A0A061IPF1_CRIGR Loading...

28S ribosomal protein S24

AlphaFold DB , UniProt , Accession A0A061IPF1, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Mrps24, Length 167 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
1M40Very low32.8Very low250 Ų250152.5 Ų152.5100%1.23286%0.858SS**  0116.40-92.2168.1167.400107.9
2A31.2Very low33.5Very low96 Ų96151.9 Ų151.979%0.79386%0.86SS**  trans-81.2169-172.500000112.8
3L30.2Very low33.3Very low168 Ų168146 Ų14688%0.8885%0.853SS**  trans133.893.4154.3-72.2162.7000107.9
4S27.3Very low33.7Very low114 Ų114146.9 Ų146.980%0.79785%0.848SS**  64.3137.658.6-167.10000114.8
5A32.3Very low33.9Very low97 Ų97148.4 Ų148.480%0.80285%0.851SS**  trans93.5135.5161.700000116.5
6S28.8Very low34.4Very low109 Ų109145.2 Ų145.276%0.76284%0.84SS**  cis-171140.7-1.2173.90000110.1
7V39.3Very low34.3Very low120 Ų120143.8 Ų143.873%0.72784%0.839SS**  trans-2133.7150-175.80000118.2
8R27.9Very low34.8Very low245 Ų245142.1 Ų142.193%0.92584%0.836SS**  trans-155109.1131.1-102.5167.9-149.6-142.36.3110.6
9R40Very low34.9Very low235 Ų235146.5 Ų146.589%0.88784%0.837SS**  trans-70.2143.8154.3-74.8-177.6-178.3-162.90.3108.2
10L33Very low35.1Very low173 Ų173148.4 Ų148.491%0.90684%0.838SS**  trans174.2115.6150.7-91151000102.8
11G31.4Very low35.5Very low71 Ų71148.2 Ų148.273%0.73283%0.834SS**  120.4122.355.600000105.7
12V40.8Very low35.5Very low145 Ų145141.9 Ų141.988%0.87981%0.812SS**  trans-32.7128.5179.5176.60000114.3M14V12-M14 HydrophobicContact CG1-CB 4.3Å
13G31.1Very low36Very low75 Ų75142 Ų14277%0.77381%0.806SS**  trans-131.772.4162.500000109.4L15G13-L15 PolarHBondContact O-N 3.27Å; G13-L15 VanDerWaalsContact O-N 3.14Å
14M38.3Very low37.1Very low158 Ų158137.8 Ų137.878%0.77880%0.795SS**  trans-69.5101.3167.5-177.1172.3179.700107.6V12V12-M14 HydrophobicContact CG1-CB 4.3Å
15L37.3Very low37.9Very low170 Ų170143.4 Ų143.489%0.8980%0.799SS**  trans-110.587.2158.3-82.2165.5000107.1G13 C17G13-L15 PolarHBondContact O-N 3.27Å; G13-L15 VanDerWaalsContact O-N 3.14Å; L15-C17 PolarHBondContact O-N 3.02Å
16S41Very low38.8Very low97 Ų97149.1 Ų149.168%0.67880%0.8SS**  trans-56.1114.5159.651.30000109
17C33.3Very low40.3Very low122 Ų122148.1 Ų148.182%0.82480%0.798SS**  trans-144.797153.5-159.90000108.4L15 R19L15-C17 PolarHBondContact O-N 3.02Å; C17-R19 PolarHBondContact O-N 3.29Å
18S43.2Very low41.4Very low112 Ų112149.3 Ų149.378%0.78380%0.8SS**  trans-53.9117168.5-68.10000109.9
19R36.9Very low42.8Very low227 Ų227145.6 Ų145.686%0.85779%0.792SS**  trans-127.195.9146.2-104.7178.3170.5-169.7-2.4105.9C17 L21C17-R19 PolarHBondContact O-N 3.29Å; R19-L21 PolarHBondContact O-N 3.06Å
20E39.9Very low44.1Very low184 Ų184141 Ų14186%0.8679%0.791SS**  trans-47.292.9159.2-70.4-94.4152.900107.8
21L41.6Very low45.9Very low145 Ų145136.4 Ų136.476%0.75977%0.773SS**  trans-74.1122.3160.7-70169.5000104.5R19 C23R19-L21 PolarHBondContact O-N 3.06Å; L21-C23 VanDerWaalsContact C-N 3.34Å; L21-C23 PolarHBondContact O-N 3.08Å
22P40.8Very low47.7Very low117 Ų117137.3 Ų137.376%0.7677%0.774SS**  trans-57.6110.9167.923.2-28.9000105.3A24P22-A24 PolarHBondContact O-N 3.18Å
23C41.8Very low49.2Very low99 Ų99137 Ų13767%0.66977%0.772SS**  trans-62.390.1167.527.60000104.4L21 W25L21-C23 VanDerWaalsContact C-N 3.34Å; L21-C23 PolarHBondContact O-N 3.08Å; C23-W25 PolarHBondContact O-N 3.07Å
24A53.3Low51Low79 Ų79138.2 Ų138.265%0.65377%0.767SS**  trans-64.689.4162.500000104.3P22 R26P22-A24 PolarHBondContact O-N 3.18Å; A24-R26 PolarHBondContact O-N 3.45Å
25W43.2Very low52.9Low232 Ų232135.2 Ų135.288%0.87977%0.767SS**  trans-60.680.1163.5-78.165.1000106C23 A27C23-W25 PolarHBondContact O-N 3.07Å; W25-A27 PolarHBondContact O-N 2.83Å
26R52.9Low55.3Low217 Ų217134.1 Ų134.182%0.81976%0.756SS**  trans-64.895.7163.2-69.7-174.2-175.4-147.11.7103.9A24 L28A24-R26 PolarHBondContact O-N 3.45Å; R26-L28 PolarHBondContact O-N 3.46Å
27A59.2Low57.6Low87 Ų87135.4 Ų135.472%0.71976%0.755SS**  trans-60.490.5167.100000107W25 H29W25-A27 PolarHBondContact O-N 2.83Å; A27-H29 VanDerWaalsContact C-N 3.32Å; A27-H29 PolarHBondContact O-N 3.37Å
28L62.2Low60.4Low146 Ų146138.9 Ų138.976%0.76475%0.751SS**  trans-6798.5168-71.5172.4000105.8R26 T30R26-L28 PolarHBondContact O-N 3.46Å; L28-T30 PolarHBondContact O-N 2.91Å
29H57Low62.7Low166 Ų166137 Ų13777%0.76974%0.742SS**  trans-64.5100.5165-98.5-82.2000107.8A27 S31A27-H29 VanDerWaalsContact C-N 3.32Å; A27-H29 PolarHBondContact O-N 3.37Å; H29-S31 VanDerWaalsContact C-N 3.27Å
30T67.2Low65.4Low139 Ų139130 Ų13085%0.85373%0.732SS**  trans-82.9-2176.650.40000113.1L28L28-T30 PolarHBondContact O-N 2.91Å
31S70.7Confident68Low77 Ų77126.3 Ų126.354%0.53871%0.71SS.*SBendtrans-72.4130.6173.357.80000110.5H29 V33H29-S31 VanDerWaalsContact C-N 3.27Å; S31-V33 PolarHBondContact O-N 2.71Å
32A69.7Low70.5Confident90 Ų90121.5 Ų121.574%0.74469%0.687SS**  trans-51.9130.1171.500000110.6C34A32-C34 PolarHBondContact O-N 3.18Å
33V71.9Confident72.9Confident138 Ų138122 Ų12284%0.83667%0.674SS**  trans-59.6111174.3176.50000107.8S31 A35S31-V33 PolarHBondContact O-N 2.71Å; V33-A35 VanDerWaalsContact C-N 3.32Å; V33-A35 PolarHBondContact O-N 2.93Å
34C68.6Low75.4Confident101 Ų101123.3 Ų123.368%0.68268%0.678SS**  trans-64.894.8171.8-65.60000109.2A32 K36A32-C34 PolarHBondContact O-N 3.18Å; C34-K36 HydrophobicContact CB-CG 4.46Å; C34-K36 PolarHBondContact O-N 3.33Å
35A79.5Confident77.2Confident94 Ų94122.3 Ų122.378%0.77767%0.67SS**  trans-71.574.7176.800000110.6V33V33-A35 VanDerWaalsContact C-N 3.32Å; V33-A35 PolarHBondContact O-N 2.93Å
36K86.6Confident79.6Confident148 Ų148120.2 Ų120.264%0.64367%0.667SS**  trans-76.3130.9175.2-63.5-178.2-177.5179.60109.9C34 R38C34-K36 HydrophobicContact CB-CG 4.46Å; C34-K36 PolarHBondContact O-N 3.33Å; K36-R38 WeakPolarHBondContact O-CG 3.13Å; K36-R38 PolarHBondContact O-N 3.4Å
37N90.3Very high81.5Confident123 Ų123111.4 Ų111.466%0.65864%0.644SS**  trans-54.5124.7175.1-69.3-27.4000111.7R41N37-R41 WeakPolarHBondContact O-CD 3.37Å
38R90.8Very high83.1Confident196 Ų196113 Ų11374%0.7464%0.64SS**  trans-114.2-16.6-176.7-47.8-155.9169.5178.7-1.8114.7K36 A40 R41K36-R38 WeakPolarHBondContact O-CG 3.13Å; K36-R38 PolarHBondContact O-N 3.4Å; R38-A40 PolarHBondContact O-N 3.48Å; R38-R41 PolarHBondContact O-N 3Å
39A93Very high84.7Confident72 Ų72110.7 Ų110.760%0.59562%0.624SS**THydrogen-bonded Turntrans-59.9125-173.500000112.2R41 P59A39-R41 WeakPolarHBondContact O-CG 3.4Å; A39-R41 PolarHBondContact O-N 2.85Å; A39-R41 VanDerWaalsContact O-N 3.11Å; A39-P59 WeakPolarHBondContact O-CD 3.25Å
40A93.2Very high86.6Confident79 Ų79106.2 Ų106.265%0.65361%0.61SS**THydrogen-bonded Turntrans41.145-179.900000114.4R38 P59R38-A40 PolarHBondContact O-N 3.48Å; A40-P59 HydrophobicContact CB-CG 3.86Å
41R93.9Very high88Confident108 Ų10899.7 Ų99.741%0.40857%0.57SS.*  trans-118.3121.7174.6-73.4173.8-172.7-120.37.2109.6N37 R38 A39 A58 H60N37-R41 WeakPolarHBondContact O-CD 3.37Å; R38-R41 PolarHBondContact O-N 3Å; A39-R41 WeakPolarHBondContact O-CG 3.4Å; A39-R41 PolarHBondContact O-N 2.85Å; A39-R41 VanDerWaalsContact O-N 3.11Å; R41-A58 HydrophobicContact CG-CB 3.95Å; R41-H60 PolarHBondContact NH2-CE1 2.7Å
42V94Very high89.2Confident44 Ų4496.1 Ų96.127%0.26755%0.545SS..PPolyproline II helixtrans-73.2126.5167.9-177.40000108.7K49 V51 E55V42-K49 HydrophobicContact CG1-CD 4.1Å; V42-V51 HydrophobicContact CG1-CG2 4.08Å; V42-V51 HydrophobicContact CG2-CG1 4.17Å; V42-E55 HydrophobicContact CG2-CB 4.15Å; V42-E55 WeakPolarHBondContact CG2-O 3.49Å
43R92.6Very high90.4Very high127 Ų12796.1 Ų96.148%0.47953%0.526SS..PPolyproline II helixtrans-72.5142.2177.4-68.9-71173.4-168.8-7.6110.7
44V92.9Very high91.5Very high127 Ų12791.5 Ų91.577%0.7750%0.496SS*.PPolyproline II helixtrans-60.6133.3173.6-176.50000109.8I167V44-I167 VanDerWaalsContact CA-CG2 3.46Å; V44-I167 HydrophobicContact CB-CG2 4.25Å; V44-I167 HydrophobicContact CG2-CG2 4.16Å
45A91.8Very high92.7Very high57 Ų5789.8 Ų89.847%0.47148%0.478SS..  trans-117.2-153.3175.700000108.8G47 K49 I167A45-G47 PolarHBondContact O-N 3.28Å; A45-K49 HydrophobicContact CB-CB 4.23Å; A45-I167 PolarHBondContact N-OXT 3.14Å
46K93.1Very high93.5Very high188 Ų18886 Ų8682%0.81745%0.447SS*.SBendtrans-76.3-3.8-179.2-164.1176.3175.3-172.80113.3
47G92.4Very high93.9Very high33 Ų3379.6 Ų79.634%0.3442%0.419SS..SBendtrans95.77.5-169.900000113.9A45 Y166 I167A45-G47 PolarHBondContact O-N 3.28Å; G47-Y166 VanDerWaalsContact O-CB 3.25Å; G47-Y166 WeakPolarHBondContact O-CB 3.18Å; G47-I167 WeakPolarHBondContact CA-O 3.41Å; G47-I167 PolarHBondContact N-O 3.24Å
48D94.5Very high94.2Very high119 Ų11974.3 Ų74.364%0.63639%0.392SS*.  trans-97.7-8.9179.6-57.3-42.6000112.4P50D48-P50 WeakPolarHBondContact O-CD 3.05Å
49K95.6Very high94.5Very high98 Ų9867.5 Ų67.543%0.42637%0.373SS..  trans-86.1112.4-172.4-174.2175.6179.7170.90110.6V42 A45 V51 Y166 I167V42-K49 HydrophobicContact CG1-CD 4.1Å; A45-K49 HydrophobicContact CB-CB 4.23Å; K49-V51 HydrophobicContact CG-CG2 4.31Å; K49-Y166 WeakPolarHBondContact O-CA 3.46Å; K49-I167 WeakPolarHBondContact CB-O 3.25Å; K49-I167 PolarHBondContact N-O 3.01Å; K49-I167 PolarHBondContact O-N 3.2Å
