SS.*Hα-helixtrans-68.3-43.9174.6-178.20000111F2 D3 Q4 N10 Y11F2-V7 HydrophobicContact CE1-CG2 4.41Å; D3-V7 PolarHBondContact O-N 3.44Å; Q4-V7 PolarHBondContact O-N 3.4Å; V7-N10 PolarHBondContact O-N 2.94Å; V7-Y11 WeakPolarHBondContact O-CB 3.45Å; V7-Y11 PolarHBondContact O-N 3.3Å
8L49.4Very low49.5Very low122 Ų122120.4 Ų120.464%0.63964%0.643SS**Hα-helixtrans-67.6-37.8177.5-87.1125.9000113.3Q4 N10 Y11 A12Q4-L8 WeakPolarHBondContact O-CD1 3.33Å; Q4-L8 PolarHBondContact O-N 3.33Å; L8-N10 VanDerWaalsContact C-N 3.34Å; L8-Y11 PolarHBondContact O-N 2.93Å; L8-A12 PolarHBondContact O-N 3.05Å; L8-A12 VanDerWaalsContact O-N 3.11Å
9K52.7Low49.7Very low133 Ų133118.4 Ų118.458%0.57865%0.654SS**Hα-helixtrans-66-36.1173.5-74.9174.7-177.7-179.50112.1N5 A13N5-K9 WeakPolarHBondContact O-CB 3.48Å; N5-K9 VanDerWaalsContact O-CG 3.25Å; N5-K9 WeakPolarHBondContact O-CG 3.38Å; N5-K9 PolarHBondContact O-N 3.41Å; N5-K9 VanDerWaalsContact O-N 3.13Å; K9-A13 VanDerWaalsContact O-CB 3.31Å; K9-A13 WeakPolarHBondContact O-CB 3.45Å; K9-A13 PolarHBondContact O-N 2.93Å
10N53.4Low49.9Very low107 Ų107118.2 Ų118.257%0.57265%0.65SS**Hα-helixtrans-73.8-32.3173.5-72.9-19.7000112.8K6 V7 L8 A12 A13 G14K6-N10 WeakPolarHBondContact O-CB 3.4Å; K6-N10 VanDerWaalsContact O-CG 3.26Å; K6-N10 PolarHBondContact O-N 3.31Å; K6-N10 VanDerWaalsContact O-N 3.08Å; K6-N10 PolarHBondContact O-ND2 3.29Å; V7-N10 PolarHBondContact O-N 2.94Å; L8-N10 VanDerWaalsContact C-N 3.34Å; N10-A12 VanDerWaalsContact C-N 3.35Å; N10-A13 PolarHBondContact O-N 3.43Å; N10-G14 PolarHBondContact O-N 3.38Å
11Y45.6Very low49.7Very low166 Ų166121.5 Ų121.565%0.65165%0.654SS**Hα-helixtrans-66-37.7175.8-159.4-95.4000111.7V7 L8 M15V7-Y11 WeakPolarHBondContact O-CB 3.45Å; V7-Y11 PolarHBondContact O-N 3.3Å; L8-Y11 PolarHBondContact O-N 2.93Å; Y11-M15 HydrophobicContact CE1-CE 4.24Å; Y11-M15 HydrophobicContact CE1-SD 4.37Å
12A53.4Low49.8Very low76 Ų76118 Ų11863%0.62863%0.628SS**Hα-helixtrans-75.4-35.7173.900000113.2L8 N10L8-A12 PolarHBondContact O-N 3.05Å; L8-A12 VanDerWaalsContact O-N 3.11Å; N10-A12 VanDerWaalsContact C-N 3.35Å
13A54.1Low50.2Low71 Ų71111.1 Ų111.159%0.58760%0.602SS**Hα-helixtrans-75.3-23.4177.900000113.6K9 N10K9-A13 VanDerWaalsContact O-CB 3.31Å; K9-A13 WeakPolarHBondContact O-CB 3.45Å; K9-A13 PolarHBondContact O-N 2.93Å; N10-A13 PolarHBondContact O-N 3.43Å
14G48.4Very low50.4Low49 Ų49110.7 Ų110.751%0.50561%0.605SS.*THydrogen-bonded Turntrans-94.4-0-179.600000115.6N10 T16N10-G14 PolarHBondContact O-N 3.38Å; G14-T16 VanDerWaalsContact C-N 3.29Å; G14-T16 PolarHBondContact O-N 3.46Å
15M51.1Low50.7Low99 Ų99107.1 Ų107.149%0.48860%0.6SS.*  trans-85.49.3179.5-98-168.1149.800114.5Y11 M17Y11-M15 HydrophobicContact CE1-CE 4.24Å; Y11-M15 HydrophobicContact CE1-SD 4.37Å; M15-M17 PolarHBondContact O-N 3.02Å
16T50.9Low50.7Low120 Ų120106.4 Ų106.474%0.73661%0.608SS**  trans-76.572.5166.771.90000109G14 P18G14-T16 VanDerWaalsContact C-N 3.29Å; G14-T16 PolarHBondContact O-N 3.46Å; T16-P18 VanDerWaalsContact O-CD 3.29Å; T16-P18 WeakPolarHBondContact O-CD 3.47Å
17M46.2Very low50.6Low123 Ų123104 Ų10461%0.60661%0.609SS**  trans-75.9111.4167.9-68.5-68.7-17900107.5M15 G19 I20M15-M17 PolarHBondContact O-N 3.02Å; M17-G19 PolarHBondContact O-N 2.94Å; M17-G19 VanDerWaalsContact O-N 3.12Å; M17-I20 PolarHBondContact O-N 3.29Å
18P45Very low50.8Low130 Ų130104.8 Ų104.884%0.84461%0.606SS**THydrogen-bonded Turntrans-63.7118.2177.627.3-31.4000108.2T16T16-P18 VanDerWaalsContact O-CD 3.29Å; T16-P18 WeakPolarHBondContact O-CD 3.47Å
19G54.2Low51.3Low82 Ų82102.3 Ų102.385%0.84559%0.594SS**THydrogen-bonded Turntrans109.7-2176.500000116.8M17M17-G19 PolarHBondContact O-N 2.94Å; M17-G19 VanDerWaalsContact O-N 3.12Å
20I52Low51.6Low113 Ų113103 Ų10358%0.57960%0.604SS**  trans-121.5100.2170.4-60.1173.9000108.5M17 W22M17-I20 PolarHBondContact O-N 3.29Å; I20-W22 PolarHBondContact O-N 3.21Å
21Y46.6Very low52.1Low189 Ų189102.5 Ų102.574%0.74161%0.609SS**  trans-69.398.8171.5176.1-110.7000108.6P23Y21-P23 HydrophobicContact CD1-CB 4.09Å; Y21-P23 HydrophobicContact CD1-CG 3.73Å; Y21-P23 HydrophobicContact CE1-CB 3.48Å; Y21-P23 VanDerWaalsContact CE1-CB 3.48Å; Y21-P23 HydrophobicContact CE1-CG 3.61Å; Y21-P23 WeakPolarHBondContact O-CD 3.3Å
22W46.2Very low52.8Low167 Ų16799.8 Ų99.863%0.63360%0.603SS**  trans-76.1108.4162.8-79.898.3000107.5I20 S24I20-W22 PolarHBondContact O-N 3.21Å; W22-S24 PolarHBondContact O-N 3.04Å
23P51.7Low53.3Low39 Ų3999.2 Ų99.225%0.25359%0.585SS.*  trans-70.2142.6-177.3-8.426.5000108.1Y21 A25 F28Y21-P23 HydrophobicContact CD1-CB 4.09Å; Y21-P23 HydrophobicContact CD1-CG 3.73Å; Y21-P23 HydrophobicContact CE1-CB 3.48Å; Y21-P23 VanDerWaalsContact CE1-CB 3.48Å; Y21-P23 HydrophobicContact CE1-CG 3.61Å; Y21-P23 WeakPolarHBondContact O-CD 3.3Å; P23-A25 PolarHBondContact O-N 2.93Å; P23-F28 HydrophobicContact CB-CD2 4.13Å; P23-F28 HydrophobicContact CB-CE2 3.24Å; P23-F28 HydrophobicContact CB-CZ 3.79Å; P23-F28 HydrophobicContact CG-CE2 3.29Å; P23-F28 HydrophobicContact CG-CZ 3.56Å
24S54.5Low54Low72 Ų7298.4 Ų98.450%0.50358%0.579SS.*  trans-52.3131.5-178.6179.10000110.5W22 A26 S27W22-S24 PolarHBondContact O-N 3.04Å; S24-A26 PolarHBondContact O-N 2.98Å; S24-S27 PolarHBondContact O-N 3.31Å
25A53.6Low54.9Low66 Ų6698.3 Ų98.355%0.54557%0.573SS.*G310 helixtrans-49.1-31.6177.500000112.4P23 S27 F28P23-A25 PolarHBondContact O-N 2.93Å; A25-S27 PolarHBondContact O-N 3.47Å; A25-F28 PolarHBondContact O-N 3.35Å
26A51.6Low55.9Low89 Ų8997.6 Ų97.674%0.73657%0.565SS**G310 helixtrans-59.9-18.7178.400000115S24S24-A26 PolarHBondContact O-N 2.98Å
27S52.6Low57Low92 Ų9294.8 Ų94.864%0.64355%0.551SS**G310 helixtrans-95.8-14.8-177.6-52.60000113.8S24 A25S24-S27 PolarHBondContact O-N 3.31Å; A25-S27 PolarHBondContact O-N 3.47Å
28F52.8Low58.2Low95 Ų9595.4 Ų95.442%0.41755%0.552SS.*THydrogen-bonded Turntrans-104.8-16-171.8-77.3-62.7000115.1P23 A25 N30P23-F28 HydrophobicContact CB-CD2 4.13Å; P23-F28 HydrophobicContact CB-CE2 3.24Å; P23-F28 HydrophobicContact CB-CZ 3.79Å; P23-F28 HydrophobicContact CG-CE2 3.29Å; P23-F28 HydrophobicContact CG-CZ 3.56Å; A25-F28 PolarHBondContact O-N 3.35Å; F28-N30 PolarHBondContact O-N 2.94Å
29D60.3Low59.5Low71 Ų7191.9 Ų91.938%0.3853%0.534SS..THydrogen-bonded Turntrans-84.1-10.3-158.4-74-20.7000115.9Q143D29-Q143 VanDerWaalsContact CA-NE2 3.25Å; D29-Q143 PolarHBondContact O-NE2 3.1Å; D29-Q143 PolarHBondContact OD1-NE2 3.22Å
30N59.2Low60.6Low146 Ų14690.2 Ų90.278%0.78151%0.51SS*.THydrogen-bonded Turntrans-93.4-30.1-171.4-142.729.6000114.9F28 A34F28-N30 PolarHBondContact O-N 2.94Å; N30-A34 VanDerWaalsContact O-CB 3.23Å; N30-A34 WeakPolarHBondContact O-CB 3.38Å; N30-A34 PolarHBondContact O-N 2.99Å
31S64.2Low61.6Low97 Ų9787.6 Ų87.668%0.67851%0.505SS*.Hα-helixtrans-86.5-44.5-171.5-170.40000113.8A35S31-A35 WeakPolarHBondContact O-CB 3.26Å; S31-A35 PolarHBondContact O-N 3.36Å; S31-A35 VanDerWaalsContact O-N 3.09Å
32M61Low63Low110 Ų11084.2 Ų84.254%0.54250%0.499SS..Hα-helixtrans-69.1-41.3-177.9-78.2-104.485.600111.7A35 Y36M32-A35 PolarHBondContact O-N 2.9Å; M32-Y36 PolarHBondContact O-N 3.32Å
33Y64Low64.2Low63 Ų6379 Ų7925%0.24749%0.492CS..Hα-helixtrans-68.5-38.3179-173.8-87.8000112.1Y36 S37 M139 Q143Y33-Y36 PolarHBondContact O-N 3.48Å; Y33-S37 VanDerWaalsContact O-CB 3.3Å; Y33-S37 WeakPolarHBondContact O-CB 3.39Å; Y33-S37 PolarHBondContact O-N 2.96Å; Y33-M139 HydrophobicContact CE2-CB 3.87Å; Y33-M139 HydrophobicContact CE2-CE 3.52Å; Y33-M139 HydrophobicContact CE2-CG 4.46Å; Y33-M139 WeakPolarHBondContact OH-CB 3.29Å; Y33-M139 WeakPolarHBondContact OH-CE 3.38Å; Y33-M139 WeakPolarHBondContact OH-CG 3.47Å; Y33-Q143 HydrophobicContact CD2-CB 4.11Å; Y33-Q143 HydrophobicContact CD2-CG 4.46Å
