A0A077Z8Y0_TRITR Loading...

DUF155 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z8Y0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 350 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
1M47.5Very low59Low204 Ų204128.5 Ų128.5100%1.00564%0.637SS**  0112.30-159.8154.870.700106.6D5M1-D5 HydrophobicContact CG-CB 3.76Å
2S56.4Low58.2Low76 Ų76130.4 Ų130.453%0.53164%0.639SS.*  trans-74.7151-171.1179.30000110K4 D5S2-K4 PolarHBondContact O-N 3.49Å; S2-D5 PolarHBondContact N-OD2 3.44Å; S2-D5 WeakPolarHBondContact O-CA 3.49Å; S2-D5 VanDerWaalsContact O-CB 3.27Å; S2-D5 WeakPolarHBondContact O-CB 3.34Å; S2-D5 PolarHBondContact O-N 3.15Å
3M55.4Low57.5Low171 Ų171127.6 Ų127.684%0.84263%0.628SS**Hα-helixtrans-54-25.3-178.5-74.8-169.5-65.900113.8D5 L6 A7M3-D5 VanDerWaalsContact C-N 3.29Å; M3-D5 PolarHBondContact O-N 2.92Å; M3-L6 PolarHBondContact O-N 3.42Å; M3-A7 PolarHBondContact O-N 3.05Å
4K61.8Low56.4Low166 Ų166129.3 Ų129.372%0.72263%0.633SS**Hα-helixtrans-65.8-30.2173.5-67.3-174.9177.9-179.20113S2 N8S2-K4 PolarHBondContact O-N 3.49Å; K4-N8 PolarHBondContact O-N 3.35Å
5D66.3Low55.1Low83 Ų83133.8 Ų133.844%0.44464%0.641SS.*Hα-helixtrans-70.9-36177.6-57.3-35.7000111.1M1 S2 M3 N8 Y9M1-D5 HydrophobicContact CG-CB 3.76Å; S2-D5 PolarHBondContact N-OD2 3.44Å; S2-D5 WeakPolarHBondContact O-CA 3.49Å; S2-D5 VanDerWaalsContact O-CB 3.27Å; S2-D5 WeakPolarHBondContact O-CB 3.34Å; S2-D5 PolarHBondContact O-N 3.15Å; M3-D5 VanDerWaalsContact C-N 3.29Å; M3-D5 PolarHBondContact O-N 2.92Å; D5-N8 PolarHBondContact O-N 3.05Å; D5-Y9 WeakPolarHBondContact O-CB 3.34Å; D5-Y9 PolarHBondContact O-N 3.43Å
6L62.7Low53.9Low96 Ų96138.7 Ų138.750%0.50365%0.651SS.*Hα-helixtrans-69.1-40.1179.3-166.969.8000112M3 Y9 K10M3-L6 PolarHBondContact O-N 3.42Å; L6-Y9 PolarHBondContact O-N 3.26Å; L6-K10 PolarHBondContact O-N 3.5Å
7A63Low53Low59 Ų59137.3 Ų137.349%0.48866%0.658SS.*Hα-helixtrans-67-39.1176.400000112.3M3 K10 K11M3-A7 PolarHBondContact O-N 3.05Å; A7-K10 PolarHBondContact O-N 3.44Å; A7-K11 PolarHBondContact O-N 3.49Å
8N57.3Low51.9Low114 Ų114135 Ų13561%0.6166%0.659SS**Hα-helixtrans-69.7-34.8174.8-97.4-20.1000112.4K4 D5 K11 K12K4-N8 PolarHBondContact O-N 3.35Å; D5-N8 PolarHBondContact O-N 3.05Å; N8-K11 PolarHBondContact O-N 2.97Å; N8-K12 WeakPolarHBondContact O-CB 3.48Å; N8-K12 PolarHBondContact O-N 2.92Å
9Y67.4Low50.8Low153 Ų153135.5 Ų135.560%0.666%0.664SS**Hα-helixtrans-64.9-44174-169.8-99.1000111.8D5 L6 K12 L13D5-Y9 WeakPolarHBondContact O-CB 3.34Å; D5-Y9 PolarHBondContact O-N 3.43Å; L6-Y9 PolarHBondContact O-N 3.26Å; Y9-K12 PolarHBondContact O-N 3.31Å; Y9-K12 VanDerWaalsContact O-N 3.15Å; Y9-L13 HydrophobicContact CD1-CD1 3.99Å; Y9-L13 HydrophobicContact CE1-CD1 3.44Å; Y9-L13 VanDerWaalsContact CE1-CD1 3.44Å; Y9-L13 HydrophobicContact CE2-CD1 4.33Å; Y9-L13 PolarHBondContact O-N 3.35Å
10K57.4Low49.7Very low148 Ų148131.9 Ų131.964%0.64366%0.663SS**Hα-helixtrans-59.7-45.9174.1-77.4-171.1175.4-171.30112.1L6 A7 K12 L13 Q14L6-K10 PolarHBondContact O-N 3.5Å; A7-K10 PolarHBondContact O-N 3.44Å; K10-K12 VanDerWaalsContact C-N 3.27Å; K10-K12 PolarHBondContact O-N 2.9Å; K10-L13 PolarHBondContact O-N 3.05Å; K10-Q14 PolarHBondContact O-N 3.03Å; K10-Q14 VanDerWaalsContact O-N 3.16Å
11K54.3Low48.9Very low143 Ų143133.9 Ų133.962%0.62267%0.674SS**Hα-helixtrans-61.9-32.3174.8-94.2-178.9177173.70113.3A7 N8 R15A7-K11 PolarHBondContact O-N 3.49Å; N8-K11 PolarHBondContact O-N 2.97Å; K11-R15 PolarHBondContact O-N 3.21Å
12K49.4Very low47.9Very low152 Ų152135.3 Ų135.366%0.66167%0.67SS**Hα-helixtrans-76.1-33.2-179.9-152.1174-173.1178.80112.5N8 Y9 K10 R16N8-K12 WeakPolarHBondContact O-CB 3.48Å; N8-K12 PolarHBondContact O-N 2.92Å; Y9-K12 PolarHBondContact O-N 3.31Å; Y9-K12 VanDerWaalsContact O-N 3.15Å; K10-K12 VanDerWaalsContact C-N 3.27Å; K10-K12 PolarHBondContact O-N 2.9Å; K12-R16 PolarHBondContact O-N 3.35Å
13L48.3Very low46.5Very low94 Ų94135.1 Ų135.149%0.49268%0.68SS.*Hα-helixtrans-65.9-43.8170.9-110.187.8000111.3Y9 K10 R15 R16 C17Y9-L13 HydrophobicContact CD1-CD1 3.99Å; Y9-L13 HydrophobicContact CE1-CD1 3.44Å; Y9-L13 VanDerWaalsContact CE1-CD1 3.44Å; Y9-L13 HydrophobicContact CE2-CD1 4.33Å; Y9-L13 PolarHBondContact O-N 3.35Å; K10-L13 PolarHBondContact O-N 3.05Å; L13-R15 VanDerWaalsContact C-N 3.31Å; L13-R15 PolarHBondContact O-N 3.48Å; L13-R16 PolarHBondContact O-N 2.99Å; L13-R16 VanDerWaalsContact O-N 3.08Å; L13-C17 PolarHBondContact O-N 3.05Å
14Q43.1Very low45.5Very low151 Ų151132.4 Ų132.471%0.70668%0.678SS**Hα-helixtrans-66.4-31.6-176.7-148.3161.7-5.600112.8K10K10-Q14 PolarHBondContact O-N 3.03Å; K10-Q14 VanDerWaalsContact O-N 3.16Å
15R36.6Very low44Very low197 Ų197129.5 Ų129.574%0.74368%0.677SS**Hα-helixtrans-77.2-19.2173.1-74.5-174.9177.8-170.9-0.8114.6K11 L13 S18K11-R15 PolarHBondContact O-N 3.21Å; L13-R15 VanDerWaalsContact C-N 3.31Å; L13-R15 PolarHBondContact O-N 3.48Å; R15-S18 PolarHBondContact O-OG 3.18Å
16R35.7Very low42.5Very low212 Ų212134.8 Ų134.880%0.869%0.691SS**Hα-helixtrans-84.3-26.5176.7-97.4-176.3167.4-175.7-4.7112.7K12 L13 S18K12-R16 PolarHBondContact O-N 3.35Å; L13-R16 PolarHBondContact O-N 2.99Å; L13-R16 VanDerWaalsContact O-N 3.08Å; R16-S18 VanDerWaalsContact C-N 3.34Å
17C38.3Very low41.1Very low115 Ų115136.6 Ų136.678%0.77770%0.701SS**THydrogen-bonded Turntrans-81.5-6.6178.6-72.90000114.5L13 L19L13-C17 PolarHBondContact O-N 3.05Å; C17-L19 VanDerWaalsContact C-N 3.29Å; C17-L19 PolarHBondContact O-N 2.92Å
18S33.4Very low39.9Very low96 Ų96136.7 Ų136.767%0.67170%0.696SS**THydrogen-bonded Turntrans-8612.7178.161.10000114.8R15 R16R15-S18 PolarHBondContact O-OG 3.18Å; R16-S18 VanDerWaalsContact C-N 3.34Å
19L31Very low39.2Very low144 Ų144133 Ų13375%0.75468%0.677SS**SBendtrans-121.597.3-179.3-86.2146.4000110.9C17C17-L19 VanDerWaalsContact C-N 3.29Å; C17-L19 PolarHBondContact O-N 2.92Å
20G28.7Very low38Very low63 Ų63128.1 Ų128.165%0.64967%0.666SS**  trans65.8116.1163.100000114.8
21I32Very low37Very low174 Ų174129.6 Ų129.689%0.89267%0.667SS**  -149.4110.672.5-75.1146.6000107.4
22Y26.6Very low36.3Very low234 Ų234127.6 Ų127.692%0.91866%0.66SS**  trans-80.1133.6171.4-97.8-100000109.8
23G27.8Very low35.9Very low72 Ų72123.8 Ų123.874%0.74264%0.644SS**SBendtrans82.1101.5151.700000117.1
24S34.9Very low35.6Very low114 Ų114122.6 Ų122.680%0.79764%0.643SS**SBend162.8-18.1124.9-161.60000113.3R26S24-R26 PolarHBondContact O-N 3.24Å
25C30.7Very low35.2Very low105 Ų105120.6 Ų120.671%0.70963%0.634SS**SBendtrans-886.8-173.7-73.30000117.4
26R34Very low35.6Very low195 Ų195116 Ų11674%0.73662%0.617SS**SBendtrans-76.4-30.8-171.3-90.9-175173.7-171.8-5115.3S24S24-R26 PolarHBondContact O-N 3.24Å
27N33.6Very low35.6Very low134 Ų134114.7 Ų114.772%0.71762%0.617SS**SBendtrans-92.7-2.1-178-77.60.1000114.4
28T37.1Very low35.3Very low60 Ų60113.6 Ų113.637%0.36861%0.611SS.*Hα-helixtrans-81.4-28-176.2-34.60000112.1Q32T28-Q32 HydrophobicContact CG2-CG 4.33Å; T28-Q32 WeakPolarHBondContact O-CB 3.34Å; T28-Q32 WeakPolarHBondContact O-CG 3.44Å; T28-Q32 PolarHBondContact O-N 3.48Å
29V42.8Very low35.4Very low37 Ų37113 Ų11322%0.22461%0.607CS.*Hα-helixtrans-80.5-44.7-169.1-176.70000113.2R31 Q32 F33V29-R31 PolarHBondContact O-N 2.95Å; V29-Q32 PolarHBondContact O-N 3.02Å; V29-F33 HydrophobicContact CG1-CD2 4.03Å; V29-F33 HydrophobicContact CG1-CE2 3.83Å; V29-F33 WeakPolarHBondContact O-CD2 3.22Å; V29-F33 PolarHBondContact O-N 3.35Å; V29-F33 VanDerWaalsContact O-N 3.08Å
30S42.5Very low35.4Very low51 Ų51111.3 Ų111.336%0.35761%0.607SS.*Hα-helixtrans-62.4-32.7172.6-52.30000111.3S34S30-S34 PolarHBondContact O-N 3.39Å
31R35.7Very low35.6Very low179 Ų179116.5 Ų116.568%0.67562%0.619SS**Hα-helixtrans-67.6-38.5169.6-96.8-174.6165.2165.3-4.2112.9V29 S34 E35V29-R31 PolarHBondContact O-N 2.95Å; R31-S34 PolarHBondContact O-N 3.46Å; R31-E35 WeakPolarHBondContact O-CB 3.44Å; R31-E35 WeakPolarHBondContact O-CG 3.08Å; R31-E35 PolarHBondContact O-N 3.3Å
32Q41.1Very low35.6Very low101 Ų101113.2 Ų113.247%0.47261%0.609SS.*Hα-helixtrans-68-35.6-179.4-83.1171.2-2.700113.4T28 V29 S34 Y36T28-Q32 HydrophobicContact CG2-CG 4.33Å; T28-Q32 WeakPolarHBondContact O-CB 3.34Å; T28-Q32 WeakPolarHBondContact O-CG 3.44Å; T28-Q32 PolarHBondContact O-N 3.48Å; V29-Q32 PolarHBondContact O-N 3.02Å; Q32-S34 VanDerWaalsContact C-N 3.35Å; Q32-Y36 WeakPolarHBondContact O-CB 3.44Å; Q32-Y36 PolarHBondContact O-N 3.24Å; Q32-Y36 VanDerWaalsContact O-N 3.07Å
33F40.8Very low35.6Very low72 Ų72111.6 Ų111.632%0.31661%0.609SS.*Hα-helixtrans-64.8-39.7172-80.6-79.3000111.5V29 F224 A253V29-F33 HydrophobicContact CG1-CD2 4.03Å; V29-F33 HydrophobicContact CG1-CE2 3.83Å; V29-F33 WeakPolarHBondContact O-CD2 3.22Å; V29-F33 PolarHBondContact O-N 3.35Å; V29-F33 VanDerWaalsContact O-N 3.08Å; F33-F224 HydrophobicContact CE1-CD2 4.5Å; F33-A253 HydrophobicContact CE2-CB 4.45Å; F33-A253 HydrophobicContact CZ-CB 3.89Å
34S42.2Very low35.7Very low68 Ų68114.2 Ų114.248%0.47661%0.611SS.*Hα-helixtrans-71.2-41.7175.8-161.20000113.3S30 R31 Q32 Y36 K37S30-S34 PolarHBondContact O-N 3.39Å; R31-S34 PolarHBondContact O-N 3.46Å; Q32-S34 VanDerWaalsContact C-N 3.35Å; S34-Y36 VanDerWaalsContact C-N 3.26Å; S34-Y36 PolarHBondContact O-N 3.1Å; S34-K37 WeakPolarHBondContact O-CB 3.29Å; S34-K37 PolarHBondContact O-N 3.01Å; S34-K37 VanDerWaalsContact O-N 3.15Å
35E34.8Very low35.3Very low109 Ų109114 Ų11451%0.50961%0.605SS.*Hα-helixtrans-64.9-28.6177.4-81.2174.5-174.800112.3R31 K37 S38R31-E35 WeakPolarHBondContact O-CB 3.44Å; R31-E35 WeakPolarHBondContact O-CG 3.08Å; R31-E35 PolarHBondContact O-N 3.3Å; E35-K37 PolarHBondContact O-N 2.93Å; E35-K37 VanDerWaalsContact O-N 3.13Å; E35-S38 WeakPolarHBondContact O-CB 3.38Å; E35-S38 PolarHBondContact O-N 2.96Å; E35-S38 PolarHBondContact O-OG 3.4Å
36Y43.8Very low35.5Very low101 Ų101114.3 Ų114.340%0.39662%0.615SS.*THydrogen-bonded Turntrans-60.4-22.8175.5-169.5-94.4000112.6Q32 S34 S38 A227 R250Q32-Y36 WeakPolarHBondContact O-CB 3.44Å; Q32-Y36 PolarHBondContact O-N 3.24Å; Q32-Y36 VanDerWaalsContact O-N 3.07Å; S34-Y36 VanDerWaalsContact C-N 3.26Å; S34-Y36 PolarHBondContact O-N 3.1Å; Y36-S38 VanDerWaalsContact C-N 3.33Å; Y36-A227 HydrophobicContact CE1-CB 3.97Å; Y36-R250 PolarHBondContact OH-NH2 2.86Å
37K36.6Very low35.3Very low184 Ų184110.2 Ų110.280%0.861%0.611SS**THydrogen-bonded Turntrans-79-13.2173.5-148.8169.3-170.2167.40113.7S34 E35S34-K37 WeakPolarHBondContact O-CB 3.29Å; S34-K37 PolarHBondContact O-N 3.01Å; S34-K37 VanDerWaalsContact O-N 3.15Å; E35-K37 PolarHBondContact O-N 2.93Å; E35-K37 VanDerWaalsContact O-N 3.13Å
38S31.2Very low35.3Very low92 Ų92112.1 Ų112.164%0.64362%0.616SS**THydrogen-bonded Turntrans-96.5-10.1-172.371.20000115.1E35 Y36 S40E35-S38 WeakPolarHBondContact O-CB 3.38Å; E35-S38 PolarHBondContact O-N 2.96Å; E35-S38 PolarHBondContact O-OG 3.4Å; Y36-S38 VanDerWaalsContact C-N 3.33Å; S38-S40 PolarHBondContact O-N 3.43Å
39S36.6Very low35.1Very low84 Ų84115 Ų11559%0.58764%0.638SS**SBendtrans-80.784.617555.60000112.2
40S30.5Very low34.7Very low108 Ų108119.3 Ų119.376%0.75566%0.664SS**  trans33.798.1150.264.30000119.5S38S38-S40 PolarHBondContact O-N 3.43Å
41L33.2Very low34.2Very low172 Ų172125.8 Ų125.890%0.90169%0.686SS**  trans-143.2149.6140.9-89.1170.3000108.3
42P31.2Very low33.9Very low105 Ų105123.2 Ų123.268%0.68269%0.686SS**  trans-73.9153-162.330.6-34.4000112.9V44P42-V44 VanDerWaalsContact C-N 3.32Å; P42-V44 PolarHBondContact O-N 3.38Å
43E25.9Very low33.6Very low200 Ų200122.1 Ų122.194%0.93569%0.694SS**  trans-54.780.5-177.8-160.8169-159.700112.4T45E43-T45 PolarHBondContact O-N 2.96Å
44V30.5Very low33.4Very low128 Ų128127.2 Ų127.278%0.77671%0.711SS**  trans-80.9110.1164.2179.90000106.7P42 A46P42-V44 VanDerWaalsContact C-N 3.32Å; P42-V44 PolarHBondContact O-N 3.38Å; V44-A46 PolarHBondContact O-N 3.42Å
45T27.7Very low33.5Very low110 Ų110131.7 Ų131.768%0.67573%0.729SS**  trans-17.7119.8171.644.10000114.2E43 V47E43-T45 PolarHBondContact O-N 2.96Å; T45-V47 VanDerWaalsContact C-N 3.29Å; T45-V47 PolarHBondContact O-N 3Å
46A33.8Very low33.9Very low110 Ų110129.2 Ų129.291%0.90972%0.724SS**SBendtrans-5683.1176.200000112.4V44V44-A46 PolarHBondContact O-N 3.42Å
47V30.5Very low34Very low109 Ų109133.1 Ų133.166%0.66174%0.738SS**  trans-140.1120.2168.4-174.10000106.1T45T45-V47 VanDerWaalsContact C-N 3.29Å; T45-V47 PolarHBondContact O-N 3Å
48E32.2Very low34.8Very low175 Ų175126.4 Ų126.482%0.81871%0.708SS**SBendtrans93.610.5160.7-76.2171.4173.900123.9
49S32.7Very low35.2Very low120 Ų120125.7 Ų125.784%0.83970%0.7SS**  trans-106.632.5166.267.30000115.1K51S49-K51 PolarHBondContact O-N 3.02Å
50V34.8Very low35.6Very low127 Ų127125 Ų12577%0.7770%0.696SS**  trans-91.768150.7-172.10000106.7N52V50-N52 PolarHBondContact O-N 2.88Å
51K31.6Very low36.2Very low187 Ų187127.2 Ų127.281%0.81369%0.689SS**  trans-69.881.4161-81.9-177-178.8170.80106.4S49S49-K51 PolarHBondContact O-N 3.02Å
52N30.9Very low36.4Very low126 Ų126127.3 Ų127.367%0.67468%0.682SS**  trans32.499.6162.5-58.1-25.9000113.3V50 R54V50-N52 PolarHBondContact O-N 2.88Å; N52-R54 VanDerWaalsContact C-N 3.34Å; N52-R54 VanDerWaalsContact O-CG 3.3Å; N52-R54 WeakPolarHBondContact O-CG 3.44Å; N52-R54 PolarHBondContact O-N 3.33Å
53A34Very low36.8Very low78 Ų78126.4 Ų126.465%0.64567%0.671SS**  trans-41107156.300000107L55A53-L55 PolarHBondContact O-N 3.26Å
54R37.5Very low37.9Very low179 Ų179122.6 Ų122.668%0.67566%0.664SS**  trans-75.181.4-167.7-67-176.5-172.7176.52.9107.2N52 S56N52-R54 VanDerWaalsContact C-N 3.34Å; N52-R54 VanDerWaalsContact O-CG 3.3Å; N52-R54 WeakPolarHBondContact O-CG 3.44Å; N52-R54 PolarHBondContact O-N 3.33Å; R54-S56 PolarHBondContact O-N 3.11Å
55L44.5Very low38.5Very low161 Ų161125 Ų12584%0.84367%0.666SS**  trans-49.9134.7169.9-70.6164.6000108.3A53A53-L55 PolarHBondContact O-N 3.26Å
56S43.3Very low39.3Very low58 Ų58121.4 Ų121.441%0.40664%0.644SS.*  trans-20.1124-174.7-163.70000114.8R54 R58 D167R54-S56 PolarHBondContact O-N 3.11Å; S56-R58 PolarHBondContact O-N 3.19Å; S56-D167 PolarHBondContact OG-OD1 2.92Å
57R44.9Very low40.1Very low183 Ų183120.1 Ų120.169%0.69163%0.628SS**  trans-66.522.3179.4-77.9177.4144.7160.5-7.1114.7P59R57-P59 WeakPolarHBondContact O-CD 3.44Å
58R53Low40.9Very low43 Ų43126 Ų12616%0.16264%0.639CS.*  trans-82122.3-179-64.8-168.5-153.8157.919.9110.6S56 S60 D167 N168 F291S56-R58 PolarHBondContact O-N 3.19Å; R58-S60 PolarHBondContact O-N 3.11Å; R58-D167 IonicContact CZ-OD1 2.75Å; R58-D167 IonicContact NH2-OD1 3.15Å; R58-D167 PolarHBondContact NH2-OD1 3.09Å; R58-D167 IonicContact NH2-OD2 2.77Å; R58-N168 PolarHBondContact NH1-O 3.44Å; R58-F291 VanDerWaalsContact NH1-CE1 3.3Å
59P40.6Very low41.9Very low76 Ų76122.5 Ų122.549%0.49463%0.625SS.*  trans-67.1110.7160.33.110.9000107.7R57 Y61R57-P59 WeakPolarHBondContact O-CD 3.44Å; P59-Y61 HydrophobicContact CB-CE2 4.25Å; P59-Y61 HydrophobicContact CG-CE2 4.38Å; P59-Y61 VanDerWaalsContact O-CD2 3.27Å; P59-Y61 WeakPolarHBondContact O-CD2 3.44Å; P59-Y61 WeakPolarHBondContact O-CE2 3.3Å; P59-Y61 PolarHBondContact O-N 2.95Å
60S44.3Very low43Very low71 Ų71128 Ų12850%0.49763%0.627SS.*  trans-67.9116.1175.2-50.30000109.9R58 F62 E184R58-S60 PolarHBondContact O-N 3.11Å; S60-F62 VanDerWaalsContact CB-CE2 3.49Å; S60-F62 PolarHBondContact O-N 3.18Å; S60-E184 VanDerWaalsContact CA-OE2 3.25Å; S60-E184 WeakPolarHBondContact CA-OE2 3.45Å
61Y43.5Very low44.7Very low154 Ų154124.1 Ų124.160%0.60460%0.6SS**  trans-92.987.5172.9-64.2-82.8000108.1P59 L63 E184P59-Y61 HydrophobicContact CB-CE2 4.25Å; P59-Y61 HydrophobicContact CG-CE2 4.38Å; P59-Y61 VanDerWaalsContact O-CD2 3.27Å; P59-Y61 WeakPolarHBondContact O-CD2 3.44Å; P59-Y61 WeakPolarHBondContact O-CE2 3.3Å; P59-Y61 PolarHBondContact O-N 2.95Å; Y61-L63 PolarHBondContact O-N 3.12Å; Y61-E184 PolarHBondContact N-OE2 3.36Å
62F37.2Very low47.1Very low174 Ų174116.8 Ų116.876%0.76357%0.571SS**  trans-70.7119.8175-71.4-80.1000110.6S60S60-F62 VanDerWaalsContact CB-CE2 3.49Å; S60-F62 PolarHBondContact O-N 3.18Å
63L40.1Very low49.8Very low86 Ų86113.9 Ų113.945%0.4556%0.556SS.*  trans-74.3131.2161-71.8173.7000109Y61 E65 V66Y61-L63 PolarHBondContact O-N 3.12Å; L63-E65 VanDerWaalsContact C-N 3.25Å; L63-E65 PolarHBondContact O-N 3.36Å; L63-V66 HydrophobicContact CB-CG2 4.06Å; L63-V66 HydrophobicContact CD1-CG2 4.01Å
64P47.8Very low52.6Low119 Ų119110.1 Ų110.177%0.77353%0.525SS*.SBendtrans-57-35.7-177.8-25.632.9000114.1S67P64-S67 PolarHBondContact O-OG 2.95Å; P64-S67 VanDerWaalsContact O-OG 3.1Å
65E44.3Very low55.3Low179 Ų179104.9 Ų104.984%0.83651%0.505SS*.SBendtrans-97.1-21.1-162.7-137.6143.9-151.900114.3L63 S67L63-E65 VanDerWaalsContact C-N 3.25Å; L63-E65 PolarHBondContact O-N 3.36Å; E65-S67 VanDerWaalsContact C-N 3.34Å; E65-S67 PolarHBondContact O-N 3.42Å
66V43.9Very low57.8Low35 Ų3597.2 Ų97.221%0.21247%0.465CS..G310 helixtrans-92.58.5-178-155.10000112.4L63 R68 K71 I172 L185L63-V66 HydrophobicContact CB-CG2 4.06Å; L63-V66 HydrophobicContact CD1-CG2 4.01Å; V66-R68 PolarHBondContact O-N 3.01Å; V66-K71 WeakPolarHBondContact O-CE 3.28Å; V66-K71 PolarHBondContact O-NZ 3.33Å; V66-I172 HydrophobicContact CG1-CD1 3.87Å; V66-L185 HydrophobicContact CG1-CD2 4.1Å
67S50.8Low60.2Low82 Ų8296.1 Ų96.157%0.57345%0.452SS*.G310 helixtrans-74.3-20.5-174.952.70000114.3P64 E65P64-S67 PolarHBondContact O-OG 2.95Å; P64-S67 VanDerWaalsContact O-OG 3.1Å; E65-S67 VanDerWaalsContact C-N 3.34Å; E65-S67 PolarHBondContact O-N 3.42Å
68R47.6Very low62.5Low233 Ų23387.5 Ų87.588%0.87942%0.42SS*.G310 helixtrans-91.2-10.7-170.3-56.8-171.7-145.4-160.66.4115.9V66V66-R68 PolarHBondContact O-N 3.01Å
69I53Low64.3Low102 Ų10286.6 Ų86.652%0.52342%0.419SS..SBendtrans-86.2129.1-179.2-59.1169.1000107.6K71 I172I69-K71 VanDerWaalsContact C-N 3.32Å; I69-K71 WeakPolarHBondContact O-CG 3.31Å; I69-K71 PolarHBondContact O-N 2.91Å; I69-I172 HydrophobicContact CD1-CD1 4.5Å
70R56.2Low66.8Low234 Ų23483 Ų8388%0.88340%0.396SS*.  trans-62.498.1166.9-175.5-179.3-178.5-177-1.2106.6
71K68.8Low69Low47 Ų4781.4 Ų81.420%0.20438%0.381CS..  trans-81.3130.3-178.5-59.9-179.4-169.6177.70108.4V66 I69 I172 L185V66-K71 WeakPolarHBondContact O-CE 3.28Å; V66-K71 PolarHBondContact O-NZ 3.33Å; I69-K71 VanDerWaalsContact C-N 3.32Å; I69-K71 WeakPolarHBondContact O-CG 3.31Å; I69-K71 PolarHBondContact O-N 2.91Å; K71-I172 HydrophobicContact CD-CD1 4.11Å; K71-I172 HydrophobicContact CD-CG1 4.32Å; K71-I172 HydrophobicContact CG-CD1 4.04Å; K71-I172 HydrophobicContact CG-CG1 4.05Å; K71-L185 HydrophobicContact CD-CD1 3.88Å
72P82.1Confident71.3Confident32 Ų3275.9 Ų75.921%0.20836%0.364CS..  trans-59.5143.5166.530-37000109D136 Y171P72-D136 HydrophobicContact CB-CB 4.12Å; P72-D136 VanDerWaalsContact CB-OD1 3.26Å; P72-D136 WeakPolarHBondContact CB-OD1 3.44Å; P72-Y171 HydrophobicContact CB-CD1 4.1Å; P72-Y171 HydrophobicContact CB-CE1 3.44Å; P72-Y171 VanDerWaalsContact CB-CE1 3.44Å; P72-Y171 HydrophobicContact CB-CE2 4.24Å; P72-Y171 VanDerWaalsContact CD-O 3.22Å; P72-Y171 WeakPolarHBondContact CD-O 3.25Å; P72-Y171 HydrophobicContact CG-CD1 3.91Å; P72-Y171 HydrophobicContact CG-CD2 3.99Å; P72-Y171 HydrophobicContact CG-CE1 3.6Å; P72-Y171 HydrophobicContact CG-CE2 3.63Å; P72-Y171 HydrophobicContact CG-CG 4.12Å; P72-Y171 VanDerWaalsContact CG-CZ 3.43Å; P72-Y171 VanDerWaalsContact CG-O 3.32Å; P72-Y171 WeakPolarHBondContact CG-O 3.5Å; P72-Y171 WeakPolarHBondContact O-CD1 3.48Å; P72-Y171 PolarHBondContact O-N 2.88Å; P72-Y171 VanDerWaalsContact O-N 3.12Å
73N88.3Confident74Confident65 Ų6568 Ų6835%0.34833%0.33SS..EExtended strand (participates in β ladder)trans-116.2147.4-171.4-70.8-45.9000110.9D136N73-D136 PolarHBondContact O-N 3.38Å
74I93.3Very high76.5Confident0 Ų066.3 Ų66.30%032%0.321CS..EExtended strand (participates in β ladder)trans-108.8131.7173.1-50.2158.6000106.8V133 F134 W135 N168 L169 Y171 L186 M208I74-V133 HydrophobicContact CG2-CG1 3.47Å; I74-V133 VanDerWaalsContact CG2-CG1 3.47Å; I74-F134 CarbonylContact C-O 3.49Å; I74-F134 WeakPolarHBondContact CA-O 3.48Å; I74-W135 HydrophobicContact CD1-CD2 4.26Å; I74-W135 HydrophobicContact CD1-CE3 3.84Å; I74-W135 HydrophobicContact CD1-CH2 3.36Å; I74-W135 HydrophobicContact CD1-CZ2 3.8Å; I74-W135 HydrophobicContact CD1-CZ3 3.38Å; I74-W135 HydrophobicContact CG1-CD2 3.88Å; I74-W135 HydrophobicContact CG1-CE3 3.67Å; I74-W135 HydrophobicContact CG1-CH2 4.08Å; I74-W135 HydrophobicContact CG1-CZ2 4.25Å; I74-W135 HydrophobicContact CG1-CZ3 3.78Å; I74-W135 HydrophobicContact CG2-CD2 4.26Å; I74-W135 HydrophobicContact CG2-CG 4.48Å; I74-W135 HydrophobicContact CG2-CZ2 4.3Å; I74-N168 CarbonylContact O-C 3.5Å; I74-N168 VanDerWaalsContact O-CA 3.24Å; I74-N168 WeakPolarHBondContact O-CA 3.38Å; I74-L169 HydrophobicContact CB-CB 4.25Å; I74-L169 HydrophobicContact CD1-CB 4.21Å; I74-L169 HydrophobicContact CD1-CD2 3.83Å; I74-L169 HydrophobicContact CD1-CG 4.11Å; I74-L169 PolarHBondContact N-O 3.33Å; I74-L169 PolarHBondContact O-N 2.79Å; I74-Y171 HydrophobicContact CD1-CD1 3.93Å; I74-Y171 HydrophobicContact CD1-CG 4.39Å; I74-Y171 HydrophobicContact CG1-CD1 3.65Å; I74-Y171 HydrophobicContact CG1-CE1 4.13Å; I74-L186 HydrophobicContact CD1-CD2 4.06Å; I74-M208 HydrophobicContact CB-CE 4.36Å; I74-M208 HydrophobicContact CB-SD 4.21Å; I74-M208 HydrophobicContact CG2-CE 3.95Å; I74-M208 HydrophobicContact CG2-SD 3.52Å; I74-M208 VanDerWaalsContact CG2-SD 3.52Å
75W94.3Very high78.5Confident68 Ų6861.9 Ų61.926%0.25829%0.29SS..EExtended strand (participates in β ladder)trans-127.8126.3-178.9-70.479.7000110Y77 V133 F134 R142 V166 N168W75-Y77 HydrophobicContact CB-CD2 4.41Å; W75-Y77 HydrophobicContact CB-CE2 3.67Å; W75-V133 CarbonylContact O-C 3.56Å; W75-V133 WeakPolarHBondContact O-CA 3.41Å; W75-F134 HydrophobicContact CB-CB 4.47Å; W75-F134 PolarHBondContact N-O 2.87Å; W75-F134 PolarHBondContact O-N 3.01Å; W75-R142 VanDerWaalsContact CD2-NH1 3.32Å; W75-R142 VanDerWaalsContact CE2-NH1 3.27Å; W75-V166 HydrophobicContact CE3-CG1 3.73Å; W75-V166 HydrophobicContact CZ3-CG1 3.93Å; W75-N168 HydrophobicContact CD2-CB 4.18Å; W75-N168 HydrophobicContact CE3-CB 4.12Å; W75-N168 HydrophobicContact CH2-CB 4.45Å; W75-N168 HydrophobicContact CZ2-CB 4.5Å; W75-N168 HydrophobicContact CZ3-CB 4.25Å
76A95.5Very high80.6Confident0 Ų062.4 Ų62.40%029%0.29CS..EExtended strand (participates in β ladder)trans-109.5135.9175.100000110.1V132 V133 D167 M208 V212A76-V132 WeakPolarHBondContact CA-O 3.45Å; A76-V133 HydrophobicContact CB-CG2 3.94Å; A76-D167 PolarHBondContact N-O 2.7Å; A76-D167 PolarHBondContact O-N 3.41Å; A76-M208 HydrophobicContact CB-CB 3.89Å; A76-M208 HydrophobicContact CB-CE 3.81Å; A76-V212 HydrophobicContact CB-CG1 3.59Å; A76-V212 HydrophobicContact CB-CG2 4.37Å
77Y94.3Very high82.8Confident36 Ų3668 Ų6814%0.14131%0.308CS..EExtended strand (participates in β ladder)trans-130.1155.4176-63.5-94.3000109.2W75 A131 V132 F134 L146 V166W75-Y77 HydrophobicContact CB-CD2 4.41Å; W75-Y77 HydrophobicContact CB-CE2 3.67Å; Y77-A131 CarbonylContact O-C 3.46Å; Y77-A131 VanDerWaalsContact O-CA 3.29Å; Y77-A131 WeakPolarHBondContact O-CA 3.45Å; Y77-V132 PolarHBondContact N-O 2.91Å; Y77-V132 PolarHBondContact O-N 2.96Å; Y77-F134 AromaticContact CD2-CD2 3.57Å; Y77-F134 HydrophobicContact CD2-CD2 3.57Å; Y77-F134 AromaticContact CD2-CE2 3.46Å; Y77-F134 HydrophobicContact CD2-CE2 3.46Å; Y77-F134 VanDerWaalsContact CD2-CE2 3.46Å; Y77-F134 AromaticContact CE2-CD2 3.82Å; Y77-F134 HydrophobicContact CE2-CD2 3.82Å; Y77-F134 AromaticContact CE2-CE2 3.97Å; Y77-F134 HydrophobicContact CE2-CE2 3.97Å; Y77-F134 HydrophobicContact CG-CE2 4.36Å; Y77-L146 HydrophobicContact CD1-CD1 4.29Å; Y77-L146 HydrophobicContact CG-CD1 4.24Å; Y77-V166 HydrophobicContact CD1-CB 4.45Å; Y77-V166 HydrophobicContact CD1-CG1 4.13Å; Y77-V166 HydrophobicContact CD1-CG2 3.57Å; Y77-V166 HydrophobicContact CE1-CB 4.33Å; Y77-V166 HydrophobicContact CE1-CG1 3.72Å; Y77-V166 HydrophobicContact CE1-CG2 3.57Å
78T92.7Very high84.7Confident2 Ų264.1 Ų64.11%0.01228%0.28CS..EExtended strand (participates in β ladder)trans-134.8131.9168.3-177.30000109.4G130 Y157 A165 V212 V216T78-G130 WeakPolarHBondContact CA-O 3.41Å; T78-G130 PolarHBondContact OG1-O 3.23Å; T78-G130 VanDerWaalsContact OG1-O 3.08Å; T78-Y157 HydrophobicContact CG2-CE2 4.47Å; T78-A165 HydrophobicContact CG2-CB 3.84Å; T78-V212 HydrophobicContact CG2-CB 4.01Å; T78-V212 HydrophobicContact CG2-CG2 4.13Å; T78-V216 HydrophobicContact CG2-CG2 3.3Å
79T92.1Very high86.5Confident23 Ų2355.6 Ų55.614%0.14126%0.259CS..  trans-117.2-27.9-174.662.60000112.6F83 G130 L146 E153 Y157T79-F83 WeakPolarHBondContact OG1-CZ 3.37Å; T79-G130 PolarHBondContact N-O 3.42Å; T79-G130 VanDerWaalsContact N-O 3.09Å; T79-L146 HydrophobicContact CG2-CD2 3.88Å; T79-E153 WeakPolarHBondContact CB-OE1 3.37Å; T79-E153 PolarHBondContact OG1-OE1 3.36Å; T79-Y157 WeakPolarHBondContact O-CD2 3.33Å; T79-Y157 PolarHBondContact O-N 3.09Å
80A93.5Very high88.1Confident0 Ų053.1 Ų53.10%026%0.259CS..EExtended strand (participates in β ladder)trans-145.2175-17600000112.9G130 E153 Y157A80-G130 WeakPolarHBondContact O-CA 3.41Å; A80-E153 HydrophobicContact CB-CB 3.72Å; A80-E153 HydrophobicContact CB-CG 3.75Å; A80-Y157 VanDerWaalsContact C-CZ 3.41Å; A80-Y157 WeakPolarHBondContact O-CE2 3.32Å; A80-Y157 VanDerWaalsContact O-CZ 3.3Å; A80-Y157 PolarHBondContact O-OH 2.98Å
