A0A060WGJ2_ONCMY Loading...

Protein phosphatase 1, regulatory (inhibitor) subunit 14Ba

AlphaFold DB , UniProt , Accession A0A060WGJ2, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 132 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M47.3Very low46.1Very low244 Ų244140.3 Ų140.3100%1.20284%0.836SS**  0138.30-74.3-111.6-147.300107.9
2A40.7Very low46.6Very low96 Ų96143.9 Ų143.979%0.79384%0.838SS**  trans72.2141174.700000117.1
3T37.3Very low47.4Very low127 Ų127140.6 Ų140.678%0.77984%0.838SS**  cis-167.6134-4.526.20000106.6
4L45.7Very low48.6Very low184 Ų184144.1 Ų144.196%0.96383%0.829SS**  trans-82.7117.6166.2-80.1150.2000109
5T46.5Very low49.5Very low116 Ų116142.5 Ų142.571%0.71282%0.822SS**  trans-150.2134.7158.4107.30000104.2
6S44.5Very low49.9Very low108 Ų108145 Ų14576%0.75582%0.816SS**  cis-158.9142.830.4-61.30000108.8
7Q46.2Very low49.9Very low197 Ų197147.8 Ų147.892%0.92182%0.817SS**  trans-104.7113.6160.2-93.9179.7-14.700108.8
8D49.4Very low50Low141 Ų141149.8 Ų149.875%0.75482%0.82SS**  trans27.399.6141.6-153-98.5000117.5
9S43.4Very low50.3Low115 Ų115148.2 Ų148.280%0.80482%0.815SS**  trans-105.6104.4157.8-157.20000107.6A11S9-A11 PolarHBondContact O-N 2.77Å
10T55.8Low50.5Low123 Ų123146.1 Ų146.176%0.75581%0.809SS**  trans-54.799.91741180000108.8
11A50.4Low50.5Low92 Ų92145.4 Ų145.476%0.7681%0.811SS**  trans-111.5110.9165.800000107S9 A13S9-A11 PolarHBondContact O-N 2.77Å; A11-A13 PolarHBondContact O-N 2.91Å
12Q52.5Low50.6Low184 Ų184137.1 Ų137.186%0.8679%0.788SS**  trans-23.5120.4179.1-62175.6-5.800113.6R14Q12-R14 PolarHBondContact O-N 3.48Å
13A56.6Low50.6Low101 Ų101137.9 Ų137.984%0.83578%0.783SS**  trans-65.881.7169.800000109.6A11 V15A11-A13 PolarHBondContact O-N 2.91Å; A13-V15 PolarHBondContact O-N 2.82Å
14R63.9Low51Low190 Ų190141.5 Ų141.572%0.71779%0.791SS**  trans-77.8102.9167.4-170.6150.6-168149.61.3107.3Q12 Y16Q12-R14 PolarHBondContact O-N 3.48Å; R14-Y16 HydrophobicContact CB-CE2 4.18Å; R14-Y16 HydrophobicContact CG-CE1 4.16Å; R14-Y16 HydrophobicContact CG-CE2 4.45Å; R14-Y16 WeakPolarHBondContact O-CD2 3.49Å; R14-Y16 VanDerWaalsContact O-CE2 3.31Å; R14-Y16 WeakPolarHBondContact O-CE2 3.3Å; R14-Y16 PolarHBondContact O-N 3.04Å
15V63Low50.6Low120 Ų120138.6 Ų138.673%0.72778%0.777SS**  trans-63.2105.9171.4-70.60000108.6A13A13-V15 PolarHBondContact O-N 2.82Å
16Y54.8Low50.5Low182 Ų182139 Ų13971%0.71478%0.779SS**  trans-83.9114.1165.9-57.6-81.2000106.6R14 Q18R14-Y16 HydrophobicContact CB-CE2 4.18Å; R14-Y16 HydrophobicContact CG-CE1 4.16Å; R14-Y16 HydrophobicContact CG-CE2 4.45Å; R14-Y16 WeakPolarHBondContact O-CD2 3.49Å; R14-Y16 VanDerWaalsContact O-CE2 3.31Å; R14-Y16 WeakPolarHBondContact O-CE2 3.3Å; R14-Y16 PolarHBondContact O-N 3.04Å; Y16-Q18 PolarHBondContact O-N 3.36Å; Y16-Q18 VanDerWaalsContact O-N 3.09Å
17F50.7Low50.2Low192 Ų192141.4 Ų141.484%0.84278%0.779SS**  trans-67.6106.3162.2-91.2-93.8000107.1T19F17-T19 PolarHBondContact O-N 3.23Å
18Q51.8Low50.2Low184 Ų184137.8 Ų137.886%0.8677%0.77SS**  trans-88.997.5177.6-162.8145.870.200107.5Y16Y16-Q18 PolarHBondContact O-N 3.36Å; Y16-Q18 VanDerWaalsContact O-N 3.09Å
19T55.1Low49.9Very low119 Ų119136 Ų13673%0.7376%0.763SS**PPolyproline II helixtrans-81126174.5-27.70000108.7F17F17-T19 PolarHBondContact O-N 3.23Å
20P54.8Low50.4Low106 Ų106138.7 Ų138.769%0.68876%0.763SS**PPolyproline II helixtrans-64.3143.4178.325.8-33.2000110.9
21P50.1Low49.9Very low132 Ų132141.5 Ų141.586%0.85777%0.765SS**SBendtrans-82.2127.8176.633-28.8000109
22G49.4Very low49.4Very low71 Ų71145.8 Ų145.873%0.73277%0.769SS**  trans93.369.9166.300000114.8
23T39.8Very low48.7Very low112 Ų112139.9 Ų139.969%0.68776%0.758SS**  trans-134.3103.3135.9-45.10000105.8D25T23-D25 HydrophobicContact CG2-CB 4.12Å; T23-D25 PolarHBondContact O-N 3.28Å
24E46.8Very low47.7Very low202 Ų202146.1 Ų146.194%0.94476%0.76SS**  trans-58.788.6159.1179.8174.991.300106
25D37.3Very low46.1Very low123 Ų123142.2 Ų142.266%0.65876%0.757SS**  trans-134.3148.6169.7-143-65.7000108.2T23 E27T23-D25 HydrophobicContact CG2-CB 4.12Å; T23-D25 PolarHBondContact O-N 3.28Å; D25-E27 PolarHBondContact O-N 2.66Å
26T44.3Very low45Very low125 Ų125142 Ų14277%0.76776%0.757SS**  trans-78.874.5-163.9-56.10000108.1V28T26-V28 WeakPolarHBondContact O-CG2 3.4Å; T26-V28 PolarHBondContact O-N 3.21Å
27E38.6Very low44.3Very low158 Ų158133.9 Ų133.974%0.73873%0.726SS**  trans-86.288.7177.954.1-172.8150.800110.3D25 V29D25-E27 PolarHBondContact O-N 2.66Å; E27-V29 PolarHBondContact O-N 3.35Å
28V46.5Very low44.4Very low121 Ų121134.5 Ų134.573%0.73373%0.728SS**  trans-45.682.9155.9-138.80000108.5T26 Q30T26-V28 WeakPolarHBondContact O-CG2 3.4Å; T26-V28 PolarHBondContact O-N 3.21Å; V28-Q30 PolarHBondContact O-N 3.32Å
29V42.1Very low44.7Very low103 Ų103130.9 Ų130.962%0.62471%0.707SS**  trans-67.992.1164175.50000105E27 K31E27-V29 PolarHBondContact O-N 3.35Å; V29-K31 HydrophobicContact CG1-CG 3.93Å; V29-K31 PolarHBondContact O-N 3.47Å
30Q54Low45.4Very low172 Ų172130 Ų13080%0.80470%0.698SS**  trans-54.182.3161.9-70.5-176.5-17.300107.5V28 Q32V28-Q30 PolarHBondContact O-N 3.32Å; Q30-Q32 PolarHBondContact O-N 2.92Å
31K44.3Very low46.4Very low183 Ų183133.6 Ų133.680%0.79670%0.698SS**  trans-6890.1160.5-67.6-171.7179.8179.80104.4V29 G33V29-K31 HydrophobicContact CG1-CG 3.93Å; V29-K31 PolarHBondContact O-N 3.47Å; K31-G33 WeakPolarHBondContact O-CA 3.03Å; K31-G33 PolarHBondContact O-N 3.21Å
32Q41.9Very low47.7Very low181 Ų181134.9 Ų134.985%0.84669%0.69SS**  trans-25.7102.8169.6-69.8171.5-12.200108Q30 R34Q30-Q32 PolarHBondContact O-N 2.92Å; Q32-R34 PolarHBondContact O-N 3.32Å
33G37.1Very low49Very low61 Ų61132.2 Ų132.263%0.62966%0.659SS**  trans-55.7115.6-172.600000106.9K31 V35K31-G33 WeakPolarHBondContact O-CA 3.03Å; K31-G33 PolarHBondContact O-N 3.21Å; G33-V35 PolarHBondContact O-N 3.49Å
34R36.3Very low50.9Low232 Ų232130 Ų13088%0.87564%0.642SS**  trans-64.787.3158.7-77.8-171.3176.7-165.3-0.6105.7Q32 T36Q32-R34 PolarHBondContact O-N 3.32Å; R34-T36 PolarHBondContact O-N 2.97Å
35V28.8Very low52.5Low108 Ų108127.3 Ų127.366%0.65562%0.623SS**  trans-76.360.7167.8-174.40000106.2G33 V37G33-V35 PolarHBondContact O-N 3.49Å; V35-V37 HydrophobicContact CG1-CG2 4.04Å; V35-V37 PolarHBondContact O-N 3.46Å
36T39.5Very low54.7Low116 Ų116126 Ų12671%0.71261%0.611SS**  trans-77.884.7163.351.30000105.3R34 K38R34-T36 PolarHBondContact O-N 2.97Å; T36-K38 PolarHBondContact O-N 2.94Å; T36-K38 VanDerWaalsContact O-N 3.15Å
37V42.1Very low56.4Low10 Ų10121.7 Ų121.76%0.06158%0.581CS.*  trans-47.8123.6161.31800000105.8V35 Y39 S121 T122V35-V37 HydrophobicContact CG1-CG2 4.04Å; V35-V37 PolarHBondContact O-N 3.46Å; V37-Y39 HydrophobicContact CB-CD1 4.16Å; V37-Y39 HydrophobicContact CB-CD2 4.44Å; V37-Y39 HydrophobicContact CB-CE1 3.63Å; V37-Y39 HydrophobicContact CB-CE2 3.92Å; V37-Y39 VanDerWaalsContact CB-CZ 3.5Å; V37-Y39 HydrophobicContact CG1-CD1 3.7Å; V37-Y39 HydrophobicContact CG1-CE1 3.36Å; V37-Y39 HydrophobicContact CG1-CG 4.43Å; V37-Y39 HydrophobicContact CG2-CE1 4.45Å; V37-Y39 WeakPolarHBondContact O-CD2 3.44Å; V37-Y39 PolarHBondContact O-N 3.27Å; V37-S121 WeakPolarHBondContact CG1-O 3.31Å; V37-T122 HydrophobicContact CG2-CG2 3.88Å