34A67.6Low65.1Low54 Ų5479.9 Ų79.945%0.44650%0.502SS..Hα-helixtrans-63-42.917300000112N30 S37 Q38N30-A34 VanDerWaalsContact O-CB 3.23Å; N30-A34 WeakPolarHBondContact O-CB 3.38Å; N30-A34 PolarHBondContact O-N 2.99Å; A34-S37 PolarHBondContact O-N 3.43Å; A34-Q38 WeakPolarHBondContact O-CB 3.22Å; A34-Q38 PolarHBondContact O-N 2.89Å
35A68.4Low65.9Low47 Ų4778.6 Ų78.639%0.38850%0.496SS..Hα-helixtrans-64.1-43.1176.400000112.2S31 M32 Q38 A39S31-A35 WeakPolarHBondContact O-CB 3.26Å; S31-A35 PolarHBondContact O-N 3.36Å; S31-A35 VanDerWaalsContact O-N 3.09Å; M32-A35 PolarHBondContact O-N 2.9Å; A35-Q38 PolarHBondContact O-N 3.5Å; A35-A39 WeakPolarHBondContact O-CB 3.49Å; A35-A39 PolarHBondContact O-N 3.21Å
36Y71.3Confident66.5Low84 Ų8478.4 Ų78.433%0.32950%0.495SS..Hα-helixtrans-65.1-43.3174.8175.2-103.6000112.3M32 Y33 Q38 A39 S40 E142 L146M32-Y36 PolarHBondContact O-N 3.32Å; Y33-Y36 PolarHBondContact O-N 3.48Å; Y36-Q38 VanDerWaalsContact C-N 3.26Å; Y36-Q38 PolarHBondContact O-N 3.39Å; Y36-A39 PolarHBondContact O-N 2.97Å; Y36-S40 WeakPolarHBondContact O-CB 3.39Å; Y36-S40 PolarHBondContact O-N 3.25Å; Y36-S40 PolarHBondContact O-OG 2.91Å; Y36-E142 HydrophobicContact CE1-CG 4.37Å; Y36-E142 WeakPolarHBondContact CE1-OE1 3.35Å; Y36-E142 PolarHBondContact OH-OE1 3.14Å; Y36-L146 HydrophobicContact CD1-CD1 3.93Å; Y36-L146 HydrophobicContact CD2-CD1 3.78Å; Y36-L146 HydrophobicContact CE1-CD1 4.25Å; Y36-L146 HydrophobicContact CE2-CD1 4.13Å; Y36-L146 HydrophobicContact CG-CD1 3.66Å
37S73.7Confident66.9Low62 Ų6279 Ų7943%0.43449%0.488SS..Hα-helixtrans-61.6-36175-174.70000111.8Y33 A34 S40 A41Y33-S37 VanDerWaalsContact O-CB 3.3Å; Y33-S37 WeakPolarHBondContact O-CB 3.39Å; Y33-S37 PolarHBondContact O-N 2.96Å; A34-S37 PolarHBondContact O-N 3.43Å; S37-S40 WeakPolarHBondContact CA-OG 3.24Å; S37-S40 PolarHBondContact O-OG 3.46Å; S37-S40 VanDerWaalsContact O-OG 3.14Å; S37-A41 VanDerWaalsContact O-CB 3.23Å; S37-A41 WeakPolarHBondContact O-CB 3.45Å; S37-A41 PolarHBondContact O-N 2.98Å; S37-A41 VanDerWaalsContact O-N 3.14Å
38Q71.9Confident67.2Low135 Ų13580.2 Ų80.263%0.63149%0.492SS*.Hα-helixtrans-71.3-45.1175.2-172.7178.450.700111.4A34 A35 Y36 A41 L42A34-Q38 WeakPolarHBondContact O-CB 3.22Å; A34-Q38 PolarHBondContact O-N 2.89Å; A35-Q38 PolarHBondContact O-N 3.5Å; Y36-Q38 VanDerWaalsContact C-N 3.26Å; Y36-Q38 PolarHBondContact O-N 3.39Å; Q38-A41 PolarHBondContact O-N 2.91Å; Q38-L42 HydrophobicContact CG-CD1 4.38Å; Q38-L42 WeakPolarHBondContact O-CG 3.47Å; Q38-L42 PolarHBondContact O-N 3.04Å
39A72.2Confident67.4Low57 Ų5782.5 Ų82.547%0.47151%0.508SS..Hα-helixtrans-65.4-42.7179.200000112.5A35 Y36 L42 A43A35-A39 WeakPolarHBondContact O-CB 3.49Å; A35-A39 PolarHBondContact O-N 3.21Å; Y36-A39 PolarHBondContact O-N 2.97Å; A39-L42 PolarHBondContact O-N 3.36Å; A39-A43 WeakPolarHBondContact O-CB 3.36Å; A39-A43 PolarHBondContact O-N 3.42Å
40S76.4Confident66.8Low47 Ų4782.2 Ų82.233%0.32952%0.522SS..Hα-helixtrans-65.7-39.3175.253.90000112.1Y36 S37 A43 A44Y36-S40 WeakPolarHBondContact O-CB 3.39Å; Y36-S40 PolarHBondContact O-N 3.25Å; Y36-S40 PolarHBondContact O-OG 2.91Å; S37-S40 WeakPolarHBondContact CA-OG 3.24Å; S37-S40 PolarHBondContact O-OG 3.46Å; S37-S40 VanDerWaalsContact O-OG 3.14Å; S40-A43 PolarHBondContact O-N 3.2Å; S40-A44 WeakPolarHBondContact O-CB 3.4Å; S40-A44 PolarHBondContact O-N 3.38Å
41A74.4Confident66.1Low58 Ų5878.9 Ų78.948%0.47952%0.515SS..Hα-helixtrans-63.1-41.1173.300000112.4S37 Q38 A44 A45S37-A41 VanDerWaalsContact O-CB 3.23Å; S37-A41 WeakPolarHBondContact O-CB 3.45Å; S37-A41 PolarHBondContact O-N 2.98Å; S37-A41 VanDerWaalsContact O-N 3.14Å; Q38-A41 PolarHBondContact O-N 2.91Å; A41-A44 PolarHBondContact O-N 2.96Å; A41-A45 VanDerWaalsContact O-CB 3.3Å; A41-A45 WeakPolarHBondContact O-CB 3.32Å; A41-A45 PolarHBondContact O-N 2.82Å
42L74.5Confident65Low117 Ų11779.4 Ų79.461%0.61353%0.525SS*.Hα-helixtrans-66.3-40.4174.6-71.4171000112Q38 A39 A45 A46Q38-L42 HydrophobicContact CG-CD1 4.38Å; Q38-L42 WeakPolarHBondContact O-CG 3.47Å; Q38-L42 PolarHBondContact O-N 3.04Å; A39-L42 PolarHBondContact O-N 3.36Å; L42-A45 PolarHBondContact O-N 3.27Å; L42-A46 WeakPolarHBondContact O-CB 3.35Å; L42-A46 PolarHBondContact O-N 3.01Å
43A72.7Confident64Low58 Ų5877.1 Ų77.148%0.47953%0.53SS..Hα-helixtrans-65.4-41.1175.600000112.2A39 S40 A46 V47A39-A43 WeakPolarHBondContact O-CB 3.36Å; A39-A43 PolarHBondContact O-N 3.42Å; S40-A43 PolarHBondContact O-N 3.2Å; A43-A46 PolarHBondContact O-N 2.99Å; A43-V47 PolarHBondContact O-N 2.96Å
44A70.8Confident62.9Low58 Ų5883.3 Ų83.348%0.47956%0.561SS.*Hα-helixtrans-65.6-41.4174.100000111.8S40 A41 A46 V47 V48S40-A44 WeakPolarHBondContact O-CB 3.4Å; S40-A44 PolarHBondContact O-N 3.38Å; A41-A44 PolarHBondContact O-N 2.96Å; A44-A46 VanDerWaalsContact C-N 3.31Å; A44-A46 PolarHBondContact O-N 3.49Å; A44-V47 PolarHBondContact O-N 3.47Å; A44-V48 WeakPolarHBondContact O-CG2 3.33Å; A44-V48 PolarHBondContact O-N 3.35Å
45A71.5Confident61.8Low45 Ų4587.5 Ų87.537%0.37258%0.581SS.*Hα-helixtrans-64.8-34.8174.100000112.3A41 L42 V48 N49A41-A45 VanDerWaalsContact O-CB 3.3Å; A41-A45 WeakPolarHBondContact O-CB 3.32Å; A41-A45 PolarHBondContact O-N 2.82Å; L42-A45 PolarHBondContact O-N 3.27Å; A45-V48 PolarHBondContact O-N 3.38Å; A45-N49 PolarHBondContact O-N 2.85Å; A45-N49 PolarHBondContact O-ND2 3.43Å
46A65.3Low60.9Low62 Ų6290.9 Ų90.951%0.51260%0.599SS.*Hα-helixtrans-67.2-37.1174.500000112.1L42 A43 A44 N49 G50L42-A46 WeakPolarHBondContact O-CB 3.35Å; L42-A46 PolarHBondContact O-N 3.01Å; A43-A46 PolarHBondContact O-N 2.99Å; A44-A46 VanDerWaalsContact C-N 3.31Å; A44-A46 PolarHBondContact O-N 3.49Å; A46-N49 PolarHBondContact O-N 2.86Å; A46-G50 WeakPolarHBondContact O-CA 3.34Å; A46-G50 PolarHBondContact O-N 3.47Å
47V61Low59.3Low100 Ų10092.4 Ų92.461%0.60662%0.622SS**Hα-helixtrans-66.2-39.3172.5167.90000111.5A43 A44 N49 G50 A51A43-V47 PolarHBondContact O-N 2.96Å; A44-V47 PolarHBondContact O-N 3.47Å; V47-N49 VanDerWaalsContact C-N 3.35Å; V47-N49 PolarHBondContact O-N 3.02Å; V47-G50 PolarHBondContact O-N 2.95Å; V47-A51 WeakPolarHBondContact O-CB 3.35Å; V47-A51 PolarHBondContact O-N 3.23Å
48V58.8Low58.1Low118 Ų11895.3 Ų95.372%0.71564%0.642SS**Hα-helixtrans-68.9-31.5178.4171.50000112.4A44 A45A44-V48 WeakPolarHBondContact O-CG2 3.33Å; A44-V48 PolarHBondContact O-N 3.35Å; A45-V48 PolarHBondContact O-N 3.38Å
49N55.4Low56.9Low143 Ų14397.7 Ų97.777%0.76565%0.653SS**Hα-helixtrans-91.7-15175.9-73.1-35.5000114.1A45 A46 V47A45-N49 PolarHBondContact O-N 2.85Å; A45-N49 PolarHBondContact O-ND2 3.43Å; A46-N49 PolarHBondContact O-N 2.86Å; V47-N49 VanDerWaalsContact C-N 3.35Å; V47-N49 PolarHBondContact O-N 3.02Å
50G48.3Very low55.6Low65 Ų65104.7 Ų104.767%0.6768%0.676SS**Hα-helixtrans-102.3-7.2-176.500000115.8A46 V47A46-G50 WeakPolarHBondContact O-CA 3.34Å; A46-G50 PolarHBondContact O-N 3.47Å; V47-G50 PolarHBondContact O-N 2.95Å
51A44.2Very low54Low76 Ų76107.5 Ų107.563%0.62870%0.702SS**  trans-107.847.2-177.900000113V47 G53V47-A51 WeakPolarHBondContact O-CB 3.35Å; V47-A51 PolarHBondContact O-N 3.23Å; A51-G53 VanDerWaalsContact C-N 3.27Å; A51-G53 PolarHBondContact O-N 3.5Å
52A41.2Very low52.5Low108 Ų108108.1 Ų108.189%0.89371%0.714SS**  trans-85.770.5161.700000109
53G40.3Very low51.5Low62 Ų62107.9 Ų107.964%0.63972%0.723SS**  trans-145.790.6-173.700000112.8A51A51-G53 VanDerWaalsContact C-N 3.27Å; A51-G53 PolarHBondContact O-N 3.5Å
54Q41.4Very low50.4Low193 Ų193111 Ų11190%0.90274%0.741SS**  trans54104.3154.2-62.5-179.67.100118.7
55V45Very low49.4Very low143 Ų143111.8 Ų111.887%0.86775%0.754SS**  trans-107.7122.1159.4-173.90000107.8