50P96Very high94.6Very high72 Ų7269.1 Ų69.147%0.46837%0.368SS..EExtended strand (participates in β ladder)trans-72.6135175.329.9-33.7000110.3D48 V163 Y166D48-P50 WeakPolarHBondContact O-CD 3.05Å; P50-V163 HydrophobicContact CB-CB 4.42Å; P50-V163 HydrophobicContact CB-CG1 3.75Å; P50-V163 HydrophobicContact CB-CG2 3.75Å; P50-Y166 HydrophobicContact CB-CD1 4.24Å; P50-Y166 HydrophobicContact CB-CE1 3.87Å
51V95.9Very high94.8Very high2 Ų267.2 Ų67.21%0.01235%0.346CS..EExtended strand (participates in β ladder)trans-130.8134.7-179.7-171.90000110.1V42 K49 E55 A56 Y164 K165 I167V42-V51 HydrophobicContact CG1-CG2 4.08Å; V42-V51 HydrophobicContact CG2-CG1 4.17Å; K49-V51 HydrophobicContact CG-CG2 4.31Å; V51-E55 HydrophobicContact CG1-CB 3.49Å; V51-E55 VanDerWaalsContact CG1-CB 3.49Å; V51-A56 HydrophobicContact CG1-CB 3.93Å; V51-Y164 PolarHBondContact O-N 2.72Å; V51-K165 PolarHBondContact N-O 2.93Å; V51-K165 PolarHBondContact O-N 2.81Å; V51-I167 HydrophobicContact CB-CD1 4.15Å; V51-I167 HydrophobicContact CB-CG1 4.46Å; V51-I167 HydrophobicContact CG1-CD1 4.28Å; V51-I167 HydrophobicContact CG2-CB 4.07Å; V51-I167 HydrophobicContact CG2-CD1 3.75Å; V51-I167 HydrophobicContact CG2-CG1 3.9Å
52S96.1Very high94.9Very high3 Ų365.6 Ų65.62%0.02135%0.345CS..  trans-70.5162.1174.162.10000111.4E54 E55 A56 D106S52-E54 VanDerWaalsContact C-N 3.27Å; S52-E54 PolarHBondContact O-N 2.93Å; S52-E55 PolarHBondContact N-OE2 2.91Å; S52-E55 PolarHBondContact O-N 2.83Å; S52-E55 WeakPolarHBondContact OG-CB 3.21Å; S52-E55 WeakPolarHBondContact OG-CG 3.33Å; S52-E55 PolarHBondContact OG-N 2.91Å; S52-E55 PolarHBondContact OG-OE2 3.38Å; S52-A56 WeakPolarHBondContact O-CB 3.47Å; S52-A56 PolarHBondContact O-N 3.26Å; S52-D106 WeakPolarHBondContact CB-OD1 3.49Å
53Y96.6Very high95Very high89 Ų8967 Ų6735%0.34936%0.36SS..Hα-helixtrans-55.7-44.8176.7-177.7-95.5000111.8E55 A56 H57 R65 K66 Y164Y53-E55 PolarHBondContact O-N 2.99Å; Y53-A56 PolarHBondContact O-N 3.26Å; Y53-H57 AromaticContact CD2-NE2 3.8Å; Y53-H57 AromaticContact CE1-CD2 3.93Å; Y53-H57 AromaticContact CE2-CD2 3.75Å; Y53-H57 AromaticContact CE2-NE2 3.25Å; Y53-H57 VanDerWaalsContact CE2-NE2 3.25Å; Y53-H57 WeakPolarHBondContact CE2-NE2 3.49Å; Y53-H57 AromaticContact CZ-CD2 3.67Å; Y53-H57 AromaticContact CZ-NE2 3.5Å; Y53-H57 PolarHBondContact O-CD2 2.91Å; Y53-H57 VanDerWaalsContact O-CD2 3.28Å; Y53-R65 PolarHBondContact OH-O 3.31Å; Y53-K66 HydrophobicContact CE1-CG 3.92Å; Y53-Y164 HydrophobicContact CD2-CD1 4.17Å; Y53-Y164 AromaticContact CD2-CD2 3.82Å; Y53-Y164 HydrophobicContact CD2-CD2 3.82Å; Y53-Y164 HydrophobicContact CD2-CE1 4.18Å; Y53-Y164 AromaticContact CD2-CE2 3.83Å; Y53-Y164 HydrophobicContact CD2-CE2 3.83Å; Y53-Y164 AromaticContact CD2-CG 3.99Å; Y53-Y164 HydrophobicContact CD2-CG 3.99Å; Y53-Y164 HydrophobicContact CE2-CE2 4.22Å
54E94.2Very high95.2Very high42 Ų4268.5 Ų68.520%0.19637%0.372CS..Hα-helixtrans-63.2-42.7-180-73.2-62.6122.600112.4S52 K66S52-E54 VanDerWaalsContact C-N 3.27Å; S52-E54 PolarHBondContact O-N 2.93Å; E54-K66 VanDerWaalsContact CD-CE 3.46Å; E54-K66 PolarHBondContact O-NZ 3.26Å; E54-K66 WeakPolarHBondContact OE2-CE 3.23Å; E54-K66 IonicContact OE2-NZ 2.78Å; E54-K66 PolarHBondContact OE2-NZ 2.88Å
55E94.4Very high95.4Very high65 Ų6569.5 Ų69.530%0.30436%0.362SS..Hα-helixtrans-75.7-25.5179.5-67.4159.2168.700112.7V42 V51 S52 Y53 H57 K161V42-E55 HydrophobicContact CG2-CB 4.15Å; V42-E55 WeakPolarHBondContact CG2-O 3.49Å; V51-E55 HydrophobicContact CG1-CB 3.49Å; V51-E55 VanDerWaalsContact CG1-CB 3.49Å; S52-E55 PolarHBondContact N-OE2 2.91Å; S52-E55 PolarHBondContact O-N 2.83Å; S52-E55 WeakPolarHBondContact OG-CB 3.21Å; S52-E55 WeakPolarHBondContact OG-CG 3.33Å; S52-E55 PolarHBondContact OG-N 2.91Å; S52-E55 PolarHBondContact OG-OE2 3.38Å; Y53-E55 PolarHBondContact O-N 2.99Å; E55-H57 VanDerWaalsContact C-N 3.33Å; E55-H57 PolarHBondContact O-N 2.71Å; E55-K161 IonicContact OE1-NZ 2.98Å; E55-K161 PolarHBondContact OE1-NZ 2.98Å; E55-K161 IonicContact OE2-NZ 3.32Å; E55-K161 PolarHBondContact OE2-NZ 2.76Å
56A95.1Very high95.6Very high15 Ų1568.2 Ų68.212%0.12435%0.346CS..Hα-helixtrans-73.7-20.5-173.800000114.6V51 S52 Y53 Y164 K165V51-A56 HydrophobicContact CG1-CB 3.93Å; S52-A56 WeakPolarHBondContact O-CB 3.47Å; S52-A56 PolarHBondContact O-N 3.26Å; Y53-A56 PolarHBondContact O-N 3.26Å; A56-Y164 HydrophobicContact CB-CD1 3.76Å; A56-Y164 HydrophobicContact CB-CE1 4.32Å; A56-K165 HydrophobicContact CB-CD 4.31Å; A56-K165 HydrophobicContact CB-CG 4.41Å; A56-K165 PolarHBondContact O-NZ 2.8Å
57H95.9Very high95.8Very high12 Ų1261.6 Ų61.66%0.05633%0.331CS..SBendtrans-107.1130.6-175.6-71.9-65.9000111.5Y53 E55 H61 K66Y53-H57 AromaticContact CD2-NE2 3.8Å; Y53-H57 AromaticContact CE1-CD2 3.93Å; Y53-H57 AromaticContact CE2-CD2 3.75Å; Y53-H57 AromaticContact CE2-NE2 3.25Å; Y53-H57 VanDerWaalsContact CE2-NE2 3.25Å; Y53-H57 WeakPolarHBondContact CE2-NE2 3.49Å; Y53-H57 AromaticContact CZ-CD2 3.67Å; Y53-H57 AromaticContact CZ-NE2 3.5Å; Y53-H57 PolarHBondContact O-CD2 2.91Å; Y53-H57 VanDerWaalsContact O-CD2 3.28Å; E55-H57 VanDerWaalsContact C-N 3.33Å; E55-H57 PolarHBondContact O-N 2.71Å; H57-H61 HydrophobicContact CB-CB 4.36Å; H57-H61 AromaticContact ND1-ND1 3.88Å; H57-K66 HydrophobicContact CB-CD 3.43Å; H57-K66 VanDerWaalsContact CB-CD 3.43Å; H57-K66 HydrophobicContact CB-CG 3.95Å
58A95.7Very high96Very high12 Ų1268 Ų6810%0.09935%0.345CS..  trans-71162.4176.500000112.9R41 H60 H61R41-A58 HydrophobicContact CG-CB 3.95Å; A58-H60 VanDerWaalsContact C-N 3.3Å; A58-H60 WeakPolarHBondContact CB-CE1 3.38Å; A58-H60 PolarHBondContact O-N 3.09Å; A58-H60 VanDerWaalsContact O-N 3.14Å; A58-H61 PolarHBondContact O-N 3.3Å
59P97.1Very high96.2Very high53 Ų5363.9 Ų63.934%0.34432%0.323SS..G310 helixtrans-55.4-33.6-174.4-31.136.4000116.5A39 A40 H61 I62A39-P59 WeakPolarHBondContact O-CD 3.25Å; A40-P59 HydrophobicContact CB-CG 3.86Å; P59-H61 PolarHBondContact O-N 3.43Å; P59-H61 VanDerWaalsContact O-N 3.09Å; P59-I62 HydrophobicContact CB-CD1 4.49Å; P59-I62 WeakPolarHBondContact O-CB 3.46Å; P59-I62 WeakPolarHBondContact O-CD1 3.4Å; P59-I62 WeakPolarHBondContact O-CG1 3.22Å; P59-I62 PolarHBondContact O-N 3.04Å; P59-I62 VanDerWaalsContact O-N 3.08Å
60H95.5Very high96.2Very high106 Ų10660.3 Ų60.349%0.49131%0.311SS..G310 helixtrans-69.2-5.4-179.957.2-92.3000113.7R41 A58R41-H60 PolarHBondContact NH2-CE1 2.7Å; A58-H60 VanDerWaalsContact C-N 3.3Å; A58-H60 WeakPolarHBondContact CB-CE1 3.38Å; A58-H60 PolarHBondContact O-N 3.09Å; A58-H60 VanDerWaalsContact O-N 3.14Å
61H97.1Very high96.3Very high39 Ų3960.8 Ų60.818%0.18131%0.309CS..G310 helixtrans-95.22.2172.6-65.1136.7000113.6H57 A58 P59 H64 R65 K66H57-H61 HydrophobicContact CB-CB 4.36Å; H57-H61 AromaticContact ND1-ND1 3.88Å; A58-H61 PolarHBondContact O-N 3.3Å; P59-H61 PolarHBondContact O-N 3.43Å; P59-H61 VanDerWaalsContact O-N 3.09Å; H61-H64 PolarHBondContact O-N 2.91Å; H61-H64 VanDerWaalsContact O-N 3.14Å; H61-R65 HydrophobicContact CB-CB 4.26Å; H61-R65 HydrophobicContact CB-CG 4.38Å; H61-R65 PolarHBondContact O-N 3.3Å; H61-K66 PolarHBondContact O-N 2.95Å; H61-K66 VanDerWaalsContact O-N 3.09Å
62I97.3Very high96.3Very high75 Ų7562.5 Ų62.539%0.38532%0.317SS..BIsolated β-bridgetrans-62.1136.5169-63.7166.3000107.7P59 H64P59-I62 HydrophobicContact CB-CD1 4.49Å; P59-I62 WeakPolarHBondContact O-CB 3.46Å; P59-I62 WeakPolarHBondContact O-CD1 3.4Å; P59-I62 WeakPolarHBondContact O-CG1 3.22Å; P59-I62 PolarHBondContact O-N 3.04Å; P59-I62 VanDerWaalsContact O-N 3.08Å; I62-H64 PolarHBondContact O-N 3.32Å
63A96.1Very high96.4Very high72 Ų7266.6 Ų66.660%0.59534%0.342SS*.THydrogen-bonded Turntrans68.5-3.5-171.200000116.6K66 W68A63-K66 WeakPolarHBondContact CA-O 3.46Å; A63-K66 PolarHBondContact N-O 3.42Å; A63-W68 HydrophobicContact CB-CZ2 4.29Å
64H97.1Very high96.3Very high159 Ų15962.7 Ų62.774%0.73633%0.328SS*.THydrogen-bonded Turntrans-108-51174.4-68.6-77000113.3H61 I62H61-H64 PolarHBondContact O-N 2.91Å; H61-H64 VanDerWaalsContact O-N 3.14Å; I62-H64 PolarHBondContact O-N 3.32Å
65R96.3Very high96.4Very high148 Ų14866.4 Ų66.456%0.55835%0.349SS*.THydrogen-bonded Turntrans-115.1-37.8178.6-56.9-177.5-175.4-177.32.9110.3Y53 H61Y53-R65 PolarHBondContact OH-O 3.31Å; H61-R65 HydrophobicContact CB-CB 4.26Å; H61-R65 HydrophobicContact CB-CG 4.38Å; H61-R65 PolarHBondContact O-N 3.3Å
66K96.3Very high96.5Very high30 Ų3068.4 Ų68.413%0.1336%0.362CS..BIsolated β-bridgetrans-106144.4-179.6-72.2-173.247.6165.50112Y53 E54 H57 H61 A63Y53-K66 HydrophobicContact CE1-CG 3.92Å; E54-K66 VanDerWaalsContact CD-CE 3.46Å; E54-K66 PolarHBondContact O-NZ 3.26Å; E54-K66 WeakPolarHBondContact OE2-CE 3.23Å; E54-K66 IonicContact OE2-NZ 2.78Å; E54-K66 PolarHBondContact OE2-NZ 2.88Å; H57-K66 HydrophobicContact CB-CD 3.43Å; H57-K66 VanDerWaalsContact CB-CD 3.43Å; H57-K66 HydrophobicContact CB-CG 3.95Å; H61-K66 PolarHBondContact O-N 2.95Å; H61-K66 VanDerWaalsContact O-N 3.09Å; A63-K66 WeakPolarHBondContact CA-O 3.46Å; A63-K66 PolarHBondContact N-O 3.42Å
