A0A077ZCA1_TRITR Loading...

Large ribosomal subunit protein uL29m

AlphaFold DB , UniProt , Accession A0A077ZCA1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 222 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M45.8Very low50.1Low235 Ų235121.8 Ų121.8100%1.15862%0.615SS**  033.60-74.4-167.6-103.900113.3
2F47.4Very low50.4Low183 Ų183123.2 Ų123.280%0.80361%0.614SS**  trans-1187.4-174.2-101.2-86.5000115.1
3W44.8Very low50.8Low239 Ų239122.4 Ų122.491%0.90561%0.605SS**  trans-91.1-17.5-171.2-92.915.6000119.2V5W3-V5 PolarHBondContact O-N 3.42Å
4P57.3Low51.1Low100 Ų100118.8 Ų118.865%0.64959%0.587SS**Hα-helixtrans-80.8-17.6-175.829.2-30.8000114.2
5V55.6Low51.3Low99 Ų99119.8 Ų119.860%0.659%0.586SS**Hα-helixtrans-86-32.5-174.5-175.50000112.4W3W3-V5 PolarHBondContact O-N 3.42Å
6F47.2Very low51.3Low155 Ų155122.4 Ų122.468%0.6859%0.588SS**Hα-helixtrans-74.6-39.6-177.7-96-90.4000112.9A8 L9 F10F6-A8 VanDerWaalsContact C-N 3.26Å; F6-A8 PolarHBondContact O-N 2.87Å; F6-L9 PolarHBondContact O-N 3.03Å; F6-L9 VanDerWaalsContact O-N 3.16Å; F6-F10 PolarHBondContact O-N 3.36Å
7A50.1Low51.2Low53 Ų53123.2 Ų123.244%0.43859%0.589SS.*Hα-helixtrans-59.5-37.5174.500000112.1L9 F10 F11A7-L9 VanDerWaalsContact C-N 3.33Å; A7-L9 PolarHBondContact O-N 2.85Å; A7-F10 PolarHBondContact O-N 3.48Å; A7-F11 WeakPolarHBondContact O-CD2 2.83Å; A7-F11 PolarHBondContact O-N 2.94Å
8A52Low51.4Low60 Ų60118.8 Ų118.850%0.49658%0.576SS.*Hα-helixtrans-66.9-31.9178.800000113.3F6 K12F6-A8 VanDerWaalsContact C-N 3.26Å; F6-A8 PolarHBondContact O-N 2.87Å; A8-K12 WeakPolarHBondContact O-CB 3.08Å; A8-K12 PolarHBondContact O-N 3.49Å
9L52.2Low51.2Low108 Ų108115.6 Ų115.657%0.56557%0.567SS**Hα-helixtrans-73.7-38.1178.3-88158.9000112F6 A7 K12 K13F6-L9 PolarHBondContact O-N 3.03Å; F6-L9 VanDerWaalsContact O-N 3.16Å; A7-L9 VanDerWaalsContact C-N 3.33Å; A7-L9 PolarHBondContact O-N 2.85Å; L9-K12 PolarHBondContact O-N 2.65Å; L9-K13 PolarHBondContact O-N 2.83Å
10F49.6Very low51.2Low33 Ų33115.1 Ų115.115%0.14557%0.565CS.*Hα-helixtrans-65.3-46.5178.3-164.5-120.1000111.9F6 A7 K12 K13 M14 E105 E107F6-F10 PolarHBondContact O-N 3.36Å; A7-F10 PolarHBondContact O-N 3.48Å; F10-K12 VanDerWaalsContact C-N 3.29Å; F10-K12 PolarHBondContact O-N 3.38Å; F10-K13 PolarHBondContact O-N 3.39Å; F10-M14 HydrophobicContact CD1-CE 3.77Å; F10-M14 HydrophobicContact CE1-CE 3.05Å; F10-M14 HydrophobicContact CE2-CE 4.31Å; F10-M14 HydrophobicContact CZ-CE 3.37Å; F10-M14 PolarHBondContact O-N 2.87Å; F10-E105 HydrophobicContact CD2-CG 4.41Å; F10-E105 HydrophobicContact CE2-CB 3.83Å; F10-E105 HydrophobicContact CE2-CG 3.34Å; F10-E105 HydrophobicContact CZ-CB 3.94Å; F10-E105 HydrophobicContact CZ-CG 3.67Å; F10-E107 VanDerWaalsContact CE1-OE2 3.23Å; F10-E107 WeakPolarHBondContact CE1-OE2 3.27Å
11F48.7Very low51Low75 Ų75114.7 Ų114.733%0.32957%0.565SS.*Hα-helixtrans-56.8-40.1171.1-91.9-115.5000113.5A7 K13 K15 D58A7-F11 WeakPolarHBondContact O-CD2 2.83Å; A7-F11 PolarHBondContact O-N 2.94Å; F11-K13 VanDerWaalsContact C-N 3.28Å; F11-K13 PolarHBondContact O-N 3.35Å; F11-K15 WeakPolarHBondContact O-CB 3.26Å; F11-K15 WeakPolarHBondContact O-CG 2.86Å; F11-K15 PolarHBondContact O-N 2.84Å; F11-D58 HydrophobicContact CE1-CB 3.99Å; F11-D58 WeakPolarHBondContact CE1-OD1 3.36Å; F11-D58 WeakPolarHBondContact CE1-OD2 2.98Å; F11-D58 HydrophobicContact CZ-CB 3.54Å; F11-D58 WeakPolarHBondContact CZ-OD1 3.39Å
12K54.6Low51.3Low138 Ų138107.3 Ų107.360%0.654%0.541SS*.Hα-helixtrans-68.5-30178.8-133.8171.5-175.4175.30111.5A8 L9 F10 R16A8-K12 WeakPolarHBondContact O-CB 3.08Å; A8-K12 PolarHBondContact O-N 3.49Å; L9-K12 PolarHBondContact O-N 2.65Å; F10-K12 VanDerWaalsContact C-N 3.29Å; F10-K12 PolarHBondContact O-N 3.38Å; K12-R16 VanDerWaalsContact O-CB 3.25Å; K12-R16 WeakPolarHBondContact O-CB 3.38Å; K12-R16 WeakPolarHBondContact O-CG 3.33Å; K12-R16 PolarHBondContact O-N 3.34Å
13K54.6Low51.4Low113 Ų113104.3 Ų104.349%0.49154%0.538SS..Hα-helixtrans-78.2-42.3-179.9-157.7177175.2-163.60111.6L9 F10 F11 R16 F17 E105L9-K13 PolarHBondContact O-N 2.83Å; F10-K13 PolarHBondContact O-N 3.39Å; F11-K13 VanDerWaalsContact C-N 3.28Å; F11-K13 PolarHBondContact O-N 3.35Å; K13-R16 PolarHBondContact O-N 2.97Å; K13-F17 PolarHBondContact O-N 3.28Å; K13-E105 IonicContact NZ-OE1 3.81Å
14M54.8Low51.7Low72 Ų7299.2 Ų99.236%0.35553%0.533SS..Hα-helixtrans-67.2-41.8172.3-79.8-160.5-127.400112.7F10 R16 F17 A18F10-M14 HydrophobicContact CD1-CE 3.77Å; F10-M14 HydrophobicContact CE1-CE 3.05Å; F10-M14 HydrophobicContact CE2-CE 4.31Å; F10-M14 HydrophobicContact CZ-CE 3.37Å; F10-M14 PolarHBondContact O-N 2.87Å; M14-R16 VanDerWaalsContact C-N 3.26Å; M14-R16 PolarHBondContact O-N 2.89Å; M14-F17 PolarHBondContact O-N 3.08Å; M14-A18 WeakPolarHBondContact O-CB 3.42Å; M14-A18 PolarHBondContact O-N 2.91Å
15K54.5Low50.9Low134 Ų13497.5 Ų97.558%0.58353%0.534SS*.Hα-helixtrans-62-33.8172-76-177.2178.5177.60112.3F11 S19F11-K15 WeakPolarHBondContact O-CB 3.26Å; F11-K15 WeakPolarHBondContact O-CG 2.86Å; F11-K15 PolarHBondContact O-N 2.84Å; K15-S19 WeakPolarHBondContact O-CB 3.44Å; K15-S19 PolarHBondContact O-N 2.97Å; K15-S19 PolarHBondContact O-OG 2.86Å
16R51.4Low50.4Low161 Ų161104.1 Ų104.161%0.60855%0.548SS*.Hα-helixtrans-69-42173.2-85.8179.2170.6-179-2.8112.4K12 K13 M14 S19 I20K12-R16 VanDerWaalsContact O-CB 3.25Å; K12-R16 WeakPolarHBondContact O-CB 3.38Å; K12-R16 WeakPolarHBondContact O-CG 3.33Å; K12-R16 PolarHBondContact O-N 3.34Å; K13-R16 PolarHBondContact O-N 2.97Å; M14-R16 VanDerWaalsContact C-N 3.26Å; M14-R16 PolarHBondContact O-N 2.89Å; R16-S19 WeakPolarHBondContact CA-OG 3.21Å; R16-S19 PolarHBondContact O-N 2.92Å; R16-S19 PolarHBondContact O-OG 3.02Å; R16-I20 VanDerWaalsContact O-CB 3.3Å; R16-I20 WeakPolarHBondContact O-CB 3.43Å; R16-I20 WeakPolarHBondContact O-CD1 3.36Å; R16-I20 WeakPolarHBondContact O-CG1 3.47Å; R16-I20 PolarHBondContact O-N 3.17Å
17F49.8Very low50Low137 Ų137107.2 Ų107.260%0.60156%0.556SS**Hα-helixtrans-64.1-41.8174.8-97.4-87.2000111.9K13 M14 S19 I20 L21K13-F17 PolarHBondContact O-N 3.28Å; M14-F17 PolarHBondContact O-N 3.08Å; F17-S19 PolarHBondContact O-N 3.5Å; F17-I20 PolarHBondContact O-N 3.09Å; F17-L21 PolarHBondContact O-N 2.92Å; F17-L21 VanDerWaalsContact O-N 3.11Å
18A54.4Low49.9Very low43 Ų43110.1 Ų110.136%0.35557%0.567SS.*Hα-helixtrans-64-38.5173.100000112.5M14 A22 W57M14-A18 WeakPolarHBondContact O-CB 3.42Å; M14-A18 PolarHBondContact O-N 2.91Å; A18-A22 WeakPolarHBondContact O-CB 3.13Å; A18-A22 PolarHBondContact O-N 3.13Å; A18-W57 HydrophobicContact CB-CH2 4.13Å
19S47.9Very low49.3Very low58 Ų58113.6 Ų113.641%0.40658%0.578SS.*Hα-helixtrans-74.8-32.4177.772.30000113.8K15 R16 F17 L21 A22 T23K15-S19 WeakPolarHBondContact O-CB 3.44Å; K15-S19 PolarHBondContact O-N 2.97Å; K15-S19 PolarHBondContact O-OG 2.86Å; R16-S19 WeakPolarHBondContact CA-OG 3.21Å; R16-S19 PolarHBondContact O-N 2.92Å; R16-S19 PolarHBondContact O-OG 3.02Å; F17-S19 PolarHBondContact O-N 3.5Å; S19-L21 VanDerWaalsContact C-N 3.34Å; S19-A22 PolarHBondContact O-N 3.47Å; S19-T23 PolarHBondContact O-N 3.42Å; S19-T23 PolarHBondContact O-OG1 3.29Å
20I51.8Low48.9Very low105 Ų105113.5 Ų113.554%0.53858%0.578SS.*Hα-helixtrans-68.3-38.5176.9-72.1163000109.5R16 F17R16-I20 VanDerWaalsContact O-CB 3.3Å; R16-I20 WeakPolarHBondContact O-CB 3.43Å; R16-I20 WeakPolarHBondContact O-CD1 3.36Å; R16-I20 WeakPolarHBondContact O-CG1 3.47Å; R16-I20 PolarHBondContact O-N 3.17Å; F17-I20 PolarHBondContact O-N 3.09Å
21L46.2Very low48.4Very low107 Ų107121.5 Ų121.556%0.5661%0.613SS**Hα-helixtrans-70.9-36.3171.5-75.1163.8000112.3F17 S19 T23 V24F17-L21 PolarHBondContact O-N 2.92Å; F17-L21 VanDerWaalsContact O-N 3.11Å; S19-L21 VanDerWaalsContact C-N 3.34Å; L21-T23 PolarHBondContact O-N 3.39Å; L21-V24 PolarHBondContact O-N 3Å
22A52.5Low48.3Very low80 Ų80124.1 Ų124.166%0.66163%0.626SS**Hα-helixtrans-67.3-17.9178.100000114.6A18 S19A18-A22 WeakPolarHBondContact O-CB 3.13Å; A18-A22 PolarHBondContact O-N 3.13Å; S19-A22 PolarHBondContact O-N 3.47Å
23T49.4Very low47.8Very low121 Ų121122.8 Ų122.874%0.74263%0.629SS**THydrogen-bonded Turntrans-94.8-7.4-176.6-50.40000113.1S19 L21S19-T23 PolarHBondContact O-N 3.42Å; S19-T23 PolarHBondContact O-OG1 3.29Å; L21-T23 PolarHBondContact O-N 3.39Å
24V50.6Low47.2Very low131 Ų131121.7 Ų121.779%0.79463%0.634SS**SBendtrans-110.635.2176.2-167.50000110.9L21L21-V24 PolarHBondContact O-N 3Å
25G41.3Very low46.6Very low65 Ų65125.9 Ų125.967%0.6766%0.657SS**  trans-104.461.9176.200000112.5R27G25-R27 PolarHBondContact O-N 3.14Å
26R44.6Very low46.2Very low238 Ų238122.4 Ų122.490%0.89865%0.654SS**  trans-70.5101.7172.4-162.9-179.9-82.9-153.4-0.9108.2V28R26-V28 PolarHBondContact O-N 3.17Å
27R38.8Very low46Very low220 Ų220122.4 Ų122.483%0.8367%0.665SS**  trans-31.597.2171.8-177.6-177-88169.9-7.8112.8G25G25-R27 PolarHBondContact O-N 3.14Å
28V47.7Very low46.1Very low113 Ų113123.7 Ų123.769%0.68567%0.671SS**  trans-99.3106.9157.71790000106.5R26 N30R26-V28 PolarHBondContact O-N 3.17Å; V28-N30 HydrophobicContact CG1-CB 4.39Å; V28-N30 PolarHBondContact O-N 3.31Å
29N40.1Very low45.9Very low134 Ų134126.5 Ų126.572%0.71768%0.677SS**  trans-70.374.1169.9-83.3-16.8000109.3K31N29-K31 PolarHBondContact O-N 3.15Å
30N44.4Very low46.2Very low106 Ų106127.9 Ų127.957%0.56769%0.687SS**  trans-84.297165.5-97.44.8000108.5V28 H32V28-N30 HydrophobicContact CG1-CB 4.39Å; V28-N30 PolarHBondContact O-N 3.31Å; N30-H32 PolarHBondContact ND2-NE2 3.29Å; N30-H32 VanDerWaalsContact ND2-NE2 3.13Å; N30-H32 PolarHBondContact O-N 2.78Å
31K39.3Very low46.4Very low201 Ų201124.8 Ų124.887%0.87467%0.674SS**  trans-66.375.1159.1-65.2179.9-178.7177.50108N29 V33N29-K31 PolarHBondContact O-N 3.15Å; K31-V33 PolarHBondContact O-N 3.42Å; K31-V33 VanDerWaalsContact O-N 3.17Å
32H45.2Very low47Very low130 Ų130123.7 Ų123.760%0.60268%0.676SS**  trans-75.6101.9163.1-81.6-71.4000107.1N30 C34N30-H32 PolarHBondContact ND2-NE2 3.29Å; N30-H32 VanDerWaalsContact ND2-NE2 3.13Å; N30-H32 PolarHBondContact O-N 2.78Å; H32-C34 PolarHBondContact O-N 3.37Å; H32-C34 VanDerWaalsContact O-N 3.08Å
33V44.6Very low47.3Very low110 Ų110123.5 Ų123.567%0.66767%0.668SS**  trans-59.2110163.4-173.90000106.3K31 L35K31-V33 PolarHBondContact O-N 3.42Å; K31-V33 VanDerWaalsContact O-N 3.17Å; V33-L35 HydrophobicContact CB-CG 4.34Å; V33-L35 HydrophobicContact CG1-CD1 4.37Å; V33-L35 HydrophobicContact CG1-CD2 3.96Å; V33-L35 HydrophobicContact CG1-CG 3.69Å; V33-L35 PolarHBondContact O-N 3.41Å
34C42.2Very low47.7Very low89 Ų89122.7 Ų122.760%0.60166%0.659SS**  trans-72.581.8172.5-19.60000107.5H32 A36H32-C34 PolarHBondContact O-N 3.37Å; H32-C34 VanDerWaalsContact O-N 3.08Å; C34-A36 PolarHBondContact O-N 2.66Å
35L42.1Very low48.5Very low160 Ų160124.1 Ų124.184%0.83866%0.661SS**  trans-75.464.5173.6-73.5164.5000109.8V33V33-L35 HydrophobicContact CB-CG 4.34Å; V33-L35 HydrophobicContact CG1-CD1 4.37Å; V33-L35 HydrophobicContact CG1-CD2 3.96Å; V33-L35 HydrophobicContact CG1-CG 3.69Å; V33-L35 PolarHBondContact O-N 3.41Å
36A46.9Very low50.3Low62 Ų62125.6 Ų125.651%0.51265%0.654SS.*SBendtrans-176.4111.3161.600000109.4C34 F38C34-A36 PolarHBondContact O-N 2.66Å; A36-F38 HydrophobicContact CB-CD2 4.07Å; A36-F38 PolarHBondContact O-N 2.66Å
37N47.2Very low52.3Low160 Ų160119.2 Ų119.286%0.85664%0.637SS**THydrogen-bonded Turntrans-70.535.1-175.7-105.4-5.9000115.1
38F51.6Low54.6Low165 Ų165111.1 Ų111.172%0.72461%0.614SS**THydrogen-bonded Turntrans-97.6-5.5-177-66.1-65.4000114.9A36A36-F38 HydrophobicContact CB-CD2 4.07Å; A36-F38 PolarHBondContact O-N 2.66Å
39H49Very low56.6Low101 Ų101109 Ų10947%0.46860%0.597SS.*  trans-109.2133.1-179.2-156.5-105.2000111.6S41H39-S41 PolarHBondContact CE1-O 3.21Å; H39-S41 PolarHBondContact CE1-OG 3.19Å; H39-S41 PolarHBondContact ND1-N 2.84Å; H39-S41 PolarHBondContact ND1-O 3.11Å; H39-S41 PolarHBondContact ND1-OG 3.41Å; H39-S41 PolarHBondContact NE2-OG 3.17Å
40S54.1Low59Low88 Ų88107 Ų10762%0.61558%0.582SS**  trans-98.1-5.4177.954.30000114.3
41S55.9Low61.3Low39 Ų39106.7 Ų106.727%0.27358%0.575SS.*SBendtrans-108.5153.5174.527.80000111.9H39 C43 K90H39-S41 PolarHBondContact CE1-O 3.21Å; H39-S41 PolarHBondContact CE1-OG 3.19Å; H39-S41 PolarHBondContact ND1-N 2.84Å; H39-S41 PolarHBondContact ND1-O 3.11Å; H39-S41 PolarHBondContact ND1-OG 3.41Å; H39-S41 PolarHBondContact NE2-OG 3.17Å; S41-C43 PolarHBondContact O-N 3.43Å; S41-K90 PolarHBondContact OG-NZ 2.98Å
42S59.8Low63.8Low85 Ų8597.8 Ų97.859%0.59454%0.537SS*.  trans-59.1129.316946.80000109.8L44S42-L44 VanDerWaalsContact C-N 3.26Å; S42-L44 PolarHBondContact O-N 2.98Å
43C57.8Low65.9Low75 Ų7594.1 Ų94.151%0.50753%0.527SS..  trans-68.585.1173.7-570000109.5S41 L45S41-C43 PolarHBondContact O-N 3.43Å; C43-L45 PolarHBondContact O-N 3.29Å
44L59.3Low67.9Low104 Ų10493.4 Ų93.455%0.54552%0.524SS..  trans-79.1109.8164-63177.8000106S42 D46S42-L44 VanDerWaalsContact C-N 3.26Å; S42-L44 PolarHBondContact O-N 2.98Å; L44-D46 PolarHBondContact O-N 3.02Å
