A0A077Z4Z8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z4Z8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 170 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
1M35.3Very low42.8Very low259 Ų259164.7 Ų164.7100%1.27684%0.842SS**  0118.10-76.1176.9175.500108.7
2G38Very low43.2Very low68 Ų68165.8 Ų165.870%0.70184%0.841SS**  trans-152105.616900000107.9K4G2-K4 PolarHBondContact O-N 2.68Å; G2-K4 VanDerWaalsContact O-N 3.16Å
3R42.9Very low43.3Very low259 Ų259164.4 Ų164.498%0.97783%0.826SS**  trans-61.2109.3179.3-73.6175.9172.9170.5-3.9108.6A5R3-A5 PolarHBondContact O-N 2.89Å
4K46.9Very low43.7Very low199 Ų199160.6 Ų160.687%0.86582%0.815SS**  trans-82.9113.1172-70.7-171.6177.9-1770108.2G2G2-K4 PolarHBondContact O-N 2.68Å; G2-K4 VanDerWaalsContact O-N 3.16Å
5A43.5Very low44.2Very low88 Ų88160.8 Ų160.873%0.72781%0.812SS**  trans-63.1137.9175.300000110.2R3 T7R3-A5 PolarHBondContact O-N 2.89Å; A5-T7 PolarHBondContact O-N 3.47Å; A5-T7 VanDerWaalsContact O-N 3.14Å
6Y41.1Very low44.3Very low231 Ų231160.3 Ų160.391%0.90681%0.812SS**  trans-67.1104.8177.4-55.3-90.5000109.3L8Y6-L8 PolarHBondContact O-N 2.9Å
7T41.2Very low44.4Very low114 Ų114157.9 Ų157.970%0.69980%0.802SS**  trans-77.9108.8167.2-50.30000107.3A5 L9A5-T7 PolarHBondContact O-N 3.47Å; A5-T7 VanDerWaalsContact O-N 3.14Å; T7-L9 VanDerWaalsContact C-N 3.29Å; T7-L9 PolarHBondContact O-N 2.99Å
8L44Very low44.8Very low173 Ų173157.2 Ų157.291%0.90680%0.799SS**  trans-56.294.3162.9-87.3142000107.8Y6 K10Y6-L8 PolarHBondContact O-N 2.9Å; L8-K10 PolarHBondContact O-N 3.2Å
9L42.5Very low44.9Very low138 Ų138154.3 Ų154.372%0.72379%0.792SS**  trans-70.7120.8178.8-77.9159.1000108.6T7T7-L9 VanDerWaalsContact C-N 3.29Å; T7-L9 PolarHBondContact O-N 2.99Å
10K41.5Very low45.2Very low168 Ų168152 Ų15273%0.7379%0.788SS**  trans-56.7147.1173.6-86.2175.8171.7178.80110.6L8 E12 F13L8-K10 PolarHBondContact O-N 3.2Å; K10-E12 PolarHBondContact O-N 2.91Å; K10-F13 PolarHBondContact O-N 2.67Å
11P53.8Low45.4Very low115 Ų115150.7 Ų150.775%0.74778%0.781SS**THydrogen-bonded Turntrans-70.611.8-171.529.6-36.8000115.7
12E47.3Very low46.2Very low178 Ų178144.8 Ų144.883%0.83275%0.754SS**THydrogen-bonded Turntrans-90.7-6.2176.9-65.4-176.8-166.200113K10 V14K10-E12 PolarHBondContact O-N 2.91Å; E12-V14 VanDerWaalsContact C-N 3.32Å; E12-V14 PolarHBondContact O-N 2.92Å
13F44.8Very low46.8Very low147 Ų147148.4 Ų148.465%0.64576%0.758SS**  trans-96.160.5167.7-77.8-89.3000110.3K10K10-F13 PolarHBondContact O-N 2.67Å
14V48.9Very low47.4Very low112 Ų112143.5 Ų143.568%0.67975%0.746SS**  trans-99.1121164178.30000106.2E12E12-V14 VanDerWaalsContact C-N 3.32Å; E12-V14 PolarHBondContact O-N 2.92Å
15E51.4Low47.6Very low163 Ų163139 Ų13976%0.76274%0.737SS**SBendtrans110.5-15.9155.2-142.9156.7-147.700119.8
16N46.1Very low48.1Very low153 Ų153146.5 Ų146.582%0.81875%0.747SS**SBendtrans-122.9-3.6-179.4-76.6-41.2000118.4
17D45.9Very low48.9Very low119 Ų119144.7 Ų144.764%0.63674%0.738SS**  trans-128.431.8-176.4-76.3-37.8000113.8P19D17-P19 WeakPolarHBondContact O-CD 3.41Å
18L51.5Low50.2Low145 Ų145141.7 Ų141.776%0.75972%0.722SS**  trans-76.2109.7161.3-80.1132.3000107.3
19P47Very low51.4Low102 Ų102144 Ų14466%0.66272%0.718SS**  trans-57.3138.6167.625.7-32.3000107.3D17 I21D17-P19 WeakPolarHBondContact O-CD 3.41Å; P19-I21 PolarHBondContact O-N 3.28Å
20P50.8Low52.9Low108 Ų108144.4 Ų144.470%0.70172%0.718SS**  trans-52.4119.3176.622.5-31.9000107.1D22P20-D22 PolarHBondContact O-N 3.24Å
21I49.1Very low54.6Low126 Ų126140.9 Ų140.965%0.64671%0.705SS**  trans-65102.5165.6-61.7171.9000102.6P19 D23P19-I21 PolarHBondContact O-N 3.28Å; I21-D23 WeakPolarHBondContact CG2-OD1 3.43Å; I21-D23 PolarHBondContact O-N 3.33Å
22D52.1Low55.9Low134 Ų134138.5 Ų138.572%0.71769%0.69SS**  trans-61.782.9163-72.5-32.6000105.8P20 E24P20-D22 PolarHBondContact O-N 3.24Å; D22-E24 PolarHBondContact O-N 2.87Å
23D50.8Low57.6Low145 Ų145135.1 Ų135.178%0.77568%0.677SS**  trans-69.548.3158-78.5-30.4000107.9I21 P25I21-D23 WeakPolarHBondContact CG2-OD1 3.43Å; I21-D23 PolarHBondContact O-N 3.33Å; D23-P25 WeakPolarHBondContact O-CD 3.44Å
24E54.1Low59.6Low156 Ų156131.2 Ų131.273%0.72967%0.667SS**  trans-92.2102.4166.9-153100.4-146.100104.4D22 R26D22-E24 PolarHBondContact O-N 2.87Å; E24-R26 PolarHBondContact O-N 3.34Å
25P52.7Low61.4Low105 Ų105132.7 Ų132.768%0.68267%0.665SS**  trans-62.695.9171.126.7-33000106.4D23 R27D23-P25 WeakPolarHBondContact O-CD 3.44Å; P25-R27 PolarHBondContact O-N 2.69Å
26R54.2Low63.2Low245 Ų245132.4 Ų132.493%0.92566%0.657SS**  trans-68.633.3165.5-155.5-176.1-174.4-174.23.1110.2E24 S28E24-R26 PolarHBondContact O-N 3.34Å; R26-S28 PolarHBondContact O-N 3.49Å
27R57.7Low65.3Low192 Ų192128.2 Ų128.273%0.72564%0.639SS**  trans-61.5121.2154.2-97-167159.2163.93.1105.5P25 R29 E31P25-R27 PolarHBondContact O-N 2.69Å; R27-R29 PolarHBondContact O-N 3.15Å; R27-E31 WeakPolarHBondContact CG-OE2 3.35Å; R27-E31 IonicContact NE-OE2 3.29Å; R27-E31 PolarHBondContact NE-OE2 2.92Å
28S68Low67.4Low51 Ų51127.7 Ų127.736%0.35764%0.635SS.*  trans-49.6133.8-178.465.40000108.9R26 M30 E31R26-S28 PolarHBondContact O-N 3.49Å; S28-M30 PolarHBondContact O-N 3.46Å; S28-E31 PolarHBondContact O-N 3.17Å; S28-E31 WeakPolarHBondContact OG-CG 3.33Å; S28-E31 PolarHBondContact OG-N 2.9Å; S28-E31 PolarHBondContact OG-OE1 2.85Å
29R70.1Confident69.3Low222 Ų222122.9 Ų122.984%0.83862%0.616SS**Hα-helixtrans-48.2-27.2173.4-73.3-177.6176.2178.2-1.5111.9R27 S32 I33R27-R29 PolarHBondContact O-N 3.15Å; R29-S32 PolarHBondContact O-N 3.33Å; R29-I33 WeakPolarHBondContact O-CD1 3.34Å; R29-I33 VanDerWaalsContact O-CG1 3.26Å; R29-I33 WeakPolarHBondContact O-CG1 3.31Å; R29-I33 PolarHBondContact O-N 3.09Å; R29-I33 VanDerWaalsContact O-N 3.11Å
30M73.1Confident71.4Confident146 Ų146123.1 Ų123.172%0.71961%0.611SS**Hα-helixtrans-61.6-45175.4-151.9160.9-175.400113.1S28 S32 I33 C34S28-M30 PolarHBondContact O-N 3.46Å; M30-S32 PolarHBondContact O-N 3.4Å; M30-I33 PolarHBondContact O-N 2.84Å; M30-C34 WeakPolarHBondContact O-CB 3.47Å; M30-C34 PolarHBondContact O-N 2.77Å; M30-C34 PolarHBondContact O-SG 3.37Å
31E77.3Confident73.4Confident95 Ų95123.3 Ų123.344%0.44461%0.605SS.*Hα-helixtrans-63.6-41.4176.5-78.7162.9-121.800112.5R27 S28 C34 F35R27-E31 WeakPolarHBondContact CG-OE2 3.35Å; R27-E31 IonicContact NE-OE2 3.29Å; R27-E31 PolarHBondContact NE-OE2 2.92Å; S28-E31 PolarHBondContact O-N 3.17Å; S28-E31 WeakPolarHBondContact OG-CG 3.33Å; S28-E31 PolarHBondContact OG-N 2.9Å; S28-E31 PolarHBondContact OG-OE1 2.85Å; E31-C34 PolarHBondContact O-N 3.41Å; E31-F35 WeakPolarHBondContact O-CB 3.33Å; E31-F35 PolarHBondContact O-N 3.43Å