38K50.9Low58.5Low205 Ų205118.8 Ų118.889%0.89157%0.571SS**  trans-76.685-176.7-165.6-176.4179.7-176.20107.5T36T36-K38 PolarHBondContact O-N 2.94Å; T36-K38 VanDerWaalsContact O-N 3.15Å
39Y58.7Low60.3Low108 Ų108117.9 Ų117.942%0.42456%0.561SS.*  trans-72.1139.5176.1-56.3-61.9000110.3V37 R41 L44 L120V37-Y39 HydrophobicContact CB-CD1 4.16Å; V37-Y39 HydrophobicContact CB-CD2 4.44Å; V37-Y39 HydrophobicContact CB-CE1 3.63Å; V37-Y39 HydrophobicContact CB-CE2 3.92Å; V37-Y39 VanDerWaalsContact CB-CZ 3.5Å; V37-Y39 HydrophobicContact CG1-CD1 3.7Å; V37-Y39 HydrophobicContact CG1-CE1 3.36Å; V37-Y39 HydrophobicContact CG1-CG 4.43Å; V37-Y39 HydrophobicContact CG2-CE1 4.45Å; V37-Y39 WeakPolarHBondContact O-CD2 3.44Å; V37-Y39 PolarHBondContact O-N 3.27Å; Y39-R41 PolarHBondContact O-N 3.48Å; Y39-L44 HydrophobicContact CD2-CD1 4.49Å; Y39-L44 HydrophobicContact CD2-CD2 4.29Å; Y39-L44 HydrophobicContact CG-CD1 4.36Å; Y39-L44 HydrophobicContact CG-CD2 4.03Å; Y39-L44 HydrophobicContact CG-CG 4.36Å; Y39-L120 HydrophobicContact CD1-CB 3.69Å; Y39-L120 HydrophobicContact CD1-CD1 3.65Å; Y39-L120 HydrophobicContact CD1-CD2 3.9Å; Y39-L120 HydrophobicContact CD1-CG 3.93Å; Y39-L120 HydrophobicContact CE1-CB 3.79Å; Y39-L120 HydrophobicContact CE1-CD1 3.96Å; Y39-L120 HydrophobicContact CE1-CG 4.37Å; Y39-L120 HydrophobicContact CG-CD1 4.38Å
40D70.6Confident62.3Low100 Ų100113.2 Ų113.254%0.53553%0.533SS..  trans-72.3125.7174-157.6-69.6000109.1K42 E43 L44D40-K42 PolarHBondContact O-N 2.88Å; D40-K42 VanDerWaalsContact O-N 3.15Å; D40-K42 PolarHBondContact OD1-N 3.44Å; D40-E43 HydrophobicContact CB-CB 3.96Å; D40-E43 PolarHBondContact O-N 2.88Å; D40-L44 PolarHBondContact O-N 2.87Å
41R74.7Confident63.6Low182 Ų182109.1 Ų109.169%0.68751%0.514SS*.Hα-helixtrans-59.1-30.6-176.6-175.8176.4-178.81672.5112.1Y39 R45Y39-R41 PolarHBondContact O-N 3.48Å; R41-R45 WeakPolarHBondContact O-CG 3.47Å; R41-R45 PolarHBondContact O-N 3.36Å
42K78.1Confident65.4Low159 Ų159106 Ų10669%0.69150%0.502SS*.Hα-helixtrans-71.7-39.3176.7-66.5-179.9179.1178.20111D40 R45 K46D40-K42 PolarHBondContact O-N 2.88Å; D40-K42 VanDerWaalsContact O-N 3.15Å; D40-K42 PolarHBondContact OD1-N 3.44Å; K42-R45 WeakPolarHBondContact O-CB 3.37Å; K42-R45 PolarHBondContact O-N 3.1Å; K42-K46 PolarHBondContact O-N 3.37Å; K42-K46 VanDerWaalsContact O-N 3.12Å
43E76.6Confident67.6Low16 Ų1699.3 Ų99.38%0.07547%0.469CS..Hα-helixtrans-72.9-41.2-179-161.258-149.300111.6D40 R45 K46 R47 L117 Q118 L120D40-E43 HydrophobicContact CB-CB 3.96Å; D40-E43 PolarHBondContact O-N 2.88Å; E43-R45 PolarHBondContact O-N 3.47Å; E43-K46 WeakPolarHBondContact O-CB 3.3Å; E43-K46 PolarHBondContact O-N 2.94Å; E43-K46 IonicContact OE2-NZ 3.58Å; E43-K46 PolarHBondContact OE2-NZ 3.02Å; E43-R47 PolarHBondContact O-N 3.25Å; E43-L117 WeakPolarHBondContact OE1-CA 3.49Å; E43-Q118 HydrophobicContact CG-CB 4.26Å; E43-Q118 PolarHBondContact OE1-N 2.81Å; E43-L120 HydrophobicContact CB-CD2 3.98Å; E43-L120 HydrophobicContact CG-CD2 3.72Å
44L79.8Confident69.7Low64 Ų6497 Ų9734%0.33544%0.442SS..Hα-helixtrans-55.9-40.9170.3-76.3173.8000112.2Y39 D40 R47 L48 L120Y39-L44 HydrophobicContact CD2-CD1 4.49Å; Y39-L44 HydrophobicContact CD2-CD2 4.29Å; Y39-L44 HydrophobicContact CG-CD1 4.36Å; Y39-L44 HydrophobicContact CG-CD2 4.03Å; Y39-L44 HydrophobicContact CG-CG 4.36Å; D40-L44 PolarHBondContact O-N 2.87Å; L44-R47 PolarHBondContact O-N 3.13Å; L44-L48 WeakPolarHBondContact O-CB 3.48Å; L44-L48 WeakPolarHBondContact O-CG 3.41Å; L44-L48 PolarHBondContact O-N 3.34Å; L44-L120 HydrophobicContact CD2-CD1 4.03Å
45R81.5Confident71.8Confident146 Ų14691.1 Ų91.155%0.55143%0.427SS*.Hα-helixtrans-62.6-44.5175.1-80.2175.2174.1-174.9-4.2111.5R41 K42 E43 R47 L48 N49R41-R45 WeakPolarHBondContact O-CG 3.47Å; R41-R45 PolarHBondContact O-N 3.36Å; K42-R45 WeakPolarHBondContact O-CB 3.37Å; K42-R45 PolarHBondContact O-N 3.1Å; E43-R45 PolarHBondContact O-N 3.47Å; R45-R47 VanDerWaalsContact C-N 3.3Å; R45-R47 PolarHBondContact O-N 3.42Å; R45-L48 PolarHBondContact O-N 3.5Å; R45-N49 WeakPolarHBondContact O-CB 3.32Å; R45-N49 PolarHBondContact O-N 3.32Å; R45-N49 PolarHBondContact O-ND2 3.38Å
46K82.8Confident74.3Confident95 Ų9591.9 Ų91.941%0.41342%0.423SS..Hα-helixtrans-61.8-40.2175.7-66.6-177.6-166.3161.20111.9K42 E43 N49 L50 G116 L117K42-K46 PolarHBondContact O-N 3.37Å; K42-K46 VanDerWaalsContact O-N 3.12Å; E43-K46 WeakPolarHBondContact O-CB 3.3Å; E43-K46 PolarHBondContact O-N 2.94Å; E43-K46 IonicContact OE2-NZ 3.58Å; E43-K46 PolarHBondContact OE2-NZ 3.02Å; K46-N49 PolarHBondContact O-N 3.24Å; K46-L50 WeakPolarHBondContact O-CB 3.45Å; K46-L50 PolarHBondContact O-N 3.2Å; K46-G116 PolarHBondContact NZ-O 3.07Å; K46-G116 VanDerWaalsContact NZ-O 3.15Å; K46-L117 HydrophobicContact CB-CD1 4.47Å
47R79.9Confident76.2Confident35 Ų3589.1 Ų89.113%0.13240%0.403CS..Hα-helixtrans-64.5-45.8178.4-174.556.4167.7-108.3-13.6111.8E43 L44 R45 N49 L50 E51 V76 D77 L117E43-R47 PolarHBondContact O-N 3.25Å; L44-R47 PolarHBondContact O-N 3.13Å; R45-R47 VanDerWaalsContact C-N 3.3Å; R45-R47 PolarHBondContact O-N 3.42Å; R47-N49 PolarHBondContact O-N 2.96Å; R47-L50 WeakPolarHBondContact O-CB 3.32Å; R47-L50 PolarHBondContact O-N 3.1Å; R47-L50 VanDerWaalsContact O-N 3.14Å; R47-E51 WeakPolarHBondContact CG-OE1 3.41Å; R47-E51 IonicContact NE-OE1 2.89Å; R47-E51 PolarHBondContact NE-OE1 2.81Å; R47-E51 WeakPolarHBondContact O-CG 3.41Å; R47-E51 PolarHBondContact O-N 3.45Å; R47-V76 VanDerWaalsContact NH1-CB 3.26Å; R47-D77 IonicContact CZ-OD2 2.89Å; R47-D77 IonicContact NH1-OD2 3.24Å; R47-D77 IonicContact NH2-OD2 3.64Å; R47-D77 PolarHBondContact NH2-OD2 2.96Å; R47-L117 HydrophobicContact CB-CD2 4.45Å
48L82.6Confident77.9Confident98 Ų9889.4 Ų89.451%0.51340%0.404SS..Hα-helixtrans-59.4-47.2173.1-74.7165.9000111.9L44 R45 L50 E51 E52L44-L48 WeakPolarHBondContact O-CB 3.48Å; L44-L48 WeakPolarHBondContact O-CG 3.41Å; L44-L48 PolarHBondContact O-N 3.34Å; R45-L48 PolarHBondContact O-N 3.5Å; L48-L50 PolarHBondContact O-N 3.33Å; L48-E51 PolarHBondContact O-N 3.3Å; L48-E52 WeakPolarHBondContact O-CG 3.33Å; L48-E52 PolarHBondContact O-N 2.99Å
49N84.8Confident79Confident101 Ų10183.5 Ų83.554%0.5439%0.385SS..Hα-helixtrans-62.3-31.8177-82.3-102.7000112.1R45 K46 R47 W53R45-N49 WeakPolarHBondContact O-CB 3.32Å; R45-N49 PolarHBondContact O-N 3.32Å; R45-N49 PolarHBondContact O-ND2 3.38Å; K46-N49 PolarHBondContact O-N 3.24Å; R47-N49 PolarHBondContact O-N 2.96Å; N49-W53 WeakPolarHBondContact O-CB 3.39Å; N49-W53 PolarHBondContact O-N 2.83Å; N49-W53 VanDerWaalsContact O-N 3.07Å