45L66.2Low70.1Confident161 Ų16193.2 Ų93.284%0.84352%0.524SS*.  trans-74.142.2175.4-66.2168.7000111C43C43-L45 PolarHBondContact O-N 3.29Å
46D79.6Confident72.3Confident97 Ų9787.2 Ų87.252%0.51949%0.493SS..SBendtrans-130.5154.6-171.7-177.633.9000110.4L44 S48L44-D46 PolarHBondContact O-N 3.02Å; D46-S48 PolarHBondContact O-N 2.77Å; D46-S48 VanDerWaalsContact OD2-CB 3.24Å; D46-S48 WeakPolarHBondContact OD2-CB 3.25Å; D46-S48 PolarHBondContact OD2-OG 2.85Å
47L87.5Confident74Confident104 Ų10488.4 Ų88.455%0.54548%0.484SS..G310 helixtrans-76.22.3-179.8-63.7176.1000112.8E49 F50 F51L47-E49 PolarHBondContact O-N 2.83Å; L47-F50 HydrophobicContact CD2-CD2 4.2Å; L47-F50 HydrophobicContact CD2-CE2 4.12Å; L47-F50 PolarHBondContact O-N 3Å; L47-F50 VanDerWaalsContact O-N 3.16Å; L47-F51 WeakPolarHBondContact O-CD2 3.33Å; L47-F51 WeakPolarHBondContact O-CE2 3.21Å
48S86.6Confident75.6Confident49 Ų4985.1 Ų85.134%0.34347%0.466SS..G310 helixtrans-61.2-27-178.839.10000113.8D46 F50 F51D46-S48 PolarHBondContact O-N 2.77Å; D46-S48 VanDerWaalsContact OD2-CB 3.24Å; D46-S48 WeakPolarHBondContact OD2-CB 3.25Å; D46-S48 PolarHBondContact OD2-OG 2.85Å; S48-F50 PolarHBondContact O-N 3.4Å; S48-F51 PolarHBondContact O-N 3.23Å; S48-F51 VanDerWaalsContact O-N 3.15Å
49E88.1Confident77.1Confident69 Ų6981.2 Ų81.232%0.32245%0.45SS..G310 helixtrans-67.6-14.7177.3-60.7-162.3150.200113.8L47 F51 K90L47-E49 PolarHBondContact O-N 2.83Å; E49-F51 VanDerWaalsContact C-N 3.32Å; E49-K90 VanDerWaalsContact CD-NZ 3.25Å; E49-K90 IonicContact OE1-NZ 3.01Å; E49-K90 PolarHBondContact OE1-NZ 3.44Å; E49-K90 WeakPolarHBondContact OE2-CD 3.42Å; E49-K90 IonicContact OE2-NZ 2.84Å; E49-K90 PolarHBondContact OE2-NZ 2.73Å
50F92.4Very high78.6Confident91 Ų9184.5 Ų84.540%0.39947%0.466SS..G310 helixtrans-83.4-6.5174.9-71-83000113.6L47 S48 N93 M94L47-F50 HydrophobicContact CD2-CD2 4.2Å; L47-F50 HydrophobicContact CD2-CE2 4.12Å; L47-F50 PolarHBondContact O-N 3Å; L47-F50 VanDerWaalsContact O-N 3.16Å; S48-F50 PolarHBondContact O-N 3.4Å; F50-N93 HydrophobicContact CD1-CB 4.41Å; F50-N93 HydrophobicContact CE1-CB 4.3Å; F50-M94 WeakPolarHBondContact O-CA 3.4Å
51F92Very high80.1Confident100 Ų10086 Ų8644%0.43947%0.471SS..SBendtrans-120.9145.8-177.6-55.2-76.6000110.2L47 S48 E49 T97L47-F51 WeakPolarHBondContact O-CD2 3.33Å; L47-F51 WeakPolarHBondContact O-CE2 3.21Å; S48-F51 PolarHBondContact O-N 3.23Å; S48-F51 VanDerWaalsContact O-N 3.15Å; E49-F51 VanDerWaalsContact C-N 3.32Å; F51-T97 HydrophobicContact CD1-CG2 4.41Å; F51-T97 HydrophobicContact CE1-CG2 3.99Å
52D90.8Very high81.6Confident14 Ų1484.9 Ų84.98%0.07546%0.462CS..  trans-65161.4172.7-156.8-21.5000109.8N56 W57 M94 M98 R114D52-N56 HydrophobicContact CB-CB 4.45Å; D52-N56 PolarHBondContact OD1-ND2 3.23Å; D52-N56 PolarHBondContact OD2-ND2 3.05Å; D52-W57 PolarHBondContact O-NE1 3.13Å; D52-M94 VanDerWaalsContact CA-SD 3.55Å; D52-M94 HydrophobicContact CB-SD 3.98Å; D52-M98 HydrophobicContact CB-CE 4.33Å; D52-M98 HydrophobicContact CB-SD 3.76Å; D52-R114 IonicContact OD2-CZ 3.01Å; D52-R114 IonicContact OD2-NH1 2.66Å; D52-R114 PolarHBondContact OD2-NH1 3.31Å
53S89.2Confident83Confident54 Ų5490.6 Ų90.638%0.37848%0.477SS..  trans-52.7138.8175.368.60000110.6S55 N56S53-S55 PolarHBondContact O-N 3.31Å; S53-N56 PolarHBondContact O-N 3.26Å; S53-N56 VanDerWaalsContact OG-CG 3.29Å; S53-N56 PolarHBondContact OG-ND2 3.21Å
54P88.1Confident84.6Confident94 Ų9489.1 Ų89.161%0.6147%0.466SS*.THydrogen-bonded Turntrans-57.2-20.1-177.3-28.435.1000115.1N56 W57P54-N56 VanDerWaalsContact C-N 3.28Å; P54-N56 PolarHBondContact O-N 3.46Å; P54-W57 HydrophobicContact CB-CD2 4.4Å; P54-W57 HydrophobicContact CB-CE3 4.5Å; P54-W57 HydrophobicContact CB-CH2 4.3Å; P54-W57 HydrophobicContact CB-CZ2 4.18Å; P54-W57 HydrophobicContact CB-CZ3 4.46Å; P54-W57 HydrophobicContact CG-CH2 4.29Å; P54-W57 HydrophobicContact CG-CZ2 4Å
55S88.2Confident86.2Confident86 Ų8687.2 Ų87.260%0.60147%0.471SS*.THydrogen-bonded Turntrans-71.5-21175.3-171.50000113.6S53 Q59S53-S55 PolarHBondContact O-N 3.31Å; S55-Q59 PolarHBondContact O-NE2 2.98Å
56N87.2Confident87.6Confident34 Ų3485.2 Ų85.218%0.18245%0.452CS..THydrogen-bonded Turntrans-96.7-11.3-174.8-67.7-14.2000113.2D52 S53 P54 D58 Q59 V62D52-N56 HydrophobicContact CB-CB 4.45Å; D52-N56 PolarHBondContact OD1-ND2 3.23Å; D52-N56 PolarHBondContact OD2-ND2 3.05Å; S53-N56 PolarHBondContact O-N 3.26Å; S53-N56 VanDerWaalsContact OG-CG 3.29Å; S53-N56 PolarHBondContact OG-ND2 3.21Å; P54-N56 VanDerWaalsContact C-N 3.28Å; P54-N56 PolarHBondContact O-N 3.46Å; N56-D58 PolarHBondContact O-N 3.02Å; N56-D58 VanDerWaalsContact O-N 3.11Å; N56-Q59 PolarHBondContact O-N 3.16Å; N56-Q59 VanDerWaalsContact O-N 3.17Å; N56-V62 HydrophobicContact CB-CG2 4.35Å
57W84.2Confident88.4Confident87 Ų8782 Ų8233%0.3344%0.436SS..THydrogen-bonded Turntrans-59.2-28.5-175-65.2-6.2000113.4A18 D52 P54A18-W57 HydrophobicContact CB-CH2 4.13Å; D52-W57 PolarHBondContact O-NE1 3.13Å; P54-W57 HydrophobicContact CB-CD2 4.4Å; P54-W57 HydrophobicContact CB-CE3 4.5Å; P54-W57 HydrophobicContact CB-CH2 4.3Å; P54-W57 HydrophobicContact CB-CZ2 4.18Å; P54-W57 HydrophobicContact CB-CZ3 4.46Å; P54-W57 HydrophobicContact CG-CH2 4.29Å; P54-W57 HydrophobicContact CG-CZ2 4Å
58D80.1Confident88.9Confident91 Ų9181.3 Ų81.349%0.48743%0.426SS..THydrogen-bonded Turntrans-98.3-6.1-172.2-52.5-15.3000112.3F11 N56F11-D58 HydrophobicContact CE1-CB 3.99Å; F11-D58 WeakPolarHBondContact CE1-OD1 3.36Å; F11-D58 WeakPolarHBondContact CE1-OD2 2.98Å; F11-D58 HydrophobicContact CZ-CB 3.54Å; F11-D58 WeakPolarHBondContact CZ-OD1 3.39Å; N56-D58 PolarHBondContact O-N 3.02Å; N56-D58 VanDerWaalsContact O-N 3.11Å
59Q83.6Confident89.4Confident83 Ų8385.1 Ų85.139%0.38843%0.433SS..  trans-95.1120.9-171.6-61.9-174.70.700110.7S55 N56 V61 V62S55-Q59 PolarHBondContact O-NE2 2.98Å; N56-Q59 PolarHBondContact O-N 3.16Å; N56-Q59 VanDerWaalsContact O-N 3.17Å; Q59-V61 VanDerWaalsContact C-N 3.3Å; Q59-V61 PolarHBondContact O-N 3.01Å; Q59-V62 HydrophobicContact CB-CG2 4.5Å
60Q79.7Confident89.9Confident170 Ų17084.4 Ų84.479%0.79443%0.429SS*.SBendtrans-69.9-29.8173.4-68.2-172-22.600112.5
61V85.7Confident90.1Very high118 Ų11885.2 Ų85.272%0.71543%0.434SS*.  trans-121.3101.2-178.2-1750000109.3Q59Q59-V61 VanDerWaalsContact C-N 3.3Å; Q59-V61 PolarHBondContact O-N 3.01Å
62V87.2Confident90.4Very high16 Ų1683.9 Ų83.910%0.09743%0.429CS..  trans-88.2127.2170.5-177.20000108.7N56 Q59 T64N56-V62 HydrophobicContact CB-CG2 4.35Å; Q59-V62 HydrophobicContact CB-CG2 4.5Å; V62-T64 PolarHBondContact O-N 2.86Å; V62-T64 VanDerWaalsContact O-N 3.14Å
63K88.4Confident90.7Very high206 Ų20683.2 Ų83.290%0.89643%0.426SS*.  trans-65.5114.4176.4-68.6-178.3-178.8177.20109.3
64T91.5Very high91.1Very high44 Ų4485.5 Ų85.527%0.2743%0.426SS..  trans-112.4144.3179.551.40000111V62 R114 K117V62-T64 PolarHBondContact O-N 2.86Å; V62-T64 VanDerWaalsContact O-N 3.14Å; T64-R114 HydrophobicContact CG2-CB 3.87Å; T64-R114 VanDerWaalsContact CG2-CD 3.5Å; T64-R114 HydrophobicContact CG2-CG 3.52Å; T64-K117 PolarHBondContact OG1-NZ 3.5Å
65G94Very high91.5Very high63 Ų6388.1 Ų88.165%0.64943%0.434SS*.  trans-75.5-178.9176.700000113.2
66R95.4Very high92Very high120 Ų12087.8 Ų87.845%0.45342%0.421SS..PPolyproline II helixtrans-76.7145.4172.8-176.4-171.8157.8-70.4-54.4110.3R69 E72R66-R69 VanDerWaalsContact NE-CZ 3.33Å; R66-R69 VanDerWaalsContact NH1-CG 3.35Å; R66-R69 VanDerWaalsContact NH2-NE 3.11Å; R66-E72 IonicContact NH1-OE1 3.09Å; R66-E72 PolarHBondContact NH1-OE1 3.25Å; R66-E72 IonicContact NH1-OE2 3.49Å; R66-E72 PolarHBondContact NH1-OE2 3.15Å; R66-E72 VanDerWaalsContact NH1-OE2 3.09Å
67P97Very high92.4Very high29 Ų2989.2 Ų89.219%0.18843%0.434CS..PPolyproline II helixtrans-67.5154.9174.228.8-35.8000112R69 K117 I120 S121P67-R69 PolarHBondContact O-N 2.89Å; P67-K117 HydrophobicContact CB-CB 4.24Å; P67-K117 WeakPolarHBondContact CB-O 3.45Å; P67-I120 HydrophobicContact CB-CB 4.4Å; P67-I120 HydrophobicContact CB-CG2 4.11Å; P67-I120 HydrophobicContact CG-CG2 4.42Å; P67-S121 WeakPolarHBondContact CA-OG 3.24Å; P67-S121 WeakPolarHBondContact CB-OG 3.44Å
68W97.8Very high93Very high89 Ų8989.9 Ų89.934%0.33744%0.444SS..PPolyproline II helixtrans-63130.8179.3-73.791.8000112.2E72 L73 L84 S121 N124W68-E72 HydrophobicContact CE3-CB 4.37Å; W68-L73 HydrophobicContact CB-CD1 3.96Å; W68-L73 HydrophobicContact CB-CD2 4.17Å; W68-L73 HydrophobicContact CB-CG 4.14Å; W68-L73 HydrophobicContact CD2-CD2 4.07Å; W68-L73 HydrophobicContact CE3-CD2 3.81Å; W68-L73 HydrophobicContact CE3-CG 4.38Å; W68-L73 HydrophobicContact CG-CD2 4.26Å; W68-L84 HydrophobicContact CD2-CD2 4.05Å; W68-L84 HydrophobicContact CE3-CD2 4.43Å; W68-L84 HydrophobicContact CH2-CD2 4.44Å; W68-L84 HydrophobicContact CZ2-CD1 3.86Å; W68-L84 HydrophobicContact CZ2-CD2 4.06Å; W68-S121 PolarHBondContact N-OG 3.21Å; W68-N124 PolarHBondContact O-ND2 3.33Å
69R97.8Very high93.8Very high129 Ų12989.3 Ų89.349%0.48745%0.447SS..PPolyproline II helixtrans-81.9153.5170.7-65.3-172.9172.2152-0.2111.6R66 P67 E71 E72 L73R66-R69 VanDerWaalsContact NE-CZ 3.33Å; R66-R69 VanDerWaalsContact NH1-CG 3.35Å; R66-R69 VanDerWaalsContact NH2-NE 3.11Å; P67-R69 PolarHBondContact O-N 2.89Å; R69-E71 VanDerWaalsContact C-N 3.27Å; R69-E71 VanDerWaalsContact CB-OE2 3.31Å; R69-E71 WeakPolarHBondContact CB-OE2 3.3Å; R69-E71 PolarHBondContact O-N 3.21Å; R69-E72 HydrophobicContact CB-CB 4.45Å; R69-E72 HydrophobicContact CB-CG 4.13Å; R69-E72 PolarHBondContact N-OE2 3.26Å; R69-E72 PolarHBondContact O-N 2.82Å; R69-L73 VanDerWaalsContact O-CG 3.26Å; R69-L73 WeakPolarHBondContact O-CG 3.33Å; R69-L73 PolarHBondContact O-N 3.35Å; R69-L73 VanDerWaalsContact O-N 3.13Å
70K97.6Very high94.4Very high55 Ų5588.3 Ų88.324%0.23944%0.444CS..Hα-helixtrans-59.1-39.8169.8-63.2-165.7-74.7-169.90111.7E72 L73 R74 N124 E127 V128K70-E72 VanDerWaalsContact C-N 3.34Å; K70-E72 PolarHBondContact O-N 2.99Å; K70-L73 PolarHBondContact O-N 3.28Å; K70-R74 VanDerWaalsContact O-CG 3.29Å; K70-R74 WeakPolarHBondContact O-CG 3.09Å; K70-R74 PolarHBondContact O-N 2.88Å; K70-N124 HydrophobicContact CG-CB 3.87Å; K70-E127 HydrophobicContact CD-CG 4.39Å; K70-E127 VanDerWaalsContact CD-OE2 3.25Å; K70-E127 WeakPolarHBondContact CD-OE2 3.45Å; K70-E127 IonicContact NZ-OE1 2.68Å; K70-E127 PolarHBondContact NZ-OE1 2.95Å; K70-E127 IonicContact NZ-OE2 2.88Å; K70-E127 PolarHBondContact NZ-OE2 3.09Å; K70-V128 HydrophobicContact CB-CG2 4.28Å
71E97.4Very high95.3Very high107 Ų10780.3 Ų80.350%0.541%0.407SS..Hα-helixtrans-62.1-40.9179.4-61.870.7-133.700112.2R69 R74R69-E71 VanDerWaalsContact C-N 3.27Å; R69-E71 VanDerWaalsContact CB-OE2 3.31Å; R69-E71 WeakPolarHBondContact CB-OE2 3.3Å; R69-E71 PolarHBondContact O-N 3.21Å; E71-R74 IonicContact OE1-NH1 3.04Å; E71-R74 PolarHBondContact OE1-NH1 3.5Å
72E97.3Very high95.8Very high72 Ų7280.1 Ų80.134%0.33640%0.398SS..Hα-helixtrans-67.4-41.6178.2-65.9162172.300111.1R66 W68 R69 K70 I75R66-E72 IonicContact NH1-OE1 3.09Å; R66-E72 PolarHBondContact NH1-OE1 3.25Å; R66-E72 IonicContact NH1-OE2 3.49Å; R66-E72 PolarHBondContact NH1-OE2 3.15Å; R66-E72 VanDerWaalsContact NH1-OE2 3.09Å; W68-E72 HydrophobicContact CE3-CB 4.37Å; R69-E72 HydrophobicContact CB-CB 4.45Å; R69-E72 HydrophobicContact CB-CG 4.13Å; R69-E72 PolarHBondContact N-OE2 3.26Å; R69-E72 PolarHBondContact O-N 2.82Å; K70-E72 VanDerWaalsContact C-N 3.34Å; K70-E72 PolarHBondContact O-N 2.99Å; E72-I75 PolarHBondContact O-N 2.73Å
73L97.7Very high96.2Very high0 Ų083 Ų830%041%0.409CS..Hα-helixtrans-70.4-31.8-179.6-65.1169.9000112.5W68 R69 K70 I75 K76 L81 L84 N124 L125 V128 R132W68-L73 HydrophobicContact CB-CD1 3.96Å; W68-L73 HydrophobicContact CB-CD2 4.17Å; W68-L73 HydrophobicContact CB-CG 4.14Å; W68-L73 HydrophobicContact CD2-CD2 4.07Å; W68-L73 HydrophobicContact CE3-CD2 3.81Å; W68-L73 HydrophobicContact CE3-CG 4.38Å; W68-L73 HydrophobicContact CG-CD2 4.26Å; R69-L73 VanDerWaalsContact O-CG 3.26Å; R69-L73 WeakPolarHBondContact O-CG 3.33Å; R69-L73 PolarHBondContact O-N 3.35Å; R69-L73 VanDerWaalsContact O-N 3.13Å; K70-L73 PolarHBondContact O-N 3.28Å; L73-I75 PolarHBondContact O-N 3.21Å; L73-K76 PolarHBondContact O-N 2.98Å; L73-K76 VanDerWaalsContact O-N 3.15Å; L73-L81 HydrophobicContact CB-CD2 4.18Å; L73-L81 HydrophobicContact CD2-CD2 3.72Å; L73-L84 HydrophobicContact CD2-CD2 3.55Å; L73-N124 HydrophobicContact CD1-CB 3.91Å; L73-L125 HydrophobicContact CD1-CB 4.17Å; L73-V128 HydrophobicContact CB-CG2 4.09Å; L73-R132 PolarHBondContact O-NH2 3.31Å
74R97.4Very high96.6Very high102 Ų10274.3 Ų74.339%0.38537%0.372SS..Hα-helixtrans-63.2-26.9176.9-77.7177.7-168.5125.70.1113.2K70 E71 V128 E131 R132K70-R74 VanDerWaalsContact O-CG 3.29Å; K70-R74 WeakPolarHBondContact O-CG 3.09Å; K70-R74 PolarHBondContact O-N 2.88Å; E71-R74 IonicContact OE1-NH1 3.04Å; E71-R74 PolarHBondContact OE1-NH1 3.5Å; R74-V128 HydrophobicContact CG-CG1 4.08Å; R74-V128 HydrophobicContact CG-CG2 3.97Å; R74-E131 IonicContact CZ-OE1 2.86Å; R74-E131 IonicContact CZ-OE2 3.45Å; R74-E131 IonicContact NE-OE2 2.94Å; R74-E131 PolarHBondContact NE-OE2 2.88Å; R74-E131 IonicContact NH2-OE1 3.94Å; R74-E131 PolarHBondContact NH2-OE1 3.43Å; R74-E131 IonicContact NH2-OE2 3.65Å; R74-E131 PolarHBondContact NH2-OE2 2.86Å; R74-R132 PolarHBondContact O-NH2 3.49Å