32S80.9Confident75.5Confident64 Ų64120.8 Ų120.845%0.44860%0.596SS.*Hα-helixtrans-63.3-46.3178.8-177.80000111.3R29 M30 C34 F35 W36R29-S32 PolarHBondContact O-N 3.33Å; M30-S32 PolarHBondContact O-N 3.4Å; S32-C34 PolarHBondContact O-N 2.82Å; S32-F35 PolarHBondContact O-N 3.49Å; S32-W36 VanDerWaalsContact O-CD1 3.22Å; S32-W36 PolarHBondContact O-N 3Å; S32-W36 VanDerWaalsContact O-N 3.09Å
33I84.1Confident77.3Confident107 Ų107116 Ų11655%0.54958%0.577SS.*Hα-helixtrans-61.1-45.6176-65.6164.7000110.3R29 M30 F35 W36 C37R29-I33 WeakPolarHBondContact O-CD1 3.34Å; R29-I33 VanDerWaalsContact O-CG1 3.26Å; R29-I33 WeakPolarHBondContact O-CG1 3.31Å; R29-I33 PolarHBondContact O-N 3.09Å; R29-I33 VanDerWaalsContact O-N 3.11Å; M30-I33 PolarHBondContact O-N 2.84Å; I33-F35 VanDerWaalsContact C-N 3.34Å; I33-F35 PolarHBondContact O-N 2.96Å; I33-W36 PolarHBondContact O-N 2.89Å; I33-C37 WeakPolarHBondContact O-CB 3.43Å; I33-C37 PolarHBondContact O-N 3.22Å; I33-C37 PolarHBondContact O-SG 3.11Å
34C85.8Confident79.3Confident66 Ų66113.1 Ų113.145%0.44657%0.565SS.*Hα-helixtrans-60.1-41.8177.2-72.80000112.4M30 E31 S32 C37 I38M30-C34 WeakPolarHBondContact O-CB 3.47Å; M30-C34 PolarHBondContact O-N 2.77Å; M30-C34 PolarHBondContact O-SG 3.37Å; E31-C34 PolarHBondContact O-N 3.41Å; S32-C34 PolarHBondContact O-N 2.82Å; C34-C37 PolarHBondContact O-N 3.23Å; C34-I38 VanDerWaalsContact O-CG1 3.26Å; C34-I38 WeakPolarHBondContact O-CG1 3.43Å; C34-I38 PolarHBondContact O-N 3.13Å
35F86.5Confident81.2Confident142 Ų142111.1 Ų111.162%0.62356%0.558SS**Hα-helixtrans-61-47.9177.6-178.7-96.1000111.7E31 S32 I33 C37 I38 A39E31-F35 WeakPolarHBondContact O-CB 3.33Å; E31-F35 PolarHBondContact O-N 3.43Å; S32-F35 PolarHBondContact O-N 3.49Å; I33-F35 VanDerWaalsContact C-N 3.34Å; I33-F35 PolarHBondContact O-N 2.96Å; F35-C37 PolarHBondContact O-N 2.8Å; F35-I38 PolarHBondContact O-N 2.75Å; F35-A39 WeakPolarHBondContact O-CB 3.46Å; F35-A39 PolarHBondContact O-N 3.35Å
36W88.9Confident83.1Confident158 Ų158110.6 Ų110.660%0.59855%0.553SS**Hα-helixtrans-63.9-39.9176.3-77.4108.9000112.5S32 I33 A39 I40S32-W36 VanDerWaalsContact O-CD1 3.22Å; S32-W36 PolarHBondContact O-N 3Å; S32-W36 VanDerWaalsContact O-N 3.09Å; I33-W36 PolarHBondContact O-N 2.89Å; W36-A39 PolarHBondContact O-N 2.85Å; W36-I40 WeakPolarHBondContact O-CB 3.14Å; W36-I40 WeakPolarHBondContact O-CG1 3.48Å; W36-I40 PolarHBondContact O-N 3.06Å
37C90.5Very high84.9Confident65 Ų65104.5 Ų104.544%0.43954%0.537SS..Hα-helixtrans-61.1-44.9174.9-71.60000111.8I33 C34 F35 L41I33-C37 WeakPolarHBondContact O-CB 3.43Å; I33-C37 PolarHBondContact O-N 3.22Å; I33-C37 PolarHBondContact O-SG 3.11Å; C34-C37 PolarHBondContact O-N 3.23Å; F35-C37 PolarHBondContact O-N 2.8Å; C37-L41 WeakPolarHBondContact O-CB 3.28Å; C37-L41 VanDerWaalsContact O-CG 3.24Å; C37-L41 WeakPolarHBondContact O-CG 3.25Å; C37-L41 PolarHBondContact O-N 2.84Å
38I90.5Very high86.4Confident108 Ų108101.7 Ų101.755%0.55453%0.531SS*.Hα-helixtrans-65.2-43.7177.5-67164.6000110.5C34 F35 I40 L41 T42C34-I38 VanDerWaalsContact O-CG1 3.26Å; C34-I38 WeakPolarHBondContact O-CG1 3.43Å; C34-I38 PolarHBondContact O-N 3.13Å; F35-I38 PolarHBondContact O-N 2.75Å; I38-I40 PolarHBondContact O-N 3.19Å; I38-L41 PolarHBondContact O-N 3.26Å; I38-T42 VanDerWaalsContact O-CB 3.31Å; I38-T42 WeakPolarHBondContact O-CB 3.3Å; I38-T42 PolarHBondContact O-N 2.96Å; I38-T42 PolarHBondContact O-OG1 2.85Å
39A91.1Very high87.3Confident43 Ų43101.4 Ų101.436%0.35553%0.531SS..Hα-helixtrans-61.6-45.2178.600000111.8F35 W36 G43F35-A39 WeakPolarHBondContact O-CB 3.46Å; F35-A39 PolarHBondContact O-N 3.35Å; W36-A39 PolarHBondContact O-N 2.85Å; A39-G43 PolarHBondContact O-N 3.09Å
40I91.8Very high88.2Confident108 Ų10892.6 Ų92.655%0.55451%0.51SS*.Hα-helixtrans-65-47.3177.5-68166.6000110.7W36 I38 T42 G43 V44W36-I40 WeakPolarHBondContact O-CB 3.14Å; W36-I40 WeakPolarHBondContact O-CG1 3.48Å; W36-I40 PolarHBondContact O-N 3.06Å; I38-I40 PolarHBondContact O-N 3.19Å; I40-T42 VanDerWaalsContact C-N 3.35Å; I40-T42 PolarHBondContact O-N 2.82Å; I40-G43 PolarHBondContact O-N 3.23Å; I40-V44 HydrophobicContact CG2-CG2 4.44Å; I40-V44 WeakPolarHBondContact O-CG2 3.46Å; I40-V44 PolarHBondContact O-N 2.91Å
41L92.4Very high88.7Confident111 Ų11189.1 Ų89.158%0.58150%0.496SS*.Hα-helixtrans-61.2-43.9178.8-75.5170.4000111.8C37 I38 G43 V44 I45C37-L41 WeakPolarHBondContact O-CB 3.28Å; C37-L41 VanDerWaalsContact O-CG 3.24Å; C37-L41 WeakPolarHBondContact O-CG 3.25Å; C37-L41 PolarHBondContact O-N 2.84Å; I38-L41 PolarHBondContact O-N 3.26Å; L41-G43 VanDerWaalsContact C-N 3.34Å; L41-G43 PolarHBondContact O-N 3.19Å; L41-V44 PolarHBondContact O-N 3.39Å; L41-I45 WeakPolarHBondContact O-CD1 3.35Å; L41-I45 VanDerWaalsContact O-CG1 3.24Å; L41-I45 WeakPolarHBondContact O-CG1 3.27Å; L41-I45 PolarHBondContact O-N 3.31Å
42T92.4Very high89Confident74 Ų7488.5 Ų88.545%0.45450%0.495SS..Hα-helixtrans-63.8-42.5177.2-49.80000110.7I38 I40 V44 I45 V46I38-T42 VanDerWaalsContact O-CB 3.31Å; I38-T42 WeakPolarHBondContact O-CB 3.3Å; I38-T42 PolarHBondContact O-N 2.96Å; I38-T42 PolarHBondContact O-OG1 2.85Å; I40-T42 VanDerWaalsContact C-N 3.35Å; I40-T42 PolarHBondContact O-N 2.82Å; T42-V44 PolarHBondContact O-N 2.83Å; T42-I45 PolarHBondContact O-N 3.47Å; T42-V46 HydrophobicContact CG2-CG2 4.48Å; T42-V46 VanDerWaalsContact O-CG2 3.28Å; T42-V46 WeakPolarHBondContact O-CG2 2.9Å; T42-V46 PolarHBondContact O-N 3.45Å
43G91.2Very high89.2Confident32 Ų3290 Ų9033%0.3350%0.498SS..Hα-helixtrans-59.4-46.3175.100000112.5A39 I40 L41 V46 I47A39-G43 PolarHBondContact O-N 3.09Å; I40-G43 PolarHBondContact O-N 3.23Å; L41-G43 VanDerWaalsContact C-N 3.34Å; L41-G43 PolarHBondContact O-N 3.19Å; G43-V46 PolarHBondContact O-N 3.24Å; G43-I47 VanDerWaalsContact O-CG1 3.24Å; G43-I47 WeakPolarHBondContact O-CG1 3.4Å; G43-I47 PolarHBondContact O-N 3.13Å
44V92.6Very high89.1Confident86 Ų8691.1 Ų91.152%0.52150%0.504SS..Hα-helixtrans-63.7-42.5177.1174.90000111.2I40 L41 T42 V46 I47 F48I40-V44 HydrophobicContact CG2-CG2 4.44Å; I40-V44 WeakPolarHBondContact O-CG2 3.46Å; I40-V44 PolarHBondContact O-N 2.91Å; L41-V44 PolarHBondContact O-N 3.39Å; T42-V44 PolarHBondContact O-N 2.83Å; V44-V46 PolarHBondContact O-N 3.29Å; V44-I47 PolarHBondContact O-N 3.43Å; V44-F48 VanDerWaalsContact O-CB 3.31Å; V44-F48 WeakPolarHBondContact O-CB 3.44Å; V44-F48 PolarHBondContact O-N 3.47Å
45I93Very high88.9Confident113 Ų11394 Ų9458%0.57952%0.515SS*.Hα-helixtrans-63-42.9177.7-68.9164.9000110.9L41 T42 F48 A49L41-I45 WeakPolarHBondContact O-CD1 3.35Å; L41-I45 VanDerWaalsContact O-CG1 3.24Å; L41-I45 WeakPolarHBondContact O-CG1 3.27Å; L41-I45 PolarHBondContact O-N 3.31Å; T42-I45 PolarHBondContact O-N 3.47Å; I45-F48 PolarHBondContact O-N 3.49Å; I45-A49 VanDerWaalsContact O-CB 3.26Å; I45-A49 WeakPolarHBondContact O-CB 3.26Å; I45-A49 PolarHBondContact O-N 3.44Å