67G96.6Very high96.6Very high49 Ų4976 Ų7651%0.50540%0.4SS..  trans-86.5-163.1167.800000112.9
68W97.4Very high96.6Very high167 Ų16778.8 Ų78.863%0.63343%0.433SS*.  trans-101.9143.3174.4-59.2-73000111.6A63 L71A63-W68 HydrophobicContact CB-CZ2 4.29Å; W68-L71 HydrophobicContact CB-CD2 4.08Å; W68-L71 HydrophobicContact CE3-CD2 4.03Å
69L97.4Very high96.6Very high34 Ų3483.1 Ų83.118%0.17845%0.451CS..SBendtrans-85.7-10177.9-62.9173.6000113.5R93 Q107 V109 L110L69-R93 PolarHBondContact O-NH2 2.94Å; L69-Q107 HydrophobicContact CD1-CB 3.99Å; L69-V109 HydrophobicContact CD2-CG2 4.04Å; L69-V109 CarbonylContact O-C 3.59Å; L69-V109 WeakPolarHBondContact O-CA 3.25Å; L69-L110 PolarHBondContact O-N 3.33Å
70S97.2Very high96.6Very high23 Ų2386.4 Ų86.416%0.16147%0.466CS..EExtended strand (participates in β ladder)trans-133.5130.6172.7177.90000108.4H72 D89 L110S70-H72 PolarHBondContact OG-ND1 2.8Å; S70-D89 WeakPolarHBondContact CB-OD2 3.31Å; S70-D89 PolarHBondContact OG-OD2 2.83Å; S70-L110 WeakPolarHBondContact CA-O 3.45Å
71L97.2Very high96.5Very high81 Ų8186.6 Ų86.642%0.42447%0.467SS..EExtended strand (participates in β ladder)trans-121.8116.7177.5-62.6173.9000108.8W68 L110 R112W68-L71 HydrophobicContact CB-CD2 4.08Å; W68-L71 HydrophobicContact CE3-CD2 4.03Å; L71-L110 PolarHBondContact N-O 2.87Å; L71-R112 PolarHBondContact O-N 2.89Å
72H96.6Very high96.4Very high39 Ų3986.1 Ų86.118%0.18147%0.469CS..  trans-153.8164.5177.562-80000109.5S70 N75 R112S70-H72 PolarHBondContact OG-ND1 2.8Å; H72-N75 PolarHBondContact NE2-ND2 2.93Å; H72-R112 HydrophobicContact CB-CB 4.36Å; H72-R112 HydrophobicContact CB-CG 4.39Å
73T96.6Very high96.4Very high89 Ų8986 Ų8655%0.54648%0.48SS..SBendtrans-84.7-20.4-174.952.40000114.3N75 L76 E79T73-N75 PolarHBondContact O-N 2.93Å; T73-L76 HydrophobicContact CG2-CD1 4.34Å; T73-L76 WeakPolarHBondContact O-CB 3.21Å; T73-L76 VanDerWaalsContact O-CG 3.29Å; T73-L76 WeakPolarHBondContact O-CG 3.4Å; T73-L76 PolarHBondContact O-N 2.87Å; T73-E79 WeakPolarHBondContact O-CB 3.3Å; T73-E79 WeakPolarHBondContact O-CG 3.32Å
74G95Very high96.4Very high7 Ų787.2 Ų87.27%0.07247%0.473CS..THydrogen-bonded Turntrans-60.8-16.7-171.200000117A82G74-A82 WeakPolarHBondContact O-CB 3.35Å
75N96.6Very high96.3Very high119 Ų11983.7 Ų83.764%0.63645%0.453SS*.THydrogen-bonded Turntrans-93.14.3175.7-70.4-26.5000113.6H72 T73H72-N75 PolarHBondContact NE2-ND2 2.93Å; T73-N75 PolarHBondContact O-N 2.93Å
76L97.1Very high96.3Very high108 Ų10879.8 Ų79.857%0.56545%0.446SS*.SBendtrans-78.3158.2174.1-59.7172.3000110.2T73 G78 E79T73-L76 HydrophobicContact CG2-CD1 4.34Å; T73-L76 WeakPolarHBondContact O-CB 3.21Å; T73-L76 VanDerWaalsContact O-CG 3.29Å; T73-L76 WeakPolarHBondContact O-CG 3.4Å; T73-L76 PolarHBondContact O-N 2.87Å; L76-G78 PolarHBondContact O-N 2.79Å; L76-E79 HydrophobicContact CB-CB 4.41Å; L76-E79 HydrophobicContact CB-CG 3.78Å; L76-E79 PolarHBondContact O-N 2.95Å
77D97.1Very high96.4Very high173 Ų17384.6 Ų84.693%0.92547%0.472SS*.THydrogen-bonded Turntrans-65128.8178.8-172.133.3000110.7E79D77-E79 VanDerWaalsContact C-N 3.32Å; D77-E79 PolarHBondContact O-N 3.28Å
78G95.7Very high96.4Very high72 Ų7283.6 Ų83.674%0.74246%0.455SS*.THydrogen-bonded Turntrans78.15.6-177.700000116.1L76L76-G78 PolarHBondContact O-N 2.79Å
79E96.7Very high96.4Very high103 Ų10376.3 Ų76.348%0.48143%0.428SS..  trans-94.9151.9175.9-66.6-69.7146.500112.5T73 L76 D77T73-E79 WeakPolarHBondContact O-CB 3.3Å; T73-E79 WeakPolarHBondContact O-CG 3.32Å; L76-E79 HydrophobicContact CB-CB 4.41Å; L76-E79 HydrophobicContact CB-CG 3.78Å; L76-E79 PolarHBondContact O-N 2.95Å; D77-E79 VanDerWaalsContact C-N 3.32Å; D77-E79 PolarHBondContact O-N 3.28Å
80D95.5Very high96.4Very high122 Ų12278 Ų7865%0.65244%0.44SS*.  trans-105179.9-179.1-70.7-46.3000112.7A82D80-A82 VanDerWaalsContact C-N 3.29Å; D80-A82 PolarHBondContact O-N 3.33Å
81H94.1Very high96.4Very high110 Ų11080.7 Ų80.751%0.50945%0.448SS..  trans64.316.3171.4-53.2-76.9000116.9A83 E84 R85H81-A83 PolarHBondContact O-N 3.28Å; H81-E84 IonicContact CE1-OE1 3.84Å; H81-E84 IonicContact ND1-OE1 2.98Å; H81-E84 PolarHBondContact ND1-OE1 3Å; H81-E84 IonicContact ND1-OE2 3.44Å; H81-E84 PolarHBondContact ND1-OE2 3.32Å; H81-E84 PolarHBondContact O-N 3.02Å; H81-R85 WeakPolarHBondContact O-CG 3.43Å; H81-R85 PolarHBondContact O-N 2.98Å
82A95.8Very high96.4Very high29 Ų2977 Ų7724%0.2443%0.429CS..Hα-helixtrans-53-40175.700000113.5G74 D80 R85 T86G74-A82 WeakPolarHBondContact O-CB 3.35Å; D80-A82 VanDerWaalsContact C-N 3.29Å; D80-A82 PolarHBondContact O-N 3.33Å; A82-R85 PolarHBondContact O-N 3.27Å; A82-T86 WeakPolarHBondContact O-CB 3.44Å; A82-T86 PolarHBondContact O-N 3.32Å; A82-T86 PolarHBondContact O-OG1 3.07Å
83A96.3Very high96.5Very high73 Ų7378.4 Ų78.460%0.60343%0.433SS*.Hα-helixtrans-64.6-47-17800000112.3H81 R85 T86 L87H81-A83 PolarHBondContact O-N 3.28Å; A83-R85 PolarHBondContact O-N 3.34Å; A83-T86 PolarHBondContact O-N 3.47Å; A83-L87 WeakPolarHBondContact O-CG 3.14Å; A83-L87 PolarHBondContact O-N 3.2Å
84E95.4Very high96.6Very high97 Ų9781.3 Ų81.345%0.45344%0.438SS..Hα-helixtrans-60.3-47.2178.1-66.2168.2-150.300110.8H81 T86 L87 E88H81-E84 IonicContact CE1-OE1 3.84Å; H81-E84 IonicContact ND1-OE1 2.98Å; H81-E84 PolarHBondContact ND1-OE1 3Å; H81-E84 IonicContact ND1-OE2 3.44Å; H81-E84 PolarHBondContact ND1-OE2 3.32Å; H81-E84 PolarHBondContact O-N 3.02Å; E84-T86 VanDerWaalsContact C-N 3.26Å; E84-T86 PolarHBondContact O-N 3.01Å; E84-L87 PolarHBondContact O-N 2.82Å; E84-L87 VanDerWaalsContact O-N 3.13Å; E84-E88 WeakPolarHBondContact O-CG 3.16Å; E84-E88 PolarHBondContact O-N 2.66Å
85R95.8Very high96.7Very high84 Ų8482.4 Ų82.432%0.31744%0.441SS..Hα-helixtrans-62.4-34.7178.5-56.6-52.6164.8-163.5-5.5112.6H81 A82 A83 E88 D89 R112H81-R85 WeakPolarHBondContact O-CG 3.43Å; H81-R85 PolarHBondContact O-N 2.98Å; A82-R85 PolarHBondContact O-N 3.27Å; A83-R85 PolarHBondContact O-N 3.34Å; R85-E88 WeakPolarHBondContact CD-OE2 3.36Å; R85-E88 IonicContact CZ-OE1 2.71Å; R85-E88 IonicContact CZ-OE2 3.46Å; R85-E88 VanDerWaalsContact NH1-CD 3.31Å; R85-E88 IonicContact NH1-OE1 2.71Å; R85-E88 PolarHBondContact NH1-OE1 3.07Å; R85-E88 IonicContact NH1-OE2 2.89Å; R85-E88 PolarHBondContact NH1-OE2 2.99Å; R85-E88 VanDerWaalsContact NH1-OE2 3.08Å; R85-D89 PolarHBondContact O-N 3.47Å; R85-R112 PolarHBondContact O-NH2 3.47Å; R85-R112 VanDerWaalsContact O-NH2 3.09Å
86T96.7Very high96.7Very high67 Ų6776.7 Ų76.741%0.41141%0.41SS..Hα-helixtrans-67.9-41175.5-56.90000111.7A82 A83 E84 D89 V90A82-T86 WeakPolarHBondContact O-CB 3.44Å; A82-T86 PolarHBondContact O-N 3.32Å; A82-T86 PolarHBondContact O-OG1 3.07Å; A83-T86 PolarHBondContact O-N 3.47Å; E84-T86 VanDerWaalsContact C-N 3.26Å; E84-T86 PolarHBondContact O-N 3.01Å; T86-D89 PolarHBondContact O-N 2.92Å; T86-V90 WeakPolarHBondContact O-CG2 3.43Å; T86-V90 PolarHBondContact O-N 3.01Å
87L97.4Very high96.7Very high130 Ų13077.2 Ų77.268%0.68141%0.413SS*.Hα-helixtrans-64.5-43.5176.4-69.1176.3000111.6A83 E84 D89 V90 F91A83-L87 WeakPolarHBondContact O-CG 3.14Å; A83-L87 PolarHBondContact O-N 3.2Å; E84-L87 PolarHBondContact O-N 2.82Å; E84-L87 VanDerWaalsContact O-N 3.13Å; L87-D89 VanDerWaalsContact C-N 3.33Å; L87-D89 PolarHBondContact O-N 3.15Å; L87-V90 PolarHBondContact O-N 3.44Å; L87-F91 WeakPolarHBondContact O-CB 3.19Å; L87-F91 PolarHBondContact O-N 2.81Å
88E96.6Very high96.6Very high29 Ų2971.7 Ų71.714%0.13640%0.397CS..Hα-helixtrans-56.9-46.5172.9-68.3174.3176.100111.5E84 R85 V90 F91 L92 R112 Y147E84-E88 WeakPolarHBondContact O-CG 3.16Å; E84-E88 PolarHBondContact O-N 2.66Å; R85-E88 WeakPolarHBondContact CD-OE2 3.36Å; R85-E88 IonicContact CZ-OE1 2.71Å; R85-E88 IonicContact CZ-OE2 3.46Å; R85-E88 VanDerWaalsContact NH1-CD 3.31Å; R85-E88 IonicContact NH1-OE1 2.71Å; R85-E88 PolarHBondContact NH1-OE1 3.07Å; R85-E88 IonicContact NH1-OE2 2.89Å; R85-E88 PolarHBondContact NH1-OE2 2.99Å; R85-E88 VanDerWaalsContact NH1-OE2 3.08Å; E88-V90 PolarHBondContact O-N 2.96Å; E88-F91 PolarHBondContact O-N 3.01Å; E88-L92 WeakPolarHBondContact O-CB 3.06Å; E88-L92 VanDerWaalsContact O-CG 3.31Å; E88-L92 WeakPolarHBondContact O-CG 3.26Å; E88-L92 PolarHBondContact O-N 3.02Å; E88-R112 IonicContact OE2-CZ 2.63Å; E88-R112 IonicContact OE2-NE 3.98Å; E88-R112 PolarHBondContact OE2-NE 3.44Å; E88-R112 IonicContact OE2-NH2 3.11Å; E88-R112 PolarHBondContact OE2-NH2 2.79Å; E88-Y147 HydrophobicContact CB-CE1 4.33Å; E88-Y147 HydrophobicContact CG-CD1 4.23Å; E88-Y147 HydrophobicContact CG-CE1 3.62Å