75I97.3Very high96.9Very high150 Ų15076 Ų7677%0.76937%0.374SS*.Hα-helixtrans-78.9-21.9178.8-58.6165.1000111.4E72 L73E72-I75 PolarHBondContact O-N 2.73Å; L73-I75 PolarHBondContact O-N 3.21Å
76K97.2Very high96.9Very high79 Ų7977.8 Ų77.834%0.34336%0.364SS..SBendtrans-79.4147.9-176-60.3-54.3-162.5153.20113.2L73 D80 L81 R132L73-K76 PolarHBondContact O-N 2.98Å; L73-K76 VanDerWaalsContact O-N 3.15Å; K76-D80 HydrophobicContact CB-CB 4.46Å; K76-D80 WeakPolarHBondContact CD-OD2 3.43Å; K76-D80 IonicContact NZ-OD2 3.34Å; K76-D80 PolarHBondContact NZ-OD2 2.94Å; K76-L81 HydrophobicContact CB-CD2 3.84Å; K76-L81 HydrophobicContact CB-CG 4.15Å; K76-L81 HydrophobicContact CG-CD2 4.45Å; K76-R132 PolarHBondContact O-NH1 3.34Å; K76-R132 PolarHBondContact O-NH2 3.11Å
77S96.7Very high96.9Very high63 Ų6375.4 Ų75.444%0.44136%0.363SS..  trans-68.2156.5173.767.60000111.5S79 D80 L81S77-S79 PolarHBondContact O-N 3.44Å; S77-S79 PolarHBondContact OG-OG 3.23Å; S77-S79 VanDerWaalsContact OG-OG 3.05Å; S77-D80 PolarHBondContact O-N 3.2Å; S77-D80 VanDerWaalsContact O-N 3.17Å; S77-D80 WeakPolarHBondContact OG-CB 3.35Å; S77-D80 PolarHBondContact OG-N 3.13Å; S77-L81 WeakPolarHBondContact O-CG 3.33Å; S77-L81 PolarHBondContact O-N 2.84Å
78N96.5Very high96.9Very high101 Ų10174.7 Ų74.754%0.5436%0.357SS..Hα-helixtrans-60.4-32.9176.5-72.2-22.2000112.4H82 R132N78-H82 WeakPolarHBondContact O-CB 3.31Å; N78-H82 PolarHBondContact O-N 2.82Å; N78-R132 WeakPolarHBondContact OD1-CD 3.4Å; N78-R132 PolarHBondContact OD1-NH1 3.42Å
79S96.8Very high96.9Very high79 Ų7972.7 Ų72.755%0.55235%0.353SS*.Hα-helixtrans-67.9-37.5176.254.80000112.6S77 K83S77-S79 PolarHBondContact O-N 3.44Å; S77-S79 PolarHBondContact OG-OG 3.23Å; S77-S79 VanDerWaalsContact OG-OG 3.05Å; S79-K83 WeakPolarHBondContact O-CG 3.47Å; S79-K83 PolarHBondContact O-N 2.95Å
80D97Very high96.7Very high62 Ų6269.3 Ų69.333%0.33234%0.341SS..Hα-helixtrans-71-41.4175.4-163.535.7000111.1K76 S77 H82 K83 L84K76-D80 HydrophobicContact CB-CB 4.46Å; K76-D80 WeakPolarHBondContact CD-OD2 3.43Å; K76-D80 IonicContact NZ-OD2 3.34Å; K76-D80 PolarHBondContact NZ-OD2 2.94Å; S77-D80 PolarHBondContact O-N 3.2Å; S77-D80 VanDerWaalsContact O-N 3.17Å; S77-D80 WeakPolarHBondContact OG-CB 3.35Å; S77-D80 PolarHBondContact OG-N 3.13Å; D80-H82 VanDerWaalsContact C-N 3.32Å; D80-H82 PolarHBondContact O-N 3.45Å; D80-K83 PolarHBondContact O-N 3.16Å; D80-L84 WeakPolarHBondContact O-CB 3.46Å; D80-L84 PolarHBondContact O-N 3.49Å
81L97.3Very high96.6Very high2 Ų269.2 Ų69.21%0.0134%0.342CS..Hα-helixtrans-60.4-40.8173.8-68-173.6000112.4L73 K76 S77 L84 W85 L125 V128 V129L73-L81 HydrophobicContact CB-CD2 4.18Å; L73-L81 HydrophobicContact CD2-CD2 3.72Å; K76-L81 HydrophobicContact CB-CD2 3.84Å; K76-L81 HydrophobicContact CB-CG 4.15Å; K76-L81 HydrophobicContact CG-CD2 4.45Å; S77-L81 WeakPolarHBondContact O-CG 3.33Å; S77-L81 PolarHBondContact O-N 2.84Å; L81-L84 PolarHBondContact O-N 3.34Å; L81-W85 PolarHBondContact O-N 3.04Å; L81-L125 HydrophobicContact CD2-CG 4.41Å; L81-V128 HydrophobicContact CD1-CG1 4.17Å; L81-V129 HydrophobicContact CD1-CG2 4.07Å
82H96.8Very high96.6Very high114 Ų11468.8 Ų68.853%0.52834%0.336SS..Hα-helixtrans-63.2-42176.7-175.7-103.5000111.7N78 D80 W85 F86N78-H82 WeakPolarHBondContact O-CB 3.31Å; N78-H82 PolarHBondContact O-N 2.82Å; D80-H82 VanDerWaalsContact C-N 3.32Å; D80-H82 PolarHBondContact O-N 3.45Å; H82-W85 WeakPolarHBondContact O-CB 3.29Å; H82-W85 PolarHBondContact O-N 3.14Å; H82-F86 AromaticContact CE1-CE2 3.52Å; H82-F86 AromaticContact NE2-CE2 3.58Å; H82-F86 VanDerWaalsContact O-CD2 3.27Å; H82-F86 WeakPolarHBondContact O-CD2 3.39Å
83K95.4Very high96.5Very high76 Ų7668 Ų6833%0.3333%0.334SS..Hα-helixtrans-64.2-45174.2-69.5173.7-178.1-175.90111.5S79 D80 W85 F86 V87S79-K83 WeakPolarHBondContact O-CG 3.47Å; S79-K83 PolarHBondContact O-N 2.95Å; D80-K83 PolarHBondContact O-N 3.16Å; K83-W85 VanDerWaalsContact C-N 3.28Å; K83-W85 PolarHBondContact O-N 3.08Å; K83-F86 PolarHBondContact O-N 3.3Å; K83-F86 VanDerWaalsContact O-N 3.16Å; K83-V87 PolarHBondContact O-N 2.84Å; K83-V87 VanDerWaalsContact O-N 3.13Å
84L96.8Very high96.4Very high24 Ų2468.7 Ų68.713%0.12634%0.337CS..Hα-helixtrans-60.1-38.2178.8-179.760.1000112W68 L73 D80 L81 F86 V87 L88 L125W68-L84 HydrophobicContact CD2-CD2 4.05Å; W68-L84 HydrophobicContact CE3-CD2 4.43Å; W68-L84 HydrophobicContact CH2-CD2 4.44Å; W68-L84 HydrophobicContact CZ2-CD1 3.86Å; W68-L84 HydrophobicContact CZ2-CD2 4.06Å; L73-L84 HydrophobicContact CD2-CD2 3.55Å; D80-L84 WeakPolarHBondContact O-CB 3.46Å; D80-L84 PolarHBondContact O-N 3.49Å; L81-L84 PolarHBondContact O-N 3.34Å; L84-F86 VanDerWaalsContact C-N 3.31Å; L84-F86 PolarHBondContact O-N 3.41Å; L84-V87 PolarHBondContact O-N 2.75Å; L84-L88 HydrophobicContact CD1-CD1 4.42Å; L84-L88 HydrophobicContact CD1-CG 4.21Å; L84-L88 HydrophobicContact CG-CD1 4.17Å; L84-L88 HydrophobicContact CG-CG 4.4Å; L84-L88 WeakPolarHBondContact O-CG 3.43Å; L84-L88 PolarHBondContact O-N 3.37Å; L84-L125 HydrophobicContact CB-CD1 4.28Å; L84-L125 HydrophobicContact CD2-CD1 4.14Å; L84-L125 HydrophobicContact CG-CD1 4.07Å
85W97.1Very high96.3Very high80 Ų8063.9 Ų63.930%0.30332%0.319SS..Hα-helixtrans-55.2-46.1175177.3-96.3000112L81 H82 K83 L88 L89 M122 L125L81-W85 PolarHBondContact O-N 3.04Å; H82-W85 WeakPolarHBondContact O-CB 3.29Å; H82-W85 PolarHBondContact O-N 3.14Å; K83-W85 VanDerWaalsContact C-N 3.28Å; K83-W85 PolarHBondContact O-N 3.08Å; W85-L88 PolarHBondContact O-N 3.43Å; W85-L89 VanDerWaalsContact O-CB 3.28Å; W85-L89 WeakPolarHBondContact O-CB 3.13Å; W85-L89 PolarHBondContact O-N 3.16Å; W85-M122 HydrophobicContact CD2-CE 4.24Å; W85-M122 HydrophobicContact CE3-CE 4.08Å; W85-M122 HydrophobicContact CH2-CE 3.43Å; W85-M122 VanDerWaalsContact CH2-CE 3.43Å; W85-M122 HydrophobicContact CZ2-CE 3.57Å; W85-M122 HydrophobicContact CZ3-CB 4.08Å; W85-M122 HydrophobicContact CZ3-CE 3.69Å; W85-M122 HydrophobicContact CZ3-CG 4.43Å; W85-L125 HydrophobicContact CB-CD1 4.2Å; W85-L125 HydrophobicContact CE3-CD1 4.31Å; W85-L125 HydrophobicContact CE3-CD2 3.96Å
86F95.7Very high96.2Very high100 Ų10059.8 Ų59.844%0.43930%0.299SS..Hα-helixtrans-69.6-35.6177.9-74.9-75.5000112.9H82 K83 L84 L89 K90H82-F86 AromaticContact CE1-CE2 3.52Å; H82-F86 AromaticContact NE2-CE2 3.58Å; H82-F86 VanDerWaalsContact O-CD2 3.27Å; H82-F86 WeakPolarHBondContact O-CD2 3.39Å; K83-F86 PolarHBondContact O-N 3.3Å; K83-F86 VanDerWaalsContact O-N 3.16Å; L84-F86 VanDerWaalsContact C-N 3.31Å; L84-F86 PolarHBondContact O-N 3.41Å; F86-L89 HydrophobicContact CD1-CD2 4.25Å; F86-L89 HydrophobicContact CE1-CD2 4.48Å; F86-L89 PolarHBondContact O-N 2.95Å; F86-K90 WeakPolarHBondContact O-CG 3.23Å; F86-K90 PolarHBondContact O-N 3.21Å
87V95.4Very high96Very high71 Ų7158.4 Ų58.443%0.4330%0.297SS..Hα-helixtrans-60.8-47.4173.6175.20000110.7K83 L84 L89 K90 E91K83-V87 PolarHBondContact O-N 2.84Å; K83-V87 VanDerWaalsContact O-N 3.13Å; L84-V87 PolarHBondContact O-N 2.75Å; V87-L89 VanDerWaalsContact C-N 3.34Å; V87-L89 PolarHBondContact O-N 3.02Å; V87-K90 PolarHBondContact O-N 3.28Å; V87-E91 PolarHBondContact O-N 3.12Å; V87-E91 VanDerWaalsContact O-N 3.15Å
88L97Very high95.8Very high14 Ų1457.2 Ų57.27%0.07329%0.285CS..Hα-helixtrans-65.8-36.2176.8-68.9175.2000112.3L84 W85 E91 R92 M122 L125L84-L88 HydrophobicContact CD1-CD1 4.42Å; L84-L88 HydrophobicContact CD1-CG 4.21Å; L84-L88 HydrophobicContact CG-CD1 4.17Å; L84-L88 HydrophobicContact CG-CG 4.4Å; L84-L88 WeakPolarHBondContact O-CG 3.43Å; L84-L88 PolarHBondContact O-N 3.37Å; W85-L88 PolarHBondContact O-N 3.43Å; L88-E91 PolarHBondContact O-N 3.38Å; L88-R92 WeakPolarHBondContact O-CB 3.41Å; L88-R92 PolarHBondContact O-N 3.44Å; L88-M122 HydrophobicContact CB-CG 3.97Å; L88-M122 HydrophobicContact CD1-CG 4.16Å; L88-L125 HydrophobicContact CD1-CD1 4.24Å
89L96.7Very high95.7Very high47 Ų4756.4 Ų56.425%0.24628%0.278CS..Hα-helixtrans-65.6-41.6177.5-177.464.4000111.8W85 F86 V87 R92 N93 M122W85-L89 VanDerWaalsContact O-CB 3.28Å; W85-L89 WeakPolarHBondContact O-CB 3.13Å; W85-L89 PolarHBondContact O-N 3.16Å; F86-L89 HydrophobicContact CD1-CD2 4.25Å; F86-L89 HydrophobicContact CE1-CD2 4.48Å; F86-L89 PolarHBondContact O-N 2.95Å; V87-L89 VanDerWaalsContact C-N 3.34Å; V87-L89 PolarHBondContact O-N 3.02Å; L89-R92 PolarHBondContact O-N 3.02Å; L89-N93 WeakPolarHBondContact O-CB 3.34Å; L89-N93 PolarHBondContact O-N 3.03Å; L89-N93 PolarHBondContact O-OD1 3.43Å; L89-M122 HydrophobicContact CD1-CE 4.34Å
90K94.7Very high95.6Very high57 Ų5758.7 Ų58.725%0.24828%0.279CS..Hα-helixtrans-61.8-47.3175-73-158.3-72.2175.40111.7S41 E49 F86 V87 R92 N93 M94S41-K90 PolarHBondContact OG-NZ 2.98Å; E49-K90 VanDerWaalsContact CD-NZ 3.25Å; E49-K90 IonicContact OE1-NZ 3.01Å; E49-K90 PolarHBondContact OE1-NZ 3.44Å; E49-K90 WeakPolarHBondContact OE2-CD 3.42Å; E49-K90 IonicContact OE2-NZ 2.84Å; E49-K90 PolarHBondContact OE2-NZ 2.73Å; F86-K90 WeakPolarHBondContact O-CG 3.23Å; F86-K90 PolarHBondContact O-N 3.21Å; V87-K90 PolarHBondContact O-N 3.28Å; K90-R92 PolarHBondContact O-N 2.86Å; K90-N93 PolarHBondContact O-N 3.16Å; K90-M94 WeakPolarHBondContact O-CB 3.32Å; K90-M94 PolarHBondContact O-N 3.42Å
91E95.2Very high95.4Very high53 Ų5357.9 Ų57.925%0.24828%0.281CS..Hα-helixtrans-56.6-48.7174.7179.872-175.400111.4V87 L88 N93 M94 L95 R114 V118V87-E91 PolarHBondContact O-N 3.12Å; V87-E91 VanDerWaalsContact O-N 3.15Å; L88-E91 PolarHBondContact O-N 3.38Å; E91-N93 PolarHBondContact O-N 3.33Å; E91-M94 VanDerWaalsContact CD-CE 3.43Å; E91-M94 HydrophobicContact CG-CE 4.43Å; E91-M94 PolarHBondContact O-N 3.36Å; E91-M94 WeakPolarHBondContact OE2-CE 3.27Å; E91-L95 HydrophobicContact CG-CD1 4.19Å; E91-L95 VanDerWaalsContact O-CG 3.27Å; E91-L95 WeakPolarHBondContact O-CG 3.43Å; E91-L95 PolarHBondContact O-N 2.9Å; E91-R114 IonicContact OE1-CZ 2.92Å; E91-R114 IonicContact OE1-NE 3.41Å; E91-R114 PolarHBondContact OE1-NE 2.89Å; E91-R114 IonicContact OE1-NH2 3.86Å; E91-R114 PolarHBondContact OE1-NH2 2.91Å; E91-R114 IonicContact OE2-NH2 2.66Å; E91-R114 PolarHBondContact OE2-NH2 3.45Å; E91-V118 HydrophobicContact CG-CG2 3.68Å
92R96.8Very high95.1Very high98 Ų9858.2 Ų58.237%0.3728%0.284SS..Hα-helixtrans-58.4-46.4177.2-174.8-179.2177.6-150.21.8111.8L88 L89 K90 L95 L96 L115 V118 M122L88-R92 WeakPolarHBondContact O-CB 3.41Å; L88-R92 PolarHBondContact O-N 3.44Å; L89-R92 PolarHBondContact O-N 3.02Å; K90-R92 PolarHBondContact O-N 2.86Å; R92-L95 PolarHBondContact O-N 3.38Å; R92-L96 HydrophobicContact CG-CD1 4.1Å; R92-L96 HydrophobicContact CG-CG 4.45Å; R92-L96 WeakPolarHBondContact O-CG 3.44Å; R92-L96 PolarHBondContact O-N 2.96Å; R92-L115 HydrophobicContact CG-CD1 4.29Å; R92-V118 HydrophobicContact CB-CG1 3.89Å; R92-M122 HydrophobicContact CB-SD 4.4Å
93N96Very high95Very high57 Ų5760.9 Ų60.931%0.30530%0.295SS..Hα-helixtrans-63.6-43-178.9-71.7-8.9000111.5F50 L89 K90 E91 L95 L96 T97F50-N93 HydrophobicContact CD1-CB 4.41Å; F50-N93 HydrophobicContact CE1-CB 4.3Å; L89-N93 WeakPolarHBondContact O-CB 3.34Å; L89-N93 PolarHBondContact O-N 3.03Å; L89-N93 PolarHBondContact O-OD1 3.43Å; K90-N93 PolarHBondContact O-N 3.16Å; E91-N93 PolarHBondContact O-N 3.33Å; N93-L95 VanDerWaalsContact C-N 3.34Å; N93-L95 PolarHBondContact O-N 2.92Å; N93-L96 PolarHBondContact O-N 3.47Å; N93-T97 PolarHBondContact O-N 2.93Å; N93-T97 PolarHBondContact O-OG1 3.38Å; N93-T97 VanDerWaalsContact O-OG1 3.08Å
94M94.3Very high95Very high13 Ų1361.8 Ų61.86%0.06431%0.306CS..Hα-helixtrans-58.1-45.7173.9173.1-163.964.700111.7F50 D52 K90 E91 T97 M98F50-M94 WeakPolarHBondContact O-CA 3.4Å; D52-M94 VanDerWaalsContact CA-SD 3.55Å; D52-M94 HydrophobicContact CB-SD 3.98Å; K90-M94 WeakPolarHBondContact O-CB 3.32Å; K90-M94 PolarHBondContact O-N 3.42Å; E91-M94 VanDerWaalsContact CD-CE 3.43Å; E91-M94 HydrophobicContact CG-CE 4.43Å; E91-M94 PolarHBondContact O-N 3.36Å; E91-M94 WeakPolarHBondContact OE2-CE 3.27Å; M94-T97 WeakPolarHBondContact O-CB 3.43Å; M94-T97 PolarHBondContact O-N 3.44Å; M94-M98 HydrophobicContact CG-SD 4.39Å; M94-M98 WeakPolarHBondContact O-CG 3.28Å; M94-M98 PolarHBondContact O-N 3.19Å