81E90.7Very high89.4Confident39 Ų3944 Ų4418%0.18223%0.23CC..EExtended strand (participates in β ladder)trans-72.9-36173.2-65.7-166.3158.300112.6E129 E154 S155 Y157 R260E81-E129 CarbonylContact O-C 3.04Å; E81-E154 PolarHBondContact N-O 3.08Å; E81-S155 PolarHBondContact N-O 3.38Å; E81-S155 VanDerWaalsContact N-O 3.17Å; E81-Y157 VanDerWaalsContact CA-OH 3.25Å; E81-Y157 WeakPolarHBondContact CA-OH 3.41Å; E81-Y157 HydrophobicContact CG-CE1 3.51Å; E81-Y157 WeakPolarHBondContact CG-OH 3.26Å; E81-Y157 PolarHBondContact N-OH 2.58Å; E81-R260 WeakPolarHBondContact OE1-CD 3.27Å; E81-R260 IonicContact OE1-CZ 3.16Å; E81-R260 IonicContact OE1-NE 3.15Å; E81-R260 PolarHBondContact OE1-NE 2.97Å; E81-R260 IonicContact OE1-NH1 2.96Å; E81-R260 PolarHBondContact OE1-NH1 3.38Å; E81-R260 IonicContact OE1-NH2 2.77Å; E81-R260 PolarHBondContact OE1-NH2 3.41Å; E81-R260 IonicContact OE2-CZ 3.53Å; E81-R260 IonicContact OE2-NE 2.97Å; E81-R260 PolarHBondContact OE2-NE 3.22Å; E81-R260 VanDerWaalsContact OE2-NE 3.15Å; E81-R260 IonicContact OE2-NH2 2.68Å; E81-R260 PolarHBondContact OE2-NH2 3.47Å
82S91.7Very high90Very high38 Ų3842.8 Ų42.827%0.26623%0.226SC..EExtended strand (participates in β ladder)trans-152.3158.2174.250.30000111.6A128 E154S82-A128 CarbonylContact C-O 3.42Å; S82-A128 WeakPolarHBondContact CA-O 3.35Å; S82-A128 VanDerWaalsContact CB-O 3.23Å; S82-A128 WeakPolarHBondContact CB-O 3.3Å; S82-E154 PolarHBondContact N-O 3.44Å; S82-E154 PolarHBondContact O-N 3.03Å; S82-E154 WeakPolarHBondContact OG-CB 3.43Å; S82-E154 PolarHBondContact OG-OE2 3.06Å
83F93.3Very high89.6Confident7 Ų745.4 Ų45.43%0.03125%0.25CS..EExtended strand (participates in β ladder)trans-102.6140.9165.7-70.7-56.7000110.3T79 M85 V126 F127 A128 G130 V132 L149 E153T79-F83 WeakPolarHBondContact OG1-CZ 3.37Å; F83-M85 VanDerWaalsContact C-N 3.3Å; F83-M85 HydrophobicContact CB-CE 4.36Å; F83-M85 PolarHBondContact O-N 3.49Å; F83-V126 HydrophobicContact CD2-CG1 3.66Å; F83-V126 HydrophobicContact CE2-CG1 3.92Å; F83-V126 HydrophobicContact CG-CG1 4.48Å; F83-F127 WeakPolarHBondContact CD2-O 3.37Å; F83-A128 PolarHBondContact N-O 3.37Å; F83-G130 VanDerWaalsContact CE2-C 3.44Å; F83-V132 HydrophobicContact CE2-CG2 3.73Å; F83-V132 HydrophobicContact CZ-CG2 3.97Å; F83-L149 HydrophobicContact CE1-CB 4.17Å; F83-L149 HydrophobicContact CZ-CB 4.41Å; F83-L149 HydrophobicContact CZ-CD1 4.37Å; F83-E153 HydrophobicContact CD1-CG 4.01Å; F83-E153 HydrophobicContact CE1-CG 3.5Å
84N93Very high88.9Confident52 Ų5247.9 Ų47.928%0.27826%0.264SS..  trans-74.386.3170.3-164.9-56.3000110.5K86 R87 L88 F152 E154N84-K86 VanDerWaalsContact C-N 3.25Å; N84-K86 PolarHBondContact O-N 3.44Å; N84-R87 HydrophobicContact CB-CB 4.19Å; N84-R87 PolarHBondContact O-N 3.35Å; N84-R87 WeakPolarHBondContact OD1-CB 3.47Å; N84-R87 PolarHBondContact OD1-N 2.92Å; N84-L88 WeakPolarHBondContact O-CB 3.47Å; N84-L88 PolarHBondContact O-N 3.38Å; N84-F152 PolarHBondContact N-O 2.8Å; N84-E154 HydrophobicContact CB-CG 4.32Å; N84-E154 WeakPolarHBondContact CB-OE1 3.47Å; N84-E154 PolarHBondContact ND2-OE1 2.97Å
85M89Confident87.8Confident25 Ų2555.5 Ų55.512%0.12330%0.304CS..Hα-helixtrans-62.3-31.7-172.8-154.657.367.900113.3F83 L88 A89 L111 V126 A128F83-M85 VanDerWaalsContact C-N 3.3Å; F83-M85 HydrophobicContact CB-CE 4.36Å; F83-M85 PolarHBondContact O-N 3.49Å; M85-L88 PolarHBondContact O-N 3.46Å; M85-L88 HydrophobicContact SD-CD2 4Å; M85-A89 VanDerWaalsContact O-CB 3.26Å; M85-A89 WeakPolarHBondContact O-CB 3.49Å; M85-A89 PolarHBondContact O-N 3.45Å; M85-L111 HydrophobicContact CG-CD1 4.34Å; M85-L111 HydrophobicContact CG-CG 4.39Å; M85-L111 HydrophobicContact SD-CD1 3.33Å; M85-L111 WeakPolarHBondContact SD-CD1 3.46Å; M85-L111 HydrophobicContact SD-CG 3.52Å; M85-L111 VanDerWaalsContact SD-CG 3.52Å; M85-V126 HydrophobicContact CE-CG1 4.49Å; M85-A128 HydrophobicContact CE-CB 3.71Å; M85-A128 VanDerWaalsContact CE-N 3.27Å
86K89.5Confident87Confident190 Ų19052.9 Ų52.983%0.82630%0.295SS*.Hα-helixtrans-65.2-45.4177.2-66.6179.7-179.5177.80111.7N84 G90N84-K86 VanDerWaalsContact C-N 3.25Å; N84-K86 PolarHBondContact O-N 3.44Å; K86-G90 PolarHBondContact O-N 3.24Å
87R89.7Confident86.3Confident154 Ų15453.9 Ų53.958%0.58131%0.305SS*.Hα-helixtrans-70-39.4178.3-166.6-171.5178.8-173.1-0.7111.1N84 G90 C91 P151 F152N84-R87 HydrophobicContact CB-CB 4.19Å; N84-R87 PolarHBondContact O-N 3.35Å; N84-R87 WeakPolarHBondContact OD1-CB 3.47Å; N84-R87 PolarHBondContact OD1-N 2.92Å; R87-G90 PolarHBondContact O-N 3.37Å; R87-C91 PolarHBondContact O-N 2.97Å; R87-C91 VanDerWaalsContact O-N 3.1Å; R87-P151 PolarHBondContact NH1-O 3.25Å; R87-P151 VanDerWaalsContact NH1-O 3.09Å; R87-F152 HydrophobicContact CB-CD1 4.07Å; R87-F152 HydrophobicContact CB-CE1 4.39Å; R87-F152 HydrophobicContact CG-CD1 3.9Å; R87-F152 HydrophobicContact CG-CE1 3.87Å
88L89.3Confident85.9Confident0 Ų052.6 Ų52.60%030%0.301CS..Hα-helixtrans-63.3-48.6177.6-177.859.4000111.5N84 M85 G90 C91 L92 F96 L111 V126 L149 F152N84-L88 WeakPolarHBondContact O-CB 3.47Å; N84-L88 PolarHBondContact O-N 3.38Å; M85-L88 PolarHBondContact O-N 3.46Å; M85-L88 HydrophobicContact SD-CD2 4Å; L88-G90 VanDerWaalsContact C-N 3.26Å; L88-G90 PolarHBondContact O-N 3.24Å; L88-C91 PolarHBondContact O-N 2.94Å; L88-C91 VanDerWaalsContact O-N 3.1Å; L88-L92 HydrophobicContact CD1-CD1 4.29Å; L88-L92 HydrophobicContact CG-CD1 3.96Å; L88-L92 WeakPolarHBondContact O-CD1 3.27Å; L88-L92 PolarHBondContact O-N 3.09Å; L88-F96 HydrophobicContact CD1-CE2 4.34Å; L88-F96 HydrophobicContact CD1-CZ 4.19Å; L88-L111 HydrophobicContact CD2-CD1 3.8Å; L88-L111 HydrophobicContact CG-CD1 3.92Å; L88-V126 HydrophobicContact CD2-CG1 3.82Å; L88-L149 HydrophobicContact CD1-CD2 3.72Å; L88-L149 HydrophobicContact CD2-CD2 3.84Å; L88-L149 HydrophobicContact CG-CD2 4.47Å; L88-F152 HydrophobicContact CB-CD1 4.1Å; L88-F152 HydrophobicContact CB-CG 4.33Å; L88-F152 HydrophobicContact CD1-CD1 4.36Å; L88-F152 HydrophobicContact CD1-CD2 3.93Å; L88-F152 HydrophobicContact CD1-CE1 4.46Å; L88-F152 HydrophobicContact CD1-CE2 4.04Å; L88-F152 HydrophobicContact CD1-CG 4.1Å; L88-F152 HydrophobicContact CD1-CZ 4.31Å
89A86.7Confident85.6Confident53 Ų5356 Ų5644%0.43832%0.321SS..Hα-helixtrans-58.9-35.8176.700000112.9M85M85-A89 VanDerWaalsContact O-CB 3.26Å; M85-A89 WeakPolarHBondContact O-CB 3.49Å; M85-A89 PolarHBondContact O-N 3.45Å
90G85.4Confident85.3Confident50 Ų5057.2 Ų57.252%0.51533%0.334SS..Hα-helixtrans-68.3-38.1174.500000113.5K86 R87 L88K86-G90 PolarHBondContact O-N 3.24Å; R87-G90 PolarHBondContact O-N 3.37Å; L88-G90 VanDerWaalsContact C-N 3.26Å; L88-G90 PolarHBondContact O-N 3.24Å
91C85Confident85Confident42 Ų4260.1 Ų60.128%0.28435%0.349SS..Hα-helixtrans-79-24.8-178.3-166.60000113.5R87 L88 A93 D94 F152R87-C91 PolarHBondContact O-N 2.97Å; R87-C91 VanDerWaalsContact O-N 3.1Å; L88-C91 PolarHBondContact O-N 2.94Å; L88-C91 VanDerWaalsContact O-N 3.1Å; C91-A93 PolarHBondContact O-N 3.02Å; C91-A93 VanDerWaalsContact O-N 3.16Å; C91-D94 PolarHBondContact O-N 3.36Å; C91-D94 VanDerWaalsContact O-O 3.06Å; C91-F152 HydrophobicContact CB-CE1 3.82Å; C91-F152 HydrophobicContact CB-CZ 3.59Å
92L81Confident84.6Confident22 Ų2264 Ų6412%0.11538%0.377CS..THydrogen-bonded Turntrans-62.2-19.4178.9-86.7151.5000113.9L88 D94 F96 L111 L113L88-L92 HydrophobicContact CD1-CD1 4.29Å; L88-L92 HydrophobicContact CG-CD1 3.96Å; L88-L92 WeakPolarHBondContact O-CD1 3.27Å; L88-L92 PolarHBondContact O-N 3.09Å; L92-D94 VanDerWaalsContact C-N 3.29Å; L92-F96 HydrophobicContact CD2-CB 4.3Å; L92-F96 HydrophobicContact CD2-CD1 3.56Å; L92-F96 HydrophobicContact CD2-CE1 4.07Å; L92-F96 HydrophobicContact CD2-CG 4Å; L92-F96 HydrophobicContact CG-CD1 4.38Å; L92-F96 HydrophobicContact CG-CG 4.47Å; L92-L111 HydrophobicContact CD1-CD1 3.55Å; L92-L113 HydrophobicContact CD1-CD2 4.05Å; L92-L113 HydrophobicContact CD2-CD1 4.35Å; L92-L113 HydrophobicContact CD2-CD2 3.43Å; L92-L113 VanDerWaalsContact CD2-CD2 3.43Å; L92-L113 HydrophobicContact CG-CD2 4.42Å
93A73.9Confident84Confident87 Ų8763.7 Ų63.772%0.71937%0.373SS*.THydrogen-bonded Turntrans-72.7-22.8172.500000112.9C91C91-A93 PolarHBondContact O-N 3.02Å; C91-A93 VanDerWaalsContact O-N 3.16Å
94D71.9Confident83.4Confident118 Ų11865.4 Ų65.463%0.63139%0.386SS*.SBendtrans-103.6111.8-176.9-64.2-29.4000109.7C91 L92 F96C91-D94 PolarHBondContact O-N 3.36Å; C91-D94 VanDerWaalsContact O-O 3.06Å; L92-D94 VanDerWaalsContact C-N 3.29Å; D94-F96 WeakPolarHBondContact O-CA 3.33Å; D94-F96 PolarHBondContact O-N 3.37Å
95D70.3Confident82.6Confident159 Ų15971.6 Ų71.685%0.8542%0.415SS*.SBendtrans8.960.4177.2-16115.1000116.9G97D95-G97 PolarHBondContact O-N 3.48Å
96F78.4Confident82.1Confident14 Ų1476.5 Ų76.56%0.06144%0.437CS..  trans-83.5-3.1-173.8-168.6-99.5000112L88 L92 D94 F98 L113 L145 R148 L149 F152L88-F96 HydrophobicContact CD1-CE2 4.34Å; L88-F96 HydrophobicContact CD1-CZ 4.19Å; L92-F96 HydrophobicContact CD2-CB 4.3Å; L92-F96 HydrophobicContact CD2-CD1 3.56Å; L92-F96 HydrophobicContact CD2-CE1 4.07Å; L92-F96 HydrophobicContact CD2-CG 4Å; L92-F96 HydrophobicContact CG-CD1 4.38Å; L92-F96 HydrophobicContact CG-CG 4.47Å; D94-F96 WeakPolarHBondContact O-CA 3.33Å; D94-F96 PolarHBondContact O-N 3.37Å; F96-F98 HydrophobicContact CD1-CB 4.01Å; F96-F98 HydrophobicContact CD1-CD2 4.07Å; F96-F98 HydrophobicContact CD1-CG 4.48Å; F96-F98 HydrophobicContact CE1-CB 4.49Å; F96-F98 HydrophobicContact CE1-CD2 4.17Å; F96-F98 PolarHBondContact O-N 3.07Å; F96-F98 VanDerWaalsContact O-N 3.12Å; F96-L113 HydrophobicContact CE1-CD1 4.34Å; F96-L145 HydrophobicContact CE1-CD1 3.54Å; F96-L145 HydrophobicContact CZ-CD1 4Å; F96-R148 HydrophobicContact CE2-CB 3.94Å; F96-R148 HydrophobicContact CZ-CB 3.82Å; F96-R148 PolarHBondContact O-NH1 2.94Å; F96-L149 HydrophobicContact CZ-CD2 4.24Å; F96-F152 HydrophobicContact CE2-CE2 4.19Å
97G81.7Confident81.7Confident21 Ų2168.1 Ų68.122%0.21640%0.402CS..SBendtrans71.1-9-173.500000114.5D95 S116D95-G97 PolarHBondContact O-N 3.48Å; G97-S116 WeakPolarHBondContact O-CB 3.33Å; G97-S116 PolarHBondContact O-N 3.48Å; G97-S116 PolarHBondContact O-OG 3.28Å
98F85.2Confident81.4Confident9 Ų967.3 Ų67.34%0.03941%0.409CS..EExtended strand (participates in β ladder)trans-127.4143.6173.8-60.5-101.9000110.2F96 L113 S114 P115 L145F96-F98 HydrophobicContact CD1-CB 4.01Å; F96-F98 HydrophobicContact CD1-CD2 4.07Å; F96-F98 HydrophobicContact CD1-CG 4.48Å; F96-F98 HydrophobicContact CE1-CB 4.49Å; F96-F98 HydrophobicContact CE1-CD2 4.17Å; F96-F98 PolarHBondContact O-N 3.07Å; F96-F98 VanDerWaalsContact O-N 3.12Å; F98-L113 HydrophobicContact CB-CB 4.2Å; F98-L113 HydrophobicContact CD1-CB 4.47Å; F98-S114 CarbonylContact C-O 3.57Å; F98-S114 WeakPolarHBondContact CA-O 3.46Å; F98-S114 WeakPolarHBondContact CB-O 3.39Å; F98-P115 HydrophobicContact CD1-CB 4.19Å; F98-P115 HydrophobicContact CE1-CB 4.04Å; F98-L145 HydrophobicContact CD2-CD1 3.82Å; F98-L145 HydrophobicContact CE1-CB 4.48Å; F98-L145 HydrophobicContact CE1-CD2 4.34Å; F98-L145 HydrophobicContact CE2-CB 3.91Å; F98-L145 HydrophobicContact CE2-CD1 3.81Å; F98-L145 HydrophobicContact CE2-CG 4.35Å; F98-L145 HydrophobicContact CG-CD1 4.29Å; F98-L145 HydrophobicContact CZ-CB 3.77Å; F98-L145 HydrophobicContact CZ-CD1 4.25Å; F98-L145 HydrophobicContact CZ-CD2 4.43Å; F98-L145 HydrophobicContact CZ-CG 4.35Å
99T86.1Confident81.3Confident73 Ų7369.8 Ų69.845%0.44842%0.422SS..EExtended strand (participates in β ladder)trans-100.7129.9176.1-57.90000109.8L113 S114 S116T99-L113 WeakPolarHBondContact O-CA 3.39Å; T99-S114 PolarHBondContact N-O 3.08Å; T99-S114 PolarHBondContact O-N 3.25Å; T99-S116 PolarHBondContact OG1-OG 3.23Å; T99-S116 VanDerWaalsContact OG1-OG 3.13Å
100A86.6Confident81.5Confident49 Ų4967.7 Ų67.741%0.40540%0.404SS..EExtended strand (participates in β ladder)trans-74.8126.6173.300000110.7R112 L113A100-R112 CarbonylContact C-O 3.53Å; A100-R112 WeakPolarHBondContact CA-O 3.39Å; A100-L113 HydrophobicContact CB-CD2 4.02Å
101L85.7Confident81.9Confident61 Ų6167 Ų6732%0.31939%0.388SS..EExtended strand (participates in β ladder)trans-103.1143.1176.6-62.4178.4000110.1R112L101-R112 HydrophobicContact CB-CB 4.4Å; L101-R112 HydrophobicContact CB-CG 4.12Å; L101-R112 PolarHBondContact N-O 3.49Å
102P82.3Confident82.2Confident120 Ų12066.1 Ų66.178%0.77938%0.379SS*.PPolyproline II helixtrans-66.8138173.628.5-33.3000110.4
103L80.9Confident82.7Confident32 Ų3265.1 Ų65.117%0.16837%0.373CS..  trans-114.2-64.4175.1-175.865.6000111.1L107 V110 F125 L199 Y202L103-L107 HydrophobicContact CD2-CD1 3.68Å; L103-L107 HydrophobicContact CG-CD1 4.12Å; L103-V110 HydrophobicContact CD2-CG1 3.98Å; L103-V110 HydrophobicContact CD2-CG2 4.45Å; L103-F125 HydrophobicContact CD1-CE1 4.22Å; L103-F125 HydrophobicContact CD2-CD1 4.46Å; L103-F125 HydrophobicContact CD2-CE1 4.13Å; L103-L199 HydrophobicContact CD1-CD2 4.26Å; L103-Y202 HydrophobicContact CD2-CD2 3.76Å; L103-Y202 HydrophobicContact CD2-CE2 4.48Å; L103-Y202 HydrophobicContact CD2-CG 3.96Å
104S80.1Confident83.4Confident43 Ų4362.4 Ų62.430%0.30135%0.349SS..  trans-159.1149.2173.4176.50000109.5E106 L107S104-E106 PolarHBondContact O-N 3.04Å; S104-E106 PolarHBondContact OG-N 3.32Å; S104-L107 PolarHBondContact O-N 3.02Å
105M76.4Confident84.2Confident181 Ų18157.3 Ų57.389%0.89232%0.323SS*.THydrogen-bonded Turntrans-70.2-18.4173.4-74.5-176.8-84.600113.1L107M105-L107 VanDerWaalsContact C-N 3.32Å
106E77.6Confident84.7Confident128 Ų12852.6 Ų52.660%0.59830%0.302SS*.THydrogen-bonded Turntrans-77.1-22.3178-65167.8173.800112.2S104 F273 K277S104-E106 PolarHBondContact O-N 3.04Å; S104-E106 PolarHBondContact OG-N 3.32Å; E106-F273 HydrophobicContact CB-CD2 4.24Å; E106-F273 HydrophobicContact CB-CE2 4.3Å; E106-F273 WeakPolarHBondContact OE2-CD2 3.31Å; E106-F273 VanDerWaalsContact OE2-CE2 3.3Å; E106-F273 WeakPolarHBondContact OE2-CE2 3.36Å; E106-K277 IonicContact OE2-NZ 3.01Å; E106-K277 PolarHBondContact OE2-NZ 3.03Å; E106-K277 VanDerWaalsContact OE2-NZ 3.15Å
107L82.4Confident84.5Confident14 Ų1457.9 Ų57.97%0.07333%0.327CS..  trans-104.381-169.1-68.7-178.7000111.1L103 S104 M105 V110 Y202 F273L103-L107 HydrophobicContact CD2-CD1 3.68Å; L103-L107 HydrophobicContact CG-CD1 4.12Å; S104-L107 PolarHBondContact O-N 3.02Å; M105-L107 VanDerWaalsContact C-N 3.32Å; L107-V110 HydrophobicContact CB-CG1 3.68Å; L107-V110 HydrophobicContact CD1-CG1 4.21Å; L107-V110 HydrophobicContact CG-CG1 4.42Å; L107-Y202 HydrophobicContact CD1-CD1 3.97Å; L107-Y202 HydrophobicContact CD1-CD2 4.27Å; L107-Y202 HydrophobicContact CD1-CE1 3.7Å; L107-Y202 HydrophobicContact CD1-CE2 4.03Å; L107-Y202 HydrophobicContact CD1-CG 4.24Å; L107-Y202 HydrophobicContact CD2-CE1 4.12Å; L107-Y202 WeakPolarHBondContact CD2-OH 3.05Å; L107-F273 HydrophobicContact CD1-CD2 4.45Å; L107-F273 HydrophobicContact CD1-CE1 4.15Å; L107-F273 HydrophobicContact CD1-CE2 3.77Å; L107-F273 HydrophobicContact CD1-CZ 3.59Å; L107-F273 HydrophobicContact CD2-CD1 4.29Å; L107-F273 HydrophobicContact CD2-CD2 3.6Å; L107-F273 HydrophobicContact CD2-CE1 4.44Å; L107-F273 HydrophobicContact CD2-CE2 3.76Å; L107-F273 HydrophobicContact CD2-CG 3.87Å; L107-F273 HydrophobicContact CD2-CZ 4.19Å; L107-F273 HydrophobicContact CG-CD2 3.96Å; L107-F273 HydrophobicContact CG-CE2 3.6Å; L107-F273 HydrophobicContact CG-CZ 3.98Å
108N83.1Confident83.4Confident137 Ų13765.6 Ų65.673%0.73336%0.362SS*.THydrogen-bonded Turntrans-87.1-9.3-179-65.5-37000114.2
109N87.5Confident82.4Confident53 Ų5368.8 Ų68.828%0.28340%0.398SS..THydrogen-bonded Turntrans-95.84.6-17965.1-37000113.4A128 E129N109-A128 HydrophobicContact CB-CB 3.93Å; N109-A128 WeakPolarHBondContact O-CB 3.41Å; N109-A128 PolarHBondContact O-N 3.15Å; N109-E129 PolarHBondContact ND2-OE1 2.96Å
110V90.9Very high81.4Confident9 Ų969 Ų696%0.05539%0.393CS..EExtended strand (participates in β ladder)trans-137.4140.7-178.453.70000111.4L103 L107 F125 V126 F127 Y202L103-V110 HydrophobicContact CD2-CG1 3.98Å; L103-V110 HydrophobicContact CD2-CG2 4.45Å; L107-V110 HydrophobicContact CB-CG1 3.68Å; L107-V110 HydrophobicContact CD1-CG1 4.21Å; L107-V110 HydrophobicContact CG-CG1 4.42Å; V110-F125 HydrophobicContact CG2-CB 4.39Å; V110-F125 HydrophobicContact CG2-CD1 4.11Å; V110-V126 CarbonylContact C-O 3.53Å; V110-V126 VanDerWaalsContact CA-O 3.29Å; V110-V126 WeakPolarHBondContact CA-O 3.5Å; V110-F127 HydrophobicContact CB-CD1 4.34Å; V110-F127 HydrophobicContact CB-CE1 4.43Å; V110-F127 HydrophobicContact CG2-CD1 4.34Å; V110-F127 HydrophobicContact CG2-CE1 4.18Å; V110-F127 HydrophobicContact CG2-CZ 4.32Å; V110-Y202 HydrophobicContact CB-CE2 4.11Å; V110-Y202 HydrophobicContact CG1-CD2 4.15Å; V110-Y202 HydrophobicContact CG1-CE2 3.63Å; V110-Y202 HydrophobicContact CG2-CD2 4.15Å; V110-Y202 HydrophobicContact CG2-CE2 4.13Å
111L92.1Very high80.8Confident34 Ų3471 Ų7118%0.17840%0.403CS..EExtended strand (participates in β ladder)trans-117129.3171.5-64175.5000109.8M85 L88 L92 L113 F125 V126M85-L111 HydrophobicContact CG-CD1 4.34Å; M85-L111 HydrophobicContact CG-CG 4.39Å; M85-L111 HydrophobicContact SD-CD1 3.33Å; M85-L111 WeakPolarHBondContact SD-CD1 3.46Å; M85-L111 HydrophobicContact SD-CG 3.52Å; M85-L111 VanDerWaalsContact SD-CG 3.52Å; L88-L111 HydrophobicContact CD2-CD1 3.8Å; L88-L111 HydrophobicContact CG-CD1 3.92Å; L92-L111 HydrophobicContact CD1-CD1 3.55Å; L111-L113 HydrophobicContact CB-CD2 4.42Å; L111-F125 WeakPolarHBondContact O-CA 3.31Å; L111-V126 HydrophobicContact CB-CB 4.47Å; L111-V126 PolarHBondContact N-O 3.45Å; L111-V126 PolarHBondContact O-N 3.16Å
112R92.5Very high80.9Confident25 Ų2568.1 Ų68.19%0.09439%0.388CS..EExtended strand (participates in β ladder)trans-93.2123.9170.4-178.2-177177-158.73.3108.5A100 L101 E123 A124 F125 S198A100-R112 CarbonylContact C-O 3.53Å; A100-R112 WeakPolarHBondContact CA-O 3.39Å; L101-R112 HydrophobicContact CB-CB 4.4Å; L101-R112 HydrophobicContact CB-CG 4.12Å; L101-R112 PolarHBondContact N-O 3.49Å; R112-E123 IonicContact CZ-OE1 3.3Å; R112-E123 IonicContact CZ-OE2 3.63Å; R112-E123 VanDerWaalsContact CZ-OE2 3.3Å; R112-E123 IonicContact NE-OE1 3.7Å; R112-E123 IonicContact NE-OE2 3.81Å; R112-E123 PolarHBondContact NE-OE2 3.05Å; R112-E123 IonicContact NH2-OE1 2.84Å; R112-E123 PolarHBondContact NH2-OE1 3.28Å; R112-E123 IonicContact NH2-OE2 3.14Å; R112-E123 PolarHBondContact NH2-OE2 3.31Å; R112-A124 CarbonylContact C-O 3.56Å; R112-A124 WeakPolarHBondContact CA-O 3.48Å; R112-F125 HydrophobicContact CB-CD1 4.31Å; R112-F125 HydrophobicContact CB-CE1 4.12Å; R112-F125 HydrophobicContact CG-CD1 4.49Å; R112-F125 HydrophobicContact CG-CE1 4Å; R112-F125 HydrophobicContact CG-CZ 4.23Å; R112-S198 PolarHBondContact NH1-OG 3.34Å; R112-S198 PolarHBondContact NH2-OG 3.01Å; R112-S198 VanDerWaalsContact NH2-OG 3.09Å
113L91.7Very high81.3Confident0 Ų063.1 Ų63.10%035%0.354CS..EExtended strand (participates in β ladder)trans-119.5140.7-177.6-57.2-176.6000109.9L92 F96 F98 T99 A100 L111 E123 A124 V126 L145L92-L113 HydrophobicContact CD1-CD2 4.05Å; L92-L113 HydrophobicContact CD2-CD1 4.35Å; L92-L113 HydrophobicContact CD2-CD2 3.43Å; L92-L113 VanDerWaalsContact CD2-CD2 3.43Å; L92-L113 HydrophobicContact CG-CD2 4.42Å; F96-L113 HydrophobicContact CE1-CD1 4.34Å; F98-L113 HydrophobicContact CB-CB 4.2Å; F98-L113 HydrophobicContact CD1-CB 4.47Å; T99-L113 WeakPolarHBondContact O-CA 3.39Å; A100-L113 HydrophobicContact CB-CD2 4.02Å; L111-L113 HydrophobicContact CB-CD2 4.42Å; L113-E123 CarbonylContact O-C 3.47Å; L113-E123 WeakPolarHBondContact O-CA 3.42Å; L113-A124 HydrophobicContact CB-CB 4.4Å; L113-A124 PolarHBondContact N-O 3.33Å; L113-A124 PolarHBondContact O-N 3.5Å; L113-V126 HydrophobicContact CD1-CG2 3.67Å; L113-V126 HydrophobicContact CG-CG2 4.35Å; L113-L145 HydrophobicContact CD1-CD1 4.14Å; L113-L145 HydrophobicContact CD1-CD2 4.35Å
114S89Confident81.9Confident30 Ų3061.7 Ų61.721%0.2135%0.346CS..EExtended strand (participates in β ladder)trans-121.9140.2169.8179.60000108.4F98 T99 S116F98-S114 CarbonylContact C-O 3.57Å; F98-S114 WeakPolarHBondContact CA-O 3.46Å; F98-S114 WeakPolarHBondContact CB-O 3.39Å; T99-S114 PolarHBondContact N-O 3.08Å; T99-S114 PolarHBondContact O-N 3.25Å; S114-S116 PolarHBondContact O-N 3.4Å
115P86.9Confident82.7Confident12 Ų1259.6 Ų59.68%0.07833%0.332CS..EExtended strand (participates in β ladder)trans-58.8138.217327.2-33.5000109.6F98 Q117 H120 G122 L137F98-P115 HydrophobicContact CD1-CB 4.19Å; F98-P115 HydrophobicContact CE1-CB 4.04Å; P115-Q117 PolarHBondContact O-N 3.4Å; P115-H120 HydrophobicContact CG-CB 3.9Å; P115-G122 WeakPolarHBondContact CD-O 3.43Å; P115-L137 HydrophobicContact CG-CD2 4.04Å
116S80.9Confident83.5Confident59 Ų5951 Ų5141%0.41329%0.289SS..SBendtrans-74.5-16.4179.7-61.10000112.6G97 T99 S114 L118G97-S116 WeakPolarHBondContact O-CB 3.33Å; G97-S116 PolarHBondContact O-N 3.48Å; G97-S116 PolarHBondContact O-OG 3.28Å; T99-S116 PolarHBondContact OG1-OG 3.23Å; T99-S116 VanDerWaalsContact OG1-OG 3.13Å; S114-S116 PolarHBondContact O-N 3.4Å; S116-L118 PolarHBondContact O-N 3.34Å; S116-L118 VanDerWaalsContact O-N 3.12Å
117Q74Confident84.3Confident126 Ų12644.9 Ų44.959%0.58926%0.261SS*.SBendtrans-64112174.4-61.9-174.540.300109.2P115 G119P115-Q117 PolarHBondContact O-N 3.4Å; Q117-G119 PolarHBondContact O-N 3.02Å; Q117-G119 VanDerWaalsContact O-N 3.09Å
118L58.9Low84.8Confident182 Ų18245.4 Ų45.495%0.95327%0.267SS*.THydrogen-bonded Turntrans-51.6114.1-178.5-118.487.7000110.7S116S116-L118 PolarHBondContact O-N 3.34Å; S116-L118 VanDerWaalsContact O-N 3.12Å
119G64.2Low85.1Confident76 Ų7640.7 Ų40.778%0.78424%0.241SC*.THydrogen-bonded Turntrans118.1-6.8165.200000117.3Q117Q117-G119 PolarHBondContact O-N 3.02Å; Q117-G119 VanDerWaalsContact O-N 3.09Å
120H64.8Low85.3Confident77 Ų7738.2 Ų38.236%0.35623%0.227SC..  trans-83122.6170.7-70-79.5000110.3P115 G122P115-H120 HydrophobicContact CG-CB 3.9Å; H120-G122 PolarHBondContact O-N 3.48Å
121P74.6Confident85.4Confident93 Ų9337.8 Ų37.860%0.60423%0.225SC*.  trans-76.43178.533.6-36.9000113.2
122G87.4Confident85.6Confident0 Ų036.2 Ų36.20%022%0.217CC..  trans-73.1146.9-17500000112.5P115 H120 W135P115-G122 WeakPolarHBondContact CD-O 3.43Å; H120-G122 PolarHBondContact O-N 3.48Å; G122-W135 CarbonylContact C-O 3.51Å; G122-W135 WeakPolarHBondContact CA-O 3.48Å
123E91.9Very high85.8Confident15 Ų1535 Ų357%0.0721%0.212CC..EExtended strand (participates in β ladder)trans-134.8154.2179.2-66174.6-151.500109.8R112 L113 W135 L137 K201R112-E123 IonicContact CZ-OE1 3.3Å; R112-E123 IonicContact CZ-OE2 3.63Å; R112-E123 VanDerWaalsContact CZ-OE2 3.3Å; R112-E123 IonicContact NE-OE1 3.7Å; R112-E123 IonicContact NE-OE2 3.81Å; R112-E123 PolarHBondContact NE-OE2 3.05Å; R112-E123 IonicContact NH2-OE1 2.84Å; R112-E123 PolarHBondContact NH2-OE1 3.28Å; R112-E123 IonicContact NH2-OE2 3.14Å; R112-E123 PolarHBondContact NH2-OE2 3.31Å; L113-E123 CarbonylContact O-C 3.47Å; L113-E123 WeakPolarHBondContact O-CA 3.42Å; E123-W135 HydrophobicContact CB-CB 4.42Å; E123-W135 PolarHBondContact N-O 2.97Å; E123-W135 WeakPolarHBondContact O-CB 3.46Å; E123-W135 PolarHBondContact O-N 3.47Å; E123-L137 WeakPolarHBondContact O-CD1 3.47Å; E123-K201 IonicContact OE1-NZ 3.94Å; E123-K201 PolarHBondContact OE1-NZ 2.97Å; E123-K201 IonicContact OE2-NZ 2.8Å; E123-K201 PolarHBondContact OE2-NZ 3.15Å
124A94.1Very high85.9Confident1 Ų135.1 Ų35.11%0.00821%0.213CC..EExtended strand (participates in β ladder)trans-127.3141.3172.100000110.7R112 L113 V133 F134 L137 L145R112-A124 CarbonylContact C-O 3.56Å; R112-A124 WeakPolarHBondContact CA-O 3.48Å; L113-A124 HydrophobicContact CB-CB 4.4Å; L113-A124 PolarHBondContact N-O 3.33Å; L113-A124 PolarHBondContact O-N 3.5Å; A124-V133 CarbonylContact C-O 3.57Å; A124-V133 VanDerWaalsContact CA-O 3.28Å; A124-V133 WeakPolarHBondContact CA-O 3.42Å; A124-F134 HydrophobicContact CB-CD1 3.88Å; A124-F134 HydrophobicContact CB-CE1 4.23Å; A124-L137 HydrophobicContact CB-CD1 4.04Å; A124-L145 HydrophobicContact CB-CD2 3.62Å
125F95.3Very high86.2Confident0 Ų033.7 Ų33.70%020%0.203CC..EExtended strand (participates in β ladder)trans-109.9118171-67.2-91.5000108.4L103 V110 L111 R112 F127 V132 V133 W135 K201L103-F125 HydrophobicContact CD1-CE1 4.22Å; L103-F125 HydrophobicContact CD2-CD1 4.46Å; L103-F125 HydrophobicContact CD2-CE1 4.13Å; V110-F125 HydrophobicContact CG2-CB 4.39Å; V110-F125 HydrophobicContact CG2-CD1 4.11Å; L111-F125 WeakPolarHBondContact O-CA 3.31Å; R112-F125 HydrophobicContact CB-CD1 4.31Å; R112-F125 HydrophobicContact CB-CE1 4.12Å; R112-F125 HydrophobicContact CG-CD1 4.49Å; R112-F125 HydrophobicContact CG-CE1 4Å; R112-F125 HydrophobicContact CG-CZ 4.23Å; F125-F127 HydrophobicContact CB-CD2 4.25Å; F125-F127 HydrophobicContact CB-CE2 3.55Å; F125-F127 HydrophobicContact CB-CZ 4.16Å; F125-V132 CarbonylContact O-C 3.59Å; F125-V132 WeakPolarHBondContact O-CA 3.4Å; F125-V133 HydrophobicContact CB-CB 4.49Å; F125-V133 PolarHBondContact N-O 3.32Å; F125-V133 PolarHBondContact O-N 2.94Å; F125-W135 AromaticContact CD2-CD1 3.6Å; F125-W135 AromaticContact CD2-NE1 3.56Å; F125-W135 AromaticContact CE2-CD1 3.65Å; F125-W135 HydrophobicContact CE2-CG 4.46Å; F125-W135 AromaticContact CE2-NE1 3.58Å; F125-K201 HydrophobicContact CE2-CB 3.82Å; F125-K201 HydrophobicContact CE2-CD 4.4Å; F125-K201 HydrophobicContact CZ-CB 3.81Å