89D97.2Very high96.6Very high13 Ų1369.2 Ų69.27%0.0737%0.367CS..Hα-helixtrans-61.7-43.3-179.6-74.1-8.2000112.4S70 R85 T86 L87 F91 L92 R93 L110 R112S70-D89 WeakPolarHBondContact CB-OD2 3.31Å; S70-D89 PolarHBondContact OG-OD2 2.83Å; R85-D89 PolarHBondContact O-N 3.47Å; T86-D89 PolarHBondContact O-N 2.92Å; L87-D89 VanDerWaalsContact C-N 3.33Å; L87-D89 PolarHBondContact O-N 3.15Å; D89-F91 VanDerWaalsContact C-N 3.34Å; D89-L92 PolarHBondContact O-N 3.39Å; D89-R93 WeakPolarHBondContact O-CB 3.18Å; D89-R93 WeakPolarHBondContact O-CG 3.37Å; D89-R93 PolarHBondContact O-N 3.32Å; D89-L110 HydrophobicContact CB-CD1 3.84Å; D89-L110 VanDerWaalsContact OD1-CD1 3.28Å; D89-L110 WeakPolarHBondContact OD1-CD1 3.44Å; D89-R112 IonicContact OD1-CZ 2.93Å; D89-R112 IonicContact OD1-NH1 3.56Å; D89-R112 PolarHBondContact OD1-NH1 2.93Å; D89-R112 IonicContact OD1-NH2 3.4Å; D89-R112 PolarHBondContact OD1-NH2 3.28Å; D89-R112 IonicContact OD2-NH1 2.68Å; D89-R112 PolarHBondContact OD2-NH1 2.9Å
90V97.8Very high96.6Very high71 Ų7164.3 Ų64.343%0.4334%0.344SS..Hα-helixtrans-65.4-40.8177.8173.80000110.6T86 L87 E88 K94T86-V90 WeakPolarHBondContact O-CG2 3.43Å; T86-V90 PolarHBondContact O-N 3.01Å; L87-V90 PolarHBondContact O-N 3.44Å; E88-V90 PolarHBondContact O-N 2.96Å; V90-K94 WeakPolarHBondContact O-CG 3.35Å; V90-K94 PolarHBondContact O-N 2.7Å
91F98Very high96.5Very high78 Ų7862.5 Ų62.534%0.34234%0.339SS..Hα-helixtrans-62.6-51.7175.3175.3-93.5000111.4L87 E88 D89 R93 K94 F95 L143 F146 Y147L87-F91 WeakPolarHBondContact O-CB 3.19Å; L87-F91 PolarHBondContact O-N 2.81Å; E88-F91 PolarHBondContact O-N 3.01Å; D89-F91 VanDerWaalsContact C-N 3.34Å; F91-R93 VanDerWaalsContact C-N 3.27Å; F91-R93 PolarHBondContact O-N 2.84Å; F91-K94 PolarHBondContact O-N 2.63Å; F91-F95 HydrophobicContact CD1-CB 4.45Å; F91-F95 HydrophobicContact CE1-CB 4.15Å; F91-F95 HydrophobicContact CE1-CG 4.41Å; F91-F95 HydrophobicContact CZ-CB 4.42Å; F91-F95 HydrophobicContact CZ-CD2 4.34Å; F91-F95 WeakPolarHBondContact O-CB 3.34Å; F91-F95 PolarHBondContact O-N 2.93Å; F91-L143 HydrophobicContact CE1-CD2 4.02Å; F91-F146 HydrophobicContact CE1-CE1 4.4Å; F91-F146 HydrophobicContact CZ-CE1 4.49Å; F91-Y147 HydrophobicContact CD1-CE2 4.21Å; F91-Y147 AromaticContact CD1-CZ 3.94Å; F91-Y147 WeakPolarHBondContact CD1-OH 3.21Å; F91-Y147 HydrophobicContact CE1-CE2 4.36Å
92L97.7Very high96.4Very high4 Ų459.9 Ų59.92%0.02134%0.342CS..Hα-helixtrans-58-39.7-179.5-72.5175000111.9E88 D89 F95 M96 L110 V117 I119 L143 Y147E88-L92 WeakPolarHBondContact O-CB 3.06Å; E88-L92 VanDerWaalsContact O-CG 3.31Å; E88-L92 WeakPolarHBondContact O-CG 3.26Å; E88-L92 PolarHBondContact O-N 3.02Å; D89-L92 PolarHBondContact O-N 3.39Å; L92-F95 PolarHBondContact O-N 3.48Å; L92-M96 WeakPolarHBondContact O-CB 3.49Å; L92-M96 WeakPolarHBondContact O-CG 3.2Å; L92-M96 PolarHBondContact O-N 3.28Å; L92-L110 HydrophobicContact CB-CD1 4.38Å; L92-L110 HydrophobicContact CB-CD2 4.41Å; L92-L110 HydrophobicContact CD1-CD1 4.33Å; L92-L110 HydrophobicContact CD1-CD2 4.13Å; L92-V117 HydrophobicContact CD1-CG1 4.2Å; L92-I119 HydrophobicContact CD1-CD1 4.42Å; L92-I119 HydrophobicContact CD2-CD1 3.86Å; L92-L143 HydrophobicContact CD2-CD1 3.79Å; L92-L143 HydrophobicContact CD2-CD2 3.82Å; L92-L143 HydrophobicContact CD2-CG 4.42Å; L92-Y147 HydrophobicContact CD2-CE2 3.98Å; L92-Y147 HydrophobicContact CG-CE2 4.38Å
93R97.7Very high96.4Very high68 Ų6858.6 Ų58.626%0.25733%0.331SS..Hα-helixtrans-61.4-44.3175.3-73.2174.6-169.1-68.3-10.2112.4L69 D89 F91 L97 I108L69-R93 PolarHBondContact O-NH2 2.94Å; D89-R93 WeakPolarHBondContact O-CB 3.18Å; D89-R93 WeakPolarHBondContact O-CG 3.37Å; D89-R93 PolarHBondContact O-N 3.32Å; F91-R93 VanDerWaalsContact C-N 3.27Å; F91-R93 PolarHBondContact O-N 2.84Å; R93-L97 WeakPolarHBondContact O-CB 3.32Å; R93-L97 PolarHBondContact O-N 3.09Å; R93-L97 VanDerWaalsContact O-N 3.15Å; R93-I108 HydrophobicContact CB-CD1 4.22Å; R93-I108 HydrophobicContact CG-CD1 3.62Å; R93-I108 HydrophobicContact CG-CG1 3.76Å; R93-I108 PolarHBondContact NH1-O 2.97Å
94K97.7Very high96.3Very high151 Ų15156.9 Ų56.966%0.65731%0.312SS*.Hα-helixtrans-70.9-42178.2-70.7-179.7179.4-178.60112V90 F91 L97 G98V90-K94 WeakPolarHBondContact O-CG 3.35Å; V90-K94 PolarHBondContact O-N 2.7Å; F91-K94 PolarHBondContact O-N 2.63Å; K94-L97 PolarHBondContact O-N 2.94Å; K94-G98 PolarHBondContact O-N 2.83Å
95F97.6Very high96.3Very high29 Ų2952.5 Ų52.513%0.12729%0.292CS..Hα-helixtrans-58.5-54176.8178.3-98.1000110.3F91 L92 L97 G98 T99 Y138 L142 L143F91-F95 HydrophobicContact CD1-CB 4.45Å; F91-F95 HydrophobicContact CE1-CB 4.15Å; F91-F95 HydrophobicContact CE1-CG 4.41Å; F91-F95 HydrophobicContact CZ-CB 4.42Å; F91-F95 HydrophobicContact CZ-CD2 4.34Å; F91-F95 WeakPolarHBondContact O-CB 3.34Å; F91-F95 PolarHBondContact O-N 2.93Å; L92-F95 PolarHBondContact O-N 3.48Å; F95-L97 VanDerWaalsContact C-N 3.32Å; F95-L97 PolarHBondContact O-N 2.82Å; F95-G98 CarbonylContact O-C 3.58Å; F95-G98 WeakPolarHBondContact O-CA 3.2Å; F95-G98 PolarHBondContact O-N 3.32Å; F95-T99 WeakPolarHBondContact CE1-OG1 3.15Å; F95-T99 WeakPolarHBondContact CZ-OG1 3.2Å; F95-T99 PolarHBondContact O-N 2.92Å; F95-T99 PolarHBondContact O-OG1 2.68Å; F95-Y138 HydrophobicContact CZ-CE1 4.05Å; F95-L142 HydrophobicContact CE2-CD2 4.31Å; F95-L142 HydrophobicContact CZ-CD2 4.41Å; F95-L143 HydrophobicContact CD1-CD1 4.17Å; F95-L143 HydrophobicContact CD1-CD2 4.17Å; F95-L143 HydrophobicContact CD1-CG 4.49Å; F95-L143 HydrophobicContact CE1-CD1 3.95Å; F95-L143 HydrophobicContact CE1-CD2 4.15Å; F95-L143 HydrophobicContact CE1-CG 4.1Å; F95-L143 HydrophobicContact CZ-CD2 4.48Å
96M97.3Very high96.3Very high0 Ų050.5 Ų50.50%029%0.288CS..Hα-helixtrans-60.7-39.1179.6-70.2-62.6-67.400112.9L92 G98 F100 L104 I108 I119 A121 L153L92-M96 WeakPolarHBondContact O-CB 3.49Å; L92-M96 WeakPolarHBondContact O-CG 3.2Å; L92-M96 PolarHBondContact O-N 3.28Å; M96-G98 VanDerWaalsContact C-N 3.29Å; M96-G98 PolarHBondContact O-N 3.42Å; M96-F100 HydrophobicContact CE-CD2 3.58Å; M96-F100 HydrophobicContact CE-CE2 3.41Å; M96-F100 VanDerWaalsContact CE-CE2 3.41Å; M96-F100 HydrophobicContact CE-CZ 4.45Å; M96-F100 PolarHBondContact O-N 2.71Å; M96-F100 HydrophobicContact SD-CD2 4.13Å; M96-F100 HydrophobicContact SD-CE2 3.85Å; M96-L104 HydrophobicContact CB-CD1 4.39Å; M96-I108 HydrophobicContact CB-CD1 4.25Å; M96-I108 HydrophobicContact CB-CG2 4.3Å; M96-I108 HydrophobicContact CG-CD1 4.1Å; M96-I119 HydrophobicContact CE-CG2 4.06Å; M96-I119 HydrophobicContact CG-CG2 4.23Å; M96-I119 HydrophobicContact SD-CG2 4.24Å; M96-A121 HydrophobicContact CE-CB 4.26Å; M96-L153 HydrophobicContact CE-CD1 3.93Å; M96-L153 HydrophobicContact CE-CD2 4.41Å; M96-L153 HydrophobicContact CE-CG 4.33Å; M96-L153 HydrophobicContact SD-CD1 4.02Å
97L96.4Very high96.2Very high119 Ų11952 Ų5262%0.62329%0.29SS*.Hα-helixtrans-63.4-35.4175.2-173.967.5000112.2R93 K94 F95 L104R93-L97 WeakPolarHBondContact O-CB 3.32Å; R93-L97 PolarHBondContact O-N 3.09Å; R93-L97 VanDerWaalsContact O-N 3.15Å; K94-L97 PolarHBondContact O-N 2.94Å; F95-L97 VanDerWaalsContact C-N 3.32Å; F95-L97 PolarHBondContact O-N 2.82Å; L97-L104 HydrophobicContact CD1-CD1 4.45Å
98G96.1Very high96.2Very high56 Ų5646.2 Ų46.258%0.57726%0.26SS*.Hα-helixtrans-78.2-39.7176.400000113.9K94 F95 M96K94-G98 PolarHBondContact O-N 2.83Å; F95-G98 CarbonylContact O-C 3.58Å; F95-G98 WeakPolarHBondContact O-CA 3.2Å; F95-G98 PolarHBondContact O-N 3.32Å; M96-G98 VanDerWaalsContact C-N 3.29Å; M96-G98 PolarHBondContact O-N 3.42Å
99T95.9Very high96.3Very high20 Ų2047 Ų4712%0.12327%0.267CS..Hα-helixtrans-71.9-33.4-178.8-52.20000112.3F95 P101 L135 Y138F95-T99 WeakPolarHBondContact CE1-OG1 3.15Å; F95-T99 WeakPolarHBondContact CZ-OG1 3.2Å; F95-T99 PolarHBondContact O-N 2.92Å; F95-T99 PolarHBondContact O-OG1 2.68Å; T99-P101 WeakPolarHBondContact O-CD 3.29Å; T99-L135 HydrophobicContact CG2-CD2 3.97Å; T99-Y138 HydrophobicContact CG2-CD1 4.36Å; T99-Y138 HydrophobicContact CG2-CE1 4.38Å
100F95.4Very high96.3Very high0 Ų046.4 Ų46.40%026%0.263CS..SBendtrans-114.967.3-179.9-63.6-82.9000111.3M96 G102 C103 L104 F132 L135 L153 L155M96-F100 HydrophobicContact CE-CD2 3.58Å; M96-F100 HydrophobicContact CE-CE2 3.41Å; M96-F100 VanDerWaalsContact CE-CE2 3.41Å; M96-F100 HydrophobicContact CE-CZ 4.45Å; M96-F100 PolarHBondContact O-N 2.71Å; M96-F100 HydrophobicContact SD-CD2 4.13Å; M96-F100 HydrophobicContact SD-CE2 3.85Å; F100-G102 PolarHBondContact O-N 3.43Å; F100-C103 HydrophobicContact CB-CB 4.2Å; F100-C103 PolarHBondContact O-N 3.24Å; F100-L104 HydrophobicContact CB-CD2 4.33Å; F100-L104 HydrophobicContact CB-CG 4.17Å; F100-F132 HydrophobicContact CD1-CD1 4.24Å; F100-F132 HydrophobicContact CD1-CE1 4.11Å; F100-F132 AromaticContact CE1-CD1 3.99Å; F100-F132 HydrophobicContact CE1-CD1 3.99Å; F100-F132 HydrophobicContact CE1-CE1 4.34Å; F100-L135 HydrophobicContact CD1-CD1 4.01Å; F100-L135 HydrophobicContact CE1-CB 3.73Å; F100-L135 HydrophobicContact CE1-CD1 3.85Å; F100-L135 HydrophobicContact CE1-CG 4.46Å; F100-L135 HydrophobicContact CZ-CB 3.83Å; F100-L153 HydrophobicContact CE2-CD1 4.3Å; F100-L153 HydrophobicContact CZ-CD1 4.42Å; F100-L155 HydrophobicContact CE1-CD1 4.38Å