46V93.3Very high88.6Confident95 Ų9593.6 Ų93.658%0.57652%0.515SS*.Hα-helixtrans-65-42.6177.3170.90000111.1T42 G43 V44 A49 G50T42-V46 HydrophobicContact CG2-CG2 4.48Å; T42-V46 VanDerWaalsContact O-CG2 3.28Å; T42-V46 WeakPolarHBondContact O-CG2 2.9Å; T42-V46 PolarHBondContact O-N 3.45Å; G43-V46 PolarHBondContact O-N 3.24Å; V44-V46 PolarHBondContact O-N 3.29Å; V46-A49 PolarHBondContact O-N 3.04Å; V46-G50 PolarHBondContact O-N 2.87Å
47I90.8Very high88.1Confident116 Ų11691.1 Ų91.160%0.59551%0.506SS*.Hα-helixtrans-62.3-46.1175.5-68.6165.7000110.1G43 V44 G50 V51G43-I47 VanDerWaalsContact O-CG1 3.24Å; G43-I47 WeakPolarHBondContact O-CG1 3.4Å; G43-I47 PolarHBondContact O-N 3.13Å; V44-I47 PolarHBondContact O-N 3.43Å; I47-G50 PolarHBondContact O-N 3.49Å; I47-V51 WeakPolarHBondContact O-CG2 3.08Å; I47-V51 PolarHBondContact O-N 2.87Å
48F90.2Very high87Confident134 Ų13488.6 Ų88.659%0.58849%0.491SS*.Hα-helixtrans-65.7-41.4-179.3-155.3-103.4000111.8V44 I45 V51 I52V44-F48 VanDerWaalsContact O-CB 3.31Å; V44-F48 WeakPolarHBondContact O-CB 3.44Å; V44-F48 PolarHBondContact O-N 3.47Å; I45-F48 PolarHBondContact O-N 3.49Å; F48-V51 PolarHBondContact O-N 3.3Å; F48-I52 HydrophobicContact CD1-CD1 3.52Å; F48-I52 HydrophobicContact CD1-CG1 4.21Å; F48-I52 HydrophobicContact CE1-CD1 3.59Å; F48-I52 HydrophobicContact CE1-CG1 4.22Å; F48-I52 WeakPolarHBondContact O-CG1 3.36Å; F48-I52 PolarHBondContact O-N 2.84Å
49A87.4Confident86.2Confident44 Ų4490 Ų9036%0.36450%0.5SS..Hα-helixtrans-63.1-41.5173.200000111.7I45 V46 V51 I52 L53I45-A49 VanDerWaalsContact O-CB 3.26Å; I45-A49 WeakPolarHBondContact O-CB 3.26Å; I45-A49 PolarHBondContact O-N 3.44Å; V46-A49 PolarHBondContact O-N 3.04Å; A49-V51 VanDerWaalsContact C-N 3.35Å; A49-V51 PolarHBondContact O-N 3.24Å; A49-I52 PolarHBondContact O-N 3.4Å; A49-L53 WeakPolarHBondContact O-CB 3.33Å; A49-L53 VanDerWaalsContact O-CG 3.27Å; A49-L53 WeakPolarHBondContact O-CG 3.24Å; A49-L53 PolarHBondContact O-N 2.87Å
50G87.7Confident85.3Confident38 Ų3894.2 Ų94.239%0.39251%0.512SS..Hα-helixtrans-60.5-42.4173.800000112.4V46 I47 L54V46-G50 PolarHBondContact O-N 2.87Å; I47-G50 PolarHBondContact O-N 3.49Å; G50-L54 VanDerWaalsContact O-CB 3.26Å; G50-L54 WeakPolarHBondContact O-CB 3.47Å; G50-L54 PolarHBondContact O-N 2.99Å
51V84.4Confident84Confident72 Ų7292.8 Ų92.844%0.43651%0.508SS..Hα-helixtrans-67.2-44.2175.9172.30000111.6I47 F48 A49 L54 L55I47-V51 WeakPolarHBondContact O-CG2 3.08Å; I47-V51 PolarHBondContact O-N 2.87Å; F48-V51 PolarHBondContact O-N 3.3Å; A49-V51 VanDerWaalsContact C-N 3.35Å; A49-V51 PolarHBondContact O-N 3.24Å; V51-L54 CarbonylContact O-C 3.55Å; V51-L54 PolarHBondContact O-N 3.04Å; V51-L55 HydrophobicContact CG1-CD1 4.05Å; V51-L55 HydrophobicContact CG1-CG 4.43Å; V51-L55 WeakPolarHBondContact O-CG 3.26Å; V51-L55 PolarHBondContact O-N 2.89Å
52I83.4Confident82.5Confident82 Ų8292.5 Ų92.542%0.42151%0.505SS..Hα-helixtrans-61.1-47.6176.6-70.5167.9000110.4F48 A49 L54 L55 E56F48-I52 HydrophobicContact CD1-CD1 3.52Å; F48-I52 HydrophobicContact CD1-CG1 4.21Å; F48-I52 HydrophobicContact CE1-CD1 3.59Å; F48-I52 HydrophobicContact CE1-CG1 4.22Å; F48-I52 WeakPolarHBondContact O-CG1 3.36Å; F48-I52 PolarHBondContact O-N 2.84Å; A49-I52 PolarHBondContact O-N 3.4Å; I52-L54 PolarHBondContact O-N 3.38Å; I52-L55 PolarHBondContact O-N 3.21Å; I52-E56 WeakPolarHBondContact O-CB 3.23Å; I52-E56 PolarHBondContact O-N 2.92Å
53L84.8Confident81.1Confident96 Ų9691.8 Ų91.850%0.50351%0.507SS..Hα-helixtrans-59.6-39.8176.4-75171.5000111.1A49 L55 Y57A49-L53 WeakPolarHBondContact O-CB 3.33Å; A49-L53 VanDerWaalsContact O-CG 3.27Å; A49-L53 WeakPolarHBondContact O-CG 3.24Å; A49-L53 PolarHBondContact O-N 2.87Å; L53-L55 VanDerWaalsContact C-N 3.31Å; L53-L55 PolarHBondContact O-N 2.84Å; L53-Y57 HydrophobicContact CB-CD2 4.5Å; L53-Y57 HydrophobicContact CD2-CD2 3.78Å; L53-Y57 HydrophobicContact CD2-CE2 3.64Å; L53-Y57 WeakPolarHBondContact O-CA 3.28Å; L53-Y57 VanDerWaalsContact O-CB 3.28Å; L53-Y57 WeakPolarHBondContact O-CB 3.34Å; L53-Y57 WeakPolarHBondContact O-CD2 3.24Å; L53-Y57 PolarHBondContact O-N 2.97Å
54L82.1Confident79.8Confident130 Ų13092.7 Ų92.768%0.68151%0.508SS*.Hα-helixtrans-72.2-23.3177.3-160.6132.6000112.8G50 V51 I52 G58G50-L54 VanDerWaalsContact O-CB 3.26Å; G50-L54 WeakPolarHBondContact O-CB 3.47Å; G50-L54 PolarHBondContact O-N 2.99Å; V51-L54 CarbonylContact O-C 3.55Å; V51-L54 PolarHBondContact O-N 3.04Å; I52-L54 PolarHBondContact O-N 3.38Å; L54-G58 WeakPolarHBondContact O-CA 3.26Å; L54-G58 PolarHBondContact O-N 2.98Å
55L81.8Confident78.3Confident128 Ų12892.2 Ų92.267%0.6750%0.502SS*.Hα-helixtrans-80.4-42.1172-72.9170.5000111.9V51 I52 L53V51-L55 HydrophobicContact CG1-CD1 4.05Å; V51-L55 HydrophobicContact CG1-CG 4.43Å; V51-L55 WeakPolarHBondContact O-CG 3.26Å; V51-L55 PolarHBondContact O-N 2.89Å; I52-L55 PolarHBondContact O-N 3.21Å; L53-L55 VanDerWaalsContact C-N 3.31Å; L53-L55 PolarHBondContact O-N 2.84Å
56E79.8Confident76.7Confident132 Ų13290.8 Ų90.862%0.61750%0.495SS*.Hα-helixtrans-75.9-42.2-177.6-172.2173.3-161.200111.9I52I52-E56 WeakPolarHBondContact O-CB 3.23Å; I52-E56 PolarHBondContact O-N 2.92Å
57Y78.4Confident75.2Confident107 Ų10790.6 Ų90.642%0.4250%0.498SS..THydrogen-bonded Turntrans-103.6-3.5-179.3-59.1-88.1000112.9L53 D59 Q60 V61L53-Y57 HydrophobicContact CB-CD2 4.5Å; L53-Y57 HydrophobicContact CD2-CD2 3.78Å; L53-Y57 HydrophobicContact CD2-CE2 3.64Å; L53-Y57 WeakPolarHBondContact O-CA 3.28Å; L53-Y57 VanDerWaalsContact O-CB 3.28Å; L53-Y57 WeakPolarHBondContact O-CB 3.34Å; L53-Y57 WeakPolarHBondContact O-CD2 3.24Å; L53-Y57 PolarHBondContact O-N 2.97Å; Y57-D59 VanDerWaalsContact C-N 3.32Å; Y57-D59 PolarHBondContact O-N 3.34Å; Y57-Q60 WeakPolarHBondContact O-CB 3.31Å; Y57-Q60 PolarHBondContact O-N 2.77Å; Y57-Q60 VanDerWaalsContact O-N 3.09Å; Y57-V61 WeakPolarHBondContact O-CG2 3.5Å; Y57-V61 PolarHBondContact O-N 3.05Å
58G68.9Low73.7Confident12 Ų1295.2 Ų95.212%0.12451%0.508CS..Hα-helixtrans-58-44.8179.100000112.5L54 Q60 V61 M62L54-G58 WeakPolarHBondContact O-CA 3.26Å; L54-G58 PolarHBondContact O-N 2.98Å; G58-Q60 VanDerWaalsContact C-N 3.27Å; G58-Q60 PolarHBondContact O-N 3.04Å; G58-V61 PolarHBondContact O-N 3.03Å; G58-M62 VanDerWaalsContact O-CB 3.3Å; G58-M62 WeakPolarHBondContact O-CB 3.29Å; G58-M62 VanDerWaalsContact O-CG 3.25Å; G58-M62 WeakPolarHBondContact O-CG 3.27Å; G58-M62 PolarHBondContact O-N 2.83Å
59D72.5Confident72.2Confident137 Ų13790.7 Ų90.773%0.73349%0.49SS*.Hα-helixtrans-60.8-39.8176.3-75.2-11000111.3Y57 A63Y57-D59 VanDerWaalsContact C-N 3.32Å; Y57-D59 PolarHBondContact O-N 3.34Å; D59-A63 WeakPolarHBondContact O-CB 3.19Å; D59-A63 PolarHBondContact O-N 2.81Å
60Q72.9Confident70.8Confident132 Ų13291.4 Ų91.462%0.61749%0.491SS*.Hα-helixtrans-68.5-41.1177.4-169.1176.79.800111.9Y57 G58 S64Y57-Q60 WeakPolarHBondContact O-CB 3.31Å; Y57-Q60 PolarHBondContact O-N 2.77Å; Y57-Q60 VanDerWaalsContact O-N 3.09Å; G58-Q60 VanDerWaalsContact C-N 3.27Å; G58-Q60 PolarHBondContact O-N 3.04Å; Q60-S64 WeakPolarHBondContact O-CB 3.29Å; Q60-S64 PolarHBondContact O-N 2.98Å