126V94.9Very high86.3Confident0 Ų036.3 Ų36.30%022%0.216CC..EExtended strand (participates in β ladder)trans-101.9120.5175.8-178.20000108.3F83 M85 L88 V110 L111 L113 V132 L149F83-V126 HydrophobicContact CD2-CG1 3.66Å; F83-V126 HydrophobicContact CE2-CG1 3.92Å; F83-V126 HydrophobicContact CG-CG1 4.48Å; M85-V126 HydrophobicContact CE-CG1 4.49Å; L88-V126 HydrophobicContact CD2-CG1 3.82Å; V110-V126 CarbonylContact C-O 3.53Å; V110-V126 VanDerWaalsContact CA-O 3.29Å; V110-V126 WeakPolarHBondContact CA-O 3.5Å; L111-V126 HydrophobicContact CB-CB 4.47Å; L111-V126 PolarHBondContact N-O 3.45Å; L111-V126 PolarHBondContact O-N 3.16Å; L113-V126 HydrophobicContact CD1-CG2 3.67Å; L113-V126 HydrophobicContact CG-CG2 4.35Å; V126-V132 HydrophobicContact CG1-CG2 4.42Å; V126-V132 HydrophobicContact CG2-CG1 4.07Å; V126-V132 HydrophobicContact CG2-CG2 4.39Å; V126-L149 HydrophobicContact CG1-CD1 4.42Å; V126-L149 HydrophobicContact CG1-CD2 4.36Å; V126-L149 HydrophobicContact CG2-CD1 4.08Å
127F94.1Very high86.7Confident0 Ų034 Ų340%020%0.199CC..EExtended strand (participates in β ladder)trans-103137.4-175.4-74.4-91.3000110.6F83 V110 F125 E129 G130 A131 V133 Y202 N206 T209F83-F127 WeakPolarHBondContact CD2-O 3.37Å; V110-F127 HydrophobicContact CB-CD1 4.34Å; V110-F127 HydrophobicContact CB-CE1 4.43Å; V110-F127 HydrophobicContact CG2-CD1 4.34Å; V110-F127 HydrophobicContact CG2-CE1 4.18Å; V110-F127 HydrophobicContact CG2-CZ 4.32Å; F125-F127 HydrophobicContact CB-CD2 4.25Å; F125-F127 HydrophobicContact CB-CE2 3.55Å; F125-F127 HydrophobicContact CB-CZ 4.16Å; F127-E129 WeakPolarHBondContact CB-OE2 3.46Å; F127-E129 PolarHBondContact O-N 3.23Å; F127-G130 PolarHBondContact O-N 2.93Å; F127-A131 HydrophobicContact CB-CB 4.37Å; F127-A131 WeakPolarHBondContact CB-O 3.1Å; F127-A131 PolarHBondContact N-O 3.05Å; F127-V133 HydrophobicContact CD2-CG2 4.38Å; F127-V133 HydrophobicContact CE2-CB 4.42Å; F127-V133 HydrophobicContact CE2-CG2 3.92Å; F127-Y202 HydrophobicContact CE1-CD2 4.2Å; F127-Y202 AromaticContact CE1-CE2 3.69Å; F127-Y202 HydrophobicContact CE1-CE2 3.69Å; F127-Y202 HydrophobicContact CZ-CD2 4.19Å; F127-Y202 HydrophobicContact CZ-CE2 4.15Å; F127-N206 HydrophobicContact CE1-CB 4.07Å; F127-N206 HydrophobicContact CZ-CB 4.29Å; F127-T209 HydrophobicContact CB-CG2 4.23Å; F127-T209 HydrophobicContact CD1-CG2 4.49Å; F127-T209 WeakPolarHBondContact CD2-OG1 3.38Å; F127-T209 WeakPolarHBondContact CE2-OG1 3.44Å; F127-T209 HydrophobicContact CG-CG2 4.22Å; F127-T209 WeakPolarHBondContact CG-OG1 3.44Å
128A91.9Very high87.4Confident24 Ų2433.4 Ų33.420%0.19820%0.196CC..THydrogen-bonded Turntrans-57.9-22.2179.400000113S82 F83 M85 N109 G130S82-A128 CarbonylContact C-O 3.42Å; S82-A128 WeakPolarHBondContact CA-O 3.35Å; S82-A128 VanDerWaalsContact CB-O 3.23Å; S82-A128 WeakPolarHBondContact CB-O 3.3Å; F83-A128 PolarHBondContact N-O 3.37Å; M85-A128 HydrophobicContact CE-CB 3.71Å; M85-A128 VanDerWaalsContact CE-N 3.27Å; N109-A128 HydrophobicContact CB-CB 3.93Å; N109-A128 WeakPolarHBondContact O-CB 3.41Å; N109-A128 PolarHBondContact O-N 3.15Å; A128-G130 PolarHBondContact O-N 3.33Å; A128-G130 VanDerWaalsContact O-N 3.11Å
129E89.2Confident88.7Confident39 Ų3930.7 Ų30.718%0.18218%0.179CC..THydrogen-bonded Turntrans-72.212.5175.3-57.977.8-171.400113.5E81 N109 F127 A131 T209E81-E129 CarbonylContact O-C 3.04Å; N109-E129 PolarHBondContact ND2-OE1 2.96Å; F127-E129 WeakPolarHBondContact CB-OE2 3.46Å; F127-E129 PolarHBondContact O-N 3.23Å; E129-A131 VanDerWaalsContact C-N 3.33Å; E129-A131 PolarHBondContact O-N 3.29Å; E129-T209 HydrophobicContact CB-CG2 4.29Å
130G92.1Very high89.9Confident0 Ų030.4 Ų30.40%017%0.165CC..THydrogen-bonded Turntrans75.322.9174.500000113.8T78 T79 A80 F83 F127 A128T78-G130 WeakPolarHBondContact CA-O 3.41Å; T78-G130 PolarHBondContact OG1-O 3.23Å; T78-G130 VanDerWaalsContact OG1-O 3.08Å; T79-G130 PolarHBondContact N-O 3.42Å; T79-G130 VanDerWaalsContact N-O 3.09Å; A80-G130 WeakPolarHBondContact O-CA 3.41Å; F83-G130 VanDerWaalsContact CE2-C 3.44Å; F127-G130 PolarHBondContact O-N 2.93Å; A128-G130 PolarHBondContact O-N 3.33Å; A128-G130 VanDerWaalsContact O-N 3.11Å
131A93.4Very high91.1Very high1 Ų127.9 Ų27.91%0.00815%0.154CC..EExtended strand (participates in β ladder)trans-118.1150.9179.200000111.6Y77 F127 E129 T209 V212Y77-A131 CarbonylContact O-C 3.46Å; Y77-A131 VanDerWaalsContact O-CA 3.29Å; Y77-A131 WeakPolarHBondContact O-CA 3.45Å; F127-A131 HydrophobicContact CB-CB 4.37Å; F127-A131 WeakPolarHBondContact CB-O 3.1Å; F127-A131 PolarHBondContact N-O 3.05Å; E129-A131 VanDerWaalsContact C-N 3.33Å; E129-A131 PolarHBondContact O-N 3.29Å; A131-T209 HydrophobicContact CB-CG2 3.48Å; A131-T209 VanDerWaalsContact CB-CG2 3.48Å; A131-V212 HydrophobicContact CB-CG2 4.23Å
132V95.4Very high91.8Very high1 Ų124.2 Ų24.21%0.00613%0.128CC..EExtended strand (participates in β ladder)trans-134.9129.9178.8-170.20000109A76 Y77 F83 F125 V126 F134 L145 L146 L149A76-V132 WeakPolarHBondContact CA-O 3.45Å; Y77-V132 PolarHBondContact N-O 2.91Å; Y77-V132 PolarHBondContact O-N 2.96Å; F83-V132 HydrophobicContact CE2-CG2 3.73Å; F83-V132 HydrophobicContact CZ-CG2 3.97Å; F125-V132 CarbonylContact O-C 3.59Å; F125-V132 WeakPolarHBondContact O-CA 3.4Å; V126-V132 HydrophobicContact CG1-CG2 4.42Å; V126-V132 HydrophobicContact CG2-CG1 4.07Å; V126-V132 HydrophobicContact CG2-CG2 4.39Å; V132-F134 HydrophobicContact CB-CE2 3.9Å; V132-F134 HydrophobicContact CB-CZ 4.12Å; V132-F134 HydrophobicContact CG1-CD1 4.45Å; V132-F134 HydrophobicContact CG1-CD2 4.16Å; V132-F134 HydrophobicContact CG1-CE1 3.94Å; V132-F134 HydrophobicContact CG1-CE2 3.55Å; V132-F134 HydrophobicContact CG1-CZ 3.43Å; V132-F134 VanDerWaalsContact CG1-CZ 3.43Å; V132-L145 HydrophobicContact CG1-CD2 4.34Å; V132-L146 HydrophobicContact CG2-CD2 4.42Å; V132-L149 HydrophobicContact CG1-CD1 4.45Å; V132-L149 HydrophobicContact CG2-CD1 3.54Å
133V96.3Very high92Very high0 Ų028.9 Ų28.90%015%0.152CC..EExtended strand (participates in β ladder)trans-117.5120.5177.9-174.40000109.6I74 W75 A76 A124 F125 F127 M208I74-V133 HydrophobicContact CG2-CG1 3.47Å; I74-V133 VanDerWaalsContact CG2-CG1 3.47Å; W75-V133 CarbonylContact O-C 3.56Å; W75-V133 WeakPolarHBondContact O-CA 3.41Å; A76-V133 HydrophobicContact CB-CG2 3.94Å; A124-V133 CarbonylContact C-O 3.57Å; A124-V133 VanDerWaalsContact CA-O 3.28Å; A124-V133 WeakPolarHBondContact CA-O 3.42Å; F125-V133 HydrophobicContact CB-CB 4.49Å; F125-V133 PolarHBondContact N-O 3.32Å; F125-V133 PolarHBondContact O-N 2.94Å; F127-V133 HydrophobicContact CD2-CG2 4.38Å; F127-V133 HydrophobicContact CE2-CB 4.42Å; F127-V133 HydrophobicContact CE2-CG2 3.92Å; V133-M208 HydrophobicContact CG1-SD 4.29Å; V133-M208 HydrophobicContact CG2-CB 4.3Å
134F95.2Very high92Very high1 Ų130.8 Ų30.80%0.00416%0.163CC..EExtended strand (participates in β ladder)trans-102.8131.5-178.2-58.5-89.6000110.1I74 W75 Y77 A124 V132 L137 R142 L145 L146I74-F134 CarbonylContact C-O 3.49Å; I74-F134 WeakPolarHBondContact CA-O 3.48Å; W75-F134 HydrophobicContact CB-CB 4.47Å; W75-F134 PolarHBondContact N-O 2.87Å; W75-F134 PolarHBondContact O-N 3.01Å; Y77-F134 AromaticContact CD2-CD2 3.57Å; Y77-F134 HydrophobicContact CD2-CD2 3.57Å; Y77-F134 AromaticContact CD2-CE2 3.46Å; Y77-F134 HydrophobicContact CD2-CE2 3.46Å; Y77-F134 VanDerWaalsContact CD2-CE2 3.46Å; Y77-F134 AromaticContact CE2-CD2 3.82Å; Y77-F134 HydrophobicContact CE2-CD2 3.82Å; Y77-F134 AromaticContact CE2-CE2 3.97Å; Y77-F134 HydrophobicContact CE2-CE2 3.97Å; Y77-F134 HydrophobicContact CG-CE2 4.36Å; A124-F134 HydrophobicContact CB-CD1 3.88Å; A124-F134 HydrophobicContact CB-CE1 4.23Å; V132-F134 HydrophobicContact CB-CE2 3.9Å; V132-F134 HydrophobicContact CB-CZ 4.12Å; V132-F134 HydrophobicContact CG1-CD1 4.45Å; V132-F134 HydrophobicContact CG1-CD2 4.16Å; V132-F134 HydrophobicContact CG1-CE1 3.94Å; V132-F134 HydrophobicContact CG1-CE2 3.55Å; V132-F134 HydrophobicContact CG1-CZ 3.43Å; V132-F134 VanDerWaalsContact CG1-CZ 3.43Å; F134-L137 HydrophobicContact CB-CB 4.35Å; F134-L137 HydrophobicContact CB-CD1 4.24Å; F134-L137 HydrophobicContact CD1-CD1 3.66Å; F134-L137 HydrophobicContact CG-CD1 4.46Å; F134-R142 HydrophobicContact CB-CG 3.99Å; F134-R142 HydrophobicContact CD1-CB 4.19Å; F134-R142 HydrophobicContact CD1-CG 3.67Å; F134-R142 HydrophobicContact CD2-CB 4.47Å; F134-R142 HydrophobicContact CD2-CG 4.12Å; F134-R142 HydrophobicContact CE1-CB 4.06Å; F134-R142 HydrophobicContact CE1-CG 4.07Å; F134-R142 HydrophobicContact CE2-CB 4.4Å; F134-R142 HydrophobicContact CG-CB 4.37Å; F134-R142 HydrophobicContact CG-CG 3.67Å; F134-R142 HydrophobicContact CZ-CB 4.19Å; F134-R142 HydrophobicContact CZ-CG 4.5Å; F134-L145 HydrophobicContact CD1-CD2 4.28Å; F134-L145 HydrophobicContact CE1-CB 3.91Å; F134-L145 HydrophobicContact CE1-CD2 3.43Å; F134-L145 VanDerWaalsContact CE1-CD2 3.43Å; F134-L145 HydrophobicContact CE1-CG 4.07Å; F134-L145 HydrophobicContact CZ-CB 4.35Å; F134-L145 HydrophobicContact CZ-CD2 4.09Å; F134-L145 HydrophobicContact CZ-CG 4.44Å; F134-L146 HydrophobicContact CE2-CD2 4.18Å; F134-L146 HydrophobicContact CE2-CG 4.28Å; F134-L146 HydrophobicContact CZ-CD2 4.03Å; F134-L146 HydrophobicContact CZ-CG 3.93Å
135W94.4Very high91.8Very high1 Ų130.7 Ų30.70%0.00416%0.162CC..EExtended strand (participates in β ladder)trans-111.6116.6176.3-71.973.5000108.8I74 G122 E123 F125 L137 Y171 L186 L188 K201 V204 S205I74-W135 HydrophobicContact CD1-CD2 4.26Å; I74-W135 HydrophobicContact CD1-CE3 3.84Å; I74-W135 HydrophobicContact CD1-CH2 3.36Å; I74-W135 HydrophobicContact CD1-CZ2 3.8Å; I74-W135 HydrophobicContact CD1-CZ3 3.38Å; I74-W135 HydrophobicContact CG1-CD2 3.88Å; I74-W135 HydrophobicContact CG1-CE3 3.67Å; I74-W135 HydrophobicContact CG1-CH2 4.08Å; I74-W135 HydrophobicContact CG1-CZ2 4.25Å; I74-W135 HydrophobicContact CG1-CZ3 3.78Å; I74-W135 HydrophobicContact CG2-CD2 4.26Å; I74-W135 HydrophobicContact CG2-CG 4.48Å; I74-W135 HydrophobicContact CG2-CZ2 4.3Å; G122-W135 CarbonylContact C-O 3.51Å; G122-W135 WeakPolarHBondContact CA-O 3.48Å; E123-W135 HydrophobicContact CB-CB 4.42Å; E123-W135 PolarHBondContact N-O 2.97Å; E123-W135 WeakPolarHBondContact O-CB 3.46Å; E123-W135 PolarHBondContact O-N 3.47Å; F125-W135 AromaticContact CD2-CD1 3.6Å; F125-W135 AromaticContact CD2-NE1 3.56Å; F125-W135 AromaticContact CE2-CD1 3.65Å; F125-W135 HydrophobicContact CE2-CG 4.46Å; F125-W135 AromaticContact CE2-NE1 3.58Å; W135-L137 PolarHBondContact O-N 3.33Å; W135-L137 VanDerWaalsContact O-N 3.11Å; W135-Y171 HydrophobicContact CE3-CD1 4.13Å; W135-Y171 AromaticContact CE3-CE1 3.89Å; W135-Y171 HydrophobicContact CE3-CE1 3.89Å; W135-Y171 HydrophobicContact CZ3-CD1 4.15Å; W135-Y171 HydrophobicContact CZ3-CD2 4.5Å; W135-Y171 HydrophobicContact CZ3-CE1 4.33Å; W135-Y171 HydrophobicContact CZ3-CG 4.2Å; W135-L186 HydrophobicContact CH2-CD2 3.54Å; W135-L186 HydrophobicContact CZ3-CD2 3.89Å; W135-L188 HydrophobicContact CZ3-CD2 4.26Å; W135-K201 HydrophobicContact CD2-CB 4.29Å; W135-K201 HydrophobicContact CD2-CD 4.01Å; W135-K201 HydrophobicContact CD2-CG 3.98Å; W135-K201 HydrophobicContact CE3-CD 4.02Å; W135-K201 HydrophobicContact CE3-CG 3.84Å; W135-K201 HydrophobicContact CG-CD 4.43Å; W135-K201 HydrophobicContact CH2-CB 3.98Å; W135-K201 HydrophobicContact CH2-CG 3.76Å; W135-K201 VanDerWaalsContact CZ2-CA 3.48Å; W135-K201 HydrophobicContact CZ2-CB 3.68Å; W135-K201 HydrophobicContact CZ2-CG 3.91Å; W135-K201 VanDerWaalsContact CZ2-O 3.29Å; W135-K201 WeakPolarHBondContact CZ2-O 2.95Å; W135-K201 HydrophobicContact CZ3-CB 4.42Å; W135-K201 HydrophobicContact CZ3-CD 4.4Å; W135-K201 HydrophobicContact CZ3-CG 3.72Å; W135-V204 HydrophobicContact CH2-CB 4.27Å; W135-V204 HydrophobicContact CH2-CG1 4.34Å; W135-V204 HydrophobicContact CZ2-CB 4.12Å; W135-V204 HydrophobicContact CZ2-CG1 4.25Å; W135-S205 PolarHBondContact NE1-OG 3.02Å
136D89.8Confident91.7Very high66 Ų6631.7 Ų31.735%0.35317%0.167SC..SBendtrans51.237.3174.1-155.836.2000114.4P72 N73 Y171P72-D136 HydrophobicContact CB-CB 4.12Å; P72-D136 VanDerWaalsContact CB-OD1 3.26Å; P72-D136 WeakPolarHBondContact CB-OD1 3.44Å; N73-D136 PolarHBondContact O-N 3.38Å; D136-Y171 HydrophobicContact CB-CE1 4.48Å; D136-Y171 WeakPolarHBondContact CB-OH 3.45Å
137L89.5Confident91.5Very high12 Ų1234.6 Ų34.66%0.06319%0.188CC..  trans-102.8139.2174.2-74.1167.8000110.5P115 E123 A124 F134 W135 D141 R142P115-L137 HydrophobicContact CG-CD2 4.04Å; E123-L137 WeakPolarHBondContact O-CD1 3.47Å; A124-L137 HydrophobicContact CB-CD1 4.04Å; F134-L137 HydrophobicContact CB-CB 4.35Å; F134-L137 HydrophobicContact CB-CD1 4.24Å; F134-L137 HydrophobicContact CD1-CD1 3.66Å; F134-L137 HydrophobicContact CG-CD1 4.46Å; W135-L137 PolarHBondContact O-N 3.33Å; W135-L137 VanDerWaalsContact O-N 3.11Å; L137-D141 HydrophobicContact CD2-CB 4.39Å; L137-R142 HydrophobicContact CB-CG 4.02Å
138E87.3Confident91.4Very high112 Ų11238.5 Ų38.552%0.52320%0.203SC..  trans-68155.8176.2-63.7-165.4168.200111.3S140 D141 R142E138-S140 VanDerWaalsContact C-N 3.27Å; E138-S140 PolarHBondContact O-N 3.47Å; E138-D141 PolarHBondContact O-N 3.16Å; E138-D141 VanDerWaalsContact O-N 3.13Å; E138-R142 WeakPolarHBondContact O-CG 3.48Å; E138-R142 PolarHBondContact O-N 3.32Å
139E87.4Confident91.4Very high125 Ų12537.4 Ų37.458%0.58419%0.193SC*.Hα-helixtrans-59.7-37.3-176-173.9172.4176.400113D141 R142 L143E139-D141 PolarHBondContact O-N 2.86Å; E139-R142 PolarHBondContact O-N 3.26Å; E139-L143 HydrophobicContact CG-CD1 4.12Å; E139-L143 HydrophobicContact CG-CG 4.43Å; E139-L143 VanDerWaalsContact O-CG 3.3Å; E139-L143 WeakPolarHBondContact O-CG 3.45Å; E139-L143 PolarHBondContact O-N 3.3Å
140S88.4Confident91.6Very high70 Ų7042.1 Ų42.149%0.4921%0.213SC..Hα-helixtrans-57.9-47.2174.747.20000112.1E138 L143 D144E138-S140 VanDerWaalsContact C-N 3.27Å; E138-S140 PolarHBondContact O-N 3.47Å; S140-L143 PolarHBondContact O-N 3.45Å; S140-D144 WeakPolarHBondContact O-CB 3.42Å; S140-D144 PolarHBondContact O-N 3.44Å
141D89.5Confident91.6Very high24 Ų2445.6 Ų45.613%0.12824%0.236CC..Hα-helixtrans-70.7-35.5-177.1-60.4-22.3000111.3L137 E138 E139 D144 L145L137-D141 HydrophobicContact CD2-CB 4.39Å; E138-D141 PolarHBondContact O-N 3.16Å; E138-D141 VanDerWaalsContact O-N 3.13Å; E139-D141 PolarHBondContact O-N 2.86Å; D141-D144 PolarHBondContact O-N 2.92Å; D141-L145 WeakPolarHBondContact O-CB 3.46Å; D141-L145 PolarHBondContact O-N 3.47Å
142R91.1Very high91.6Very high17 Ų1746.3 Ų46.36%0.06424%0.239CC..Hα-helixtrans-62.7-48.6173.7-63.7-173.5-51.1-147.95.2111.1W75 F134 L137 E138 E139 D144 L145 L146W75-R142 VanDerWaalsContact CD2-NH1 3.32Å; W75-R142 VanDerWaalsContact CE2-NH1 3.27Å; F134-R142 HydrophobicContact CB-CG 3.99Å; F134-R142 HydrophobicContact CD1-CB 4.19Å; F134-R142 HydrophobicContact CD1-CG 3.67Å; F134-R142 HydrophobicContact CD2-CB 4.47Å; F134-R142 HydrophobicContact CD2-CG 4.12Å; F134-R142 HydrophobicContact CE1-CB 4.06Å; F134-R142 HydrophobicContact CE1-CG 4.07Å; F134-R142 HydrophobicContact CE2-CB 4.4Å; F134-R142 HydrophobicContact CG-CB 4.37Å; F134-R142 HydrophobicContact CG-CG 3.67Å; F134-R142 HydrophobicContact CZ-CB 4.19Å; F134-R142 HydrophobicContact CZ-CG 4.5Å; L137-R142 HydrophobicContact CB-CG 4.02Å; E138-R142 WeakPolarHBondContact O-CG 3.48Å; E138-R142 PolarHBondContact O-N 3.32Å; E139-R142 PolarHBondContact O-N 3.26Å; R142-D144 VanDerWaalsContact C-N 3.34Å; R142-L145 PolarHBondContact O-N 2.77Å; R142-L146 WeakPolarHBondContact O-CB 3.43Å; R142-L146 VanDerWaalsContact O-CG 3.25Å; R142-L146 WeakPolarHBondContact O-CG 3.25Å; R142-L146 PolarHBondContact O-N 3.37Å
143L91.2Very high91.5Very high97 Ų9748.2 Ų48.251%0.50825%0.248SC..Hα-helixtrans-66.1-37.5179.8-68.8176.1000111.7E139 S140 L146 S147E139-L143 HydrophobicContact CG-CD1 4.12Å; E139-L143 HydrophobicContact CG-CG 4.43Å; E139-L143 VanDerWaalsContact O-CG 3.3Å; E139-L143 WeakPolarHBondContact O-CG 3.45Å; E139-L143 PolarHBondContact O-N 3.3Å; S140-L143 PolarHBondContact O-N 3.45Å; L143-L146 PolarHBondContact O-N 3.42Å; L143-S147 WeakPolarHBondContact O-CB 3.33Å; L143-S147 PolarHBondContact O-N 3.35Å
144D90.9Very high91.4Very high55 Ų5551.5 Ų51.529%0.29426%0.263SS..Hα-helixtrans-60.2-52.3172.9-175.934.7000110.7S140 D141 R142 L146 S147 R148S140-D144 WeakPolarHBondContact O-CB 3.42Å; S140-D144 PolarHBondContact O-N 3.44Å; D141-D144 PolarHBondContact O-N 2.92Å; R142-D144 VanDerWaalsContact C-N 3.34Å; D144-L146 PolarHBondContact O-N 2.92Å; D144-S147 WeakPolarHBondContact O-CB 3.3Å; D144-S147 PolarHBondContact O-N 3.38Å; D144-S147 VanDerWaalsContact O-N 3.1Å; D144-S147 PolarHBondContact O-OG 3.08Å; D144-R148 VanDerWaalsContact CG-NE 3.32Å; D144-R148 WeakPolarHBondContact O-CG 3.49Å; D144-R148 PolarHBondContact O-N 3.05Å; D144-R148 IonicContact OD1-CZ 3.66Å; D144-R148 IonicContact OD1-NE 2.98Å; D144-R148 PolarHBondContact OD1-NE 3.41Å; D144-R148 IonicContact OD1-NH2 2.72Å; D144-R148 PolarHBondContact OD1-NH2 3.46Å; D144-R148 IonicContact OD2-CZ 3.7Å; D144-R148 VanDerWaalsContact OD2-CZ 3.3Å; D144-R148 IonicContact OD2-NE 2.73Å; D144-R148 PolarHBondContact OD2-NE 2.93Å; D144-R148 IonicContact OD2-NH2 3.46Å; D144-R148 PolarHBondContact OD2-NH2 3.05Å
145L91.3Very high91.2Very high0 Ų052.9 Ų52.90%027%0.273CS..Hα-helixtrans-59.9-44.1178.6-176.357.5000112.2F96 F98 L113 A124 V132 F134 D141 R142 S147 R148 L149F96-L145 HydrophobicContact CE1-CD1 3.54Å; F96-L145 HydrophobicContact CZ-CD1 4Å; F98-L145 HydrophobicContact CD2-CD1 3.82Å; F98-L145 HydrophobicContact CE1-CB 4.48Å; F98-L145 HydrophobicContact CE1-CD2 4.34Å; F98-L145 HydrophobicContact CE2-CB 3.91Å; F98-L145 HydrophobicContact CE2-CD1 3.81Å; F98-L145 HydrophobicContact CE2-CG 4.35Å; F98-L145 HydrophobicContact CG-CD1 4.29Å; F98-L145 HydrophobicContact CZ-CB 3.77Å; F98-L145 HydrophobicContact CZ-CD1 4.25Å; F98-L145 HydrophobicContact CZ-CD2 4.43Å; F98-L145 HydrophobicContact CZ-CG 4.35Å; L113-L145 HydrophobicContact CD1-CD1 4.14Å; L113-L145 HydrophobicContact CD1-CD2 4.35Å; A124-L145 HydrophobicContact CB-CD2 3.62Å; V132-L145 HydrophobicContact CG1-CD2 4.34Å; F134-L145 HydrophobicContact CD1-CD2 4.28Å; F134-L145 HydrophobicContact CE1-CB 3.91Å; F134-L145 HydrophobicContact CE1-CD2 3.43Å; F134-L145 VanDerWaalsContact CE1-CD2 3.43Å; F134-L145 HydrophobicContact CE1-CG 4.07Å; F134-L145 HydrophobicContact CZ-CB 4.35Å; F134-L145 HydrophobicContact CZ-CD2 4.09Å; F134-L145 HydrophobicContact CZ-CG 4.44Å; D141-L145 WeakPolarHBondContact O-CB 3.46Å; D141-L145 PolarHBondContact O-N 3.47Å; R142-L145 PolarHBondContact O-N 2.77Å; L145-S147 VanDerWaalsContact C-N 3.28Å; L145-S147 PolarHBondContact O-N 2.99Å; L145-R148 PolarHBondContact O-N 3.36Å; L145-L149 HydrophobicContact CD1-CD1 4.27Å; L145-L149 HydrophobicContact CD1-CG 4.22Å; L145-L149 HydrophobicContact CG-CD1 3.99Å; L145-L149 HydrophobicContact CG-CG 4.39Å; L145-L149 WeakPolarHBondContact O-CG 3.44Å; L145-L149 PolarHBondContact O-N 3.1Å
146L92.4Very high91.2Very high20 Ų2055.9 Ų55.911%0.10529%0.292CS..Hα-helixtrans-60-40176.4-70.9173000111.5Y77 T79 V132 F134 R142 L143 D144 R148 L149 K150Y77-L146 HydrophobicContact CD1-CD1 4.29Å; Y77-L146 HydrophobicContact CG-CD1 4.24Å; T79-L146 HydrophobicContact CG2-CD2 3.88Å; V132-L146 HydrophobicContact CG2-CD2 4.42Å; F134-L146 HydrophobicContact CE2-CD2 4.18Å; F134-L146 HydrophobicContact CE2-CG 4.28Å; F134-L146 HydrophobicContact CZ-CD2 4.03Å; F134-L146 HydrophobicContact CZ-CG 3.93Å; R142-L146 WeakPolarHBondContact O-CB 3.43Å; R142-L146 VanDerWaalsContact O-CG 3.25Å; R142-L146 WeakPolarHBondContact O-CG 3.25Å; R142-L146 PolarHBondContact O-N 3.37Å; L143-L146 PolarHBondContact O-N 3.42Å; D144-L146 PolarHBondContact O-N 2.92Å; L146-R148 VanDerWaalsContact C-N 3.33Å; L146-R148 PolarHBondContact O-N 3.24Å; L146-L149 PolarHBondContact O-N 2.98Å; L146-K150 PolarHBondContact O-N 3.46Å
147S91.5Very high91.3Very high61 Ų6154 Ų5443%0.42728%0.281SS..Hα-helixtrans-64.7-37.7177.381.80000112.5L143 D144 L145L143-S147 WeakPolarHBondContact O-CB 3.33Å; L143-S147 PolarHBondContact O-N 3.35Å; D144-S147 WeakPolarHBondContact O-CB 3.3Å; D144-S147 PolarHBondContact O-N 3.38Å; D144-S147 VanDerWaalsContact O-N 3.1Å; D144-S147 PolarHBondContact O-OG 3.08Å; L145-S147 VanDerWaalsContact C-N 3.28Å; L145-S147 PolarHBondContact O-N 2.99Å
148R90.6Very high91.4Very high83 Ų8356.6 Ų56.631%0.31329%0.292SS..Hα-helixtrans-72.6-26.1176.9-66.2177.4-168.4-129.24.3113.1F96 D144 L145 L146 P151 F152F96-R148 HydrophobicContact CE2-CB 3.94Å; F96-R148 HydrophobicContact CZ-CB 3.82Å; F96-R148 PolarHBondContact O-NH1 2.94Å; D144-R148 VanDerWaalsContact CG-NE 3.32Å; D144-R148 WeakPolarHBondContact O-CG 3.49Å; D144-R148 PolarHBondContact O-N 3.05Å; D144-R148 IonicContact OD1-CZ 3.66Å; D144-R148 IonicContact OD1-NE 2.98Å; D144-R148 PolarHBondContact OD1-NE 3.41Å; D144-R148 IonicContact OD1-NH2 2.72Å; D144-R148 PolarHBondContact OD1-NH2 3.46Å; D144-R148 IonicContact OD2-CZ 3.7Å; D144-R148 VanDerWaalsContact OD2-CZ 3.3Å; D144-R148 IonicContact OD2-NE 2.73Å; D144-R148 PolarHBondContact OD2-NE 2.93Å; D144-R148 IonicContact OD2-NH2 3.46Å; D144-R148 PolarHBondContact OD2-NH2 3.05Å; L145-R148 PolarHBondContact O-N 3.36Å; L146-R148 VanDerWaalsContact C-N 3.33Å; L146-R148 PolarHBondContact O-N 3.24Å; R148-P151 WeakPolarHBondContact O-CD 3.5Å; R148-F152 WeakPolarHBondContact O-CE2 3.4Å
149L92.6Very high91.4Very high0 Ų055.9 Ų55.90%030%0.296CS..Hα-helixtrans-79.6-21.1178.5-72.4173.5000113.6F83 L88 F96 V126 V132 L145 L146 F152F83-L149 HydrophobicContact CE1-CB 4.17Å; F83-L149 HydrophobicContact CZ-CB 4.41Å; F83-L149 HydrophobicContact CZ-CD1 4.37Å; L88-L149 HydrophobicContact CD1-CD2 3.72Å; L88-L149 HydrophobicContact CD2-CD2 3.84Å; L88-L149 HydrophobicContact CG-CD2 4.47Å; F96-L149 HydrophobicContact CZ-CD2 4.24Å; V126-L149 HydrophobicContact CG1-CD1 4.42Å; V126-L149 HydrophobicContact CG1-CD2 4.36Å; V126-L149 HydrophobicContact CG2-CD1 4.08Å; V132-L149 HydrophobicContact CG1-CD1 4.45Å; V132-L149 HydrophobicContact CG2-CD1 3.54Å; L145-L149 HydrophobicContact CD1-CD1 4.27Å; L145-L149 HydrophobicContact CD1-CG 4.22Å; L145-L149 HydrophobicContact CG-CD1 3.99Å; L145-L149 HydrophobicContact CG-CG 4.39Å; L145-L149 WeakPolarHBondContact O-CG 3.44Å; L145-L149 PolarHBondContact O-N 3.1Å; L146-L149 PolarHBondContact O-N 2.98Å; L149-F152 PolarHBondContact O-N 3.29Å
150K92.4Very high91.5Very high138 Ų13857.5 Ų57.560%0.630%0.301SS*.G310 helixtrans-48.1-43.4179.8-70.4-173.4177.4-178.40115.4L146 F152 E153L146-K150 PolarHBondContact O-N 3.46Å; K150-F152 PolarHBondContact O-N 3.48Å; K150-F152 VanDerWaalsContact O-N 3.15Å; K150-E153 WeakPolarHBondContact O-CB 3.46Å; K150-E153 PolarHBondContact O-N 3.03Å
151P92.2Very high91.4Very high74 Ų7454.3 Ų54.348%0.48128%0.278SS..G310 helixtrans-66.9-12.8-179.8-20.334.6000114.7R87 R148R87-P151 PolarHBondContact NH1-O 3.25Å; R87-P151 VanDerWaalsContact NH1-O 3.09Å; R148-P151 WeakPolarHBondContact O-CD 3.5Å
152F93.5Very high91.2Very high15 Ų1554 Ų547%0.06628%0.279CS..G310 helixtrans-104.4-0.4-177.3-52.3-84.1000113.1N84 R87 L88 C91 F96 R148 L149 K150N84-F152 PolarHBondContact N-O 2.8Å; R87-F152 HydrophobicContact CB-CD1 4.07Å; R87-F152 HydrophobicContact CB-CE1 4.39Å; R87-F152 HydrophobicContact CG-CD1 3.9Å; R87-F152 HydrophobicContact CG-CE1 3.87Å; L88-F152 HydrophobicContact CB-CD1 4.1Å; L88-F152 HydrophobicContact CB-CG 4.33Å; L88-F152 HydrophobicContact CD1-CD1 4.36Å; L88-F152 HydrophobicContact CD1-CD2 3.93Å; L88-F152 HydrophobicContact CD1-CE1 4.46Å; L88-F152 HydrophobicContact CD1-CE2 4.04Å; L88-F152 HydrophobicContact CD1-CG 4.1Å; L88-F152 HydrophobicContact CD1-CZ 4.31Å; C91-F152 HydrophobicContact CB-CE1 3.82Å; C91-F152 HydrophobicContact CB-CZ 3.59Å; F96-F152 HydrophobicContact CE2-CE2 4.19Å; R148-F152 WeakPolarHBondContact O-CE2 3.4Å; L149-F152 PolarHBondContact O-N 3.29Å; K150-F152 PolarHBondContact O-N 3.48Å; K150-F152 VanDerWaalsContact O-N 3.15Å
153E94.7Very high90.9Very high42 Ų4259.9 Ų59.920%0.19631%0.307CS..EExtended strand (participates in β ladder)trans-71.3128.1179-72.1174.9-179.300111.7T79 A80 F83 K150 P156T79-E153 WeakPolarHBondContact CB-OE1 3.37Å; T79-E153 PolarHBondContact OG1-OE1 3.36Å; A80-E153 HydrophobicContact CB-CB 3.72Å; A80-E153 HydrophobicContact CB-CG 3.75Å; F83-E153 HydrophobicContact CD1-CG 4.01Å; F83-E153 HydrophobicContact CE1-CG 3.5Å; K150-E153 WeakPolarHBondContact O-CB 3.46Å; K150-E153 PolarHBondContact O-N 3.03Å; E153-P156 HydrophobicContact CB-CB 4.36Å
154E93.2Very high90.4Very high69 Ų6957.9 Ų57.932%0.32230%0.302SS..EExtended strand (participates in β ladder)trans-105122.6168.9-64.9-173.7173.500108.9E81 S82 N84E81-E154 PolarHBondContact N-O 3.08Å; S82-E154 PolarHBondContact N-O 3.44Å; S82-E154 PolarHBondContact O-N 3.03Å; S82-E154 WeakPolarHBondContact OG-CB 3.43Å; S82-E154 PolarHBondContact OG-OE2 3.06Å; N84-E154 HydrophobicContact CB-CG 4.32Å; N84-E154 WeakPolarHBondContact CB-OE1 3.47Å; N84-E154 PolarHBondContact ND2-OE1 2.97Å
155S91.1Very high90.2Very high29 Ų2955.3 Ų55.320%0.20329%0.288CS..EExtended strand (participates in β ladder)trans54.767.3-175-67.50000112.4E81E81-S155 PolarHBondContact N-O 3.38Å; E81-S155 VanDerWaalsContact N-O 3.17Å
156P94.3Very high90.2Very high65 Ų6557.2 Ų57.242%0.42230%0.299SS..EExtended strand (participates in β ladder)trans-62.8146.6178.828.1-35.5000111.6E153E153-P156 HydrophobicContact CB-CB 4.36Å
157Y91.9Very high90.1Very high27 Ų2756.3 Ų56.311%0.10630%0.295CS..PPolyproline II helixtrans-78.6163.4172.7-56.5-55000111.6T78 T79 A80 E81 K213 V216T78-Y157 HydrophobicContact CG2-CE2 4.47Å; T79-Y157 WeakPolarHBondContact O-CD2 3.33Å; T79-Y157 PolarHBondContact O-N 3.09Å; A80-Y157 VanDerWaalsContact C-CZ 3.41Å; A80-Y157 WeakPolarHBondContact O-CE2 3.32Å; A80-Y157 VanDerWaalsContact O-CZ 3.3Å; A80-Y157 PolarHBondContact O-OH 2.98Å; E81-Y157 VanDerWaalsContact CA-OH 3.25Å; E81-Y157 WeakPolarHBondContact CA-OH 3.41Å; E81-Y157 HydrophobicContact CG-CE1 3.51Å; E81-Y157 WeakPolarHBondContact CG-OH 3.26Å; E81-Y157 PolarHBondContact N-OH 2.58Å; Y157-K213 WeakPolarHBondContact OH-CE 3.44Å; Y157-K213 PolarHBondContact OH-NZ 3.03Å; Y157-V216 HydrophobicContact CD1-CG1 3.82Å; Y157-V216 HydrophobicContact CD2-CG1 4.1Å; Y157-V216 HydrophobicContact CD2-CG2 4.15Å; Y157-V216 HydrophobicContact CE1-CG1 3.7Å; Y157-V216 HydrophobicContact CE2-CG1 3.98Å; Y157-V216 HydrophobicContact CE2-CG2 4.09Å; Y157-V216 HydrophobicContact CG-CG1 4.04Å