50L83.9Confident79.8Confident5 Ų583.7 Ų83.73%0.02639%0.393CS..Hα-helixtrans-68.8-46.8175.4-178.268.2000110.9K46 R47 L48 W53 I54 V76 L110 K113 V114 L117K46-L50 WeakPolarHBondContact O-CB 3.45Å; K46-L50 PolarHBondContact O-N 3.2Å; R47-L50 WeakPolarHBondContact O-CB 3.32Å; R47-L50 PolarHBondContact O-N 3.1Å; R47-L50 VanDerWaalsContact O-N 3.14Å; L48-L50 PolarHBondContact O-N 3.33Å; L50-W53 HydrophobicContact CD1-CE3 4.07Å; L50-W53 HydrophobicContact CD1-CZ3 4.47Å; L50-W53 PolarHBondContact O-N 3.38Å; L50-I54 HydrophobicContact CD1-CD1 4.4Å; L50-I54 HydrophobicContact CD2-CD1 4.49Å; L50-I54 HydrophobicContact CG-CD1 3.93Å; L50-I54 HydrophobicContact CG-CG1 4.48Å; L50-I54 WeakPolarHBondContact O-CB 3.32Å; L50-I54 VanDerWaalsContact O-CG1 3.24Å; L50-I54 WeakPolarHBondContact O-CG1 3.21Å; L50-I54 PolarHBondContact O-N 3.05Å; L50-V76 HydrophobicContact CD2-CB 4.5Å; L50-V76 HydrophobicContact CD2-CG1 3.87Å; L50-V76 HydrophobicContact CD2-CG2 3.78Å; L50-L110 HydrophobicContact CD1-CD1 4.05Å; L50-K113 HydrophobicContact CD1-CB 3.41Å; L50-K113 VanDerWaalsContact CD1-CB 3.41Å; L50-K113 HydrophobicContact CD1-CG 4.05Å; L50-V114 HydrophobicContact CD2-CG2 4.25Å; L50-L117 HydrophobicContact CD2-CD1 4.09Å; L50-L117 HydrophobicContact CD2-CD2 3.54Å; L50-L117 HydrophobicContact CD2-CG 4.48Å
51E81.2Confident79.9Confident86 Ų8679.9 Ų79.940%0.40237%0.372SS..Hα-helixtrans-63-46.2179-73172.6-158.500111.3R47 L48 W53 I54 I55R47-E51 WeakPolarHBondContact CG-OE1 3.41Å; R47-E51 IonicContact NE-OE1 2.89Å; R47-E51 PolarHBondContact NE-OE1 2.81Å; R47-E51 WeakPolarHBondContact O-CG 3.41Å; R47-E51 PolarHBondContact O-N 3.45Å; L48-E51 PolarHBondContact O-N 3.3Å; E51-W53 VanDerWaalsContact C-N 3.34Å; E51-W53 PolarHBondContact O-N 3.01Å; E51-I54 PolarHBondContact O-N 3.49Å; E51-I55 VanDerWaalsContact O-CG1 3.31Å; E51-I55 WeakPolarHBondContact O-CG1 3.26Å; E51-I55 PolarHBondContact O-N 3.01Å
52E83Confident79.5Confident118 Ų11872.6 Ų72.655%0.55135%0.345SS*.Hα-helixtrans-57.5-47.3173.5-72.8176.3143.800111.2L48 I54 I55 E56L48-E52 WeakPolarHBondContact O-CG 3.33Å; L48-E52 PolarHBondContact O-N 2.99Å; E52-I54 PolarHBondContact O-N 2.9Å; E52-I55 PolarHBondContact O-N 2.79Å; E52-E56 WeakPolarHBondContact O-CG 3.41Å; E52-E56 PolarHBondContact O-N 2.81Å
53W87Confident78.7Confident41 Ų4171.2 Ų71.216%0.15535%0.345CS..Hα-helixtrans-64.8-37.5178.6174.574.2000113N49 L50 E51 I55 E56 Q57 F106 A109 L110N49-W53 WeakPolarHBondContact O-CB 3.39Å; N49-W53 PolarHBondContact O-N 2.83Å; N49-W53 VanDerWaalsContact O-N 3.07Å; L50-W53 HydrophobicContact CD1-CE3 4.07Å; L50-W53 HydrophobicContact CD1-CZ3 4.47Å; L50-W53 PolarHBondContact O-N 3.38Å; E51-W53 VanDerWaalsContact C-N 3.34Å; E51-W53 PolarHBondContact O-N 3.01Å; W53-I55 VanDerWaalsContact C-N 3.32Å; W53-E56 PolarHBondContact O-N 3.32Å; W53-Q57 HydrophobicContact CD2-CG 4.03Å; W53-Q57 HydrophobicContact CG-CG 4.41Å; W53-Q57 HydrophobicContact CH2-CG 4.25Å; W53-Q57 HydrophobicContact CZ2-CG 3.55Å; W53-Q57 WeakPolarHBondContact O-CB 3.3Å; W53-Q57 WeakPolarHBondContact O-CG 3.5Å; W53-Q57 PolarHBondContact O-N 2.73Å; W53-F106 AromaticContact CH2-CD2 3.88Å; W53-F106 HydrophobicContact CH2-CD2 3.88Å; W53-F106 AromaticContact CH2-CE2 3.98Å; W53-F106 HydrophobicContact CH2-CE2 3.98Å; W53-F106 HydrophobicContact CZ2-CD2 4.44Å; W53-F106 HydrophobicContact CZ3-CD2 4.34Å; W53-F106 AromaticContact CZ3-CE2 3.95Å; W53-F106 HydrophobicContact CZ3-CE2 3.95Å; W53-A109 HydrophobicContact CH2-CB 3.56Å; W53-A109 HydrophobicContact CZ2-CB 3.48Å; W53-A109 VanDerWaalsContact CZ2-CB 3.48Å; W53-L110 HydrophobicContact CH2-CB 4.07Å; W53-L110 HydrophobicContact CZ3-CB 3.88Å; W53-L110 HydrophobicContact CZ3-CD1 4Å
54I81.5Confident77.4Confident13 Ų1374.2 Ų74.27%0.06737%0.368CS..Hα-helixtrans-60.5-46174.9-74.5166.4000109.7L50 E51 E52 Q57 L58 I74 V76 F106 L110L50-I54 HydrophobicContact CD1-CD1 4.4Å; L50-I54 HydrophobicContact CD2-CD1 4.49Å; L50-I54 HydrophobicContact CG-CD1 3.93Å; L50-I54 HydrophobicContact CG-CG1 4.48Å; L50-I54 WeakPolarHBondContact O-CB 3.32Å; L50-I54 VanDerWaalsContact O-CG1 3.24Å; L50-I54 WeakPolarHBondContact O-CG1 3.21Å; L50-I54 PolarHBondContact O-N 3.05Å; E51-I54 PolarHBondContact O-N 3.49Å; E52-I54 PolarHBondContact O-N 2.9Å; I54-Q57 PolarHBondContact O-N 3.45Å; I54-L58 HydrophobicContact CG2-CD1 3.77Å; I54-L58 HydrophobicContact CG2-CG 4.33Å; I54-L58 WeakPolarHBondContact O-CB 3.5Å; I54-L58 VanDerWaalsContact O-CG 3.23Å; I54-L58 WeakPolarHBondContact O-CG 3.34Å; I54-L58 PolarHBondContact O-N 3.46Å; I54-I74 HydrophobicContact CG2-CD1 3.91Å; I54-V76 HydrophobicContact CD1-CG2 4.49Å; I54-F106 HydrophobicContact CG1-CZ 4.41Å; I54-F106 HydrophobicContact CG2-CZ 4.3Å; I54-L110 HydrophobicContact CD1-CD1 3.7Å; I54-L110 HydrophobicContact CG1-CD1 3.89Å
55I79.1Confident75.8Confident107 Ų10779.5 Ų79.555%0.54939%0.391SS..Hα-helixtrans-64-46.9179.6-65.5163.8000110.8E51 E52 W53 Q57 L58 T59E51-I55 VanDerWaalsContact O-CG1 3.31Å; E51-I55 WeakPolarHBondContact O-CG1 3.26Å; E51-I55 PolarHBondContact O-N 3.01Å; E52-I55 PolarHBondContact O-N 2.79Å; W53-I55 VanDerWaalsContact C-N 3.32Å; I55-Q57 PolarHBondContact O-N 3.06Å; I55-L58 PolarHBondContact O-N 2.76Å; I55-T59 WeakPolarHBondContact O-CB 3.34Å; I55-T59 PolarHBondContact O-N 3.35Å; I55-T59 PolarHBondContact O-OG1 3.47Å
56E81.4Confident74.2Confident124 Ų12481.4 Ų81.458%0.57941%0.405SS*.Hα-helixtrans-57.9-49.6176.8-74.2-178.4150.400111.2E52 W53 L58 T59 D60E52-E56 WeakPolarHBondContact O-CG 3.41Å; E52-E56 PolarHBondContact O-N 2.81Å; W53-E56 PolarHBondContact O-N 3.32Å; E56-L58 VanDerWaalsContact C-N 3.35Å; E56-L58 PolarHBondContact O-N 3.33Å; E56-T59 WeakPolarHBondContact O-CB 3.05Å; E56-T59 PolarHBondContact O-N 2.85Å; E56-T59 VanDerWaalsContact O-N 3.16Å; E56-D60 PolarHBondContact O-N 3.4Å
57Q81.4Confident72.4Confident59 Ų5985.8 Ų85.828%0.27643%0.427SS..Hα-helixtrans-64.1-37.8178.9-75.7-62.8139.700113.2W53 I54 I55 T59 L61 F106W53-Q57 HydrophobicContact CD2-CG 4.03Å; W53-Q57 HydrophobicContact CG-CG 4.41Å; W53-Q57 HydrophobicContact CH2-CG 4.25Å; W53-Q57 HydrophobicContact CZ2-CG 3.55Å; W53-Q57 WeakPolarHBondContact O-CB 3.3Å; W53-Q57 WeakPolarHBondContact O-CG 3.5Å; W53-Q57 PolarHBondContact O-N 2.73Å; I54-Q57 PolarHBondContact O-N 3.45Å; I55-Q57 PolarHBondContact O-N 3.06Å; Q57-T59 VanDerWaalsContact C-N 3.32Å; Q57-L61 WeakPolarHBondContact O-CB 3.47Å; Q57-L61 PolarHBondContact O-N 3.37Å; Q57-F106 HydrophobicContact CB-CD2 3.53Å; Q57-F106 HydrophobicContact CB-CE2 3.68Å; Q57-F106 HydrophobicContact CG-CD2 4Å; Q57-F106 HydrophobicContact CG-CE2 4.32Å
58L76Confident70.8Confident16 Ų1691.2 Ų91.28%0.08445%0.454CS..Hα-helixtrans-65-39.9174.6-76.8173.5000110.8I54 I55 E56 L61 Y62 L72 L96I54-L58 HydrophobicContact CG2-CD1 3.77Å; I54-L58 HydrophobicContact CG2-CG 4.33Å; I54-L58 WeakPolarHBondContact O-CB 3.5Å; I54-L58 VanDerWaalsContact O-CG 3.23Å; I54-L58 WeakPolarHBondContact O-CG 3.34Å; I54-L58 PolarHBondContact O-N 3.46Å; I55-L58 PolarHBondContact O-N 2.76Å; E56-L58 VanDerWaalsContact C-N 3.35Å; E56-L58 PolarHBondContact O-N 3.33Å; L58-L61 PolarHBondContact O-N 2.89Å; L58-Y62 HydrophobicContact CD2-CD2 4.4Å; L58-Y62 HydrophobicContact CD2-CE2 4.1Å; L58-Y62 WeakPolarHBondContact O-CB 3.36Å; L58-Y62 WeakPolarHBondContact O-CD2 3.48Å; L58-Y62 PolarHBondContact O-N 3.46Å; L58-L72 HydrophobicContact CD2-CD2 4.27Å; L58-L96 HydrophobicContact CD2-CD2 3.61Å