56P47.6Very low48.6Very low117 Ų117116.1 Ų116.176%0.7678%0.778SS**  trans-102120.5162.731.2-20.2000111.3
57S38.3Very low47.6Very low116 Ų116117.8 Ų117.881%0.81179%0.792SS**  trans-17.3128.2159.2-37.10000118.4
58S48.4Very low47.3Very low123 Ų123118.8 Ų118.886%0.8680%0.804SS**  trans-146.3129.714149.40000110.4
59Q47.4Very low46.9Very low186 Ų186121.3 Ų121.387%0.86981%0.813SS**  trans-79.2141.3-170.5-61161.61.900111.2
60Q44.1Very low46.4Very low204 Ų204118.1 Ų118.195%0.95381%0.814SS**  -169.9151.6121.1-129163-200113.6
61A44.1Very low46.4Very low105 Ų105120.2 Ų120.287%0.86882%0.819SS**  trans-72.1161.4-160.300000117.7
62G42.1Very low46.4Very low72 Ų72121.8 Ų121.874%0.74283%0.825SS**  trans166.966.8161.500000119.1
63S52.7Low46.7Very low112 Ų112122.1 Ų122.178%0.78382%0.821SS**  trans44.8122.1146.862.40000124.9
64S51.4Low47.5Very low124 Ų124125.5 Ų125.587%0.86783%0.829SS**  trans83.5117.4130.662.10000122.5
65G48.4Very low48.5Very low73 Ų73121.8 Ų121.875%0.75382%0.822SS**  trans158.6110.7155.200000112.8
66P54.2Low48.8Very low136 Ų136120.7 Ų120.788%0.88382%0.818SS**  trans-86.4164.4-168.235.1-34.1000114.5
67A44.9Very low49Very low97 Ų97125.4 Ų125.480%0.80282%0.822SS**  trans-61150.6-171.400000116.3
68S55.8Low49.4Very low121 Ų121124.6 Ų124.685%0.84682%0.816SS**  trans-133.1122.9145.355.70000109.6
69N49.6Very low49.2Very low171 Ų171123.2 Ų123.291%0.91481%0.812SS**  trans-65.1135.7173.5-80.8-24.6000110.4
70G44.9Very low49.2Very low77 Ų77121.5 Ų121.579%0.79481%0.806SS**  trans-146.3108.1170.300000109.4
71S48.5Very low49.4Very low108 Ų108118.3 Ų118.376%0.75580%0.8SS**  trans-60.4141.2-168.751.50000115.8
72S44Very low49.7Very low110 Ų110118.4 Ų118.477%0.76979%0.79SS**  trans-7.9125.7139.256.40000117.5
73S48Very low49.9Very low114 Ų114120.4 Ų120.480%0.79779%0.793SS**  -175.4104.8127.356.90000109.4
74T56.7Low50Low133 Ų133120.2 Ų120.282%0.81679%0.792SS**PPolyproline II helixtrans-69.1129155.440.80000107.7
75P62.5Low50.2Low116 Ų116120.3 Ų120.375%0.75379%0.787SS**PPolyproline II helixtrans-82.5133.2169.431.8-27.8000108.7
76P51.6Low50.6Low119 Ų119121.9 Ų121.977%0.77378%0.784SS**PPolyproline II helixtrans-84.6118.816232.3-24.3000107.2
77Y51.6Low50.3Low216 Ų216120.7 Ų120.785%0.84777%0.774SS**  trans-111.390162.6-145.5-97.6000109.1
78S47.3Very low50.7Low100 Ų100123.3 Ų123.370%0.69977%0.774SS**  trans-62.7137.9158.1-73.40000109.6
79A43.7Very low50.2Low94 Ų94123.9 Ų123.978%0.77777%0.773SS**  trans30.5108.714500000118.8
80M47.1Very low50.2Low149 Ų149119 Ų11973%0.73476%0.757SS**  -145.6106.3129.9-171.6170.2-178.400109.7T82M80-T82 WeakPolarHBondContact CE-OG1 3.45Å; M80-T82 PolarHBondContact O-N 3.4Å
81V49.4Very low50.4Low138 Ų138121.3 Ų121.384%0.83676%0.76SS**  trans-65.81181601770000106.9
82T49Very low50.7Low106 Ų106123 Ų12365%0.6576%0.759SS**  trans-149.4113.7149.7-4.30000109.7M80M80-T82 WeakPolarHBondContact CE-OG1 3.45Å; M80-T82 PolarHBondContact O-N 3.4Å
83S46.2Very low51Low114 Ų114121.5 Ų121.580%0.79775%0.754SS**  trans-58.3123.3167.844.70000112
84S54.7Low51.4Low109 Ų109123.8 Ų123.876%0.76276%0.756SS**  trans-155.697.7152.550.70000108.5P86S84-P86 WeakPolarHBondContact O-CD 3.39Å
85T56Low51Low125 Ų125124.9 Ų124.977%0.76775%0.752SS**  trans-71.5124.2170.245.10000110.2
86P57.9Low50.4Low107 Ų107124.6 Ų124.670%0.69575%0.753SS**  trans-90.3105.6150.431.2-24.7000108S84 L88S84-P86 WeakPolarHBondContact O-CD 3.39Å; P86-L88 VanDerWaalsContact C-N 3.33Å; P86-L88 PolarHBondContact O-N 3.36Å
87T46Very low50.3Low110 Ų110125.8 Ų125.868%0.67575%0.748SS**  trans-6394164.5-55.10000108.1T89T87-T89 HydrophobicContact CG2-CG2 4.3Å
88L54.8Low49.9Very low152 Ų152121.3 Ų121.380%0.79674%0.739SS**  trans-99.784.8163.6-65.5-177.9000108.1P86 A90P86-L88 VanDerWaalsContact C-N 3.33Å; P86-L88 PolarHBondContact O-N 3.36Å; L88-A90 PolarHBondContact O-N 3.09Å
89T43.9Very low50.5Low133 Ų133123.4 Ų123.482%0.81674%0.741SS**  trans-64.778.4156.1340000108.4T87T87-T89 HydrophobicContact CG2-CG2 4.3Å
90A50.9Low51.2Low70 Ų70123.8 Ų123.858%0.57973%0.734SS**  trans-105.4103.7164.900000107.2L88 I92L88-A90 PolarHBondContact O-N 3.09Å; A90-I92 PolarHBondContact O-N 2.94Å
91S48.3Very low51.9Low125 Ų125122.2 Ų122.287%0.87474%0.735SS**  trans-5587.9163.241.70000109.5A93S91-A93 PolarHBondContact O-N 3.28Å
92I54.6Low52.8Low142 Ų142119.9 Ų119.973%0.72872%0.724SS**  trans-76.388165.9-56.3-176.1000105.8A90 L94A90-I92 PolarHBondContact O-N 2.94Å; I92-L94 PolarHBondContact O-N 2.93Å
93A50.7Low53.6Low80 Ų80120.8 Ų120.866%0.66173%0.732SS**  trans-54.1105.9158.900000107.1S91 Q95S91-A93 PolarHBondContact O-N 3.28Å; A93-Q95 PolarHBondContact O-N 3Å
94L56.1Low54.7Low162 Ų162124.3 Ų124.385%0.84873%0.733SS**  trans-65.878.6166.4-75.6161.5000107.4I92 S96I92-L94 PolarHBondContact O-N 2.93Å; L94-S96 PolarHBondContact O-N 3.21Å
95Q47.8Very low55.5Low155 Ų155128.5 Ų128.572%0.72474%0.737SS**  trans-65.990.8158.6-80.1-177.6800106.4A93 Q97A93-Q95 PolarHBondContact O-N 3Å; Q95-Q97 PolarHBondContact O-N 2.89Å
96S50Low56.4Low111 Ų111131.8 Ų131.878%0.77674%0.741SS**  trans-62.678.2162.9-169.10000107.5L94 N98L94-S96 PolarHBondContact O-N 3.21Å; S96-N98 PolarHBondContact O-N 3.01Å
97Q50.3Low57.5Low143 Ų143132.7 Ų132.767%0.66875%0.747SS**  trans-59.4110.6164.8-75-81.2-3.600105.5Q95 I99Q95-Q97 PolarHBondContact O-N 2.89Å; Q97-I99 HydrophobicContact CB-CG1 4.19Å; Q97-I99 WeakPolarHBondContact O-CG1 3.23Å; Q97-I99 PolarHBondContact O-N 3.46Å
98N44Very low59.1Low123 Ų123136 Ų13666%0.65876%0.755SS**  trans-68.374175-173.147.6000108.3S96 T100S96-N98 PolarHBondContact O-N 3.01Å; N98-T100 VanDerWaalsContact C-N 3.34Å; N98-T100 PolarHBondContact O-N 3.4Å
99I59.3Low60.5Low143 Ų143134.3 Ų134.373%0.73375%0.753SS**  trans-75.195.4172.9-38.4-177.8000105.7Q97Q97-I99 HydrophobicContact CB-CG1 4.19Å; Q97-I99 WeakPolarHBondContact O-CG1 3.23Å; Q97-I99 PolarHBondContact O-N 3.46Å
100T59Low62.3Low103 Ų103130.4 Ų130.463%0.63273%0.729SS**  trans-52.5124.4163.646.90000106.9N98 S102N98-T100 VanDerWaalsContact C-N 3.34Å; N98-T100 PolarHBondContact O-N 3.4Å; T100-S102 VanDerWaalsContact C-N 3.33Å; T100-S102 PolarHBondContact O-N 3.25Å
101P62Low64.1Low116 Ų116130 Ų13075%0.75372%0.72SS**  trans-66.998.6-179.725.4-31.1000107.5
102S67.1Low65.8Low88 Ų88130.1 Ų130.162%0.61571%0.711SS**  trans-51.3139.5165.859.70000108.1T100 K104T100-S102 VanDerWaalsContact C-N 3.33Å; T100-S102 PolarHBondContact O-N 3.25Å; S102-K104 PolarHBondContact O-N 2.99Å
103P66.5Low67.3Low125 Ų125131.3 Ų131.381%0.81271%0.713SS**  trans-54.6110.7-177.422-32.2000109.2K105P103-K105 PolarHBondContact O-N 3.47Å; P103-K105 VanDerWaalsContact O-N 3.1Å
104K68.3Low68.9Low188 Ų188132.9 Ų132.982%0.81771%0.708SS**  trans-63.3115.7-180-66.5179-178.5174.80106.9S102 K106S102-K104 PolarHBondContact O-N 2.99Å; K104-K106 PolarHBondContact O-N 3.46Å
105K72.4Confident70.6Confident197 Ų197128.2 Ų128.286%0.85768%0.681SS**PPolyproline II helixtrans-49.7133.7169.5-70.9-178.2178.7-1790108P103P103-K105 PolarHBondContact O-N 3.47Å; P103-K105 VanDerWaalsContact O-N 3.1Å
106K74.9Confident72.7Confident195 Ų195124.7 Ų124.785%0.84867%0.667SS**PPolyproline II helixtrans-54.6127.6176.7-67177-177.8177.40107.4K104 E108K104-K106 PolarHBondContact O-N 3.46Å; K106-E108 PolarHBondContact O-N 2.71Å; K106-E108 VanDerWaalsContact O-N 3.09Å
107P79.7Confident74.7Confident125 Ų125127.2 Ų127.281%0.81266%0.664SS**PPolyproline II helixtrans-59118177.4-20.630.6000109
108E80.4Confident76.7Confident180 Ų180124.2 Ų124.284%0.84165%0.653SS**PPolyproline II helixtrans-70.5132.5171.7-69.2-168.9176.200108.8K106 V110K106-E108 PolarHBondContact O-N 2.71Å; K106-E108 VanDerWaalsContact O-N 3.09Å; E108-V110 PolarHBondContact O-N 2.9Å