158E91.3Very high90.2Very high65 Ų6557.1 Ų57.130%0.30429%0.294SS..PPolyproline II helixtrans-63.3137.4167.1-60.5-169-173.700110.2K160 I161 A162E158-K160 PolarHBondContact O-N 3.44Å; E158-K160 VanDerWaalsContact O-N 3.12Å; E158-I161 HydrophobicContact CB-CD1 4.18Å; E158-I161 HydrophobicContact CB-CG1 4.24Å; E158-I161 WeakPolarHBondContact O-CB 3.45Å; E158-I161 PolarHBondContact O-N 3.3Å; E158-A162 PolarHBondContact O-N 3.41Å
159T88.3Confident90.2Very high98 Ų9853.4 Ų53.460%0.60128%0.28SS*.Hα-helixtrans-51.9-40.8-176.2-47.10000112.6I161 A162 E163T159-I161 VanDerWaalsContact C-N 3.3Å; T159-I161 PolarHBondContact O-N 2.8Å; T159-A162 PolarHBondContact O-N 2.87Å; T159-E163 HydrophobicContact CG2-CG 4.28Å; T159-E163 WeakPolarHBondContact CG2-OE1 3.18Å; T159-E163 WeakPolarHBondContact O-CB 3.42Å; T159-E163 VanDerWaalsContact O-CG 3.31Å; T159-E163 WeakPolarHBondContact O-CG 3.35Å; T159-E163 PolarHBondContact O-N 2.82Å
160K88Confident90.1Very high159 Ų15954.7 Ų54.769%0.69129%0.289SS*.Hα-helixtrans-61.8-37.4179.2-65.1-178.6179.1179.80112.8E158 S164E158-K160 PolarHBondContact O-N 3.44Å; E158-K160 VanDerWaalsContact O-N 3.12Å; K160-S164 WeakPolarHBondContact O-CB 3.07Å; K160-S164 PolarHBondContact O-N 3.3Å
161I87.3Confident90Very high3 Ų348.7 Ų48.72%0.01526%0.263CS..Hα-helixtrans-74.8-45.2180-58.7178.5000109.1E158 T159 E163 S164 A165 V216 T219 L220E158-I161 HydrophobicContact CB-CD1 4.18Å; E158-I161 HydrophobicContact CB-CG1 4.24Å; E158-I161 WeakPolarHBondContact O-CB 3.45Å; E158-I161 PolarHBondContact O-N 3.3Å; T159-I161 VanDerWaalsContact C-N 3.3Å; T159-I161 PolarHBondContact O-N 2.8Å; I161-E163 PolarHBondContact O-N 3.31Å; I161-S164 PolarHBondContact O-N 2.88Å; I161-S164 PolarHBondContact O-OG 3.35Å; I161-A165 WeakPolarHBondContact O-CB 3.5Å; I161-A165 PolarHBondContact O-N 2.96Å; I161-A165 VanDerWaalsContact O-N 3.15Å; I161-V216 HydrophobicContact CG2-CB 4.31Å; I161-V216 HydrophobicContact CG2-CG1 3.84Å; I161-V216 HydrophobicContact CG2-CG2 4.26Å; I161-T219 HydrophobicContact CG1-CG2 4.16Å; I161-T219 HydrophobicContact CG2-CG2 4.1Å; I161-L220 HydrophobicContact CD1-CD2 3.55Å; I161-L220 HydrophobicContact CD1-CG 4.29Å
162A85Confident89.9Confident18 Ų1847 Ų4715%0.14925%0.25CC..Hα-helixtrans-60-45177.600000112.3E158 T159 S164 A165E158-A162 PolarHBondContact O-N 3.41Å; T159-A162 PolarHBondContact O-N 2.87Å; A162-S164 VanDerWaalsContact C-N 3.28Å; A162-S164 PolarHBondContact O-N 3.29Å; A162-A165 PolarHBondContact O-N 3.3Å; A162-A165 VanDerWaalsContact O-N 3.1Å
163E85.2Confident89.7Confident139 Ų13950 Ų5065%0.6527%0.266SS*.Hα-helixtrans-65.5-30.1177.2-73.5173.6177.100112.9T159 I161 A165T159-E163 HydrophobicContact CG2-CG 4.28Å; T159-E163 WeakPolarHBondContact CG2-OE1 3.18Å; T159-E163 WeakPolarHBondContact O-CB 3.42Å; T159-E163 VanDerWaalsContact O-CG 3.31Å; T159-E163 WeakPolarHBondContact O-CG 3.35Å; T159-E163 PolarHBondContact O-N 2.82Å; I161-E163 PolarHBondContact O-N 3.31Å; E163-A165 VanDerWaalsContact C-N 3.3Å
164S80.1Confident89.1Confident56 Ų5649 Ų4939%0.39226%0.262SS..Hα-helixtrans-75.1-21.3174.677.70000113.2K160 I161 A162 V166K160-S164 WeakPolarHBondContact O-CB 3.07Å; K160-S164 PolarHBondContact O-N 3.3Å; I161-S164 PolarHBondContact O-N 2.88Å; I161-S164 PolarHBondContact O-OG 3.35Å; A162-S164 VanDerWaalsContact C-N 3.28Å; A162-S164 PolarHBondContact O-N 3.29Å; S164-V166 PolarHBondContact O-N 3.46Å
165A87.2Confident88.6Confident0 Ų050.3 Ų50.30%029%0.285CS..  trans-9962.6-173.300000111.7T78 I161 A162 E163 V216T78-A165 HydrophobicContact CG2-CB 3.84Å; I161-A165 WeakPolarHBondContact O-CB 3.5Å; I161-A165 PolarHBondContact O-N 2.96Å; I161-A165 VanDerWaalsContact O-N 3.15Å; A162-A165 PolarHBondContact O-N 3.3Å; A162-A165 VanDerWaalsContact O-N 3.1Å; E163-A165 VanDerWaalsContact C-N 3.3Å; A165-V216 HydrophobicContact CB-CG2 3.43Å; A165-V216 VanDerWaalsContact CB-CG2 3.43Å
166V90.8Very high88.3Confident40 Ų4054.4 Ų54.424%0.24230%0.302CS..EExtended strand (participates in β ladder)trans-119.2134.5177.6-176.40000109.3W75 Y77 S164W75-V166 HydrophobicContact CE3-CG1 3.73Å; W75-V166 HydrophobicContact CZ3-CG1 3.93Å; Y77-V166 HydrophobicContact CD1-CB 4.45Å; Y77-V166 HydrophobicContact CD1-CG1 4.13Å; Y77-V166 HydrophobicContact CD1-CG2 3.57Å; Y77-V166 HydrophobicContact CE1-CB 4.33Å; Y77-V166 HydrophobicContact CE1-CG1 3.72Å; Y77-V166 HydrophobicContact CE1-CG2 3.57Å; S164-V166 PolarHBondContact O-N 3.46Å
167D91.6Very high87.7Confident1 Ų155.4 Ų55.41%0.00531%0.309CS..EExtended strand (participates in β ladder)trans-126.7147.3172.5-88.9-52.4000110.3S56 R58 A76 S211 V212S56-D167 PolarHBondContact OG-OD1 2.92Å; R58-D167 IonicContact CZ-OD1 2.75Å; R58-D167 IonicContact NH2-OD1 3.15Å; R58-D167 PolarHBondContact NH2-OD1 3.09Å; R58-D167 IonicContact NH2-OD2 2.77Å; A76-D167 PolarHBondContact N-O 2.7Å; A76-D167 PolarHBondContact O-N 3.41Å; D167-S211 VanDerWaalsContact OD2-CB 3.27Å; D167-S211 WeakPolarHBondContact OD2-CB 3.3Å; D167-S211 PolarHBondContact OD2-OG 3.49Å; D167-V212 HydrophobicContact CB-CG1 3.76Å
168N91.8Very high87.5Confident79 Ų7961.3 Ų61.342%0.42233%0.331SS..EExtended strand (participates in β ladder)trans-127158.6177.568.2-46.5000111.8R58 I74 W75R58-N168 PolarHBondContact NH1-O 3.44Å; I74-N168 CarbonylContact O-C 3.5Å; I74-N168 VanDerWaalsContact O-CA 3.24Å; I74-N168 WeakPolarHBondContact O-CA 3.38Å; W75-N168 HydrophobicContact CD2-CB 4.18Å; W75-N168 HydrophobicContact CE3-CB 4.12Å; W75-N168 HydrophobicContact CH2-CB 4.45Å; W75-N168 HydrophobicContact CZ2-CB 4.5Å; W75-N168 HydrophobicContact CZ3-CB 4.25Å
169L91.8Very high87.5Confident4 Ų459.1 Ų59.12%0.02132%0.323CS..EExtended strand (participates in β ladder)trans-149143174.418067.9000108.7I74 F181 E184 L186 V204 M208 L290 F291I74-L169 HydrophobicContact CB-CB 4.25Å; I74-L169 HydrophobicContact CD1-CB 4.21Å; I74-L169 HydrophobicContact CD1-CD2 3.83Å; I74-L169 HydrophobicContact CD1-CG 4.11Å; I74-L169 PolarHBondContact N-O 3.33Å; I74-L169 PolarHBondContact O-N 2.79Å; L169-F181 HydrophobicContact CD1-CE1 4.27Å; L169-F181 HydrophobicContact CD2-CE1 3.81Å; L169-F181 HydrophobicContact CD2-CZ 4.23Å; L169-E184 WeakPolarHBondContact CD1-O 3.3Å; L169-L186 HydrophobicContact CD2-CB 4.33Å; L169-V204 HydrophobicContact CD2-CG1 3.57Å; L169-M208 HydrophobicContact CB-CE 3.98Å; L169-M208 HydrophobicContact CB-SD 4.07Å; L169-M208 HydrophobicContact CD2-SD 4.29Å; L169-L290 HydrophobicContact CD1-CD2 3.98Å; L169-F291 HydrophobicContact CD2-CZ 4.34Å
170S90.2Very high87.6Confident27 Ų2757.4 Ų57.419%0.18931%0.308CS..EExtended strand (participates in β ladder)trans-99.5147174.166.10000110.4L185 L186S170-L185 WeakPolarHBondContact OG-CD1 3.37Å; S170-L186 PolarHBondContact O-N 2.92Å; S170-L186 VanDerWaalsContact O-N 3.09Å
171Y91.2Very high87.7Confident13 Ų1351 Ų515%0.05128%0.28CS..EExtended strand (participates in β ladder)trans-134.4160.3172.678.6-82.2000112.1P72 I74 W135 D136 L186 L188P72-Y171 HydrophobicContact CB-CD1 4.1Å; P72-Y171 HydrophobicContact CB-CE1 3.44Å; P72-Y171 VanDerWaalsContact CB-CE1 3.44Å; P72-Y171 HydrophobicContact CB-CE2 4.24Å; P72-Y171 VanDerWaalsContact CD-O 3.22Å; P72-Y171 WeakPolarHBondContact CD-O 3.25Å; P72-Y171 HydrophobicContact CG-CD1 3.91Å; P72-Y171 HydrophobicContact CG-CD2 3.99Å; P72-Y171 HydrophobicContact CG-CE1 3.6Å; P72-Y171 HydrophobicContact CG-CE2 3.63Å; P72-Y171 HydrophobicContact CG-CG 4.12Å; P72-Y171 VanDerWaalsContact CG-CZ 3.43Å; P72-Y171 VanDerWaalsContact CG-O 3.32Å; P72-Y171 WeakPolarHBondContact CG-O 3.5Å; P72-Y171 WeakPolarHBondContact O-CD1 3.48Å; P72-Y171 PolarHBondContact O-N 2.88Å; P72-Y171 VanDerWaalsContact O-N 3.12Å; I74-Y171 HydrophobicContact CD1-CD1 3.93Å; I74-Y171 HydrophobicContact CD1-CG 4.39Å; I74-Y171 HydrophobicContact CG1-CD1 3.65Å; I74-Y171 HydrophobicContact CG1-CE1 4.13Å; W135-Y171 HydrophobicContact CE3-CD1 4.13Å; W135-Y171 AromaticContact CE3-CE1 3.89Å; W135-Y171 HydrophobicContact CE3-CE1 3.89Å; W135-Y171 HydrophobicContact CZ3-CD1 4.15Å; W135-Y171 HydrophobicContact CZ3-CD2 4.5Å; W135-Y171 HydrophobicContact CZ3-CE1 4.33Å; W135-Y171 HydrophobicContact CZ3-CG 4.2Å; D136-Y171 HydrophobicContact CB-CE1 4.48Å; D136-Y171 WeakPolarHBondContact CB-OH 3.45Å; Y171-L186 CarbonylContact C-O 3.55Å; Y171-L186 WeakPolarHBondContact CA-O 3.47Å; Y171-L186 WeakPolarHBondContact CB-O 3.37Å; Y171-L188 HydrophobicContact CD2-CB 4.15Å; Y171-L188 HydrophobicContact CD2-CD2 4.12Å; Y171-L188 HydrophobicContact CE2-CD2 4.11Å
172I90.2Very high87.6Confident38 Ų3856.7 Ų56.720%0.19530%0.302CS..EExtended strand (participates in β ladder)trans-138.5148.1170.3-63.8173.3000107.3V66 I69 K71 N174 L185 L186 L187 L188V66-I172 HydrophobicContact CG1-CD1 3.87Å; I69-I172 HydrophobicContact CD1-CD1 4.5Å; K71-I172 HydrophobicContact CD-CD1 4.11Å; K71-I172 HydrophobicContact CD-CG1 4.32Å; K71-I172 HydrophobicContact CG-CD1 4.04Å; K71-I172 HydrophobicContact CG-CG1 4.05Å; I172-N174 PolarHBondContact O-N 2.91Å; I172-L185 HydrophobicContact CD1-CD1 4.23Å; I172-L185 HydrophobicContact CD1-CD2 3.9Å; I172-L185 HydrophobicContact CG1-CD1 4.07Å; I172-L185 HydrophobicContact CG1-CD2 4.45Å; I172-L186 PolarHBondContact N-O 3.33Å; I172-L187 WeakPolarHBondContact O-CA 3.32Å; I172-L188 PolarHBondContact O-N 3.01Å
173D88.7Confident87.5Confident77 Ų7759.4 Ų59.441%0.41232%0.319SS..EExtended strand (participates in β ladder)trans-68.7124.5171.9-70.4-22.2000110.7R197D173-R197 IonicContact OD1-CZ 3.79Å; D173-R197 IonicContact OD1-NH2 2.68Å; D173-R197 PolarHBondContact OD1-NH2 3.47Å; D173-R197 IonicContact OD2-NH2 3.14Å; D173-R197 PolarHBondContact OD2-NH2 3.05Å; D173-R197 VanDerWaalsContact OD2-NH2 3.14Å
174N82.5Confident87.5Confident22 Ų2254.9 Ų54.912%0.11830%0.297CS..  trans-79.5150.9178.9-158.1-3.6000110.2I172 M176 R178 L187 L188 P190I172-N174 PolarHBondContact O-N 2.91Å; N174-M176 VanDerWaalsContact C-N 3.33Å; N174-M176 PolarHBondContact OD1-N 3Å; N174-R178 PolarHBondContact ND2-O 3.47Å; N174-R178 VanDerWaalsContact ND2-O 3.07Å; N174-L187 HydrophobicContact CB-CB 3.9Å; N174-L188 WeakPolarHBondContact CA-O 3.47Å; N174-L188 WeakPolarHBondContact CB-O 3.36Å; N174-L188 PolarHBondContact N-O 3.41Å; N174-P190 WeakPolarHBondContact O-CD 3.32Å
175A83.1Confident87.9Confident97 Ų9752.9 Ų52.980%0.80228%0.282SS*.SBendtrans-78.7-22.5168.400000112
176M83.6Confident88.1Confident114 Ų11452.9 Ų52.956%0.56228%0.282SS*.SBendtrans-84.7151.5-177-60.9-64.1-74.500111.8N174 R178 P190N174-M176 VanDerWaalsContact C-N 3.33Å; N174-M176 PolarHBondContact OD1-N 3Å; M176-R178 PolarHBondContact O-N 3.35Å; M176-P190 WeakPolarHBondContact O-CD 3.3Å
177P82.6Confident88.2Confident86 Ų8652.2 Ų52.256%0.55828%0.277SS*.SBendtrans-71.86.5-179.631.6-37.7000114.1R189P177-R189 WeakPolarHBondContact O-CD 3.49Å; P177-R189 WeakPolarHBondContact O-CG 3.26Å; P177-R189 PolarHBondContact O-NE 3.43Å
178R87.5Confident88.2Confident152 Ų15252.2 Ų52.257%0.57428%0.277SS*.SBendtrans-127140.1-176.8-73-178.9168.9168.3-2.7110.9N174 M176 E279N174-R178 PolarHBondContact ND2-O 3.47Å; N174-R178 VanDerWaalsContact ND2-O 3.07Å; M176-R178 PolarHBondContact O-N 3.35Å; R178-E279 IonicContact CZ-OE1 3.15Å; R178-E279 IonicContact NE-OE1 3.13Å; R178-E279 PolarHBondContact NE-OE1 2.94Å; R178-E279 IonicContact NH2-OE1 2.63Å; R178-E279 PolarHBondContact NH2-OE1 3.48Å
179S91.4Very high88.2Confident19 Ų1949.5 Ų49.513%0.13326%0.261CS..  trans-81.1134.3172.3-60.20000110.1L187 R189 D200S179-L187 CarbonylContact C-O 3.58Å; S179-L187 WeakPolarHBondContact CA-O 3.35Å; S179-R189 PolarHBondContact OG-N 3.2Å; S179-D200 VanDerWaalsContact CB-OD2 3.27Å; S179-D200 WeakPolarHBondContact CB-OD2 3.45Å; S179-D200 PolarHBondContact OG-OD2 3.19Å
180E90.8Very high88Confident61 Ų6151.2 Ų51.229%0.28527%0.272SS..EExtended strand (participates in β ladder)trans-149.3152.3-178.860.5-179.7179.200111.3R182 L187E180-R182 IonicContact OE1-CZ 3.77Å; E180-R182 IonicContact OE1-NH1 3.41Å; E180-R182 PolarHBondContact OE1-NH1 3.01Å; E180-R182 IonicContact OE1-NH2 3.48Å; E180-R182 PolarHBondContact OE1-NH2 3.46Å; E180-R182 IonicContact OE2-CZ 2.72Å; E180-R182 IonicContact OE2-NH1 3.96Å; E180-R182 PolarHBondContact OE2-NH1 3.28Å; E180-R182 IonicContact OE2-NH2 2.84Å; E180-L187 HydrophobicContact CG-CB 4.03Å; E180-L187 HydrophobicContact CG-CD1 4.06Å; E180-L187 HydrophobicContact CG-CG 4.49Å; E180-L187 PolarHBondContact N-O 2.92Å; E180-L187 WeakPolarHBondContact O-CB 3.33Å; E180-L187 PolarHBondContact O-N 3.15Å
181F89.7Confident87.5Confident25 Ų2553.9 Ų53.911%0.1129%0.289CS..EExtended strand (participates in β ladder)trans-91.9133.3172.1-75.5-87.2000110.6L169 L185 L186 V204 L283 V286 A287 L290L169-F181 HydrophobicContact CD1-CE1 4.27Å; L169-F181 HydrophobicContact CD2-CE1 3.81Å; L169-F181 HydrophobicContact CD2-CZ 4.23Å; F181-L185 WeakPolarHBondContact CA-O 3.39Å; F181-L186 HydrophobicContact CD1-CB 4.28Å; F181-L186 HydrophobicContact CD1-CD1 4.41Å; F181-L186 HydrophobicContact CD2-CD1 4.35Å; F181-L186 HydrophobicContact CE1-CB 3.94Å; F181-L186 HydrophobicContact CE1-CD1 4.1Å; F181-L186 HydrophobicContact CE2-CD1 4.02Å; F181-L186 HydrophobicContact CZ-CB 4.46Å; F181-L186 HydrophobicContact CZ-CD1 3.89Å; F181-V204 HydrophobicContact CE2-CG2 4.08Å; F181-V204 HydrophobicContact CZ-CG1 4.18Å; F181-V204 HydrophobicContact CZ-CG2 3.81Å; F181-L283 HydrophobicContact CD2-CD1 3.77Å; F181-L283 HydrophobicContact CE2-CD1 3.58Å; F181-L283 HydrophobicContact CE2-CG 4.26Å; F181-V286 HydrophobicContact CB-CG1 3.67Å; F181-V286 HydrophobicContact CD2-CB 4.04Å; F181-V286 HydrophobicContact CD2-CG1 3.64Å; F181-V286 HydrophobicContact CG-CG1 3.89Å; F181-A287 HydrophobicContact CE2-CB 3.74Å; F181-A287 HydrophobicContact CZ-CB 3.76Å; F181-L290 HydrophobicContact CD1-CD2 3.83Å; F181-L290 HydrophobicContact CE1-CD2 3.72Å
182R85.4Confident86.9Confident123 Ų12356.5 Ų56.546%0.46432%0.32SS..EExtended strand (participates in β ladder)trans-112.899.7164.4-72.2-71.2-164-81.5-17.1107.8E180 E184 L185 L187E180-R182 IonicContact OE1-CZ 3.77Å; E180-R182 IonicContact OE1-NH1 3.41Å; E180-R182 PolarHBondContact OE1-NH1 3.01Å; E180-R182 IonicContact OE1-NH2 3.48Å; E180-R182 PolarHBondContact OE1-NH2 3.46Å; E180-R182 IonicContact OE2-CZ 2.72Å; E180-R182 IonicContact OE2-NH1 3.96Å; E180-R182 PolarHBondContact OE2-NH1 3.28Å; E180-R182 IonicContact OE2-NH2 2.84Å; R182-E184 PolarHBondContact O-N 3.25Å; R182-E184 VanDerWaalsContact O-N 3.09Å; R182-L185 PolarHBondContact N-O 3.49Å; R182-L185 WeakPolarHBondContact O-CB 3.34Å; R182-L185 PolarHBondContact O-N 2.94Å; R182-L187 HydrophobicContact CG-CD1 3.55Å; R182-L187 HydrophobicContact CG-CG 4.12Å
183C83Confident86.5Confident75 Ų7557 Ų5751%0.50733%0.325SS..THydrogen-bonded Turntrans54.6-114.2-171.6-55.80000110.3L290C183-L290 WeakPolarHBondContact O-CD1 3.41Å
184E84.6Confident86.4Confident43 Ų4357.8 Ų57.820%0.20133%0.326CS..THydrogen-bonded Turntrans-98.27.9-179.2-54.2-171.8127.600113.6S60 Y61 L169 R182 L290S60-E184 VanDerWaalsContact CA-OE2 3.25Å; S60-E184 WeakPolarHBondContact CA-OE2 3.45Å; Y61-E184 PolarHBondContact N-OE2 3.36Å; L169-E184 WeakPolarHBondContact CD1-O 3.3Å; R182-E184 PolarHBondContact O-N 3.25Å; R182-E184 VanDerWaalsContact O-N 3.09Å; E184-L290 HydrophobicContact CG-CD1 4.18Å
185L88.7Confident86.6Confident15 Ų1561.5 Ų61.58%0.07935%0.349CS..EExtended strand (participates in β ladder)trans-104.9124.5179.2-177.865000110.4V66 K71 S170 I172 F181 R182 L187V66-L185 HydrophobicContact CG1-CD2 4.1Å; K71-L185 HydrophobicContact CD-CD1 3.88Å; S170-L185 WeakPolarHBondContact OG-CD1 3.37Å; I172-L185 HydrophobicContact CD1-CD1 4.23Å; I172-L185 HydrophobicContact CD1-CD2 3.9Å; I172-L185 HydrophobicContact CG1-CD1 4.07Å; I172-L185 HydrophobicContact CG1-CD2 4.45Å; F181-L185 WeakPolarHBondContact CA-O 3.39Å; R182-L185 PolarHBondContact N-O 3.49Å; R182-L185 WeakPolarHBondContact O-CB 3.34Å; R182-L185 PolarHBondContact O-N 2.94Å; L185-L187 HydrophobicContact CD2-CD2 3.9Å; L185-L187 HydrophobicContact CG-CD2 4.2Å
186L91.9Very high86.9Confident0 Ų060.8 Ų60.80%033%0.329CS..EExtended strand (participates in β ladder)trans-80.9119.5168.1175.466000109.7I74 W135 L169 S170 Y171 I172 F181 V204 L283I74-L186 HydrophobicContact CD1-CD2 4.06Å; W135-L186 HydrophobicContact CH2-CD2 3.54Å; W135-L186 HydrophobicContact CZ3-CD2 3.89Å; L169-L186 HydrophobicContact CD2-CB 4.33Å; S170-L186 PolarHBondContact O-N 2.92Å; S170-L186 VanDerWaalsContact O-N 3.09Å; Y171-L186 CarbonylContact C-O 3.55Å; Y171-L186 WeakPolarHBondContact CA-O 3.47Å; Y171-L186 WeakPolarHBondContact CB-O 3.37Å; I172-L186 PolarHBondContact N-O 3.33Å; F181-L186 HydrophobicContact CD1-CB 4.28Å; F181-L186 HydrophobicContact CD1-CD1 4.41Å; F181-L186 HydrophobicContact CD2-CD1 4.35Å; F181-L186 HydrophobicContact CE1-CB 3.94Å; F181-L186 HydrophobicContact CE1-CD1 4.1Å; F181-L186 HydrophobicContact CE2-CD1 4.02Å; F181-L186 HydrophobicContact CZ-CB 4.46Å; F181-L186 HydrophobicContact CZ-CD1 3.89Å; L186-V204 HydrophobicContact CD1-CG2 4.18Å; L186-V204 HydrophobicContact CD2-CG1 4.32Å; L186-V204 HydrophobicContact CD2-CG2 4.02Å; L186-L283 HydrophobicContact CD1-CD1 4.11Å
187L91.9Very high87.2Confident26 Ų2656.6 Ų56.614%0.13631%0.307CS..EExtended strand (participates in β ladder)trans-91102.4165.4-58.6-176000107.5I172 N174 S179 E180 R182 L185I172-L187 WeakPolarHBondContact O-CA 3.32Å; N174-L187 HydrophobicContact CB-CB 3.9Å; S179-L187 CarbonylContact C-O 3.58Å; S179-L187 WeakPolarHBondContact CA-O 3.35Å; E180-L187 HydrophobicContact CG-CB 4.03Å; E180-L187 HydrophobicContact CG-CD1 4.06Å; E180-L187 HydrophobicContact CG-CG 4.49Å; E180-L187 PolarHBondContact N-O 2.92Å; E180-L187 WeakPolarHBondContact O-CB 3.33Å; E180-L187 PolarHBondContact O-N 3.15Å; R182-L187 HydrophobicContact CG-CD1 3.55Å; R182-L187 HydrophobicContact CG-CG 4.12Å; L185-L187 HydrophobicContact CD2-CD2 3.9Å; L185-L187 HydrophobicContact CG-CD2 4.2Å
188L91.5Very high87.7Confident0 Ų052.7 Ų52.70%028%0.282CS..EExtended strand (participates in β ladder)trans-86.1141.8-176.5-175.766.6000110.6W135 Y171 I172 N174 R197 D200 K201W135-L188 HydrophobicContact CZ3-CD2 4.26Å; Y171-L188 HydrophobicContact CD2-CB 4.15Å; Y171-L188 HydrophobicContact CD2-CD2 4.12Å; Y171-L188 HydrophobicContact CE2-CD2 4.11Å; I172-L188 PolarHBondContact O-N 3.01Å; N174-L188 WeakPolarHBondContact CA-O 3.47Å; N174-L188 WeakPolarHBondContact CB-O 3.36Å; N174-L188 PolarHBondContact N-O 3.41Å; L188-R197 HydrophobicContact CD1-CG 4.23Å; L188-R197 HydrophobicContact CD2-CG 4.01Å; L188-R197 HydrophobicContact CG-CG 4.09Å; L188-D200 HydrophobicContact CD1-CB 4.06Å; L188-K201 HydrophobicContact CD1-CG 4.29Å; L188-K201 HydrophobicContact CD2-CG 4.21Å
189R91.8Very high87.9Confident23 Ų2347 Ų479%0.08726%0.263CS..PPolyproline II helixtrans-49.4143172.6-170.3-178.3-55.5-143.1-8.3112.7P177 S179 T193 E196 R197 D200 E279P177-R189 WeakPolarHBondContact O-CD 3.49Å; P177-R189 WeakPolarHBondContact O-CG 3.26Å; P177-R189 PolarHBondContact O-NE 3.43Å; S179-R189 PolarHBondContact OG-N 3.2Å; R189-T193 WeakPolarHBondContact CD-OG1 3.42Å; R189-T193 WeakPolarHBondContact CG-OG1 3.46Å; R189-E196 VanDerWaalsContact NH1-CB 3.29Å; R189-R197 PolarHBondContact O-NE 3.01Å; R189-R197 VanDerWaalsContact O-NE 3.16Å; R189-D200 IonicContact CZ-OD2 3.02Å; R189-D200 IonicContact NE-OD2 3.01Å; R189-D200 PolarHBondContact NE-OD2 3.38Å; R189-D200 IonicContact NH2-OD2 3.02Å; R189-E279 IonicContact NH2-OE2 3.3Å; R189-E279 PolarHBondContact NH2-OE2 2.8Å; R189-E279 VanDerWaalsContact NH2-OE2 3.15Å
190P87.1Confident88Confident39 Ų3946.4 Ų46.425%0.25326%0.258SS..PPolyproline II helixtrans-65157.1-176.324.6-34.9000113.9N174 M176 G192N174-P190 WeakPolarHBondContact O-CD 3.32Å; M176-P190 WeakPolarHBondContact O-CD 3.3Å; P190-G192 PolarHBondContact O-N 3.17Å
191P80.9Confident88.2Confident84 Ų8443.9 Ų43.955%0.54525%0.246SC..THydrogen-bonded Turntrans-60.6116171.825.3-33000109.8
192G78Confident88.5Confident68 Ų6843 Ų4370%0.70124%0.242SC*.THydrogen-bonded Turntrans153.5-18.9-173.700000113.7P190P190-G192 PolarHBondContact O-N 3.17Å
193T82.3Confident88.9Confident48 Ų4837.2 Ų37.229%0.29422%0.22SC..  trans-125.665.2174.636.40000108.5R189 V195 E196 R197R189-T193 WeakPolarHBondContact CD-OG1 3.42Å; R189-T193 WeakPolarHBondContact CG-OG1 3.46Å; T193-V195 VanDerWaalsContact C-N 3.29Å; T193-V195 PolarHBondContact O-N 3.4Å; T193-E196 WeakPolarHBondContact CB-OE2 3.5Å; T193-E196 PolarHBondContact O-N 3.15Å; T193-R197 WeakPolarHBondContact O-CB 3.43Å; T193-R197 PolarHBondContact O-N 3.33Å
194E85.3Confident89.4Confident94 Ų9433.6 Ų33.644%0.43920%0.196SC..Hα-helixtrans-59.5-37.6-168.7-72-57.8131.300113.2R197 S198E194-R197 IonicContact OE1-NH1 3.99Å; E194-S198 VanDerWaalsContact O-CB 3.31Å; E194-S198 WeakPolarHBondContact O-CB 3.35Å; E194-S198 PolarHBondContact O-N 3.28Å; E194-S198 PolarHBondContact O-OG 3.33Å
195V87.4Confident89.9Confident99 Ų9931.6 Ų31.660%0.619%0.187SC*.Hα-helixtrans-66.5-53.3179.9-179.80000110.2T193 R197 S198 L199T193-V195 VanDerWaalsContact C-N 3.29Å; T193-V195 PolarHBondContact O-N 3.4Å; V195-R197 VanDerWaalsContact C-N 3.35Å; V195-R197 PolarHBondContact O-N 3.19Å; V195-S198 PolarHBondContact O-N 2.96Å; V195-L199 WeakPolarHBondContact O-CG 3.34Å; V195-L199 PolarHBondContact O-N 3.35Å; V195-L199 VanDerWaalsContact O-N 3.1Å
196E89.3Confident90.2Very high83 Ų8331 Ų3139%0.38818%0.184SC..Hα-helixtrans-65.2-39.5179.6-61.480.8-177.100111.6R189 T193 S198 L199 D200R189-E196 VanDerWaalsContact NH1-CB 3.29Å; T193-E196 WeakPolarHBondContact CB-OE2 3.5Å; T193-E196 PolarHBondContact O-N 3.15Å; E196-S198 VanDerWaalsContact C-N 3.3Å; E196-S198 PolarHBondContact O-N 2.98Å; E196-L199 PolarHBondContact O-N 3.17Å; E196-D200 PolarHBondContact O-N 2.92Å
197R90.9Very high90.2Very high25 Ų2531 Ų319%0.09418%0.184CC..Hα-helixtrans-61.3-40.2176.2-170.2178.9-168.3-160.63.8111.5D173 L188 R189 T193 E194 V195 L199 D200 K201D173-R197 IonicContact OD1-CZ 3.79Å; D173-R197 IonicContact OD1-NH2 2.68Å; D173-R197 PolarHBondContact OD1-NH2 3.47Å; D173-R197 IonicContact OD2-NH2 3.14Å; D173-R197 PolarHBondContact OD2-NH2 3.05Å; D173-R197 VanDerWaalsContact OD2-NH2 3.14Å; L188-R197 HydrophobicContact CD1-CG 4.23Å; L188-R197 HydrophobicContact CD2-CG 4.01Å; L188-R197 HydrophobicContact CG-CG 4.09Å; R189-R197 PolarHBondContact O-NE 3.01Å; R189-R197 VanDerWaalsContact O-NE 3.16Å; T193-R197 WeakPolarHBondContact O-CB 3.43Å; T193-R197 PolarHBondContact O-N 3.33Å; E194-R197 IonicContact OE1-NH1 3.99Å; V195-R197 VanDerWaalsContact C-N 3.35Å; V195-R197 PolarHBondContact O-N 3.19Å; R197-L199 VanDerWaalsContact C-N 3.34Å; R197-D200 PolarHBondContact O-N 3.31Å; R197-K201 WeakPolarHBondContact O-CG 3.25Å; R197-K201 PolarHBondContact O-N 2.96Å
198S91.7Very high90.2Very high5 Ų529.8 Ų29.84%0.03518%0.177CC..Hα-helixtrans-66-37.4176.3-56.50000112R112 E194 V195 E196 Y202R112-S198 PolarHBondContact NH1-OG 3.34Å; R112-S198 PolarHBondContact NH2-OG 3.01Å; R112-S198 VanDerWaalsContact NH2-OG 3.09Å; E194-S198 VanDerWaalsContact O-CB 3.31Å; E194-S198 WeakPolarHBondContact O-CB 3.35Å; E194-S198 PolarHBondContact O-N 3.28Å; E194-S198 PolarHBondContact O-OG 3.33Å; V195-S198 PolarHBondContact O-N 2.96Å; E196-S198 VanDerWaalsContact C-N 3.3Å; E196-S198 PolarHBondContact O-N 2.98Å; S198-Y202 WeakPolarHBondContact O-CB 3.21Å; S198-Y202 PolarHBondContact O-N 2.96Å
199L92.9Very high90.3Very high31 Ų3129.8 Ų29.816%0.16218%0.177CC..Hα-helixtrans-68.5-42.9174.7-67.3177.7000111.8L103 V195 E196 R197 K201 Y202 A203 F273 L280L103-L199 HydrophobicContact CD1-CD2 4.26Å; V195-L199 WeakPolarHBondContact O-CG 3.34Å; V195-L199 PolarHBondContact O-N 3.35Å; V195-L199 VanDerWaalsContact O-N 3.1Å; E196-L199 PolarHBondContact O-N 3.17Å; R197-L199 VanDerWaalsContact C-N 3.34Å; L199-K201 VanDerWaalsContact C-N 3.34Å; L199-K201 PolarHBondContact O-N 2.77Å; L199-Y202 WeakPolarHBondContact O-CA 3.46Å; L199-Y202 WeakPolarHBondContact O-CB 3.46Å; L199-Y202 PolarHBondContact O-N 3.38Å; L199-Y202 VanDerWaalsContact O-N 3.12Å; L199-A203 PolarHBondContact O-N 2.93Å; L199-F273 HydrophobicContact CD2-CZ 4.01Å; L199-L280 HydrophobicContact CB-CD1 4.36Å; L199-L280 HydrophobicContact CB-CD2 4.3Å; L199-L280 WeakPolarHBondContact O-CD1 3.27Å
200D93.9Very high90.2Very high7 Ų730.1 Ų30.14%0.03718%0.179CC..Hα-helixtrans-58.7-45.8174.6-73.1-14.3000110.7S179 L188 R189 E196 R197 Y202 A203 V204 L283S179-D200 VanDerWaalsContact CB-OD2 3.27Å; S179-D200 WeakPolarHBondContact CB-OD2 3.45Å; S179-D200 PolarHBondContact OG-OD2 3.19Å; L188-D200 HydrophobicContact CD1-CB 4.06Å; R189-D200 IonicContact CZ-OD2 3.02Å; R189-D200 IonicContact NE-OD2 3.01Å; R189-D200 PolarHBondContact NE-OD2 3.38Å; R189-D200 IonicContact NH2-OD2 3.02Å; E196-D200 PolarHBondContact O-N 2.92Å; R197-D200 PolarHBondContact O-N 3.31Å; D200-Y202 VanDerWaalsContact C-N 3.35Å; D200-Y202 PolarHBondContact O-N 3.44Å; D200-A203 PolarHBondContact O-N 3.08Å; D200-V204 PolarHBondContact O-N 3.16Å; D200-L283 HydrophobicContact CB-CD2 3.75Å
