A0A096NXI5_PAPAN Loading...

Cyclin-dependent kinase 2-associated protein

AlphaFold DB (A0A2K5MAM5), UniProt , Accession A0A096NXI5, Species PAPAN (Papio anubis, Olive baboon), Gene CDK2AP1, Length 114 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M45.1Very low48.9Very low239 Ų239158.3 Ų158.3100%1.17785%0.852SS**  097.80-8962.9175.600109.7
2S57Low49Very low102 Ų102155.3 Ų155.371%0.71385%0.847SS**  trans-72.8150.7155.8-71.90000109.4
3Y40.5Very low48Very low210 Ų210151 Ų15182%0.82485%0.846SS**  -178.2101.2128.6-73.5-57.2000106.9
4K61.4Low47.4Very low188 Ų188148 Ų14882%0.81785%0.85SS**  99.1130.894.2-88.6-179160.5-1770112.8
5P53.8Low46.9Very low128 Ų128143.5 Ų143.583%0.83184%0.838SS**  trans-84.6156.1176.135.4-32.1000111.1
6N48.6Very low46.5Very low157 Ų157144.2 Ų144.284%0.8484%0.836SS**  trans-125.5128.4171.5-156.7-80.2000111.3
7L51.8Low46.3Very low172 Ų172145.1 Ų145.190%0.90184%0.837SS**  trans-102.8117.7-178-167.587.7000107.3
8A48.8Very low46Very low96 Ų96142.7 Ų142.779%0.79384%0.837SS**  trans-148.1113.2165.600000110.2
9A43Very low45.5Very low97 Ų97140.8 Ų140.880%0.80284%0.84SS**  trans-74.7148.1172.400000111.3
10H38.9Very low44.9Very low185 Ų185137.6 Ų137.686%0.85684%0.836SS**  trans-167.1126.5139.5-153.358.2000112
11M49.4Very low45Very low167 Ų167136.3 Ų136.382%0.82383%0.834SS**  trans-84157.3162.7-61-157.3173.500109.9
12P49.7Very low44.6Very low122 Ų122131.4 Ų131.479%0.79282%0.817SS**  trans-115.5116.6150.624.9-9.1000110.9
13A35.4Very low44.2Very low100 Ų100135.1 Ų135.183%0.82682%0.823SS**PPolyproline II helixtrans-68.3121.9161.800000109.1
14A40.2Very low44.1Very low109 Ų109130.3 Ų130.390%0.90182%0.82SS**PPolyproline II helixtrans-82117.8168.500000109
15A39.9Very low43.9Very low81 Ų81126.3 Ų126.367%0.66981%0.813SS**PPolyproline II helixtrans-92.9144.1177.400000110.8
16L41.1Very low43.5Very low154 Ų154125.6 Ų125.681%0.80681%0.811SS**  trans70.8106.5151.1-55.3160000118.1
17N42.7Very low43.5Very low160 Ų160124.8 Ų124.886%0.85681%0.812SS**  177.6119.6100.4-97.7-77.9000110.2
18A40.8Very low43.2Very low102 Ų102120 Ų12084%0.84379%0.793SS**  trans-111.7113.8166.300000107.6
19A37Very low43.4Very low107 Ų107124.2 Ų124.288%0.88480%0.798SS**  trans167.2129.8151.600000108.4
20G33.8Very low43.7Very low75 Ų75123.5 Ų123.577%0.77379%0.792SS**  trans140.891.7166.600000113.3
21S46.6Very low44.2Very low111 Ų111118 Ų11878%0.77678%0.775SS**  trans-24.3138.4146.9-44.70000113.2
22V36.5Very low44.3Very low137 Ų137113.2 Ų113.283%0.8376%0.758SS**  173.1130.6109.6-85.30000109.9
23H49.4Very low44.5Very low179 Ų179113.6 Ų113.683%0.82975%0.749SS**  trans-57.2138.6166.4-144.3108.1000109.6
24S38.2Very low45.2Very low110 Ų110117.3 Ų117.377%0.76974%0.743SS**  trans-151.9146.7152.4-89.70000112.9
25P55.5Low45.8Very low103 Ų103119.7 Ų119.767%0.66973%0.728SS**  trans-104.1171.5-155.318.93.1000112.1
26S47Very low46.5Very low113 Ų113122.6 Ų122.679%0.7973%0.728SS**  trans76.189.5159.4-59.80000117.3
27T48.5Very low47.2Very low140 Ų140121.5 Ų121.586%0.85972%0.722SS**  -155.1115.2121.9-29.60000108.6