109P83.8Confident79.2Confident117 Ų117120.4 Ų120.476%0.7663%0.629SS**PPolyproline II helixtrans-56.3131.6173.7-22.633.1000109.9P111P109-P111 VanDerWaalsContact O-CD 3.3Å; P109-P111 WeakPolarHBondContact O-CD 3.49Å
110V83Confident80.9Confident51 Ų51120.5 Ų120.531%0.30962%0.621SS.*PPolyproline II helixtrans-61.9122.3174.21780000108.2E108 M114 K115 Y119E108-V110 PolarHBondContact O-N 2.9Å; V110-M114 HydrophobicContact CG1-CB 3.8Å; V110-K115 HydrophobicContact CG1-CG 4.16Å; V110-K115 WeakPolarHBondContact O-CE 3.17Å; V110-Y119 HydrophobicContact CB-CD2 4.34Å; V110-Y119 HydrophobicContact CB-CE2 3.82Å; V110-Y119 HydrophobicContact CG1-CD2 4.18Å; V110-Y119 HydrophobicContact CG1-CE2 4.15Å; V110-Y119 HydrophobicContact CG2-CD2 4.13Å; V110-Y119 HydrophobicContact CG2-CE2 3.59Å
111P87.4Confident82.6Confident62 Ų62120.4 Ų120.440%0.40361%0.613SS.*PPolyproline II helixtrans-56.9146.4177.7-26.836000112P109 H113 M114P109-P111 VanDerWaalsContact O-CD 3.3Å; P109-P111 WeakPolarHBondContact O-CD 3.49Å; P111-H113 VanDerWaalsContact C-N 3.27Å; P111-H113 WeakPolarHBondContact CB-CE1 3.47Å; P111-H113 WeakPolarHBondContact CB-ND1 3.46Å; P111-H113 PolarHBondContact O-N 3.38Å; P111-M114 PolarHBondContact O-N 3.32Å
112D84.8Confident84.2Confident126 Ų126120.6 Ų120.667%0.67460%0.599SS**G310 helixtrans-59.6-35.5-171.7-71.1-33.8000113.7M114 K115D112-M114 PolarHBondContact O-N 3.42Å; D112-K115 PolarHBondContact O-N 2.81Å; D112-K115 VanDerWaalsContact O-N 3.11Å; D112-K115 VanDerWaalsContact OD1-CE 3.29Å; D112-K115 WeakPolarHBondContact OD1-CE 3.24Å; D112-K115 IonicContact OD1-NZ 3.9Å; D112-K115 PolarHBondContact OD1-NZ 3.29Å
113H85.2Confident85.6Confident167 Ų167121.3 Ų121.377%0.77359%0.588SS**G310 helixtrans-65.4-16.8176.567.1-89.3000113.8P111P111-H113 VanDerWaalsContact C-N 3.27Å; P111-H113 WeakPolarHBondContact CB-CE1 3.47Å; P111-H113 WeakPolarHBondContact CB-ND1 3.46Å; P111-H113 PolarHBondContact O-N 3.38Å
114M84.6Confident87.1Confident114 Ų114123 Ų12356%0.56258%0.582SS**G310 helixtrans-100.4-1177-58.2-164.680.500113.2V110 P111 D112 D116V110-M114 HydrophobicContact CG1-CB 3.8Å; P111-M114 PolarHBondContact O-N 3.32Å; D112-M114 PolarHBondContact O-N 3.42Å; M114-D116 PolarHBondContact O-N 2.85Å
115K91.3Very high88.5Confident64 Ų64121.9 Ų121.928%0.27857%0.573SS.*  trans-80.267.9176.9-64.9-179.1-175.91640110.7V110 D112 Y119 W120V110-K115 HydrophobicContact CG1-CG 4.16Å; V110-K115 WeakPolarHBondContact O-CE 3.17Å; D112-K115 PolarHBondContact O-N 2.81Å; D112-K115 VanDerWaalsContact O-N 3.11Å; D112-K115 VanDerWaalsContact OD1-CE 3.29Å; D112-K115 WeakPolarHBondContact OD1-CE 3.24Å; D112-K115 IonicContact OD1-NZ 3.9Å; D112-K115 PolarHBondContact OD1-NZ 3.29Å; K115-Y119 HydrophobicContact CB-CD1 3.81Å; K115-Y119 HydrophobicContact CB-CE1 4.16Å; K115-Y119 HydrophobicContact CB-CG 4.42Å; K115-Y119 HydrophobicContact CD-CD1 4.49Å; K115-Y119 HydrophobicContact CD-CE1 4Å; K115-Y119 HydrophobicContact CG-CD1 3.83Å; K115-Y119 HydrophobicContact CG-CE1 3.73Å; K115-Y119 HydrophobicContact CG-CG 4.41Å; K115-W120 HydrophobicContact CB-CZ2 4.33Å; K115-W120 HydrophobicContact CD-CZ2 4.05Å; K115-W120 PolarHBondContact O-NE1 2.9Å
116D92.3Very high89.7Confident80 Ų80117 Ų11743%0.42856%0.557SS.*  trans-71.2173.9175.868.7-11.3000112.8M114 N118 Y119 W120M114-D116 PolarHBondContact O-N 2.85Å; D116-N118 PolarHBondContact O-N 2.73Å; D116-Y119 WeakPolarHBondContact O-CB 3.45Å; D116-Y119 PolarHBondContact O-N 3.34Å; D116-Y119 WeakPolarHBondContact OD1-CA 3.44Å; D116-Y119 WeakPolarHBondContact OD1-CB 3.3Å; D116-Y119 PolarHBondContact OD1-N 3.39Å; D116-W120 PolarHBondContact O-N 3.14Å
117K92.7Very high90.8Very high164 Ų164111.4 Ų111.471%0.71354%0.536SS*.Hα-helixtrans-54.5-40.3175.9-177.5179.9174.3-175.90111.9W120 E121K117-W120 PolarHBondContact O-N 3.14Å; K117-E121 VanDerWaalsContact CE-OE1 3.26Å; K117-E121 WeakPolarHBondContact CE-OE1 3.32Å; K117-E121 PolarHBondContact O-N 2.9Å; K117-E121 VanDerWaalsContact O-N 3.09Å
118N92.8Very high91.6Very high81 Ų81111.2 Ų111.243%0.43352%0.524SS..Hα-helixtrans-66.5-38.1-179.3-168-10.7000111.9D116 W120 E121 R122D116-N118 PolarHBondContact O-N 2.73Å; N118-W120 VanDerWaalsContact C-N 3.35Å; N118-W120 PolarHBondContact O-N 3.44Å; N118-E121 PolarHBondContact O-N 2.84Å; N118-R122 PolarHBondContact ND2-NH1 2.98Å; N118-R122 WeakPolarHBondContact O-CG 3.34Å; N118-R122 PolarHBondContact O-N 2.87Å; N118-R122 PolarHBondContact OD1-NH1 3.34Å
119Y95.8Very high92.4Very high42 Ų42105.8 Ų105.817%0.16551%0.506CS..Hα-helixtrans-56.6-47.4171.2169.2-94000111.6V110 K115 D116 R122 R123V110-Y119 HydrophobicContact CB-CD2 4.34Å; V110-Y119 HydrophobicContact CB-CE2 3.82Å; V110-Y119 HydrophobicContact CG1-CD2 4.18Å; V110-Y119 HydrophobicContact CG1-CE2 4.15Å; V110-Y119 HydrophobicContact CG2-CD2 4.13Å; V110-Y119 HydrophobicContact CG2-CE2 3.59Å; K115-Y119 HydrophobicContact CB-CD1 3.81Å; K115-Y119 HydrophobicContact CB-CE1 4.16Å; K115-Y119 HydrophobicContact CB-CG 4.42Å; K115-Y119 HydrophobicContact CD-CD1 4.49Å; K115-Y119 HydrophobicContact CD-CE1 4Å; K115-Y119 HydrophobicContact CG-CD1 3.83Å; K115-Y119 HydrophobicContact CG-CE1 3.73Å; K115-Y119 HydrophobicContact CG-CG 4.41Å; D116-Y119 WeakPolarHBondContact O-CB 3.45Å; D116-Y119 PolarHBondContact O-N 3.34Å; D116-Y119 WeakPolarHBondContact OD1-CA 3.44Å; D116-Y119 WeakPolarHBondContact OD1-CB 3.3Å; D116-Y119 PolarHBondContact OD1-N 3.39Å; Y119-R122 PolarHBondContact O-N 3.03Å; Y119-R123 WeakPolarHBondContact O-CB 3.38Å; Y119-R123 PolarHBondContact O-N 3.49Å
120W94Very high93Very high146 Ų146102 Ų10255%0.55348%0.484SS*.Hα-helixtrans-65.2-39.9-179.7-69.7113.2000112.8K115 D116 K117 N118 R123 K124K115-W120 HydrophobicContact CB-CZ2 4.33Å; K115-W120 HydrophobicContact CD-CZ2 4.05Å; K115-W120 PolarHBondContact O-NE1 2.9Å; D116-W120 PolarHBondContact O-N 3.14Å; K117-W120 PolarHBondContact O-N 3.14Å; N118-W120 VanDerWaalsContact C-N 3.35Å; N118-W120 PolarHBondContact O-N 3.44Å; W120-R123 PolarHBondContact O-N 3.04Å; W120-K124 WeakPolarHBondContact O-CB 3.23Å; W120-K124 PolarHBondContact O-N 3.21Å
121E95.7Very high93.7Very high100 Ų100108.2 Ų108.247%0.46750%0.502SS..Hα-helixtrans-62.4-45.8174.3-71.8176.9-172.400111.9K117 N118 R123 K124 R125K117-E121 VanDerWaalsContact CE-OE1 3.26Å; K117-E121 WeakPolarHBondContact CE-OE1 3.32Å; K117-E121 PolarHBondContact O-N 2.9Å; K117-E121 VanDerWaalsContact O-N 3.09Å; N118-E121 PolarHBondContact O-N 2.84Å; E121-R123 VanDerWaalsContact C-N 3.34Å; E121-R123 PolarHBondContact O-N 3.28Å; E121-K124 PolarHBondContact O-N 3.49Å; E121-R125 PolarHBondContact O-N 3.44Å
122R95.7Very high94.1Very high121 Ų121114.9 Ų114.946%0.45752%0.519SS..Hα-helixtrans-60.5-42.8173.9-70.6-172-57.3-95.24.3111.8N118 Y119 R125 N126N118-R122 PolarHBondContact ND2-NH1 2.98Å; N118-R122 WeakPolarHBondContact O-CG 3.34Å; N118-R122 PolarHBondContact O-N 2.87Å; N118-R122 PolarHBondContact OD1-NH1 3.34Å; Y119-R122 PolarHBondContact O-N 3.03Å; R122-R125 PolarHBondContact O-N 3.49Å; R122-N126 PolarHBondContact O-N 3.31Å
123R97.1Very high94.7Very high103 Ų103111.9 Ų111.939%0.38951%0.508SS..Hα-helixtrans-64.2-42.5179.4-166.572.5-174.2943.9111.4Y119 W120 E121 N126 N127Y119-R123 WeakPolarHBondContact O-CB 3.38Å; Y119-R123 PolarHBondContact O-N 3.49Å; W120-R123 PolarHBondContact O-N 3.04Å; E121-R123 VanDerWaalsContact C-N 3.34Å; E121-R123 PolarHBondContact O-N 3.28Å; R123-N126 PolarHBondContact NH1-OD1 2.88Å; R123-N126 PolarHBondContact O-N 2.93Å; R123-N127 PolarHBondContact NH1-OD1 2.95Å; R123-N127 WeakPolarHBondContact O-CB 3.37Å; R123-N127 VanDerWaalsContact O-CG 3.29Å; R123-N127 PolarHBondContact O-N 3.27Å; R123-N127 PolarHBondContact O-ND2 3.45Å