59T74.8Confident69.4Low81 Ų8189.8 Ų89.850%0.49745%0.447SS..Hα-helixtrans-61.5-48.1176.6-53.70000110.9I55 E56 Q57 L61 Y62 D63I55-T59 WeakPolarHBondContact O-CB 3.34Å; I55-T59 PolarHBondContact O-N 3.35Å; I55-T59 PolarHBondContact O-OG1 3.47Å; E56-T59 WeakPolarHBondContact O-CB 3.05Å; E56-T59 PolarHBondContact O-N 2.85Å; E56-T59 VanDerWaalsContact O-N 3.16Å; Q57-T59 VanDerWaalsContact C-N 3.32Å; T59-L61 VanDerWaalsContact C-N 3.34Å; T59-L61 PolarHBondContact O-N 3.31Å; T59-Y62 PolarHBondContact O-N 3.05Å; T59-D63 PolarHBondContact O-N 2.89Å
60D75.6Confident68.1Low111 Ų11187.5 Ų87.559%0.59444%0.437SS*.Hα-helixtrans-63.1-37.5175-84.6-52.1000112.8E56 K101E56-D60 PolarHBondContact O-N 3.4Å; D60-K101 PolarHBondContact O-NZ 2.91Å
61L71.6Confident66.9Low20 Ų2097 Ų9711%0.10548%0.481CS..Hα-helixtrans-68.6-44.3179.4-115.279.1000111.8Q57 L58 T59 K101 T103 F106Q57-L61 WeakPolarHBondContact O-CB 3.47Å; Q57-L61 PolarHBondContact O-N 3.37Å; L58-L61 PolarHBondContact O-N 2.89Å; T59-L61 VanDerWaalsContact C-N 3.34Å; T59-L61 PolarHBondContact O-N 3.31Å; L61-K101 HydrophobicContact CG-CB 4.34Å; L61-K101 WeakPolarHBondContact O-CD 3.44Å; L61-K101 WeakPolarHBondContact O-CE 3.19Å; L61-K101 WeakPolarHBondContact O-CG 3.31Å; L61-K101 PolarHBondContact O-NZ 3.21Å; L61-T103 HydrophobicContact CD2-CG2 3.55Å; L61-F106 HydrophobicContact CD1-CB 4.49Å
62Y66.3Low66.1Low29 Ų2994.6 Ų94.611%0.11447%0.471CS..Hα-helixtrans-83.6-29.3-174.1-82.4-90.9000112.9L58 T59 C64 L96 C99L58-Y62 HydrophobicContact CD2-CD2 4.4Å; L58-Y62 HydrophobicContact CD2-CE2 4.1Å; L58-Y62 WeakPolarHBondContact O-CB 3.36Å; L58-Y62 WeakPolarHBondContact O-CD2 3.48Å; L58-Y62 PolarHBondContact O-N 3.46Å; T59-Y62 PolarHBondContact O-N 3.05Å; Y62-C64 VanDerWaalsContact O-CB 3.3Å; Y62-C64 WeakPolarHBondContact O-CB 3.35Å; Y62-C64 PolarHBondContact O-N 3.32Å; Y62-C64 PolarHBondContact O-SG 3.45Å; Y62-C64 VanDerWaalsContact O-SG 3.32Å; Y62-L96 HydrophobicContact CE2-CD2 4.49Å; Y62-C99 HydrophobicContact CE1-CB 4.32Å; Y62-C99 HydrophobicContact CE2-CB 4.09Å; Y62-C99 WeakPolarHBondContact OH-CB 3.34Å; Y62-C99 PolarHBondContact OH-N 3.14Å
63D61.4Low65.6Low130 Ų13095.9 Ų95.970%0.69548%0.477SS*.  trans48.422.1171.3-152.821.1000114.2T59 K101T59-D63 PolarHBondContact O-N 2.89Å; D63-K101 VanDerWaalsContact CB-NZ 3.3Å; D63-K101 IonicContact OD2-NZ 3.36Å; D63-K101 PolarHBondContact OD2-NZ 2.9Å
64C50.9Low65.2Low80 Ų8095 Ų9554%0.54148%0.475SS..SBendtrans-134.8150.5-170.1-780000109.7Y62Y62-C64 VanDerWaalsContact O-CB 3.3Å; Y62-C64 WeakPolarHBondContact O-CB 3.35Å; Y62-C64 PolarHBondContact O-N 3.32Å; Y62-C64 PolarHBondContact O-SG 3.45Å; Y62-C64 VanDerWaalsContact O-SG 3.32Å
65E44.8Very low65.2Low175 Ų17597.8 Ų97.882%0.81849%0.49SS*.  trans-51.8142.5179.7-70.81759100111.1E67E65-E67 PolarHBondContact O-N 2.88Å
66E49.1Very low65.3Low185 Ų18592.8 Ų92.886%0.86447%0.465SS*.THydrogen-bonded Turntrans-42.6-6.6-174.6-159.2173.1108.900117.1
67E44.5Very low65.3Low187 Ų18789.5 Ų89.587%0.87445%0.451SS*.THydrogen-bonded Turntrans-87.3-16.8-171.3-125.9176.816400115.2E65E65-E67 PolarHBondContact O-N 2.88Å
68E45.4Very low65.4Low150 Ų15089.8 Ų89.870%0.70145%0.452SS*.SBendtrans-111.3-2.6179.9-85.6-172.4159.600114.6P70E68-P70 WeakPolarHBondContact O-CD 3.03Å; E68-P70 VanDerWaalsContact O-N 3.16Å
69I53.2Low65.8Low68 Ų6889.1 Ų89.135%0.34945%0.449SS..  trans-72.2108.1172.6-56.5176.2000106.3
70P57.5Low66.2Low52 Ų5286.8 Ų86.834%0.33843%0.433SS..  trans-59.1158.7174.3-13.129.1000108.4E68 L72E68-P70 WeakPolarHBondContact O-CD 3.03Å; E68-P70 VanDerWaalsContact O-N 3.16Å; P70-L72 PolarHBondContact O-N 3.16Å
71E59.4Low66.5Low205 Ų20586.4 Ų86.496%0.95843%0.431SS*.  trans-6377.6168.3-71.3179.592.100109.7E73E71-E73 PolarHBondContact O-N 3.27Å
72L65.3Low67.1Low35 Ų3587.1 Ų87.118%0.18343%0.434CS..  trans-89.490-173.1-157.983.4000109L58 P70 I74 L95 L96L58-L72 HydrophobicContact CD2-CD2 4.27Å; P70-L72 PolarHBondContact O-N 3.16Å; L72-I74 HydrophobicContact CD2-CG1 4.42Å; L72-I74 PolarHBondContact O-N 3.31Å; L72-L95 HydrophobicContact CD1-CB 3.85Å; L72-L95 HydrophobicContact CD1-CD2 4.2Å; L72-L95 WeakPolarHBondContact CD1-O 3.06Å; L72-L95 HydrophobicContact CD2-CB 4.25Å; L72-L95 HydrophobicContact CG-CB 4.18Å; L72-L96 HydrophobicContact CD2-CD2 3.69Å; L72-L96 HydrophobicContact CD2-CG 4.4Å
73E71.9Confident67.7Low146 Ų14691.1 Ų91.168%0.68246%0.464SS*.  trans-85.6107.6175.4-165.6168.7-172.300109.9E71 D75E71-E73 PolarHBondContact O-N 3.27Å; E73-D75 PolarHBondContact O-N 3.42Å
74I78.6Confident69Low21 Ų2188.1 Ų88.111%0.10845%0.451CS..  trans-87.399.1171.6-57.9-178.7000108.4I54 L72 V76 L79 L95 F106 L110I54-I74 HydrophobicContact CG2-CD1 3.91Å; L72-I74 HydrophobicContact CD2-CG1 4.42Å; L72-I74 PolarHBondContact O-N 3.31Å; I74-V76 PolarHBondContact O-N 2.67Å; I74-L79 HydrophobicContact CG2-CD1 3.75Å; I74-L95 HydrophobicContact CG1-CD1 4.21Å; I74-F106 HydrophobicContact CD1-CE1 4.2Å; I74-F106 HydrophobicContact CD1-CZ 4.01Å; I74-L110 HydrophobicContact CD1-CD2 4.29Å; I74-L110 HydrophobicContact CG2-CD2 4.27Å
75D80.5Confident70.7Confident73 Ų7387.5 Ų87.539%0.3944%0.442SS..  trans-69.393.4174-77.7-65.8000111.7E73 D77 E78 L79E73-D75 PolarHBondContact O-N 3.42Å; D75-D77 PolarHBondContact O-N 2.93Å; D75-E78 HydrophobicContact CB-CB 3.63Å; D75-E78 WeakPolarHBondContact O-CB 3.32Å; D75-E78 PolarHBondContact O-N 3.17Å; D75-E78 VanDerWaalsContact O-N 3.09Å; D75-L79 PolarHBondContact O-N 3.4Å
76V81.8Confident72.8Confident2 Ų281.3 Ų81.31%0.01243%0.425CS..Hα-helixtrans-65.5-27.8178.9175.60000111.8R47 L50 I54 I74 L79 L80 V114 L117R47-V76 VanDerWaalsContact NH1-CB 3.26Å; L50-V76 HydrophobicContact CD2-CB 4.5Å; L50-V76 HydrophobicContact CD2-CG1 3.87Å; L50-V76 HydrophobicContact CD2-CG2 3.78Å; I54-V76 HydrophobicContact CD1-CG2 4.49Å; I74-V76 PolarHBondContact O-N 2.67Å; V76-L79 PolarHBondContact O-N 2.93Å; V76-L80 HydrophobicContact CG1-CD1 4.29Å; V76-L80 HydrophobicContact CG1-CG 4.45Å; V76-L80 WeakPolarHBondContact O-CB 3.47Å; V76-L80 VanDerWaalsContact O-CG 3.3Å; V76-L80 WeakPolarHBondContact O-CG 3.46Å; V76-L80 PolarHBondContact O-N 3.34Å; V76-V114 HydrophobicContact CG1-CG2 4.21Å; V76-L117 HydrophobicContact CG1-CD2 3.93Å
77D80.6Confident74.6Confident55 Ų5576.4 Ų76.429%0.29441%0.405SS..Hα-helixtrans-68.3-35.7173.2-70.8-74.3000112.1R47 D75 L80 D81R47-D77 IonicContact CZ-OD2 2.89Å; R47-D77 IonicContact NH1-OD2 3.24Å; R47-D77 IonicContact NH2-OD2 3.64Å; R47-D77 PolarHBondContact NH2-OD2 2.96Å; D75-D77 PolarHBondContact O-N 2.93Å; D77-L80 PolarHBondContact O-N 3.47Å; D77-D81 PolarHBondContact O-N 3.09Å