61V63.9Low69.5Low77 Ų7797.3 Ų97.347%0.46751%0.508SS..Hα-helixtrans-66.1-48.6176.6173.20000110Y57 G58 A63 S64 I65Y57-V61 WeakPolarHBondContact O-CG2 3.5Å; Y57-V61 PolarHBondContact O-N 3.05Å; G58-V61 PolarHBondContact O-N 3.03Å; V61-A63 PolarHBondContact O-N 2.98Å; V61-S64 PolarHBondContact O-N 3.35Å; V61-S64 VanDerWaalsContact O-N 3.15Å; V61-S64 PolarHBondContact O-OG 2.82Å; V61-I65 HydrophobicContact CG1-CD1 3.8Å; V61-I65 HydrophobicContact CG1-CG1 4.46Å; V61-I65 VanDerWaalsContact O-CG1 3.31Å; V61-I65 WeakPolarHBondContact O-CG1 3.46Å; V61-I65 PolarHBondContact O-N 3.36Å
62M60.5Low68.3Low105 Ų105100.4 Ų100.452%0.51751%0.512SS..Hα-helixtrans-62-41.8177.3-71.2-59.6-68.800111.9G58 S64 I65 N66G58-M62 VanDerWaalsContact O-CB 3.3Å; G58-M62 WeakPolarHBondContact O-CB 3.29Å; G58-M62 VanDerWaalsContact O-CG 3.25Å; G58-M62 WeakPolarHBondContact O-CG 3.27Å; G58-M62 PolarHBondContact O-N 2.83Å; M62-S64 VanDerWaalsContact C-N 3.34Å; M62-S64 PolarHBondContact O-N 2.91Å; M62-I65 PolarHBondContact O-N 3.47Å; M62-I65 HydrophobicContact SD-CD1 4.47Å; M62-N66 WeakPolarHBondContact O-CB 3.29Å; M62-N66 PolarHBondContact O-N 2.83Å; M62-N66 PolarHBondContact O-ND2 2.93Å
63A63.6Low67Low60 Ų6097.3 Ų97.350%0.49650%0.497SS..Hα-helixtrans-62.5-41.7173.900000111.6D59 V61 N66 S67D59-A63 WeakPolarHBondContact O-CB 3.19Å; D59-A63 PolarHBondContact O-N 2.81Å; V61-A63 PolarHBondContact O-N 2.98Å; A63-N66 PolarHBondContact O-N 3.35Å; A63-S67 WeakPolarHBondContact O-CB 3.4Å; A63-S67 PolarHBondContact O-N 3.18Å
64S64.8Low65.5Low51 Ų5199 Ų9936%0.35750%0.5SS..Hα-helixtrans-64.9-39.3176.580.70000112.4Q60 V61 M62 S67 R68Q60-S64 WeakPolarHBondContact O-CB 3.29Å; Q60-S64 PolarHBondContact O-N 2.98Å; V61-S64 PolarHBondContact O-N 3.35Å; V61-S64 VanDerWaalsContact O-N 3.15Å; V61-S64 PolarHBondContact O-OG 2.82Å; M62-S64 VanDerWaalsContact C-N 3.34Å; M62-S64 PolarHBondContact O-N 2.91Å; S64-S67 PolarHBondContact O-N 3.5Å; S64-S67 PolarHBondContact O-OG 2.73Å; S64-R68 WeakPolarHBondContact O-CG 3.28Å; S64-R68 PolarHBondContact O-N 3.09Å
65I61.1Low64.1Low76 Ų7699.4 Ų99.439%0.3950%0.503SS..Hα-helixtrans-65.1-50.3175.1-67.5166.4000109.4V61 M62 S67 R68 L69V61-I65 HydrophobicContact CG1-CD1 3.8Å; V61-I65 HydrophobicContact CG1-CG1 4.46Å; V61-I65 VanDerWaalsContact O-CG1 3.31Å; V61-I65 WeakPolarHBondContact O-CG1 3.46Å; V61-I65 PolarHBondContact O-N 3.36Å; M62-I65 PolarHBondContact O-N 3.47Å; M62-I65 HydrophobicContact SD-CD1 4.47Å; I65-S67 PolarHBondContact O-N 2.88Å; I65-S67 VanDerWaalsContact O-N 3.17Å; I65-R68 PolarHBondContact O-N 3.28Å; I65-L69 HydrophobicContact CG2-CD1 3.89Å; I65-L69 HydrophobicContact CG2-CG 4.11Å; I65-L69 WeakPolarHBondContact O-CG 3.31Å; I65-L69 PolarHBondContact O-N 3.02Å
66N59.3Low62.8Low83 Ų8396.7 Ų96.744%0.44449%0.489SS..Hα-helixtrans-59.5-27.7176.8-76.1-22.4000113.7M62 A63M62-N66 WeakPolarHBondContact O-CB 3.29Å; M62-N66 PolarHBondContact O-N 2.83Å; M62-N66 PolarHBondContact O-ND2 2.93Å; A63-N66 PolarHBondContact O-N 3.35Å
67S61.3Low61.2Low90 Ų9098 Ų9863%0.62950%0.495SS*.Hα-helixtrans-76.4-2917576.30000113.6A63 S64 I65A63-S67 WeakPolarHBondContact O-CB 3.4Å; A63-S67 PolarHBondContact O-N 3.18Å; S64-S67 PolarHBondContact O-N 3.5Å; S64-S67 PolarHBondContact O-OG 2.73Å; I65-S67 PolarHBondContact O-N 2.88Å; I65-S67 VanDerWaalsContact O-N 3.17Å
68R58.1Low59.9Low213 Ų21398.5 Ų98.580%0.80451%0.511SS*.Hα-helixtrans-92.8-16.9179.7-67.4178.8-176.8-157.41.3113S64 I65S64-R68 WeakPolarHBondContact O-CG 3.28Å; S64-R68 PolarHBondContact O-N 3.09Å; I65-R68 PolarHBondContact O-N 3.28Å
69L58.9Low58.8Low40 Ų40102 Ų10221%0.20954%0.539CS..SBendtrans-66123.9177.4-85173.5000109.8I65 T73 I92I65-L69 HydrophobicContact CG2-CD1 3.89Å; I65-L69 HydrophobicContact CG2-CG 4.11Å; I65-L69 WeakPolarHBondContact O-CG 3.31Å; I65-L69 PolarHBondContact O-N 3.02Å; L69-T73 WeakPolarHBondContact CB-OG1 3.24Å; L69-T73 HydrophobicContact CD2-CG2 4.22Å; L69-I92 HydrophobicContact CD2-CG2 3.34Å
70P58.4Low57.5Low59 Ų59100.4 Ų100.438%0.38354%0.538SS..  trans-62.8144.6178.727.3-35.4000110.4W72 T73P70-W72 HydrophobicContact CG-CD2 4.47Å; P70-W72 HydrophobicContact CG-CG 4.47Å; P70-W72 HydrophobicContact CG-CZ2 4.11Å; P70-W72 PolarHBondContact O-N 3.17Å; P70-T73 HydrophobicContact CG-CG2 4.17Å; P70-T73 PolarHBondContact O-N 3.31Å; P70-T73 PolarHBondContact O-OG1 2.87Å
71E60.3Low56Low161 Ų16198.4 Ų98.475%0.75253%0.53SS*.G310 helixtrans-52-29-169.5-69.9-170.5155.500114.5T73 K74E71-T73 VanDerWaalsContact C-N 3.25Å; E71-T73 PolarHBondContact O-N 3.32Å; E71-K74 PolarHBondContact O-N 3.06Å
72W59.8Low54.9Low137 Ų137102.8 Ų102.852%0.51954%0.543SS..G310 helixtrans-61.9-29.1177.666.4-98.6000113.9P70 I76 I92P70-W72 HydrophobicContact CG-CD2 4.47Å; P70-W72 HydrophobicContact CG-CG 4.47Å; P70-W72 HydrophobicContact CG-CZ2 4.11Å; P70-W72 PolarHBondContact O-N 3.17Å; W72-I76 HydrophobicContact CE3-CD1 4.02Å; W72-I76 HydrophobicContact CZ3-CD1 3.79Å; W72-I92 HydrophobicContact CH2-CD1 3.7Å; W72-I92 HydrophobicContact CH2-CG1 3.96Å; W72-I92 HydrophobicContact CZ2-CD1 4.47Å; W72-I92 HydrophobicContact CZ2-CG1 4.4Å; W72-I92 HydrophobicContact CZ3-CD1 4.28Å
73T56.5Low54.3Low17 Ų17105.8 Ų105.810%0.10456%0.556CS.*G310 helixtrans-75.3-23.2179.653.90000113.4L69 P70 E71 N75 I76 I92L69-T73 WeakPolarHBondContact CB-OG1 3.24Å; L69-T73 HydrophobicContact CD2-CG2 4.22Å; P70-T73 HydrophobicContact CG-CG2 4.17Å; P70-T73 PolarHBondContact O-N 3.31Å; P70-T73 PolarHBondContact O-OG1 2.87Å; E71-T73 VanDerWaalsContact C-N 3.25Å; E71-T73 PolarHBondContact O-N 3.32Å; T73-N75 PolarHBondContact O-N 3.35Å; T73-I76 PolarHBondContact O-N 3.21Å; T73-I92 HydrophobicContact CG2-CD1 3.77Å
74K52.9Low53.4Low131 Ų131105.9 Ų105.957%0.5756%0.562SS**G310 helixtrans-70.5-20.3179-64.9179.5-177.8172.30112.8E71 I76E71-K74 PolarHBondContact O-N 3.06Å; K74-I76 VanDerWaalsContact C-N 3.3Å
75N52.7Low52.5Low140 Ų140108 Ų10875%0.74957%0.569SS**G310 helixtrans-85.2-4.4176.7-62.4-34.8000112.9T73 E77T73-N75 PolarHBondContact O-N 3.35Å; N75-E77 PolarHBondContact O-N 2.73Å
76I54.8Low51.3Low71 Ų71110 Ų11036%0.36458%0.578SS.*SBendtrans-88.695.4178-51.9176.2000107.4W72 T73 K74 P78 M81W72-I76 HydrophobicContact CE3-CD1 4.02Å; W72-I76 HydrophobicContact CZ3-CD1 3.79Å; T73-I76 PolarHBondContact O-N 3.21Å; K74-I76 VanDerWaalsContact C-N 3.3Å; I76-P78 WeakPolarHBondContact O-CD 3.33Å; I76-M81 HydrophobicContact CG2-CE 3.43Å; I76-M81 VanDerWaalsContact CG2-CE 3.43Å
77E45.5Very low50.7Low160 Ų160108.9 Ų108.975%0.74858%0.576SS**  trans-57.8121.5174.3-163.2171-16300109.4N75 A79N75-E77 PolarHBondContact O-N 2.73Å; E77-A79 HydrophobicContact CG-CB 4.29Å; E77-A79 PolarHBondContact O-N 3.47Å