101P94.2Very high96.3Very high85 Ų8546.9 Ų46.955%0.55226%0.26SS*.THydrogen-bonded Turntrans-64.8127.1-174.428.3-35.4000110.9T99 C103T99-P101 WeakPolarHBondContact O-CD 3.29Å; P101-C103 PolarHBondContact O-N 3.15Å; P101-C103 PolarHBondContact O-SG 3.27Å
102G92.1Very high96.2Very high55 Ų5545 Ų4557%0.56725%0.25SS*.THydrogen-bonded Turntrans68-5.7178.500000115.5F100 Q126F100-G102 PolarHBondContact O-N 3.43Å; G102-Q126 VanDerWaalsContact O-CD 3.26Å; G102-Q126 PolarHBondContact O-NE2 3.46Å; G102-Q126 PolarHBondContact O-OE1 2.71Å
103C94.1Very high96.1Very high2 Ų251.8 Ų51.81%0.01428%0.276CS..THydrogen-bonded Turntrans-92-27.3-173.4-63.70000112.7F100 P101 A105 V123 L124 L127 F132F100-C103 HydrophobicContact CB-CB 4.2Å; F100-C103 PolarHBondContact O-N 3.24Å; P101-C103 PolarHBondContact O-N 3.15Å; P101-C103 PolarHBondContact O-SG 3.27Å; C103-A105 PolarHBondContact O-N 3.4Å; C103-V123 HydrophobicContact CB-CG1 3.59Å; C103-V123 CarbonylContact O-C 3.47Å; C103-V123 VanDerWaalsContact O-CA 3.31Å; C103-V123 WeakPolarHBondContact O-CA 3.17Å; C103-V123 VanDerWaalsContact O-CG1 3.23Å; C103-V123 WeakPolarHBondContact O-CG1 3.45Å; C103-L124 PolarHBondContact O-N 3.03Å; C103-L127 VanDerWaalsContact SG-CD1 3.53Å; C103-F132 HydrophobicContact CB-CE1 4.5Å
104L95.6Very high95.8Very high36 Ų3654 Ų5419%0.18831%0.308CS..BIsolated β-bridgetrans-69.7121.5-180-65.2178.3000111.1M96 L97 F100 I108 A121 V123M96-L104 HydrophobicContact CB-CD1 4.39Å; L97-L104 HydrophobicContact CD1-CD1 4.45Å; F100-L104 HydrophobicContact CB-CD2 4.33Å; F100-L104 HydrophobicContact CB-CG 4.17Å; L104-I108 HydrophobicContact CD1-CG2 4.24Å; L104-I108 HydrophobicContact CD2-CG2 4.46Å; L104-A121 HydrophobicContact CD2-CB 3.96Å; L104-V123 HydrophobicContact CD2-CG2 4.39Å
105A95Very high95.7Very high6 Ų651.9 Ų51.95%0.0530%0.304CS..  trans-80.5-43.5179.700000111.8C103 V122 L124 K161C103-A105 PolarHBondContact O-N 3.4Å; A105-V122 HydrophobicContact CB-CB 4.48Å; A105-V122 HydrophobicContact CB-CG1 4.03Å; A105-V122 PolarHBondContact N-O 3.02Å; A105-L124 HydrophobicContact CB-CD2 3.81Å; A105-L124 HydrophobicContact CB-CG 3.97Å; A105-K161 VanDerWaalsContact O-CE 3.26Å; A105-K161 WeakPolarHBondContact O-CE 3.49Å
106D95.4Very high95.6Very high42 Ų4252.7 Ų52.723%0.22531%0.308CS..SBendtrans-131.9177.2-177.7-75.3-40000111.2S52S52-D106 WeakPolarHBondContact CB-OD1 3.49Å
107Q95.4Very high95.6Very high99 Ų9953.2 Ų53.246%0.46331%0.312SS..  trans-67.7144.4177.1-58.8-171.820.200111.3L69L69-Q107 HydrophobicContact CD1-CB 3.99Å
108I96.9Very high95.6Very high8 Ų847.6 Ų47.64%0.04128%0.282CS..  trans-71145.6179.168.1171.8000111.9R93 M96 L104 L110 A121R93-I108 HydrophobicContact CB-CD1 4.22Å; R93-I108 HydrophobicContact CG-CD1 3.62Å; R93-I108 HydrophobicContact CG-CG1 3.76Å; R93-I108 PolarHBondContact NH1-O 2.97Å; M96-I108 HydrophobicContact CB-CD1 4.25Å; M96-I108 HydrophobicContact CB-CG2 4.3Å; M96-I108 HydrophobicContact CG-CD1 4.1Å; L104-I108 HydrophobicContact CD1-CG2 4.24Å; L104-I108 HydrophobicContact CD2-CG2 4.46Å; I108-L110 HydrophobicContact CD1-CD2 3.86Å; I108-L110 HydrophobicContact CD1-CG 4.3Å; I108-L110 HydrophobicContact CG1-CD2 4.42Å; I108-L110 HydrophobicContact CG1-CG 4.49Å; I108-A121 HydrophobicContact CG2-CB 4.14Å
109V98Very high95.7Very high45 Ų4545 Ų4527%0.27326%0.255SS..EExtended strand (participates in β ladder)trans-108.6122.7174.9-179.80000108.8L69 K111 C120L69-V109 HydrophobicContact CD2-CG2 4.04Å; L69-V109 CarbonylContact O-C 3.59Å; L69-V109 WeakPolarHBondContact O-CA 3.25Å; V109-K111 HydrophobicContact CG1-CG 4.4Å; V109-C120 HydrophobicContact CB-CB 4.18Å; V109-C120 PolarHBondContact N-O 3.02Å; V109-C120 PolarHBondContact O-N 2.95Å
110L98Very high95.8Very high0 Ų045.4 Ų45.40%026%0.259CS..EExtended strand (participates in β ladder)trans-106.2128.9-178.7-59.3176.6000109.4L69 S70 L71 D89 L92 I108 I119L69-L110 PolarHBondContact O-N 3.33Å; S70-L110 WeakPolarHBondContact CA-O 3.45Å; L71-L110 PolarHBondContact N-O 2.87Å; D89-L110 HydrophobicContact CB-CD1 3.84Å; D89-L110 VanDerWaalsContact OD1-CD1 3.28Å; D89-L110 WeakPolarHBondContact OD1-CD1 3.44Å; L92-L110 HydrophobicContact CB-CD1 4.38Å; L92-L110 HydrophobicContact CB-CD2 4.41Å; L92-L110 HydrophobicContact CD1-CD1 4.33Å; L92-L110 HydrophobicContact CD1-CD2 4.13Å; I108-L110 HydrophobicContact CD1-CD2 3.86Å; I108-L110 HydrophobicContact CD1-CG 4.3Å; I108-L110 HydrophobicContact CG1-CD2 4.42Å; I108-L110 HydrophobicContact CG1-CG 4.49Å; L110-I119 HydrophobicContact CD2-CB 4.39Å; L110-I119 HydrophobicContact CD2-CG1 3.97Å; L110-I119 HydrophobicContact CD2-CG2 4.15Å
111K97.8Very high95.9Very high82 Ų8245.7 Ų45.736%0.35726%0.261SS..EExtended strand (participates in β ladder)trans-125.9125.8175.6-56179.4-178.61780108.6V109 D118V109-K111 HydrophobicContact CG1-CG 4.4Å; K111-D118 HydrophobicContact CB-CB 4.25Å; K111-D118 PolarHBondContact N-O 3.34Å; K111-D118 PolarHBondContact O-N 3.14Å
112R96.6Very high96.1Very high38 Ų3843.1 Ų43.114%0.14324%0.243CC..EExtended strand (participates in β ladder)trans-104126.1170.3-64.3-172.1177.178.4-2.9109L71 H72 R85 E88 D89 Q116 V117L71-R112 PolarHBondContact O-N 2.89Å; H72-R112 HydrophobicContact CB-CB 4.36Å; H72-R112 HydrophobicContact CB-CG 4.39Å; R85-R112 PolarHBondContact O-NH2 3.47Å; R85-R112 VanDerWaalsContact O-NH2 3.09Å; E88-R112 IonicContact OE2-CZ 2.63Å; E88-R112 IonicContact OE2-NE 3.98Å; E88-R112 PolarHBondContact OE2-NE 3.44Å; E88-R112 IonicContact OE2-NH2 3.11Å; E88-R112 PolarHBondContact OE2-NH2 2.79Å; D89-R112 IonicContact OD1-CZ 2.93Å; D89-R112 IonicContact OD1-NH1 3.56Å; D89-R112 PolarHBondContact OD1-NH1 2.93Å; D89-R112 IonicContact OD1-NH2 3.4Å; D89-R112 PolarHBondContact OD1-NH2 3.28Å; D89-R112 IonicContact OD2-NH1 2.68Å; D89-R112 PolarHBondContact OD2-NH1 2.9Å; R112-Q116 WeakPolarHBondContact CA-O 3.43Å; R112-V117 HydrophobicContact CG-CG2 4.41Å
113R94.4Very high96.3Very high147 Ų14740.5 Ų40.556%0.55522%0.216SC*.EExtended strand (participates in β ladder)trans-132.3110.5177.5-68.7-173.2-69.3-158.55.9108.4N115 Q116 D118R113-N115 PolarHBondContact O-N 3.09Å; R113-Q116 PolarHBondContact N-O 3.21Å; R113-Q116 WeakPolarHBondContact O-CB 3.42Å; R113-Q116 PolarHBondContact O-N 3.06Å; R113-D118 IonicContact CZ-OD2 3.99Å; R113-D118 IonicContact NE-OD2 3.08Å; R113-D118 PolarHBondContact NE-OD2 3.4Å; R113-D118 IonicContact NH2-OD1 3.1Å; R113-D118 IonicContact NH2-OD2 3.8Å; R113-D118 PolarHBondContact NH2-OD2 2.92Å
114A92.7Very high96.4Very high114 Ų11441.6 Ų41.694%0.94222%0.222SC*.THydrogen-bonded Turntrans49.2-131.1-168.300000110.2Q116A114-Q116 VanDerWaalsContact C-N 3.26Å; A114-Q116 PolarHBondContact O-N 2.78Å
115N94.3Very high96.3Very high107 Ų10747.6 Ų47.657%0.57224%0.242SC*.THydrogen-bonded Turntrans-77.4-5.9177.5-16627.5000113.7R113 C149 P150R113-N115 PolarHBondContact O-N 3.09Å; N115-C149 WeakPolarHBondContact O-CB 3.38Å; N115-C149 WeakPolarHBondContact OD1-CB 3.4Å; N115-P150 WeakPolarHBondContact O-CD 3.32Å
116Q95.8Very high96.1Very high45 Ų4552.8 Ų52.821%0.2127%0.265CS..EExtended strand (participates in β ladder)trans-91.5137.5-175.4-172.3176-22.700112R112 R113 A114 D118 P150R112-Q116 WeakPolarHBondContact CA-O 3.43Å; R113-Q116 PolarHBondContact N-O 3.21Å; R113-Q116 WeakPolarHBondContact O-CB 3.42Å; R113-Q116 PolarHBondContact O-N 3.06Å; A114-Q116 VanDerWaalsContact C-N 3.26Å; A114-Q116 PolarHBondContact O-N 2.78Å; Q116-D118 PolarHBondContact NE2-OD1 2.95Å; Q116-P150 WeakPolarHBondContact CA-O 3.39Å; Q116-P150 HydrophobicContact CB-CG 4.23Å; Q116-P150 HydrophobicContact CG-CG 4.45Å; Q116-P150 WeakPolarHBondContact CG-O 3.48Å
117V97.1Very high95.9Very high12 Ų1253.4 Ų53.47%0.07327%0.268CS..EExtended strand (participates in β ladder)trans-109.5116.2172.6-176.10000109.2L92 R112 I119 P150 V151 R152L92-V117 HydrophobicContact CD1-CG1 4.2Å; R112-V117 HydrophobicContact CG-CG2 4.41Å; V117-I119 HydrophobicContact CG1-CG1 4.36Å; V117-P150 PolarHBondContact N-O 3.2Å; V117-P150 VanDerWaalsContact N-O 3.09Å; V117-V151 HydrophobicContact CB-CG2 4.31Å; V117-V151 WeakPolarHBondContact O-CA 3.36Å; V117-R152 PolarHBondContact O-N 2.82Å
118D97.8Very high95.9Very high1 Ų151.3 Ų51.31%0.00526%0.264CS..EExtended strand (participates in β ladder)trans-104.1116.6177.6-60.2-49.9000110.1K111 R113 Q116 R152 H154K111-D118 HydrophobicContact CB-CB 4.25Å; K111-D118 PolarHBondContact N-O 3.34Å; K111-D118 PolarHBondContact O-N 3.14Å; R113-D118 IonicContact CZ-OD2 3.99Å; R113-D118 IonicContact NE-OD2 3.08Å; R113-D118 PolarHBondContact NE-OD2 3.4Å; R113-D118 IonicContact NH2-OD1 3.1Å; R113-D118 IonicContact NH2-OD2 3.8Å; R113-D118 PolarHBondContact NH2-OD2 2.92Å; Q116-D118 PolarHBondContact NE2-OD1 2.95Å; D118-R152 WeakPolarHBondContact CA-O 3.35Å; D118-H154 IonicContact OD1-NE2 3.97Å