201K94.8Very high90.5Very high8 Ų828.3 Ų28.34%0.03517%0.167CC..Hα-helixtrans-58.5-44.9172.6-71.5-176.4-175.3-178.40111.6E123 F125 W135 L188 R197 L199 V204 S205E123-K201 IonicContact OE1-NZ 3.94Å; E123-K201 PolarHBondContact OE1-NZ 2.97Å; E123-K201 IonicContact OE2-NZ 2.8Å; E123-K201 PolarHBondContact OE2-NZ 3.15Å; F125-K201 HydrophobicContact CE2-CB 3.82Å; F125-K201 HydrophobicContact CE2-CD 4.4Å; F125-K201 HydrophobicContact CZ-CB 3.81Å; W135-K201 HydrophobicContact CD2-CB 4.29Å; W135-K201 HydrophobicContact CD2-CD 4.01Å; W135-K201 HydrophobicContact CD2-CG 3.98Å; W135-K201 HydrophobicContact CE3-CD 4.02Å; W135-K201 HydrophobicContact CE3-CG 3.84Å; W135-K201 HydrophobicContact CG-CD 4.43Å; W135-K201 HydrophobicContact CH2-CB 3.98Å; W135-K201 HydrophobicContact CH2-CG 3.76Å; W135-K201 VanDerWaalsContact CZ2-CA 3.48Å; W135-K201 HydrophobicContact CZ2-CB 3.68Å; W135-K201 HydrophobicContact CZ2-CG 3.91Å; W135-K201 VanDerWaalsContact CZ2-O 3.29Å; W135-K201 WeakPolarHBondContact CZ2-O 2.95Å; W135-K201 HydrophobicContact CZ3-CB 4.42Å; W135-K201 HydrophobicContact CZ3-CD 4.4Å; W135-K201 HydrophobicContact CZ3-CG 3.72Å; L188-K201 HydrophobicContact CD1-CG 4.29Å; L188-K201 HydrophobicContact CD2-CG 4.21Å; R197-K201 WeakPolarHBondContact O-CG 3.25Å; R197-K201 PolarHBondContact O-N 2.96Å; L199-K201 VanDerWaalsContact C-N 3.34Å; L199-K201 PolarHBondContact O-N 2.77Å; K201-V204 PolarHBondContact O-N 3.07Å; K201-S205 VanDerWaalsContact O-CB 3.29Å; K201-S205 WeakPolarHBondContact O-CB 3.11Å; K201-S205 PolarHBondContact O-N 3.13Å; K201-S205 PolarHBondContact O-OG 2.85Å
202Y94.4Very high91Very high8 Ų824.3 Ų24.33%0.03114%0.141CC..Hα-helixtrans-60-45.8177165.3-100.2000112L103 L107 V110 F127 S198 L199 D200 V204 S205 N206 F273L103-Y202 HydrophobicContact CD2-CD2 3.76Å; L103-Y202 HydrophobicContact CD2-CE2 4.48Å; L103-Y202 HydrophobicContact CD2-CG 3.96Å; L107-Y202 HydrophobicContact CD1-CD1 3.97Å; L107-Y202 HydrophobicContact CD1-CD2 4.27Å; L107-Y202 HydrophobicContact CD1-CE1 3.7Å; L107-Y202 HydrophobicContact CD1-CE2 4.03Å; L107-Y202 HydrophobicContact CD1-CG 4.24Å; L107-Y202 HydrophobicContact CD2-CE1 4.12Å; L107-Y202 WeakPolarHBondContact CD2-OH 3.05Å; V110-Y202 HydrophobicContact CB-CE2 4.11Å; V110-Y202 HydrophobicContact CG1-CD2 4.15Å; V110-Y202 HydrophobicContact CG1-CE2 3.63Å; V110-Y202 HydrophobicContact CG2-CD2 4.15Å; V110-Y202 HydrophobicContact CG2-CE2 4.13Å; F127-Y202 HydrophobicContact CE1-CD2 4.2Å; F127-Y202 AromaticContact CE1-CE2 3.69Å; F127-Y202 HydrophobicContact CE1-CE2 3.69Å; F127-Y202 HydrophobicContact CZ-CD2 4.19Å; F127-Y202 HydrophobicContact CZ-CE2 4.15Å; S198-Y202 WeakPolarHBondContact O-CB 3.21Å; S198-Y202 PolarHBondContact O-N 2.96Å; L199-Y202 WeakPolarHBondContact O-CA 3.46Å; L199-Y202 WeakPolarHBondContact O-CB 3.46Å; L199-Y202 PolarHBondContact O-N 3.38Å; L199-Y202 VanDerWaalsContact O-N 3.12Å; D200-Y202 VanDerWaalsContact C-N 3.35Å; D200-Y202 PolarHBondContact O-N 3.44Å; Y202-V204 PolarHBondContact O-N 3.35Å; Y202-S205 CarbonylContact O-C 3.44Å; Y202-S205 WeakPolarHBondContact O-CB 3.32Å; Y202-S205 PolarHBondContact O-N 2.69Å; Y202-N206 WeakPolarHBondContact O-CB 3.08Å; Y202-N206 PolarHBondContact O-N 3.27Å; Y202-F273 AromaticContact CD1-CE1 3.97Å; Y202-F273 HydrophobicContact CD1-CE1 3.97Å; Y202-F273 AromaticContact CE1-CD1 3.9Å; Y202-F273 HydrophobicContact CE1-CD1 3.9Å; Y202-F273 AromaticContact CE1-CE1 3.67Å; Y202-F273 HydrophobicContact CE1-CE1 3.67Å; Y202-F273 HydrophobicContact CE1-CZ 4.41Å
203A93.7Very high91.7Very high0 Ų021.2 Ų21.20%011%0.108CC..Hα-helixtrans-61.5-43.5-179.200000112.5L199 D200 N206 A207 Y274 L280L199-A203 PolarHBondContact O-N 2.93Å; D200-A203 PolarHBondContact O-N 3.08Å; A203-N206 PolarHBondContact O-N 3.02Å; A203-A207 PolarHBondContact O-N 3.33Å; A203-Y274 HydrophobicContact CB-CE1 3.97Å; A203-L280 HydrophobicContact CB-CD1 3.47Å; A203-L280 VanDerWaalsContact CB-CD1 3.47Å; A203-L280 HydrophobicContact CB-CG 3.85Å
204V95Very high92.1Very high0 Ų019 Ų190%09%0.094CC..Hα-helixtrans-65.6-43.2175176.10000110.9W135 L169 F181 L186 D200 K201 Y202 N206 A207 M208 L283W135-V204 HydrophobicContact CH2-CB 4.27Å; W135-V204 HydrophobicContact CH2-CG1 4.34Å; W135-V204 HydrophobicContact CZ2-CB 4.12Å; W135-V204 HydrophobicContact CZ2-CG1 4.25Å; L169-V204 HydrophobicContact CD2-CG1 3.57Å; F181-V204 HydrophobicContact CE2-CG2 4.08Å; F181-V204 HydrophobicContact CZ-CG1 4.18Å; F181-V204 HydrophobicContact CZ-CG2 3.81Å; L186-V204 HydrophobicContact CD1-CG2 4.18Å; L186-V204 HydrophobicContact CD2-CG1 4.32Å; L186-V204 HydrophobicContact CD2-CG2 4.02Å; D200-V204 PolarHBondContact O-N 3.16Å; K201-V204 PolarHBondContact O-N 3.07Å; Y202-V204 PolarHBondContact O-N 3.35Å; V204-N206 VanDerWaalsContact C-N 3.31Å; V204-N206 PolarHBondContact O-N 2.87Å; V204-A207 PolarHBondContact O-N 3.39Å; V204-M208 HydrophobicContact CG1-SD 4.25Å; V204-M208 WeakPolarHBondContact O-CG 3.02Å; V204-M208 PolarHBondContact O-N 3.27Å; V204-L283 HydrophobicContact CG2-CD2 4.09Å; V204-L283 HydrophobicContact CG2-CG 4.15Å
205S95.2Very high92.4Very high0 Ų015.4 Ų15.40%08%0.08CC..Hα-helixtrans-61.5-40.7177.6-56.60000111.9W135 K201 Y202 M208 T209W135-S205 PolarHBondContact NE1-OG 3.02Å; K201-S205 VanDerWaalsContact O-CB 3.29Å; K201-S205 WeakPolarHBondContact O-CB 3.11Å; K201-S205 PolarHBondContact O-N 3.13Å; K201-S205 PolarHBondContact O-OG 2.85Å; Y202-S205 CarbonylContact O-C 3.44Å; Y202-S205 WeakPolarHBondContact O-CB 3.32Å; Y202-S205 PolarHBondContact O-N 2.69Å; S205-M208 WeakPolarHBondContact O-CB 3.25Å; S205-M208 PolarHBondContact O-N 3.3Å; S205-T209 PolarHBondContact O-N 3.46Å; S205-T209 PolarHBondContact O-OG1 3.07Å
206N93.3Very high92.7Very high4 Ų410.7 Ų10.72%0.0215%0.051CC..Hα-helixtrans-61.4-46.4177.3-170.529.9000111F127 Y202 A203 V204 M208 T209 Y210 Y274 Y284F127-N206 HydrophobicContact CE1-CB 4.07Å; F127-N206 HydrophobicContact CZ-CB 4.29Å; Y202-N206 WeakPolarHBondContact O-CB 3.08Å; Y202-N206 PolarHBondContact O-N 3.27Å; A203-N206 PolarHBondContact O-N 3.02Å; V204-N206 VanDerWaalsContact C-N 3.31Å; V204-N206 PolarHBondContact O-N 2.87Å; N206-M208 VanDerWaalsContact C-N 3.32Å; N206-M208 PolarHBondContact O-N 2.87Å; N206-T209 WeakPolarHBondContact O-CB 3.46Å; N206-T209 PolarHBondContact O-N 3.22Å; N206-Y210 WeakPolarHBondContact O-CD2 3.29Å; N206-Y210 PolarHBondContact O-N 2.9Å; N206-Y210 WeakPolarHBondContact OD1-CE2 3.4Å; N206-Y274 PolarHBondContact ND2-OH 3.24Å; N206-Y284 HydrophobicContact CB-CE2 4.35Å
207A92.4Very high92.8Very high0 Ų06.8 Ų6.80%03%0.033CC..Hα-helixtrans-61.7-39.5174.200000112.4A203 V204 Y210 S211 Y284 A287 F291 I293A203-A207 PolarHBondContact O-N 3.33Å; V204-A207 PolarHBondContact O-N 3.39Å; A207-Y210 PolarHBondContact O-N 3.42Å; A207-S211 PolarHBondContact O-N 3.16Å; A207-S211 VanDerWaalsContact O-N 3.15Å; A207-Y284 HydrophobicContact CB-CD2 4.16Å; A207-Y284 HydrophobicContact CB-CE2 4.05Å; A207-A287 HydrophobicContact CB-CB 3.68Å; A207-F291 HydrophobicContact CB-CD2 4.25Å; A207-F291 HydrophobicContact CB-CE2 4.28Å; A207-I293 WeakPolarHBondContact O-CD1 3.48Å
208M93.4Very high92.9Very high0 Ų07.4 Ų7.40%04%0.037CC..Hα-helixtrans-65.7-39.1176.9-74-176.279.200112.9I74 A76 V133 L169 V204 S205 N206 Y210 S211 V212 F291I74-M208 HydrophobicContact CB-CE 4.36Å; I74-M208 HydrophobicContact CB-SD 4.21Å; I74-M208 HydrophobicContact CG2-CE 3.95Å; I74-M208 HydrophobicContact CG2-SD 3.52Å; I74-M208 VanDerWaalsContact CG2-SD 3.52Å; A76-M208 HydrophobicContact CB-CB 3.89Å; A76-M208 HydrophobicContact CB-CE 3.81Å; V133-M208 HydrophobicContact CG1-SD 4.29Å; V133-M208 HydrophobicContact CG2-CB 4.3Å; L169-M208 HydrophobicContact CB-CE 3.98Å; L169-M208 HydrophobicContact CB-SD 4.07Å; L169-M208 HydrophobicContact CD2-SD 4.29Å; V204-M208 HydrophobicContact CG1-SD 4.25Å; V204-M208 WeakPolarHBondContact O-CG 3.02Å; V204-M208 PolarHBondContact O-N 3.27Å; S205-M208 WeakPolarHBondContact O-CB 3.25Å; S205-M208 PolarHBondContact O-N 3.3Å; N206-M208 VanDerWaalsContact C-N 3.32Å; N206-M208 PolarHBondContact O-N 2.87Å; M208-Y210 VanDerWaalsContact C-N 3.27Å; M208-Y210 PolarHBondContact O-N 3.29Å; M208-S211 WeakPolarHBondContact O-CA 3.37Å; M208-S211 WeakPolarHBondContact O-CB 3.45Å; M208-S211 PolarHBondContact O-N 3.25Å; M208-V212 PolarHBondContact O-N 3.36Å; M208-F291 HydrophobicContact CB-CZ 4.48Å; M208-F291 HydrophobicContact CG-CE1 4.07Å; M208-F291 HydrophobicContact CG-CE2 3.55Å; M208-F291 HydrophobicContact CG-CZ 3.27Å; M208-F291 HydrophobicContact SD-CZ 4.13Å
209T92.3Very high93Very high0 Ų09.1 Ų9.10%05%0.047CC..Hα-helixtrans-52.2-48.7173.8-74.10000110.6F127 E129 A131 S205 N206 S211 V212 K213F127-T209 HydrophobicContact CB-CG2 4.23Å; F127-T209 HydrophobicContact CD1-CG2 4.49Å; F127-T209 WeakPolarHBondContact CD2-OG1 3.38Å; F127-T209 WeakPolarHBondContact CE2-OG1 3.44Å; F127-T209 HydrophobicContact CG-CG2 4.22Å; F127-T209 WeakPolarHBondContact CG-OG1 3.44Å; E129-T209 HydrophobicContact CB-CG2 4.29Å; A131-T209 HydrophobicContact CB-CG2 3.48Å; A131-T209 VanDerWaalsContact CB-CG2 3.48Å; S205-T209 PolarHBondContact O-N 3.46Å; S205-T209 PolarHBondContact O-OG1 3.07Å; N206-T209 WeakPolarHBondContact O-CB 3.46Å; N206-T209 PolarHBondContact O-N 3.22Å; T209-S211 VanDerWaalsContact C-N 3.34Å; T209-S211 PolarHBondContact O-N 2.9Å; T209-V212 WeakPolarHBondContact O-CG2 3.41Å; T209-V212 PolarHBondContact O-N 2.9Å; T209-K213 WeakPolarHBondContact O-CB 3.26Å; T209-K213 PolarHBondContact O-N 3.36Å
210Y90.5Very high93Very high29 Ų298.7 Ų8.711%0.1145%0.045CC..Hα-helixtrans-66.6-35.1177-65-59.8000113.2N206 A207 M208 V212 K213 L214 L267N206-Y210 WeakPolarHBondContact O-CD2 3.29Å; N206-Y210 PolarHBondContact O-N 2.9Å; N206-Y210 WeakPolarHBondContact OD1-CE2 3.4Å; A207-Y210 PolarHBondContact O-N 3.42Å; M208-Y210 VanDerWaalsContact C-N 3.27Å; M208-Y210 PolarHBondContact O-N 3.29Å; Y210-V212 PolarHBondContact O-N 3.46Å; Y210-K213 PolarHBondContact O-N 3.43Å; Y210-L214 WeakPolarHBondContact O-CB 3.31Å; Y210-L214 PolarHBondContact O-N 3.23Å; Y210-L267 HydrophobicContact CD1-CD1 3.32Å; Y210-L267 HydrophobicContact CD1-CD2 3.67Å; Y210-L267 HydrophobicContact CD1-CG 4.05Å; Y210-L267 HydrophobicContact CD2-CD1 3.3Å; Y210-L267 HydrophobicContact CE1-CB 4.33Å; Y210-L267 HydrophobicContact CE1-CD1 3.51Å; Y210-L267 HydrophobicContact CE1-CD2 4.19Å; Y210-L267 HydrophobicContact CE1-CG 4.24Å; Y210-L267 HydrophobicContact CE2-CD1 3.48Å; Y210-L267 VanDerWaalsContact CE2-CD1 3.48Å; Y210-L267 HydrophobicContact CG-CD1 3.19Å; Y210-L267 HydrophobicContact CG-CD2 4.09Å; Y210-L267 HydrophobicContact CG-CG 4.27Å
211S92.3Very high93Very high1 Ų18.3 Ų8.31%0.0074%0.043CC..Hα-helixtrans-59.6-46.8175.9-169.20000112D167 A207 M208 T209 S215 R296D167-S211 VanDerWaalsContact OD2-CB 3.27Å; D167-S211 WeakPolarHBondContact OD2-CB 3.3Å; D167-S211 PolarHBondContact OD2-OG 3.49Å; A207-S211 PolarHBondContact O-N 3.16Å; A207-S211 VanDerWaalsContact O-N 3.15Å; M208-S211 WeakPolarHBondContact O-CA 3.37Å; M208-S211 WeakPolarHBondContact O-CB 3.45Å; M208-S211 PolarHBondContact O-N 3.25Å; T209-S211 VanDerWaalsContact C-N 3.34Å; T209-S211 PolarHBondContact O-N 2.9Å; S211-S215 PolarHBondContact O-N 2.96Å; S211-S215 VanDerWaalsContact O-N 3.15Å; S211-S215 PolarHBondContact O-OG 2.93Å; S211-R296 PolarHBondContact O-NH1 3.02Å; S211-R296 VanDerWaalsContact O-NH1 3.12Å; S211-R296 PolarHBondContact O-NH2 3.16Å; S211-R296 PolarHBondContact OG-NH1 3.3Å
212V92.9Very high92.9Very high0 Ų09 Ų90%05%0.049CC..Hα-helixtrans-72.2-38.7179.2-63.90000112.2A76 T78 A131 D167 M208 T209 Y210 L214 S215 V216A76-V212 HydrophobicContact CB-CG1 3.59Å; A76-V212 HydrophobicContact CB-CG2 4.37Å; T78-V212 HydrophobicContact CG2-CB 4.01Å; T78-V212 HydrophobicContact CG2-CG2 4.13Å; A131-V212 HydrophobicContact CB-CG2 4.23Å; D167-V212 HydrophobicContact CB-CG1 3.76Å; M208-V212 PolarHBondContact O-N 3.36Å; T209-V212 WeakPolarHBondContact O-CG2 3.41Å; T209-V212 PolarHBondContact O-N 2.9Å; Y210-V212 PolarHBondContact O-N 3.46Å; V212-L214 VanDerWaalsContact C-N 3.29Å; V212-L214 PolarHBondContact O-N 3.03Å; V212-S215 WeakPolarHBondContact O-CB 3.42Å; V212-S215 PolarHBondContact O-N 2.93Å; V212-S215 VanDerWaalsContact O-N 3.12Å; V212-V216 PolarHBondContact O-N 2.88Å; V212-V216 VanDerWaalsContact O-N 3.16Å
213K91Very high92.8Very high4 Ų412.5 Ų12.52%0.0177%0.066CC..Hα-helixtrans-61.9-42.3177.1-139-46-167.5-172.50111.2Y157 T209 Y210 S215 V216 W217Y157-K213 WeakPolarHBondContact OH-CE 3.44Å; Y157-K213 PolarHBondContact OH-NZ 3.03Å; T209-K213 WeakPolarHBondContact O-CB 3.26Å; T209-K213 PolarHBondContact O-N 3.36Å; Y210-K213 PolarHBondContact O-N 3.43Å; K213-S215 VanDerWaalsContact C-N 3.29Å; K213-S215 PolarHBondContact O-N 2.93Å; K213-V216 WeakPolarHBondContact O-CB 3.42Å; K213-V216 PolarHBondContact O-N 3.32Å; K213-W217 HydrophobicContact CD-CD2 4.1Å; K213-W217 HydrophobicContact CD-CH2 4.05Å; K213-W217 HydrophobicContact CD-CZ2 3.61Å; K213-W217 VanDerWaalsContact CE-CZ2 3.42Å; K213-W217 HydrophobicContact CG-CH2 4.46Å; K213-W217 HydrophobicContact CG-CZ2 4.42Å; K213-W217 VanDerWaalsContact NZ-CE2 3.29Å; K213-W217 PolarHBondContact O-N 2.92Å
214L91.3Very high92.7Very high0 Ų013.2 Ų13.20%07%0.069CC..Hα-helixtrans-64.2-36176.4-17354.3000111.8Y210 V212 V216 W217 E218 I293 R296 I297 L300Y210-L214 WeakPolarHBondContact O-CB 3.31Å; Y210-L214 PolarHBondContact O-N 3.23Å; V212-L214 VanDerWaalsContact C-N 3.29Å; V212-L214 PolarHBondContact O-N 3.03Å; L214-V216 VanDerWaalsContact C-N 3.34Å; L214-V216 PolarHBondContact O-N 3.46Å; L214-W217 HydrophobicContact CD1-CE3 3.94Å; L214-W217 PolarHBondContact O-N 3Å; L214-E218 HydrophobicContact CD1-CG 4.49Å; L214-E218 HydrophobicContact CG-CG 4.49Å; L214-E218 WeakPolarHBondContact O-CB 3.12Å; L214-E218 VanDerWaalsContact O-CG 3.26Å; L214-E218 WeakPolarHBondContact O-CG 3.47Å; L214-E218 PolarHBondContact O-N 3.39Å; L214-I293 HydrophobicContact CD2-CG2 4.15Å; L214-R296 HydrophobicContact CD2-CB 3.32Å; L214-R296 HydrophobicContact CD2-CG 4.32Å; L214-R296 HydrophobicContact CG-CB 4.15Å; L214-I297 HydrophobicContact CD1-CG1 4.25Å; L214-I297 HydrophobicContact CD2-CG1 3.96Å; L214-L300 HydrophobicContact CD1-CD2 3.68Å
215S92.5Very high92.6Very high19 Ų1914.8 Ų14.813%0.1338%0.078CC..Hα-helixtrans-61.2-41.7174.6-58.50000111.7S211 V212 K213 E218 T219 R296S211-S215 PolarHBondContact O-N 2.96Å; S211-S215 VanDerWaalsContact O-N 3.15Å; S211-S215 PolarHBondContact O-OG 2.93Å; V212-S215 WeakPolarHBondContact O-CB 3.42Å; V212-S215 PolarHBondContact O-N 2.93Å; V212-S215 VanDerWaalsContact O-N 3.12Å; K213-S215 VanDerWaalsContact C-N 3.29Å; K213-S215 PolarHBondContact O-N 2.93Å; S215-E218 PolarHBondContact O-N 2.88Å; S215-T219 PolarHBondContact O-N 2.93Å; S215-T219 PolarHBondContact O-OG1 3.03Å; S215-T219 VanDerWaalsContact O-OG1 3.12Å; S215-R296 VanDerWaalsContact N-NH2 3.14Å; S215-R296 PolarHBondContact OG-NH2 2.95Å
216V93Very high92.4Very high0 Ų019.2 Ų19.20%010%0.102CC..Hα-helixtrans-60.3-47.7174.31720000111.6T78 Y157 I161 A165 V212 K213 L214 E218 T219 L220T78-V216 HydrophobicContact CG2-CG2 3.3Å; Y157-V216 HydrophobicContact CD1-CG1 3.82Å; Y157-V216 HydrophobicContact CD2-CG1 4.1Å; Y157-V216 HydrophobicContact CD2-CG2 4.15Å; Y157-V216 HydrophobicContact CE1-CG1 3.7Å; Y157-V216 HydrophobicContact CE2-CG1 3.98Å; Y157-V216 HydrophobicContact CE2-CG2 4.09Å; Y157-V216 HydrophobicContact CG-CG1 4.04Å; I161-V216 HydrophobicContact CG2-CB 4.31Å; I161-V216 HydrophobicContact CG2-CG1 3.84Å; I161-V216 HydrophobicContact CG2-CG2 4.26Å; A165-V216 HydrophobicContact CB-CG2 3.43Å; A165-V216 VanDerWaalsContact CB-CG2 3.43Å; V212-V216 PolarHBondContact O-N 2.88Å; V212-V216 VanDerWaalsContact O-N 3.16Å; K213-V216 WeakPolarHBondContact O-CB 3.42Å; K213-V216 PolarHBondContact O-N 3.32Å; L214-V216 VanDerWaalsContact C-N 3.34Å; L214-V216 PolarHBondContact O-N 3.46Å; V216-E218 PolarHBondContact O-N 3.49Å; V216-T219 PolarHBondContact O-N 2.97Å; V216-L220 HydrophobicContact CG1-CD1 3.89Å; V216-L220 HydrophobicContact CG1-CG 4.36Å; V216-L220 WeakPolarHBondContact O-CG 3.43Å; V216-L220 PolarHBondContact O-N 3.03Å
217W92Very high92.3Very high2 Ų220.3 Ų20.31%0.00811%0.112CC..Hα-helixtrans-65.5-37.9179-67-36000113.4K213 L214 T219 L220 L221 L257 I261 D264 L300K213-W217 HydrophobicContact CD-CD2 4.1Å; K213-W217 HydrophobicContact CD-CH2 4.05Å; K213-W217 HydrophobicContact CD-CZ2 3.61Å; K213-W217 VanDerWaalsContact CE-CZ2 3.42Å; K213-W217 HydrophobicContact CG-CH2 4.46Å; K213-W217 HydrophobicContact CG-CZ2 4.42Å; K213-W217 VanDerWaalsContact NZ-CE2 3.29Å; K213-W217 PolarHBondContact O-N 2.92Å; L214-W217 HydrophobicContact CD1-CE3 3.94Å; L214-W217 PolarHBondContact O-N 3Å; W217-T219 VanDerWaalsContact C-N 3.29Å; W217-T219 PolarHBondContact O-N 3.48Å; W217-L220 PolarHBondContact O-N 2.66Å; W217-L221 VanDerWaalsContact O-CB 3.32Å; W217-L221 WeakPolarHBondContact O-CB 3.33Å; W217-L221 PolarHBondContact O-N 3.3Å; W217-L257 HydrophobicContact CG-CD1 4.37Å; W217-I261 HydrophobicContact CB-CG1 4.37Å; W217-I261 HydrophobicContact CD2-CG1 3.67Å; W217-I261 HydrophobicContact CE3-CG1 3.89Å; W217-I261 HydrophobicContact CG-CG1 3.92Å; W217-I261 HydrophobicContact CZ2-CG1 4.47Å; W217-I261 HydrophobicContact CZ3-CG1 4.44Å; W217-D264 HydrophobicContact CH2-CB 3.53Å; W217-D264 WeakPolarHBondContact CH2-OD2 3.11Å; W217-D264 HydrophobicContact CZ2-CB 4.04Å; W217-D264 WeakPolarHBondContact CZ2-OD2 3.33Å; W217-L300 HydrophobicContact CB-CD2 3.98Å; W217-L300 HydrophobicContact CE3-CD2 4.43Å
218E93Very high92.2Very high37 Ų3720.5 Ų20.517%0.17311%0.113CC..Hα-helixtrans-61.2-40.2174.7-75.9172.5162.500111.2L214 S215 V216 S222 R296 L300L214-E218 HydrophobicContact CD1-CG 4.49Å; L214-E218 HydrophobicContact CG-CG 4.49Å; L214-E218 WeakPolarHBondContact O-CB 3.12Å; L214-E218 VanDerWaalsContact O-CG 3.26Å; L214-E218 WeakPolarHBondContact O-CG 3.47Å; L214-E218 PolarHBondContact O-N 3.39Å; S215-E218 PolarHBondContact O-N 2.88Å; V216-E218 PolarHBondContact O-N 3.49Å; E218-S222 VanDerWaalsContact O-CB 3.31Å; E218-S222 WeakPolarHBondContact O-CB 3.3Å; E218-S222 PolarHBondContact O-N 3.1Å; E218-S222 PolarHBondContact O-OG 2.76Å; E218-R296 WeakPolarHBondContact OE1-CB 3.28Å; E218-R296 IonicContact OE1-CZ 3.53Å; E218-R296 IonicContact OE1-NE 3.4Å; E218-R296 PolarHBondContact OE1-NE 2.65Å; E218-R296 IonicContact OE1-NH2 2.79Å; E218-R296 IonicContact OE2-CZ 2.93Å; E218-R296 IonicContact OE2-NE 3.68Å; E218-R296 PolarHBondContact OE2-NE 3.1Å; E218-R296 IonicContact OE2-NH2 3.79Å; E218-R296 PolarHBondContact OE2-NH2 3.24Å; E218-L300 HydrophobicContact CB-CD1 4.43Å; E218-L300 HydrophobicContact CG-CD1 3.88Å
219T93.3Very high92Very high41 Ų4125.8 Ų25.825%0.25214%0.137SC..Hα-helixtrans-66.7-51.7175.1-61.20000111.2I161 S215 V216 W217 L221 S222 E223I161-T219 HydrophobicContact CG1-CG2 4.16Å; I161-T219 HydrophobicContact CG2-CG2 4.1Å; S215-T219 PolarHBondContact O-N 2.93Å; S215-T219 PolarHBondContact O-OG1 3.03Å; S215-T219 VanDerWaalsContact O-OG1 3.12Å; V216-T219 PolarHBondContact O-N 2.97Å; W217-T219 VanDerWaalsContact C-N 3.29Å; W217-T219 PolarHBondContact O-N 3.48Å; T219-L221 VanDerWaalsContact C-N 3.32Å; T219-L221 PolarHBondContact O-N 3.42Å; T219-S222 WeakPolarHBondContact O-CA 3.4Å; T219-S222 WeakPolarHBondContact O-CB 3.45Å; T219-S222 PolarHBondContact O-N 3.17Å; T219-E223 PolarHBondContact O-N 3.15Å
220L92.8Very high91.9Very high22 Ų2228.4 Ų28.412%0.11516%0.156CC..Hα-helixtrans-57.3-42.6178.1-72.6171.5000112.5I161 V216 W217 S222 F224 L257I161-L220 HydrophobicContact CD1-CD2 3.55Å; I161-L220 HydrophobicContact CD1-CG 4.29Å; V216-L220 HydrophobicContact CG1-CD1 3.89Å; V216-L220 HydrophobicContact CG1-CG 4.36Å; V216-L220 WeakPolarHBondContact O-CG 3.43Å; V216-L220 PolarHBondContact O-N 3.03Å; W217-L220 PolarHBondContact O-N 2.66Å; L220-S222 VanDerWaalsContact C-N 3.32Å; L220-F224 PolarHBondContact O-N 3.25Å; L220-F224 VanDerWaalsContact O-N 3.1Å; L220-L257 HydrophobicContact CB-CD1 4.45Å; L220-L257 HydrophobicContact CD1-CD1 4.42Å
221L93.5Very high91.8Very high0 Ų027.4 Ų27.40%015%0.152CC..Hα-helixtrans-67.9-35.2176-176.159.4000111.6W217 T219 F224 V225 L254 L257 L300 R303 L304W217-L221 VanDerWaalsContact O-CB 3.32Å; W217-L221 WeakPolarHBondContact O-CB 3.33Å; W217-L221 PolarHBondContact O-N 3.3Å; T219-L221 VanDerWaalsContact C-N 3.32Å; T219-L221 PolarHBondContact O-N 3.42Å; L221-F224 PolarHBondContact O-N 2.98Å; L221-V225 HydrophobicContact CD1-CG2 4.48Å; L221-V225 HydrophobicContact CG-CG2 4.45Å; L221-V225 VanDerWaalsContact O-CG2 3.25Å; L221-V225 WeakPolarHBondContact O-CG2 3.39Å; L221-V225 PolarHBondContact O-N 3.3Å; L221-L254 HydrophobicContact CD1-CD1 3.96Å; L221-L257 HydrophobicContact CB-CD2 3.96Å; L221-L257 HydrophobicContact CD1-CD2 4.12Å; L221-L300 HydrophobicContact CB-CD1 4.09Å; L221-L300 HydrophobicContact CD2-CD1 3.52Å; L221-L300 HydrophobicContact CD2-CG 4.13Å; L221-L300 HydrophobicContact CG-CD1 4.46Å; L221-R303 HydrophobicContact CD2-CB 3.61Å; L221-R303 HydrophobicContact CG-CB 4.49Å; L221-L304 HydrophobicContact CD1-CD1 4.39Å; L221-L304 HydrophobicContact CD2-CB 4.32Å
222S93Very high91.6Very high23 Ų2329.8 Ų29.816%0.16117%0.167CC..Hα-helixtrans-66.7-43.7178.1-60.10000111.2E218 T219 L220 F224 V225 D226 R303E218-S222 VanDerWaalsContact O-CB 3.31Å; E218-S222 WeakPolarHBondContact O-CB 3.3Å; E218-S222 PolarHBondContact O-N 3.1Å; E218-S222 PolarHBondContact O-OG 2.76Å; T219-S222 WeakPolarHBondContact O-CA 3.4Å; T219-S222 WeakPolarHBondContact O-CB 3.45Å; T219-S222 PolarHBondContact O-N 3.17Å; L220-S222 VanDerWaalsContact C-N 3.32Å; S222-F224 VanDerWaalsContact C-N 3.28Å; S222-F224 PolarHBondContact O-N 3.35Å; S222-V225 PolarHBondContact O-N 2.83Å; S222-V225 VanDerWaalsContact O-N 3.15Å; S222-D226 PolarHBondContact O-N 3.45Å; S222-R303 PolarHBondContact OG-NH1 3.43Å; S222-R303 PolarHBondContact OG-NH2 2.83Å
223E92Very high91.6Very high81 Ų8135.6 Ų35.638%0.37919%0.194SC..Hα-helixtrans-59.2-40.2173.2-68.2179165.300112T219 D226 A227T219-E223 PolarHBondContact O-N 3.15Å; E223-D226 PolarHBondContact O-N 2.82Å; E223-A227 PolarHBondContact O-N 3.02Å
224F91.8Very high91.5Very high15 Ų1538.5 Ų38.57%0.06621%0.208CC..Hα-helixtrans-65.3-40.3175.7-172.4-94.9000112.8F33 L220 L221 S222 A227 L228 R250 A253 L254 C307 L311F33-F224 HydrophobicContact CE1-CD2 4.5Å; L220-F224 PolarHBondContact O-N 3.25Å; L220-F224 VanDerWaalsContact O-N 3.1Å; L221-F224 PolarHBondContact O-N 2.98Å; S222-F224 VanDerWaalsContact C-N 3.28Å; S222-F224 PolarHBondContact O-N 3.35Å; F224-A227 PolarHBondContact O-N 2.9Å; F224-L228 HydrophobicContact CD1-CD1 3.76Å; F224-L228 HydrophobicContact CD1-CG 4.41Å; F224-L228 HydrophobicContact CE1-CD1 3.32Å; F224-L228 HydrophobicContact CE1-CG 4.09Å; F224-L228 HydrophobicContact CZ-CD1 4.11Å; F224-L228 WeakPolarHBondContact O-CG 3.5Å; F224-L228 PolarHBondContact O-N 2.79Å; F224-L228 VanDerWaalsContact O-N 3.17Å; F224-R250 HydrophobicContact CE2-CB 4.17Å; F224-R250 HydrophobicContact CZ-CB 4.05Å; F224-R250 WeakPolarHBondContact CZ-O 3.45Å; F224-A253 HydrophobicContact CE2-CB 4.41Å; F224-L254 HydrophobicContact CD1-CD1 3.95Å; F224-L254 HydrophobicContact CE1-CB 4.07Å; F224-L254 HydrophobicContact CE1-CD1 3.83Å; F224-L254 HydrophobicContact CE1-CD2 3.91Å; F224-L254 HydrophobicContact CE1-CG 4.17Å; F224-L254 HydrophobicContact CE2-CB 4.46Å; F224-L254 HydrophobicContact CZ-CB 3.87Å; F224-L254 HydrophobicContact CZ-CD1 4.44Å; F224-L254 HydrophobicContact CZ-CD2 4.38Å; F224-L254 HydrophobicContact CZ-CG 4.47Å; F224-C307 HydrophobicContact CD1-CB 4.41Å; F224-C307 HydrophobicContact CE1-CB 4.11Å; F224-L311 HydrophobicContact CE1-CD1 4.45Å; F224-L311 HydrophobicContact CZ-CD1 4.14Å
225V92.8Very high91.3Very high32 Ų3240.8 Ų40.819%0.19422%0.22CC..Hα-helixtrans-64.7-44.3175.8168.70000110.8L221 S222 A227 L228 E229 C307L221-V225 HydrophobicContact CD1-CG2 4.48Å; L221-V225 HydrophobicContact CG-CG2 4.45Å; L221-V225 VanDerWaalsContact O-CG2 3.25Å; L221-V225 WeakPolarHBondContact O-CG2 3.39Å; L221-V225 PolarHBondContact O-N 3.3Å; S222-V225 PolarHBondContact O-N 2.83Å; S222-V225 VanDerWaalsContact O-N 3.15Å; V225-A227 VanDerWaalsContact C-N 3.29Å; V225-A227 PolarHBondContact O-N 3.04Å; V225-L228 CarbonylContact O-C 3.53Å; V225-L228 WeakPolarHBondContact O-CA 3.36Å; V225-L228 WeakPolarHBondContact O-CB 3.11Å; V225-L228 PolarHBondContact O-N 3Å; V225-E229 PolarHBondContact O-N 3.09Å; V225-C307 WeakPolarHBondContact CG2-SG 3.27Å
226D92.5Very high91.2Very high94 Ų9448.8 Ų48.850%0.50325%0.252SS..Hα-helixtrans-62.2-39.3178.7-63.4-12.1000110.6S222 E223 L228 E229S222-D226 PolarHBondContact O-N 3.45Å; E223-D226 PolarHBondContact O-N 2.82Å; D226-L228 VanDerWaalsContact C-N 3.26Å; D226-L228 PolarHBondContact O-N 3.17Å; D226-E229 WeakPolarHBondContact O-CB 3.29Å; D226-E229 PolarHBondContact O-N 3.3Å
227A89.8Confident91.1Very high27 Ų2755.9 Ų55.922%0.22329%0.289CS..Hα-helixtrans-65.4-26.5173.800000113.7Y36 E223 F224 V225 S230 R250Y36-A227 HydrophobicContact CE1-CB 3.97Å; E223-A227 PolarHBondContact O-N 3.02Å; F224-A227 PolarHBondContact O-N 2.9Å; V225-A227 VanDerWaalsContact C-N 3.29Å; V225-A227 PolarHBondContact O-N 3.04Å; A227-S230 PolarHBondContact O-OG 3.14Å; A227-R250 PolarHBondContact O-NH1 3.02Å