78P51.6Low49.9Very low117 Ų117109.5 Ų109.576%0.7657%0.571SS**G310 helixtrans-72.31.8-17427.4-34.3000113.9I76 S80I76-P78 WeakPolarHBondContact O-CD 3.33Å; P78-S80 PolarHBondContact O-N 3.49Å
79A45.2Very low49.1Very low85 Ų85101.8 Ų101.870%0.70255%0.548SS*.G310 helixtrans-84.1-0.9-165.100000115.8E77E77-A79 HydrophobicContact CG-CB 4.29Å; E77-A79 PolarHBondContact O-N 3.47Å
80S45.6Very low48.3Very low103 Ų103104.4 Ų104.472%0.7256%0.562SS**G310 helixtrans-149.128.3178.485.60000116.4P78 K82P78-S80 PolarHBondContact O-N 3.49Å; S80-K82 PolarHBondContact O-N 2.81Å
81M41.5Very low47.6Very low91 Ų91108.4 Ų108.445%0.44858%0.575SS.*  trans-67.4105171.5-73.8-174176.700109I76 V89I76-M81 HydrophobicContact CG2-CE 3.43Å; I76-M81 VanDerWaalsContact CG2-CE 3.43Å; M81-V89 HydrophobicContact CE-CG2 3.9Å; M81-V89 HydrophobicContact SD-CG2 3.8Å
82K41.6Very low46.7Very low168 Ų168103.4 Ų103.473%0.7355%0.553SS**  trans-60.8146.6166.2-68.9-178.9178.8177.80106.9S80 G84 D85S80-K82 PolarHBondContact O-N 2.81Å; K82-G84 PolarHBondContact O-N 3.41Å; K82-D85 PolarHBondContact O-N 2.87Å
83Q47.7Very low45.8Very low169 Ų169102.8 Ų102.879%0.7956%0.559SS**THydrogen-bonded Turntrans-51.4-17.3-179.8-164.9169-1400113.9
84G44.7Very low45.2Very low61 Ų61103.6 Ų103.663%0.62957%0.567SS**THydrogen-bonded Turntrans-81.4-13.3172.500000117.3K82 M86 P87K82-G84 PolarHBondContact O-N 3.41Å; G84-M86 VanDerWaalsContact C-N 3.31Å; G84-P87 VanDerWaalsContact O-CD 3.23Å; G84-P87 WeakPolarHBondContact O-CD 3.35Å
85D44Very low44.7Very low95 Ų95100.2 Ų100.251%0.50856%0.559SS.*  trans-91.16.2178-69.5-29.7000113.1K82 P87K82-D85 PolarHBondContact O-N 2.87Å; D85-P87 VanDerWaalsContact C-N 3.31Å; D85-P87 VanDerWaalsContact O-CD 3.26Å; D85-P87 WeakPolarHBondContact O-CD 3.47Å
86M36.7Very low44.5Very low118 Ų11898.1 Ų98.158%0.58155%0.553SS**Hα-helixtrans-69.60.5176.1-147.2161137.700116.8G84 L90G84-M86 VanDerWaalsContact C-N 3.31Å; M86-L90 HydrophobicContact CE-CD1 4.41Å
87P47.4Very low44.2Very low61 Ų61102.5 Ų102.540%0.39657%0.572SS.*Hα-helixtrans-70.8-31.3168.6-14.227.8000113.9G84 D85G84-P87 VanDerWaalsContact O-CD 3.23Å; G84-P87 WeakPolarHBondContact O-CD 3.35Å; D85-P87 VanDerWaalsContact C-N 3.31Å; D85-P87 VanDerWaalsContact O-CD 3.26Å; D85-P87 WeakPolarHBondContact O-CD 3.47Å
88L45Very low44.1Very low102 Ų10299.3 Ų99.353%0.53456%0.555SS.*Hα-helixtrans-77.8-36.3-174.2-108.585.8000112.8L90 Q91 I92L88-L90 PolarHBondContact O-N 3.38Å; L88-Q91 WeakPolarHBondContact O-CB 3.44Å; L88-Q91 PolarHBondContact O-N 3.18Å; L88-I92 WeakPolarHBondContact O-CG1 3.43Å; L88-I92 PolarHBondContact O-N 3.43Å
89V40.6Very low43.9Very low52 Ų5296.8 Ų96.832%0.31555%0.545SS..Hα-helixtrans-71-33.1-176.2-176.50000112M81 Q91 I92 I93M81-V89 HydrophobicContact CE-CG2 3.9Å; M81-V89 HydrophobicContact SD-CG2 3.8Å; V89-Q91 VanDerWaalsContact C-N 3.29Å; V89-Q91 PolarHBondContact O-N 2.84Å; V89-I92 WeakPolarHBondContact O-CB 3.5Å; V89-I92 PolarHBondContact O-N 3.32Å; V89-I92 VanDerWaalsContact O-N 3.13Å; V89-I93 PolarHBondContact O-N 3.38Å
90L41.9Very low44Very low94 Ų94100.3 Ų100.349%0.49255%0.547SS..Hα-helixtrans-70.5-26.3175.1-98.2144.5000112.8M86 L88 I92 I93 A94M86-L90 HydrophobicContact CE-CD1 4.41Å; L88-L90 PolarHBondContact O-N 3.38Å; L90-I92 PolarHBondContact O-N 2.8Å; L90-I93 PolarHBondContact O-N 3.28Å; L90-A94 PolarHBondContact O-N 2.79Å
91Q43Very low44.2Very low144 Ų14498.3 Ų98.367%0.67354%0.542SS*.Hα-helixtrans-69.2-24.8171.6-146.7173.114.500112.1L88 V89L88-Q91 WeakPolarHBondContact O-CB 3.44Å; L88-Q91 PolarHBondContact O-N 3.18Å; V89-Q91 VanDerWaalsContact C-N 3.29Å; V89-Q91 PolarHBondContact O-N 2.84Å
92I42.8Very low44.5Very low56 Ų5697 Ų9729%0.28754%0.537SS..Hα-helixtrans-82.3-30.7178.9-59165.4000111.8L69 W72 T73 L88 V89 L90L69-I92 HydrophobicContact CD2-CG2 3.34Å; W72-I92 HydrophobicContact CH2-CD1 3.7Å; W72-I92 HydrophobicContact CH2-CG1 3.96Å; W72-I92 HydrophobicContact CZ2-CD1 4.47Å; W72-I92 HydrophobicContact CZ2-CG1 4.4Å; W72-I92 HydrophobicContact CZ3-CD1 4.28Å; T73-I92 HydrophobicContact CG2-CD1 3.77Å; L88-I92 WeakPolarHBondContact O-CG1 3.43Å; L88-I92 PolarHBondContact O-N 3.43Å; V89-I92 WeakPolarHBondContact O-CB 3.5Å; V89-I92 PolarHBondContact O-N 3.32Å; V89-I92 VanDerWaalsContact O-N 3.13Å; L90-I92 PolarHBondContact O-N 2.8Å
93I41Very low45.2Very low123 Ų12394 Ų9463%0.63153%0.534SS*.Hα-helixtrans-83.3-22.7-179.9-59.3172.1000111.8V89 L90 P95V89-I93 PolarHBondContact O-N 3.38Å; L90-I93 PolarHBondContact O-N 3.28Å; I93-P95 WeakPolarHBondContact O-CD 3.31Å
94A43.5Very low45.4Very low35 Ų3592.9 Ų92.929%0.28953%0.527SS..SBendtrans-58.8114.4173.400000108.6L90L90-A94 PolarHBondContact O-N 2.79Å
95P41.7Very low45.5Very low59 Ų5993 Ų9338%0.38351%0.513SS..  trans-51.1140.6173.5-23.431.2000108.8I93 Q97 F98I93-P95 WeakPolarHBondContact O-CD 3.31Å; P95-Q97 PolarHBondContact O-N 2.86Å; P95-F98 HydrophobicContact CB-CD2 4.06Å; P95-F98 HydrophobicContact CB-CE2 4.37Å; P95-F98 HydrophobicContact CG-CD2 3.97Å; P95-F98 HydrophobicContact CG-CE2 3.95Å; P95-F98 PolarHBondContact O-N 3.45Å
96P48.7Very low45.9Very low96 Ų9691.9 Ų91.962%0.62351%0.506SS*.G310 helixtrans-52-23.5-17715.1-28.7000113.5F98 A99 E100P96-F98 PolarHBondContact O-N 3.24Å; P96-F98 VanDerWaalsContact O-N 3.11Å; P96-A99 PolarHBondContact O-N 2.67Å; P96-A99 VanDerWaalsContact O-N 3.13Å; P96-E100 PolarHBondContact O-N 3.5Å
97Q48.5Very low46.9Very low164 Ų16492 Ų9277%0.76651%0.505SS*.G310 helixtrans-55.2-23.1171.9-50.2-17428.700114.8P95P95-Q97 PolarHBondContact O-N 2.86Å
98F43.6Very low47.2Very low92 Ų9293.7 Ų93.740%0.40451%0.514SS..G310 helixtrans-93.4-22.7178.6-71.6-83.3000113.8P95 P96 I105P95-F98 HydrophobicContact CB-CD2 4.06Å; P95-F98 HydrophobicContact CB-CE2 4.37Å; P95-F98 HydrophobicContact CG-CD2 3.97Å; P95-F98 HydrophobicContact CG-CE2 3.95Å; P95-F98 PolarHBondContact O-N 3.45Å; P96-F98 PolarHBondContact O-N 3.24Å; P96-F98 VanDerWaalsContact O-N 3.11Å; F98-I105 HydrophobicContact CD1-CD1 4.31Å; F98-I105 HydrophobicContact CD1-CG2 4Å
99A47.4Very low47.6Very low65 Ų6593 Ų9354%0.53751%0.51SS..THydrogen-bonded Turntrans-79.2-37.3178.800000111.7P96P96-A99 PolarHBondContact O-N 2.67Å; P96-A99 VanDerWaalsContact O-N 3.13Å
100E48.1Very low48.5Very low159 Ų15995.6 Ų95.674%0.74352%0.522SS*.SBendtrans-89.4-14.8-172-70.7176.6175.600114.4P96P96-E100 PolarHBondContact O-N 3.5Å
101G49.6Very low49.2Very low60 Ų6095 Ų9562%0.61952%0.52SS*.SBendtrans-104.2-26.1-163.400000117.8
102N47.4Very low49.8Very low64 Ų6490.8 Ų90.834%0.34251%0.509SS..  trans-162.1106.5-172.3-161.6-22.6000113.1K104 I105N102-K104 PolarHBondContact O-N 3.34Å; N102-K104 VanDerWaalsContact OD1-CB 3.24Å; N102-K104 WeakPolarHBondContact OD1-CB 3.36Å; N102-K104 PolarHBondContact OD1-N 2.9Å; N102-I105 HydrophobicContact CB-CB 4.49Å; N102-I105 HydrophobicContact CB-CD1 3.86Å; N102-I105 HydrophobicContact CB-CG1 3.92Å; N102-I105 PolarHBondContact O-N 3.32Å