119I98.1Very high95.8Very high0 Ų053.9 Ų53.90%029%0.286CS..EExtended strand (participates in β ladder)trans-100.1111.4178.4-56.3174.6000107.9L92 M96 L110 V117 L143 V151 R152 L153 H154L92-I119 HydrophobicContact CD1-CD1 4.42Å; L92-I119 HydrophobicContact CD2-CD1 3.86Å; M96-I119 HydrophobicContact CE-CG2 4.06Å; M96-I119 HydrophobicContact CG-CG2 4.23Å; M96-I119 HydrophobicContact SD-CG2 4.24Å; L110-I119 HydrophobicContact CD2-CB 4.39Å; L110-I119 HydrophobicContact CD2-CG1 3.97Å; L110-I119 HydrophobicContact CD2-CG2 4.15Å; V117-I119 HydrophobicContact CG1-CG1 4.36Å; I119-L143 HydrophobicContact CD1-CD1 3.74Å; I119-V151 HydrophobicContact CD1-CG1 3.81Å; I119-V151 HydrophobicContact CG1-CG1 4.29Å; I119-R152 PolarHBondContact N-O 2.82Å; I119-L153 HydrophobicContact CB-CG 4.37Å; I119-H154 PolarHBondContact O-N 2.9Å
120C98Very high95.7Very high30 Ų3057.8 Ų57.820%0.20330%0.301CS..EExtended strand (participates in β ladder)trans-102.9122.8176.6-58.50000109.5V109 H154V109-C120 HydrophobicContact CB-CB 4.18Å; V109-C120 PolarHBondContact N-O 3.02Å; V109-C120 PolarHBondContact O-N 2.95Å; C120-H154 WeakPolarHBondContact CA-O 3.29Å
121A97.3Very high95.6Very high5 Ų562.9 Ų62.94%0.04132%0.323CS..EExtended strand (participates in β ladder)trans-131.9139.218000000111.9M96 L104 I108 V123 H154 L155 Q156M96-A121 HydrophobicContact CE-CB 4.26Å; L104-A121 HydrophobicContact CD2-CB 3.96Å; I108-A121 HydrophobicContact CG2-CB 4.14Å; A121-V123 HydrophobicContact CB-CG2 4.31Å; A121-H154 PolarHBondContact N-O 2.8Å; A121-L155 HydrophobicContact CB-CD2 3.89Å; A121-L155 WeakPolarHBondContact O-CA 3.47Å; A121-Q156 PolarHBondContact O-N 3.49Å
122V97.2Very high95.5Very high31 Ų3159.8 Ų59.819%0.18831%0.31CS..EExtended strand (participates in β ladder)trans-97.2123.6172.1-174.10000108.3A105 Q156 V158A105-V122 HydrophobicContact CB-CB 4.48Å; A105-V122 HydrophobicContact CB-CG1 4.03Å; A105-V122 PolarHBondContact N-O 3.02Å; V122-Q156 CarbonylContact C-O 3.5Å; V122-Q156 WeakPolarHBondContact CA-O 3.47Å; V122-V158 HydrophobicContact CG1-CB 4.27Å; V122-V158 HydrophobicContact CG1-CG2 3.37Å
123V96.9Very high95.5Very high0 Ų066.6 Ų66.60%034%0.337CS..EExtended strand (participates in β ladder)trans-127.5142.5-167.5-160.10000111.3C103 L104 A121 F132 L155 Q156 T157 V158C103-V123 HydrophobicContact CB-CG1 3.59Å; C103-V123 CarbonylContact O-C 3.47Å; C103-V123 VanDerWaalsContact O-CA 3.31Å; C103-V123 WeakPolarHBondContact O-CA 3.17Å; C103-V123 VanDerWaalsContact O-CG1 3.23Å; C103-V123 WeakPolarHBondContact O-CG1 3.45Å; L104-V123 HydrophobicContact CD2-CG2 4.39Å; A121-V123 HydrophobicContact CB-CG2 4.31Å; V123-F132 HydrophobicContact CG1-CE1 3.59Å; V123-F132 HydrophobicContact CG1-CZ 3.76Å; V123-L155 HydrophobicContact CG2-CB 4.4Å; V123-L155 HydrophobicContact CG2-CD2 3.56Å; V123-L155 HydrophobicContact CG2-CG 4.38Å; V123-Q156 PolarHBondContact N-O 3.27Å; V123-T157 CarbonylContact O-C 3.58Å; V123-T157 VanDerWaalsContact O-CA 3.25Å; V123-T157 WeakPolarHBondContact O-CA 3.34Å; V123-V158 PolarHBondContact O-N 3.4Å
124L95.9Very high95.7Very high25 Ų2566.6 Ų66.613%0.13134%0.341CS..EExtended strand (participates in β ladder)trans-79.1147.7173.5-60.4175.9000110.8C103 A105 Q126 V158C103-L124 PolarHBondContact O-N 3.03Å; A105-L124 HydrophobicContact CB-CD2 3.81Å; A105-L124 HydrophobicContact CB-CG 3.97Å; L124-Q126 HydrophobicContact CB-CG 4.08Å; L124-Q126 PolarHBondContact O-N 3.14Å; L124-V158 WeakPolarHBondContact CA-O 3.4Å
125R93.8Very high95.9Very high162 Ų16262.7 Ų62.761%0.61130%0.304SS*.THydrogen-bonded Turntrans-79.647.9179.2-61.1178.5-178.3171.93.3112.9T157 V158R125-T157 PolarHBondContact NE-OG1 3.4Å; R125-V158 PolarHBondContact N-O 3.3Å
126Q90.9Very high96Very high115 Ų11558.7 Ų58.754%0.53728%0.284SS..THydrogen-bonded Turntrans-84.3-32.4-179.4-69.3178.35.700113.1G102 L124G102-Q126 VanDerWaalsContact O-CD 3.26Å; G102-Q126 PolarHBondContact O-NE2 3.46Å; G102-Q126 PolarHBondContact O-OE1 2.71Å; L124-Q126 HydrophobicContact CB-CG 4.08Å; L124-Q126 PolarHBondContact O-N 3.14Å
127L91.4Very high96.1Very high55 Ų5558.1 Ų58.129%0.28829%0.289SS..SBendtrans-102.5151.9-179.2-65.7172.9000111.3C103 K131 F132 L135C103-L127 VanDerWaalsContact SG-CD1 3.53Å; L127-K131 HydrophobicContact CD2-CD 4.45Å; L127-F132 HydrophobicContact CB-CD2 4.26Å; L127-F132 HydrophobicContact CB-CE1 4.37Å; L127-F132 HydrophobicContact CB-CE2 3.74Å; L127-F132 HydrophobicContact CB-CZ 3.79Å; L127-F132 HydrophobicContact CD1-CE1 4.33Å; L127-F132 HydrophobicContact CD1-CZ 4.43Å; L127-F132 HydrophobicContact CG-CZ 4.48Å; L127-F132 WeakPolarHBondContact O-CE2 3.45Å; L127-L135 HydrophobicContact CD1-CD1 4.49Å
128P94.9Very high96.2Very high56 Ų5662.4 Ų62.436%0.36431%0.305SS..  trans-68.4150172.430.8-36.9000111.3H130 K131 F132P128-H130 VanDerWaalsContact C-N 3.3Å; P128-H130 VanDerWaalsContact CB-CE1 3.41Å; P128-H130 WeakPolarHBondContact CB-CE1 3.33Å; P128-H130 WeakPolarHBondContact CG-CE1 3.38Å; P128-H130 PolarHBondContact O-N 3.24Å; P128-K131 HydrophobicContact CG-CB 4.41Å; P128-K131 HydrophobicContact CG-CD 3.88Å; P128-K131 HydrophobicContact CG-CG 3.98Å; P128-K131 PolarHBondContact O-N 3.09Å; P128-K131 VanDerWaalsContact O-N 3.08Å; P128-F132 PolarHBondContact O-N 3.38Å
129A95Very high96.2Very high62 Ų6262.3 Ų62.351%0.51231%0.305SS..Hα-helixtrans-55.8-38.5-172.900000114.1K131 F132 Y133A129-K131 VanDerWaalsContact C-N 3.27Å; A129-K131 PolarHBondContact O-N 2.53Å; A129-F132 WeakPolarHBondContact O-CB 3.25Å; A129-F132 PolarHBondContact O-N 3.19Å; A129-Y133 HydrophobicContact CB-CE2 4.27Å; A129-Y133 WeakPolarHBondContact O-CD2 2.84Å; A129-Y133 PolarHBondContact O-N 3.49Å
130H96.1Very high96.2Very high127 Ų12765.1 Ų65.159%0.58832%0.317SS*.Hα-helixtrans-61.6-34.2-179.660.7-97000112.8P128 F134P128-H130 VanDerWaalsContact C-N 3.3Å; P128-H130 VanDerWaalsContact CB-CE1 3.41Å; P128-H130 WeakPolarHBondContact CB-CE1 3.33Å; P128-H130 WeakPolarHBondContact CG-CE1 3.38Å; P128-H130 PolarHBondContact O-N 3.24Å; H130-F134 PolarHBondContact O-N 2.89Å; H130-F134 VanDerWaalsContact O-N 3.07Å
131K95.8Very high96.2Very high106 Ų10667.4 Ų67.446%0.46133%0.331SS..Hα-helixtrans-70.7-36.2174.7-68.2-174.8-175.1179.70111.4L127 P128 A129 F134 L135L127-K131 HydrophobicContact CD2-CD 4.45Å; P128-K131 HydrophobicContact CG-CB 4.41Å; P128-K131 HydrophobicContact CG-CD 3.88Å; P128-K131 HydrophobicContact CG-CG 3.98Å; P128-K131 PolarHBondContact O-N 3.09Å; P128-K131 VanDerWaalsContact O-N 3.08Å; A129-K131 VanDerWaalsContact C-N 3.27Å; A129-K131 PolarHBondContact O-N 2.53Å; K131-F134 PolarHBondContact O-N 3.31Å; K131-L135 WeakPolarHBondContact O-CB 3.35Å; K131-L135 WeakPolarHBondContact O-CG 3.5Å; K131-L135 PolarHBondContact O-N 3.47Å
132F95.9Very high96.2Very high18 Ų1869.9 Ų69.98%0.07934%0.343CS..Hα-helixtrans-61.6-49.8173.7-77.8-59.3000111.2F100 C103 V123 L127 P128 A129 F134 L135 V136 L155F100-F132 HydrophobicContact CD1-CD1 4.24Å; F100-F132 HydrophobicContact CD1-CE1 4.11Å; F100-F132 AromaticContact CE1-CD1 3.99Å; F100-F132 HydrophobicContact CE1-CD1 3.99Å; F100-F132 HydrophobicContact CE1-CE1 4.34Å; C103-F132 HydrophobicContact CB-CE1 4.5Å; V123-F132 HydrophobicContact CG1-CE1 3.59Å; V123-F132 HydrophobicContact CG1-CZ 3.76Å; L127-F132 HydrophobicContact CB-CD2 4.26Å; L127-F132 HydrophobicContact CB-CE1 4.37Å; L127-F132 HydrophobicContact CB-CE2 3.74Å; L127-F132 HydrophobicContact CB-CZ 3.79Å; L127-F132 HydrophobicContact CD1-CE1 4.33Å; L127-F132 HydrophobicContact CD1-CZ 4.43Å; L127-F132 HydrophobicContact CG-CZ 4.48Å; L127-F132 WeakPolarHBondContact O-CE2 3.45Å; P128-F132 PolarHBondContact O-N 3.38Å; A129-F132 WeakPolarHBondContact O-CB 3.25Å; A129-F132 PolarHBondContact O-N 3.19Å; F132-F134 VanDerWaalsContact C-N 3.28Å; F132-F134 PolarHBondContact O-N 2.99Å; F132-L135 PolarHBondContact O-N 3.11Å; F132-V136 WeakPolarHBondContact O-CB 3.38Å; F132-V136 WeakPolarHBondContact O-CG2 3.46Å; F132-V136 PolarHBondContact O-N 2.71Å; F132-L155 HydrophobicContact CD1-CD1 4.17Å
133Y96.9Very high96.2Very high181 Ų18168.5 Ų68.571%0.7133%0.334SS*.Hα-helixtrans-60.1-38.6177.6-72-68.6000112.7A129 V136 G137A129-Y133 HydrophobicContact CB-CE2 4.27Å; A129-Y133 WeakPolarHBondContact O-CD2 2.84Å; A129-Y133 PolarHBondContact O-N 3.49Å; Y133-V136 PolarHBondContact O-N 3.49Å; Y133-G137 PolarHBondContact O-N 3.03Å
134F97.4Very high96.3Very high147 Ų14770.1 Ų70.165%0.64535%0.346SS*.Hα-helixtrans-61-50.3173.2176.7-95.5000112.3H130 K131 F132 V136 G137 Y138H130-F134 PolarHBondContact O-N 2.89Å; H130-F134 VanDerWaalsContact O-N 3.07Å; K131-F134 PolarHBondContact O-N 3.31Å; F132-F134 VanDerWaalsContact C-N 3.28Å; F132-F134 PolarHBondContact O-N 2.99Å; F134-V136 VanDerWaalsContact C-N 3.31Å; F134-V136 PolarHBondContact O-N 2.83Å; F134-G137 PolarHBondContact O-N 3.25Å; F134-Y138 WeakPolarHBondContact O-CB 3.48Å; F134-Y138 PolarHBondContact O-N 3.37Å