124K97Very high95.3Very high159 Ų159112.1 Ų112.169%0.69150%0.502SS*.Hα-helixtrans-60.1-49174.5-174.1179.3177.6-177.70111.2W120 E121 N126 N127 E128W120-K124 WeakPolarHBondContact O-CB 3.23Å; W120-K124 PolarHBondContact O-N 3.21Å; E121-K124 PolarHBondContact O-N 3.49Å; K124-N126 PolarHBondContact O-N 2.97Å; K124-N127 PolarHBondContact O-N 3.26Å; K124-E128 PolarHBondContact O-N 3.12Å
125R96.9Very high95.8Very high166 Ų166110.3 Ų110.363%0.62649%0.493SS*.Hα-helixtrans-60.4-44.1177.2-170.3-174.7-61.4162.82.6112.2E121 R122 N127 E128 S129E121-R125 PolarHBondContact O-N 3.44Å; R122-R125 PolarHBondContact O-N 3.49Å; R125-N127 PolarHBondContact O-N 3.05Å; R125-E128 WeakPolarHBondContact O-CB 3.44Å; R125-E128 PolarHBondContact O-N 3.05Å; R125-S129 WeakPolarHBondContact O-CB 3.19Å; R125-S129 PolarHBondContact O-N 2.97Å; R125-S129 PolarHBondContact O-OG 2.93Å; R125-S129 VanDerWaalsContact O-OG 3.1Å
126N97.8Very high95.8Very high95 Ų95111.1 Ų111.151%0.50851%0.506SS..Hα-helixtrans-64.4-40177.3177.5-97.8000112.3R122 R123 K124 E128 S129 A130R122-N126 PolarHBondContact O-N 3.31Å; R123-N126 PolarHBondContact NH1-OD1 2.88Å; R123-N126 PolarHBondContact O-N 2.93Å; K124-N126 PolarHBondContact O-N 2.97Å; N126-E128 VanDerWaalsContact C-N 3.32Å; N126-E128 PolarHBondContact O-N 3.31Å; N126-S129 PolarHBondContact O-N 3.37Å; N126-A130 VanDerWaalsContact O-CB 3.22Å; N126-A130 WeakPolarHBondContact O-CB 3.3Å; N126-A130 PolarHBondContact O-N 3.27Å
127N97.9Very high95.9Very high77 Ų77113.5 Ų113.541%0.41251%0.509SS..Hα-helixtrans-63-40.4175-74.5-19.1000111.8R123 K124 R125 A130 R131R123-N127 PolarHBondContact NH1-OD1 2.95Å; R123-N127 WeakPolarHBondContact O-CB 3.37Å; R123-N127 VanDerWaalsContact O-CG 3.29Å; R123-N127 PolarHBondContact O-N 3.27Å; R123-N127 PolarHBondContact O-ND2 3.45Å; K124-N127 PolarHBondContact O-N 3.26Å; R125-N127 PolarHBondContact O-N 3.05Å; N127-A130 PolarHBondContact O-N 3.18Å; N127-R131 WeakPolarHBondContact O-CB 3.41Å; N127-R131 PolarHBondContact O-N 3.22Å
128E97.6Very high95.9Very high120 Ų120112 Ų11256%0.56150%0.499SS*.Hα-helixtrans-63.4-49.7173.9-174.5-179179.300111.6K124 R125 N126 A130 R131 R132K124-E128 PolarHBondContact O-N 3.12Å; R125-E128 WeakPolarHBondContact O-CB 3.44Å; R125-E128 PolarHBondContact O-N 3.05Å; N126-E128 VanDerWaalsContact C-N 3.32Å; N126-E128 PolarHBondContact O-N 3.31Å; E128-A130 VanDerWaalsContact C-N 3.3Å; E128-A130 PolarHBondContact O-N 3.44Å; E128-R131 WeakPolarHBondContact O-CB 3.35Å; E128-R131 PolarHBondContact O-N 3.47Å; E128-R132 PolarHBondContact O-N 2.89Å
129S96.3Very high95.5Very high67 Ų67110.2 Ų110.247%0.46949%0.489SS..Hα-helixtrans-59.7-39.4175.6-62.40000112.4R125 N126 R132 S133R125-S129 WeakPolarHBondContact O-CB 3.19Å; R125-S129 PolarHBondContact O-N 2.97Å; R125-S129 PolarHBondContact O-OG 2.93Å; R125-S129 VanDerWaalsContact O-OG 3.1Å; N126-S129 PolarHBondContact O-N 3.37Å; S129-R132 PolarHBondContact O-N 3.48Å; S129-S133 VanDerWaalsContact O-CB 3.29Å; S129-S133 WeakPolarHBondContact O-CB 3.5Å; S129-S133 PolarHBondContact O-N 3.09Å
130A97.8Very high94.7Very high36 Ų36114.4 Ų114.430%0.29851%0.508SS..Hα-helixtrans-66.5-40.8177.100000111.3N126 N127 E128 S133 R134N126-A130 VanDerWaalsContact O-CB 3.22Å; N126-A130 WeakPolarHBondContact O-CB 3.3Å; N126-A130 PolarHBondContact O-N 3.27Å; N127-A130 PolarHBondContact O-N 3.18Å; E128-A130 VanDerWaalsContact C-N 3.3Å; E128-A130 PolarHBondContact O-N 3.44Å; A130-S133 PolarHBondContact O-N 2.61Å; A130-R134 WeakPolarHBondContact O-CB 3.3Å; A130-R134 VanDerWaalsContact O-CG 3.25Å; A130-R134 WeakPolarHBondContact O-CG 3.42Å; A130-R134 PolarHBondContact O-N 2.81Å
131R97.2Very high94.3Very high182 Ų182112.7 Ų112.769%0.68751%0.506SS*.Hα-helixtrans-61-49.5172.2-175.8-176.9-72.9131.7-5.7110.5N127 E128 S133 R134 E135N127-R131 WeakPolarHBondContact O-CB 3.41Å; N127-R131 PolarHBondContact O-N 3.22Å; E128-R131 WeakPolarHBondContact O-CB 3.35Å; E128-R131 PolarHBondContact O-N 3.47Å; R131-S133 VanDerWaalsContact C-N 3.33Å; R131-S133 PolarHBondContact O-N 2.9Å; R131-R134 WeakPolarHBondContact O-CB 3.44Å; R131-R134 PolarHBondContact O-N 2.89Å; R131-E135 PolarHBondContact O-N 3.36Å
132R94.9Very high93.8Very high203 Ų203110.8 Ų110.877%0.76650%0.497SS*.Hα-helixtrans-60.9-39.9178.5-170.8173.5-174.9140.11.5112.6E128 S129 E135 S136E128-R132 PolarHBondContact O-N 2.89Å; S129-R132 PolarHBondContact O-N 3.48Å; R132-E135 PolarHBondContact O-N 3.35Å; R132-S136 WeakPolarHBondContact O-CB 3.32Å; R132-S136 PolarHBondContact O-N 2.93Å
133S97.5Very high93.1Very high63 Ų63106.6 Ų106.644%0.44148%0.482SS..Hα-helixtrans-66.7-39.5176.1176.70000112.1S129 A130 R131 R137S129-S133 VanDerWaalsContact O-CB 3.29Å; S129-S133 WeakPolarHBondContact O-CB 3.5Å; S129-S133 PolarHBondContact O-N 3.09Å; A130-S133 PolarHBondContact O-N 2.61Å; R131-S133 VanDerWaalsContact C-N 3.33Å; R131-S133 PolarHBondContact O-N 2.9Å; S133-R137 PolarHBondContact O-N 3.48Å; S133-R137 VanDerWaalsContact O-N 3.1Å
134R98.1Very high92.5Very high171 Ų171106.1 Ų106.165%0.64549%0.487SS*.Hα-helixtrans-63.4-44.7173-73.5171.3-179.9-174.7-0.6111.3A130 R131 R137 R138A130-R134 WeakPolarHBondContact O-CB 3.3Å; A130-R134 VanDerWaalsContact O-CG 3.25Å; A130-R134 WeakPolarHBondContact O-CG 3.42Å; A130-R134 PolarHBondContact O-N 2.81Å; R131-R134 WeakPolarHBondContact O-CB 3.44Å; R131-R134 PolarHBondContact O-N 2.89Å; R134-R137 PolarHBondContact O-N 2.92Å; R134-R138 PolarHBondContact O-N 3.44Å
135E96.4Very high91.9Very high77 Ų77101.1 Ų101.136%0.3648%0.475SS..Hα-helixtrans-62.8-50178.4-159.558.6-119.300111.2R131 R132 R137 R138 M139R131-E135 PolarHBondContact O-N 3.36Å; R132-E135 PolarHBondContact O-N 3.35Å; E135-R137 VanDerWaalsContact C-N 3.25Å; E135-R137 PolarHBondContact O-N 2.94Å; E135-R138 PolarHBondContact O-N 3.16Å; E135-R138 IonicContact OE1-NH1 2.65Å; E135-R138 PolarHBondContact OE1-NH1 3.36Å; E135-R138 IonicContact OE2-CZ 2.68Å; E135-R138 IonicContact OE2-NH1 2.9Å; E135-R138 PolarHBondContact OE2-NH1 3.14Å; E135-M139 HydrophobicContact CG-CG 4.31Å; E135-M139 WeakPolarHBondContact O-CG 3.17Å; E135-M139 PolarHBondContact O-N 3.34Å
136S91.1Very high91.1Very high81 Ų8196.5 Ų96.557%0.56646%0.463SS*.Hα-helixtrans-57-38.4177.91740000112.8R132 K140R132-S136 WeakPolarHBondContact O-CB 3.32Å; R132-S136 PolarHBondContact O-N 2.93Å; S136-K140 WeakPolarHBondContact O-CB 3.43Å; S136-K140 PolarHBondContact O-N 3.41Å; S136-K140 VanDerWaalsContact O-N 3.14Å
137R94.4Very high90.4Very high130 Ų13096.4 Ų96.449%0.49146%0.455SS..Hα-helixtrans-65.5-49.4173.7-173.7-171.9-60.192.57.2111.3S133 R134 E135 M139 K140 E141S133-R137 PolarHBondContact O-N 3.48Å; S133-R137 VanDerWaalsContact O-N 3.1Å; R134-R137 PolarHBondContact O-N 2.92Å; E135-R137 VanDerWaalsContact C-N 3.25Å; E135-R137 PolarHBondContact O-N 2.94Å; R137-M139 VanDerWaalsContact C-N 3.35Å; R137-M139 PolarHBondContact O-N 3.2Å; R137-K140 WeakPolarHBondContact O-CB 3.23Å; R137-K140 PolarHBondContact O-N 3.45Å; R137-K140 VanDerWaalsContact O-N 3.16Å; R137-E141 WeakPolarHBondContact CD-OE1 3.45Å; R137-E141 HydrophobicContact CG-CG 4.5Å; R137-E141 VanDerWaalsContact CG-OE1 3.28Å; R137-E141 WeakPolarHBondContact CG-OE1 3.45Å; R137-E141 WeakPolarHBondContact O-CG 3.15Å; R137-E141 PolarHBondContact O-N 2.88Å