103P55Low50.4Low104 Ų10491.1 Ų91.168%0.67551%0.51SS*.Hα-helixtrans-58.9-22.4177.223.6-33000112.6Q107P103-Q107 WeakPolarHBondContact O-CB 3.34Å; P103-Q107 PolarHBondContact O-N 2.89Å
104K52.2Low51Low146 Ų14690.4 Ų90.464%0.63550%0.502SS*.Hα-helixtrans-69.2-31.5175.8-61.5-177.3177.41780113N102 Q107 V108N102-K104 PolarHBondContact O-N 3.34Å; N102-K104 VanDerWaalsContact OD1-CB 3.24Å; N102-K104 WeakPolarHBondContact OD1-CB 3.36Å; N102-K104 PolarHBondContact OD1-N 2.9Å; K104-Q107 PolarHBondContact O-N 3.25Å; K104-V108 VanDerWaalsContact O-CG2 3.29Å; K104-V108 WeakPolarHBondContact O-CG2 3.12Å; K104-V108 PolarHBondContact O-N 3.5Å
105I48Very low51.5Low65 Ų6596.3 Ų96.333%0.33352%0.521SS..Hα-helixtrans-71.8-41.3178.5-61.1173.3000109.8F98 N102 Q107 V108 L109F98-I105 HydrophobicContact CD1-CD1 4.31Å; F98-I105 HydrophobicContact CD1-CG2 4Å; N102-I105 HydrophobicContact CB-CB 4.49Å; N102-I105 HydrophobicContact CB-CD1 3.86Å; N102-I105 HydrophobicContact CB-CG1 3.92Å; N102-I105 PolarHBondContact O-N 3.32Å; I105-Q107 VanDerWaalsContact C-N 3.28Å; I105-Q107 PolarHBondContact O-N 2.93Å; I105-V108 PolarHBondContact O-N 3.15Å; I105-L109 HydrophobicContact CG2-CD1 4.04Å; I105-L109 WeakPolarHBondContact O-CB 3.24Å; I105-L109 PolarHBondContact O-N 3.06Å
106L52.3Low51.9Low71 Ų7196.6 Ų96.637%0.37253%0.528SS..Hα-helixtrans-59.3-41.6171-69.2172.8000111.1L109 L110L106-L109 PolarHBondContact O-N 3.18Å; L106-L110 VanDerWaalsContact O-CB 3.29Å; L106-L110 WeakPolarHBondContact O-CB 3.16Å; L106-L110 VanDerWaalsContact O-CG 3.29Å; L106-L110 WeakPolarHBondContact O-CG 3.43Å; L106-L110 PolarHBondContact O-N 3.39Å
107Q57.2Low52Low119 Ų11996.4 Ų96.456%0.55653%0.526SS*.Hα-helixtrans-67.4-39.5177.3-161.8178.725.100112.8P103 K104 I105 N111P103-Q107 WeakPolarHBondContact O-CB 3.34Å; P103-Q107 PolarHBondContact O-N 2.89Å; K104-Q107 PolarHBondContact O-N 3.25Å; I105-Q107 VanDerWaalsContact C-N 3.28Å; I105-Q107 PolarHBondContact O-N 2.93Å; Q107-N111 WeakPolarHBondContact O-CB 3.42Å; Q107-N111 PolarHBondContact O-N 3.42Å; Q107-N111 PolarHBondContact O-ND2 3.44Å
108V53.9Low51.9Low97 Ų9793.3 Ų93.359%0.58851%0.514SS*.Hα-helixtrans-66.5-41.3174.9171.50000110.9K104 I105 N111 A112K104-V108 VanDerWaalsContact O-CG2 3.29Å; K104-V108 WeakPolarHBondContact O-CG2 3.12Å; K104-V108 PolarHBondContact O-N 3.5Å; I105-V108 PolarHBondContact O-N 3.15Å; V108-N111 PolarHBondContact O-N 3.2Å; V108-A112 VanDerWaalsContact O-CB 3.27Å; V108-A112 WeakPolarHBondContact O-CB 3.45Å; V108-A112 PolarHBondContact O-N 3.46Å
109L53.3Low52.2Low87 Ų8792.8 Ų92.846%0.45553%0.526SS..Hα-helixtrans-63.9-47.1174.6-86.5161.7000111.7I105 L106 N111 A112 Q113I105-L109 HydrophobicContact CG2-CD1 4.04Å; I105-L109 WeakPolarHBondContact O-CB 3.24Å; I105-L109 PolarHBondContact O-N 3.06Å; L106-L109 PolarHBondContact O-N 3.18Å; L109-N111 VanDerWaalsContact C-N 3.31Å; L109-N111 PolarHBondContact O-N 3.41Å; L109-A112 PolarHBondContact O-N 3.22Å; L109-Q113 VanDerWaalsContact O-CB 3.28Å; L109-Q113 WeakPolarHBondContact O-CB 3.44Å; L109-Q113 PolarHBondContact O-N 3.41Å
110L59.9Low52Low107 Ų10796 Ų9656%0.5653%0.534SS*.Hα-helixtrans-61.2-40.1174.8-78.5165.5000111.5L106 K114L106-L110 VanDerWaalsContact O-CB 3.29Å; L106-L110 WeakPolarHBondContact O-CB 3.16Å; L106-L110 VanDerWaalsContact O-CG 3.29Å; L106-L110 WeakPolarHBondContact O-CG 3.43Å; L106-L110 PolarHBondContact O-N 3.39Å; L110-K114 WeakPolarHBondContact O-CB 3.43Å; L110-K114 PolarHBondContact O-N 2.87Å
111N55.2Low51.3Low82 Ų8296.3 Ų96.344%0.43954%0.536SS..Hα-helixtrans-68.8-38.9176-76.1-24.7000112.3Q107 V108 L109 K115Q107-N111 WeakPolarHBondContact O-CB 3.42Å; Q107-N111 PolarHBondContact O-N 3.42Å; Q107-N111 PolarHBondContact O-ND2 3.44Å; V108-N111 PolarHBondContact O-N 3.2Å; L109-N111 VanDerWaalsContact C-N 3.31Å; L109-N111 PolarHBondContact O-N 3.41Å; N111-K115 WeakPolarHBondContact O-CB 3.38Å; N111-K115 VanDerWaalsContact O-CG 3.31Å; N111-K115 WeakPolarHBondContact O-CG 3.22Å; N111-K115 PolarHBondContact O-N 3.24Å
112A56.1Low50.6Low55 Ų55102 Ų10246%0.45555%0.547SS..Hα-helixtrans-67.4-42.6175.900000110.8V108 L109 K115 A116V108-A112 VanDerWaalsContact O-CB 3.27Å; V108-A112 WeakPolarHBondContact O-CB 3.45Å; V108-A112 PolarHBondContact O-N 3.46Å; L109-A112 PolarHBondContact O-N 3.22Å; A112-K115 PolarHBondContact O-N 3.37Å; A112-A116 WeakPolarHBondContact O-CB 3.26Å; A112-A116 PolarHBondContact O-N 3.43Å
113Q55.5Low50.1Low63 Ų63104.2 Ų104.229%0.29456%0.564SS.*Hα-helixtrans-62.8-47.7174.2-171.9-175.18.400110.6L109 K115 A116 T117L109-Q113 VanDerWaalsContact O-CB 3.28Å; L109-Q113 WeakPolarHBondContact O-CB 3.44Å; L109-Q113 PolarHBondContact O-N 3.41Å; Q113-K115 VanDerWaalsContact C-N 3.29Å; Q113-K115 PolarHBondContact O-N 3.39Å; Q113-A116 CarbonylContact O-C 3.54Å; Q113-A116 WeakPolarHBondContact O-CA 3.24Å; Q113-A116 WeakPolarHBondContact O-CB 3.47Å; Q113-A116 PolarHBondContact O-N 3.11Å; Q113-T117 PolarHBondContact O-N 2.85Å; Q113-T117 PolarHBondContact O-OG1 3.3Å
114K53.4Low49.1Very low108 Ų108107.7 Ų107.747%0.4757%0.571SS.*Hα-helixtrans-59.4-39.4175.6-171.5176.8-177.3176.20111.7L110 T117 L118L110-K114 WeakPolarHBondContact O-CB 3.43Å; L110-K114 PolarHBondContact O-N 2.87Å; K114-T117 WeakPolarHBondContact CA-OG1 3.41Å; K114-T117 PolarHBondContact O-OG1 3.36Å; K114-L118 HydrophobicContact CG-CD1 3.99Å; K114-L118 HydrophobicContact CG-CG 4.46Å; K114-L118 VanDerWaalsContact O-CB 3.24Å; K114-L118 WeakPolarHBondContact O-CB 3.46Å; K114-L118 WeakPolarHBondContact O-CD1 3.4Å; K114-L118 WeakPolarHBondContact O-CG 3.4Å; K114-L118 PolarHBondContact O-N 2.89Å
115K54Low48.4Very low159 Ų159106.1 Ų106.169%0.69158%0.577SS**Hα-helixtrans-66.6-36.2173.2-79.7-178.4178.4-174.60112.4N111 A112 Q113 A119N111-K115 WeakPolarHBondContact O-CB 3.38Å; N111-K115 VanDerWaalsContact O-CG 3.31Å; N111-K115 WeakPolarHBondContact O-CG 3.22Å; N111-K115 PolarHBondContact O-N 3.24Å; A112-K115 PolarHBondContact O-N 3.37Å; Q113-K115 VanDerWaalsContact C-N 3.29Å; Q113-K115 PolarHBondContact O-N 3.39Å; K115-A119 PolarHBondContact O-N 3.02Å
116A51.5Low48Very low65 Ų65110.2 Ų110.254%0.53760%0.598SS.*Hα-helixtrans-69.9-39.8175.900000111.9A112 Q113 A119A112-A116 WeakPolarHBondContact O-CB 3.26Å; A112-A116 PolarHBondContact O-N 3.43Å; Q113-A116 CarbonylContact O-C 3.54Å; Q113-A116 WeakPolarHBondContact O-CA 3.24Å; Q113-A116 WeakPolarHBondContact O-CB 3.47Å; Q113-A116 PolarHBondContact O-N 3.11Å; A116-A119 WeakPolarHBondContact O-CB 3.46Å; A116-A119 PolarHBondContact O-N 2.79Å