95L94.9Very high94.8Very high1 Ų164.5 Ų64.51%0.00532%0.318CS..Hα-helixtrans-65.7-39178.9-64.8170.7000112.7E91 R92 N93 T97 M98 E99 F109 R114 L115 V118E91-L95 HydrophobicContact CG-CD1 4.19Å; E91-L95 VanDerWaalsContact O-CG 3.27Å; E91-L95 WeakPolarHBondContact O-CG 3.43Å; E91-L95 PolarHBondContact O-N 2.9Å; R92-L95 PolarHBondContact O-N 3.38Å; N93-L95 VanDerWaalsContact C-N 3.34Å; N93-L95 PolarHBondContact O-N 2.92Å; L95-T97 VanDerWaalsContact C-N 3.33Å; L95-M98 PolarHBondContact O-N 3.41Å; L95-E99 WeakPolarHBondContact O-CB 3.45Å; L95-E99 PolarHBondContact O-N 3.49Å; L95-F109 HydrophobicContact CB-CZ 4.4Å; L95-F109 HydrophobicContact CD2-CZ 4.2Å; L95-R114 HydrophobicContact CD1-CB 4.27Å; L95-R114 HydrophobicContact CD1-CG 3.76Å; L95-R114 HydrophobicContact CD2-CB 4.46Å; L95-R114 HydrophobicContact CD2-CG 4.06Å; L95-L115 HydrophobicContact CB-CD1 4.11Å; L95-L115 HydrophobicContact CD1-CD1 4.41Å; L95-V118 HydrophobicContact CD1-CG2 4.13Å
96L95.7Very high94.4Very high65 Ų6565.2 Ų65.234%0.3434%0.341SS..Hα-helixtrans-64.8-37.6175.1-71.1172.4000111.9R92 N93 E99 H100 L115R92-L96 HydrophobicContact CG-CD1 4.1Å; R92-L96 HydrophobicContact CG-CG 4.45Å; R92-L96 WeakPolarHBondContact O-CG 3.44Å; R92-L96 PolarHBondContact O-N 2.96Å; N93-L96 PolarHBondContact O-N 3.47Å; L96-E99 PolarHBondContact O-N 3.33Å; L96-H100 WeakPolarHBondContact O-CB 3.43Å; L96-H100 PolarHBondContact O-N 3.46Å; L96-L115 HydrophobicContact CD2-CD1 4.44Å; L96-L115 HydrophobicContact CD2-CD2 4.42Å
97T94.3Very high94.1Very high49 Ų4965 Ų6530%0.30134%0.341SS..Hα-helixtrans-62.8-44.4173.1-59.50000111.2F51 N93 M94 L95 H100 A101F51-T97 HydrophobicContact CD1-CG2 4.41Å; F51-T97 HydrophobicContact CE1-CG2 3.99Å; N93-T97 PolarHBondContact O-N 2.93Å; N93-T97 PolarHBondContact O-OG1 3.38Å; N93-T97 VanDerWaalsContact O-OG1 3.08Å; M94-T97 WeakPolarHBondContact O-CB 3.43Å; M94-T97 PolarHBondContact O-N 3.44Å; L95-T97 VanDerWaalsContact C-N 3.33Å; T97-H100 PolarHBondContact O-N 3.15Å; T97-A101 WeakPolarHBondContact O-CB 3.5Å; T97-A101 PolarHBondContact O-N 2.97Å
98M92.5Very high93.7Very high38 Ų3869.7 Ų69.719%0.18736%0.363CS..Hα-helixtrans-66-41.8176.8-70.8175.765.900112.8D52 M94 L95 H100 A101 A102 F109 P110D52-M98 HydrophobicContact CB-CE 4.33Å; D52-M98 HydrophobicContact CB-SD 3.76Å; M94-M98 HydrophobicContact CG-SD 4.39Å; M94-M98 WeakPolarHBondContact O-CG 3.28Å; M94-M98 PolarHBondContact O-N 3.19Å; L95-M98 PolarHBondContact O-N 3.41Å; M98-H100 VanDerWaalsContact C-N 3.34Å; M98-A101 PolarHBondContact O-N 3.46Å; M98-A102 WeakPolarHBondContact O-CB 3.37Å; M98-A102 PolarHBondContact O-N 3.47Å; M98-F109 HydrophobicContact CB-CE2 3.73Å; M98-P110 HydrophobicContact CE-CG 4Å
99E93.7Very high93.2Very high84 Ų8470.7 Ų70.739%0.39337%0.367SS..Hα-helixtrans-61.3-44.9176.5-176.7-173.7-160.600110.9L95 L96 A102 K103 F109L95-E99 WeakPolarHBondContact O-CB 3.45Å; L95-E99 PolarHBondContact O-N 3.49Å; L96-E99 PolarHBondContact O-N 3.33Å; E99-A102 PolarHBondContact O-N 3.27Å; E99-K103 WeakPolarHBondContact O-CB 3.37Å; E99-K103 PolarHBondContact O-N 2.86Å; E99-F109 VanDerWaalsContact CA-CD2 3.48Å; E99-F109 HydrophobicContact CB-CD2 3.93Å; E99-F109 HydrophobicContact CB-CE2 3.93Å; E99-F109 HydrophobicContact CB-CG 4.45Å; E99-F109 HydrophobicContact CB-CZ 4.46Å; E99-F109 HydrophobicContact CG-CD2 4.47Å
100H95.1Very high92.5Very high127 Ų12770.3 Ų70.359%0.58837%0.368SS*.Hα-helixtrans-61.9-44.4175.8-173.472.1000111.7L96 T97 M98 K103 V104L96-H100 WeakPolarHBondContact O-CB 3.43Å; L96-H100 PolarHBondContact O-N 3.46Å; T97-H100 PolarHBondContact O-N 3.15Å; M98-H100 VanDerWaalsContact C-N 3.34Å; H100-K103 PolarHBondContact O-N 3.05Å; H100-V104 VanDerWaalsContact O-CG2 3.31Å; H100-V104 WeakPolarHBondContact O-CG2 3.49Å; H100-V104 PolarHBondContact O-N 3.35Å
101A92.5Very high92Very high45 Ų4568.7 Ų68.737%0.37236%0.363SS..Hα-helixtrans-61.9-45.1177.200000112.3T97 M98 K103 V104 E105T97-A101 WeakPolarHBondContact O-CB 3.5Å; T97-A101 PolarHBondContact O-N 2.97Å; M98-A101 PolarHBondContact O-N 3.46Å; A101-K103 VanDerWaalsContact C-N 3.32Å; A101-K103 PolarHBondContact O-N 3.43Å; A101-V104 PolarHBondContact O-N 3.01Å; A101-E105 WeakPolarHBondContact O-CG 3.43Å; A101-E105 PolarHBondContact O-N 3.26Å; A101-E105 VanDerWaalsContact O-N 3.09Å
102A91.6Very high91.8Very high9 Ų969.9 Ų69.97%0.07438%0.375CS..Hα-helixtrans-60.2-42.417600000111.3M98 E99 V104 E105 A106 E107 F109M98-A102 WeakPolarHBondContact O-CB 3.37Å; M98-A102 PolarHBondContact O-N 3.47Å; E99-A102 PolarHBondContact O-N 3.27Å; A102-V104 PolarHBondContact O-N 3.02Å; A102-E105 CarbonylContact O-C 3.59Å; A102-E105 PolarHBondContact O-N 3.28Å; A102-A106 PolarHBondContact O-N 3.07Å; A102-E107 PolarHBondContact O-N 3.16Å; A102-F109 HydrophobicContact CB-CB 4.44Å; A102-F109 HydrophobicContact CB-CD2 4.47Å
103K93.5Very high91.6Very high171 Ų17170.5 Ų70.574%0.74338%0.383SS*.Hα-helixtrans-63.4-41.6176.8-173.6176.3-177.1174.50112.8E99 H100 A101 E105 A106E99-K103 WeakPolarHBondContact O-CB 3.37Å; E99-K103 PolarHBondContact O-N 2.86Å; H100-K103 PolarHBondContact O-N 3.05Å; A101-K103 VanDerWaalsContact C-N 3.32Å; A101-K103 PolarHBondContact O-N 3.43Å; K103-E105 VanDerWaalsContact C-N 3.3Å; K103-A106 PolarHBondContact O-N 3.07Å
104V95.7Very high91.6Very high94 Ų9469.4 Ų69.457%0.5737%0.374SS*.Hα-helixtrans-63.9-39178.5168.30000111.2H100 A101 A102 A106H100-V104 VanDerWaalsContact O-CG2 3.31Å; H100-V104 WeakPolarHBondContact O-CG2 3.49Å; H100-V104 PolarHBondContact O-N 3.35Å; A101-V104 PolarHBondContact O-N 3.01Å; A102-V104 PolarHBondContact O-N 3.02Å; V104-A106 VanDerWaalsContact C-N 3.26Å; V104-A106 PolarHBondContact O-N 2.98Å
105E91.6Very high91.6Very high81 Ų8170.1 Ų70.138%0.37938%0.378SS..THydrogen-bonded Turntrans-89.84.4-177.5-60.3-78.2172.100112.1F10 K13 A101 A102 K103 E107F10-E105 HydrophobicContact CD2-CG 4.41Å; F10-E105 HydrophobicContact CE2-CB 3.83Å; F10-E105 HydrophobicContact CE2-CG 3.34Å; F10-E105 HydrophobicContact CZ-CB 3.94Å; F10-E105 HydrophobicContact CZ-CG 3.67Å; K13-E105 IonicContact NZ-OE1 3.81Å; A101-E105 WeakPolarHBondContact O-CG 3.43Å; A101-E105 PolarHBondContact O-N 3.26Å; A101-E105 VanDerWaalsContact O-N 3.09Å; A102-E105 CarbonylContact O-C 3.59Å; A102-E105 PolarHBondContact O-N 3.28Å; K103-E105 VanDerWaalsContact C-N 3.3Å; E105-E107 HydrophobicContact CB-CG 4.25Å; E105-E107 PolarHBondContact O-N 2.9Å
106A90.7Very high91.6Very high95 Ų9574.2 Ų74.279%0.78540%0.4SS*.THydrogen-bonded Turntrans54.632.4-177.100000113.6A102 K103 V104A102-A106 PolarHBondContact O-N 3.07Å; K103-A106 PolarHBondContact O-N 3.07Å; V104-A106 VanDerWaalsContact C-N 3.26Å; V104-A106 PolarHBondContact O-N 2.98Å
107E87.7Confident91.7Very high95 Ų9573.3 Ų73.344%0.44439%0.393SS..PPolyproline II helixtrans-95.9155.9174.5-62.3-171.2162.400111F10 A102 E105F10-E107 VanDerWaalsContact CE1-OE2 3.23Å; F10-E107 WeakPolarHBondContact CE1-OE2 3.27Å; A102-E107 PolarHBondContact O-N 3.16Å; E105-E107 HydrophobicContact CB-CG 4.25Å; E105-E107 PolarHBondContact O-N 2.9Å
108L87Confident91.9Very high170 Ų17071.5 Ų71.589%0.8938%0.382SS*.PPolyproline II helixtrans-75133.9173.3-65.7173.7000109.8
109F86.5Confident92.1Very high35 Ų3575.2 Ų75.215%0.15440%0.399CS..PPolyproline II helixtrans-63.9126.5178.4-179.7-115.5000111.3L95 M98 E99 A102 C111 P112L95-F109 HydrophobicContact CB-CZ 4.4Å; L95-F109 HydrophobicContact CD2-CZ 4.2Å; M98-F109 HydrophobicContact CB-CE2 3.73Å; E99-F109 VanDerWaalsContact CA-CD2 3.48Å; E99-F109 HydrophobicContact CB-CD2 3.93Å; E99-F109 HydrophobicContact CB-CE2 3.93Å; E99-F109 HydrophobicContact CB-CG 4.45Å; E99-F109 HydrophobicContact CB-CZ 4.46Å; E99-F109 HydrophobicContact CG-CD2 4.47Å; A102-F109 HydrophobicContact CB-CB 4.44Å; A102-F109 HydrophobicContact CB-CD2 4.47Å; F109-C111 PolarHBondContact O-N 2.88Å; F109-P112 HydrophobicContact CD1-CB 4.04Å
110P82.4Confident92.3Very high40 Ų4075 Ų7526%0.2640%0.4SS..SBendtrans-68.2116.4176.326-32.6000110.3M98M98-P110 HydrophobicContact CE-CG 4Å
111C84.4Confident92.4Very high23 Ų2369.1 Ų69.116%0.15537%0.373CS..  trans5771.5177-162.60000115.4F109 E113 R114F109-C111 PolarHBondContact O-N 2.88Å; C111-E113 PolarHBondContact O-N 2.68Å; C111-E113 VanDerWaalsContact O-N 3.16Å; C111-R114 WeakPolarHBondContact O-CB 3.46Å; C111-R114 PolarHBondContact O-N 2.94Å
112P90.9Very high92.7Very high78 Ų7867.6 Ų67.651%0.50636%0.358SS..THydrogen-bonded Turntrans-55.2-31.7172.722.8-33.6000113.4F109 R114 L115 D116F109-P112 HydrophobicContact CD1-CB 4.04Å; P112-R114 PolarHBondContact O-N 3.49Å; P112-L115 WeakPolarHBondContact O-CB 3.49Å; P112-L115 PolarHBondContact O-N 2.85Å; P112-D116 PolarHBondContact O-N 3.03Å
113E93.7Very high93Very high111 Ų11174 Ų7452%0.51938%0.384SS..Hα-helixtrans-54.9-27.5176.4-56.3-177.3-178.500113.6C111 L115 D116 K117C111-E113 PolarHBondContact O-N 2.68Å; C111-E113 VanDerWaalsContact O-N 3.16Å; E113-L115 VanDerWaalsContact C-N 3.31Å; E113-D116 PolarHBondContact O-N 3.43Å; E113-K117 WeakPolarHBondContact O-CB 3.36Å; E113-K117 WeakPolarHBondContact O-CD 3.45Å; E113-K117 WeakPolarHBondContact O-CG 3.25Å; E113-K117 PolarHBondContact O-N 3.49Å; E113-K117 IonicContact OE2-NZ 2.91Å; E113-K117 PolarHBondContact OE2-NZ 2.8Å
114R95Very high93.3Very high34 Ų3467.1 Ų67.113%0.12836%0.356CS..Hα-helixtrans-63.1-41.2179.2-167.1173.4174.2-178.7-1110.7D52 T64 E91 L95 C111 P112 K117 V118D52-R114 IonicContact OD2-CZ 3.01Å; D52-R114 IonicContact OD2-NH1 2.66Å; D52-R114 PolarHBondContact OD2-NH1 3.31Å; T64-R114 HydrophobicContact CG2-CB 3.87Å; T64-R114 VanDerWaalsContact CG2-CD 3.5Å; T64-R114 HydrophobicContact CG2-CG 3.52Å; E91-R114 IonicContact OE1-CZ 2.92Å; E91-R114 IonicContact OE1-NE 3.41Å; E91-R114 PolarHBondContact OE1-NE 2.89Å; E91-R114 IonicContact OE1-NH2 3.86Å; E91-R114 PolarHBondContact OE1-NH2 2.91Å; E91-R114 IonicContact OE2-NH2 2.66Å; E91-R114 PolarHBondContact OE2-NH2 3.45Å; L95-R114 HydrophobicContact CD1-CB 4.27Å; L95-R114 HydrophobicContact CD1-CG 3.76Å; L95-R114 HydrophobicContact CD2-CB 4.46Å; L95-R114 HydrophobicContact CD2-CG 4.06Å; C111-R114 WeakPolarHBondContact O-CB 3.46Å; C111-R114 PolarHBondContact O-N 2.94Å; P112-R114 PolarHBondContact O-N 3.49Å; R114-K117 PolarHBondContact O-N 3.48Å; R114-V118 WeakPolarHBondContact O-CG2 3.38Å; R114-V118 PolarHBondContact O-N 3.1Å; R114-V118 VanDerWaalsContact O-N 3.12Å
115L94.6Very high93.4Very high27 Ų2763 Ų6314%0.14133%0.33CS..Hα-helixtrans-66.2-45.5178.1-173.863000110.5R92 L95 L96 P112 E113 K117 V118 E119R92-L115 HydrophobicContact CG-CD1 4.29Å; L95-L115 HydrophobicContact CB-CD1 4.11Å; L95-L115 HydrophobicContact CD1-CD1 4.41Å; L96-L115 HydrophobicContact CD2-CD1 4.44Å; L96-L115 HydrophobicContact CD2-CD2 4.42Å; P112-L115 WeakPolarHBondContact O-CB 3.49Å; P112-L115 PolarHBondContact O-N 2.85Å; E113-L115 VanDerWaalsContact C-N 3.31Å; L115-K117 VanDerWaalsContact C-N 3.32Å; L115-K117 PolarHBondContact O-N 2.98Å; L115-V118 PolarHBondContact O-N 3.48Å; L115-V118 VanDerWaalsContact O-N 3.16Å; L115-E119 PolarHBondContact O-N 3.27Å
116D95.8Very high93.7Very high88 Ų8864.7 Ų64.747%0.47134%0.338SS..Hα-helixtrans-59.1-43.1176.6-61.9-23.3000111.6P112 E113 V118 E119 I120P112-D116 PolarHBondContact O-N 3.03Å; E113-D116 PolarHBondContact O-N 3.43Å; D116-V118 VanDerWaalsContact C-N 3.33Å; D116-V118 PolarHBondContact O-N 3.31Å; D116-E119 PolarHBondContact O-N 3.35Å; D116-I120 WeakPolarHBondContact O-CB 3.19Å; D116-I120 WeakPolarHBondContact O-CD1 3.47Å; D116-I120 WeakPolarHBondContact O-CG1 3.43Å; D116-I120 PolarHBondContact O-N 3.06Å
117K97.3Very high94Very high46 Ų4663.5 Ų63.520%0.232%0.316CS..Hα-helixtrans-62.5-39.2177.8-71.3163.6-168.8167.30111.9T64 P67 E113 R114 L115 S121T64-K117 PolarHBondContact OG1-NZ 3.5Å; P67-K117 HydrophobicContact CB-CB 4.24Å; P67-K117 WeakPolarHBondContact CB-O 3.45Å; E113-K117 WeakPolarHBondContact O-CB 3.36Å; E113-K117 WeakPolarHBondContact O-CD 3.45Å; E113-K117 WeakPolarHBondContact O-CG 3.25Å; E113-K117 PolarHBondContact O-N 3.49Å; E113-K117 IonicContact OE2-NZ 2.91Å; E113-K117 PolarHBondContact OE2-NZ 2.8Å; R114-K117 PolarHBondContact O-N 3.48Å; L115-K117 VanDerWaalsContact C-N 3.32Å; L115-K117 PolarHBondContact O-N 2.98Å; K117-S121 WeakPolarHBondContact O-CB 3.44Å; K117-S121 PolarHBondContact O-N 3.42Å; K117-S121 VanDerWaalsContact O-N 3.08Å; K117-S121 PolarHBondContact O-OG 3.33Å
118V97.2Very high94.5Very high10 Ų1059 Ų596%0.06130%0.295CS..Hα-helixtrans-68.8-44.7176.3173.70000110.5E91 R92 L95 R114 L115 D116 I120 S121 M122E91-V118 HydrophobicContact CG-CG2 3.68Å; R92-V118 HydrophobicContact CB-CG1 3.89Å; L95-V118 HydrophobicContact CD1-CG2 4.13Å; R114-V118 WeakPolarHBondContact O-CG2 3.38Å; R114-V118 PolarHBondContact O-N 3.1Å; R114-V118 VanDerWaalsContact O-N 3.12Å; L115-V118 PolarHBondContact O-N 3.48Å; L115-V118 VanDerWaalsContact O-N 3.16Å; D116-V118 VanDerWaalsContact C-N 3.33Å; D116-V118 PolarHBondContact O-N 3.31Å; V118-I120 PolarHBondContact O-N 3.25Å; V118-S121 WeakPolarHBondContact O-CB 3.3Å; V118-S121 PolarHBondContact O-N 2.89Å; V118-S121 VanDerWaalsContact O-N 3.14Å; V118-M122 HydrophobicContact CG1-CG 4.36Å; V118-M122 HydrophobicContact CG1-SD 4.21Å; V118-M122 WeakPolarHBondContact O-CG 3.46Å; V118-M122 PolarHBondContact O-N 2.95Å