135L97Very high96.4Very high31 Ų3175.4 Ų75.416%0.16237%0.369CS..Hα-helixtrans-65.3-34.8-180-70.4174.1000112.3T99 F100 L127 K131 F132 S139T99-L135 HydrophobicContact CG2-CD2 3.97Å; F100-L135 HydrophobicContact CD1-CD1 4.01Å; F100-L135 HydrophobicContact CE1-CB 3.73Å; F100-L135 HydrophobicContact CE1-CD1 3.85Å; F100-L135 HydrophobicContact CE1-CG 4.46Å; F100-L135 HydrophobicContact CZ-CB 3.83Å; L127-L135 HydrophobicContact CD1-CD1 4.49Å; K131-L135 WeakPolarHBondContact O-CB 3.35Å; K131-L135 WeakPolarHBondContact O-CG 3.5Å; K131-L135 PolarHBondContact O-N 3.47Å; F132-L135 PolarHBondContact O-N 3.11Å; L135-S139 VanDerWaalsContact O-CB 3.32Å; L135-S139 WeakPolarHBondContact O-CB 3.5Å; L135-S139 PolarHBondContact O-N 3.48Å; L135-S139 PolarHBondContact O-OG 2.81Å
136V97.6Very high96.5Very high24 Ų2473.5 Ų73.515%0.14537%0.366CS..Hα-helixtrans-61.5-53.4172.8170.80000109.9F132 Y133 F134 Y138 S139 E140 L153 L155F132-V136 WeakPolarHBondContact O-CB 3.38Å; F132-V136 WeakPolarHBondContact O-CG2 3.46Å; F132-V136 PolarHBondContact O-N 2.71Å; Y133-V136 PolarHBondContact O-N 3.49Å; F134-V136 VanDerWaalsContact C-N 3.31Å; F134-V136 PolarHBondContact O-N 2.83Å; V136-Y138 PolarHBondContact O-N 3.23Å; V136-S139 PolarHBondContact O-N 2.97Å; V136-S139 PolarHBondContact O-OG 3.43Å; V136-E140 HydrophobicContact CG1-CG 4.36Å; V136-E140 WeakPolarHBondContact O-CB 3.38Å; V136-E140 WeakPolarHBondContact O-CG 3.16Å; V136-E140 PolarHBondContact O-N 3.37Å; V136-L153 HydrophobicContact CG1-CB 4.44Å; V136-L153 HydrophobicContact CG2-CD2 4.26Å; V136-L155 HydrophobicContact CG2-CD1 3.51Å; V136-L155 HydrophobicContact CG2-CG 4.15Å
137G97.9Very high96.8Very high32 Ų3270.5 Ų70.533%0.3335%0.35SS..Hα-helixtrans-61.1-41.5178.200000113.3Y133 F134 T141Y133-G137 PolarHBondContact O-N 3.03Å; F134-G137 PolarHBondContact O-N 3.25Å; G137-T141 WeakPolarHBondContact O-CB 3.48Å; G137-T141 VanDerWaalsContact O-CG2 3.3Å; G137-T141 WeakPolarHBondContact O-CG2 3.28Å; G137-T141 PolarHBondContact O-N 3.08Å; G137-T141 VanDerWaalsContact O-N 3.09Å; G137-T141 PolarHBondContact O-OG1 3.09Å
138Y97.9Very high97Very high102 Ų10275.9 Ų75.940%0.437%0.371SS..Hα-helixtrans-59.2-48.5174.9164.5-104.4000112.4F95 T99 F134 V136 T141 L142F95-Y138 HydrophobicContact CZ-CE1 4.05Å; T99-Y138 HydrophobicContact CG2-CD1 4.36Å; T99-Y138 HydrophobicContact CG2-CE1 4.38Å; F134-Y138 WeakPolarHBondContact O-CB 3.48Å; F134-Y138 PolarHBondContact O-N 3.37Å; V136-Y138 PolarHBondContact O-N 3.23Å; Y138-T141 PolarHBondContact O-OG1 3.13Å; Y138-T141 VanDerWaalsContact O-OG1 3.07Å; Y138-L142 HydrophobicContact CE1-CD1 4.39Å; Y138-L142 HydrophobicContact CE2-CD1 3.71Å; Y138-L142 WeakPolarHBondContact O-CB 3.31Å; Y138-L142 PolarHBondContact O-N 3.31Å; Y138-L142 VanDerWaalsContact OH-CD1 3.29Å; Y138-L142 WeakPolarHBondContact OH-CD1 2.97Å
139S97.7Very high97.1Very high0 Ų073.9 Ų73.90%036%0.358CS..Hα-helixtrans-71.2-43.2-177.651.50000112.4L135 V136 T141 L143 L153L135-S139 VanDerWaalsContact O-CB 3.32Å; L135-S139 WeakPolarHBondContact O-CB 3.5Å; L135-S139 PolarHBondContact O-N 3.48Å; L135-S139 PolarHBondContact O-OG 2.81Å; V136-S139 PolarHBondContact O-N 2.97Å; V136-S139 PolarHBondContact O-OG 3.43Å; S139-T141 PolarHBondContact O-N 3.25Å; S139-L143 WeakPolarHBondContact O-CB 3.46Å; S139-L143 WeakPolarHBondContact O-CG 3.21Å; S139-L143 PolarHBondContact O-N 3.48Å; S139-L153 WeakPolarHBondContact OG-CD1 3.37Å
140E97.9Very high97.2Very high58 Ų5873.8 Ų73.827%0.27135%0.353SS..Hα-helixtrans-60.3-46.3177.3-72.4-175.9157.500111.5V136 S144 L153V136-E140 HydrophobicContact CG1-CG 4.36Å; V136-E140 WeakPolarHBondContact O-CB 3.38Å; V136-E140 WeakPolarHBondContact O-CG 3.16Å; V136-E140 PolarHBondContact O-N 3.37Å; E140-S144 WeakPolarHBondContact O-CB 3.29Å; E140-S144 PolarHBondContact O-N 3.08Å; E140-S144 PolarHBondContact O-OG 2.78Å; E140-L153 HydrophobicContact CG-CB 3.9Å; E140-L153 PolarHBondContact OE1-N 2.98Å
141T98.2Very high97.3Very high78 Ų7868.1 Ų68.148%0.47933%0.327SS..Hα-helixtrans-66.6-50.717952.20000111.9G137 Y138 S139 L143 S144 H145G137-T141 WeakPolarHBondContact O-CB 3.48Å; G137-T141 VanDerWaalsContact O-CG2 3.3Å; G137-T141 WeakPolarHBondContact O-CG2 3.28Å; G137-T141 PolarHBondContact O-N 3.08Å; G137-T141 VanDerWaalsContact O-N 3.09Å; G137-T141 PolarHBondContact O-OG1 3.09Å; Y138-T141 PolarHBondContact O-OG1 3.13Å; Y138-T141 VanDerWaalsContact O-OG1 3.07Å; S139-T141 PolarHBondContact O-N 3.25Å; T141-L143 PolarHBondContact O-N 3.49Å; T141-S144 PolarHBondContact O-N 3.5Å; T141-H145 PolarHBondContact O-CD2 3.28Å; T141-H145 PolarHBondContact O-N 2.98Å
142L98.2Very high97.4Very high58 Ų5869.8 Ų69.830%0.30433%0.33SS..Hα-helixtrans-59.7-49.6-179.4-175.6158.4000111.4F95 Y138 S144 H145 F146F95-L142 HydrophobicContact CE2-CD2 4.31Å; F95-L142 HydrophobicContact CZ-CD2 4.41Å; Y138-L142 HydrophobicContact CE1-CD1 4.39Å; Y138-L142 HydrophobicContact CE2-CD1 3.71Å; Y138-L142 WeakPolarHBondContact O-CB 3.31Å; Y138-L142 PolarHBondContact O-N 3.31Å; Y138-L142 VanDerWaalsContact OH-CD1 3.29Å; Y138-L142 WeakPolarHBondContact OH-CD1 2.97Å; L142-S144 VanDerWaalsContact C-N 3.31Å; L142-S144 PolarHBondContact O-N 3.24Å; L142-H145 PolarHBondContact O-N 3.32Å; L142-F146 WeakPolarHBondContact O-CB 3.39Å; L142-F146 PolarHBondContact O-N 2.95Å
143L97.7Very high97.5Very high1 Ų169.5 Ų69.51%0.00533%0.329CS..Hα-helixtrans-66.8-35.8-178-65.3174.4000111.4F91 L92 F95 I119 S139 T141 F146 Y147 V151F91-L143 HydrophobicContact CE1-CD2 4.02Å; L92-L143 HydrophobicContact CD2-CD1 3.79Å; L92-L143 HydrophobicContact CD2-CD2 3.82Å; L92-L143 HydrophobicContact CD2-CG 4.42Å; F95-L143 HydrophobicContact CD1-CD1 4.17Å; F95-L143 HydrophobicContact CD1-CD2 4.17Å; F95-L143 HydrophobicContact CD1-CG 4.49Å; F95-L143 HydrophobicContact CE1-CD1 3.95Å; F95-L143 HydrophobicContact CE1-CD2 4.15Å; F95-L143 HydrophobicContact CE1-CG 4.1Å; F95-L143 HydrophobicContact CZ-CD2 4.48Å; I119-L143 HydrophobicContact CD1-CD1 3.74Å; S139-L143 WeakPolarHBondContact O-CB 3.46Å; S139-L143 WeakPolarHBondContact O-CG 3.21Å; S139-L143 PolarHBondContact O-N 3.48Å; T141-L143 PolarHBondContact O-N 3.49Å; L143-F146 PolarHBondContact O-N 2.99Å; L143-Y147 HydrophobicContact CD2-CD2 4.44Å; L143-Y147 HydrophobicContact CD2-CE2 4.1Å; L143-Y147 PolarHBondContact O-N 3.06Å; L143-V151 HydrophobicContact CB-CB 4.13Å; L143-V151 HydrophobicContact CB-CG1 4.12Å; L143-V151 HydrophobicContact CB-CG2 3.85Å; L143-V151 HydrophobicContact CD1-CG1 4.1Å
144S97.5Very high97.5Very high34 Ų3465 Ų6524%0.23832%0.315CS..Hα-helixtrans-65.2-40.9175.4-59.40000112.1E140 T141 L142 K148 C149 V151E140-S144 WeakPolarHBondContact O-CB 3.29Å; E140-S144 PolarHBondContact O-N 3.08Å; E140-S144 PolarHBondContact O-OG 2.78Å; T141-S144 PolarHBondContact O-N 3.5Å; L142-S144 VanDerWaalsContact C-N 3.31Å; L142-S144 PolarHBondContact O-N 3.24Å; S144-K148 VanDerWaalsContact O-CA 3.25Å; S144-K148 WeakPolarHBondContact O-CA 3.46Å; S144-K148 PolarHBondContact O-N 3.02Å; S144-C149 WeakPolarHBondContact CA-O 3.32Å; S144-C149 WeakPolarHBondContact CB-O 3.49Å; S144-C149 PolarHBondContact O-N 3.44Å; S144-C149 PolarHBondContact OG-O 3.29Å; S144-V151 PolarHBondContact OG-N 2.78Å; S144-V151 VanDerWaalsContact OG-N 3.15Å
145H98Very high97.5Very high136 Ų13660.7 Ų60.763%0.6330%0.298SS*.Hα-helixtrans-71.1-31.3175.6-75.8-66.4000113.5T141 L142 K148T141-H145 PolarHBondContact O-CD2 3.28Å; T141-H145 PolarHBondContact O-N 2.98Å; L142-H145 PolarHBondContact O-N 3.32Å; H145-K148 WeakPolarHBondContact O-CD 3.39Å; H145-K148 VanDerWaalsContact O-CE 3.29Å; H145-K148 WeakPolarHBondContact O-CE 3.39Å; H145-K148 PolarHBondContact O-NZ 3.18Å
146F97.3Very high97.5Very high122 Ų12265.3 Ų65.354%0.53532%0.319SS..Hα-helixtrans-74.6-51180-173.6-105.6000111.8F91 L142 L143F91-F146 HydrophobicContact CE1-CE1 4.4Å; F91-F146 HydrophobicContact CZ-CE1 4.49Å; L142-F146 WeakPolarHBondContact O-CB 3.39Å; L142-F146 PolarHBondContact O-N 2.95Å; L143-F146 PolarHBondContact O-N 2.99Å
147Y95.7Very high97.4Very high52 Ų5267.4 Ų67.420%0.20433%0.332CS..Hα-helixtrans-88.6-6.6-177.8-70.1-60.4000114.6E88 F91 L92 L143 C149E88-Y147 HydrophobicContact CB-CE1 4.33Å; E88-Y147 HydrophobicContact CG-CD1 4.23Å; E88-Y147 HydrophobicContact CG-CE1 3.62Å; F91-Y147 HydrophobicContact CD1-CE2 4.21Å; F91-Y147 AromaticContact CD1-CZ 3.94Å; F91-Y147 WeakPolarHBondContact CD1-OH 3.21Å; F91-Y147 HydrophobicContact CE1-CE2 4.36Å; L92-Y147 HydrophobicContact CD2-CE2 3.98Å; L92-Y147 HydrophobicContact CG-CE2 4.38Å; L143-Y147 HydrophobicContact CD2-CD2 4.44Å; L143-Y147 HydrophobicContact CD2-CE2 4.1Å; L143-Y147 PolarHBondContact O-N 3.06Å; Y147-C149 WeakPolarHBondContact CB-SG 3.4Å; Y147-C149 PolarHBondContact O-N 2.98Å
148K97.2Very high97.4Very high168 Ų16866.9 Ų66.973%0.7332%0.322SS*.SBendtrans58.527.8-176.4-49.2-57.9-179.2-165.20113.2S144 H145S144-K148 VanDerWaalsContact O-CA 3.25Å; S144-K148 WeakPolarHBondContact O-CA 3.46Å; S144-K148 PolarHBondContact O-N 3.02Å; H145-K148 WeakPolarHBondContact O-CD 3.39Å; H145-K148 VanDerWaalsContact O-CE 3.29Å; H145-K148 WeakPolarHBondContact O-CE 3.39Å; H145-K148 PolarHBondContact O-NZ 3.18Å