117T49.7Very low47.6Very low92 Ų92114.8 Ų114.856%0.56462%0.622SS**Hα-helixtrans-72.7-3317424.40000113.2Q113 K114 A119 D120 E121Q113-T117 PolarHBondContact O-N 2.85Å; Q113-T117 PolarHBondContact O-OG1 3.3Å; K114-T117 WeakPolarHBondContact CA-OG1 3.41Å; K114-T117 PolarHBondContact O-OG1 3.36Å; T117-A119 PolarHBondContact O-N 3.37Å; T117-D120 PolarHBondContact O-N 2.85Å; T117-D120 VanDerWaalsContact O-N 3.17Å; T117-E121 PolarHBondContact O-N 2.83Å
118L47.3Very low46.7Very low99 Ų99117.6 Ų117.652%0.51864%0.635SS.*THydrogen-bonded Turntrans-66.1-17.7173.2-78.5165.3000113.3K114 D120K114-L118 HydrophobicContact CG-CD1 3.99Å; K114-L118 HydrophobicContact CG-CG 4.46Å; K114-L118 VanDerWaalsContact O-CB 3.24Å; K114-L118 WeakPolarHBondContact O-CB 3.46Å; K114-L118 WeakPolarHBondContact O-CD1 3.4Å; K114-L118 WeakPolarHBondContact O-CG 3.4Å; K114-L118 PolarHBondContact O-N 2.89Å; L118-D120 VanDerWaalsContact C-N 3.31Å
119A49.7Very low46.2Very low81 Ų81117.9 Ų117.967%0.66964%0.642SS**THydrogen-bonded Turntrans-73.3-25.3174.500000112.4K115 A116 T117K115-A119 PolarHBondContact O-N 3.02Å; A116-A119 WeakPolarHBondContact O-CB 3.46Å; A116-A119 PolarHBondContact O-N 2.79Å; T117-A119 PolarHBondContact O-N 3.37Å
120D43Very low45.6Very low132 Ų132120.7 Ų120.771%0.70666%0.655SS**THydrogen-bonded Turntrans-110.9-19.5-173.7-89-22.3000115.2T117 L118T117-D120 PolarHBondContact O-N 2.85Å; T117-D120 VanDerWaalsContact O-N 3.17Å; L118-D120 VanDerWaalsContact C-N 3.31Å
121E32.4Very low44.4Very low166 Ų166122.7 Ų122.778%0.77667%0.667SS**SBendtrans-138.7139.7176.6-80.2-171.8147.700115.6T117T117-E121 PolarHBondContact O-N 2.83Å
122Q35Very low43.9Very low181 Ų181124.8 Ų124.885%0.84668%0.677SS**  trans-47.7139.7-178-162.7174.49.600112.6Q124Q122-Q124 PolarHBondContact O-N 2.89Å; Q122-Q124 VanDerWaalsContact O-N 3.09Å
123P36.7Very low43Very low110 Ų110129.8 Ų129.871%0.71470%0.696SS**  trans-66111.2-163.325.1-35.1000112.5
124Q35.4Very low42.6Very low176 Ų176131.6 Ų131.682%0.82271%0.707SS**  trans-82.1139.7162.6-76-174.42.100110.4Q122Q122-Q124 PolarHBondContact O-N 2.89Å; Q122-Q124 VanDerWaalsContact O-N 3.09Å
125P36.7Very low41.8Very low114 Ų114129.3 Ų129.374%0.7471%0.705SS**  trans-68.9138.1-173.627.5-32.5000111.4L127P125-L127 PolarHBondContact O-N 3.36Å; P125-L127 VanDerWaalsContact O-N 3.11Å
126L39.9Very low41.6Very low150 Ų150128.4 Ų128.479%0.78571%0.707SS**  trans-27.1104.7172.6-64.4147.6000112.9E128L126-E128 PolarHBondContact O-N 3.41Å
127L44.2Very low41.4Very low167 Ų167133.5 Ų133.587%0.87472%0.719SS**PPolyproline II helixtrans-60.4132.9164.3-90.296.2000109P125P125-L127 PolarHBondContact O-N 3.36Å; P125-L127 VanDerWaalsContact O-N 3.11Å
128E37.8Very low41.4Very low178 Ų178135.7 Ų135.783%0.83272%0.723SS**PPolyproline II helixtrans-54.5153.3-174.4-70.7166.8142.500113.4L126 I130L126-E128 PolarHBondContact O-N 3.41Å; E128-I130 PolarHBondContact O-N 3.5Å; E128-I130 VanDerWaalsContact O-N 3.17Å
129S43.9Very low41.5Very low104 Ų104136.5 Ų136.573%0.72772%0.724SS**PPolyproline II helixtrans-51.9118.6172.845.10000110D131S129-D131 PolarHBondContact O-N 3.49Å
130I40.9Very low41.3Very low145 Ų145141.9 Ų141.974%0.74474%0.735SS**  trans-70.1100.9168.9-55.6171.2000106.1E128 I132E128-I130 PolarHBondContact O-N 3.5Å; E128-I130 VanDerWaalsContact O-N 3.17Å; I130-I132 VanDerWaalsContact C-N 3.31Å; I130-I132 HydrophobicContact CB-CG1 4.41Å; I130-I132 HydrophobicContact CG2-CD1 4.26Å; I130-I132 HydrophobicContact CG2-CG1 3.51Å; I130-I132 PolarHBondContact O-N 3.32Å
131D34.7Very low41.4Very low150 Ų150139.7 Ų139.780%0.80274%0.736SS**  trans-67.694.6161.4-87-31.6000106.9S129 D133S129-D131 PolarHBondContact O-N 3.49Å; D131-D133 PolarHBondContact O-N 2.9Å
132I44.2Very low42.2Very low125 Ų125136.6 Ų136.664%0.64172%0.724SS**  trans-82.2102.3167.2-54.7177000105.8I130 L134I130-I132 VanDerWaalsContact C-N 3.31Å; I130-I132 HydrophobicContact CB-CG1 4.41Å; I130-I132 HydrophobicContact CG2-CD1 4.26Å; I130-I132 HydrophobicContact CG2-CG1 3.51Å; I130-I132 PolarHBondContact O-N 3.32Å; I132-L134 HydrophobicContact CG2-CD1 3.93Å; I132-L134 PolarHBondContact O-N 2.92Å
133D37.1Very low42.7Very low161 Ų161136.8 Ų136.886%0.86172%0.724SS**  trans-63.291.7159.1-87.7-29.2000107.1D131 S135D131-D133 PolarHBondContact O-N 2.9Å; D133-S135 PolarHBondContact O-N 2.93Å
134L47.1Very low43.1Very low101 Ų101138.4 Ų138.453%0.52973%0.727SS.*  trans-65.4115.2172-138.879.6000107I132 L136I132-L134 HydrophobicContact CG2-CD1 3.93Å; I132-L134 PolarHBondContact O-N 2.92Å; L134-L136 PolarHBondContact O-N 3.09Å
135S36.6Very low43.7Very low60 Ų60136.4 Ų136.442%0.4272%0.721SS.*  trans-60.8122.8174.2-174.50000108.3D133 E137 E138D133-S135 PolarHBondContact O-N 2.93Å; S135-E137 PolarHBondContact O-N 3.33Å; S135-E138 PolarHBondContact O-N 3.17Å
136L50.8Low44Very low140 Ų140136.6 Ų136.673%0.73372%0.722SS**G310 helixtrans-52.5-17.4179.6-78.8151.1000113.7L134 E138L134-L136 PolarHBondContact O-N 3.09Å; L136-E138 VanDerWaalsContact C-N 3.31Å; L136-E138 PolarHBondContact O-N 3.27Å
137E45.5Very low44.4Very low171 Ų171137.4 Ų137.480%0.79972%0.722SS**G310 helixtrans-70.7-23.6178-64.2166.4169.900113S135S135-E137 PolarHBondContact O-N 3.33Å
138E51.1Low44.6Very low138 Ų138135.4 Ų135.465%0.64572%0.719SS**G310 helixtrans-91.2-8.8178.7-73-177.516200113.7S135 L136S135-E138 PolarHBondContact O-N 3.17Å; L136-E138 VanDerWaalsContact C-N 3.31Å; L136-E138 PolarHBondContact O-N 3.27Å
139E49.5Very low45.1Very low116 Ų116134.7 Ų134.754%0.54272%0.72SS.*G310 helixtrans-73.3-29-178.2-122.8175.7-177.200113A141E139-A141 VanDerWaalsContact C-N 3.34Å; E139-A141 PolarHBondContact O-N 3.23Å
140E45.4Very low45.5Very low194 Ų194134.4 Ų134.491%0.90772%0.723SS**G310 helixtrans-75.1-19.6179.9-77.9-172161.600113.9
141A45.4Very low45.8Very low87 Ų87133.8 Ų133.872%0.71972%0.72SS**G310 helixtrans-90.3-4.8-178.900000113.6E139 E143E139-A141 VanDerWaalsContact C-N 3.34Å; E139-A141 PolarHBondContact O-N 3.23Å; A141-E143 PolarHBondContact O-N 2.88Å
142I49.2Very low46.1Very low101 Ų101131 Ų13152%0.51871%0.705SS.*  trans-76.983.9172.2-49.7174.7000106.6L144I142-L144 PolarHBondContact O-N 3.41Å
143E44.8Very low46.2Very low184 Ų184131 Ų13186%0.8671%0.707SS**  trans-54.694.7163.5-163.5171.3-156.300106.4A141 L145A141-E143 PolarHBondContact O-N 2.88Å; E143-L145 PolarHBondContact O-N 3.27Å
144L45.5Very low46.7Very low145 Ų145131 Ų13176%0.75970%0.702SS**  trans-57102.8-174.5-83109.4000107.6I142I142-L144 PolarHBondContact O-N 3.41Å
145L46.6Very low46.8Very low133 Ų133133.1 Ų133.170%0.69671%0.712SS**PPolyproline II helixtrans-47.9135.4173.2-78.7163.3000108.3E143 Q147E143-L145 PolarHBondContact O-N 3.27Å; L145-Q147 PolarHBondContact O-N 3.34Å
146P44.4Very low47.2Very low118 Ų118135.5 Ų135.577%0.76672%0.719SS**PPolyproline II helixtrans-55.2116.6-176.521-31.3000108.7