119E97.3Very high95Very high116 Ų11653.1 Ų53.154%0.54227%0.267SS..Hα-helixtrans-61.1-45.9177.7-174.7173.2-174.300112L115 D116 S121 M122 K123L115-E119 PolarHBondContact O-N 3.27Å; D116-E119 PolarHBondContact O-N 3.35Å; E119-S121 VanDerWaalsContact C-N 3.28Å; E119-S121 PolarHBondContact O-N 3.18Å; E119-M122 PolarHBondContact O-N 3.03Å; E119-K123 WeakPolarHBondContact O-CB 3.34Å; E119-K123 PolarHBondContact O-N 3.46Å
120I98.1Very high95.5Very high80 Ų8054.5 Ų54.541%0.4128%0.281SS..Hα-helixtrans-57-44.6173.9-69.2164.1000110.4P67 D116 V118 K123 N124P67-I120 HydrophobicContact CB-CB 4.4Å; P67-I120 HydrophobicContact CB-CG2 4.11Å; P67-I120 HydrophobicContact CG-CG2 4.42Å; D116-I120 WeakPolarHBondContact O-CB 3.19Å; D116-I120 WeakPolarHBondContact O-CD1 3.47Å; D116-I120 WeakPolarHBondContact O-CG1 3.43Å; D116-I120 PolarHBondContact O-N 3.06Å; V118-I120 PolarHBondContact O-N 3.25Å; I120-K123 PolarHBondContact O-N 3.44Å; I120-N124 WeakPolarHBondContact O-CB 3.47Å; I120-N124 PolarHBondContact O-N 3.45Å; I120-N124 PolarHBondContact O-ND2 2.91Å
121S98Very high96.1Very high4 Ų455.9 Ų55.93%0.02828%0.284CS..Hα-helixtrans-64.8-42.4179.6-59.70000112.2P67 W68 K117 V118 E119 N124 L125P67-S121 WeakPolarHBondContact CA-OG 3.24Å; P67-S121 WeakPolarHBondContact CB-OG 3.44Å; W68-S121 PolarHBondContact N-OG 3.21Å; K117-S121 WeakPolarHBondContact O-CB 3.44Å; K117-S121 PolarHBondContact O-N 3.42Å; K117-S121 VanDerWaalsContact O-N 3.08Å; K117-S121 PolarHBondContact O-OG 3.33Å; V118-S121 WeakPolarHBondContact O-CB 3.3Å; V118-S121 PolarHBondContact O-N 2.89Å; V118-S121 VanDerWaalsContact O-N 3.14Å; E119-S121 VanDerWaalsContact C-N 3.28Å; E119-S121 PolarHBondContact O-N 3.18Å; S121-N124 PolarHBondContact O-N 2.84Å; S121-L125 WeakPolarHBondContact O-CB 3.37Å; S121-L125 PolarHBondContact O-N 3.28Å
122M98.1Very high96.8Very high13 Ų1357.8 Ų57.86%0.06429%0.288CS..Hα-helixtrans-64.6-43.1176.9-71-173.776.800111.6W85 L88 L89 R92 V118 E119 L125 Q126W85-M122 HydrophobicContact CD2-CE 4.24Å; W85-M122 HydrophobicContact CE3-CE 4.08Å; W85-M122 HydrophobicContact CH2-CE 3.43Å; W85-M122 VanDerWaalsContact CH2-CE 3.43Å; W85-M122 HydrophobicContact CZ2-CE 3.57Å; W85-M122 HydrophobicContact CZ3-CB 4.08Å; W85-M122 HydrophobicContact CZ3-CE 3.69Å; W85-M122 HydrophobicContact CZ3-CG 4.43Å; L88-M122 HydrophobicContact CB-CG 3.97Å; L88-M122 HydrophobicContact CD1-CG 4.16Å; L89-M122 HydrophobicContact CD1-CE 4.34Å; R92-M122 HydrophobicContact CB-SD 4.4Å; V118-M122 HydrophobicContact CG1-CG 4.36Å; V118-M122 HydrophobicContact CG1-SD 4.21Å; V118-M122 WeakPolarHBondContact O-CG 3.46Å; V118-M122 PolarHBondContact O-N 2.95Å; E119-M122 PolarHBondContact O-N 3.03Å; M122-L125 PolarHBondContact O-N 3.25Å; M122-Q126 PolarHBondContact O-N 3.5Å
123K98.3Very high97Very high142 Ų14258 Ų5862%0.61728%0.284SS*.Hα-helixtrans-62.4-44.7175.9-175.1177.8179.1177.70111.8E119 I120 L125 Q126 E127E119-K123 WeakPolarHBondContact O-CB 3.34Å; E119-K123 PolarHBondContact O-N 3.46Å; I120-K123 PolarHBondContact O-N 3.44Å; K123-L125 VanDerWaalsContact C-N 3.33Å; K123-L125 PolarHBondContact O-N 2.86Å; K123-Q126 PolarHBondContact O-N 3.33Å; K123-E127 WeakPolarHBondContact O-CB 3.39Å; K123-E127 PolarHBondContact O-N 2.9Å
124N98.2Very high97.2Very high28 Ų2859.2 Ų59.215%0.1528%0.284CS..Hα-helixtrans-62.3-40.3176.8-73-15.9000111.9W68 K70 L73 I120 S121 E127 V128W68-N124 PolarHBondContact O-ND2 3.33Å; K70-N124 HydrophobicContact CG-CB 3.87Å; L73-N124 HydrophobicContact CD1-CB 3.91Å; I120-N124 WeakPolarHBondContact O-CB 3.47Å; I120-N124 PolarHBondContact O-N 3.45Å; I120-N124 PolarHBondContact O-ND2 2.91Å; S121-N124 PolarHBondContact O-N 2.84Å; N124-E127 PolarHBondContact O-N 3.29Å; N124-V128 WeakPolarHBondContact O-CG2 3.44Å; N124-V128 PolarHBondContact O-N 3.27Å
125L98.1Very high97.3Very high7 Ų760.4 Ų60.44%0.03730%0.301CS..Hα-helixtrans-63.5-47.3176-169.2166.9000110.9L73 L81 L84 W85 L88 S121 M122 K123 E127 V128 V129L73-L125 HydrophobicContact CD1-CB 4.17Å; L81-L125 HydrophobicContact CD2-CG 4.41Å; L84-L125 HydrophobicContact CB-CD1 4.28Å; L84-L125 HydrophobicContact CD2-CD1 4.14Å; L84-L125 HydrophobicContact CG-CD1 4.07Å; W85-L125 HydrophobicContact CB-CD1 4.2Å; W85-L125 HydrophobicContact CE3-CD1 4.31Å; W85-L125 HydrophobicContact CE3-CD2 3.96Å; L88-L125 HydrophobicContact CD1-CD1 4.24Å; S121-L125 WeakPolarHBondContact O-CB 3.37Å; S121-L125 PolarHBondContact O-N 3.28Å; M122-L125 PolarHBondContact O-N 3.25Å; K123-L125 VanDerWaalsContact C-N 3.33Å; K123-L125 PolarHBondContact O-N 2.86Å; L125-E127 VanDerWaalsContact C-N 3.33Å; L125-E127 PolarHBondContact O-N 3Å; L125-V128 PolarHBondContact O-N 3.43Å; L125-V129 HydrophobicContact CD2-CG2 3.95Å; L125-V129 WeakPolarHBondContact O-CG2 3.42Å; L125-V129 PolarHBondContact O-N 2.82Å
126Q97.5Very high97.5Very high116 Ų11666 Ų6654%0.54232%0.322SS..Hα-helixtrans-60-43.2176-172.9-1806.300111.6M122 K123 V128 V129 S130M122-Q126 PolarHBondContact O-N 3.5Å; K123-Q126 PolarHBondContact O-N 3.33Å; Q126-V128 PolarHBondContact O-N 3.23Å; Q126-V129 PolarHBondContact O-N 2.95Å; Q126-S130 WeakPolarHBondContact O-CB 3.39Å; Q126-S130 PolarHBondContact O-N 3.27Å; Q126-S130 PolarHBondContact O-OG 3.41Å
127E97.8Very high97.5Very high70 Ų7065 Ų6533%0.32731%0.313SS..Hα-helixtrans-59.6-46.6177.4-166.8179.6162.300111.4K70 K123 N124 L125 V129 S130 E131K70-E127 HydrophobicContact CD-CG 4.39Å; K70-E127 VanDerWaalsContact CD-OE2 3.25Å; K70-E127 WeakPolarHBondContact CD-OE2 3.45Å; K70-E127 IonicContact NZ-OE1 2.68Å; K70-E127 PolarHBondContact NZ-OE1 2.95Å; K70-E127 IonicContact NZ-OE2 2.88Å; K70-E127 PolarHBondContact NZ-OE2 3.09Å; K123-E127 WeakPolarHBondContact O-CB 3.39Å; K123-E127 PolarHBondContact O-N 2.9Å; N124-E127 PolarHBondContact O-N 3.29Å; L125-E127 VanDerWaalsContact C-N 3.33Å; L125-E127 PolarHBondContact O-N 3Å; E127-V129 PolarHBondContact O-N 3.48Å; E127-S130 PolarHBondContact O-N 2.98Å; E127-E131 WeakPolarHBondContact O-CB 3.49Å; E127-E131 VanDerWaalsContact O-CG 3.3Å; E127-E131 WeakPolarHBondContact O-CG 3.37Å; E127-E131 PolarHBondContact O-N 3.5Å
128V98Very high97.5Very high0 Ų066.6 Ų66.60%032%0.323CS..Hα-helixtrans-63.1-39.8177.5170.80000112.1K70 L73 R74 L81 N124 L125 Q126 E131 R132K70-V128 HydrophobicContact CB-CG2 4.28Å; L73-V128 HydrophobicContact CB-CG2 4.09Å; R74-V128 HydrophobicContact CG-CG1 4.08Å; R74-V128 HydrophobicContact CG-CG2 3.97Å; L81-V128 HydrophobicContact CD1-CG1 4.17Å; N124-V128 WeakPolarHBondContact O-CG2 3.44Å; N124-V128 PolarHBondContact O-N 3.27Å; L125-V128 PolarHBondContact O-N 3.43Å; Q126-V128 PolarHBondContact O-N 3.23Å; V128-E131 PolarHBondContact O-N 3.1Å; V128-R132 WeakPolarHBondContact O-CG 3.4Å; V128-R132 PolarHBondContact O-N 2.97Å; V128-R132 VanDerWaalsContact O-N 3.1Å
129V97.4Very high97.5Very high47 Ų4773.5 Ų73.529%0.28536%0.359SS..Hα-helixtrans-67.1-41.8176173.40000110.9L81 L125 Q126 E127 R132 N133L81-V129 HydrophobicContact CD1-CG2 4.07Å; L125-V129 HydrophobicContact CD2-CG2 3.95Å; L125-V129 WeakPolarHBondContact O-CG2 3.42Å; L125-V129 PolarHBondContact O-N 2.82Å; Q126-V129 PolarHBondContact O-N 2.95Å; E127-V129 PolarHBondContact O-N 3.48Å; V129-R132 PolarHBondContact O-N 3.33Å; V129-N133 WeakPolarHBondContact O-CB 3.48Å; V129-N133 PolarHBondContact O-N 3.08Å
130S96.4Very high97.6Very high64 Ų6471 Ų7145%0.44835%0.352SS..Hα-helixtrans-63.5-42174.8-71.50000112.4Q126 E127 R132 N133 R134Q126-S130 WeakPolarHBondContact O-CB 3.39Å; Q126-S130 PolarHBondContact O-N 3.27Å; Q126-S130 PolarHBondContact O-OG 3.41Å; E127-S130 PolarHBondContact O-N 2.98Å; S130-R132 PolarHBondContact O-N 3.34Å; S130-N133 PolarHBondContact O-N 3Å; S130-R134 VanDerWaalsContact O-CB 3.22Å; S130-R134 WeakPolarHBondContact O-CB 3.31Å; S130-R134 PolarHBondContact O-N 3.48Å
131E97Very high97.4Very high69 Ų6974.2 Ų74.232%0.32236%0.363SS..Hα-helixtrans-55.4-49.2173.2-76.5174.7-177.400110.6R74 E127 V128 R134 A135R74-E131 IonicContact CZ-OE1 2.86Å; R74-E131 IonicContact CZ-OE2 3.45Å; R74-E131 IonicContact NE-OE2 2.94Å; R74-E131 PolarHBondContact NE-OE2 2.88Å; R74-E131 IonicContact NH2-OE1 3.94Å; R74-E131 PolarHBondContact NH2-OE1 3.43Å; R74-E131 IonicContact NH2-OE2 3.65Å; R74-E131 PolarHBondContact NH2-OE2 2.86Å; E127-E131 WeakPolarHBondContact O-CB 3.49Å; E127-E131 VanDerWaalsContact O-CG 3.3Å; E127-E131 WeakPolarHBondContact O-CG 3.37Å; E127-E131 PolarHBondContact O-N 3.5Å; V128-E131 PolarHBondContact O-N 3.1Å; E131-R134 PolarHBondContact O-N 2.94Å; E131-A135 WeakPolarHBondContact O-CB 3.33Å; E131-A135 PolarHBondContact O-N 3.42Å
132R97.3Very high97.3Very high64 Ų6476.9 Ų76.924%0.24239%0.391CS..Hα-helixtrans-63.4-47.4179.1-72.5174.5179.4177.12.8112.3L73 R74 K76 N78 V128 V129 S130 A135 Y136L73-R132 PolarHBondContact O-NH2 3.31Å; R74-R132 PolarHBondContact O-NH2 3.49Å; K76-R132 PolarHBondContact O-NH1 3.34Å; K76-R132 PolarHBondContact O-NH2 3.11Å; N78-R132 WeakPolarHBondContact OD1-CD 3.4Å; N78-R132 PolarHBondContact OD1-NH1 3.42Å; V128-R132 WeakPolarHBondContact O-CG 3.4Å; V128-R132 PolarHBondContact O-N 2.97Å; V128-R132 VanDerWaalsContact O-N 3.1Å; V129-R132 PolarHBondContact O-N 3.33Å; S130-R132 PolarHBondContact O-N 3.34Å; R132-A135 PolarHBondContact O-N 3.48Å; R132-Y136 WeakPolarHBondContact O-CB 3.47Å; R132-Y136 PolarHBondContact O-N 3.43Å
133N96.7Very high97.1Very high82 Ų8281.3 Ų81.344%0.43941%0.412SS..Hα-helixtrans-62.2-46.1178.8-75.2-9000110.9V129 S130 A135 Y136 F137V129-N133 WeakPolarHBondContact O-CB 3.48Å; V129-N133 PolarHBondContact O-N 3.08Å; S130-N133 PolarHBondContact O-N 3Å; N133-A135 VanDerWaalsContact C-N 3.34Å; N133-A135 PolarHBondContact O-N 3.31Å; N133-Y136 PolarHBondContact O-N 3.35Å; N133-F137 HydrophobicContact CB-CD2 4.4Å; N133-F137 HydrophobicContact CB-CE2 4.31Å; N133-F137 WeakPolarHBondContact O-CD2 3.22Å; N133-F137 PolarHBondContact O-N 3.19Å
134R97.1Very high96.8Very high137 Ų13776.8 Ų76.852%0.51740%0.396SS..Hα-helixtrans-58.6-44.9176.7179.6176.7170.9-172.4-2.3111.6S130 E131 F137 L138 T144S130-R134 VanDerWaalsContact O-CB 3.22Å; S130-R134 WeakPolarHBondContact O-CB 3.31Å; S130-R134 PolarHBondContact O-N 3.48Å; E131-R134 PolarHBondContact O-N 2.94Å; R134-F137 PolarHBondContact O-N 3.14Å; R134-L138 HydrophobicContact CG-CD1 3.84Å; R134-L138 HydrophobicContact CG-CG 4.41Å; R134-L138 WeakPolarHBondContact O-CB 3.46Å; R134-L138 WeakPolarHBondContact O-CG 3.21Å; R134-L138 PolarHBondContact O-N 3.19Å; R134-T144 HydrophobicContact CG-CG2 4.18Å
135A97.4Very high96.5Very high59 Ų5977.2 Ų77.249%0.48841%0.406SS..Hα-helixtrans-62.3-44177.200000112.2E131 R132 N133 L138 L139E131-A135 WeakPolarHBondContact O-CB 3.33Å; E131-A135 PolarHBondContact O-N 3.42Å; R132-A135 PolarHBondContact O-N 3.48Å; N133-A135 VanDerWaalsContact C-N 3.34Å; N133-A135 PolarHBondContact O-N 3.31Å; A135-L138 PolarHBondContact O-N 3.3Å; A135-L139 PolarHBondContact O-N 2.97Å; A135-L139 VanDerWaalsContact O-N 3.1Å
136Y97.5Very high96.2Very high144 Ų14483.1 Ų83.157%0.56543%0.434SS*.Hα-helixtrans-61.6-47.5177174.6-99000112.4R132 N133 L139 T140R132-Y136 WeakPolarHBondContact O-CB 3.47Å; R132-Y136 PolarHBondContact O-N 3.43Å; N133-Y136 PolarHBondContact O-N 3.35Å; Y136-L139 PolarHBondContact O-N 3.41Å; Y136-T140 HydrophobicContact CD2-CG2 4.11Å; Y136-T140 HydrophobicContact CE1-CG2 4.36Å; Y136-T140 HydrophobicContact CE2-CG2 3.72Å; Y136-T140 WeakPolarHBondContact O-CB 3.06Å; Y136-T140 WeakPolarHBondContact O-CG2 3.45Å; Y136-T140 PolarHBondContact O-N 2.75Å; Y136-T140 PolarHBondContact O-OG1 2.98Å
137F97.5Very high96Very high68 Ų6884 Ų8430%0.29843%0.433SS..Hα-helixtrans-68.5-37.3179.6-74-64000112.7N133 R134 L139 T140 K141 G142 H143N133-F137 HydrophobicContact CB-CD2 4.4Å; N133-F137 HydrophobicContact CB-CE2 4.31Å; N133-F137 WeakPolarHBondContact O-CD2 3.22Å; N133-F137 PolarHBondContact O-N 3.19Å; R134-F137 PolarHBondContact O-N 3.14Å; F137-L139 VanDerWaalsContact C-N 3.3Å; F137-L139 PolarHBondContact O-N 2.87Å; F137-T140 PolarHBondContact O-N 2.82Å; F137-K141 HydrophobicContact CD1-CG 4.31Å; F137-K141 WeakPolarHBondContact O-CA 3.29Å; F137-K141 WeakPolarHBondContact O-CB 3.34Å; F137-K141 PolarHBondContact O-N 3.42Å; F137-G142 PolarHBondContact O-N 2.96Å; F137-G142 VanDerWaalsContact O-N 3.14Å; F137-H143 CarbonylContact C-O 3.59Å; F137-H143 WeakPolarHBondContact CB-O 3.21Å
138L97.4Very high95.8Very high78 Ų7884.5 Ų84.541%0.40844%0.441SS..Hα-helixtrans-61.5-41174.8-76.5169.8000111.3R134 A135 G142 H143 T144R134-L138 HydrophobicContact CG-CD1 3.84Å; R134-L138 HydrophobicContact CG-CG 4.41Å; R134-L138 WeakPolarHBondContact O-CB 3.46Å; R134-L138 WeakPolarHBondContact O-CG 3.21Å; R134-L138 PolarHBondContact O-N 3.19Å; A135-L138 PolarHBondContact O-N 3.3Å; L138-G142 VanDerWaalsContact O-CA 3.29Å; L138-G142 WeakPolarHBondContact O-CA 3.43Å; L138-G142 PolarHBondContact O-N 2.92Å; L138-H143 PolarHBondContact N-O 3.49Å; L138-T144 HydrophobicContact CD2-CG2 4.36Å
139L97.4Very high95.6Very high155 Ų15589.5 Ų89.581%0.81246%0.46SS*.Hα-helixtrans-71.1-40.8178.5-174.866.8000112.9A135 Y136 F137A135-L139 PolarHBondContact O-N 2.97Å; A135-L139 VanDerWaalsContact O-N 3.1Å; Y136-L139 PolarHBondContact O-N 3.41Å; F137-L139 VanDerWaalsContact C-N 3.3Å; F137-L139 PolarHBondContact O-N 2.87Å