149C95.6Very high97.2Very high14 Ų1466.7 Ų66.710%0.09533%0.333CS..SBendtrans-132.5151.7-179.170.70000110.3N115 S144 Y147 V151N115-C149 WeakPolarHBondContact O-CB 3.38Å; N115-C149 WeakPolarHBondContact OD1-CB 3.4Å; S144-C149 WeakPolarHBondContact CA-O 3.32Å; S144-C149 WeakPolarHBondContact CB-O 3.49Å; S144-C149 PolarHBondContact O-N 3.44Å; S144-C149 PolarHBondContact OG-O 3.29Å; Y147-C149 WeakPolarHBondContact CB-SG 3.4Å; Y147-C149 PolarHBondContact O-N 2.98Å; C149-V151 PolarHBondContact O-N 3.05Å
150P97.5Very high97.1Very high61 Ų6170.3 Ų70.340%0.39636%0.358SS..  trans-68.8118.4175.626.5-32.1000110.3N115 Q116 V117N115-P150 WeakPolarHBondContact O-CD 3.32Å; Q116-P150 WeakPolarHBondContact CA-O 3.39Å; Q116-P150 HydrophobicContact CB-CG 4.23Å; Q116-P150 HydrophobicContact CG-CG 4.45Å; Q116-P150 WeakPolarHBondContact CG-O 3.48Å; V117-P150 PolarHBondContact N-O 3.2Å; V117-P150 VanDerWaalsContact N-O 3.09Å
151V98.1Very high96.9Very high7 Ų771.5 Ų71.54%0.04236%0.363CS..EExtended strand (participates in β ladder)trans-106131.1175.4-176.30000109.7V117 I119 L143 S144 C149V117-V151 HydrophobicContact CB-CG2 4.31Å; V117-V151 WeakPolarHBondContact O-CA 3.36Å; I119-V151 HydrophobicContact CD1-CG1 3.81Å; I119-V151 HydrophobicContact CG1-CG1 4.29Å; L143-V151 HydrophobicContact CB-CB 4.13Å; L143-V151 HydrophobicContact CB-CG1 4.12Å; L143-V151 HydrophobicContact CB-CG2 3.85Å; L143-V151 HydrophobicContact CD1-CG1 4.1Å; S144-V151 PolarHBondContact OG-N 2.78Å; S144-V151 VanDerWaalsContact OG-N 3.15Å; C149-V151 PolarHBondContact O-N 3.05Å
152R97.7Very high96.8Very high141 Ų14171.6 Ų71.653%0.53236%0.363SS..EExtended strand (participates in β ladder)trans-121.5140172.8-66.3-161.2-177.8164-3.1111.4V117 D118 I119V117-R152 PolarHBondContact O-N 2.82Å; D118-R152 WeakPolarHBondContact CA-O 3.35Å; I119-R152 PolarHBondContact N-O 2.82Å
153L97.7Very high96.7Very high12 Ų1271.7 Ų71.76%0.06337%0.366CS..EExtended strand (participates in β ladder)trans-117.9116.8-174.6-159.1167.7000110.1M96 F100 I119 V136 S139 E140 L155M96-L153 HydrophobicContact CE-CD1 3.93Å; M96-L153 HydrophobicContact CE-CD2 4.41Å; M96-L153 HydrophobicContact CE-CG 4.33Å; M96-L153 HydrophobicContact SD-CD1 4.02Å; F100-L153 HydrophobicContact CE2-CD1 4.3Å; F100-L153 HydrophobicContact CZ-CD1 4.42Å; I119-L153 HydrophobicContact CB-CG 4.37Å; V136-L153 HydrophobicContact CG1-CB 4.44Å; V136-L153 HydrophobicContact CG2-CD2 4.26Å; S139-L153 WeakPolarHBondContact OG-CD1 3.37Å; E140-L153 HydrophobicContact CG-CB 3.9Å; E140-L153 PolarHBondContact OE1-N 2.98Å; L153-L155 HydrophobicContact CD2-CD1 4.2Å; L153-L155 HydrophobicContact CD2-CD2 3.17Å; L153-L155 HydrophobicContact CD2-CG 3.42Å; L153-L155 VanDerWaalsContact CD2-CG 3.42Å
154H97.8Very high96.6Very high88 Ų8877.5 Ų77.541%0.40739%0.389SS..EExtended strand (participates in β ladder)trans-105.9114.5179.5-61.9-64.5000110.3D118 I119 C120 A121D118-H154 IonicContact OD1-NE2 3.97Å; I119-H154 PolarHBondContact O-N 2.9Å; C120-H154 WeakPolarHBondContact CA-O 3.29Å; A121-H154 PolarHBondContact N-O 2.8Å
155L96.8Very high96.5Very high55 Ų5579.8 Ų79.829%0.28839%0.394SS..EExtended strand (participates in β ladder)trans-104129.6177.8-62.9-173.7000111.6F100 A121 V123 F132 V136 L153F100-L155 HydrophobicContact CE1-CD1 4.38Å; A121-L155 HydrophobicContact CB-CD2 3.89Å; A121-L155 WeakPolarHBondContact O-CA 3.47Å; V123-L155 HydrophobicContact CG2-CB 4.4Å; V123-L155 HydrophobicContact CG2-CD2 3.56Å; V123-L155 HydrophobicContact CG2-CG 4.38Å; F132-L155 HydrophobicContact CD1-CD1 4.17Å; V136-L155 HydrophobicContact CG2-CD1 3.51Å; V136-L155 HydrophobicContact CG2-CG 4.15Å; L153-L155 HydrophobicContact CD2-CD1 4.2Å; L153-L155 HydrophobicContact CD2-CD2 3.17Å; L153-L155 HydrophobicContact CD2-CG 3.42Å; L153-L155 VanDerWaalsContact CD2-CG 3.42Å
156Q97Very high96.4Very high129 Ų12980.4 Ų80.460%0.60339%0.392SS*.EExtended strand (participates in β ladder)trans-112.4117.5169.1-176.6177.10.400109.3A121 V122 V123A121-Q156 PolarHBondContact O-N 3.49Å; V122-Q156 CarbonylContact C-O 3.5Å; V122-Q156 WeakPolarHBondContact CA-O 3.47Å; V123-Q156 PolarHBondContact N-O 3.27Å
157T96.3Very high96.1Very high67 Ų6775.8 Ų75.841%0.41137%0.373SS..EExtended strand (participates in β ladder)trans-86.1136.4179.6710000112.3V123 R125V123-T157 CarbonylContact O-C 3.58Å; V123-T157 VanDerWaalsContact O-CA 3.25Å; V123-T157 WeakPolarHBondContact O-CA 3.34Å; R125-T157 PolarHBondContact NE-OG1 3.4Å
158V96.8Very high96.2Very high22 Ų2277 Ų7713%0.13338%0.381CS..EExtended strand (participates in β ladder)trans-129141.9177.2-173.90000108.6V122 V123 L124 R125 S160 V162V122-V158 HydrophobicContact CG1-CB 4.27Å; V122-V158 HydrophobicContact CG1-CG2 3.37Å; V123-V158 PolarHBondContact O-N 3.4Å; L124-V158 WeakPolarHBondContact CA-O 3.4Å; R125-V158 PolarHBondContact N-O 3.3Å; V158-S160 WeakPolarHBondContact CG1-O 3.46Å; V158-V162 HydrophobicContact CG1-CG2 4Å
159P95.4Very high96.1Very high97 Ų9772.2 Ų72.263%0.6336%0.363SS*.SBendtrans-64.1-38.5179.524.4-35.4000113.6
160S94.8Very high96.1Very high76 Ų7675.4 Ų75.453%0.53138%0.378SS..SBendtrans-144.3164.8-177.856.90000110.9V158 V162V158-S160 WeakPolarHBondContact CG1-O 3.46Å; S160-V162 PolarHBondContact O-N 2.99Å
161K94.6Very high96Very high84 Ų8476.3 Ų76.337%0.36538%0.377SS..PPolyproline II helixtrans-62.8130.6177.1-174.5173.1-178.5-179.60109.7E55 A105 V163E55-K161 IonicContact OE1-NZ 2.98Å; E55-K161 PolarHBondContact OE1-NZ 2.98Å; E55-K161 IonicContact OE2-NZ 3.32Å; E55-K161 PolarHBondContact OE2-NZ 2.76Å; A105-K161 VanDerWaalsContact O-CE 3.26Å; A105-K161 WeakPolarHBondContact O-CE 3.49Å; K161-V163 PolarHBondContact O-N 2.69Å
162V94.9Very high95.9Very high80 Ų8080.6 Ų80.649%0.48540%0.398SS..PPolyproline II helixtrans-71.3117.1-177.4-176.60000109.5V158 S160V158-V162 HydrophobicContact CG1-CG2 4Å; S160-V162 PolarHBondContact O-N 2.99Å
163V96.5Very high95.8Very high59 Ų5976.6 Ų76.636%0.35839%0.389SS..PPolyproline II helixtrans-95.4124.9179-173.70000109.1P50 K161 Y166P50-V163 HydrophobicContact CB-CB 4.42Å; P50-V163 HydrophobicContact CB-CG1 3.75Å; P50-V163 HydrophobicContact CB-CG2 3.75Å; K161-V163 PolarHBondContact O-N 2.69Å; V163-Y166 HydrophobicContact CG1-CD2 4.3Å; V163-Y166 HydrophobicContact CG1-CE1 4.35Å; V163-Y166 HydrophobicContact CG1-CE2 3.83Å
164Y96.4Very high95.7Very high124 Ų12481.2 Ų81.249%0.48641%0.412SS..  trans-91.5-46.7175.5174.1-117000111.8V51 Y53 A56V51-Y164 PolarHBondContact O-N 2.72Å; Y53-Y164 HydrophobicContact CD2-CD1 4.17Å; Y53-Y164 AromaticContact CD2-CD2 3.82Å; Y53-Y164 HydrophobicContact CD2-CD2 3.82Å; Y53-Y164 HydrophobicContact CD2-CE1 4.18Å; Y53-Y164 AromaticContact CD2-CE2 3.83Å; Y53-Y164 HydrophobicContact CD2-CE2 3.83Å; Y53-Y164 AromaticContact CD2-CG 3.99Å; Y53-Y164 HydrophobicContact CD2-CG 3.99Å; Y53-Y164 HydrophobicContact CE2-CE2 4.22Å; A56-Y164 HydrophobicContact CB-CD1 3.76Å; A56-Y164 HydrophobicContact CB-CE1 4.32Å
165K95.5Very high95.5Very high82 Ų8280.7 Ų80.736%0.35741%0.412SS..EExtended strand (participates in β ladder)trans-154.1162.4177.169.6-174.8-172.3-168.10111.1V51 A56 I167V51-K165 PolarHBondContact N-O 2.93Å; V51-K165 PolarHBondContact O-N 2.81Å; A56-K165 HydrophobicContact CB-CD 4.31Å; A56-K165 HydrophobicContact CB-CG 4.41Å; A56-K165 PolarHBondContact O-NZ 2.8Å; K165-I167 HydrophobicContact CD-CD1 4.45Å; K165-I167 HydrophobicContact CD-CG1 4.31Å; K165-I167 HydrophobicContact CG-CD1 4.42Å; K165-I167 HydrophobicContact CG-CG1 4.05Å
166Y95.6Very high95.4Very high148 Ų14882.8 Ų82.858%0.5842%0.423SS*.EExtended strand (participates in β ladder)trans-100.4135.7171.4-64.9-94.8000110.2G47 K49 P50 V163G47-Y166 VanDerWaalsContact O-CB 3.25Å; G47-Y166 WeakPolarHBondContact O-CB 3.18Å; K49-Y166 WeakPolarHBondContact O-CA 3.46Å; P50-Y166 HydrophobicContact CB-CD1 4.24Å; P50-Y166 HydrophobicContact CB-CE1 3.87Å; V163-Y166 HydrophobicContact CG1-CD2 4.3Å; V163-Y166 HydrophobicContact CG1-CE1 4.35Å; V163-Y166 HydrophobicContact CG1-CE2 3.83Å
167I91.1Very high95.3Very high26 Ų2678.6 Ų78.613%0.13341%0.406CS..  trans-122.20-174.4-64.1-173.1000110.3V44 A45 G47 K49 V51 K165V44-I167 VanDerWaalsContact CA-CG2 3.46Å; V44-I167 HydrophobicContact CB-CG2 4.25Å; V44-I167 HydrophobicContact CG2-CG2 4.16Å; A45-I167 PolarHBondContact N-OXT 3.14Å; G47-I167 WeakPolarHBondContact CA-O 3.41Å; G47-I167 PolarHBondContact N-O 3.24Å; K49-I167 WeakPolarHBondContact CB-O 3.25Å; K49-I167 PolarHBondContact N-O 3.01Å; K49-I167 PolarHBondContact O-N 3.2Å; V51-I167 HydrophobicContact CB-CD1 4.15Å; V51-I167 HydrophobicContact CB-CG1 4.46Å; V51-I167 HydrophobicContact CG1-CD1 4.28Å; V51-I167 HydrophobicContact CG2-CB 4.07Å; V51-I167 HydrophobicContact CG2-CD1 3.75Å; V51-I167 HydrophobicContact CG2-CG1 3.9Å; K165-I167 HydrophobicContact CD-CD1 4.45Å; K165-I167 HydrophobicContact CD-CG1 4.31Å; K165-I167 HydrophobicContact CG-CD1 4.42Å; K165-I167 HydrophobicContact CG-CG1 4.05Å

Retrieved 167 of 167 residues in 46.7 ms (Link to these results)