138R92.5Very high89.9Confident132 Ų13296 Ų9650%0.49846%0.455SS..Hα-helixtrans-58.6-47-179.8-170.6-172.5-60.9122-3.3111.4R134 E135 K140 E141 E142R134-R138 PolarHBondContact O-N 3.44Å; E135-R138 PolarHBondContact O-N 3.16Å; E135-R138 IonicContact OE1-NH1 2.65Å; E135-R138 PolarHBondContact OE1-NH1 3.36Å; E135-R138 IonicContact OE2-CZ 2.68Å; E135-R138 IonicContact OE2-NH1 2.9Å; E135-R138 PolarHBondContact OE2-NH1 3.14Å; R138-K140 VanDerWaalsContact C-N 3.28Å; R138-K140 PolarHBondContact O-N 2.83Å; R138-E141 WeakPolarHBondContact O-CB 3.35Å; R138-E141 PolarHBondContact O-N 2.98Å; R138-E141 VanDerWaalsContact O-N 3.15Å; R138-E142 PolarHBondContact O-N 2.95Å
139M83Confident89.4Confident43 Ų4394.3 Ų94.321%0.21245%0.453CS..Hα-helixtrans-60.9-37.8177.6-66.4-40.6-62.200112.2Y33 E135 R137 E142 Q143Y33-M139 HydrophobicContact CE2-CB 3.87Å; Y33-M139 HydrophobicContact CE2-CE 3.52Å; Y33-M139 HydrophobicContact CE2-CG 4.46Å; Y33-M139 WeakPolarHBondContact OH-CB 3.29Å; Y33-M139 WeakPolarHBondContact OH-CE 3.38Å; Y33-M139 WeakPolarHBondContact OH-CG 3.47Å; E135-M139 HydrophobicContact CG-CG 4.31Å; E135-M139 WeakPolarHBondContact O-CG 3.17Å; E135-M139 PolarHBondContact O-N 3.34Å; R137-M139 VanDerWaalsContact C-N 3.35Å; R137-M139 PolarHBondContact O-N 3.2Å; M139-E142 WeakPolarHBondContact CE-OE2 3.47Å; M139-E142 PolarHBondContact O-N 2.99Å; M139-Q143 WeakPolarHBondContact O-CB 2.8Å; M139-Q143 PolarHBondContact O-N 3.43Å
140K80.9Confident88.9Confident130 Ų13095.8 Ų95.857%0.56545%0.449SS*.Hα-helixtrans-66.5-42.1174.5-174.1173.7-178171.40111.9S136 R137 R138 Q143 I144S136-K140 WeakPolarHBondContact O-CB 3.43Å; S136-K140 PolarHBondContact O-N 3.41Å; S136-K140 VanDerWaalsContact O-N 3.14Å; R137-K140 WeakPolarHBondContact O-CB 3.23Å; R137-K140 PolarHBondContact O-N 3.45Å; R137-K140 VanDerWaalsContact O-N 3.16Å; R138-K140 VanDerWaalsContact C-N 3.28Å; R138-K140 PolarHBondContact O-N 2.83Å; K140-Q143 PolarHBondContact O-N 2.91Å; K140-I144 HydrophobicContact CG-CD1 4.12Å; K140-I144 WeakPolarHBondContact O-CD1 3.32Å; K140-I144 VanDerWaalsContact O-CG1 3.23Å; K140-I144 WeakPolarHBondContact O-CG1 3Å; K140-I144 PolarHBondContact O-N 3.35Å
141E85.6Confident88.4Confident111 Ų11196.9 Ų96.952%0.51945%0.449SS..Hα-helixtrans-62.6-42.3175.6-70.9165.1-176.900111.4R137 R138 I144 A145R137-E141 WeakPolarHBondContact CD-OE1 3.45Å; R137-E141 HydrophobicContact CG-CG 4.5Å; R137-E141 VanDerWaalsContact CG-OE1 3.28Å; R137-E141 WeakPolarHBondContact CG-OE1 3.45Å; R137-E141 WeakPolarHBondContact O-CG 3.15Å; R137-E141 PolarHBondContact O-N 2.88Å; R138-E141 WeakPolarHBondContact O-CB 3.35Å; R138-E141 PolarHBondContact O-N 2.98Å; R138-E141 VanDerWaalsContact O-N 3.15Å; E141-I144 PolarHBondContact O-N 2.94Å; E141-A145 PolarHBondContact O-N 2.86Å
142E85Confident88.1Confident59 Ų5994 Ų9428%0.27644%0.444SS..Hα-helixtrans-63.6-43.8175.1-176174.2-15700112.1Y36 R138 M139 I144 A145 L146Y36-E142 HydrophobicContact CE1-CG 4.37Å; Y36-E142 WeakPolarHBondContact CE1-OE1 3.35Å; Y36-E142 PolarHBondContact OH-OE1 3.14Å; R138-E142 PolarHBondContact O-N 2.95Å; M139-E142 WeakPolarHBondContact CE-OE2 3.47Å; M139-E142 PolarHBondContact O-N 2.99Å; E142-I144 VanDerWaalsContact C-N 3.32Å; E142-I144 PolarHBondContact O-N 3.15Å; E142-A145 WeakPolarHBondContact O-CB 3.46Å; E142-A145 PolarHBondContact O-N 2.89Å; E142-L146 WeakPolarHBondContact O-CG 3.5Å; E142-L146 PolarHBondContact O-N 2.68Å
143Q80.9Confident87.9Confident33 Ų3389.6 Ų89.615%0.15443%0.432CS..Hα-helixtrans-59.7-43.1174.7-179.1169.32300112.2D29 Y33 M139 K140 L146 R147D29-Q143 VanDerWaalsContact CA-NE2 3.25Å; D29-Q143 PolarHBondContact O-NE2 3.1Å; D29-Q143 PolarHBondContact OD1-NE2 3.22Å; Y33-Q143 HydrophobicContact CD2-CB 4.11Å; Y33-Q143 HydrophobicContact CD2-CG 4.46Å; M139-Q143 WeakPolarHBondContact O-CB 2.8Å; M139-Q143 PolarHBondContact O-N 3.43Å; K140-Q143 PolarHBondContact O-N 2.91Å; Q143-L146 PolarHBondContact O-N 3.39Å; Q143-R147 WeakPolarHBondContact O-CB 3.13Å; Q143-R147 PolarHBondContact O-N 2.87Å
144I84Confident87.5Confident93 Ų9390.1 Ų90.148%0.47743%0.428SS..Hα-helixtrans-62.7-45.3176-69.2164.4000110K140 E141 E142 L146 R147 V148K140-I144 HydrophobicContact CG-CD1 4.12Å; K140-I144 WeakPolarHBondContact O-CD1 3.32Å; K140-I144 VanDerWaalsContact O-CG1 3.23Å; K140-I144 WeakPolarHBondContact O-CG1 3Å; K140-I144 PolarHBondContact O-N 3.35Å; E141-I144 PolarHBondContact O-N 2.94Å; E142-I144 VanDerWaalsContact C-N 3.32Å; E142-I144 PolarHBondContact O-N 3.15Å; I144-L146 PolarHBondContact O-N 3.45Å; I144-R147 PolarHBondContact O-N 3.04Å; I144-V148 HydrophobicContact CG2-CG2 4.45Å; I144-V148 WeakPolarHBondContact O-CG2 3.48Å; I144-V148 PolarHBondContact O-N 2.78Å
145A84.7Confident87.2Confident55 Ų5585.6 Ų85.646%0.45542%0.416SS..Hα-helixtrans-59.4-45.8178.300000111.9E141 E142 R147 V148 V149E141-A145 PolarHBondContact O-N 2.86Å; E142-A145 WeakPolarHBondContact O-CB 3.46Å; E142-A145 PolarHBondContact O-N 2.89Å; A145-R147 VanDerWaalsContact C-N 3.33Å; A145-R147 PolarHBondContact O-N 2.98Å; A145-V148 PolarHBondContact O-N 2.85Å; A145-V149 WeakPolarHBondContact O-CG2 3.48Å; A145-V149 PolarHBondContact O-N 3.11Å; A145-V149 VanDerWaalsContact O-N 3.09Å
146L80.4Confident87.1Confident69 Ų6987.3 Ų87.336%0.36143%0.427SS..Hα-helixtrans-61.5-41.4175.4-71.4174.1000112.1Y36 E142 Q143 I144 V148 V149 Y150Y36-L146 HydrophobicContact CD1-CD1 3.93Å; Y36-L146 HydrophobicContact CD2-CD1 3.78Å; Y36-L146 HydrophobicContact CE1-CD1 4.25Å; Y36-L146 HydrophobicContact CE2-CD1 4.13Å; Y36-L146 HydrophobicContact CG-CD1 3.66Å; E142-L146 WeakPolarHBondContact O-CG 3.5Å; E142-L146 PolarHBondContact O-N 2.68Å; Q143-L146 PolarHBondContact O-N 3.39Å; I144-L146 PolarHBondContact O-N 3.45Å; L146-V148 VanDerWaalsContact C-N 3.33Å; L146-V148 PolarHBondContact O-N 3.06Å; L146-V149 PolarHBondContact O-N 2.9Å; L146-Y150 PolarHBondContact O-N 3.33Å
147R83.2Confident87.3Confident93 Ų9388.4 Ų88.435%0.35142%0.423SS..Hα-helixtrans-63.3-40.3177.5-179.257.2174.2177.11.9111.8Q143 I144 A145 Y150 L151Q143-R147 WeakPolarHBondContact O-CB 3.13Å; Q143-R147 PolarHBondContact O-N 2.87Å; I144-R147 PolarHBondContact O-N 3.04Å; A145-R147 VanDerWaalsContact C-N 3.33Å; A145-R147 PolarHBondContact O-N 2.98Å; R147-Y150 PolarHBondContact O-N 3.4Å; R147-L151 HydrophobicContact CG-CD1 4.02Å; R147-L151 HydrophobicContact CG-CG 4.46Å; R147-L151 WeakPolarHBondContact O-CB 3.35Å; R147-L151 VanDerWaalsContact O-CG 3.3Å; R147-L151 WeakPolarHBondContact O-CG 3.49Å; R147-L151 PolarHBondContact O-N 3.08Å
148V86.9Confident87.4Confident67 Ų6786.4 Ų86.441%0.40642%0.422SS..Hα-helixtrans-60.3-50.9175.8170.10000110.1I144 A145 L146 Y150 L151 E152I144-V148 HydrophobicContact CG2-CG2 4.45Å; I144-V148 WeakPolarHBondContact O-CG2 3.48Å; I144-V148 PolarHBondContact O-N 2.78Å; A145-V148 PolarHBondContact O-N 2.85Å; L146-V148 VanDerWaalsContact C-N 3.33Å; L146-V148 PolarHBondContact O-N 3.06Å; V148-Y150 VanDerWaalsContact C-N 3.35Å; V148-Y150 PolarHBondContact O-N 2.83Å; V148-L151 PolarHBondContact O-N 3.1Å; V148-E152 HydrophobicContact CG1-CG 4.34Å; V148-E152 WeakPolarHBondContact CG1-OE1 3.42Å; V148-E152 WeakPolarHBondContact O-CB 3.48Å; V148-E152 WeakPolarHBondContact O-CG 3.34Å; V148-E152 PolarHBondContact O-N 3.38Å
149V86.7Confident87.5Confident86 Ų8688.1 Ų88.152%0.52143%0.428SS..Hα-helixtrans-58.9-44.4179174.30000111.9A145 L146 E152 Q153A145-V149 WeakPolarHBondContact O-CG2 3.48Å; A145-V149 PolarHBondContact O-N 3.11Å; A145-V149 VanDerWaalsContact O-N 3.09Å; L146-V149 PolarHBondContact O-N 2.9Å; V149-E152 PolarHBondContact O-N 3.49Å; V149-Q153 PolarHBondContact O-N 3.29Å