140T97.3Very high95.3Very high65 Ų6593.1 Ų93.140%0.39947%0.469SS..Hα-helixtrans-90.7-34.5-171.254.30000114.2Y136 F137Y136-T140 HydrophobicContact CD2-CG2 4.11Å; Y136-T140 HydrophobicContact CE1-CG2 4.36Å; Y136-T140 HydrophobicContact CE2-CG2 3.72Å; Y136-T140 WeakPolarHBondContact O-CB 3.06Å; Y136-T140 WeakPolarHBondContact O-CG2 3.45Å; Y136-T140 PolarHBondContact O-N 2.75Å; Y136-T140 PolarHBondContact O-OG1 2.98Å; F137-T140 PolarHBondContact O-N 2.82Å
141K95.5Very high95.1Very high146 Ų14697 Ų9764%0.63547%0.474SS*.Hα-helixtrans-118.7-18-174.7-57.3-60.5-177.7-177.90113.7F137F137-K141 HydrophobicContact CD1-CG 4.31Å; F137-K141 WeakPolarHBondContact O-CA 3.29Å; F137-K141 WeakPolarHBondContact O-CB 3.34Å; F137-K141 PolarHBondContact O-N 3.42Å
142G95.6Very high94.8Very high60 Ų6094.6 Ų94.662%0.61946%0.463SS*.SBendtrans81.97.8-176.400000114.8F137 L138F137-G142 PolarHBondContact O-N 2.96Å; F137-G142 VanDerWaalsContact O-N 3.14Å; L138-G142 VanDerWaalsContact O-CA 3.29Å; L138-G142 WeakPolarHBondContact O-CA 3.43Å; L138-G142 PolarHBondContact O-N 2.92Å
143H93.5Very high94.5Very high107 Ų10793.3 Ų93.350%0.49546%0.462SS..SBendtrans-134.2165.9177.662.357.7000111.5F137 L138 G145F137-H143 CarbonylContact C-O 3.59Å; F137-H143 WeakPolarHBondContact CB-O 3.21Å; L138-H143 PolarHBondContact N-O 3.49Å; H143-G145 VanDerWaalsContact C-N 3.3Å; H143-G145 PolarHBondContact ND1-N 3.25Å; H143-G145 PolarHBondContact O-N 3.29Å
144T92.8Very high94.1Very high47 Ų4791.6 Ų91.629%0.28845%0.453SS..  trans-69.4-21.7-173.155.60000115R134 L138 E146R134-T144 HydrophobicContact CG-CG2 4.18Å; L138-T144 HydrophobicContact CD2-CG2 4.36Å; T144-E146 PolarHBondContact O-N 3.47Å
145G91.1Very high93.6Very high36 Ų3691.7 Ų91.737%0.37146%0.459SS..  trans77.97.6-175.100000113.6H143H143-G145 VanDerWaalsContact C-N 3.3Å; H143-G145 PolarHBondContact ND1-N 3.25Å; H143-G145 PolarHBondContact O-N 3.29Å
146E92.5Very high93.1Very high132 Ų13294.1 Ų94.162%0.61746%0.459SS*.SBendtrans-73.8159.5168.9-65177.2179.900110.8T144 P148T144-E146 PolarHBondContact O-N 3.47Å; E146-P148 VanDerWaalsContact O-N 3.16Å
147R93.8Very high92.6Very high135 Ų13587.9 Ų87.951%0.50944%0.439SS..PPolyproline II helixtrans-53.6121.2178-176.8175.1178.6-170.5-6.6110.2Y163 L164 T165R147-Y163 HydrophobicContact CB-CD1 4.31Å; R147-Y163 HydrophobicContact CG-CD1 4.12Å; R147-L164 VanDerWaalsContact CZ-O 3.26Å; R147-L164 PolarHBondContact NE-O 2.98Å; R147-L164 PolarHBondContact NH2-O 3.28Å; R147-T165 VanDerWaalsContact NH2-CG2 3.31Å
148P93.1Very high92.3Very high79 Ų7987.6 Ų87.651%0.51344%0.438SS..PPolyproline II helixtrans-68.1153.2-177.128.6-34.5000110.8E146 L164E146-P148 VanDerWaalsContact O-N 3.16Å; P148-L164 HydrophobicContact CB-CD1 3.96Å; P148-L164 HydrophobicContact CG-CB 4.27Å; P148-L164 HydrophobicContact CG-CD1 3.99Å; P148-L164 PolarHBondContact O-N 3.3Å
149W93.1Very high92Very high105 Ų10593.2 Ų93.240%0.39845%0.453SS..EExtended strand (participates in β ladder)trans-146.1157.5-175.458.5-93.4000110.5W151 K161 K162 Y163W149-W151 AromaticContact CH2-CE2 3.94Å; W149-W151 HydrophobicContact CH2-CZ2 4.15Å; W149-W151 AromaticContact CH2-NE1 3.64Å; W149-W151 AromaticContact CZ3-CD1 3.68Å; W149-W151 HydrophobicContact CZ3-CD2 4Å; W149-W151 AromaticContact CZ3-CE2 3.52Å; W149-W151 HydrophobicContact CZ3-CG 4.09Å; W149-W151 HydrophobicContact CZ3-CZ2 4.02Å; W149-W151 AromaticContact CZ3-NE1 3.33Å; W149-W151 VanDerWaalsContact CZ3-NE1 3.33Å; W149-K161 HydrophobicContact CB-CG 4.08Å; W149-K161 VanDerWaalsContact CD1-CE 3.42Å; W149-K161 HydrophobicContact CD2-CD 3.7Å; W149-K161 HydrophobicContact CD2-CG 3.82Å; W149-K161 HydrophobicContact CE3-CB 4.45Å; W149-K161 HydrophobicContact CE3-CD 3.79Å; W149-K161 HydrophobicContact CE3-CG 3.6Å; W149-K161 HydrophobicContact CG-CD 4.06Å; W149-K161 HydrophobicContact CG-CG 4.05Å; W149-K161 HydrophobicContact CZ2-CD 4.46Å; W149-K161 HydrophobicContact CZ3-CD 4.22Å; W149-K161 HydrophobicContact CZ3-CG 4.27Å; W149-K162 CarbonylContact C-O 3.59Å; W149-K162 VanDerWaalsContact CA-O 3.22Å; W149-K162 WeakPolarHBondContact CA-O 3.39Å; W149-K162 WeakPolarHBondContact CB-O 3.46Å; W149-Y163 HydrophobicContact CB-CD1 3.84Å; W149-Y163 HydrophobicContact CB-CE1 4.21Å; W149-Y163 HydrophobicContact CB-CG 4.41Å; W149-Y163 HydrophobicContact CG-CE1 4.48Å
150R91.2Very high91.8Very high124 Ų12489.3 Ų89.347%0.46844%0.436SS..EExtended strand (participates in β ladder)trans-132.9149.3176.9-173.3171.4173.5157.4-9.7110.2I152 K162 F178R150-I152 HydrophobicContact CG-CG1 4.47Å; R150-K162 PolarHBondContact N-O 3Å; R150-K162 PolarHBondContact O-N 3.31Å; R150-F178 VanDerWaalsContact NE-CZ 3.27Å
151W93Very high91.6Very high145 Ų14589.8 Ų89.855%0.54943%0.432SS..EExtended strand (participates in β ladder)trans-76123.7167.7-70.5114.6000109.2W149 R159 K161W149-W151 AromaticContact CH2-CE2 3.94Å; W149-W151 HydrophobicContact CH2-CZ2 4.15Å; W149-W151 AromaticContact CH2-NE1 3.64Å; W149-W151 AromaticContact CZ3-CD1 3.68Å; W149-W151 HydrophobicContact CZ3-CD2 4Å; W149-W151 AromaticContact CZ3-CE2 3.52Å; W149-W151 HydrophobicContact CZ3-CG 4.09Å; W149-W151 HydrophobicContact CZ3-CZ2 4.02Å; W149-W151 AromaticContact CZ3-NE1 3.33Å; W149-W151 VanDerWaalsContact CZ3-NE1 3.33Å; W151-R159 HydrophobicContact CE3-CB 4.36Å; W151-K161 HydrophobicContact CE3-CB 4.21Å; W151-K161 HydrophobicContact CH2-CB 4.25Å; W151-K161 HydrophobicContact CZ3-CB 3.89Å
152I90.3Very high91.4Very high18 Ų1888.4 Ų88.49%0.09243%0.426CS..EExtended strand (participates in β ladder)trans-129.5143.6177.9-64.6167.3000108.1R150 R159 V160 K162 F178R150-I152 HydrophobicContact CG-CG1 4.47Å; I152-R159 CarbonylContact O-C 3.07Å; I152-R159 WeakPolarHBondContact O-CA 3.39Å; I152-V160 PolarHBondContact N-O 3.01Å; I152-V160 PolarHBondContact O-N 3.04Å; I152-K162 HydrophobicContact CD1-CB 3.64Å; I152-K162 HydrophobicContact CD1-CD 3.39Å; I152-K162 HydrophobicContact CD1-CG 4.09Å; I152-K162 HydrophobicContact CG1-CB 4.43Å; I152-F178 HydrophobicContact CD1-CB 3.45Å; I152-F178 VanDerWaalsContact CD1-CB 3.45Å; I152-F178 HydrophobicContact CD1-CD1 3.91Å; I152-F178 HydrophobicContact CD1-CD2 3.93Å; I152-F178 HydrophobicContact CD1-CG 3.42Å; I152-F178 VanDerWaalsContact CD1-CG 3.42Å; I152-F178 HydrophobicContact CG1-CB 4.28Å; I152-F178 HydrophobicContact CG1-CD2 3.89Å; I152-F178 HydrophobicContact CG1-CG 3.92Å
153V90.1Very high91.3Very high37 Ų3791 Ų9122%0.22442%0.418CS..EExtended strand (participates in β ladder)trans-82.4126.1173.9-1780000108.3F158 R159 P181 I183V153-F158 CarbonylContact C-O 3.56Å; V153-F158 WeakPolarHBondContact CA-O 3.31Å; V153-R159 HydrophobicContact CG2-CG 4.14Å; V153-P181 WeakPolarHBondContact O-CD 3.22Å; V153-P181 VanDerWaalsContact O-CG 3.29Å; V153-P181 WeakPolarHBondContact O-CG 3.44Å; V153-I183 HydrophobicContact CG1-CD1 3.77Å; V153-I183 HydrophobicContact CG1-CG1 4.32Å
154N89Confident91.2Very high46 Ų4689.5 Ų89.525%0.24641%0.413CS..  trans-78.6175.2173.772.61.7000111F156 G157 F158 V160 P181N154-F156 PolarHBondContact O-N 3.35Å; N154-F156 VanDerWaalsContact O-N 3.17Å; N154-F156 WeakPolarHBondContact OD1-CA 3.31Å; N154-F156 PolarHBondContact OD1-N 3.2Å; N154-G157 WeakPolarHBondContact O-CA 3.35Å; N154-G157 PolarHBondContact O-N 2.84Å; N154-G157 PolarHBondContact OD1-N 3.14Å; N154-F158 PolarHBondContact N-O 2.78Å; N154-F158 WeakPolarHBondContact OD1-CA 3.22Å; N154-F158 WeakPolarHBondContact OD1-CB 3.46Å; N154-F158 PolarHBondContact OD1-N 2.91Å; N154-F158 PolarHBondContact OD1-O 3.16Å; N154-V160 HydrophobicContact CB-CG2 4.36Å; N154-P181 VanDerWaalsContact C-CG 3.45Å
155E86.4Confident91Very high140 Ų14091.3 Ų91.365%0.65442%0.424SS*.THydrogen-bonded Turntrans-58.5-29.7-179.9-64.6163.8-171.200112.9G157 P181 A187E155-G157 PolarHBondContact O-N 2.96Å; E155-P181 HydrophobicContact CG-CB 3.91Å; E155-P181 HydrophobicContact CG-CG 4.26Å; E155-A187 WeakPolarHBondContact O-CB 3.39Å
156F86.9Confident91.1Very high109 Ų10999.1 Ų99.148%0.47845%0.451SS..THydrogen-bonded Turntrans-80.11.1174.4-52.7-67.8000113.4N154 F158 F190 Q191N154-F156 PolarHBondContact O-N 3.35Å; N154-F156 VanDerWaalsContact O-N 3.17Å; N154-F156 WeakPolarHBondContact OD1-CA 3.31Å; N154-F156 PolarHBondContact OD1-N 3.2Å; F156-F158 HydrophobicContact CB-CD2 4.01Å; F156-F158 HydrophobicContact CB-CE2 4.25Å; F156-F158 PolarHBondContact O-N 2.88Å; F156-F190 HydrophobicContact CB-CD1 4.04Å; F156-F190 HydrophobicContact CB-CE1 3.97Å; F156-F190 HydrophobicContact CD1-CD1 4.18Å; F156-F190 HydrophobicContact CD1-CE1 4.1Å; F156-F190 HydrophobicContact CG-CD1 4.39Å; F156-F190 HydrophobicContact CG-CE1 4.1Å; F156-Q191 WeakPolarHBondContact O-CG 3.38Å; F156-Q191 PolarHBondContact O-NE2 2.96Å
157G87.2Confident90.9Very high14 Ų1499.2 Ų99.214%0.14445%0.451CS..SBendtrans75.810.9-179.500000115.8N154 E155 Q191N154-G157 WeakPolarHBondContact O-CA 3.35Å; N154-G157 PolarHBondContact O-N 2.84Å; N154-G157 PolarHBondContact OD1-N 3.14Å; E155-G157 PolarHBondContact O-N 2.96Å; G157-Q191 PolarHBondContact O-NE2 3.44Å
158F90.7Very high90.8Very high61 Ų61102.4 Ų102.427%0.26847%0.472SS..  trans-80.6138.1172.4-62.7-53.6000111.8V153 N154 F156 V160 F190 Q191 W194V153-F158 CarbonylContact C-O 3.56Å; V153-F158 WeakPolarHBondContact CA-O 3.31Å; N154-F158 PolarHBondContact N-O 2.78Å; N154-F158 WeakPolarHBondContact OD1-CA 3.22Å; N154-F158 WeakPolarHBondContact OD1-CB 3.46Å; N154-F158 PolarHBondContact OD1-N 2.91Å; N154-F158 PolarHBondContact OD1-O 3.16Å; F156-F158 HydrophobicContact CB-CD2 4.01Å; F156-F158 HydrophobicContact CB-CE2 4.25Å; F156-F158 PolarHBondContact O-N 2.88Å; F158-V160 PolarHBondContact O-N 3.11Å; F158-F190 HydrophobicContact CE2-CD1 4.28Å; F158-F190 AromaticContact CE2-CE1 3.56Å; F158-F190 HydrophobicContact CE2-CE1 3.56Å; F158-F190 HydrophobicContact CE2-CZ 4.42Å; F158-F190 HydrophobicContact CZ-CD1 4.36Å; F158-F190 AromaticContact CZ-CE1 3.93Å; F158-F190 HydrophobicContact CZ-CE1 3.93Å; F158-Q191 HydrophobicContact CD1-CG 4.32Å; F158-Q191 HydrophobicContact CE1-CG 3.87Å; F158-Q191 HydrophobicContact CZ-CG 4.31Å; F158-W194 HydrophobicContact CE1-CG 4.5Å; F158-W194 HydrophobicContact CE2-CD2 4.48Å; F158-W194 HydrophobicContact CZ-CB 4.18Å; F158-W194 AromaticContact CZ-CD2 3.99Å; F158-W194 HydrophobicContact CZ-CD2 3.99Å; F158-W194 AromaticContact CZ-CG 3.79Å; F158-W194 HydrophobicContact CZ-CG 3.79Å
159R92.1Very high90.8Very high196 Ų196103.7 Ų103.774%0.7448%0.479SS*.EExtended strand (participates in β ladder)trans-76.2114.4171.7-66.8-166.8-61.8-97.62.4110.5W151 I152 V153W151-R159 HydrophobicContact CE3-CB 4.36Å; I152-R159 CarbonylContact O-C 3.07Å; I152-R159 WeakPolarHBondContact O-CA 3.39Å; V153-R159 HydrophobicContact CG2-CG 4.14Å
160V92Very high90.6Very high73 Ų73104 Ų10444%0.44249%0.494SS..EExtended strand (participates in β ladder)trans-115.6142.9178.4-176.80000109.5I152 N154 F158 K162I152-V160 PolarHBondContact N-O 3.01Å; I152-V160 PolarHBondContact O-N 3.04Å; N154-V160 HydrophobicContact CB-CG2 4.36Å; F158-V160 PolarHBondContact O-N 3.11Å; V160-K162 PolarHBondContact O-N 3.02Å
161K93.7Very high90.4Very high75 Ų75101.3 Ų101.333%0.32649%0.493SS..EExtended strand (participates in β ladder)trans-78.2110.1173173.7169.9167.6169.10109W149 W151 Y163W149-K161 HydrophobicContact CB-CG 4.08Å; W149-K161 VanDerWaalsContact CD1-CE 3.42Å; W149-K161 HydrophobicContact CD2-CD 3.7Å; W149-K161 HydrophobicContact CD2-CG 3.82Å; W149-K161 HydrophobicContact CE3-CB 4.45Å; W149-K161 HydrophobicContact CE3-CD 3.79Å; W149-K161 HydrophobicContact CE3-CG 3.6Å; W149-K161 HydrophobicContact CG-CD 4.06Å; W149-K161 HydrophobicContact CG-CG 4.05Å; W149-K161 HydrophobicContact CZ2-CD 4.46Å; W149-K161 HydrophobicContact CZ3-CD 4.22Å; W149-K161 HydrophobicContact CZ3-CG 4.27Å; W151-K161 HydrophobicContact CE3-CB 4.21Å; W151-K161 HydrophobicContact CH2-CB 4.25Å; W151-K161 HydrophobicContact CZ3-CB 3.89Å; K161-Y163 WeakPolarHBondContact CE-OH 3.35Å
162K91.5Very high90.2Very high117 Ų117101.5 Ų101.551%0.50950%0.498SS..EExtended strand (participates in β ladder)trans-101.7127.6175-164.3179.7-173.7178.80109.7W149 R150 I152 V160W149-K162 CarbonylContact C-O 3.59Å; W149-K162 VanDerWaalsContact CA-O 3.22Å; W149-K162 WeakPolarHBondContact CA-O 3.39Å; W149-K162 WeakPolarHBondContact CB-O 3.46Å; R150-K162 PolarHBondContact N-O 3Å; R150-K162 PolarHBondContact O-N 3.31Å; I152-K162 HydrophobicContact CD1-CB 3.64Å; I152-K162 HydrophobicContact CD1-CD 3.39Å; I152-K162 HydrophobicContact CD1-CG 4.09Å; I152-K162 HydrophobicContact CG1-CB 4.43Å; V160-K162 PolarHBondContact O-N 3.02Å