78E83.8Confident76.7Confident64 Ų6469 Ų6930%0.29937%0.369SS..Hα-helixtrans-63.5-45171.5-162.7-163.9141.900110.3D75 L80 D81 M82 R91D75-E78 HydrophobicContact CB-CB 3.63Å; D75-E78 WeakPolarHBondContact O-CB 3.32Å; D75-E78 PolarHBondContact O-N 3.17Å; D75-E78 VanDerWaalsContact O-N 3.09Å; E78-L80 VanDerWaalsContact C-N 3.32Å; E78-L80 PolarHBondContact O-N 3.33Å; E78-D81 PolarHBondContact O-N 2.88Å; E78-D81 VanDerWaalsContact O-N 3.16Å; E78-M82 HydrophobicContact CG-CE 4.1Å; E78-M82 WeakPolarHBondContact O-CG 3.26Å; E78-M82 PolarHBondContact O-N 2.9Å; E78-M82 WeakPolarHBondContact OE1-CE 3.08Å; E78-R91 IonicContact OE1-CZ 2.61Å; E78-R91 IonicContact OE1-NE 3.7Å; E78-R91 PolarHBondContact OE1-NE 3.16Å; E78-R91 IonicContact OE1-NH2 2.68Å; E78-R91 PolarHBondContact OE1-NH2 3Å; E78-R91 IonicContact OE2-CZ 3.81Å; E78-R91 IonicContact OE2-NE 2.87Å; E78-R91 PolarHBondContact OE2-NE 2.89Å; E78-R91 IonicContact OE2-NH2 3.47Å; E78-R91 PolarHBondContact OE2-NH2 2.76Å
79L84.3Confident78.7Confident3 Ų362.6 Ų62.62%0.01634%0.342CS..Hα-helixtrans-61.7-39175.9-61.8-179.9000112I74 D75 V76 D81 M82 R88 R91 V92 L110 V114I74-L79 HydrophobicContact CG2-CD1 3.75Å; D75-L79 PolarHBondContact O-N 3.4Å; V76-L79 PolarHBondContact O-N 2.93Å; L79-D81 VanDerWaalsContact C-N 3.33Å; L79-M82 PolarHBondContact O-N 3.38Å; L79-R88 HydrophobicContact CB-CG 4.4Å; L79-R88 HydrophobicContact CD2-CB 4.1Å; L79-R88 HydrophobicContact CD2-CG 4.39Å; L79-R88 WeakPolarHBondContact O-CD 3.32Å; L79-R88 WeakPolarHBondContact O-CG 3.34Å; L79-R88 PolarHBondContact O-NE 3.05Å; L79-R91 HydrophobicContact CD2-CB 4.23Å; L79-R91 HydrophobicContact CD2-CG 4.34Å; L79-V92 HydrophobicContact CD1-CG2 3.99Å; L79-V92 HydrophobicContact CD2-CG2 3.94Å; L79-L110 HydrophobicContact CD1-CD2 4.27Å; L79-V114 HydrophobicContact CB-CG1 4.19Å; L79-V114 HydrophobicContact CD1-CG2 4.26Å
80L82.9Confident80.4Confident31 Ų3162.6 Ų62.616%0.16235%0.348CS..Hα-helixtrans-68.5-30.3176.3-75.4171.3000112.8V76 D77 E78 M82 V114 L117 K119V76-L80 HydrophobicContact CG1-CD1 4.29Å; V76-L80 HydrophobicContact CG1-CG 4.45Å; V76-L80 WeakPolarHBondContact O-CB 3.47Å; V76-L80 VanDerWaalsContact O-CG 3.3Å; V76-L80 WeakPolarHBondContact O-CG 3.46Å; V76-L80 PolarHBondContact O-N 3.34Å; D77-L80 PolarHBondContact O-N 3.47Å; E78-L80 VanDerWaalsContact C-N 3.32Å; E78-L80 PolarHBondContact O-N 3.33Å; L80-M82 VanDerWaalsContact C-N 3.31Å; L80-V114 HydrophobicContact CD2-CG1 3.72Å; L80-V114 WeakPolarHBondContact CD2-O 3.24Å; L80-V114 HydrophobicContact CG-CG1 4.03Å; L80-L117 HydrophobicContact CD1-CB 4.44Å; L80-L117 HydrophobicContact CD2-CB 4.43Å; L80-K119 HydrophobicContact CD1-CB 4.29Å
81D83.5Confident81.8Confident104 Ų10464.4 Ų64.456%0.55635%0.348SS*.Hα-helixtrans-72.7-24.4175-83.2-38000113.1D77 E78 L79 K119D77-D81 PolarHBondContact O-N 3.09Å; E78-D81 PolarHBondContact O-N 2.88Å; E78-D81 VanDerWaalsContact O-N 3.16Å; L79-D81 VanDerWaalsContact C-N 3.33Å; D81-K119 IonicContact OD1-NZ 2.73Å; D81-K119 PolarHBondContact OD1-NZ 2.87Å; D81-K119 IonicContact OD2-NZ 3.52Å; D81-K119 PolarHBondContact OD2-NZ 3.42Å
82M84Confident82.9Confident34 Ų3454.7 Ų54.717%0.16730%0.302CS..  trans-71.2131.5174.8-67.2-178-172.500111E78 L79 L80 D87 R88 R91E78-M82 HydrophobicContact CG-CE 4.1Å; E78-M82 WeakPolarHBondContact O-CG 3.26Å; E78-M82 PolarHBondContact O-N 2.9Å; E78-M82 WeakPolarHBondContact OE1-CE 3.08Å; L79-M82 PolarHBondContact O-N 3.38Å; L80-M82 VanDerWaalsContact C-N 3.31Å; M82-D87 HydrophobicContact CB-CB 4.38Å; M82-D87 HydrophobicContact CG-CB 4.46Å; M82-D87 VanDerWaalsContact SD-C 3.59Å; M82-D87 HydrophobicContact SD-CB 3.95Å; M82-R88 HydrophobicContact CB-CG 3.62Å; M82-R88 HydrophobicContact CG-CG 4.44Å; M82-R88 VanDerWaalsContact O-CZ 3.29Å; M82-R88 PolarHBondContact O-NE 3.05Å; M82-R88 PolarHBondContact O-NH2 2.97Å; M82-R88 HydrophobicContact SD-CG 4.17Å; M82-R91 HydrophobicContact CE-CB 3.85Å; M82-R91 HydrophobicContact CE-CG 3.8Å; M82-R91 HydrophobicContact SD-CB 4.17Å
83P79.4Confident83.8Confident114 Ų11457.1 Ų57.174%0.7431%0.312SS*.SBendtrans-81.4-22.5-175.130.7-34.6000113.7
84T87.2Confident84.3Confident67 Ų6754.7 Ų54.741%0.41131%0.307SS..SBendtrans-117.2144.2-178.3760000112.3G86 D87 R88T84-G86 PolarHBondContact O-N 3.28Å; T84-D87 PolarHBondContact O-N 3.32Å; T84-D87 PolarHBondContact OG1-N 3.01Å; T84-D87 PolarHBondContact OG1-OD2 3.15Å; T84-R88 WeakPolarHBondContact O-CG 3.27Å; T84-R88 PolarHBondContact O-N 3.33Å
85D87.4Confident84.3Confident67 Ų6755.5 Ų55.536%0.35831%0.311SS..Hα-helixtrans-65.3-24.6174.8-66.6-36.9000112.2R88 A89 L111D85-R88 IonicContact OD1-CZ 3.37Å; D85-R88 IonicContact OD1-NH1 2.88Å; D85-R88 PolarHBondContact OD1-NH1 3.44Å; D85-A89 VanDerWaalsContact O-CB 3.3Å; D85-A89 WeakPolarHBondContact O-CB 3.36Å; D85-A89 PolarHBondContact O-N 3.4Å; D85-L111 HydrophobicContact CB-CD1 4.21Å
86G88Confident84.1Confident45 Ų4552.3 Ų52.346%0.46429%0.294SS..Hα-helixtrans-67.2-43.4174.900000113.4T84 A89 S90T84-G86 PolarHBondContact O-N 3.28Å; G86-A89 PolarHBondContact O-N 3.25Å; G86-S90 WeakPolarHBondContact O-CB 3.36Å; G86-S90 PolarHBondContact O-N 2.63Å; G86-S90 PolarHBondContact O-OG 3.07Å
87D88.1Confident83.6Confident82 Ų8257.3 Ų57.344%0.43932%0.324SS..Hα-helixtrans-66-43.4176.3-64.3-42.7000110.5M82 T84 A89 S90 R91M82-D87 HydrophobicContact CB-CB 4.38Å; M82-D87 HydrophobicContact CG-CB 4.46Å; M82-D87 VanDerWaalsContact SD-C 3.59Å; M82-D87 HydrophobicContact SD-CB 3.95Å; T84-D87 PolarHBondContact O-N 3.32Å; T84-D87 PolarHBondContact OG1-N 3.01Å; T84-D87 PolarHBondContact OG1-OD2 3.15Å; D87-A89 PolarHBondContact O-N 2.92Å; D87-S90 WeakPolarHBondContact O-CB 3.47Å; D87-S90 PolarHBondContact O-N 3.24Å; D87-R91 PolarHBondContact O-N 2.93Å
88R88.9Confident82.9Confident30 Ų3059.2 Ų59.211%0.11333%0.334CS..Hα-helixtrans-59.7-47.3175.7-64.8171.9-174.9169.7-6.1111.7L79 M82 T84 D85 S90 R91 V92 L111L79-R88 HydrophobicContact CB-CG 4.4Å; L79-R88 HydrophobicContact CD2-CB 4.1Å; L79-R88 HydrophobicContact CD2-CG 4.39Å; L79-R88 WeakPolarHBondContact O-CD 3.32Å; L79-R88 WeakPolarHBondContact O-CG 3.34Å; L79-R88 PolarHBondContact O-NE 3.05Å; M82-R88 HydrophobicContact CB-CG 3.62Å; M82-R88 HydrophobicContact CG-CG 4.44Å; M82-R88 VanDerWaalsContact O-CZ 3.29Å; M82-R88 PolarHBondContact O-NE 3.05Å; M82-R88 PolarHBondContact O-NH2 2.97Å; M82-R88 HydrophobicContact SD-CG 4.17Å; T84-R88 WeakPolarHBondContact O-CG 3.27Å; T84-R88 PolarHBondContact O-N 3.33Å; D85-R88 IonicContact OD1-CZ 3.37Å; D85-R88 IonicContact OD1-NH1 2.88Å; D85-R88 PolarHBondContact OD1-NH1 3.44Å; R88-S90 VanDerWaalsContact C-N 3.31Å; R88-S90 PolarHBondContact O-N 3.45Å; R88-R91 PolarHBondContact O-N 2.68Å; R88-V92 WeakPolarHBondContact O-CG2 3.23Å; R88-V92 PolarHBondContact O-N 2.84Å; R88-V92 VanDerWaalsContact O-N 3.1Å; R88-L111 HydrophobicContact CB-CD2 3.21Å; R88-L111 HydrophobicContact CG-CD2 4.14Å
89A86.9Confident82.2Confident16 Ų1657 Ų5713%0.13233%0.326CS..Hα-helixtrans-58.2-45.6175.700000111.5D85 G86 D87 R91 V92 K93 V107 L111D85-A89 VanDerWaalsContact O-CB 3.3Å; D85-A89 WeakPolarHBondContact O-CB 3.36Å; D85-A89 PolarHBondContact O-N 3.4Å; G86-A89 PolarHBondContact O-N 3.25Å; D87-A89 PolarHBondContact O-N 2.92Å; A89-R91 VanDerWaalsContact C-N 3.33Å; A89-R91 PolarHBondContact O-N 2.61Å; A89-V92 PolarHBondContact O-N 3.23Å; A89-K93 WeakPolarHBondContact O-CB 3.38Å; A89-K93 VanDerWaalsContact O-CG 3.3Å; A89-K93 WeakPolarHBondContact O-CG 3.17Å; A89-K93 PolarHBondContact O-N 3.26Å; A89-V107 HydrophobicContact CB-CG1 3.57Å; A89-L111 HydrophobicContact CB-CD1 3.99Å