228L89.7Confident90.8Very high4 Ų458.5 Ų58.52%0.02132%0.317CS..Hα-helixtrans-83.5-21.8174.7-74.6174.6000113.1F224 V225 D226 S230 V231 V232 C307 L310 L311F224-L228 HydrophobicContact CD1-CD1 3.76Å; F224-L228 HydrophobicContact CD1-CG 4.41Å; F224-L228 HydrophobicContact CE1-CD1 3.32Å; F224-L228 HydrophobicContact CE1-CG 4.09Å; F224-L228 HydrophobicContact CZ-CD1 4.11Å; F224-L228 WeakPolarHBondContact O-CG 3.5Å; F224-L228 PolarHBondContact O-N 2.79Å; F224-L228 VanDerWaalsContact O-N 3.17Å; V225-L228 CarbonylContact O-C 3.53Å; V225-L228 WeakPolarHBondContact O-CA 3.36Å; V225-L228 WeakPolarHBondContact O-CB 3.11Å; V225-L228 PolarHBondContact O-N 3Å; D226-L228 VanDerWaalsContact C-N 3.26Å; D226-L228 PolarHBondContact O-N 3.17Å; L228-S230 VanDerWaalsContact C-N 3.31Å; L228-S230 PolarHBondContact O-N 3.31Å; L228-V231 WeakPolarHBondContact O-CA 3.36Å; L228-V231 VanDerWaalsContact O-CB 3.3Å; L228-V231 WeakPolarHBondContact O-CB 3.32Å; L228-V231 PolarHBondContact O-N 3.22Å; L228-V232 WeakPolarHBondContact O-CG2 3.2Å; L228-V232 PolarHBondContact O-N 3.26Å; L228-C307 HydrophobicContact CD1-CB 4.19Å; L228-L310 HydrophobicContact CB-CD2 4.28Å; L228-L310 HydrophobicContact CD1-CD2 4.26Å; L228-L310 HydrophobicContact CD2-CD2 4.47Å; L228-L311 HydrophobicContact CD2-CD2 4.26Å
229E90.7Very high90.3Very high110 Ų11061.8 Ų61.851%0.51433%0.332SS..Hα-helixtrans-55.6-47.2179.9-170.8171.8-166.600111.3V225 D226 V231 V232 E233V225-E229 PolarHBondContact O-N 3.09Å; D226-E229 WeakPolarHBondContact O-CB 3.29Å; D226-E229 PolarHBondContact O-N 3.3Å; E229-V231 PolarHBondContact O-N 2.95Å; E229-V232 WeakPolarHBondContact O-CB 3.23Å; E229-V232 PolarHBondContact O-N 2.79Å; E229-E233 PolarHBondContact O-N 3.4Å
230S89Confident89.7Confident56 Ų5660.4 Ų60.439%0.39232%0.323SS..Hα-helixtrans-55.9-34.1174.264.80000114A227 L228 Q234A227-S230 PolarHBondContact O-OG 3.14Å; L228-S230 VanDerWaalsContact C-N 3.31Å; L228-S230 PolarHBondContact O-N 3.31Å; S230-Q234 WeakPolarHBondContact O-CG 3.39Å; S230-Q234 PolarHBondContact O-N 2.65Å
231V89Confident89.1Confident7 Ų762.8 Ų62.84%0.04234%0.342CS..Hα-helixtrans-73.9-41178.5177.90000110.3L228 E229 E233 Q234 L235 L242 L314L228-V231 WeakPolarHBondContact O-CA 3.36Å; L228-V231 VanDerWaalsContact O-CB 3.3Å; L228-V231 WeakPolarHBondContact O-CB 3.32Å; L228-V231 PolarHBondContact O-N 3.22Å; E229-V231 PolarHBondContact O-N 2.95Å; V231-E233 VanDerWaalsContact C-N 3.3Å; V231-E233 PolarHBondContact O-N 3.01Å; V231-Q234 PolarHBondContact O-N 2.91Å; V231-L235 WeakPolarHBondContact O-CB 3.47Å; V231-L235 PolarHBondContact O-N 3.37Å; V231-L242 HydrophobicContact CB-CD1 4.16Å; V231-L242 HydrophobicContact CG1-CD1 3.31Å; V231-L242 HydrophobicContact CG1-CG 4.38Å; V231-L242 HydrophobicContact CG2-CD1 3.71Å; V231-L242 HydrophobicContact CG2-CG 4.35Å; V231-L314 HydrophobicContact CG1-CD1 3.74Å; V231-L314 HydrophobicContact CG1-CD2 4Å
232V89.3Confident88.7Confident51 Ų5163.7 Ų63.731%0.30935%0.346SS..Hα-helixtrans-63.5-38.6176.2176.60000110.7L228 E229 L235 K236 L310L228-V232 WeakPolarHBondContact O-CG2 3.2Å; L228-V232 PolarHBondContact O-N 3.26Å; E229-V232 WeakPolarHBondContact O-CB 3.23Å; E229-V232 PolarHBondContact O-N 2.79Å; V232-L235 WeakPolarHBondContact O-CB 3.06Å; V232-L235 PolarHBondContact O-N 2.88Å; V232-K236 PolarHBondContact O-N 3.27Å; V232-L310 HydrophobicContact CG2-CD1 4.17Å; V232-L310 HydrophobicContact CG2-CD2 3.44Å; V232-L310 VanDerWaalsContact CG2-CD2 3.44Å; V232-L310 HydrophobicContact CG2-CG 4.47Å
233E91.4Very high88.5Confident122 Ų12265.4 Ų65.457%0.5736%0.358SS*.Hα-helixtrans-62.1-42174.6-71.4-173.8155.800112.6E229 V231 K236 L237E229-E233 PolarHBondContact O-N 3.4Å; V231-E233 VanDerWaalsContact C-N 3.3Å; V231-E233 PolarHBondContact O-N 3.01Å; E233-K236 WeakPolarHBondContact O-CB 3.4Å; E233-K236 PolarHBondContact O-N 2.96Å; E233-L237 PolarHBondContact O-N 3.15Å
234Q88.8Confident88.3Confident66 Ų6666.9 Ų66.931%0.30836%0.363SS..Hα-helixtrans-64.9-41.8173.6-67.9179.13.700111.7S230 V231 K236 L237 G238 H239 S241S230-Q234 WeakPolarHBondContact O-CG 3.39Å; S230-Q234 PolarHBondContact O-N 2.65Å; V231-Q234 PolarHBondContact O-N 2.91Å; Q234-K236 VanDerWaalsContact C-N 3.26Å; Q234-K236 PolarHBondContact O-N 3.02Å; Q234-L237 WeakPolarHBondContact O-CA 3.33Å; Q234-L237 WeakPolarHBondContact O-CB 3.45Å; Q234-L237 PolarHBondContact O-N 3.5Å; Q234-G238 PolarHBondContact O-N 2.9Å; Q234-H239 CarbonylContact C-O 3.57Å; Q234-H239 WeakPolarHBondContact CB-O 3.26Å; Q234-H239 PolarHBondContact O-N 3.19Å; Q234-H239 VanDerWaalsContact O-N 3.16Å; Q234-S241 PolarHBondContact NE2-OG 3.23Å; Q234-S241 PolarHBondContact OE1-OG 3.38Å
235L87.8Confident88.3Confident48 Ų4869.4 Ų69.425%0.25138%0.381SS..Hα-helixtrans-61.3-36.4178.3-17464.7000111.6V231 V232 L237 G238 H239 I240 L310 L313 L314V231-L235 WeakPolarHBondContact O-CB 3.47Å; V231-L235 PolarHBondContact O-N 3.37Å; V232-L235 WeakPolarHBondContact O-CB 3.06Å; V232-L235 PolarHBondContact O-N 2.88Å; L235-L237 PolarHBondContact O-N 3.46Å; L235-G238 WeakPolarHBondContact O-CA 3.49Å; L235-G238 PolarHBondContact O-N 3.27Å; L235-H239 PolarHBondContact N-O 3.36Å; L235-I240 HydrophobicContact CD1-CD1 3.67Å; L235-I240 HydrophobicContact CD1-CG1 3.85Å; L235-L310 HydrophobicContact CD2-CD1 4.16Å; L235-L313 HydrophobicContact CD1-CD2 4.17Å; L235-L313 HydrophobicContact CD2-CD2 3.77Å; L235-L314 HydrophobicContact CD2-CD2 4.49Å
236K89.9Confident88.3Confident187 Ų18769.9 Ų69.981%0.81338%0.381SS*.Hα-helixtrans-59.5-32.8172.8-176.6-177.2176.3-1760112.6V232 E233 Q234 G238V232-K236 PolarHBondContact O-N 3.27Å; E233-K236 WeakPolarHBondContact O-CB 3.4Å; E233-K236 PolarHBondContact O-N 2.96Å; Q234-K236 VanDerWaalsContact C-N 3.26Å; Q234-K236 PolarHBondContact O-N 3.02Å; K236-G238 PolarHBondContact O-N 3.43Å
237L90.8Very high88.2Confident149 Ų14965.5 Ų65.578%0.7836%0.358SS*.THydrogen-bonded Turntrans-81.81.1174.7-59.5175000112.9E233 Q234 L235 H239E233-L237 PolarHBondContact O-N 3.15Å; Q234-L237 WeakPolarHBondContact O-CA 3.33Å; Q234-L237 WeakPolarHBondContact O-CB 3.45Å; Q234-L237 PolarHBondContact O-N 3.5Å; L235-L237 PolarHBondContact O-N 3.46Å; L237-H239 VanDerWaalsContact C-N 3.27Å; L237-H239 PolarHBondContact O-N 3.47Å
238G85.9Confident88.3Confident57 Ų5768.9 Ų68.959%0.58837%0.372SS*.THydrogen-bonded Turntrans76.99.9-177.200000114.2Q234 L235 K236Q234-G238 PolarHBondContact O-N 2.9Å; L235-G238 WeakPolarHBondContact O-CA 3.49Å; L235-G238 PolarHBondContact O-N 3.27Å; K236-G238 PolarHBondContact O-N 3.43Å
239H82.5Confident88.6Confident105 Ų10576.6 Ų76.649%0.48640%0.401SS..  trans-112.6138.3-179-175.3-97.7000111.3Q234 L235 L237Q234-H239 CarbonylContact C-O 3.57Å; Q234-H239 WeakPolarHBondContact CB-O 3.26Å; Q234-H239 PolarHBondContact O-N 3.19Å; Q234-H239 VanDerWaalsContact O-N 3.16Å; L235-H239 PolarHBondContact N-O 3.36Å; L237-H239 VanDerWaalsContact C-N 3.27Å; L237-H239 PolarHBondContact O-N 3.47Å
240I80.5Confident88.7Confident12 Ų1272.5 Ų72.56%0.06238%0.38CS..  trans-123.4114.2173.1-53.5-169.7000107.5L235 L242 L314 N317L235-I240 HydrophobicContact CD1-CD1 3.67Å; L235-I240 HydrophobicContact CD1-CG1 3.85Å; I240-L242 HydrophobicContact CG2-CB 3.99Å; I240-L314 HydrophobicContact CD1-CD2 3.77Å; I240-L314 HydrophobicContact CG2-CD2 4.27Å; I240-N317 HydrophobicContact CD1-CB 3.83Å; I240-N317 WeakPolarHBondContact CD1-ND2 3.49Å
241S79.7Confident88.9Confident73 Ų7370.6 Ų70.651%0.5137%0.368SS..  trans-86.8-13.8175.667.10000113.4Q234Q234-S241 PolarHBondContact NE2-OG 3.23Å; Q234-S241 PolarHBondContact OE1-OG 3.38Å
242L85.9Confident89.1Confident18 Ų1871.9 Ų71.99%0.09438%0.383CS..  trans-69.2132.5-177.5-74.6165.6000112.1V231 I240 E246 V247 L314 I318V231-L242 HydrophobicContact CB-CD1 4.16Å; V231-L242 HydrophobicContact CG1-CD1 3.31Å; V231-L242 HydrophobicContact CG1-CG 4.38Å; V231-L242 HydrophobicContact CG2-CD1 3.71Å; V231-L242 HydrophobicContact CG2-CG 4.35Å; I240-L242 HydrophobicContact CG2-CB 3.99Å; L242-E246 HydrophobicContact CD2-CB 4.04Å; L242-E246 HydrophobicContact CD2-CG 3.36Å; L242-V247 HydrophobicContact CB-CG2 3.99Å; L242-V247 HydrophobicContact CD1-CG2 4.3Å; L242-L314 HydrophobicContact CD1-CD1 3.86Å; L242-I318 WeakPolarHBondContact O-CD1 3.22Å
243S88.3Confident89.2Confident59 Ų5970.6 Ų70.641%0.41338%0.377SS..  trans-80.8156.2170.571.30000111.1P245 E246 V247S243-P245 WeakPolarHBondContact OG-CD 3.34Å; S243-P245 WeakPolarHBondContact OG-CG 3.25Å; S243-E246 WeakPolarHBondContact O-CB 3.31Å; S243-E246 PolarHBondContact O-N 3.15Å; S243-E246 WeakPolarHBondContact OG-CB 3.43Å; S243-E246 PolarHBondContact OG-N 3.41Å; S243-V247 PolarHBondContact O-N 3.26Å; S243-V247 VanDerWaalsContact O-N 3.08Å
244K89.3Confident89.3Confident112 Ų11264.8 Ų64.849%0.48735%0.351SS..Hα-helixtrans-50.5-48.8173.8-167.7171.9-175.6174.10113.8E246 V247 L248 I318K244-E246 PolarHBondContact O-N 3.16Å; K244-V247 PolarHBondContact O-N 3.44Å; K244-L248 HydrophobicContact CG-CD1 4.28Å; K244-L248 WeakPolarHBondContact O-CG 3.36Å; K244-L248 PolarHBondContact O-N 3.12Å; K244-I318 HydrophobicContact CB-CG2 3.99Å; K244-I318 HydrophobicContact CG-CG2 4.43Å
245P92Very high89.4Confident69 Ų6966.6 Ų66.645%0.44836%0.357SS..Hα-helixtrans-63.5-30.6178.623.8-33.7000112.6S243 L248 R249S243-P245 WeakPolarHBondContact OG-CD 3.34Å; S243-P245 WeakPolarHBondContact OG-CG 3.25Å; P245-L248 PolarHBondContact O-N 3.08Å; P245-R249 VanDerWaalsContact O-CG 3.3Å; P245-R249 WeakPolarHBondContact O-CG 3.5Å; P245-R249 PolarHBondContact O-N 3.4Å
246E91Very high89.6Confident41 Ų4168.3 Ų68.319%0.19237%0.365CS..Hα-helixtrans-70.5-42.1178-170.759-160.100112.1L242 S243 K244 L248 R249 R250L242-E246 HydrophobicContact CD2-CB 4.04Å; L242-E246 HydrophobicContact CD2-CG 3.36Å; S243-E246 WeakPolarHBondContact O-CB 3.31Å; S243-E246 PolarHBondContact O-N 3.15Å; S243-E246 WeakPolarHBondContact OG-CB 3.43Å; S243-E246 PolarHBondContact OG-N 3.41Å; K244-E246 PolarHBondContact O-N 3.16Å; E246-L248 VanDerWaalsContact C-N 3.32Å; E246-L248 PolarHBondContact O-N 2.81Å; E246-R249 PolarHBondContact O-N 3.23Å; E246-R249 IonicContact OE2-NH1 3.78Å; E246-R250 WeakPolarHBondContact O-CG 3.38Å; E246-R250 PolarHBondContact O-N 3.12Å; E246-R250 IonicContact OE1-CZ 3.96Å; E246-R250 IonicContact OE1-NE 3.41Å; E246-R250 PolarHBondContact OE1-NE 2.79Å; E246-R250 IonicContact OE1-NH2 3.54Å
247V91.5Very high89.6Confident3 Ų360.1 Ų60.12%0.01833%0.33CS..Hα-helixtrans-60.6-43.4172.3177.30000110.8L242 S243 K244 R249 R250 A251 L311 L314 D315 I318L242-V247 HydrophobicContact CB-CG2 3.99Å; L242-V247 HydrophobicContact CD1-CG2 4.3Å; S243-V247 PolarHBondContact O-N 3.26Å; S243-V247 VanDerWaalsContact O-N 3.08Å; K244-V247 PolarHBondContact O-N 3.44Å; V247-R249 PolarHBondContact O-N 3.02Å; V247-R250 PolarHBondContact O-N 3.15Å; V247-A251 WeakPolarHBondContact O-CB 3.49Å; V247-A251 PolarHBondContact O-N 3.11Å; V247-L311 HydrophobicContact CG1-CD2 4.34Å; V247-L314 HydrophobicContact CG1-CB 4.34Å; V247-L314 HydrophobicContact CG2-CB 4.16Å; V247-D315 HydrophobicContact CG1-CB 4.1Å; V247-I318 HydrophobicContact CB-CD1 4.47Å; V247-I318 HydrophobicContact CG2-CD1 3.61Å
248L92.5Very high89.6Confident97 Ų9757.6 Ų57.651%0.50831%0.31SS..Hα-helixtrans-63.9-38.7177.6-71173.9000112.8K244 P245 E246 A251 G252K244-L248 HydrophobicContact CG-CD1 4.28Å; K244-L248 WeakPolarHBondContact O-CG 3.36Å; K244-L248 PolarHBondContact O-N 3.12Å; P245-L248 PolarHBondContact O-N 3.08Å; E246-L248 VanDerWaalsContact C-N 3.32Å; E246-L248 PolarHBondContact O-N 2.81Å; L248-A251 PolarHBondContact O-N 3.04Å; L248-G252 PolarHBondContact O-N 2.98Å
249R94.2Very high89.7Confident167 Ų16759.6 Ų59.663%0.6330%0.304SS*.Hα-helixtrans-62.3-46.8174.5-77.6173-178.6157.2-2.5111.6P245 E246 V247 G252 A253P245-R249 VanDerWaalsContact O-CG 3.3Å; P245-R249 WeakPolarHBondContact O-CG 3.5Å; P245-R249 PolarHBondContact O-N 3.4Å; E246-R249 PolarHBondContact O-N 3.23Å; E246-R249 IonicContact OE2-NH1 3.78Å; V247-R249 PolarHBondContact O-N 3.02Å; R249-G252 PolarHBondContact O-N 3.12Å; R249-A253 PolarHBondContact O-N 2.97Å
250R93.3Very high89.8Confident23 Ų2356.9 Ų56.99%0.08729%0.29CS..Hα-helixtrans-64.3-41.6177.4-67.9-178.6-168.9-141.66.2112Y36 F224 A227 E246 V247 A253 L254 L311Y36-R250 PolarHBondContact OH-NH2 2.86Å; F224-R250 HydrophobicContact CE2-CB 4.17Å; F224-R250 HydrophobicContact CZ-CB 4.05Å; F224-R250 WeakPolarHBondContact CZ-O 3.45Å; A227-R250 PolarHBondContact O-NH1 3.02Å; E246-R250 WeakPolarHBondContact O-CG 3.38Å; E246-R250 PolarHBondContact O-N 3.12Å; E246-R250 IonicContact OE1-CZ 3.96Å; E246-R250 IonicContact OE1-NE 3.41Å; E246-R250 PolarHBondContact OE1-NE 2.79Å; E246-R250 IonicContact OE1-NH2 3.54Å; V247-R250 PolarHBondContact O-N 3.15Å; R250-A253 PolarHBondContact O-N 3.41Å; R250-L254 WeakPolarHBondContact O-CB 2.99Å; R250-L254 PolarHBondContact O-N 3.4Å; R250-L311 HydrophobicContact CB-CD1 4.48Å; R250-L311 HydrophobicContact CB-CD2 3.84Å
251A92.9Very high90Very high16 Ų1656.6 Ų56.613%0.13229%0.288CS..Hα-helixtrans-59.9-46.9173.100000111.1V247 L248 A253 L254 F255 L311V247-A251 WeakPolarHBondContact O-CB 3.49Å; V247-A251 PolarHBondContact O-N 3.11Å; L248-A251 PolarHBondContact O-N 3.04Å; A251-A253 PolarHBondContact O-N 3.45Å; A251-L254 PolarHBondContact O-N 3.09Å; A251-F255 HydrophobicContact CB-CD2 4.43Å; A251-F255 HydrophobicContact CB-CE2 4.5Å; A251-F255 WeakPolarHBondContact O-CB 3.49Å; A251-F255 WeakPolarHBondContact O-CD2 3.3Å; A251-F255 PolarHBondContact O-N 3.18Å; A251-L311 HydrophobicContact CB-CD1 4.19Å
252G93.8Very high90Very high34 Ų3456.5 Ų56.535%0.35128%0.282SS..Hα-helixtrans-57.6-46.8175.400000112.8L248 R249 L254 F255 M256L248-G252 PolarHBondContact O-N 2.98Å; R249-G252 PolarHBondContact O-N 3.12Å; G252-L254 PolarHBondContact O-N 3.23Å; G252-F255 PolarHBondContact O-N 3.31Å; G252-M256 WeakPolarHBondContact O-CG 3.44Å; G252-M256 PolarHBondContact O-N 2.95Å
253A92.2Very high89.6Confident24 Ų2460.7 Ų60.720%0.19830%0.304CS..Hα-helixtrans-60.3-44.3177.100000112.2F33 F224 R249 R250 A251 M256 L257F33-A253 HydrophobicContact CE2-CB 4.45Å; F33-A253 HydrophobicContact CZ-CB 3.89Å; F224-A253 HydrophobicContact CE2-CB 4.41Å; R249-A253 PolarHBondContact O-N 2.97Å; R250-A253 PolarHBondContact O-N 3.41Å; A251-A253 PolarHBondContact O-N 3.45Å; A253-M256 PolarHBondContact O-N 3.15Å; A253-L257 PolarHBondContact O-N 2.9Å
254L92.7Very high88.8Confident1 Ų160.4 Ų60.41%0.00530%0.298CS..Hα-helixtrans-67.4-39.5177.1-171.563.3000112.3L221 F224 R250 A251 G252 M256 L257 R258 L304 C307 M308 L311L221-L254 HydrophobicContact CD1-CD1 3.96Å; F224-L254 HydrophobicContact CD1-CD1 3.95Å; F224-L254 HydrophobicContact CE1-CB 4.07Å; F224-L254 HydrophobicContact CE1-CD1 3.83Å; F224-L254 HydrophobicContact CE1-CD2 3.91Å; F224-L254 HydrophobicContact CE1-CG 4.17Å; F224-L254 HydrophobicContact CE2-CB 4.46Å; F224-L254 HydrophobicContact CZ-CB 3.87Å; F224-L254 HydrophobicContact CZ-CD1 4.44Å; F224-L254 HydrophobicContact CZ-CD2 4.38Å; F224-L254 HydrophobicContact CZ-CG 4.47Å; R250-L254 WeakPolarHBondContact O-CB 2.99Å; R250-L254 PolarHBondContact O-N 3.4Å; A251-L254 PolarHBondContact O-N 3.09Å; G252-L254 PolarHBondContact O-N 3.23Å; L254-M256 VanDerWaalsContact C-N 3.33Å; L254-L257 PolarHBondContact O-N 3.49Å; L254-R258 WeakPolarHBondContact O-CB 3.33Å; L254-R258 PolarHBondContact O-N 2.97Å; L254-L304 HydrophobicContact CD1-CD1 3.55Å; L254-L304 HydrophobicContact CD1-CG 4.06Å; L254-L304 HydrophobicContact CG-CD1 4.2Å; L254-L304 HydrophobicContact CG-CG 4.44Å; L254-C307 HydrophobicContact CD1-CB 4.16Å; L254-C307 HydrophobicContact CD2-CB 3.41Å; L254-C307 VanDerWaalsContact CD2-CB 3.41Å; L254-C307 HydrophobicContact CG-CB 4.46Å; L254-M308 HydrophobicContact CB-SD 4.42Å; L254-M308 HydrophobicContact CD2-CB 4.37Å; L254-M308 HydrophobicContact CD2-CG 3.63Å; L254-M308 HydrophobicContact CD2-SD 3.53Å; L254-M308 VanDerWaalsContact CD2-SD 3.53Å; L254-M308 HydrophobicContact CG-CG 4.3Å; L254-M308 HydrophobicContact CG-SD 4.01Å; L254-L311 HydrophobicContact CB-CD1 4.39Å; L254-L311 HydrophobicContact CD2-CD1 3.76Å
255F91.9Very high87.1Confident103 Ų10356.7 Ų56.745%0.45229%0.286SS..Hα-helixtrans-63.2-38.7173.5-86.2-63.2000112A251 G252 R258 H259 M308A251-F255 HydrophobicContact CB-CD2 4.43Å; A251-F255 HydrophobicContact CB-CE2 4.5Å; A251-F255 WeakPolarHBondContact O-CB 3.49Å; A251-F255 WeakPolarHBondContact O-CD2 3.3Å; A251-F255 PolarHBondContact O-N 3.18Å; G252-F255 PolarHBondContact O-N 3.31Å; F255-R258 WeakPolarHBondContact O-CB 3.49Å; F255-R258 PolarHBondContact O-N 3.25Å; F255-H259 VanDerWaalsContact O-CB 3.26Å; F255-H259 WeakPolarHBondContact O-CB 3.42Å; F255-H259 PolarHBondContact O-N 2.63Å; F255-M308 HydrophobicContact CD1-SD 4.48Å; F255-M308 HydrophobicContact CD2-CE 4.31Å; F255-M308 HydrophobicContact CD2-SD 4.37Å; F255-M308 HydrophobicContact CE1-CE 3.81Å; F255-M308 HydrophobicContact CE1-SD 4.24Å; F255-M308 HydrophobicContact CE2-CE 3.49Å; F255-M308 VanDerWaalsContact CE2-CE 3.49Å; F255-M308 HydrophobicContact CE2-SD 4.11Å; F255-M308 HydrophobicContact CZ-CE 3.19Å; F255-M308 HydrophobicContact CZ-SD 4.05Å
256M90.8Very high85.6Confident85 Ų8560 Ų6042%0.41930%0.3SS..Hα-helixtrans-63.6-43.4174.3-75.8-62.4-61.100111.5G252 A253 L254 H259 R260G252-M256 WeakPolarHBondContact O-CG 3.44Å; G252-M256 PolarHBondContact O-N 2.95Å; A253-M256 PolarHBondContact O-N 3.15Å; L254-M256 VanDerWaalsContact C-N 3.33Å; M256-H259 PolarHBondContact O-N 3.35Å; M256-R260 VanDerWaalsContact O-CG 3.3Å; M256-R260 WeakPolarHBondContact O-CG 3.33Å; M256-R260 PolarHBondContact O-N 2.88Å
257L90.2Very high83.9Confident14 Ų1458.3 Ų58.37%0.07329%0.292CS..Hα-helixtrans-62.1-45.1174.7-177.758.5000111.5W217 L220 L221 A253 L254 H259 R260 I261 L304W217-L257 HydrophobicContact CG-CD1 4.37Å; L220-L257 HydrophobicContact CB-CD1 4.45Å; L220-L257 HydrophobicContact CD1-CD1 4.42Å; L221-L257 HydrophobicContact CB-CD2 3.96Å; L221-L257 HydrophobicContact CD1-CD2 4.12Å; A253-L257 PolarHBondContact O-N 2.9Å; L254-L257 PolarHBondContact O-N 3.49Å; L257-H259 VanDerWaalsContact C-N 3.33Å; L257-H259 PolarHBondContact O-N 3.01Å; L257-R260 PolarHBondContact O-N 3.09Å; L257-I261 HydrophobicContact CD1-CD1 4.17Å; L257-I261 HydrophobicContact CG-CD1 3.97Å; L257-I261 WeakPolarHBondContact O-CD1 3.49Å; L257-I261 WeakPolarHBondContact O-CG1 3.48Å; L257-I261 PolarHBondContact O-N 3Å; L257-L304 HydrophobicContact CD2-CD1 4.47Å; L257-L304 HydrophobicContact CG-CD1 4.41Å
258R89.8Confident82.4Confident96 Ų9662.7 Ų62.736%0.36232%0.315SS..Hα-helixtrans-57.7-45.7173.8-172.3176.8-170.2162.2-1.2112L254 F255 R260 I261 N262 L304L254-R258 WeakPolarHBondContact O-CB 3.33Å; L254-R258 PolarHBondContact O-N 2.97Å; F255-R258 WeakPolarHBondContact O-CB 3.49Å; F255-R258 PolarHBondContact O-N 3.25Å; R258-R260 VanDerWaalsContact C-N 3.33Å; R258-I261 PolarHBondContact O-N 3.37Å; R258-N262 VanDerWaalsContact O-CB 3.25Å; R258-N262 WeakPolarHBondContact O-CB 3.43Å; R258-N262 PolarHBondContact O-N 3.1Å; R258-L304 HydrophobicContact CB-CD1 4.11Å; R258-L304 HydrophobicContact CB-CD2 3.64Å; R258-L304 HydrophobicContact CB-CG 4.44Å; R258-L304 HydrophobicContact CG-CD2 3.44Å; R258-L304 VanDerWaalsContact CG-CD2 3.44Å
259H87.8Confident81.4Confident100 Ų10063.9 Ų63.946%0.46332%0.322SS..Hα-helixtrans-62.3-43.2-179.1-179.554.3000110.9F255 M256 L257 N262 L263F255-H259 VanDerWaalsContact O-CB 3.26Å; F255-H259 WeakPolarHBondContact O-CB 3.42Å; F255-H259 PolarHBondContact O-N 2.63Å; M256-H259 PolarHBondContact O-N 3.35Å; L257-H259 VanDerWaalsContact C-N 3.33Å; L257-H259 PolarHBondContact O-N 3.01Å; H259-N262 PolarHBondContact O-N 3.45Å; H259-L263 VanDerWaalsContact NE2-CD1 3.33Å; H259-L263 WeakPolarHBondContact NE2-CD1 3.5Å; H259-L263 WeakPolarHBondContact O-CB 3.39Å; H259-L263 WeakPolarHBondContact O-CG 3.45Å; H259-L263 PolarHBondContact O-N 3.45Å
260R85.4Confident80.7Confident47 Ų4757.8 Ų57.818%0.17730%0.303CS..Hα-helixtrans-60.2-50.6175.2-72.2164.6169.5-176.2-12.8112E81 M256 L257 R258 N262 L263 D264E81-R260 WeakPolarHBondContact OE1-CD 3.27Å; E81-R260 IonicContact OE1-CZ 3.16Å; E81-R260 IonicContact OE1-NE 3.15Å; E81-R260 PolarHBondContact OE1-NE 2.97Å; E81-R260 IonicContact OE1-NH1 2.96Å; E81-R260 PolarHBondContact OE1-NH1 3.38Å; E81-R260 IonicContact OE1-NH2 2.77Å; E81-R260 PolarHBondContact OE1-NH2 3.41Å; E81-R260 IonicContact OE2-CZ 3.53Å; E81-R260 IonicContact OE2-NE 2.97Å; E81-R260 PolarHBondContact OE2-NE 3.22Å; E81-R260 VanDerWaalsContact OE2-NE 3.15Å; E81-R260 IonicContact OE2-NH2 2.68Å; E81-R260 PolarHBondContact OE2-NH2 3.47Å; M256-R260 VanDerWaalsContact O-CG 3.3Å; M256-R260 WeakPolarHBondContact O-CG 3.33Å; M256-R260 PolarHBondContact O-N 2.88Å; L257-R260 PolarHBondContact O-N 3.09Å; R258-R260 VanDerWaalsContact C-N 3.33Å; R260-N262 VanDerWaalsContact C-N 3.26Å; R260-N262 PolarHBondContact O-N 3.08Å; R260-L263 PolarHBondContact O-N 3.08Å; R260-D264 PolarHBondContact O-N 2.91Å
261I84.2Confident80.2Confident6 Ų658.3 Ų58.33%0.03131%0.31CS..Hα-helixtrans-58.3-41.6176.6-65158.8000110.7W217 L257 R258 S265 L300 L304W217-I261 HydrophobicContact CB-CG1 4.37Å; W217-I261 HydrophobicContact CD2-CG1 3.67Å; W217-I261 HydrophobicContact CE3-CG1 3.89Å; W217-I261 HydrophobicContact CG-CG1 3.92Å; W217-I261 HydrophobicContact CZ2-CG1 4.47Å; W217-I261 HydrophobicContact CZ3-CG1 4.44Å; L257-I261 HydrophobicContact CD1-CD1 4.17Å; L257-I261 HydrophobicContact CG-CD1 3.97Å; L257-I261 WeakPolarHBondContact O-CD1 3.49Å; L257-I261 WeakPolarHBondContact O-CG1 3.48Å; L257-I261 PolarHBondContact O-N 3Å; R258-I261 PolarHBondContact O-N 3.37Å; I261-S265 WeakPolarHBondContact O-CA 3.09Å; I261-S265 VanDerWaalsContact O-CB 3.26Å; I261-S265 WeakPolarHBondContact O-CB 3.41Å; I261-S265 PolarHBondContact O-N 3.34Å; I261-L300 HydrophobicContact CD1-CD2 3.49Å; I261-L300 VanDerWaalsContact CD1-CD2 3.49Å; I261-L300 HydrophobicContact CD1-CG 4.14Å; I261-L300 HydrophobicContact CG1-CD2 3.98Å; I261-L300 HydrophobicContact CG2-CD2 4.3Å; I261-L304 HydrophobicContact CD1-CD1 4.43Å
262N81.2Confident79.8Confident72 Ų7262.8 Ų62.839%0.38533%0.331SS..Hα-helixtrans-77.1-31.3-177.2-78.2-1000114.4R258 H259 R260 D264 S265R258-N262 VanDerWaalsContact O-CB 3.25Å; R258-N262 WeakPolarHBondContact O-CB 3.43Å; R258-N262 PolarHBondContact O-N 3.1Å; H259-N262 PolarHBondContact O-N 3.45Å; R260-N262 VanDerWaalsContact C-N 3.26Å; R260-N262 PolarHBondContact O-N 3.08Å; N262-D264 VanDerWaalsContact C-N 3.28Å; N262-S265 VanDerWaalsContact O-CB 3.3Å; N262-S265 WeakPolarHBondContact O-CB 3.29Å; N262-S265 PolarHBondContact O-N 3.43Å
263L76.5Confident79.5Confident106 Ų10662.6 Ų62.656%0.55532%0.321SS*.Hα-helixtrans-65-38.9172.6-80.3177.8000110.6H259 R260 S265H259-L263 VanDerWaalsContact NE2-CD1 3.33Å; H259-L263 WeakPolarHBondContact NE2-CD1 3.5Å; H259-L263 WeakPolarHBondContact O-CB 3.39Å; H259-L263 WeakPolarHBondContact O-CG 3.45Å; H259-L263 PolarHBondContact O-N 3.45Å; R260-L263 PolarHBondContact O-N 3.08Å; L263-S265 VanDerWaalsContact C-N 3.27Å
264D70.9Confident79.4Confident53 Ų5361.4 Ų61.428%0.28331%0.311SS..Hα-helixtrans-80.2-13.6174.7-66.3-3.6000111.1W217 R260 N262 D266 L267W217-D264 HydrophobicContact CH2-CB 3.53Å; W217-D264 WeakPolarHBondContact CH2-OD2 3.11Å; W217-D264 HydrophobicContact CZ2-CB 4.04Å; W217-D264 WeakPolarHBondContact CZ2-OD2 3.33Å; R260-D264 PolarHBondContact O-N 2.91Å; N262-D264 VanDerWaalsContact C-N 3.28Å; D264-D266 PolarHBondContact O-N 3.27Å; D264-D266 VanDerWaalsContact O-N 3.15Å; D264-L267 WeakPolarHBondContact O-CB 3.46Å; D264-L267 PolarHBondContact O-N 3.43Å
265S53.9Low79.1Confident33 Ų3369.1 Ų69.123%0.23134%0.34CS..G310 helixtrans-70.5-1.5-175.2-176.90000115.7I261 N262 L263 L267 L268I261-S265 WeakPolarHBondContact O-CA 3.09Å; I261-S265 VanDerWaalsContact O-CB 3.26Å; I261-S265 WeakPolarHBondContact O-CB 3.41Å; I261-S265 PolarHBondContact O-N 3.34Å; N262-S265 VanDerWaalsContact O-CB 3.3Å; N262-S265 WeakPolarHBondContact O-CB 3.29Å; N262-S265 PolarHBondContact O-N 3.43Å; L263-S265 VanDerWaalsContact C-N 3.27Å; S265-L267 PolarHBondContact O-N 3.49Å; S265-L268 PolarHBondContact O-N 2.96Å; S265-L268 VanDerWaalsContact O-N 3.16Å
266D60.5Low78.9Confident139 Ų13971.8 Ų71.874%0.74336%0.359SS*.G310 helixtrans-52.2-16.8155-79.9-10.5000110.3D264 L268 D269D264-D266 PolarHBondContact O-N 3.27Å; D264-D266 VanDerWaalsContact O-N 3.15Å; D266-L268 VanDerWaalsContact C-N 3.32Å; D266-L268 PolarHBondContact O-N 3.14Å; D266-D269 PolarHBondContact O-N 3.22Å
267L54.8Low78.8Confident6 Ų670.5 Ų70.53%0.03135%0.351CS..G310 helixtrans-48.6-26.2166.4174.958.8000118.3Y210 D264 S265 D269 F288 I297Y210-L267 HydrophobicContact CD1-CD1 3.32Å; Y210-L267 HydrophobicContact CD1-CD2 3.67Å; Y210-L267 HydrophobicContact CD1-CG 4.05Å; Y210-L267 HydrophobicContact CD2-CD1 3.3Å; Y210-L267 HydrophobicContact CE1-CB 4.33Å; Y210-L267 HydrophobicContact CE1-CD1 3.51Å; Y210-L267 HydrophobicContact CE1-CD2 4.19Å; Y210-L267 HydrophobicContact CE1-CG 4.24Å; Y210-L267 HydrophobicContact CE2-CD1 3.48Å; Y210-L267 VanDerWaalsContact CE2-CD1 3.48Å; Y210-L267 HydrophobicContact CG-CD1 3.19Å; Y210-L267 HydrophobicContact CG-CD2 4.09Å; Y210-L267 HydrophobicContact CG-CG 4.27Å; D264-L267 WeakPolarHBondContact O-CB 3.46Å; D264-L267 PolarHBondContact O-N 3.43Å; S265-L267 PolarHBondContact O-N 3.49Å; L267-D269 VanDerWaalsContact C-N 3.25Å; L267-F288 HydrophobicContact CD1-CE2 3.79Å; L267-F288 HydrophobicContact CG-CE2 4.44Å; L267-I297 HydrophobicContact CD2-CD1 3.75Å; L267-I297 HydrophobicContact CG-CD1 4.06Å
268L60.4Low78.8Confident95 Ų9575.8 Ų75.850%0.49738%0.376SS..G310 helixtrans-75.1-22178.8-76.1174.9000112.5S265 D266 I297S265-L268 PolarHBondContact O-N 2.96Å; S265-L268 VanDerWaalsContact O-N 3.16Å; D266-L268 VanDerWaalsContact C-N 3.32Å; D266-L268 PolarHBondContact O-N 3.14Å; L268-I297 HydrophobicContact CD2-CD1 3.9Å; L268-I297 HydrophobicContact CD2-CG2 4.31Å