163Y93.5Very high90.1Very high115 Ų115107.3 Ų107.345%0.45154%0.536SS..EExtended strand (participates in β ladder)trans-79.9134.3173.3-68-81.4000110.4R147 W149 K161R147-Y163 HydrophobicContact CB-CD1 4.31Å; R147-Y163 HydrophobicContact CG-CD1 4.12Å; W149-Y163 HydrophobicContact CB-CD1 3.84Å; W149-Y163 HydrophobicContact CB-CE1 4.21Å; W149-Y163 HydrophobicContact CB-CG 4.41Å; W149-Y163 HydrophobicContact CG-CE1 4.48Å; K161-Y163 WeakPolarHBondContact CE-OH 3.35Å
164L90.8Very high89.9Confident75 Ų75109.5 Ų109.539%0.39357%0.567SS.*PPolyproline II helixtrans-68.9141.3179.1-62.6176.4000110.3R147 P148R147-L164 VanDerWaalsContact CZ-O 3.26Å; R147-L164 PolarHBondContact NE-O 2.98Å; R147-L164 PolarHBondContact NH2-O 3.28Å; P148-L164 HydrophobicContact CB-CD1 3.96Å; P148-L164 HydrophobicContact CG-CB 4.27Å; P148-L164 HydrophobicContact CG-CD1 3.99Å; P148-L164 PolarHBondContact O-N 3.3Å
165T90Very high89.5Confident85 Ų85112 Ų11252%0.52158%0.577SS.*PPolyproline II helixtrans-101152.7174.339.80000109.9R147 H167R147-T165 VanDerWaalsContact NH2-CG2 3.31Å; T165-H167 PolarHBondContact O-CD2 3.46Å; T165-H167 PolarHBondContact OG1-NE2 2.93Å
166E91.7Very high88.9Confident200 Ų200110.1 Ų110.194%0.93557%0.568SS**PPolyproline II helixtrans-76.4137.9170.5-65.7173.3-169.900108.6
167H88.5Confident88.1Confident134 Ų134108.8 Ų108.862%0.6257%0.571SS**  trans-126.7144.7178.2-64.2-88.8000108.7T165T165-H167 PolarHBondContact O-CD2 3.46Å; T165-H167 PolarHBondContact OG1-NE2 2.93Å
168E92.8Very high87.4Confident203 Ų203108.9 Ų108.995%0.94957%0.567SS**SBendtrans-71.9-35.9179.6-62.7-175165.200112.2
169T91.6Very high86.5Confident106 Ų106113.5 Ų113.565%0.6559%0.589SS**SBendtrans-117.7148.3-179.349.70000110.8
170P89.6Confident85.7Confident110 Ų110110 Ų11071%0.71458%0.582SS**PPolyproline II helixtrans-65.3156.117229.3-34.6000110.5
171P87.6Confident85.1Confident69 Ų69108.3 Ų108.345%0.44857%0.572SS.*PPolyproline II helixtrans-55.7142.3171.6-1726.9000110.6E175 P177P171-E175 HydrophobicContact CB-CB 4.5Å; P171-E175 WeakPolarHBondContact CB-O 3.35Å; P171-P177 HydrophobicContact CG-CB 4.37Å; P171-P177 HydrophobicContact CG-CG 3.81Å
172K88.7Confident84.4Confident148 Ų148114.5 Ų114.564%0.64360%0.595SS**PPolyproline II helixtrans-62.6153.1175.4-65.7173.1-172.6159.30109.7G174 E175K172-G174 PolarHBondContact O-N 3.39Å; K172-E175 HydrophobicContact CB-CB 4.14Å; K172-E175 WeakPolarHBondContact O-CB 3.49Å; K172-E175 PolarHBondContact O-N 2.92Å
173P88.9Confident84Confident140 Ų140110.8 Ų110.891%0.90958%0.58SS**THydrogen-bonded Turntrans-53117.6172.5-24.534.1000110.8
174G84.4Confident83.6Confident84 Ų84107.6 Ų107.687%0.86657%0.574SS**THydrogen-bonded Turntrans94.5-12.3-177.300000115.7K172K172-G174 PolarHBondContact O-N 3.39Å
175E81.1Confident83.6Confident97 Ų97109.9 Ų109.945%0.45359%0.587SS.*  trans-87.9111.5172-169.2173.6-174.600108.2P171 K172P171-E175 HydrophobicContact CB-CB 4.5Å; P171-E175 WeakPolarHBondContact CB-O 3.35Å; K172-E175 HydrophobicContact CB-CB 4.14Å; K172-E175 WeakPolarHBondContact O-CB 3.49Å; K172-E175 PolarHBondContact O-N 2.92Å
176E73.5Confident83.6Confident102 Ų102111.9 Ų111.948%0.47760%0.595SS.*  trans-73.8141.6171.8-65.8-157.9166.300109.4F178E176-F178 VanDerWaalsContact CB-O 3.24Å; E176-F178 WeakPolarHBondContact CB-O 3.42Å; E176-F178 PolarHBondContact O-N 2.87Å
177P70.5Confident83.6Confident81 Ų81102.5 Ų102.553%0.52655%0.552SS.*SBendtrans-56.3-18.1176-1622.8000113.5P171P171-P177 HydrophobicContact CG-CB 4.37Å; P171-P177 HydrophobicContact CG-CG 3.81Å
178F73.2Confident83.6Confident15 Ų15102.3 Ų102.37%0.06655%0.546CS..SBendtrans-139.8120171.844.6-84.3000106.5R150 I152 E176 E180R150-F178 VanDerWaalsContact NE-CZ 3.27Å; I152-F178 HydrophobicContact CD1-CB 3.45Å; I152-F178 VanDerWaalsContact CD1-CB 3.45Å; I152-F178 HydrophobicContact CD1-CD1 3.91Å; I152-F178 HydrophobicContact CD1-CD2 3.93Å; I152-F178 HydrophobicContact CD1-CG 3.42Å; I152-F178 VanDerWaalsContact CD1-CG 3.42Å; I152-F178 HydrophobicContact CG1-CB 4.28Å; I152-F178 HydrophobicContact CG1-CD2 3.89Å; I152-F178 HydrophobicContact CG1-CG 3.92Å; E176-F178 VanDerWaalsContact CB-O 3.24Å; E176-F178 WeakPolarHBondContact CB-O 3.42Å; E176-F178 PolarHBondContact O-N 2.87Å; F178-E180 PolarHBondContact O-N 2.89Å
179E70.5Confident83.6Confident158 Ų15895.6 Ų95.674%0.73852%0.519SS*.  trans-72.1126.2168.2-64.6177.6175.500107.8P181E179-P181 WeakPolarHBondContact O-CD 3.38Å
180E76.5Confident83.6Confident123 Ų12394 Ų9458%0.57550%0.503SS*.  trans-70.8113.5166.8-67.2-170.2169.900107.4F178F178-E180 PolarHBondContact O-N 2.89Å
181P77.7Confident83.7Confident37 Ų3790.2 Ų90.224%0.2448%0.476CS..  trans-65143.6-174.126.4-32.5000109.9V153 N154 E155 E179 I183V153-P181 WeakPolarHBondContact O-CD 3.22Å; V153-P181 VanDerWaalsContact O-CG 3.29Å; V153-P181 WeakPolarHBondContact O-CG 3.44Å; N154-P181 VanDerWaalsContact C-CG 3.45Å; E155-P181 HydrophobicContact CG-CB 3.91Å; E155-P181 HydrophobicContact CG-CG 4.26Å; E179-P181 WeakPolarHBondContact O-CD 3.38Å; P181-I183 PolarHBondContact O-N 3.3Å; P181-I183 VanDerWaalsContact O-N 3.09Å
182Y78.9Confident84Confident206 Ų20693.7 Ų93.781%0.80848%0.48SS*.  trans-62.1114.6167.8-178.8-94.5000109S184Y182-S184 PolarHBondContact O-N 3.17Å
183I84.1Confident84.4Confident38 Ų3890.9 Ų90.920%0.19547%0.472CS..  trans-78110.9179.5-54.6173.6000107.4V153 P181 A187 Y188V153-I183 HydrophobicContact CG1-CD1 3.77Å; V153-I183 HydrophobicContact CG1-CG1 4.32Å; P181-I183 PolarHBondContact O-N 3.3Å; P181-I183 VanDerWaalsContact O-N 3.09Å; I183-A187 HydrophobicContact CG2-CB 3.61Å; I183-Y188 HydrophobicContact CB-CE2 4.12Å; I183-Y188 HydrophobicContact CG2-CD2 3.93Å; I183-Y188 HydrophobicContact CG2-CE2 3.59Å
184S85.9Confident84.6Confident48 Ų4889.7 Ų89.734%0.33645%0.449SS..  trans-66.2156.7175.365.60000111.5Y182 D186 A187 Y188Y182-S184 PolarHBondContact O-N 3.17Å; S184-D186 PolarHBondContact O-N 3.22Å; S184-A187 VanDerWaalsContact O-CB 3.31Å; S184-A187 WeakPolarHBondContact O-CB 3.49Å; S184-A187 PolarHBondContact O-N 3.37Å; S184-A187 PolarHBondContact OG-N 3.39Å; S184-Y188 PolarHBondContact O-N 2.94Å
185D89Confident85.1Confident123 Ų12392.2 Ų92.266%0.65844%0.436SS*.Hα-helixtrans-56.7-34.8173.5-70.1-19.9000111.6A187 Y188 V189D185-A187 VanDerWaalsContact C-N 3.28Å; D185-A187 PolarHBondContact O-N 2.96Å; D185-Y188 WeakPolarHBondContact O-CB 3.42Å; D185-Y188 PolarHBondContact O-N 2.92Å; D185-Y188 VanDerWaalsContact O-N 3.12Å; D185-V189 PolarHBondContact O-N 3.1Å; D185-V189 VanDerWaalsContact O-N 3.09Å
186D91Very high85.9Confident127 Ų12792.4 Ų92.468%0.67944%0.437SS*.Hα-helixtrans-59.6-36.9174.4-64.3-23.2000112.3S184 Y188 V189 F190S184-D186 PolarHBondContact O-N 3.22Å; D186-Y188 VanDerWaalsContact C-N 3.33Å; D186-Y188 PolarHBondContact O-N 3.12Å; D186-V189 PolarHBondContact O-N 2.64Å; D186-F190 VanDerWaalsContact O-CB 3.25Å; D186-F190 WeakPolarHBondContact O-CB 3.14Å; D186-F190 PolarHBondContact O-N 3.19Å
187A91.3Very high87Confident4 Ų493.7 Ų93.73%0.03344%0.441CS..Hα-helixtrans-65.4-36.3176.500000111.7E155 I183 S184 D185 F190 Q191E155-A187 WeakPolarHBondContact O-CB 3.39Å; I183-A187 HydrophobicContact CG2-CB 3.61Å; S184-A187 VanDerWaalsContact O-CB 3.31Å; S184-A187 WeakPolarHBondContact O-CB 3.49Å; S184-A187 PolarHBondContact O-N 3.37Å; S184-A187 PolarHBondContact OG-N 3.39Å; D185-A187 VanDerWaalsContact C-N 3.28Å; D185-A187 PolarHBondContact O-N 2.96Å; A187-F190 WeakPolarHBondContact O-CB 3.46Å; A187-F190 PolarHBondContact O-N 2.92Å; A187-Q191 WeakPolarHBondContact O-CG 3.46Å; A187-Q191 PolarHBondContact O-N 2.93Å
188Y88.2Confident88.3Confident130 Ų13093.4 Ų93.451%0.5144%0.435SS..Hα-helixtrans-67.3-43.5173.8-74.4-74.8000112.4I183 S184 D185 D186 F190 Q191 R192I183-Y188 HydrophobicContact CB-CE2 4.12Å; I183-Y188 HydrophobicContact CG2-CD2 3.93Å; I183-Y188 HydrophobicContact CG2-CE2 3.59Å; S184-Y188 PolarHBondContact O-N 2.94Å; D185-Y188 WeakPolarHBondContact O-CB 3.42Å; D185-Y188 PolarHBondContact O-N 2.92Å; D185-Y188 VanDerWaalsContact O-N 3.12Å; D186-Y188 VanDerWaalsContact C-N 3.33Å; D186-Y188 PolarHBondContact O-N 3.12Å; Y188-F190 VanDerWaalsContact C-N 3.28Å; Y188-F190 PolarHBondContact O-N 3.37Å; Y188-Q191 PolarHBondContact O-N 3.1Å; Y188-R192 PolarHBondContact O-N 3.45Å; Y188-R192 VanDerWaalsContact O-N 3.07Å
189V92.5Very high89.4Confident61 Ų6199.6 Ų99.637%0.3746%0.459SS..Hα-helixtrans-59.7-44.7174.5175.70000110D185 D186 Q191 R192 L193D185-V189 PolarHBondContact O-N 3.1Å; D185-V189 VanDerWaalsContact O-N 3.09Å; D186-V189 PolarHBondContact O-N 2.64Å; V189-Q191 PolarHBondContact O-N 3.48Å; V189-R192 WeakPolarHBondContact O-CB 3.46Å; V189-R192 PolarHBondContact O-N 2.99Å; V189-L193 HydrophobicContact CG1-CD1 4.03Å; V189-L193 HydrophobicContact CG1-CG 4.4Å; V189-L193 WeakPolarHBondContact O-CG 3.24Å; V189-L193 PolarHBondContact O-N 2.9Å
190F93.3Very high90.6Very high74 Ų7495.3 Ų95.333%0.32545%0.446SS..Hα-helixtrans-59.5-45.9176.7174.6-107.6000112.2F156 F158 D186 A187 Y188 R192 L193 W194F156-F190 HydrophobicContact CB-CD1 4.04Å; F156-F190 HydrophobicContact CB-CE1 3.97Å; F156-F190 HydrophobicContact CD1-CD1 4.18Å; F156-F190 HydrophobicContact CD1-CE1 4.1Å; F156-F190 HydrophobicContact CG-CD1 4.39Å; F156-F190 HydrophobicContact CG-CE1 4.1Å; F158-F190 HydrophobicContact CE2-CD1 4.28Å; F158-F190 AromaticContact CE2-CE1 3.56Å; F158-F190 HydrophobicContact CE2-CE1 3.56Å; F158-F190 HydrophobicContact CE2-CZ 4.42Å; F158-F190 HydrophobicContact CZ-CD1 4.36Å; F158-F190 AromaticContact CZ-CE1 3.93Å; F158-F190 HydrophobicContact CZ-CE1 3.93Å; D186-F190 VanDerWaalsContact O-CB 3.25Å; D186-F190 WeakPolarHBondContact O-CB 3.14Å; D186-F190 PolarHBondContact O-N 3.19Å; A187-F190 WeakPolarHBondContact O-CB 3.46Å; A187-F190 PolarHBondContact O-N 2.92Å; Y188-F190 VanDerWaalsContact C-N 3.28Å; Y188-F190 PolarHBondContact O-N 3.37Å; F190-R192 VanDerWaalsContact C-N 3.3Å; F190-R192 PolarHBondContact O-N 3.06Å; F190-L193 PolarHBondContact O-N 2.91Å; F190-W194 HydrophobicContact CE1-CE3 4.13Å; F190-W194 AromaticContact CE2-CE3 3.89Å; F190-W194 HydrophobicContact CE2-CE3 3.89Å; F190-W194 HydrophobicContact CE2-CZ3 4.36Å; F190-W194 HydrophobicContact CZ-CD2 4.43Å; F190-W194 AromaticContact CZ-CE3 3.42Å; F190-W194 HydrophobicContact CZ-CE3 3.42Å; F190-W194 VanDerWaalsContact CZ-CE3 3.42Å; F190-W194 AromaticContact CZ-CZ3 3.76Å; F190-W194 HydrophobicContact CZ-CZ3 3.76Å; F190-W194 VanDerWaalsContact O-CB 3.24Å; F190-W194 WeakPolarHBondContact O-CB 3.36Å; F190-W194 PolarHBondContact O-N 3.39Å
191Q91.7Very high91.6Very high29 Ų2992.9 Ų92.914%0.13644%0.437CS..Hα-helixtrans-60.1-38.8175.7-74.3177.916.900113.1F156 G157 F158 A187 Y188 V189 K195F156-Q191 WeakPolarHBondContact O-CG 3.38Å; F156-Q191 PolarHBondContact O-NE2 2.96Å; G157-Q191 PolarHBondContact O-NE2 3.44Å; F158-Q191 HydrophobicContact CD1-CG 4.32Å; F158-Q191 HydrophobicContact CE1-CG 3.87Å; F158-Q191 HydrophobicContact CZ-CG 4.31Å; A187-Q191 WeakPolarHBondContact O-CG 3.46Å; A187-Q191 PolarHBondContact O-N 2.93Å; Y188-Q191 PolarHBondContact O-N 3.1Å; V189-Q191 PolarHBondContact O-N 3.48Å; Q191-K195 VanDerWaalsContact O-CG 3.31Å; Q191-K195 WeakPolarHBondContact O-CG 3.41Å; Q191-K195 PolarHBondContact O-N 3.09Å
192R93.5Very high92.5Very high143 Ų14398 Ų9854%0.5446%0.456SS..Hα-helixtrans-63.7-52.8176.4-176.1-176.569.3-157-2.5110.5Y188 V189 F190 W194 K195 E196Y188-R192 PolarHBondContact O-N 3.45Å; Y188-R192 VanDerWaalsContact O-N 3.07Å; V189-R192 WeakPolarHBondContact O-CB 3.46Å; V189-R192 PolarHBondContact O-N 2.99Å; F190-R192 VanDerWaalsContact C-N 3.3Å; F190-R192 PolarHBondContact O-N 3.06Å; R192-W194 PolarHBondContact O-N 3.43Å; R192-K195 WeakPolarHBondContact O-CB 3.46Å; R192-K195 PolarHBondContact O-N 3.4Å; R192-K195 VanDerWaalsContact O-N 3.1Å; R192-E196 PolarHBondContact O-N 2.8Å
193L95.9Very high93.1Very high89 Ų8994 Ų9447%0.46644%0.439SS..Hα-helixtrans-60.5-36.4177.9-67.1175.5000111.8V189 F190 E196 K197V189-L193 HydrophobicContact CG1-CD1 4.03Å; V189-L193 HydrophobicContact CG1-CG 4.4Å; V189-L193 WeakPolarHBondContact O-CG 3.24Å; V189-L193 PolarHBondContact O-N 2.9Å; F190-L193 PolarHBondContact O-N 2.91Å; L193-E196 PolarHBondContact O-N 3.35Å; L193-K197 WeakPolarHBondContact O-CB 3.43Å; L193-K197 PolarHBondContact O-N 3.33Å
194W94.6Very high93.5Very high114 Ų11498.4 Ų98.443%0.43246%0.459SS..Hα-helixtrans-64.1-42.6175.1-171.9-78.7000111.9F158 F190 R192 K197 L198F158-W194 HydrophobicContact CE1-CG 4.5Å; F158-W194 HydrophobicContact CE2-CD2 4.48Å; F158-W194 HydrophobicContact CZ-CB 4.18Å; F158-W194 AromaticContact CZ-CD2 3.99Å; F158-W194 HydrophobicContact CZ-CD2 3.99Å; F158-W194 AromaticContact CZ-CG 3.79Å; F158-W194 HydrophobicContact CZ-CG 3.79Å; F190-W194 HydrophobicContact CE1-CE3 4.13Å; F190-W194 AromaticContact CE2-CE3 3.89Å; F190-W194 HydrophobicContact CE2-CE3 3.89Å; F190-W194 HydrophobicContact CE2-CZ3 4.36Å; F190-W194 HydrophobicContact CZ-CD2 4.43Å; F190-W194 AromaticContact CZ-CE3 3.42Å; F190-W194 HydrophobicContact CZ-CE3 3.42Å; F190-W194 VanDerWaalsContact CZ-CE3 3.42Å; F190-W194 AromaticContact CZ-CZ3 3.76Å; F190-W194 HydrophobicContact CZ-CZ3 3.76Å; F190-W194 VanDerWaalsContact O-CB 3.24Å; F190-W194 WeakPolarHBondContact O-CB 3.36Å; F190-W194 PolarHBondContact O-N 3.39Å; R192-W194 PolarHBondContact O-N 3.43Å; W194-K197 PolarHBondContact O-N 2.87Å; W194-L198 WeakPolarHBondContact O-CG 3.31Å; W194-L198 PolarHBondContact O-N 3.44Å