150Y86.4Confident88.1Confident98 Ų9889.5 Ų89.538%0.38444%0.439SS..Hα-helixtrans-59.5-48.3176.9173.1-93.4000112L146 R147 V148 E152 Q153 E154L146-Y150 PolarHBondContact O-N 3.33Å; R147-Y150 PolarHBondContact O-N 3.4Å; V148-Y150 VanDerWaalsContact C-N 3.35Å; V148-Y150 PolarHBondContact O-N 2.83Å; Y150-E152 VanDerWaalsContact C-N 3.32Å; Y150-E152 PolarHBondContact O-N 3.32Å; Y150-Q153 PolarHBondContact O-N 2.81Å; Y150-E154 WeakPolarHBondContact CE1-OE2 3.48Å; Y150-E154 WeakPolarHBondContact O-CB 3.28Å; Y150-E154 PolarHBondContact O-N 3.47Å
151L87.2Confident88.9Confident58 Ų5888 Ų8830%0.30444%0.435SS..Hα-helixtrans-66-35.5180-73.1174.2000111.9R147 V148 N155R147-L151 HydrophobicContact CG-CD1 4.02Å; R147-L151 HydrophobicContact CG-CG 4.46Å; R147-L151 WeakPolarHBondContact O-CB 3.35Å; R147-L151 VanDerWaalsContact O-CG 3.3Å; R147-L151 WeakPolarHBondContact O-CG 3.49Å; R147-L151 PolarHBondContact O-N 3.08Å; V148-L151 PolarHBondContact O-N 3.1Å; L151-N155 WeakPolarHBondContact O-CB 3.31Å; L151-N155 PolarHBondContact O-N 2.85Å
152E90.3Very high89.5Confident121 Ų12185.9 Ų85.957%0.56543%0.429SS*.Hα-helixtrans-63.9-43.4174.1-74.7175.4170.900111.6V148 V149 Y150 N155 L156V148-E152 HydrophobicContact CG1-CG 4.34Å; V148-E152 WeakPolarHBondContact CG1-OE1 3.42Å; V148-E152 WeakPolarHBondContact O-CB 3.48Å; V148-E152 WeakPolarHBondContact O-CG 3.34Å; V148-E152 PolarHBondContact O-N 3.38Å; V149-E152 PolarHBondContact O-N 3.49Å; Y150-E152 VanDerWaalsContact C-N 3.32Å; Y150-E152 PolarHBondContact O-N 3.32Å; E152-N155 PolarHBondContact O-N 3.4Å; E152-L156 WeakPolarHBondContact O-CB 3.29Å; E152-L156 PolarHBondContact O-N 3.36Å
153Q90Very high90Very high112 Ų11286 Ų8652%0.52344%0.436SS..Hα-helixtrans-64.1-47.7176-175.2-179.617.900111.9V149 Y150 N155 L156 Q157V149-Q153 PolarHBondContact O-N 3.29Å; Y150-Q153 PolarHBondContact O-N 2.81Å; Q153-N155 VanDerWaalsContact C-N 3.33Å; Q153-N155 PolarHBondContact O-N 2.79Å; Q153-L156 PolarHBondContact O-N 3.46Å; Q153-Q157 WeakPolarHBondContact O-CG 3.25Å; Q153-Q157 PolarHBondContact O-N 3.19Å
154E89.4Confident90.8Very high74 Ų7489.8 Ų89.835%0.34646%0.455SS..Hα-helixtrans-60.3-43.7176.9-176.1179-157.500110.9Y150 L156 Q157 L158Y150-E154 WeakPolarHBondContact CE1-OE2 3.48Å; Y150-E154 WeakPolarHBondContact O-CB 3.28Å; Y150-E154 PolarHBondContact O-N 3.47Å; E154-L156 VanDerWaalsContact C-N 3.32Å; E154-L156 PolarHBondContact O-N 3.38Å; E154-Q157 PolarHBondContact O-N 3.25Å; E154-L158 HydrophobicContact CG-CD1 4.19Å; E154-L158 WeakPolarHBondContact O-CG 3.41Å; E154-L158 PolarHBondContact O-N 2.78Å
155N93.2Very high91.5Very high76 Ų7690.8 Ų90.841%0.40646%0.461SS..Hα-helixtrans-62-39.9177.2-163.8-96.6000112.1L151 E152 Q153 R159L151-N155 WeakPolarHBondContact O-CB 3.31Å; L151-N155 PolarHBondContact O-N 2.85Å; E152-N155 PolarHBondContact O-N 3.4Å; Q153-N155 VanDerWaalsContact C-N 3.33Å; Q153-N155 PolarHBondContact O-N 2.79Å; N155-R159 WeakPolarHBondContact O-CB 3.48Å; N155-R159 VanDerWaalsContact O-CG 3.24Å; N155-R159 WeakPolarHBondContact O-CG 3.25Å; N155-R159 PolarHBondContact O-N 3.13Å; N155-R159 PolarHBondContact OD1-NE 3.29Å; N155-R159 PolarHBondContact OD1-NH2 3.44Å
156L93.5Very high92.1Very high112 Ų11296.6 Ų96.659%0.58647%0.471SS*.Hα-helixtrans-65.3-43176.4-179.962.3000112E152 Q153 E154 R159 T160E152-L156 WeakPolarHBondContact O-CB 3.29Å; E152-L156 PolarHBondContact O-N 3.36Å; Q153-L156 PolarHBondContact O-N 3.46Å; E154-L156 VanDerWaalsContact C-N 3.32Å; E154-L156 PolarHBondContact O-N 3.38Å; L156-R159 PolarHBondContact O-N 3.38Å; L156-T160 PolarHBondContact O-N 3.37Å; L156-T160 PolarHBondContact O-OG1 2.95Å
157Q95.1Very high92.9Very high105 Ų10598.4 Ų98.449%0.49148%0.481SS..Hα-helixtrans-60-50.8176.1-72.7176.38.600110.9Q153 E154 R159 T160 E161Q153-Q157 WeakPolarHBondContact O-CG 3.25Å; Q153-Q157 PolarHBondContact O-N 3.19Å; E154-Q157 PolarHBondContact O-N 3.25Å; Q157-R159 VanDerWaalsContact C-N 3.33Å; Q157-R159 PolarHBondContact O-N 2.96Å; Q157-T160 WeakPolarHBondContact O-CA 3.46Å; Q157-T160 WeakPolarHBondContact O-CB 3.43Å; Q157-T160 PolarHBondContact O-N 3.18Å; Q157-E161 PolarHBondContact O-N 2.93Å
158L95.6Very high93.5Very high88 Ų8898.1 Ų98.146%0.46148%0.483SS..Hα-helixtrans-60.1-41178-69.1172.3000112.4E154 T160 E161 V162E154-L158 HydrophobicContact CG-CD1 4.19Å; E154-L158 WeakPolarHBondContact O-CG 3.41Å; E154-L158 PolarHBondContact O-N 2.78Å; L158-T160 VanDerWaalsContact C-N 3.29Å; L158-T160 PolarHBondContact O-N 2.79Å; L158-E161 PolarHBondContact O-N 3.05Å; L158-V162 WeakPolarHBondContact O-CB 3.36Å; L158-V162 VanDerWaalsContact O-CG2 3.24Å; L158-V162 WeakPolarHBondContact O-CG2 3.39Å; L158-V162 PolarHBondContact O-N 2.87Å
159R95.4Very high94Very high168 Ų16898.8 Ų98.863%0.63448%0.484SS*.Hα-helixtrans-61.8-38.6174.6-76.7177.2-170.3-81.9-4.4112.2N155 L156 Q157 S163N155-R159 WeakPolarHBondContact O-CB 3.48Å; N155-R159 VanDerWaalsContact O-CG 3.24Å; N155-R159 WeakPolarHBondContact O-CG 3.25Å; N155-R159 PolarHBondContact O-N 3.13Å; N155-R159 PolarHBondContact OD1-NE 3.29Å; N155-R159 PolarHBondContact OD1-NH2 3.44Å; L156-R159 PolarHBondContact O-N 3.38Å; Q157-R159 VanDerWaalsContact C-N 3.33Å; Q157-R159 PolarHBondContact O-N 2.96Å; R159-S163 WeakPolarHBondContact O-CB 3.4Å; R159-S163 PolarHBondContact O-N 2.93Å
160T96.4Very high94.5Very high72 Ų7299.9 Ų99.944%0.44248%0.483SS..Hα-helixtrans-66-47.8177.5-55.20000110.5L156 Q157 L158 V162 S163 M164L156-T160 PolarHBondContact O-N 3.37Å; L156-T160 PolarHBondContact O-OG1 2.95Å; Q157-T160 WeakPolarHBondContact O-CA 3.46Å; Q157-T160 WeakPolarHBondContact O-CB 3.43Å; Q157-T160 PolarHBondContact O-N 3.18Å; L158-T160 VanDerWaalsContact C-N 3.29Å; L158-T160 PolarHBondContact O-N 2.79Å; T160-V162 PolarHBondContact O-N 3.31Å; T160-S163 WeakPolarHBondContact O-CB 3.41Å; T160-S163 PolarHBondContact O-N 3.21Å; T160-M164 HydrophobicContact CG2-CE 4.45Å; T160-M164 WeakPolarHBondContact O-CG 3.22Å; T160-M164 PolarHBondContact O-N 2.93Å
161E97.4Very high95Very high99 Ų99100.7 Ų100.746%0.46349%0.489SS..Hα-helixtrans-59.6-47.3175.9-70.6177.6-16700112.3Q157 L158 S163 M164 L165Q157-E161 PolarHBondContact O-N 2.93Å; L158-E161 PolarHBondContact O-N 3.05Å; E161-S163 VanDerWaalsContact C-N 3.28Å; E161-S163 PolarHBondContact O-N 3.37Å; E161-M164 HydrophobicContact CG-CE 4.23Å; E161-M164 PolarHBondContact O-N 2.98Å; E161-L165 WeakPolarHBondContact O-CG 3.49Å; E161-L165 PolarHBondContact O-N 3.46Å
162V97.5Very high95.4Very high66 Ų66102 Ų10240%0.450%0.496SS..Hα-helixtrans-60-40.1176.31690000111.2L158 T160 R166L158-V162 WeakPolarHBondContact O-CB 3.36Å; L158-V162 VanDerWaalsContact O-CG2 3.24Å; L158-V162 WeakPolarHBondContact O-CG2 3.39Å; L158-V162 PolarHBondContact O-N 2.87Å; T160-V162 PolarHBondContact O-N 3.31Å; V162-R166 HydrophobicContact CG1-CG 4.47Å; V162-R166 WeakPolarHBondContact O-CB 3.26Å; V162-R166 WeakPolarHBondContact O-CG 3.36Å; V162-R166 PolarHBondContact O-N 3.43Å
163S96.9Very high95.6Very high60 Ų60103.8 Ų103.842%0.4250%0.497SS..Hα-helixtrans-63.6-47175.6-173.90000111.7R159 T160 E161 L165 R166 N167R159-S163 WeakPolarHBondContact O-CB 3.4Å; R159-S163 PolarHBondContact O-N 2.93Å; T160-S163 WeakPolarHBondContact O-CB 3.41Å; T160-S163 PolarHBondContact O-N 3.21Å; E161-S163 VanDerWaalsContact C-N 3.28Å; E161-S163 PolarHBondContact O-N 3.37Å; S163-L165 PolarHBondContact O-N 3.37Å; S163-R166 PolarHBondContact O-N 3.46Å; S163-N167 PolarHBondContact O-N 2.89Å; S163-N167 PolarHBondContact O-ND2 2.77Å; S163-N167 VanDerWaalsContact O-ND2 3.14Å
164M96.8Very high95.8Very high113 Ų113103.6 Ų103.656%0.55750%0.498SS*.Hα-helixtrans-60.2-46.5177.3-70.1-170.3-61.500112T160 E161 R166 N167 E168T160-M164 HydrophobicContact CG2-CE 4.45Å; T160-M164 WeakPolarHBondContact O-CG 3.22Å; T160-M164 PolarHBondContact O-N 2.93Å; E161-M164 HydrophobicContact CG-CE 4.23Å; E161-M164 PolarHBondContact O-N 2.98Å; M164-R166 PolarHBondContact O-N 3.09Å; M164-N167 PolarHBondContact O-N 3.34Å; M164-E168 PolarHBondContact O-N 3Å