269D72.6Confident78.8Confident121 Ų12175.2 Ų75.265%0.64738%0.377SS*.SBendtrans-94.2143.9177.4-66.2-30.4000109.6D266 L267 P271D266-D269 PolarHBondContact O-N 3.22Å; L267-D269 VanDerWaalsContact C-N 3.25Å; D269-P271 VanDerWaalsContact O-CD 3.25Å; D269-P271 WeakPolarHBondContact O-CD 3.32Å
270T78.3Confident79Confident39 Ų3970.9 Ų70.924%0.23936%0.357CS..PPolyproline II helixtrans-59121.2171.6-57.70000108.4D272 Y274 W275 E281T270-D272 PolarHBondContact O-N 3.1Å; T270-Y274 HydrophobicContact CG2-CD2 4.01Å; T270-Y274 HydrophobicContact CG2-CG 4.3Å; T270-W275 PolarHBondContact O-NE1 3.02Å; T270-E281 HydrophobicContact CG2-CG 3.96Å
271P83Confident79.3Confident35 Ų3571.5 Ų71.523%0.22736%0.362CS..PPolyproline II helixtrans-55.2139.4179.5-28.435.6000112.3D269 F273 Y274D269-P271 VanDerWaalsContact O-CD 3.25Å; D269-P271 WeakPolarHBondContact O-CD 3.32Å; P271-F273 PolarHBondContact O-N 3.31Å; P271-Y274 HydrophobicContact CB-CD2 3.79Å; P271-Y274 HydrophobicContact CB-CE2 3.82Å; P271-Y274 HydrophobicContact CG-CD2 4.01Å; P271-Y274 HydrophobicContact CG-CE2 3.74Å; P271-Y274 WeakPolarHBondContact O-CD2 3.04Å; P271-Y274 PolarHBondContact O-N 2.92Å
272D84.8Confident79.8Confident109 Ų10976.9 Ų76.958%0.58339%0.386SS*.G310 helixtrans-51.3-30.7-176.7-63.35.8000113.3T270 Y274 W275T270-D272 PolarHBondContact O-N 3.1Å; D272-Y274 PolarHBondContact O-N 3.43Å; D272-W275 HydrophobicContact CB-CD2 4.29Å; D272-W275 HydrophobicContact CB-CE3 4.34Å; D272-W275 HydrophobicContact CB-CZ3 4.47Å; D272-W275 WeakPolarHBondContact O-CB 3.32Å; D272-W275 PolarHBondContact O-N 2.89Å; D272-W275 WeakPolarHBondContact OD1-CH2 3.36Å; D272-W275 WeakPolarHBondContact OD1-CZ2 3.43Å
273F87.5Confident80.3Confident30 Ų3073.9 Ų73.913%0.13237%0.369CS..G310 helixtrans-51.9-28.2175.8177.5-102.3000114E106 L107 L199 Y202 P271 K277 L280E106-F273 HydrophobicContact CB-CD2 4.24Å; E106-F273 HydrophobicContact CB-CE2 4.3Å; E106-F273 WeakPolarHBondContact OE2-CD2 3.31Å; E106-F273 VanDerWaalsContact OE2-CE2 3.3Å; E106-F273 WeakPolarHBondContact OE2-CE2 3.36Å; L107-F273 HydrophobicContact CD1-CD2 4.45Å; L107-F273 HydrophobicContact CD1-CE1 4.15Å; L107-F273 HydrophobicContact CD1-CE2 3.77Å; L107-F273 HydrophobicContact CD1-CZ 3.59Å; L107-F273 HydrophobicContact CD2-CD1 4.29Å; L107-F273 HydrophobicContact CD2-CD2 3.6Å; L107-F273 HydrophobicContact CD2-CE1 4.44Å; L107-F273 HydrophobicContact CD2-CE2 3.76Å; L107-F273 HydrophobicContact CD2-CG 3.87Å; L107-F273 HydrophobicContact CD2-CZ 4.19Å; L107-F273 HydrophobicContact CG-CD2 3.96Å; L107-F273 HydrophobicContact CG-CE2 3.6Å; L107-F273 HydrophobicContact CG-CZ 3.98Å; L199-F273 HydrophobicContact CD2-CZ 4.01Å; Y202-F273 AromaticContact CD1-CE1 3.97Å; Y202-F273 HydrophobicContact CD1-CE1 3.97Å; Y202-F273 AromaticContact CE1-CD1 3.9Å; Y202-F273 HydrophobicContact CE1-CD1 3.9Å; Y202-F273 AromaticContact CE1-CE1 3.67Å; Y202-F273 HydrophobicContact CE1-CE1 3.67Å; Y202-F273 HydrophobicContact CE1-CZ 4.41Å; P271-F273 PolarHBondContact O-N 3.31Å; F273-K277 HydrophobicContact CZ-CD 4.44Å; F273-L280 HydrophobicContact CD1-CD2 4.39Å; F273-L280 HydrophobicContact CE1-CD2 3.66Å; F273-L280 HydrophobicContact CZ-CD2 4.48Å
274Y89.6Confident81.1Confident0 Ų069.1 Ų69.10%034%0.344CS..G310 helixtrans-90.8-13-178-57.8-70.2000113.8A203 N206 T270 P271 D272 D276 K277 L280 Y284A203-Y274 HydrophobicContact CB-CE1 3.97Å; N206-Y274 PolarHBondContact ND2-OH 3.24Å; T270-Y274 HydrophobicContact CG2-CD2 4.01Å; T270-Y274 HydrophobicContact CG2-CG 4.3Å; P271-Y274 HydrophobicContact CB-CD2 3.79Å; P271-Y274 HydrophobicContact CB-CE2 3.82Å; P271-Y274 HydrophobicContact CG-CD2 4.01Å; P271-Y274 HydrophobicContact CG-CE2 3.74Å; P271-Y274 WeakPolarHBondContact O-CD2 3.04Å; P271-Y274 PolarHBondContact O-N 2.92Å; D272-Y274 PolarHBondContact O-N 3.43Å; Y274-D276 VanDerWaalsContact C-N 3.31Å; Y274-D276 PolarHBondContact O-N 3.5Å; Y274-K277 CarbonylContact O-C 3.57Å; Y274-K277 PolarHBondContact O-N 2.85Å; Y274-L280 HydrophobicContact CD1-CB 4.16Å; Y274-L280 HydrophobicContact CD1-CD2 3.71Å; Y274-L280 HydrophobicContact CD1-CG 3.71Å; Y274-L280 HydrophobicContact CE1-CD2 3.7Å; Y274-L280 HydrophobicContact CE1-CG 3.73Å; Y274-Y284 HydrophobicContact CD2-CD1 4.49Å; Y274-Y284 HydrophobicContact CE2-CD1 4.28Å; Y274-Y284 HydrophobicContact CE2-CD2 4.02Å; Y274-Y284 HydrophobicContact CE2-CE2 4.27Å; Y274-Y284 HydrophobicContact CE2-CG 4.02Å; Y274-Y284 AromaticContact CZ-CD2 3.87Å
275W86.4Confident82.1Confident163 Ų16369.1 Ų69.162%0.61735%0.348SS*.THydrogen-bonded Turntrans-61.7-35.4-171.3-69.6-2.9000113.9T270 D272 K277T270-W275 PolarHBondContact O-NE1 3.02Å; D272-W275 HydrophobicContact CB-CD2 4.29Å; D272-W275 HydrophobicContact CB-CE3 4.34Å; D272-W275 HydrophobicContact CB-CZ3 4.47Å; D272-W275 WeakPolarHBondContact O-CB 3.32Å; D272-W275 PolarHBondContact O-N 2.89Å; D272-W275 WeakPolarHBondContact OD1-CH2 3.36Å; D272-W275 WeakPolarHBondContact OD1-CZ2 3.43Å; W275-K277 VanDerWaalsContact C-N 3.31Å
276D87.6Confident84Confident159 Ų15970.7 Ų70.785%0.8536%0.356SS*.THydrogen-bonded Turntrans-88.82.4177.8-62.3-41.9000112.8Y274Y274-D276 VanDerWaalsContact C-N 3.31Å; Y274-D276 PolarHBondContact O-N 3.5Å
277K89.8Confident85.5Confident58 Ų5864 Ų6425%0.25232%0.321SS..  trans-130.773-168.9-62.2173.1-169.2150.70111E106 F273 Y274 W275 E279 L280 E281E106-K277 IonicContact OE2-NZ 3.01Å; E106-K277 PolarHBondContact OE2-NZ 3.03Å; E106-K277 VanDerWaalsContact OE2-NZ 3.15Å; F273-K277 HydrophobicContact CZ-CD 4.44Å; Y274-K277 CarbonylContact O-C 3.57Å; Y274-K277 PolarHBondContact O-N 2.85Å; W275-K277 VanDerWaalsContact C-N 3.31Å; K277-E279 VanDerWaalsContact C-N 3.33Å; K277-E279 PolarHBondContact O-N 3.41Å; K277-L280 HydrophobicContact CB-CB 3.9Å; K277-L280 HydrophobicContact CD-CD2 4.13Å; K277-L280 WeakPolarHBondContact O-CB 3.34Å; K277-L280 PolarHBondContact O-N 3.42Å; K277-E281 PolarHBondContact O-N 2.79Å
278E89.8Confident87.2Confident125 Ų12565.4 Ų65.458%0.58433%0.326SS*.Hα-helixtrans-54.5-41.3-174.8-170.4-171.8172.100113.9L280 K282E278-L280 VanDerWaalsContact C-N 3.29Å; E278-L280 PolarHBondContact O-N 3.44Å; E278-K282 HydrophobicContact CG-CD 4.45Å; E278-K282 WeakPolarHBondContact O-CG 3.47Å; E278-K282 PolarHBondContact O-N 3.12Å; E278-K282 VanDerWaalsContact O-N 3.1Å; E278-K282 VanDerWaalsContact OE1-CE 3.25Å; E278-K282 WeakPolarHBondContact OE1-CE 3.21Å; E278-K282 IonicContact OE1-NZ 2.8Å; E278-K282 PolarHBondContact OE1-NZ 2.54Å
279E90.1Very high88.7Confident84 Ų8464.4 Ų64.439%0.39333%0.328SS..Hα-helixtrans-62.5-39.6177.6-64.6-167.8166.800111.6R178 R189 K277 L283R178-E279 IonicContact CZ-OE1 3.15Å; R178-E279 IonicContact NE-OE1 3.13Å; R178-E279 PolarHBondContact NE-OE1 2.94Å; R178-E279 IonicContact NH2-OE1 2.63Å; R178-E279 PolarHBondContact NH2-OE1 3.48Å; R189-E279 IonicContact NH2-OE2 3.3Å; R189-E279 PolarHBondContact NH2-OE2 2.8Å; R189-E279 VanDerWaalsContact NH2-OE2 3.15Å; K277-E279 VanDerWaalsContact C-N 3.33Å; K277-E279 PolarHBondContact O-N 3.41Å; E279-L283 PolarHBondContact O-N 2.79Å; E279-L283 VanDerWaalsContact O-N 3.14Å
280L92Very high89.6Confident9 Ų960 Ų605%0.04730%0.304CS..Hα-helixtrans-76-38.5-177-162.165.3000111.7L199 A203 F273 Y274 K277 E278 K282 L283 Y284L199-L280 HydrophobicContact CB-CD1 4.36Å; L199-L280 HydrophobicContact CB-CD2 4.3Å; L199-L280 WeakPolarHBondContact O-CD1 3.27Å; A203-L280 HydrophobicContact CB-CD1 3.47Å; A203-L280 VanDerWaalsContact CB-CD1 3.47Å; A203-L280 HydrophobicContact CB-CG 3.85Å; F273-L280 HydrophobicContact CD1-CD2 4.39Å; F273-L280 HydrophobicContact CE1-CD2 3.66Å; F273-L280 HydrophobicContact CZ-CD2 4.48Å; Y274-L280 HydrophobicContact CD1-CB 4.16Å; Y274-L280 HydrophobicContact CD1-CD2 3.71Å; Y274-L280 HydrophobicContact CD1-CG 3.71Å; Y274-L280 HydrophobicContact CE1-CD2 3.7Å; Y274-L280 HydrophobicContact CE1-CG 3.73Å; K277-L280 HydrophobicContact CB-CB 3.9Å; K277-L280 HydrophobicContact CD-CD2 4.13Å; K277-L280 WeakPolarHBondContact O-CB 3.34Å; K277-L280 PolarHBondContact O-N 3.42Å; E278-L280 VanDerWaalsContact C-N 3.29Å; E278-L280 PolarHBondContact O-N 3.44Å; L280-K282 VanDerWaalsContact C-N 3.33Å; L280-K282 PolarHBondContact O-N 3.32Å; L280-L283 PolarHBondContact O-N 2.85Å; L280-Y284 WeakPolarHBondContact O-CB 3.5Å; L280-Y284 PolarHBondContact O-N 3.42Å
281E92.4Very high90.2Very high60 Ų6058.4 Ų58.428%0.2829%0.293SS..Hα-helixtrans-58.4-45.3172.1-179.3176.5-164.900111.3T270 K277 Y284 S285T270-E281 HydrophobicContact CG2-CG 3.96Å; K277-E281 PolarHBondContact O-N 2.79Å; E281-Y284 PolarHBondContact O-N 2.97Å; E281-S285 VanDerWaalsContact O-CB 3.29Å; E281-S285 WeakPolarHBondContact O-CB 3.35Å; E281-S285 PolarHBondContact O-N 3.17Å; E281-S285 PolarHBondContact O-OG 3.02Å
282K93.1Very high90.6Very high119 Ų11959.2 Ų59.252%0.51730%0.296SS..Hα-helixtrans-61.5-46176.7-74.3172.7-175.6168.90111.2E278 L280 S285 V286E278-K282 HydrophobicContact CG-CD 4.45Å; E278-K282 WeakPolarHBondContact O-CG 3.47Å; E278-K282 PolarHBondContact O-N 3.12Å; E278-K282 VanDerWaalsContact O-N 3.1Å; E278-K282 VanDerWaalsContact OE1-CE 3.25Å; E278-K282 WeakPolarHBondContact OE1-CE 3.21Å; E278-K282 IonicContact OE1-NZ 2.8Å; E278-K282 PolarHBondContact OE1-NZ 2.54Å; L280-K282 VanDerWaalsContact C-N 3.33Å; L280-K282 PolarHBondContact O-N 3.32Å; K282-S285 PolarHBondContact O-N 2.87Å; K282-V286 VanDerWaalsContact O-CG2 3.31Å; K282-V286 WeakPolarHBondContact O-CG2 3.41Å; K282-V286 PolarHBondContact O-N 3.32Å
283L93.1Very high90.9Very high8 Ų854 Ų544%0.04227%0.268CS..Hα-helixtrans-61.8-46.8178.8-173.667000111.5F181 L186 D200 V204 E279 L280 V286 A287F181-L283 HydrophobicContact CD2-CD1 3.77Å; F181-L283 HydrophobicContact CE2-CD1 3.58Å; F181-L283 HydrophobicContact CE2-CG 4.26Å; L186-L283 HydrophobicContact CD1-CD1 4.11Å; D200-L283 HydrophobicContact CB-CD2 3.75Å; V204-L283 HydrophobicContact CG2-CD2 4.09Å; V204-L283 HydrophobicContact CG2-CG 4.15Å; E279-L283 PolarHBondContact O-N 2.79Å; E279-L283 VanDerWaalsContact O-N 3.14Å; L280-L283 PolarHBondContact O-N 2.85Å; L283-V286 PolarHBondContact O-N 3.38Å; L283-A287 WeakPolarHBondContact O-CB 3.5Å; L283-A287 PolarHBondContact O-N 2.86Å
284Y92.9Very high91Very high6 Ų653.6 Ų53.62%0.02427%0.272CS..Hα-helixtrans-59.1-47.4175.5176.4-99.6000111.5N206 A207 Y274 L280 E281 V286 A287 F288N206-Y284 HydrophobicContact CB-CE2 4.35Å; A207-Y284 HydrophobicContact CB-CD2 4.16Å; A207-Y284 HydrophobicContact CB-CE2 4.05Å; Y274-Y284 HydrophobicContact CD2-CD1 4.49Å; Y274-Y284 HydrophobicContact CE2-CD1 4.28Å; Y274-Y284 HydrophobicContact CE2-CD2 4.02Å; Y274-Y284 HydrophobicContact CE2-CE2 4.27Å; Y274-Y284 HydrophobicContact CE2-CG 4.02Å; Y274-Y284 AromaticContact CZ-CD2 3.87Å; L280-Y284 WeakPolarHBondContact O-CB 3.5Å; L280-Y284 PolarHBondContact O-N 3.42Å; E281-Y284 PolarHBondContact O-N 2.97Å; Y284-V286 VanDerWaalsContact C-N 3.33Å; Y284-V286 PolarHBondContact O-N 2.97Å; Y284-A287 WeakPolarHBondContact O-CB 3.31Å; Y284-A287 PolarHBondContact O-N 3.1Å; Y284-F288 HydrophobicContact CE1-CD2 4.16Å; Y284-F288 AromaticContact CZ-CD2 3.95Å; Y284-F288 VanDerWaalsContact O-CB 3.3Å; Y284-F288 WeakPolarHBondContact O-CB 3.29Å; Y284-F288 PolarHBondContact O-N 3.18Å
285S91.9Very high91Very high53 Ų5360.2 Ų60.237%0.37130%0.301SS..Hα-helixtrans-61-40.8-179.5-63.20000112.4E281 K282 F288 S289E281-S285 VanDerWaalsContact O-CB 3.29Å; E281-S285 WeakPolarHBondContact O-CB 3.35Å; E281-S285 PolarHBondContact O-N 3.17Å; E281-S285 PolarHBondContact O-OG 3.02Å; K282-S285 PolarHBondContact O-N 2.87Å; S285-F288 PolarHBondContact O-N 3.29Å; S285-S289 PolarHBondContact O-N 3.43Å
286V93.3Very high91.3Very high66 Ų6654.2 Ų54.240%0.428%0.278SS..Hα-helixtrans-67.7-45.3177176.90000110.6F181 K282 L283 Y284 F288 S289 L290F181-V286 HydrophobicContact CB-CG1 3.67Å; F181-V286 HydrophobicContact CD2-CB 4.04Å; F181-V286 HydrophobicContact CD2-CG1 3.64Å; F181-V286 HydrophobicContact CG-CG1 3.89Å; K282-V286 VanDerWaalsContact O-CG2 3.31Å; K282-V286 WeakPolarHBondContact O-CG2 3.41Å; K282-V286 PolarHBondContact O-N 3.32Å; L283-V286 PolarHBondContact O-N 3.38Å; Y284-V286 VanDerWaalsContact C-N 3.33Å; Y284-V286 PolarHBondContact O-N 2.97Å; V286-F288 VanDerWaalsContact C-N 3.33Å; V286-F288 PolarHBondContact O-N 3.34Å; V286-S289 PolarHBondContact O-N 2.76Å; V286-S289 PolarHBondContact O-OG 2.77Å; V286-L290 WeakPolarHBondContact O-CB 3.38Å; V286-L290 PolarHBondContact O-N 3.23Å
287A92.8Very high91.4Very high0 Ų047 Ų470%024%0.24CC..Hα-helixtrans-57.9-46174.200000111.4F181 A207 L283 Y284 S289 L290 F291F181-A287 HydrophobicContact CE2-CB 3.74Å; F181-A287 HydrophobicContact CZ-CB 3.76Å; A207-A287 HydrophobicContact CB-CB 3.68Å; L283-A287 WeakPolarHBondContact O-CB 3.5Å; L283-A287 PolarHBondContact O-N 2.86Å; Y284-A287 WeakPolarHBondContact O-CB 3.31Å; Y284-A287 PolarHBondContact O-N 3.1Å; A287-S289 VanDerWaalsContact C-N 3.29Å; A287-S289 PolarHBondContact O-N 2.7Å; A287-L290 WeakPolarHBondContact O-CB 3.36Å; A287-L290 PolarHBondContact O-N 3.2Å; A287-L290 VanDerWaalsContact O-N 3.08Å; A287-F291 HydrophobicContact CB-CE2 4.28Å; A287-F291 WeakPolarHBondContact O-CD2 3.4Å; A287-F291 PolarHBondContact O-N 3.27Å; A287-F291 VanDerWaalsContact O-N 3.08Å
288F91Very high91.4Very high34 Ų3451.9 Ų51.915%0.14926%0.261CS..Hα-helixtrans-59.2-40.2177.9-168.2-84.7000112.2L267 Y284 S285 V286 N292 I293L267-F288 HydrophobicContact CD1-CE2 3.79Å; L267-F288 HydrophobicContact CG-CE2 4.44Å; Y284-F288 HydrophobicContact CE1-CD2 4.16Å; Y284-F288 AromaticContact CZ-CD2 3.95Å; Y284-F288 VanDerWaalsContact O-CB 3.3Å; Y284-F288 WeakPolarHBondContact O-CB 3.29Å; Y284-F288 PolarHBondContact O-N 3.18Å; S285-F288 PolarHBondContact O-N 3.29Å; V286-F288 VanDerWaalsContact C-N 3.33Å; V286-F288 PolarHBondContact O-N 3.34Å; F288-N292 PolarHBondContact O-N 3.15Å; F288-I293 HydrophobicContact CD1-CB 4.03Å; F288-I293 HydrophobicContact CD2-CB 4.05Å; F288-I293 HydrophobicContact CD2-CD1 3.62Å; F288-I293 HydrophobicContact CD2-CG1 4.36Å; F288-I293 HydrophobicContact CD2-CG2 4.21Å; F288-I293 HydrophobicContact CE1-CB 3.75Å; F288-I293 HydrophobicContact CE1-CG2 4.06Å; F288-I293 HydrophobicContact CE2-CB 3.77Å; F288-I293 HydrophobicContact CE2-CD1 3.96Å; F288-I293 HydrophobicContact CE2-CG1 4.45Å; F288-I293 HydrophobicContact CE2-CG2 3.49Å; F288-I293 VanDerWaalsContact CE2-CG2 3.49Å; F288-I293 HydrophobicContact CG-CB 4.17Å; F288-I293 HydrophobicContact CG-CD1 4.05Å; F288-I293 HydrophobicContact CZ-CB 3.61Å; F288-I293 HydrophobicContact CZ-CG2 3.41Å; F288-I293 VanDerWaalsContact CZ-CG2 3.41Å; F288-I293 PolarHBondContact O-N 3.04Å
289S91.2Very high91.5Very high75 Ų7549.3 Ų49.352%0.52425%0.254SS..Hα-helixtrans-68.6-38.617495.80000112.6S285 V286 A287 F291 N292S285-S289 PolarHBondContact O-N 3.43Å; V286-S289 PolarHBondContact O-N 2.76Å; V286-S289 PolarHBondContact O-OG 2.77Å; A287-S289 VanDerWaalsContact C-N 3.29Å; A287-S289 PolarHBondContact O-N 2.7Å; S289-F291 VanDerWaalsContact C-N 3.35Å; S289-F291 PolarHBondContact O-N 3.48Å; S289-N292 WeakPolarHBondContact O-CA 3.29Å; S289-N292 PolarHBondContact O-N 3.38Å
290L91.9Very high91.5Very high29 Ų2945.5 Ų45.515%0.15224%0.236CC..Hα-helixtrans-61.3-44.7-178.6178.966.8000110.8L169 F181 C183 E184 V286 A287 N292L169-L290 HydrophobicContact CD1-CD2 3.98Å; F181-L290 HydrophobicContact CD1-CD2 3.83Å; F181-L290 HydrophobicContact CE1-CD2 3.72Å; C183-L290 WeakPolarHBondContact O-CD1 3.41Å; E184-L290 HydrophobicContact CG-CD1 4.18Å; V286-L290 WeakPolarHBondContact O-CB 3.38Å; V286-L290 PolarHBondContact O-N 3.23Å; A287-L290 WeakPolarHBondContact O-CB 3.36Å; A287-L290 PolarHBondContact O-N 3.2Å; A287-L290 VanDerWaalsContact O-N 3.08Å; L290-N292 PolarHBondContact O-N 2.89Å; L290-N292 PolarHBondContact O-ND2 3.32Å
291F91.2Very high91.5Very high4 Ų447.1 Ų47.12%0.01825%0.245CC..THydrogen-bonded Turntrans-771.7174.7-59.7-64.2000113.4R58 L169 A207 M208 A287 S289 I293 R296R58-F291 VanDerWaalsContact NH1-CE1 3.3Å; L169-F291 HydrophobicContact CD2-CZ 4.34Å; A207-F291 HydrophobicContact CB-CD2 4.25Å; A207-F291 HydrophobicContact CB-CE2 4.28Å; M208-F291 HydrophobicContact CB-CZ 4.48Å; M208-F291 HydrophobicContact CG-CE1 4.07Å; M208-F291 HydrophobicContact CG-CE2 3.55Å; M208-F291 HydrophobicContact CG-CZ 3.27Å; M208-F291 HydrophobicContact SD-CZ 4.13Å; A287-F291 HydrophobicContact CB-CE2 4.28Å; A287-F291 WeakPolarHBondContact O-CD2 3.4Å; A287-F291 PolarHBondContact O-N 3.27Å; A287-F291 VanDerWaalsContact O-N 3.08Å; S289-F291 VanDerWaalsContact C-N 3.35Å; S289-F291 PolarHBondContact O-N 3.48Å; F291-I293 HydrophobicContact CB-CD1 4Å; F291-I293 HydrophobicContact CB-CG1 3.66Å; F291-I293 PolarHBondContact O-N 3.36Å; F291-I293 VanDerWaalsContact O-N 3.14Å; F291-R296 WeakPolarHBondContact O-CD 3.38Å
292N91.3Very high91.5Very high52 Ų5251.1 Ų51.128%0.27827%0.265SS..THydrogen-bonded Turntrans50.533-178.1-72.6-78.2000113.9F288 S289 L290 G294 K295 R296F288-N292 PolarHBondContact O-N 3.15Å; S289-N292 WeakPolarHBondContact O-CA 3.29Å; S289-N292 PolarHBondContact O-N 3.38Å; L290-N292 PolarHBondContact O-N 2.89Å; L290-N292 PolarHBondContact O-ND2 3.32Å; N292-G294 PolarHBondContact O-N 2.92Å; N292-K295 PolarHBondContact O-N 3.42Å; N292-K295 VanDerWaalsContact O-N 3.09Å; N292-K295 PolarHBondContact OD1-NZ 2.88Å; N292-R296 WeakPolarHBondContact O-CG 3.42Å; N292-R296 PolarHBondContact O-N 2.86Å
293I90.6Very high91.5Very high0 Ų048.6 Ų48.60%025%0.252CS..Hα-helixtrans-58.1-47.9-169.3-59.8175.1000110.8A207 L214 F288 F291 K295 R296 I297A207-I293 WeakPolarHBondContact O-CD1 3.48Å; L214-I293 HydrophobicContact CD2-CG2 4.15Å; F288-I293 HydrophobicContact CD1-CB 4.03Å; F288-I293 HydrophobicContact CD2-CB 4.05Å; F288-I293 HydrophobicContact CD2-CD1 3.62Å; F288-I293 HydrophobicContact CD2-CG1 4.36Å; F288-I293 HydrophobicContact CD2-CG2 4.21Å; F288-I293 HydrophobicContact CE1-CB 3.75Å; F288-I293 HydrophobicContact CE1-CG2 4.06Å; F288-I293 HydrophobicContact CE2-CB 3.77Å; F288-I293 HydrophobicContact CE2-CD1 3.96Å; F288-I293 HydrophobicContact CE2-CG1 4.45Å; F288-I293 HydrophobicContact CE2-CG2 3.49Å; F288-I293 VanDerWaalsContact CE2-CG2 3.49Å; F288-I293 HydrophobicContact CG-CB 4.17Å; F288-I293 HydrophobicContact CG-CD1 4.05Å; F288-I293 HydrophobicContact CZ-CB 3.61Å; F288-I293 HydrophobicContact CZ-CG2 3.41Å; F288-I293 VanDerWaalsContact CZ-CG2 3.41Å; F288-I293 PolarHBondContact O-N 3.04Å; F291-I293 HydrophobicContact CB-CD1 4Å; F291-I293 HydrophobicContact CB-CG1 3.66Å; F291-I293 PolarHBondContact O-N 3.36Å; F291-I293 VanDerWaalsContact O-N 3.14Å; I293-K295 VanDerWaalsContact C-N 3.33Å; I293-K295 PolarHBondContact O-N 2.87Å; I293-R296 PolarHBondContact O-N 2.86Å; I293-I297 HydrophobicContact CG2-CD1 3.73Å; I293-I297 HydrophobicContact CG2-CG1 4.3Å; I293-I297 WeakPolarHBondContact O-CG1 3.5Å; I293-I297 PolarHBondContact O-N 2.75Å
294G88.7Confident91.5Very high21 Ų2148.3 Ų48.322%0.21625%0.251CS..Hα-helixtrans-60.7-36.3178.800000114.3N292 K298N292-G294 PolarHBondContact O-N 2.92Å; G294-K298 WeakPolarHBondContact O-CG 3.47Å; G294-K298 PolarHBondContact O-N 2.83Å
295K90.7Very high91.6Very high140 Ų14050.7 Ų50.761%0.60927%0.266SS*.Hα-helixtrans-71-42.6175.9-66.8178.1-169.9155.70111N292 I293 K298 V299N292-K295 PolarHBondContact O-N 3.42Å; N292-K295 VanDerWaalsContact O-N 3.09Å; N292-K295 PolarHBondContact OD1-NZ 2.88Å; I293-K295 VanDerWaalsContact C-N 3.33Å; I293-K295 PolarHBondContact O-N 2.87Å; K295-K298 WeakPolarHBondContact O-CB 3.25Å; K295-K298 PolarHBondContact O-N 3.15Å; K295-V299 WeakPolarHBondContact O-CG2 3.4Å; K295-V299 PolarHBondContact O-N 3.2Å; K295-V299 VanDerWaalsContact O-N 3.07Å
296R92.3Very high91.6Very high37 Ų3754.2 Ų54.214%0.1427%0.272CS..Hα-helixtrans-61.6-45.2178.5-72174.167-167.83.9111.6S211 L214 S215 E218 F291 N292 I293 K298 V299 L300S211-R296 PolarHBondContact O-NH1 3.02Å; S211-R296 VanDerWaalsContact O-NH1 3.12Å; S211-R296 PolarHBondContact O-NH2 3.16Å; S211-R296 PolarHBondContact OG-NH1 3.3Å; L214-R296 HydrophobicContact CD2-CB 3.32Å; L214-R296 HydrophobicContact CD2-CG 4.32Å; L214-R296 HydrophobicContact CG-CB 4.15Å; S215-R296 VanDerWaalsContact N-NH2 3.14Å; S215-R296 PolarHBondContact OG-NH2 2.95Å; E218-R296 WeakPolarHBondContact OE1-CB 3.28Å; E218-R296 IonicContact OE1-CZ 3.53Å; E218-R296 IonicContact OE1-NE 3.4Å; E218-R296 PolarHBondContact OE1-NE 2.65Å; E218-R296 IonicContact OE1-NH2 2.79Å; E218-R296 IonicContact OE2-CZ 2.93Å; E218-R296 IonicContact OE2-NE 3.68Å; E218-R296 PolarHBondContact OE2-NE 3.1Å; E218-R296 IonicContact OE2-NH2 3.79Å; E218-R296 PolarHBondContact OE2-NH2 3.24Å; F291-R296 WeakPolarHBondContact O-CD 3.38Å; N292-R296 WeakPolarHBondContact O-CG 3.42Å; N292-R296 PolarHBondContact O-N 2.86Å; I293-R296 PolarHBondContact O-N 2.86Å; R296-K298 VanDerWaalsContact C-N 3.34Å; R296-K298 PolarHBondContact O-N 2.9Å; R296-V299 PolarHBondContact O-N 2.76Å; R296-L300 WeakPolarHBondContact O-CB 3.45Å; R296-L300 PolarHBondContact O-N 2.57Å
297I89Confident91.7Very high8 Ų851.1 Ų51.14%0.04125%0.253CS..Hα-helixtrans-57.7-44.8174.3-68.1169.3000111.2L214 L267 L268 I293 V299 L300 N301L214-I297 HydrophobicContact CD1-CG1 4.25Å; L214-I297 HydrophobicContact CD2-CG1 3.96Å; L267-I297 HydrophobicContact CD2-CD1 3.75Å; L267-I297 HydrophobicContact CG-CD1 4.06Å; L268-I297 HydrophobicContact CD2-CD1 3.9Å; L268-I297 HydrophobicContact CD2-CG2 4.31Å; I293-I297 HydrophobicContact CG2-CD1 3.73Å; I293-I297 HydrophobicContact CG2-CG1 4.3Å; I293-I297 WeakPolarHBondContact O-CG1 3.5Å; I293-I297 PolarHBondContact O-N 2.75Å; I297-V299 PolarHBondContact O-N 3.41Å; I297-L300 PolarHBondContact O-N 3.17Å; I297-N301 WeakPolarHBondContact CG2-ND2 3.48Å; I297-N301 WeakPolarHBondContact O-CB 3.49Å; I297-N301 PolarHBondContact O-N 2.77Å; I297-N301 PolarHBondContact O-ND2 3.18Å
298K89.6Confident91.7Very high159 Ų15951.8 Ų51.869%0.69126%0.257SS*.Hα-helixtrans-59.9-45.6177.4-74.1175.6-178-177.60112.2G294 K295 R296 N301 M302G294-K298 WeakPolarHBondContact O-CG 3.47Å; G294-K298 PolarHBondContact O-N 2.83Å; K295-K298 WeakPolarHBondContact O-CB 3.25Å; K295-K298 PolarHBondContact O-N 3.15Å; R296-K298 VanDerWaalsContact C-N 3.34Å; R296-K298 PolarHBondContact O-N 2.9Å; K298-N301 PolarHBondContact O-N 2.72Å; K298-M302 WeakPolarHBondContact O-CB 3.47Å; K298-M302 PolarHBondContact O-N 2.96Å
299V91.9Very high91.9Very high72 Ų7255.5 Ų55.544%0.43628%0.275SS..Hα-helixtrans-64.9-42.5177.6174.10000111.1K295 R296 I297 M302 R303K295-V299 WeakPolarHBondContact O-CG2 3.4Å; K295-V299 PolarHBondContact O-N 3.2Å; K295-V299 VanDerWaalsContact O-N 3.07Å; R296-V299 PolarHBondContact O-N 2.76Å; I297-V299 PolarHBondContact O-N 3.41Å; V299-M302 PolarHBondContact O-N 3.47Å; V299-R303 WeakPolarHBondContact O-CG 3.25Å; V299-R303 PolarHBondContact O-N 2.91Å
300L91.7Very high91.9Very high3 Ų352.8 Ų52.82%0.01625%0.254CS..Hα-helixtrans-60-48.7177.2-170.276.2000111.2L214 W217 E218 L221 I261 R296 I297 M302 R303 L304L214-L300 HydrophobicContact CD1-CD2 3.68Å; W217-L300 HydrophobicContact CB-CD2 3.98Å; W217-L300 HydrophobicContact CE3-CD2 4.43Å; E218-L300 HydrophobicContact CB-CD1 4.43Å; E218-L300 HydrophobicContact CG-CD1 3.88Å; L221-L300 HydrophobicContact CB-CD1 4.09Å; L221-L300 HydrophobicContact CD2-CD1 3.52Å; L221-L300 HydrophobicContact CD2-CG 4.13Å; L221-L300 HydrophobicContact CG-CD1 4.46Å; I261-L300 HydrophobicContact CD1-CD2 3.49Å; I261-L300 VanDerWaalsContact CD1-CD2 3.49Å; I261-L300 HydrophobicContact CD1-CG 4.14Å; I261-L300 HydrophobicContact CG1-CD2 3.98Å; I261-L300 HydrophobicContact CG2-CD2 4.3Å; R296-L300 WeakPolarHBondContact O-CB 3.45Å; R296-L300 PolarHBondContact O-N 2.57Å; I297-L300 PolarHBondContact O-N 3.17Å; L300-M302 VanDerWaalsContact C-N 3.35Å; L300-M302 PolarHBondContact O-N 3.19Å; L300-R303 PolarHBondContact O-N 3.19Å; L300-L304 WeakPolarHBondContact O-CB 3.48Å; L300-L304 PolarHBondContact O-N 3.41Å
301N90.1Very high92Very high44 Ų4451.6 Ų51.624%0.23525%0.248CC..Hα-helixtrans-63.4-37.6178.1-79.7-31.2000113I297 K298 L304 T305I297-N301 WeakPolarHBondContact CG2-ND2 3.48Å; I297-N301 WeakPolarHBondContact O-CB 3.49Å; I297-N301 PolarHBondContact O-N 2.77Å; I297-N301 PolarHBondContact O-ND2 3.18Å; K298-N301 PolarHBondContact O-N 2.72Å; N301-L304 PolarHBondContact O-N 2.84Å; N301-T305 WeakPolarHBondContact O-CB 3.37Å; N301-T305 PolarHBondContact O-N 3.46Å; N301-T305 PolarHBondContact O-OG1 2.93Å
302M93.2Very high92Very high144 Ų14457.5 Ų57.571%0.70928%0.276SS*.Hα-helixtrans-63-47.4174.5-178.2-177.7-78.700111.3K298 V299 L300 L304 T305 Y306K298-M302 WeakPolarHBondContact O-CB 3.47Å; K298-M302 PolarHBondContact O-N 2.96Å; V299-M302 PolarHBondContact O-N 3.47Å; L300-M302 VanDerWaalsContact C-N 3.35Å; L300-M302 PolarHBondContact O-N 3.19Å; M302-L304 VanDerWaalsContact C-N 3.34Å; M302-L304 PolarHBondContact O-N 3.41Å; M302-T305 PolarHBondContact O-N 3.12Å; M302-Y306 PolarHBondContact O-N 2.96Å
303R94.1Very high92.1Very high66 Ų6659.5 Ų59.525%0.24929%0.286CS..Hα-helixtrans-62.7-41.2177.3-71.2-178.275.7-167.73.5112L221 S222 V299 L300 T305 Y306 C307L221-R303 HydrophobicContact CD2-CB 3.61Å; L221-R303 HydrophobicContact CG-CB 4.49Å; S222-R303 PolarHBondContact OG-NH1 3.43Å; S222-R303 PolarHBondContact OG-NH2 2.83Å; V299-R303 WeakPolarHBondContact O-CG 3.25Å; V299-R303 PolarHBondContact O-N 2.91Å; L300-R303 PolarHBondContact O-N 3.19Å; R303-T305 VanDerWaalsContact C-N 3.33Å; R303-T305 PolarHBondContact O-N 3.46Å; R303-Y306 WeakPolarHBondContact O-CB 3.18Å; R303-Y306 PolarHBondContact O-N 2.67Å; R303-C307 PolarHBondContact O-N 2.76Å; R303-C307 PolarHBondContact O-SG 3.47Å; R303-C307 VanDerWaalsContact O-SG 3.33Å