147Q48.1Very low47.2Very low168 Ų168130.6 Ų130.679%0.78570%0.702SS**PPolyproline II helixtrans-52.9131.9179.6-75.6-175.211.900108.8L145 L149L145-Q147 PolarHBondContact O-N 3.34Å; Q147-L149 PolarHBondContact O-N 3.33Å; Q147-L149 VanDerWaalsContact O-N 3.09Å
148P48.1Very low47.5Very low124 Ų124127.4 Ų127.481%0.80569%0.69SS**PPolyproline II helixtrans-58.4122.3175.322.8-30.7000108.1A150P148-A150 PolarHBondContact O-N 3.09Å
149L48.4Very low47.8Very low164 Ų164127.8 Ų127.886%0.85970%0.695SS**  trans-44.9127.8177.1-76.3158.2000108.8Q147 I151Q147-L149 PolarHBondContact O-N 3.33Å; Q147-L149 VanDerWaalsContact O-N 3.09Å; L149-I151 PolarHBondContact O-N 3.47Å
150A51.9Low48.2Very low97 Ų97124.3 Ų124.380%0.80269%0.686SS**  trans-47.6116.5173.900000108P148 N152P148-A150 PolarHBondContact O-N 3.09Å; A150-N152 PolarHBondContact O-N 3.24Å
151I47.2Very low48.7Very low133 Ų133120.5 Ų120.568%0.68267%0.668SS**  trans-59.4103.6179-62.9171.6000106L149 N153 I156L149-I151 PolarHBondContact O-N 3.47Å; I151-N153 PolarHBondContact O-N 2.96Å; I151-I156 HydrophobicContact CG2-CD1 4.47Å; I151-I156 HydrophobicContact CG2-CG1 4.45Å
152N40.2Very low49.2Very low90 Ų90121.1 Ų121.148%0.48166%0.663SS.*  trans-66.5116.2170.5-172.98000106.2A150 E154 I155A150-N152 PolarHBondContact O-N 3.24Å; N152-E154 PolarHBondContact ND2-OE2 3.25Å; N152-E154 PolarHBondContact O-N 3.33Å; N152-I155 PolarHBondContact O-N 2.89Å
153N46.9Very low49.7Very low126 Ų126119.1 Ų119.167%0.67466%0.662SS**THydrogen-bonded Turntrans-59.7-4.8-176.6-72-23.1000113.7I151 I155I151-N153 PolarHBondContact O-N 2.96Å; N153-I155 VanDerWaalsContact C-N 3.35Å
154E47.4Very low50.5Low161 Ų161118 Ų11875%0.75265%0.65SS**THydrogen-bonded Turntrans-69.6-24.3169.3-82.4179.8139.700114.4N152N152-E154 PolarHBondContact ND2-OE2 3.25Å; N152-E154 PolarHBondContact O-N 3.33Å
155I50.2Low50.9Low146 Ų146120.6 Ų120.675%0.74965%0.65SS**SBendtrans-88-14.5-178.7-60.6160.6000111.8N152 N153 G157N152-I155 PolarHBondContact O-N 2.89Å; N153-I155 VanDerWaalsContact C-N 3.35Å; I155-G157 PolarHBondContact O-N 3.29Å
156I45.4Very low51.9Low110 Ų110119.8 Ų119.856%0.56465%0.646SS**SBendtrans-70.590.3167.4-55.1176.7000105.2I151 D158I151-I156 HydrophobicContact CG2-CD1 4.47Å; I151-I156 HydrophobicContact CG2-CG1 4.45Å; I156-D158 PolarHBondContact O-N 2.89Å; I156-D158 VanDerWaalsContact O-N 3.09Å
157G49Very low53.2Low36 Ų36121.5 Ų121.537%0.37164%0.643SS.*  trans-40.7121.1-176.200000109.4I155 I159I155-G157 PolarHBondContact O-N 3.29Å; G157-I159 PolarHBondContact O-N 2.93Å
158D53Low54.3Low105 Ų105117.6 Ų117.656%0.56164%0.635SS**  trans-25.1123.8174.5177.91.3000110.7I156 A160 Q161I156-D158 PolarHBondContact O-N 2.89Å; I156-D158 VanDerWaalsContact O-N 3.09Å; D158-A160 PolarHBondContact O-N 2.88Å; D158-A160 WeakPolarHBondContact OD1-CB 3.26Å; D158-A160 PolarHBondContact OD1-N 3.49Å; D158-A160 VanDerWaalsContact OD1-N 3.15Å; D158-Q161 WeakPolarHBondContact O-CB 3.38Å; D158-Q161 PolarHBondContact O-N 3.27Å
159I57Low55Low145 Ų145118.1 Ų118.174%0.74463%0.63SS**Hα-helixtrans-49.8-25.8-177.3-63.6166.7000111G157 Q161 V162 A163G157-I159 PolarHBondContact O-N 2.93Å; I159-Q161 VanDerWaalsContact C-N 3.35Å; I159-Q161 PolarHBondContact O-N 3.47Å; I159-V162 PolarHBondContact O-N 3.11Å; I159-A163 PolarHBondContact O-N 3.3Å
160A58.8Low55.1Low43 Ų43123.8 Ų123.836%0.35564%0.64SS.*Hα-helixtrans-64.7-27.4172.800000115.2D158 R164D158-A160 PolarHBondContact O-N 2.88Å; D158-A160 WeakPolarHBondContact OD1-CB 3.26Å; D158-A160 PolarHBondContact OD1-N 3.49Å; D158-A160 VanDerWaalsContact OD1-N 3.15Å; A160-R164 WeakPolarHBondContact O-CG 3.11Å; A160-R164 PolarHBondContact O-N 2.73Å; A160-R164 PolarHBondContact O-NE 3.14Å
161Q55.5Low55.3Low114 Ų114125.2 Ų125.253%0.53363%0.632SS.*Hα-helixtrans-74.6-38.4173.1-68.3-169.436.400111.7D158 I159 A163 R164 W165D158-Q161 WeakPolarHBondContact O-CB 3.38Å; D158-Q161 PolarHBondContact O-N 3.27Å; I159-Q161 VanDerWaalsContact C-N 3.35Å; I159-Q161 PolarHBondContact O-N 3.47Å; Q161-A163 VanDerWaalsContact C-N 3.34Å; Q161-R164 PolarHBondContact O-N 3.32Å; Q161-W165 PolarHBondContact O-N 3.45Å
162V56.4Low55.7Low101 Ų101124.7 Ų124.761%0.61263%0.63SS**Hα-helixtrans-64.8-41.7175.4-176.60000110.3I159 R164 W165 D166I159-V162 PolarHBondContact O-N 3.11Å; V162-R164 PolarHBondContact O-N 2.86Å; V162-W165 WeakPolarHBondContact O-CB 3.1Å; V162-W165 PolarHBondContact O-N 2.7Å; V162-D166 PolarHBondContact O-N 2.79Å
163A59.6Low56.5Low59 Ų59126.7 Ų126.749%0.48864%0.638SS.*Hα-helixtrans-62.6-39.4175.100000112.9I159 Q161 W165 D166 E167I159-A163 PolarHBondContact O-N 3.3Å; Q161-A163 VanDerWaalsContact C-N 3.34Å; A163-W165 VanDerWaalsContact C-N 3.33Å; A163-W165 PolarHBondContact O-N 3.46Å; A163-D166 PolarHBondContact O-N 2.92Å; A163-E167 PolarHBondContact O-N 3.33Å
164R60Low57.1Low161 Ų161126.7 Ų126.761%0.60864%0.636SS**Hα-helixtrans-66.8-31.4175.1-80.6-173.6-79.8176.3-6.6113.3A160 Q161 V162 S168A160-R164 WeakPolarHBondContact O-CG 3.11Å; A160-R164 PolarHBondContact O-N 2.73Å; A160-R164 PolarHBondContact O-NE 3.14Å; Q161-R164 PolarHBondContact O-N 3.32Å; V162-R164 PolarHBondContact O-N 2.86Å; R164-S168 PolarHBondContact O-N 2.88Å
165W55.4Low57.7Low199 Ų199124.6 Ų124.675%0.75463%0.628SS**Hα-helixtrans-67.2-42.2174.7-114.354.1000111.7Q161 V162 A163 E167 S168Q161-W165 PolarHBondContact O-N 3.45Å; V162-W165 WeakPolarHBondContact O-CB 3.1Å; V162-W165 PolarHBondContact O-N 2.7Å; A163-W165 VanDerWaalsContact C-N 3.33Å; A163-W165 PolarHBondContact O-N 3.46Å; W165-E167 PolarHBondContact O-N 2.96Å; W165-S168 PolarHBondContact O-N 3.16Å; W165-S168 PolarHBondContact O-OG 3.5Å
166D67.6Low58.2Low116 Ų116123.1 Ų123.162%0.6262%0.62SS**Hα-helixtrans-64.6-38.6179.2-164.553.2000112.6V162 A163 S168 L169V162-D166 PolarHBondContact O-N 2.79Å; A163-D166 PolarHBondContact O-N 2.92Å; D166-S168 VanDerWaalsContact C-N 3.31Å; D166-S168 PolarHBondContact O-N 3.3Å; D166-L169 PolarHBondContact O-N 2.9Å
167E72Confident59.1Low153 Ų153124.1 Ų124.172%0.71562%0.624SS**Hα-helixtrans-65.9-29.9174.3-102.1177.7174.900113.5A163 W165 L169A163-E167 PolarHBondContact O-N 3.33Å; W165-E167 PolarHBondContact O-N 2.96Å; E167-L169 PolarHBondContact O-N 3.39Å
168S70Confident59.9Low86 Ų86130.8 Ų130.860%0.60164%0.644SS**THydrogen-bonded Turntrans-76-10.2179.173.10000114.5R164 W165 D166R164-S168 PolarHBondContact O-N 2.88Å; W165-S168 PolarHBondContact O-N 3.16Å; W165-S168 PolarHBondContact O-OG 3.5Å; D166-S168 VanDerWaalsContact C-N 3.31Å; D166-S168 PolarHBondContact O-N 3.3Å
169L62.6Low60.5Low135 Ų135133 Ų13371%0.70765%0.651SS**THydrogen-bonded Turntrans-96.4-0.2179.8-71.3167.4000113.4D166 E167D166-L169 PolarHBondContact O-N 2.9Å; E167-L169 PolarHBondContact O-N 3.39Å
170R50.9Low60.8Low284 Ų284131.9 Ų131.9100%1.07264%0.642SS**  trans-103.60171.5-83.4-174.4173.8-176.31.3111.7

Retrieved 170 of 170 residues in 39.2 ms (Link to these results)