195K95Very high93.9Very high138 Ų13898.3 Ų98.360%0.646%0.461SS*.Hα-helixtrans-64.2-41.6175.2-74.2170.6-176.5171.80111.7Q191 R192 L198 Y199Q191-K195 VanDerWaalsContact O-CG 3.31Å; Q191-K195 WeakPolarHBondContact O-CG 3.41Å; Q191-K195 PolarHBondContact O-N 3.09Å; R192-K195 WeakPolarHBondContact O-CB 3.46Å; R192-K195 PolarHBondContact O-N 3.4Å; R192-K195 VanDerWaalsContact O-N 3.1Å; K195-L198 PolarHBondContact O-N 3.38Å; K195-Y199 WeakPolarHBondContact O-CB 3.46Å; K195-Y199 PolarHBondContact O-N 2.91Å
196E97.2Very high94Very high100 Ų10098.7 Ų98.747%0.46745%0.454SS..Hα-helixtrans-61.7-45174.8-71.8170.8-167.600111.1R192 L193 Y199 S200R192-E196 PolarHBondContact O-N 2.8Å; L193-E196 PolarHBondContact O-N 3.35Å; E196-Y199 WeakPolarHBondContact O-CB 3.4Å; E196-Y199 PolarHBondContact O-N 2.89Å; E196-S200 PolarHBondContact O-N 3.01Å; E196-S200 PolarHBondContact O-OG 3.27Å
197K97.5Very high93.9Very high129 Ų12995.4 Ų95.456%0.56144%0.436SS*.Hα-helixtrans-59.3-51.1174.7-175.8179.3177.8-1800112L193 W194 Y199 S200 D201L193-K197 WeakPolarHBondContact O-CB 3.43Å; L193-K197 PolarHBondContact O-N 3.33Å; W194-K197 PolarHBondContact O-N 2.87Å; K197-Y199 PolarHBondContact O-N 3.03Å; K197-S200 WeakPolarHBondContact O-CB 3.24Å; K197-S200 PolarHBondContact O-N 3.3Å; K197-D201 VanDerWaalsContact O-CG 3.31Å; K197-D201 PolarHBondContact O-N 2.94Å
198L96.2Very high93.8Very high76 Ų7698 Ų9840%0.39845%0.451SS..Hα-helixtrans-57.4-33.9176.9-75.9178000112.4W194 K195 K202W194-L198 WeakPolarHBondContact O-CG 3.31Å; W194-L198 PolarHBondContact O-N 3.44Å; K195-L198 PolarHBondContact O-N 3.38Å; L198-K202 WeakPolarHBondContact O-CB 3.48Å; L198-K202 VanDerWaalsContact O-CG 3.22Å; L198-K202 WeakPolarHBondContact O-CG 3.41Å; L198-K202 PolarHBondContact O-N 3.04Å; L198-K202 VanDerWaalsContact O-N 3.09Å
199Y95.9Very high93.9Very high144 Ų14498 Ų9857%0.56546%0.456SS*.Hα-helixtrans-69.5-44.5175.3179.3-98.6000111.7K195 E196 K197 K202 R203K195-Y199 WeakPolarHBondContact O-CB 3.46Å; K195-Y199 PolarHBondContact O-N 2.91Å; E196-Y199 WeakPolarHBondContact O-CB 3.4Å; E196-Y199 PolarHBondContact O-N 2.89Å; K197-Y199 PolarHBondContact O-N 3.03Å; Y199-K202 PolarHBondContact O-N 3.19Å; Y199-R203 HydrophobicContact CD1-CG 4.44Å; Y199-R203 VanDerWaalsContact CE1-CD 3.43Å; Y199-R203 HydrophobicContact CE1-CG 4.05Å; Y199-R203 WeakPolarHBondContact O-CG 3.49Å; Y199-R203 PolarHBondContact O-N 3Å
200S96.2Very high93.7Very high69 Ų6997.8 Ų97.848%0.48345%0.452SS..Hα-helixtrans-59.5-47.9173.9-64.70000111.9E196 K197 K202 R203 E204E196-S200 PolarHBondContact O-N 3.01Å; E196-S200 PolarHBondContact O-OG 3.27Å; K197-S200 WeakPolarHBondContact O-CB 3.24Å; K197-S200 PolarHBondContact O-N 3.3Å; S200-K202 VanDerWaalsContact C-N 3.34Å; S200-K202 PolarHBondContact O-N 3.19Å; S200-R203 WeakPolarHBondContact O-CB 3.35Å; S200-R203 PolarHBondContact O-N 2.85Å; S200-E204 PolarHBondContact O-N 3.38Å
201D97.1Very high93.3Very high72 Ų72102 Ų10239%0.38547%0.466SS..Hα-helixtrans-60.7-42.4178.5-63.4-9.6000111.2K197 R203 E204 A205K197-D201 VanDerWaalsContact O-CG 3.31Å; K197-D201 PolarHBondContact O-N 2.94Å; D201-R203 VanDerWaalsContact C-N 3.31Å; D201-R203 PolarHBondContact O-N 3.45Å; D201-E204 PolarHBondContact O-N 2.85Å; D201-A205 WeakPolarHBondContact O-CB 3.1Å; D201-A205 PolarHBondContact O-N 3.37Å
202K96.5Very high93.1Very high144 Ų144106.9 Ų106.963%0.62649%0.493SS*.Hα-helixtrans-64.1-34.7175.1-79.2176.6-179.2-179.10112.9L198 Y199 S200 R206L198-K202 WeakPolarHBondContact O-CB 3.48Å; L198-K202 VanDerWaalsContact O-CG 3.22Å; L198-K202 WeakPolarHBondContact O-CG 3.41Å; L198-K202 PolarHBondContact O-N 3.04Å; L198-K202 VanDerWaalsContact O-N 3.09Å; Y199-K202 PolarHBondContact O-N 3.19Å; S200-K202 VanDerWaalsContact C-N 3.34Å; S200-K202 PolarHBondContact O-N 3.19Å; K202-R206 PolarHBondContact O-N 2.98Å
203R93.1Very high92.9Very high122 Ų122102.6 Ų102.646%0.4649%0.485SS..Hα-helixtrans-68-49.5175.3-81.2-169.455.8177.4-5.1110.7Y199 S200 D201 A205 R206 D207Y199-R203 HydrophobicContact CD1-CG 4.44Å; Y199-R203 VanDerWaalsContact CE1-CD 3.43Å; Y199-R203 HydrophobicContact CE1-CG 4.05Å; Y199-R203 WeakPolarHBondContact O-CG 3.49Å; Y199-R203 PolarHBondContact O-N 3Å; S200-R203 WeakPolarHBondContact O-CB 3.35Å; S200-R203 PolarHBondContact O-N 2.85Å; D201-R203 VanDerWaalsContact C-N 3.31Å; D201-R203 PolarHBondContact O-N 3.45Å; R203-A205 VanDerWaalsContact C-N 3.34Å; R203-A205 PolarHBondContact O-N 2.9Å; R203-R206 WeakPolarHBondContact O-CB 3.33Å; R203-R206 PolarHBondContact O-N 3.1Å; R203-D207 PolarHBondContact O-N 3.01Å
204E92Very high92.2Very high130 Ų130101.6 Ų101.661%0.60750%0.496SS*.Hα-helixtrans-60-44178.7-174.7173.4-166.900111.5S200 D201 R206 D207 V208S200-E204 PolarHBondContact O-N 3.38Å; D201-E204 PolarHBondContact O-N 2.85Å; E204-R206 VanDerWaalsContact C-N 3.32Å; E204-R206 PolarHBondContact O-N 3Å; E204-D207 PolarHBondContact O-N 2.85Å; E204-D207 VanDerWaalsContact O-N 3.1Å; E204-V208 WeakPolarHBondContact O-CG2 3.42Å; E204-V208 PolarHBondContact O-N 2.76Å
205A94.3Very high91.3Very high47 Ų47105 Ų10539%0.38851%0.509SS..Hα-helixtrans-57.7-43.5174.900000112.4D201 R203 D207 V208 E209D201-A205 WeakPolarHBondContact O-CB 3.1Å; D201-A205 PolarHBondContact O-N 3.37Å; R203-A205 VanDerWaalsContact C-N 3.34Å; R203-A205 PolarHBondContact O-N 2.9Å; A205-D207 VanDerWaalsContact C-N 3.34Å; A205-D207 PolarHBondContact O-N 3.47Å; A205-V208 PolarHBondContact O-N 3.06Å; A205-E209 WeakPolarHBondContact O-CG 3.33Å; A205-E209 PolarHBondContact O-N 3.37Å
206R91.1Very high90.3Very high131 Ų131100.2 Ų100.249%0.49449%0.488SS..Hα-helixtrans-63.5-40175.4-171.8-170.6-62.1116-0.5111.8K202 R203 E204 V208 E209 L210K202-R206 PolarHBondContact O-N 2.98Å; R203-R206 WeakPolarHBondContact O-CB 3.33Å; R203-R206 PolarHBondContact O-N 3.1Å; E204-R206 VanDerWaalsContact C-N 3.32Å; E204-R206 PolarHBondContact O-N 3Å; R206-V208 VanDerWaalsContact C-N 3.33Å; R206-E209 PolarHBondContact O-N 3.18Å; R206-L210 HydrophobicContact CG-CD1 4.34Å; R206-L210 WeakPolarHBondContact O-CB 3.49Å; R206-L210 VanDerWaalsContact O-CG 3.31Å; R206-L210 WeakPolarHBondContact O-CG 3.25Å; R206-L210 PolarHBondContact O-N 3.17Å
207D88.7Confident88.9Confident58 Ų58103.9 Ų103.931%0.3150%0.503SS..Hα-helixtrans-66.1-37.9178.2-67.6-16.6000110.6R203 E204 A205 L210 R211 H216R203-D207 PolarHBondContact O-N 3.01Å; E204-D207 PolarHBondContact O-N 2.85Å; E204-D207 VanDerWaalsContact O-N 3.1Å; A205-D207 VanDerWaalsContact C-N 3.34Å; A205-D207 PolarHBondContact O-N 3.47Å; D207-L210 PolarHBondContact O-N 3.32Å; D207-R211 WeakPolarHBondContact O-CB 3.29Å; D207-R211 PolarHBondContact O-N 3.36Å; D207-H216 PolarHBondContact O-CD2 3.09Å
208V89.1Confident87.4Confident57 Ų57103.9 Ų103.935%0.34550%0.5SS..Hα-helixtrans-63.5-49.3171.41740000111.4E204 A205 R206 L210 R211 D212E204-V208 WeakPolarHBondContact O-CG2 3.42Å; E204-V208 PolarHBondContact O-N 2.76Å; A205-V208 PolarHBondContact O-N 3.06Å; R206-V208 VanDerWaalsContact C-N 3.33Å; V208-L210 VanDerWaalsContact C-N 3.26Å; V208-L210 PolarHBondContact O-N 3.07Å; V208-R211 WeakPolarHBondContact O-CA 3.49Å; V208-R211 WeakPolarHBondContact O-CB 3.47Å; V208-R211 PolarHBondContact O-N 3.2Å; V208-D212 PolarHBondContact O-N 2.81Å
209E90.9Very high85.6Confident132 Ų132107 Ų10762%0.61752%0.522SS*.Hα-helixtrans-57.8-38.8176.8-73.3173.4-173.700112.5A205 R206 S213A205-E209 WeakPolarHBondContact O-CG 3.33Å; A205-E209 PolarHBondContact O-N 3.37Å; R206-E209 PolarHBondContact O-N 3.18Å; E209-S213 VanDerWaalsContact O-CB 3.31Å; E209-S213 WeakPolarHBondContact O-CB 3.31Å; E209-S213 PolarHBondContact O-N 3.3Å; E209-S213 PolarHBondContact O-OG 3.45Å
210L87.8Confident83.7Confident56 Ų56107.2 Ų107.229%0.29352%0.523SS..Hα-helixtrans-66.9-38.1175-78173.5000111.8R206 D207 V208 S213 G214 R215 H216R206-L210 HydrophobicContact CG-CD1 4.34Å; R206-L210 WeakPolarHBondContact O-CB 3.49Å; R206-L210 VanDerWaalsContact O-CG 3.31Å; R206-L210 WeakPolarHBondContact O-CG 3.25Å; R206-L210 PolarHBondContact O-N 3.17Å; D207-L210 PolarHBondContact O-N 3.32Å; V208-L210 VanDerWaalsContact C-N 3.26Å; V208-L210 PolarHBondContact O-N 3.07Å; L210-S213 WeakPolarHBondContact CA-OG 3.46Å; L210-S213 PolarHBondContact O-OG 2.8Å; L210-G214 PolarHBondContact O-N 3.33Å; L210-R215 HydrophobicContact CD2-CB 4.23Å; L210-R215 PolarHBondContact O-N 3.45Å; L210-H216 HydrophobicContact CB-CB 4.17Å; L210-H216 PolarHBondContact O-N 2.83Å
211R84.1Confident81.2Confident161 Ų161115.1 Ų115.161%0.60854%0.542SS*.Hα-helixtrans-65.3-48.1175.3-173.1-174.6-65.11610.9111.2D207 V208 S213 G214 H216D207-R211 WeakPolarHBondContact O-CB 3.29Å; D207-R211 PolarHBondContact O-N 3.36Å; V208-R211 WeakPolarHBondContact O-CA 3.49Å; V208-R211 WeakPolarHBondContact O-CB 3.47Å; V208-R211 PolarHBondContact O-N 3.2Å; R211-S213 VanDerWaalsContact C-N 3.32Å; R211-S213 PolarHBondContact O-N 2.91Å; R211-G214 PolarHBondContact O-N 2.97Å; R211-H216 HydrophobicContact CB-CB 4.47Å
212D88.1Confident78.6Confident132 Ų132124.8 Ų124.871%0.70658%0.575SS**Hα-helixtrans-65.9-35.1-179.7-68.3-11.1000112V208 G214V208-D212 PolarHBondContact O-N 2.81Å; D212-G214 PolarHBondContact O-N 3.12Å
213S89.4Confident77.7Confident54 Ų54123.8 Ų123.838%0.37857%0.572SS.*THydrogen-bonded Turntrans-77.2-2.2174.162.70000114.3E209 L210 R211 R215E209-S213 VanDerWaalsContact O-CB 3.31Å; E209-S213 WeakPolarHBondContact O-CB 3.31Å; E209-S213 PolarHBondContact O-N 3.3Å; E209-S213 PolarHBondContact O-OG 3.45Å; L210-S213 WeakPolarHBondContact CA-OG 3.46Å; L210-S213 PolarHBondContact O-OG 2.8Å; R211-S213 VanDerWaalsContact C-N 3.32Å; R211-S213 PolarHBondContact O-N 2.91Å; S213-R215 PolarHBondContact O-N 3.48Å; S213-R215 VanDerWaalsContact O-N 3.14Å; S213-R215 PolarHBondContact OG-NE 3.41Å
214G81.7Confident76.9Confident67 Ų67123.9 Ų123.969%0.69158%0.578SS**THydrogen-bonded Turntrans65.610.2-176.400000114.4L210 R211 D212L210-G214 PolarHBondContact O-N 3.33Å; R211-G214 PolarHBondContact O-N 2.97Å; D212-G214 PolarHBondContact O-N 3.12Å
215R76Confident76Confident185 Ų185123.6 Ų123.670%0.69858%0.577SS**  trans-976-179.3-65.7-175.1-64.4-171.11112.9L210 S213 K217L210-R215 HydrophobicContact CD2-CB 4.23Å; L210-R215 PolarHBondContact O-N 3.45Å; S213-R215 PolarHBondContact O-N 3.48Å; S213-R215 VanDerWaalsContact O-N 3.14Å; S213-R215 PolarHBondContact OG-NE 3.41Å; R215-K217 PolarHBondContact O-N 3.47Å; R215-K217 VanDerWaalsContact O-N 3.11Å
216H72.5Confident75Confident38 Ų38128.1 Ų128.118%0.17659%0.588CS.*  trans-67.5111.7-178.3-158.4-87.1000110.5D207 L210 R211 Y218D207-H216 PolarHBondContact O-CD2 3.09Å; L210-H216 HydrophobicContact CB-CB 4.17Å; L210-H216 PolarHBondContact O-N 2.83Å; R211-H216 HydrophobicContact CB-CB 4.47Å; H216-Y218 PolarHBondContact CE1-O 3.34Å; H216-Y218 PolarHBondContact ND1-N 2.95Å; H216-Y218 PolarHBondContact ND1-O 3.09Å; H216-Y218 PolarHBondContact O-N 3.35Å; H216-Y218 VanDerWaalsContact O-N 3.12Å
217K69.4Low74Confident177 Ų177127.9 Ų127.977%0.7759%0.594SS**SBendtrans-61.5-22-176.7-171174.3-178.1-177.10113.3R215R215-K217 PolarHBondContact O-N 3.47Å; R215-K217 VanDerWaalsContact O-N 3.11Å
218Y65.5Low73Confident130 Ų130132.5 Ų132.551%0.5161%0.613SS.*  trans-121.4101.5-177.3-62.2-81000111.7H216 Y220H216-Y218 PolarHBondContact CE1-O 3.34Å; H216-Y218 PolarHBondContact ND1-N 2.95Å; H216-Y218 PolarHBondContact ND1-O 3.09Å; H216-Y218 PolarHBondContact O-N 3.35Å; H216-Y218 VanDerWaalsContact O-N 3.12Å; Y218-Y220 VanDerWaalsContact C-N 3.26Å; Y218-Y220 VanDerWaalsContact CB-CE2 3.46Å; Y218-Y220 HydrophobicContact CG-CE2 4.05Å; Y218-Y220 PolarHBondContact O-N 3.31Å
219V57.5Low71.8Confident140 Ų140137.9 Ų137.985%0.84863%0.632SS**  trans-74.785.5167.4-176.50000107.5R221V219-R221 VanDerWaalsContact C-N 3.33Å; V219-R221 PolarHBondContact O-N 3.21Å
220Y56Low70.3Confident150 Ų150138.4 Ų138.459%0.58863%0.633SS**  trans-71.897.1166.3-70.2-74.8000107.6Y218 Y222Y218-Y220 VanDerWaalsContact C-N 3.26Å; Y218-Y220 VanDerWaalsContact CB-CE2 3.46Å; Y218-Y220 HydrophobicContact CG-CE2 4.05Å; Y218-Y220 PolarHBondContact O-N 3.31Å; Y220-Y222 HydrophobicContact CG-CE2 4.4Å; Y220-Y222 PolarHBondContact O-N 3.29Å
221R44.4Very low68.9Low235 Ų235145.3 Ų145.389%0.88766%0.661SS**  trans-72.7100.4163.6-168.4-175.4-153.1168.65.6106.3V219V219-R221 VanDerWaalsContact C-N 3.33Å; V219-R221 PolarHBondContact O-N 3.21Å
222Y42.1Very low67.5Low274 Ų274143.8 Ų143.8100%1.07567%0.666SS**  trans-960157.7-70.1-75.6000108.2Y220Y220-Y222 HydrophobicContact CG-CE2 4.4Å; Y220-Y222 PolarHBondContact O-N 3.29Å

Retrieved 222 of 222 residues in 313.9 ms (Link to these results)