90S88.5Confident81.3Confident69 Ų6967.7 Ų67.748%0.48337%0.367SS..Hα-helixtrans-61.9-43.4-179.4-59.40000111G86 D87 R88 V92 K93 V94G86-S90 WeakPolarHBondContact O-CB 3.36Å; G86-S90 PolarHBondContact O-N 2.63Å; G86-S90 PolarHBondContact O-OG 3.07Å; D87-S90 WeakPolarHBondContact O-CB 3.47Å; D87-S90 PolarHBondContact O-N 3.24Å; R88-S90 VanDerWaalsContact C-N 3.31Å; R88-S90 PolarHBondContact O-N 3.45Å; S90-V92 PolarHBondContact O-N 3.44Å; S90-K93 PolarHBondContact O-N 2.73Å; S90-V94 VanDerWaalsContact O-CG2 3.32Å; S90-V94 WeakPolarHBondContact O-CG2 3.42Å; S90-V94 PolarHBondContact O-N 3.48Å
91R86.1Confident80.8Confident90 Ų9070.2 Ų70.234%0.3438%0.377SS..Hα-helixtrans-60.5-46.4177.5-171.559.8164.7131.78.6112.2E78 L79 M82 D87 R88 A89 V94 L95E78-R91 IonicContact OE1-CZ 2.61Å; E78-R91 IonicContact OE1-NE 3.7Å; E78-R91 PolarHBondContact OE1-NE 3.16Å; E78-R91 IonicContact OE1-NH2 2.68Å; E78-R91 PolarHBondContact OE1-NH2 3Å; E78-R91 IonicContact OE2-CZ 3.81Å; E78-R91 IonicContact OE2-NE 2.87Å; E78-R91 PolarHBondContact OE2-NE 2.89Å; E78-R91 IonicContact OE2-NH2 3.47Å; E78-R91 PolarHBondContact OE2-NH2 2.76Å; L79-R91 HydrophobicContact CD2-CB 4.23Å; L79-R91 HydrophobicContact CD2-CG 4.34Å; M82-R91 HydrophobicContact CE-CB 3.85Å; M82-R91 HydrophobicContact CE-CG 3.8Å; M82-R91 HydrophobicContact SD-CB 4.17Å; D87-R91 PolarHBondContact O-N 2.93Å; R88-R91 PolarHBondContact O-N 2.68Å; A89-R91 VanDerWaalsContact C-N 3.33Å; A89-R91 PolarHBondContact O-N 2.61Å; R91-V94 PolarHBondContact O-N 3.39Å; R91-L95 WeakPolarHBondContact O-CG 3.24Å; R91-L95 PolarHBondContact O-N 3.06Å; R91-L95 VanDerWaalsContact O-N 3.13Å
92V84.1Confident80.5Confident0 Ų070.6 Ų70.60%039%0.386CS..Hα-helixtrans-65.6-39.4177.4178.10000111.1L79 R88 A89 S90 V94 L95 L96 F106 V107 L110L79-V92 HydrophobicContact CD1-CG2 3.99Å; L79-V92 HydrophobicContact CD2-CG2 3.94Å; R88-V92 WeakPolarHBondContact O-CG2 3.23Å; R88-V92 PolarHBondContact O-N 2.84Å; R88-V92 VanDerWaalsContact O-N 3.1Å; A89-V92 PolarHBondContact O-N 3.23Å; S90-V92 PolarHBondContact O-N 3.44Å; V92-V94 VanDerWaalsContact C-N 3.34Å; V92-V94 PolarHBondContact O-N 2.87Å; V92-L95 WeakPolarHBondContact O-CB 3.3Å; V92-L95 PolarHBondContact O-N 3.24Å; V92-L96 HydrophobicContact CG1-CD1 3.68Å; V92-L96 HydrophobicContact CG1-CG 4.37Å; V92-L96 WeakPolarHBondContact O-CG 3.47Å; V92-L96 PolarHBondContact O-N 2.89Å; V92-F106 HydrophobicContact CG1-CD1 4.26Å; V92-F106 HydrophobicContact CG1-CE1 3.83Å; V92-V107 HydrophobicContact CB-CG2 4.34Å; V92-V107 HydrophobicContact CG1-CG2 3.82Å; V92-L110 HydrophobicContact CB-CD2 4.4Å; V92-L110 HydrophobicContact CG1-CD2 3.85Å; V92-L110 HydrophobicContact CG2-CD2 3.61Å
93K82.6Confident80.4Confident87 Ų8770 Ų7038%0.37838%0.384SS..Hα-helixtrans-65.4-35176.5-75.3178.9177.6-175.30112.7A89 S90 L95 L96 V97 D104 V107A89-K93 WeakPolarHBondContact O-CB 3.38Å; A89-K93 VanDerWaalsContact O-CG 3.3Å; A89-K93 WeakPolarHBondContact O-CG 3.17Å; A89-K93 PolarHBondContact O-N 3.26Å; S90-K93 PolarHBondContact O-N 2.73Å; K93-L95 VanDerWaalsContact C-N 3.35Å; K93-L96 CarbonylContact O-C 3.55Å; K93-L96 PolarHBondContact O-N 3.31Å; K93-V97 PolarHBondContact O-N 2.86Å; K93-D104 IonicContact NZ-OD2 2.91Å; K93-D104 PolarHBondContact NZ-OD2 3.46Å; K93-V107 HydrophobicContact CG-CG2 3.93Å
94V82.4Confident80.6Confident95 Ų9569 Ų6958%0.57637%0.372SS*.Hα-helixtrans-66.8-38.3173.9169.40000111.2S90 R91 V92 V97S90-V94 VanDerWaalsContact O-CG2 3.32Å; S90-V94 WeakPolarHBondContact O-CG2 3.42Å; S90-V94 PolarHBondContact O-N 3.48Å; R91-V94 PolarHBondContact O-N 3.39Å; V92-V94 VanDerWaalsContact C-N 3.34Å; V92-V94 PolarHBondContact O-N 2.87Å; V94-V97 WeakPolarHBondContact O-CB 3.48Å
95L78.8Confident80.5Confident38 Ų3869.6 Ų69.620%0.19938%0.384CS..Hα-helixtrans-65.1-41.6174-73.2172.8000110.8L72 I74 R91 V92 K93 V97L72-L95 HydrophobicContact CD1-CB 3.85Å; L72-L95 HydrophobicContact CD1-CD2 4.2Å; L72-L95 WeakPolarHBondContact CD1-O 3.06Å; L72-L95 HydrophobicContact CD2-CB 4.25Å; L72-L95 HydrophobicContact CG-CB 4.18Å; I74-L95 HydrophobicContact CG1-CD1 4.21Å; R91-L95 WeakPolarHBondContact O-CG 3.24Å; R91-L95 PolarHBondContact O-N 3.06Å; R91-L95 VanDerWaalsContact O-N 3.13Å; V92-L95 WeakPolarHBondContact O-CB 3.3Å; V92-L95 PolarHBondContact O-N 3.24Å; K93-L95 VanDerWaalsContact C-N 3.35Å; L95-V97 PolarHBondContact O-N 2.94Å
96L76.7Confident80.4Confident5 Ų566.5 Ų66.53%0.02637%0.367CS..G310 helixtrans-84.923.2-179.4-61.7167.3000114.5L58 Y62 L72 V92 K93 D98 C99 T103 F106 V107L58-L96 HydrophobicContact CD2-CD2 3.61Å; Y62-L96 HydrophobicContact CE2-CD2 4.49Å; L72-L96 HydrophobicContact CD2-CD2 3.69Å; L72-L96 HydrophobicContact CD2-CG 4.4Å; V92-L96 HydrophobicContact CG1-CD1 3.68Å; V92-L96 HydrophobicContact CG1-CG 4.37Å; V92-L96 WeakPolarHBondContact O-CG 3.47Å; V92-L96 PolarHBondContact O-N 2.89Å; K93-L96 CarbonylContact O-C 3.55Å; K93-L96 PolarHBondContact O-N 3.31Å; L96-D98 PolarHBondContact O-N 3.12Å; L96-C99 HydrophobicContact CB-CB 4.38Å; L96-C99 WeakPolarHBondContact O-CB 3.49Å; L96-C99 PolarHBondContact O-N 3.19Å; L96-T103 HydrophobicContact CB-CG2 3.84Å; L96-T103 HydrophobicContact CD1-CG2 3.68Å; L96-T103 HydrophobicContact CG-CG2 4.26Å; L96-F106 HydrophobicContact CD1-CD1 3.54Å; L96-F106 HydrophobicContact CD1-CE1 3.72Å; L96-V107 HydrophobicContact CD1-CG2 4.37Å
97V70.7Confident80.4Confident108 Ų10864.5 Ų64.566%0.65535%0.346SS*.G310 helixtrans-63.7-28.9-172.874.70000113.1K93 V94 L95 C99K93-V97 PolarHBondContact O-N 2.86Å; V94-V97 WeakPolarHBondContact O-CB 3.48Å; L95-V97 PolarHBondContact O-N 2.94Å; V97-C99 VanDerWaalsContact C-N 3.27Å; V97-C99 PolarHBondContact O-N 3.28Å
98D66.8Low80.4Confident94 Ų9463.9 Ų63.950%0.50335%0.345SS..G310 helixtrans-84.30.1177.9-63.1-65.4000113L96 Y100L96-D98 PolarHBondContact O-N 3.12Å; D98-Y100 WeakPolarHBondContact O-CD2 3.39Å
99C68.3Low80.4Confident19 Ų1963.7 Ų63.713%0.12835%0.351CS..  trans-83.9121.2177.8-161.20000111.4Y62 L96 V97 K101 T103Y62-C99 HydrophobicContact CE1-CB 4.32Å; Y62-C99 HydrophobicContact CE2-CB 4.09Å; Y62-C99 WeakPolarHBondContact OH-CB 3.34Å; Y62-C99 PolarHBondContact OH-N 3.14Å; L96-C99 HydrophobicContact CB-CB 4.38Å; L96-C99 WeakPolarHBondContact O-CB 3.49Å; L96-C99 PolarHBondContact O-N 3.19Å; V97-C99 VanDerWaalsContact C-N 3.27Å; V97-C99 PolarHBondContact O-N 3.28Å; C99-K101 VanDerWaalsContact C-N 3.33Å; C99-T103 HydrophobicContact CB-CG2 3.87Å
100Y66.1Low80.4Confident226 Ų22663 Ų6389%0.88634%0.344SS*.  trans-83.3-6.3177.6-63.7-85.1000113.8D98D98-Y100 WeakPolarHBondContact O-CD2 3.39Å