165L97.7Very high96.1Very high115 Ų115104.3 Ų104.360%0.60250%0.503SS*.Hα-helixtrans-64-40.1178.2-70.2173.6000112E161 S163 E168 I169E161-L165 WeakPolarHBondContact O-CG 3.49Å; E161-L165 PolarHBondContact O-N 3.46Å; S163-L165 PolarHBondContact O-N 3.37Å; L165-E168 PolarHBondContact O-N 3.32Å; L165-I169 VanDerWaalsContact O-CG1 3.26Å; L165-I169 WeakPolarHBondContact O-CG1 3.39Å; L165-I169 PolarHBondContact O-N 3.49Å
166R97.7Very high96.1Very high177 Ų177106.7 Ų106.767%0.66852%0.515SS*.Hα-helixtrans-62.3-42.3174.5-77.4175.1176.1177.1-0.2112V162 S163 M164 I169 E170V162-R166 HydrophobicContact CG1-CG 4.47Å; V162-R166 WeakPolarHBondContact O-CB 3.26Å; V162-R166 WeakPolarHBondContact O-CG 3.36Å; V162-R166 PolarHBondContact O-N 3.43Å; S163-R166 PolarHBondContact O-N 3.46Å; M164-R166 PolarHBondContact O-N 3.09Å; R166-I169 PolarHBondContact O-N 3.47Å; R166-E170 WeakPolarHBondContact O-CB 3.38Å; R166-E170 PolarHBondContact O-N 3.1Å
167N97.1Very high96.1Very high106 Ų106108.2 Ų108.257%0.56751%0.514SS*.Hα-helixtrans-63.1-41.7175.8-74.8-39.8000112.1S163 M164 E170 K171S163-N167 PolarHBondContact O-N 2.89Å; S163-N167 PolarHBondContact O-ND2 2.77Å; S163-N167 VanDerWaalsContact O-ND2 3.14Å; M164-N167 PolarHBondContact O-N 3.34Å; N167-E170 PolarHBondContact O-N 3.14Å; N167-K171 WeakPolarHBondContact O-CB 3.16Å; N167-K171 PolarHBondContact O-N 3.38Å
168E96.6Very high96Very high87 Ų87107.6 Ų107.641%0.40751%0.514SS..Hα-helixtrans-67.1-41.2177.7-172.460.5-164.100111.8M164 L165 E170 K171 L172M164-E168 PolarHBondContact O-N 3Å; L165-E168 PolarHBondContact O-N 3.32Å; E168-E170 VanDerWaalsContact C-N 3.3Å; E168-E170 PolarHBondContact O-N 3.43Å; E168-K171 PolarHBondContact O-N 2.99Å; E168-L172 HydrophobicContact CG-CD1 4.34Å; E168-L172 WeakPolarHBondContact O-CG 3.49Å; E168-L172 PolarHBondContact O-N 3.03Å
169I97.2Very high95.8Very high82 Ų82107.4 Ų107.442%0.42153%0.525SS..Hα-helixtrans-58.2-44.7173.3-71166.1000110.6L165 R166 L172 R173L165-I169 VanDerWaalsContact O-CG1 3.26Å; L165-I169 WeakPolarHBondContact O-CG1 3.39Å; L165-I169 PolarHBondContact O-N 3.49Å; R166-I169 PolarHBondContact O-N 3.47Å; I169-L172 PolarHBondContact O-N 2.76Å; I169-R173 HydrophobicContact CG2-CG 4.49Å; I169-R173 VanDerWaalsContact O-CG 3.3Å; I169-R173 WeakPolarHBondContact O-CG 3.13Å; I169-R173 PolarHBondContact O-N 3.47Å
170E97Very high95Very high108 Ų108107 Ų10751%0.50553%0.53SS..Hα-helixtrans-65.6-42.1179.9-167.257.4-15400111.9R166 N167 E168 L172 R173 M174R166-E170 WeakPolarHBondContact O-CB 3.38Å; R166-E170 PolarHBondContact O-N 3.1Å; N167-E170 PolarHBondContact O-N 3.14Å; E168-E170 VanDerWaalsContact C-N 3.3Å; E168-E170 PolarHBondContact O-N 3.43Å; E170-L172 PolarHBondContact O-N 3.25Å; E170-R173 WeakPolarHBondContact O-CB 3.4Å; E170-R173 PolarHBondContact O-N 3.39Å; E170-R173 IonicContact OE2-NH1 3.64Å; E170-M174 PolarHBondContact O-N 3.33Å
171K96.2Very high93.5Very high115 Ų115111.9 Ų111.950%0.555%0.548SS..Hα-helixtrans-59.5-45.2174.3-177.5-174.8173.3-166.10112N167 E168 M174 I175N167-K171 WeakPolarHBondContact O-CB 3.16Å; N167-K171 PolarHBondContact O-N 3.38Å; E168-K171 PolarHBondContact O-N 2.99Å; K171-M174 PolarHBondContact O-N 3.12Å; K171-I175 HydrophobicContact CG-CD1 4.3Å; K171-I175 WeakPolarHBondContact O-CG1 3.4Å; K171-I175 PolarHBondContact O-N 3.3Å
172L95.6Very high93.3Very high87 Ų87112.6 Ų112.646%0.45555%0.552SS.*Hα-helixtrans-64.7-41.5177.2-70.1172.8000111.8E168 I169 E170 M174 I175 L176E168-L172 HydrophobicContact CG-CD1 4.34Å; E168-L172 WeakPolarHBondContact O-CG 3.49Å; E168-L172 PolarHBondContact O-N 3.03Å; I169-L172 PolarHBondContact O-N 2.76Å; E170-L172 PolarHBondContact O-N 3.25Å; L172-M174 VanDerWaalsContact C-N 3.3Å; L172-M174 PolarHBondContact O-N 2.72Å; L172-I175 PolarHBondContact O-N 3.18Å; L172-L176 WeakPolarHBondContact O-CG 3.29Å; L172-L176 PolarHBondContact O-N 2.93Å
173R95.6Very high93.1Very high157 Ų157115 Ų11559%0.59256%0.56SS**Hα-helixtrans-59-42173.4-75.5172.3177173.7-2111.8I169 E170 L176 Y177I169-R173 HydrophobicContact CG2-CG 4.49Å; I169-R173 VanDerWaalsContact O-CG 3.3Å; I169-R173 WeakPolarHBondContact O-CG 3.13Å; I169-R173 PolarHBondContact O-N 3.47Å; E170-R173 WeakPolarHBondContact O-CB 3.4Å; E170-R173 PolarHBondContact O-N 3.39Å; E170-R173 IonicContact OE2-NH1 3.64Å; R173-L176 PolarHBondContact O-N 3.11Å; R173-Y177 WeakPolarHBondContact O-CB 3.3Å; R173-Y177 PolarHBondContact O-N 3.09Å
174M94.8Very high92.8Very high109 Ų109118.1 Ų118.154%0.53757%0.568SS.*Hα-helixtrans-65.1-42.4178.2-158-169.577.700111.8E170 K171 L172 Y177 N178E170-M174 PolarHBondContact O-N 3.33Å; K171-M174 PolarHBondContact O-N 3.12Å; L172-M174 VanDerWaalsContact C-N 3.3Å; L172-M174 PolarHBondContact O-N 2.72Å; M174-Y177 PolarHBondContact O-N 3.34Å; M174-N178 WeakPolarHBondContact O-CB 3.48Å; M174-N178 PolarHBondContact O-N 3.25Å; M174-N178 PolarHBondContact O-ND2 3.27Å
175I95.1Very high92.6Very high89 Ų89118.4 Ų118.446%0.45657%0.568SS.*Hα-helixtrans-61.8-45.5175.6-67.7166000110.8K171 L172 N178 A179K171-I175 HydrophobicContact CG-CD1 4.3Å; K171-I175 WeakPolarHBondContact O-CG1 3.4Å; K171-I175 PolarHBondContact O-N 3.3Å; L172-I175 PolarHBondContact O-N 3.18Å; I175-N178 PolarHBondContact O-N 2.79Å; I175-A179 WeakPolarHBondContact O-CB 3.28Å; I175-A179 PolarHBondContact O-N 2.88Å
176L93.4Very high92.3Very high125 Ų125118.6 Ų118.665%0.65457%0.566SS**Hα-helixtrans-65-39.3178.6-70.5176.8000112.5L172 R173 A179 H180L172-L176 WeakPolarHBondContact O-CG 3.29Å; L172-L176 PolarHBondContact O-N 2.93Å; R173-L176 PolarHBondContact O-N 3.11Å; L176-A179 PolarHBondContact O-N 2.65Å; L176-H180 PolarHBondContact O-N 3.1Å
177Y93.6Very high91.9Very high144 Ų144114.7 Ų114.757%0.56556%0.56SS**Hα-helixtrans-61.7-46.1175.9178.5-95.9000111.7R173 M174 A179 H180 H181R173-Y177 WeakPolarHBondContact O-CB 3.3Å; R173-Y177 PolarHBondContact O-N 3.09Å; M174-Y177 PolarHBondContact O-N 3.34Å; Y177-A179 VanDerWaalsContact C-N 3.3Å; Y177-A179 PolarHBondContact O-N 3.32Å; Y177-H180 PolarHBondContact O-N 3.18Å; Y177-H181 AromaticContact CD2-CE1 3.88Å; Y177-H181 AromaticContact CD2-ND1 3.88Å; Y177-H181 AromaticContact CE2-CE1 3.62Å; Y177-H181 AromaticContact CE2-ND1 3.79Å; Y177-H181 PolarHBondContact O-N 2.92Å; Y177-H181 PolarHBondContact O-ND1 3.2Å
178N91.9Very high91.6Very high93 Ų93115.3 Ų115.350%0.49756%0.559SS.*Hα-helixtrans-71.7-19.5178.8-66.7-22000113.8M174 I175M174-N178 WeakPolarHBondContact O-CB 3.48Å; M174-N178 PolarHBondContact O-N 3.25Å; M174-N178 PolarHBondContact O-ND2 3.27Å; I175-N178 PolarHBondContact O-N 2.79Å
179A91.1Very high91.2Very high83 Ų83117.5 Ų117.569%0.68657%0.571SS**Hα-helixtrans-83.4-19.5176.700000112.8I175 L176 Y177I175-A179 WeakPolarHBondContact O-CB 3.28Å; I175-A179 PolarHBondContact O-N 2.88Å; L176-A179 PolarHBondContact O-N 2.65Å; Y177-A179 VanDerWaalsContact C-N 3.3Å; Y177-A179 PolarHBondContact O-N 3.32Å
180H79.9Confident90.7Very high161 Ų161120.4 Ų120.475%0.74558%0.583SS**Hα-helixtrans-106.2-8.8-176.4-168.1-81.5000113.5L176 Y177L176-H180 PolarHBondContact O-N 3.1Å; Y177-H180 PolarHBondContact O-N 3.18Å
181H64.1Low90.1Very high174 Ų174121.5 Ų121.581%0.80659%0.59SS**  trans-122.30175.4-6381.7000109.7Y177Y177-H181 AromaticContact CD2-CE1 3.88Å; Y177-H181 AromaticContact CD2-ND1 3.88Å; Y177-H181 AromaticContact CE2-CE1 3.62Å; Y177-H181 AromaticContact CE2-ND1 3.79Å; Y177-H181 PolarHBondContact O-N 2.92Å; Y177-H181 PolarHBondContact O-ND1 3.2Å

Retrieved 181 of 181 residues in 319 ms (Link to these results)