304L93.1Very high92.1Very high1 Ų159.5 Ų59.51%0.00529%0.286CS..Hα-helixtrans-63.4-40.1176.8-174.3111000111.7L221 L254 L257 R258 I261 L300 N301 M302 C307 M308L221-L304 HydrophobicContact CD1-CD1 4.39Å; L221-L304 HydrophobicContact CD2-CB 4.32Å; L254-L304 HydrophobicContact CD1-CD1 3.55Å; L254-L304 HydrophobicContact CD1-CG 4.06Å; L254-L304 HydrophobicContact CG-CD1 4.2Å; L254-L304 HydrophobicContact CG-CG 4.44Å; L257-L304 HydrophobicContact CD2-CD1 4.47Å; L257-L304 HydrophobicContact CG-CD1 4.41Å; R258-L304 HydrophobicContact CB-CD1 4.11Å; R258-L304 HydrophobicContact CB-CD2 3.64Å; R258-L304 HydrophobicContact CB-CG 4.44Å; R258-L304 HydrophobicContact CG-CD2 3.44Å; R258-L304 VanDerWaalsContact CG-CD2 3.44Å; I261-L304 HydrophobicContact CD1-CD1 4.43Å; L300-L304 WeakPolarHBondContact O-CB 3.48Å; L300-L304 PolarHBondContact O-N 3.41Å; N301-L304 PolarHBondContact O-N 2.84Å; M302-L304 VanDerWaalsContact C-N 3.34Å; M302-L304 PolarHBondContact O-N 3.41Å; L304-C307 PolarHBondContact O-N 3.19Å; L304-M308 WeakPolarHBondContact O-CG 3.39Å; L304-M308 PolarHBondContact O-N 3.37Å
305T93.1Very high92.2Very high57 Ų5761.2 Ų61.235%0.3529%0.29SS..Hα-helixtrans-63.5-46.1175.6-57.10000111.2N301 M302 R303 C307 M308 E309N301-T305 WeakPolarHBondContact O-CB 3.37Å; N301-T305 PolarHBondContact O-N 3.46Å; N301-T305 PolarHBondContact O-OG1 2.93Å; M302-T305 PolarHBondContact O-N 3.12Å; R303-T305 VanDerWaalsContact C-N 3.33Å; R303-T305 PolarHBondContact O-N 3.46Å; T305-C307 VanDerWaalsContact C-N 3.33Å; T305-C307 PolarHBondContact O-N 3.1Å; T305-M308 WeakPolarHBondContact O-CB 3.46Å; T305-M308 PolarHBondContact O-N 3.26Å; T305-M308 VanDerWaalsContact O-N 3.1Å; T305-E309 WeakPolarHBondContact O-CG 3.22Å; T305-E309 PolarHBondContact O-N 2.87Å
306Y93.6Very high92.2Very high126 Ų12656.4 Ų56.449%0.49428%0.28SS..Hα-helixtrans-55.3-45.9173.8167.9-99.9000112.5M302 R303 M308 E309 L310M302-Y306 PolarHBondContact O-N 2.96Å; R303-Y306 WeakPolarHBondContact O-CB 3.18Å; R303-Y306 PolarHBondContact O-N 2.67Å; Y306-M308 VanDerWaalsContact C-N 3.32Å; Y306-M308 PolarHBondContact O-N 2.82Å; Y306-E309 PolarHBondContact O-N 2.87Å; Y306-L310 PolarHBondContact O-N 2.81Å
307C94.2Very high92Very high1 Ų157 Ų571%0.00729%0.286CS..Hα-helixtrans-62.6-38.9176.8-68.10000112.6F224 V225 L228 L254 R303 L304 T305 L310 L311F224-C307 HydrophobicContact CD1-CB 4.41Å; F224-C307 HydrophobicContact CE1-CB 4.11Å; V225-C307 WeakPolarHBondContact CG2-SG 3.27Å; L228-C307 HydrophobicContact CD1-CB 4.19Å; L254-C307 HydrophobicContact CD1-CB 4.16Å; L254-C307 HydrophobicContact CD2-CB 3.41Å; L254-C307 VanDerWaalsContact CD2-CB 3.41Å; L254-C307 HydrophobicContact CG-CB 4.46Å; R303-C307 PolarHBondContact O-N 2.76Å; R303-C307 PolarHBondContact O-SG 3.47Å; R303-C307 VanDerWaalsContact O-SG 3.33Å; L304-C307 PolarHBondContact O-N 3.19Å; T305-C307 VanDerWaalsContact C-N 3.33Å; T305-C307 PolarHBondContact O-N 3.1Å; C307-L310 PolarHBondContact O-N 2.93Å; C307-L311 WeakPolarHBondContact O-CG 3.33Å; C307-L311 PolarHBondContact O-N 3.37Å
308M93.3Very high91.9Very high15 Ų1558 Ų587%0.07429%0.291CS..Hα-helixtrans-64.5-44.1176.2-79.5-60.6-49.500111.9L254 F255 L304 T305 Y306 L310 L311 Q312L254-M308 HydrophobicContact CB-SD 4.42Å; L254-M308 HydrophobicContact CD2-CB 4.37Å; L254-M308 HydrophobicContact CD2-CG 3.63Å; L254-M308 HydrophobicContact CD2-SD 3.53Å; L254-M308 VanDerWaalsContact CD2-SD 3.53Å; L254-M308 HydrophobicContact CG-CG 4.3Å; L254-M308 HydrophobicContact CG-SD 4.01Å; F255-M308 HydrophobicContact CD1-SD 4.48Å; F255-M308 HydrophobicContact CD2-CE 4.31Å; F255-M308 HydrophobicContact CD2-SD 4.37Å; F255-M308 HydrophobicContact CE1-CE 3.81Å; F255-M308 HydrophobicContact CE1-SD 4.24Å; F255-M308 HydrophobicContact CE2-CE 3.49Å; F255-M308 VanDerWaalsContact CE2-CE 3.49Å; F255-M308 HydrophobicContact CE2-SD 4.11Å; F255-M308 HydrophobicContact CZ-CE 3.19Å; F255-M308 HydrophobicContact CZ-SD 4.05Å; L304-M308 WeakPolarHBondContact O-CG 3.39Å; L304-M308 PolarHBondContact O-N 3.37Å; T305-M308 WeakPolarHBondContact O-CB 3.46Å; T305-M308 PolarHBondContact O-N 3.26Å; T305-M308 VanDerWaalsContact O-N 3.1Å; Y306-M308 VanDerWaalsContact C-N 3.32Å; Y306-M308 PolarHBondContact O-N 2.82Å; M308-L310 VanDerWaalsContact C-N 3.35Å; M308-L311 PolarHBondContact O-N 3.49Å; M308-Q312 WeakPolarHBondContact O-CG 2.84Å; M308-Q312 PolarHBondContact O-N 2.97Å
309E94.2Very high91.8Very high112 Ų11252.7 Ų52.752%0.52328%0.277SS..Hα-helixtrans-61.4-42.8176.9-71.3171.1-179.400111.5T305 Y306 L311 Q312 L313T305-E309 WeakPolarHBondContact O-CG 3.22Å; T305-E309 PolarHBondContact O-N 2.87Å; Y306-E309 PolarHBondContact O-N 2.87Å; E309-L311 PolarHBondContact O-N 2.8Å; E309-Q312 PolarHBondContact O-N 2.77Å; E309-L313 PolarHBondContact O-N 2.78Å
310L92.8Very high91.7Very high17 Ų1754.5 Ų54.59%0.08928%0.281CS..Hα-helixtrans-61.1-45.8175.2178.661.9000111.6L228 V232 L235 Y306 C307 M308 Q312 L313 L314L228-L310 HydrophobicContact CB-CD2 4.28Å; L228-L310 HydrophobicContact CD1-CD2 4.26Å; L228-L310 HydrophobicContact CD2-CD2 4.47Å; V232-L310 HydrophobicContact CG2-CD1 4.17Å; V232-L310 HydrophobicContact CG2-CD2 3.44Å; V232-L310 VanDerWaalsContact CG2-CD2 3.44Å; V232-L310 HydrophobicContact CG2-CG 4.47Å; L235-L310 HydrophobicContact CD2-CD1 4.16Å; Y306-L310 PolarHBondContact O-N 2.81Å; C307-L310 PolarHBondContact O-N 2.93Å; M308-L310 VanDerWaalsContact C-N 3.35Å; L310-Q312 VanDerWaalsContact C-N 3.3Å; L310-Q312 PolarHBondContact O-N 3.19Å; L310-L313 WeakPolarHBondContact O-CB 3.33Å; L310-L313 PolarHBondContact O-N 3.1Å; L310-L314 HydrophobicContact CG-CD1 4.39Å; L310-L314 VanDerWaalsContact O-CG 3.31Å; L310-L314 WeakPolarHBondContact O-CG 3.13Å; L310-L314 PolarHBondContact O-N 3.48Å
311L92.6Very high91.5Very high4 Ų459.9 Ų59.92%0.02130%0.301CS..Hα-helixtrans-63.8-36.1177.8-70.5170.3000112.4F224 L228 V247 R250 A251 L254 C307 M308 E309 L314 D315F224-L311 HydrophobicContact CE1-CD1 4.45Å; F224-L311 HydrophobicContact CZ-CD1 4.14Å; L228-L311 HydrophobicContact CD2-CD2 4.26Å; V247-L311 HydrophobicContact CG1-CD2 4.34Å; R250-L311 HydrophobicContact CB-CD1 4.48Å; R250-L311 HydrophobicContact CB-CD2 3.84Å; A251-L311 HydrophobicContact CB-CD1 4.19Å; L254-L311 HydrophobicContact CB-CD1 4.39Å; L254-L311 HydrophobicContact CD2-CD1 3.76Å; C307-L311 WeakPolarHBondContact O-CG 3.33Å; C307-L311 PolarHBondContact O-N 3.37Å; M308-L311 PolarHBondContact O-N 3.49Å; E309-L311 PolarHBondContact O-N 2.8Å; L311-L314 HydrophobicContact CD2-CD1 4.3Å; L311-L314 PolarHBondContact O-N 3.38Å; L311-D315 PolarHBondContact O-N 3.03Å
312Q92.7Very high91.4Very high129 Ų12962.8 Ų62.860%0.60331%0.313SS*.Hα-helixtrans-64.6-40.5174-74.4174.5-12.700112M308 E309 L310 L314 D315 G316M308-Q312 WeakPolarHBondContact O-CG 2.84Å; M308-Q312 PolarHBondContact O-N 2.97Å; E309-Q312 PolarHBondContact O-N 2.77Å; L310-Q312 VanDerWaalsContact C-N 3.3Å; L310-Q312 PolarHBondContact O-N 3.19Å; Q312-L314 VanDerWaalsContact C-N 3.34Å; Q312-D315 PolarHBondContact O-N 3.38Å; Q312-G316 PolarHBondContact O-N 2.95Å
313L92Very high91.3Very high93 Ų9359.1 Ų59.149%0.48730%0.301SS..Hα-helixtrans-59.7-46.3173-176.6163.1000110.8L235 E309 L310 G316 N317L235-L313 HydrophobicContact CD1-CD2 4.17Å; L235-L313 HydrophobicContact CD2-CD2 3.77Å; E309-L313 PolarHBondContact O-N 2.78Å; L310-L313 WeakPolarHBondContact O-CB 3.33Å; L310-L313 PolarHBondContact O-N 3.1Å; L313-G316 PolarHBondContact O-N 2.75Å; L313-N317 PolarHBondContact O-N 2.98Å
314L91.2Very high91.3Very high0 Ų059.3 Ų59.30%031%0.306CS..Hα-helixtrans-62.4-46.5179.3-65.1172.1000111.9V231 L235 I240 L242 V247 L310 L311 Q312 N317 I318V231-L314 HydrophobicContact CG1-CD1 3.74Å; V231-L314 HydrophobicContact CG1-CD2 4Å; L235-L314 HydrophobicContact CD2-CD2 4.49Å; I240-L314 HydrophobicContact CD1-CD2 3.77Å; I240-L314 HydrophobicContact CG2-CD2 4.27Å; L242-L314 HydrophobicContact CD1-CD1 3.86Å; V247-L314 HydrophobicContact CG1-CB 4.34Å; V247-L314 HydrophobicContact CG2-CB 4.16Å; L310-L314 HydrophobicContact CG-CD1 4.39Å; L310-L314 VanDerWaalsContact O-CG 3.31Å; L310-L314 WeakPolarHBondContact O-CG 3.13Å; L310-L314 PolarHBondContact O-N 3.48Å; L311-L314 HydrophobicContact CD2-CD1 4.3Å; L311-L314 PolarHBondContact O-N 3.38Å; Q312-L314 VanDerWaalsContact C-N 3.34Å; L314-N317 PolarHBondContact O-N 3.06Å; L314-I318 WeakPolarHBondContact O-CG1 3.24Å; L314-I318 PolarHBondContact O-N 3.3Å; L314-I318 VanDerWaalsContact O-N 3.09Å
315D91.2Very high91.3Very high57 Ų5767.7 Ų67.731%0.30534%0.338SS..Hα-helixtrans-62.9-42.6177.4-170.847.9000111.5V247 L311 Q312 N317 I318 A319V247-D315 HydrophobicContact CG1-CB 4.1Å; L311-D315 PolarHBondContact O-N 3.03Å; Q312-D315 PolarHBondContact O-N 3.38Å; D315-N317 PolarHBondContact O-N 3.38Å; D315-I318 PolarHBondContact O-N 2.7Å; D315-A319 WeakPolarHBondContact O-CB 3.37Å; D315-A319 PolarHBondContact O-N 2.87Å
316G90.4Very high91.4Very high39 Ų3968.6 Ų68.640%0.40234%0.34SS..Hα-helixtrans-58.7-44175.300000113Q312 L313 A319 H320Q312-G316 PolarHBondContact O-N 2.95Å; L313-G316 PolarHBondContact O-N 2.75Å; G316-A319 PolarHBondContact O-N 2.98Å; G316-H320 WeakPolarHBondContact O-CB 3.43Å; G316-H320 PolarHBondContact O-N 2.73Å
317N88.2Confident91.5Very high50 Ų5068.5 Ų68.527%0.26734%0.344SS..Hα-helixtrans-66.7-38177.5-173.167.4000112.5I240 L313 L314 D315 H320 R321I240-N317 HydrophobicContact CD1-CB 3.83Å; I240-N317 WeakPolarHBondContact CD1-ND2 3.49Å; L313-N317 PolarHBondContact O-N 2.98Å; L314-N317 PolarHBondContact O-N 3.06Å; D315-N317 PolarHBondContact O-N 3.38Å; N317-H320 PolarHBondContact O-N 3.09Å; N317-R321 WeakPolarHBondContact O-CG 3.32Å; N317-R321 PolarHBondContact O-N 3.01Å; N317-R321 VanDerWaalsContact O-N 3.08Å
318I86.8Confident91.6Very high28 Ų2872.1 Ų72.114%0.14437%0.366CS..Hα-helixtrans-65.9-43.2176-67.6168.8000110.7L242 K244 V247 L314 D315 H320 R321 H322L242-I318 WeakPolarHBondContact O-CD1 3.22Å; K244-I318 HydrophobicContact CB-CG2 3.99Å; K244-I318 HydrophobicContact CG-CG2 4.43Å; V247-I318 HydrophobicContact CB-CD1 4.47Å; V247-I318 HydrophobicContact CG2-CD1 3.61Å; L314-I318 WeakPolarHBondContact O-CG1 3.24Å; L314-I318 PolarHBondContact O-N 3.3Å; L314-I318 VanDerWaalsContact O-N 3.09Å; D315-I318 PolarHBondContact O-N 2.7Å; I318-H320 VanDerWaalsContact C-N 3.34Å; I318-H320 PolarHBondContact O-N 3.07Å; I318-R321 PolarHBondContact O-N 2.89Å; I318-H322 PolarHBondContact O-N 2.96Å; I318-H322 VanDerWaalsContact O-N 3.09Å
319A88.3Confident91.8Very high48 Ų4876.4 Ų76.440%0.39739%0.387SS..Hα-helixtrans-62-41.5176.100000111.9D315 G316 H322 S323D315-A319 WeakPolarHBondContact O-CB 3.37Å; D315-A319 PolarHBondContact O-N 2.87Å; G316-A319 PolarHBondContact O-N 2.98Å; A319-H322 WeakPolarHBondContact O-CB 3.04Å; A319-H322 PolarHBondContact O-N 2.82Å; A319-S323 PolarHBondContact O-N 3.09Å
320H89.5Confident91.9Very high111 Ų11174.8 Ų74.851%0.51439%0.385SS..Hα-helixtrans-62.1-44.7176.6-175.457.8000112.3G316 N317 I318 H322 S323 I324G316-H320 WeakPolarHBondContact O-CB 3.43Å; G316-H320 PolarHBondContact O-N 2.73Å; N317-H320 PolarHBondContact O-N 3.09Å; I318-H320 VanDerWaalsContact C-N 3.34Å; I318-H320 PolarHBondContact O-N 3.07Å; H320-H322 VanDerWaalsContact C-N 3.29Å; H320-H322 PolarHBondContact O-N 2.99Å; H320-S323 WeakPolarHBondContact O-CB 3.1Å; H320-S323 PolarHBondContact O-N 2.96Å; H320-S323 VanDerWaalsContact O-N 3.12Å; H320-I324 WeakPolarHBondContact NE2-CD1 3.35Å; H320-I324 PolarHBondContact O-N 2.83Å
321R86.8Confident92.1Very high116 Ų11678 Ų7844%0.43841%0.405SS..Hα-helixtrans-59.6-39.2174.3-73.4-177.6175.3-169.4-1.4112.5N317 I318 R325N317-R321 WeakPolarHBondContact O-CG 3.32Å; N317-R321 PolarHBondContact O-N 3.01Å; N317-R321 VanDerWaalsContact O-N 3.08Å; I318-R321 PolarHBondContact O-N 2.89Å; R321-R325 PolarHBondContact O-N 2.61Å
322H87.6Confident92.3Very high105 Ų10582.8 Ų82.849%0.48643%0.43SS..Hα-helixtrans-64.7-41.5175.3-172.4-81000111.7I318 A319 H320 R325 L326I318-H322 PolarHBondContact O-N 2.96Å; I318-H322 VanDerWaalsContact O-N 3.09Å; A319-H322 WeakPolarHBondContact O-CB 3.04Å; A319-H322 PolarHBondContact O-N 2.82Å; H320-H322 VanDerWaalsContact C-N 3.29Å; H320-H322 PolarHBondContact O-N 2.99Å; H322-R325 PolarHBondContact O-N 2.84Å; H322-L326 WeakPolarHBondContact O-CG 3.3Å; H322-L326 PolarHBondContact O-N 3.48Å; H322-L326 VanDerWaalsContact O-N 3.09Å
323S92.3Very high92.5Very high66 Ų6681.7 Ų81.746%0.46243%0.428SS..Hα-helixtrans-60.1-49.4175.3-167.10000111.8A319 H320 R325 L326 E327A319-S323 PolarHBondContact O-N 3.09Å; H320-S323 WeakPolarHBondContact O-CB 3.1Å; H320-S323 PolarHBondContact O-N 2.96Å; H320-S323 VanDerWaalsContact O-N 3.12Å; S323-R325 VanDerWaalsContact C-N 3.29Å; S323-R325 PolarHBondContact O-N 2.75Å; S323-L326 PolarHBondContact O-N 2.95Å; S323-E327 PolarHBondContact O-N 2.73Å
324I93.5Very high92.7Very high71 Ų7182.3 Ų82.336%0.36443%0.43SS..Hα-helixtrans-59.5-41.2177.5-68.2166.8000110.7H320 L326 E327 V328H320-I324 WeakPolarHBondContact NE2-CD1 3.35Å; H320-I324 PolarHBondContact O-N 2.83Å; I324-L326 VanDerWaalsContact C-N 3.33Å; I324-L326 PolarHBondContact O-N 3.28Å; I324-E327 PolarHBondContact O-N 2.88Å; I324-V328 HydrophobicContact CG2-CG2 4.21Å; I324-V328 VanDerWaalsContact O-CG2 3.31Å; I324-V328 WeakPolarHBondContact O-CG2 3.47Å; I324-V328 PolarHBondContact O-N 2.8Å
325R93.4Very high93Very high177 Ų17787.7 Ų87.767%0.66846%0.458SS*.Hα-helixtrans-61.8-41.6178.5-164.2-176.290175.36.7112.1R321 H322 S323 M329R321-R325 PolarHBondContact O-N 2.61Å; H322-R325 PolarHBondContact O-N 2.84Å; S323-R325 VanDerWaalsContact C-N 3.29Å; S323-R325 PolarHBondContact O-N 2.75Å; R325-M329 PolarHBondContact O-N 3.02Å; R325-M329 VanDerWaalsContact O-N 3.11Å
326L94.4Very high93.2Very high76 Ų7686.8 Ų86.840%0.39846%0.459SS..Hα-helixtrans-66.8-42.2176.1-69.4179.3000111.4H322 S323 I324 M329 V330H322-L326 WeakPolarHBondContact O-CG 3.3Å; H322-L326 PolarHBondContact O-N 3.48Å; H322-L326 VanDerWaalsContact O-N 3.09Å; S323-L326 PolarHBondContact O-N 2.95Å; I324-L326 VanDerWaalsContact C-N 3.33Å; I324-L326 PolarHBondContact O-N 3.28Å; L326-M329 WeakPolarHBondContact O-CB 3.21Å; L326-M329 PolarHBondContact O-N 2.8Å; L326-V330 WeakPolarHBondContact O-CG2 3.37Å; L326-V330 PolarHBondContact O-N 2.95Å
327E96.1Very high93.5Very high123 Ų12390.6 Ų90.658%0.57547%0.466SS*.Hα-helixtrans-60.6-47.7177.6-174.8179.2175.800111.5S323 I324 M329 V330 V331S323-E327 PolarHBondContact O-N 2.73Å; I324-E327 PolarHBondContact O-N 2.88Å; E327-M329 VanDerWaalsContact C-N 3.27Å; E327-M329 PolarHBondContact O-N 3Å; E327-V330 PolarHBondContact O-N 3.09Å; E327-V330 VanDerWaalsContact O-N 3.11Å; E327-V331 WeakPolarHBondContact O-CG2 3.15Å; E327-V331 PolarHBondContact O-N 3.39Å
328V96.7Very high93.9Very high77 Ų7791.9 Ų91.947%0.46748%0.476SS..Hα-helixtrans-59.9-38.5175.4171.70000111.3I324 V331 L332I324-V328 HydrophobicContact CG2-CG2 4.21Å; I324-V328 VanDerWaalsContact O-CG2 3.31Å; I324-V328 WeakPolarHBondContact O-CG2 3.47Å; I324-V328 PolarHBondContact O-N 2.8Å; V328-V331 PolarHBondContact O-N 2.94Å; V328-L332 HydrophobicContact CG1-CD1 4.03Å; V328-L332 HydrophobicContact CG1-CG 4.36Å; V328-L332 WeakPolarHBondContact O-CB 3.41Å; V328-L332 VanDerWaalsContact O-CG 3.28Å; V328-L332 WeakPolarHBondContact O-CG 3.4Å; V328-L332 PolarHBondContact O-N 2.95Å
329M96.8Very high94.3Very high105 Ų10595.7 Ų95.752%0.51750%0.496SS..Hα-helixtrans-62.2-43.6175.3-169.4-17384.900111.7R325 L326 E327 L332 L333R325-M329 PolarHBondContact O-N 3.02Å; R325-M329 VanDerWaalsContact O-N 3.11Å; L326-M329 WeakPolarHBondContact O-CB 3.21Å; L326-M329 PolarHBondContact O-N 2.8Å; E327-M329 VanDerWaalsContact C-N 3.27Å; E327-M329 PolarHBondContact O-N 3Å; M329-L332 PolarHBondContact O-N 3.49Å; M329-L333 HydrophobicContact CE-CD1 4.32Å; M329-L333 HydrophobicContact CG-CD1 4.45Å; M329-L333 VanDerWaalsContact O-CG 3.3Å; M329-L333 WeakPolarHBondContact O-CG 3.17Å; M329-L333 PolarHBondContact O-N 2.9Å
330V96.7Very high94.7Very high78 Ų78100.4 Ų100.447%0.47351%0.508SS..Hα-helixtrans-63.1-45.5177.3173.30000111.1L326 E327 L332 L333 I334L326-V330 WeakPolarHBondContact O-CG2 3.37Å; L326-V330 PolarHBondContact O-N 2.95Å; E327-V330 PolarHBondContact O-N 3.09Å; E327-V330 VanDerWaalsContact O-N 3.11Å; V330-L332 VanDerWaalsContact C-N 3.33Å; V330-L332 PolarHBondContact O-N 3.11Å; V330-L333 PolarHBondContact O-N 3Å; V330-I334 HydrophobicContact CG1-CD1 4.09Å; V330-I334 WeakPolarHBondContact O-CG1 3.48Å; V330-I334 PolarHBondContact O-N 3.49Å; V330-I334 VanDerWaalsContact O-N 3.1Å
331V96.5Very high94.9Very high86 Ų86100.6 Ų100.652%0.52151%0.509SS..Hα-helixtrans-61-42177.8173.80000111.4E327 V328 I334 L335E327-V331 WeakPolarHBondContact O-CG2 3.15Å; E327-V331 PolarHBondContact O-N 3.39Å; V328-V331 PolarHBondContact O-N 2.94Å; V331-I334 PolarHBondContact O-N 3.38Å; V331-L335 PolarHBondContact O-N 3.45Å
332L97.1Very high95.3Very high103 Ų10399.2 Ų99.254%0.53951%0.509SS..Hα-helixtrans-65.4-37.1177-73.2174.7000112.9V328 M329 V330 L335 A336V328-L332 HydrophobicContact CG1-CD1 4.03Å; V328-L332 HydrophobicContact CG1-CG 4.36Å; V328-L332 WeakPolarHBondContact O-CB 3.41Å; V328-L332 VanDerWaalsContact O-CG 3.28Å; V328-L332 WeakPolarHBondContact O-CG 3.4Å; V328-L332 PolarHBondContact O-N 2.95Å; M329-L332 PolarHBondContact O-N 3.49Å; V330-L332 VanDerWaalsContact C-N 3.33Å; V330-L332 PolarHBondContact O-N 3.11Å; L332-L335 PolarHBondContact O-N 3.12Å; L332-A336 WeakPolarHBondContact O-CB 3.15Å; L332-A336 PolarHBondContact O-N 2.76Å
333L96.4Very high95.6Very high107 Ų10799.7 Ų99.756%0.5651%0.513SS*.Hα-helixtrans-65.1-43.5176.6-72.8170000111.7M329 V330 L335 A336 E337M329-L333 HydrophobicContact CE-CD1 4.32Å; M329-L333 HydrophobicContact CG-CD1 4.45Å; M329-L333 VanDerWaalsContact O-CG 3.3Å; M329-L333 WeakPolarHBondContact O-CG 3.17Å; M329-L333 PolarHBondContact O-N 2.9Å; V330-L333 PolarHBondContact O-N 3Å; L333-L335 VanDerWaalsContact C-N 3.33Å; L333-L335 PolarHBondContact O-N 2.88Å; L333-A336 PolarHBondContact O-N 3.37Å; L333-E337 PolarHBondContact O-N 3.13Å
334I96.6Very high95.6Very high106 Ų106102.2 Ų102.254%0.54452%0.517SS..Hα-helixtrans-62.2-43.4175.8-65.3168000110.4V330 V331 A336 E337 V338V330-I334 HydrophobicContact CG1-CD1 4.09Å; V330-I334 WeakPolarHBondContact O-CG1 3.48Å; V330-I334 PolarHBondContact O-N 3.49Å; V330-I334 VanDerWaalsContact O-N 3.1Å; V331-I334 PolarHBondContact O-N 3.38Å; I334-A336 VanDerWaalsContact C-N 3.33Å; I334-A336 PolarHBondContact O-N 3.24Å; I334-E337 PolarHBondContact O-N 2.78Å; I334-V338 WeakPolarHBondContact O-CG2 3.22Å; I334-V338 PolarHBondContact O-N 3.02Å
335L97.3Very high95.5Very high112 Ų112105 Ų10559%0.58653%0.527SS*.Hα-helixtrans-62.3-40.9177.6-177.665.7000112.1V331 L332 L333 L339V331-L335 PolarHBondContact O-N 3.45Å; L332-L335 PolarHBondContact O-N 3.12Å; L333-L335 VanDerWaalsContact C-N 3.33Å; L333-L335 PolarHBondContact O-N 2.88Å; L335-L339 WeakPolarHBondContact O-CB 3.43Å; L335-L339 PolarHBondContact O-N 2.84Å
336A96.5Very high95.5Very high38 Ų38101.7 Ų101.731%0.31452%0.522SS..Hα-helixtrans-63.9-43.817700000111.7L332 L333 I334 L339 F340L332-A336 WeakPolarHBondContact O-CB 3.15Å; L332-A336 PolarHBondContact O-N 2.76Å; L333-A336 PolarHBondContact O-N 3.37Å; I334-A336 VanDerWaalsContact C-N 3.33Å; I334-A336 PolarHBondContact O-N 3.24Å; A336-L339 WeakPolarHBondContact O-CB 3.4Å; A336-L339 PolarHBondContact O-N 3.46Å; A336-F340 WeakPolarHBondContact O-CD2 3.39Å; A336-F340 PolarHBondContact O-N 2.72Å
337E96Very high95.4Very high119 Ų119105.3 Ų105.356%0.55654%0.537SS*.Hα-helixtrans-60-48177.1-169.267.5-171.900111.6L333 I334 L339 F340 E341L333-E337 PolarHBondContact O-N 3.13Å; I334-E337 PolarHBondContact O-N 2.78Å; E337-L339 VanDerWaalsContact C-N 3.27Å; E337-L339 PolarHBondContact O-N 3.38Å; E337-F340 PolarHBondContact O-N 3.33Å; E337-E341 PolarHBondContact O-N 3.35Å
338V96.5Very high95Very high77 Ų77104 Ų10447%0.46754%0.541SS..Hα-helixtrans-61.5-38.3177.21730000111I334 I342I334-V338 WeakPolarHBondContact O-CG2 3.22Å; I334-V338 PolarHBondContact O-N 3.02Å; V338-I342 HydrophobicContact CG1-CD1 3.89Å; V338-I342 WeakPolarHBondContact O-CD1 3.32Å; V338-I342 VanDerWaalsContact O-CG1 3.22Å; V338-I342 WeakPolarHBondContact O-CG1 3.37Å; V338-I342 PolarHBondContact O-N 3.01Å
339L96.1Very high94.2Very high108 Ų108110.2 Ų110.257%0.56556%0.556SS**Hα-helixtrans-65.3-42.5175.9-173.671.1000111.9L335 A336 E337 I342 M343L335-L339 WeakPolarHBondContact O-CB 3.43Å; L335-L339 PolarHBondContact O-N 2.84Å; A336-L339 WeakPolarHBondContact O-CB 3.4Å; A336-L339 PolarHBondContact O-N 3.46Å; E337-L339 VanDerWaalsContact C-N 3.27Å; E337-L339 PolarHBondContact O-N 3.38Å; L339-I342 PolarHBondContact O-N 3.39Å; L339-M343 VanDerWaalsContact O-CG 3.29Å; L339-M343 WeakPolarHBondContact O-CG 3.26Å; L339-M343 PolarHBondContact O-N 2.68Å
340F95.3Very high93Very high147 Ų147111 Ų11165%0.64559%0.592SS**Hα-helixtrans-62.9-43.2176.8-79.6-63.5000112.2A336 E337 I342 M343 H344A336-F340 WeakPolarHBondContact O-CD2 3.39Å; A336-F340 PolarHBondContact O-N 2.72Å; E337-F340 PolarHBondContact O-N 3.33Å; F340-I342 VanDerWaalsContact C-N 3.35Å; F340-I342 PolarHBondContact O-N 2.92Å; F340-M343 PolarHBondContact O-N 3.12Å; F340-H344 WeakPolarHBondContact O-CB 3.45Å; F340-H344 PolarHBondContact O-N 3.13Å
341E94.9Very high92.8Very high115 Ų115112.7 Ų112.754%0.53760%0.598SS.*Hα-helixtrans-61.3-42.1175.2-78.3-73.3-175.600112.1E337 M343 H344 F345E337-E341 PolarHBondContact O-N 3.35Å; E341-M343 PolarHBondContact O-N 2.7Å; E341-H344 PolarHBondContact O-N 3.04Å; E341-F345 WeakPolarHBondContact O-CB 2.91Å; E341-F345 PolarHBondContact O-N 3.44Å
342I94.3Very high92.6Very high88 Ų88114.1 Ų114.145%0.45160%0.602SS.*Hα-helixtrans-63.1-43175.3-69165.5000110.9V338 L339 F340 F345 L346V338-I342 HydrophobicContact CG1-CD1 3.89Å; V338-I342 WeakPolarHBondContact O-CD1 3.32Å; V338-I342 VanDerWaalsContact O-CG1 3.22Å; V338-I342 WeakPolarHBondContact O-CG1 3.37Å; V338-I342 PolarHBondContact O-N 3.01Å; L339-I342 PolarHBondContact O-N 3.39Å; F340-I342 VanDerWaalsContact C-N 3.35Å; F340-I342 PolarHBondContact O-N 2.92Å; I342-F345 PolarHBondContact O-N 3.19Å; I342-L346 HydrophobicContact CG2-CD1 4.24Å; I342-L346 WeakPolarHBondContact O-CG 3.42Å; I342-L346 PolarHBondContact O-N 3.16Å
343M93.7Very high92.4Very high114 Ų114114.7 Ų114.756%0.56261%0.605SS**Hα-helixtrans-63.5-45.5178-73.2-66.2-62.500111.9L339 F340 E341 F345 L346 E347L339-M343 VanDerWaalsContact O-CG 3.29Å; L339-M343 WeakPolarHBondContact O-CG 3.26Å; L339-M343 PolarHBondContact O-N 2.68Å; F340-M343 PolarHBondContact O-N 3.12Å; E341-M343 PolarHBondContact O-N 2.7Å; M343-F345 PolarHBondContact O-N 3.12Å; M343-L346 PolarHBondContact O-N 3.1Å; M343-E347 PolarHBondContact O-N 3.21Å
344H92.5Very high92.2Very high119 Ų119115.2 Ų115.255%0.55161%0.608SS**Hα-helixtrans-63.7-40.4177178.5-96.2000112F340 E341 L346 E347 S348F340-H344 WeakPolarHBondContact O-CB 3.45Å; F340-H344 PolarHBondContact O-N 3.13Å; E341-H344 PolarHBondContact O-N 3.04Å; H344-L346 VanDerWaalsContact C-N 3.32Å; H344-L346 PolarHBondContact O-N 3.05Å; H344-E347 PolarHBondContact O-N 3.27Å; H344-S348 WeakPolarHBondContact O-CB 3.39Å; H344-S348 PolarHBondContact O-N 3.49Å
345F92.6Very high91.9Very high129 Ų129115.8 Ų115.857%0.56661%0.612SS**Hα-helixtrans-62.4-38.3175.2179-99.1000112.7E341 I342 M343 R349E341-F345 WeakPolarHBondContact O-CB 2.91Å; E341-F345 PolarHBondContact O-N 3.44Å; I342-F345 PolarHBondContact O-N 3.19Å; M343-F345 PolarHBondContact O-N 3.12Å; F345-R349 PolarHBondContact O-N 3.21Å
346L93.2Very high91.5Very high109 Ų109116 Ų11657%0.57161%0.614SS**Hα-helixtrans-67.8-41.2175.6-72.3172.1000111.9I342 M343 H344 R349 G350I342-L346 HydrophobicContact CG2-CD1 4.24Å; I342-L346 WeakPolarHBondContact O-CG 3.42Å; I342-L346 PolarHBondContact O-N 3.16Å; M343-L346 PolarHBondContact O-N 3.1Å; H344-L346 VanDerWaalsContact C-N 3.32Å; H344-L346 PolarHBondContact O-N 3.05Å; L346-R349 PolarHBondContact O-N 3.5Å; L346-G350 PolarHBondContact O-N 3.14Å
347E92.1Very high91.2Very high152 Ų152121.6 Ų121.671%0.7164%0.635SS**Hα-helixtrans-65.4-44176.6-173.5172.7-170.400111.8M343 H344 R349 G350M343-E347 PolarHBondContact O-N 3.21Å; H344-E347 PolarHBondContact O-N 3.27Å; E347-R349 PolarHBondContact O-N 2.87Å; E347-G350 PolarHBondContact O-N 3.09Å; E347-G350 VanDerWaalsContact O-N 3.15Å; E347-G350 VanDerWaalsContact O-OXT 3.13Å
348S87.1Confident90.8Very high94 Ų94121.8 Ų121.866%0.65764%0.641SS**THydrogen-bonded Turntrans-63.5-14.1178.2-179.10000114.2H344H344-S348 WeakPolarHBondContact O-CB 3.39Å; H344-S348 PolarHBondContact O-N 3.49Å
349R80.7Confident90.3Very high208 Ų208125.5 Ų125.579%0.78566%0.656SS**THydrogen-bonded Turntrans-96.8-20.2178.1-167174-179.81781.1113.1F345 L346 E347F345-R349 PolarHBondContact O-N 3.21Å; L346-R349 PolarHBondContact O-N 3.5Å; E347-R349 PolarHBondContact O-N 2.87Å
350G71.4Confident89.8Confident123 Ų123127.1 Ų127.1100%1.26866%0.664SS**  trans-84.30172.800000111L346 E347L346-G350 PolarHBondContact O-N 3.14Å; E347-G350 PolarHBondContact O-N 3.09Å; E347-G350 VanDerWaalsContact O-N 3.15Å; E347-G350 VanDerWaalsContact O-OXT 3.13Å

Retrieved 350 of 350 residues in 103.7 ms (Link to these results)