101K72.3Confident80.3Confident84 Ų8460.7 Ų60.737%0.36533%0.326SS..SBendtrans-95157.9178.7-69.8-156.8-161.1172.10111.8D60 L61 D63 C99 T103D60-K101 PolarHBondContact O-NZ 2.91Å; L61-K101 HydrophobicContact CG-CB 4.34Å; L61-K101 WeakPolarHBondContact O-CD 3.44Å; L61-K101 WeakPolarHBondContact O-CE 3.19Å; L61-K101 WeakPolarHBondContact O-CG 3.31Å; L61-K101 PolarHBondContact O-NZ 3.21Å; D63-K101 VanDerWaalsContact CB-NZ 3.3Å; D63-K101 IonicContact OD2-NZ 3.36Å; D63-K101 PolarHBondContact OD2-NZ 2.9Å; C99-K101 VanDerWaalsContact C-N 3.33Å; K101-T103 PolarHBondContact O-N 3.43Å
102P76.9Confident80.4Confident113 Ų11362.7 Ų62.773%0.73434%0.34SS*.  trans-65.3108.2176.226-34.5000111.5D104P102-D104 VanDerWaalsContact C-N 3.34Å
103T82.5Confident80.4Confident22 Ų2268.1 Ų68.114%0.13536%0.363CS..  trans-84.4-5.4179.453.80000113.5L61 L96 C99 K101 A105 F106 V107L61-T103 HydrophobicContact CD2-CG2 3.55Å; L96-T103 HydrophobicContact CB-CG2 3.84Å; L96-T103 HydrophobicContact CD1-CG2 3.68Å; L96-T103 HydrophobicContact CG-CG2 4.26Å; C99-T103 HydrophobicContact CB-CG2 3.87Å; K101-T103 PolarHBondContact O-N 3.43Å; T103-A105 VanDerWaalsContact C-N 3.34Å; T103-A105 PolarHBondContact O-N 3.49Å; T103-F106 WeakPolarHBondContact O-CB 3.19Å; T103-F106 PolarHBondContact O-N 2.75Å; T103-F106 VanDerWaalsContact O-N 3.1Å; T103-V107 VanDerWaalsContact O-CG2 3.26Å; T103-V107 WeakPolarHBondContact O-CG2 3.45Å; T103-V107 PolarHBondContact O-N 3.04Å
104D84.3Confident80.5Confident91 Ų9164 Ų6449%0.48735%0.345SS..Hα-helixtrans-63.1-38-172-158.6-104.6000113.3K93 P102 T108K93-D104 IonicContact NZ-OD2 2.91Å; K93-D104 PolarHBondContact NZ-OD2 3.46Å; P102-D104 VanDerWaalsContact C-N 3.34Å; D104-T108 WeakPolarHBondContact O-CB 3.5Å; D104-T108 PolarHBondContact O-N 3.19Å; D104-T108 PolarHBondContact O-OG1 3.37Å
105A85.3Confident80.5Confident80 Ų8067.4 Ų67.466%0.66135%0.348SS*.Hα-helixtrans-65.4-42.2173.900000111.9T103 A109T103-A105 VanDerWaalsContact C-N 3.34Å; T103-A105 PolarHBondContact O-N 3.49Å; A105-A109 WeakPolarHBondContact O-CB 3.43Å; A105-A109 PolarHBondContact O-N 3.26Å
106F84.8Confident80.4Confident2 Ų267.6 Ų67.61%0.00936%0.359CS..Hα-helixtrans-63.6-48.6175.8170.2-101.2000111.4W53 I54 Q57 L61 I74 V92 L96 T103 T108 A109 L110W53-F106 AromaticContact CH2-CD2 3.88Å; W53-F106 HydrophobicContact CH2-CD2 3.88Å; W53-F106 AromaticContact CH2-CE2 3.98Å; W53-F106 HydrophobicContact CH2-CE2 3.98Å; W53-F106 HydrophobicContact CZ2-CD2 4.44Å; W53-F106 HydrophobicContact CZ3-CD2 4.34Å; W53-F106 AromaticContact CZ3-CE2 3.95Å; W53-F106 HydrophobicContact CZ3-CE2 3.95Å; I54-F106 HydrophobicContact CG1-CZ 4.41Å; I54-F106 HydrophobicContact CG2-CZ 4.3Å; Q57-F106 HydrophobicContact CB-CD2 3.53Å; Q57-F106 HydrophobicContact CB-CE2 3.68Å; Q57-F106 HydrophobicContact CG-CD2 4Å; Q57-F106 HydrophobicContact CG-CE2 4.32Å; L61-F106 HydrophobicContact CD1-CB 4.49Å; I74-F106 HydrophobicContact CD1-CE1 4.2Å; I74-F106 HydrophobicContact CD1-CZ 4.01Å; V92-F106 HydrophobicContact CG1-CD1 4.26Å; V92-F106 HydrophobicContact CG1-CE1 3.83Å; L96-F106 HydrophobicContact CD1-CD1 3.54Å; L96-F106 HydrophobicContact CD1-CE1 3.72Å; T103-F106 WeakPolarHBondContact O-CB 3.19Å; T103-F106 PolarHBondContact O-N 2.75Å; T103-F106 VanDerWaalsContact O-N 3.1Å; F106-T108 VanDerWaalsContact C-N 3.34Å; F106-T108 PolarHBondContact O-N 3.15Å; F106-A109 PolarHBondContact O-N 3.08Å; F106-L110 HydrophobicContact CE1-CD2 3.95Å; F106-L110 HydrophobicContact CZ-CD2 4.05Å; F106-L110 VanDerWaalsContact O-CB 3.26Å; F106-L110 WeakPolarHBondContact O-CB 3.46Å; F106-L110 PolarHBondContact O-N 2.94Å
107V87Confident80.5Confident3 Ų368.1 Ų68.12%0.01836%0.362CS..Hα-helixtrans-58.7-47.4179.2173.60000110.2A89 V92 K93 L96 T103 A109 L110 L111A89-V107 HydrophobicContact CB-CG1 3.57Å; V92-V107 HydrophobicContact CB-CG2 4.34Å; V92-V107 HydrophobicContact CG1-CG2 3.82Å; K93-V107 HydrophobicContact CG-CG2 3.93Å; L96-V107 HydrophobicContact CD1-CG2 4.37Å; T103-V107 VanDerWaalsContact O-CG2 3.26Å; T103-V107 WeakPolarHBondContact O-CG2 3.45Å; T103-V107 PolarHBondContact O-N 3.04Å; V107-A109 PolarHBondContact O-N 2.79Å; V107-L110 PolarHBondContact O-N 3.12Å; V107-L111 HydrophobicContact CG1-CD1 4.15Å; V107-L111 WeakPolarHBondContact O-CG 3.47Å; V107-L111 PolarHBondContact O-N 2.99Å
108T89.3Confident80.7Confident69 Ų6969.7 Ų69.742%0.42336%0.362SS..Hα-helixtrans-61-48.3178.8-56.80000111.5D104 F106 L110 L111 E112D104-T108 WeakPolarHBondContact O-CB 3.5Å; D104-T108 PolarHBondContact O-N 3.19Å; D104-T108 PolarHBondContact O-OG1 3.37Å; F106-T108 VanDerWaalsContact C-N 3.34Å; F106-T108 PolarHBondContact O-N 3.15Å; T108-L110 PolarHBondContact O-N 2.89Å; T108-L111 PolarHBondContact O-N 3.15Å; T108-E112 WeakPolarHBondContact O-CG 3.39Å; T108-E112 PolarHBondContact O-N 3.3Å
109A88.1Confident80.9Confident27 Ų2769.9 Ų69.922%0.22336%0.358CS..Hα-helixtrans-64.4-38.8178.900000112.4W53 A105 F106 V107 E112 K113W53-A109 HydrophobicContact CH2-CB 3.56Å; W53-A109 HydrophobicContact CZ2-CB 3.48Å; W53-A109 VanDerWaalsContact CZ2-CB 3.48Å; A105-A109 WeakPolarHBondContact O-CB 3.43Å; A105-A109 PolarHBondContact O-N 3.26Å; F106-A109 PolarHBondContact O-N 3.08Å; V107-A109 PolarHBondContact O-N 2.79Å; A109-E112 PolarHBondContact O-N 2.85Å; A109-K113 VanDerWaalsContact O-CG 3.27Å; A109-K113 WeakPolarHBondContact O-CG 3.5Å; A109-K113 PolarHBondContact O-N 3.01Å
110L87Confident80.8Confident0 Ų070.6 Ų70.60%036%0.361CS..Hα-helixtrans-61.8-45.9176.4176.660.2000110.4L50 W53 I54 I74 L79 V92 F106 V107 T108 E112 K113 V114L50-L110 HydrophobicContact CD1-CD1 4.05Å; W53-L110 HydrophobicContact CH2-CB 4.07Å; W53-L110 HydrophobicContact CZ3-CB 3.88Å; W53-L110 HydrophobicContact CZ3-CD1 4Å; I54-L110 HydrophobicContact CD1-CD1 3.7Å; I54-L110 HydrophobicContact CG1-CD1 3.89Å; I74-L110 HydrophobicContact CD1-CD2 4.29Å; I74-L110 HydrophobicContact CG2-CD2 4.27Å; L79-L110 HydrophobicContact CD1-CD2 4.27Å; V92-L110 HydrophobicContact CB-CD2 4.4Å; V92-L110 HydrophobicContact CG1-CD2 3.85Å; V92-L110 HydrophobicContact CG2-CD2 3.61Å; F106-L110 HydrophobicContact CE1-CD2 3.95Å; F106-L110 HydrophobicContact CZ-CD2 4.05Å; F106-L110 VanDerWaalsContact O-CB 3.26Å; F106-L110 WeakPolarHBondContact O-CB 3.46Å; F106-L110 PolarHBondContact O-N 2.94Å; V107-L110 PolarHBondContact O-N 3.12Å; T108-L110 PolarHBondContact O-N 2.89Å; L110-E112 PolarHBondContact O-N 3.1Å; L110-K113 PolarHBondContact O-N 2.82Å; L110-V114 HydrophobicContact CD1-CG2 3.98Å; L110-V114 HydrophobicContact CG-CG2 4.3Å; L110-V114 WeakPolarHBondContact O-CB 3.47Å; L110-V114 VanDerWaalsContact O-CG2 3.24Å; L110-V114 WeakPolarHBondContact O-CG2 3.48Å; L110-V114 PolarHBondContact O-N 2.92Å
111L86.6Confident80.3Confident21 Ų2164.5 Ų64.511%0.1135%0.351CS..Hα-helixtrans-61.3-42.5176.8-67.5174.4000112.5D85 R88 A89 V107 T108 K113 V114 R115D85-L111 HydrophobicContact CB-CD1 4.21Å; R88-L111 HydrophobicContact CB-CD2 3.21Å; R88-L111 HydrophobicContact CG-CD2 4.14Å; A89-L111 HydrophobicContact CB-CD1 3.99Å; V107-L111 HydrophobicContact CG1-CD1 4.15Å; V107-L111 WeakPolarHBondContact O-CG 3.47Å; V107-L111 PolarHBondContact O-N 2.99Å; T108-L111 PolarHBondContact O-N 3.15Å; L111-K113 VanDerWaalsContact C-N 3.28Å; L111-K113 PolarHBondContact O-N 3.43Å; L111-V114 PolarHBondContact O-N 2.76Å; L111-R115 WeakPolarHBondContact O-CB 3.39Å; L111-R115 WeakPolarHBondContact O-CG 3.34Å; L111-R115 PolarHBondContact O-N 2.84Å
112E88.1Confident79.2Confident133 Ų13365 Ų6562%0.62136%0.362SS*.Hα-helixtrans-59.7-41.2175.8-73.2-167.6121.900112T108 A109 L110T108-E112 WeakPolarHBondContact O-CG 3.39Å; T108-E112 PolarHBondContact O-N 3.3Å; A109-E112 PolarHBondContact O-N 2.85Å; L110-E112 PolarHBondContact O-N 3.1Å
113K84.4Confident77.7Confident113 Ų11363.7 Ų63.749%0.49135%0.353SS..Hα-helixtrans-68.9-46.9177.2-62.9-77.2-177.7170.60111.5L50 A109 L110 L111 R115 G116 L117L50-K113 HydrophobicContact CD1-CB 3.41Å; L50-K113 VanDerWaalsContact CD1-CB 3.41Å; L50-K113 HydrophobicContact CD1-CG 4.05Å; A109-K113 VanDerWaalsContact O-CG 3.27Å; A109-K113 WeakPolarHBondContact O-CG 3.5Å; A109-K113 PolarHBondContact O-N 3.01Å; L110-K113 PolarHBondContact O-N 2.82Å; L111-K113 VanDerWaalsContact C-N 3.28Å; L111-K113 PolarHBondContact O-N 3.43Å; K113-R115 VanDerWaalsContact C-N 3.27Å; K113-R115 PolarHBondContact O-N 2.94Å; K113-G116 WeakPolarHBondContact O-CA 3.21Å; K113-G116 PolarHBondContact O-N 2.7Å; K113-L117 WeakPolarHBondContact O-CD1 3.14Å; K113-L117 PolarHBondContact O-N 2.79Å
114V83.5Confident75.9Confident0 Ų068.4 Ų68.40%038%0.384CS..Hα-helixtrans-59.3-36.9177.9172.50000111.3L50 V76 L79 L80 L110 L111 G116 L117L50-V114 HydrophobicContact CD2-CG2 4.25Å; V76-V114 HydrophobicContact CG1-CG2 4.21Å; L79-V114 HydrophobicContact CB-CG1 4.19Å; L79-V114 HydrophobicContact CD1-CG2 4.26Å; L80-V114 HydrophobicContact CD2-CG1 3.72Å; L80-V114 WeakPolarHBondContact CD2-O 3.24Å; L80-V114 HydrophobicContact CG-CG1 4.03Å; L110-V114 HydrophobicContact CD1-CG2 3.98Å; L110-V114 HydrophobicContact CG-CG2 4.3Å; L110-V114 WeakPolarHBondContact O-CB 3.47Å; L110-V114 VanDerWaalsContact O-CG2 3.24Å; L110-V114 WeakPolarHBondContact O-CG2 3.48Å; L110-V114 PolarHBondContact O-N 2.92Å; L111-V114 PolarHBondContact O-N 2.76Å; V114-G116 PolarHBondContact O-N 2.83Å; V114-L117 WeakPolarHBondContact O-CB 3.44Å; V114-L117 PolarHBondContact O-N 2.73Å
115R82.4Confident73.9Confident168 Ų16873.3 Ų73.363%0.63440%0.401SS*.Hα-helixtrans-60.2-28.5172.8-78-177.968.7-115.8-2113.6L111 K113 L117L111-R115 WeakPolarHBondContact O-CB 3.39Å; L111-R115 WeakPolarHBondContact O-CG 3.34Å; L111-R115 PolarHBondContact O-N 2.84Å; K113-R115 VanDerWaalsContact C-N 3.27Å; K113-R115 PolarHBondContact O-N 2.94Å; R115-L117 VanDerWaalsContact C-N 3.35Å
116G77.9Confident72.1Confident42 Ų4278.8 Ų78.843%0.43341%0.41SS..THydrogen-bonded Turntrans-85.4-7.5176.100000114.4K46 K113 V114K46-G116 PolarHBondContact NZ-O 3.07Å; K46-G116 VanDerWaalsContact NZ-O 3.15Å; K113-G116 WeakPolarHBondContact O-CA 3.21Å; K113-G116 PolarHBondContact O-N 2.7Å; V114-G116 PolarHBondContact O-N 2.83Å
117L78.8Confident70.4Confident15 Ų1585.9 Ų85.98%0.07945%0.448CS..PPolyproline II helixtrans-89.9143.5176.8-8975.9000111.2E43 K46 R47 L50 V76 L80 K113 V114 R115E43-L117 WeakPolarHBondContact OE1-CA 3.49Å; K46-L117 HydrophobicContact CB-CD1 4.47Å; R47-L117 HydrophobicContact CB-CD2 4.45Å; L50-L117 HydrophobicContact CD2-CD1 4.09Å; L50-L117 HydrophobicContact CD2-CD2 3.54Å; L50-L117 HydrophobicContact CD2-CG 4.48Å; V76-L117 HydrophobicContact CG1-CD2 3.93Å; L80-L117 HydrophobicContact CD1-CB 4.44Å; L80-L117 HydrophobicContact CD2-CB 4.43Å; K113-L117 WeakPolarHBondContact O-CD1 3.14Å; K113-L117 PolarHBondContact O-N 2.79Å; V114-L117 WeakPolarHBondContact O-CB 3.44Å; V114-L117 PolarHBondContact O-N 2.73Å; R115-L117 VanDerWaalsContact C-N 3.35Å
118Q74.2Confident68.7Low142 Ų14294 Ų9466%0.66449%0.485SS*.PPolyproline II helixtrans-103.7134.8172.4-72.8-86.5-65.300108.5E43 L120E43-Q118 HydrophobicContact CG-CB 4.26Å; E43-Q118 PolarHBondContact OE1-N 2.81Å; Q118-L120 PolarHBondContact O-N 3.09Å; Q118-L120 VanDerWaalsContact O-N 3.12Å
119K70.4Confident66.5Low97 Ų97101 Ų10142%0.42251%0.51SS..PPolyproline II helixtrans-57.5121.8173.9-165.2172.9-169.2178.30108.7L80 D81 S121L80-K119 HydrophobicContact CD1-CB 4.29Å; D81-K119 IonicContact OD1-NZ 2.73Å; D81-K119 PolarHBondContact OD1-NZ 2.87Å; D81-K119 IonicContact OD2-NZ 3.52Å; D81-K119 PolarHBondContact OD2-NZ 3.42Å; K119-S121 PolarHBondContact O-N 3.04Å
120L66.3Low64.2Low35 Ų35104.6 Ų104.618%0.18353%0.534CS..  trans-69.586.2175.5-70.6178000107.6Y39 E43 L44 Q118 T122Y39-L120 HydrophobicContact CD1-CB 3.69Å; Y39-L120 HydrophobicContact CD1-CD1 3.65Å; Y39-L120 HydrophobicContact CD1-CD2 3.9Å; Y39-L120 HydrophobicContact CD1-CG 3.93Å; Y39-L120 HydrophobicContact CE1-CB 3.79Å; Y39-L120 HydrophobicContact CE1-CD1 3.96Å; Y39-L120 HydrophobicContact CE1-CG 4.37Å; Y39-L120 HydrophobicContact CG-CD1 4.38Å; E43-L120 HydrophobicContact CB-CD2 3.98Å; E43-L120 HydrophobicContact CG-CD2 3.72Å; L44-L120 HydrophobicContact CD2-CD1 4.03Å; Q118-L120 PolarHBondContact O-N 3.09Å; Q118-L120 VanDerWaalsContact O-N 3.12Å; L120-T122 PolarHBondContact O-N 3.24Å
121S56.6Low62.9Low97 Ų97109.8 Ų109.868%0.67857%0.567SS**  trans-57.5115.4-176-106.20000110.3V37 K119V37-S121 WeakPolarHBondContact CG1-O 3.31Å; K119-S121 PolarHBondContact O-N 3.04Å
122T49Very low62.1Low96 Ų96118.2 Ų118.259%0.58962%0.623SS**PPolyproline II helixtrans-64.4130.8156.843.60000107V37 L120V37-T122 HydrophobicContact CG2-CG2 3.88Å; L120-T122 PolarHBondContact O-N 3.24Å
123P45Very low60.8Low85 Ų85117.5 Ų117.555%0.55262%0.623SS**PPolyproline II helixtrans-58136.6175.124.2-31.5000108.2K125P123-K125 PolarHBondContact O-N 3.37Å; P123-K125 VanDerWaalsContact O-N 3.1Å
124P44.7Very low59.6Low120 Ų120117.7 Ų117.778%0.77963%0.63SS**PPolyproline II helixtrans-58.1124179.423.7-32.4000107.9K126P124-K126 VanDerWaalsContact C-N 3.25Å; P124-K126 PolarHBondContact O-N 2.77Å
125K41.9Very low58.2Low194 Ų194124.3 Ų124.384%0.84367%0.665SS**  trans-61.996.7164.5-74.3-148.9178.9-177.90107P123 N127P123-K125 PolarHBondContact O-N 3.37Å; P123-K125 VanDerWaalsContact O-N 3.1Å; K125-N127 PolarHBondContact O-N 2.94Å; K125-N127 VanDerWaalsContact O-N 3.08Å
126K47.9Very low56.8Low195 Ų195121.7 Ų121.785%0.84867%0.667SS**  trans-59.6109157.1-99.3-176.7174.4179.80106P124P124-K126 VanDerWaalsContact C-N 3.25Å; P124-K126 PolarHBondContact O-N 2.77Å
127N50Low55.5Low152 Ų152126.7 Ų126.781%0.81368%0.682SS**  trans-178.7119.7150.7-861.5000102.1K125K125-N127 PolarHBondContact O-N 2.94Å; K125-N127 VanDerWaalsContact O-N 3.08Å
128E50.2Low53.9Low172 Ų172134.1 Ų134.180%0.80472%0.722SS**  -177.5137.552.3174.3163.478.500106.4
129K43.8Very low52.5Low217 Ų217133.6 Ų133.694%0.94373%0.726SS**  trans-133.1110.7153.8-111.4-178.5-177.8179.50108.8
130S40.1Very low51.1Low103 Ų103136.4 Ų136.472%0.7275%0.75SS**  trans-40.4166.6176-115.40000117.6
131P58.1Low49.9Very low108 Ų108144.8 Ų144.870%0.70180%0.797SS**  trans-86.7166.4-165.138.6-34.6000112.6
132P70.9Confident49.2Very low199 Ų199149.2 Ų149.2100%1.29281%0.808SS**  trans-81.10154.434.5-31.5000112.3

Retrieved 132 of 132 residues in 26.2 ms (Link to these results)