28S44.3Very low47.8Very low72 Ų72118.8 Ų118.850%0.50371%0.708SS.*  trans147.576.5148.2-65.20000110.7A30 S31S28-A30 PolarHBondContact O-N 3.28Å; S28-S31 PolarHBondContact O-N 2.9Å; S28-S31 VanDerWaalsContact O-N 3.08Å; S28-S31 PolarHBondContact O-OG 3.48Å
29M53.2Low48.5Very low184 Ų184117.7 Ų117.791%0.90669%0.694SS**THydrogen-bonded Turntrans-53.2-9.5165.2-80.4-81.6-16800113.5
30A50.4Low49.4Very low82 Ų82119.6 Ų119.668%0.67869%0.689SS**THydrogen-bonded Turntrans-93.9-19.4178.100000114.8S28S28-A30 PolarHBondContact O-N 3.28Å
31S49.3Very low50.5Low70 Ų70125.7 Ų125.749%0.4969%0.69SS.*Hα-helixtrans-85.6-25.8-178.178.90000113S28 Q33 Y34 R35S28-S31 PolarHBondContact O-N 2.9Å; S28-S31 VanDerWaalsContact O-N 3.08Å; S28-S31 PolarHBondContact O-OG 3.48Å; S31-Q33 VanDerWaalsContact C-N 3.35Å; S31-Q33 PolarHBondContact O-N 3.47Å; S31-Y34 PolarHBondContact O-N 2.99Å; S31-R35 PolarHBondContact O-N 3.47Å
32S51.3Low51.4Low66 Ų66122.7 Ų122.746%0.46268%0.677SS.*Hα-helixtrans-64.1-38.6178.2-45.10000112.2Y34 R35 Q36S32-Y34 VanDerWaalsContact C-N 3.34Å; S32-Y34 PolarHBondContact O-N 3.27Å; S32-R35 PolarHBondContact O-N 3.38Å; S32-Q36 WeakPolarHBondContact O-CG 3.49Å; S32-Q36 PolarHBondContact O-N 2.96Å
33Q53.3Low52.4Low130 Ų130121.5 Ų121.561%0.60767%0.672SS**Hα-helixtrans-65.8-36.5180-63.7-6291.200111.9S31 L37S31-Q33 VanDerWaalsContact C-N 3.35Å; S31-Q33 PolarHBondContact O-N 3.47Å; Q33-L37 WeakPolarHBondContact O-CG 3.43Å; Q33-L37 PolarHBondContact O-N 3.44Å
34Y50.1Low52.9Low178 Ų178118.8 Ų118.870%0.69867%0.67SS**Hα-helixtrans-77.2-32.8-179.3-135.4-90.5000112.7S31 S32 L38S31-Y34 PolarHBondContact O-N 2.99Å; S32-Y34 VanDerWaalsContact C-N 3.34Å; S32-Y34 PolarHBondContact O-N 3.27Å; Y34-L38 PolarHBondContact O-N 3.06Å
35R53.1Low54.1Low159 Ų159119.2 Ų119.260%0.667%0.673SS**Hα-helixtrans-69.3-33.7174.4-84.3-98.666.3141.5-0.8112.7S31 S32 S39S31-R35 PolarHBondContact O-N 3.47Å; S32-R35 PolarHBondContact O-N 3.38Å; R35-S39 WeakPolarHBondContact O-CB 3.33Å; R35-S39 PolarHBondContact O-N 2.91Å
36Q54.7Low54Low143 Ų143121.6 Ų121.667%0.66868%0.679SS**Hα-helixtrans-68.3-44.3174-73.5-70-72.500111.5S32 L38 S39S32-Q36 WeakPolarHBondContact O-CG 3.49Å; S32-Q36 PolarHBondContact O-N 2.96Å; Q36-L38 VanDerWaalsContact C-N 3.29Å; Q36-L38 PolarHBondContact O-N 2.94Å; Q36-S39 PolarHBondContact O-N 3.14Å
37L56Low54.1Low130 Ų130119.3 Ų119.368%0.68167%0.674SS**Hα-helixtrans-66.6-26.5-179.6-69.5172.4000114.1Q33Q33-L37 WeakPolarHBondContact O-CG 3.43Å; Q33-L37 PolarHBondContact O-N 3.44Å
38L55.8Low54.1Low104 Ų104120.9 Ų120.955%0.54567%0.665SS.*Hα-helixtrans-90.8-19.7177.3-170.659.5000113.4Y34 Q36 D40Y34-L38 PolarHBondContact O-N 3.06Å; Q36-L38 VanDerWaalsContact C-N 3.29Å; Q36-L38 PolarHBondContact O-N 2.94Å; L38-D40 VanDerWaalsContact C-N 3.29Å; L38-D40 PolarHBondContact O-N 2.76Å
39S55.7Low54.2Low79 Ų79123.9 Ų123.955%0.55268%0.681SS**Hα-helixtrans-75.9-16.2-178.9-111.60000113.9R35 Q36 Y41 G42R35-S39 WeakPolarHBondContact O-CB 3.33Å; R35-S39 PolarHBondContact O-N 2.91Å; Q36-S39 PolarHBondContact O-N 3.14Å; S39-Y41 VanDerWaalsContact C-N 3.29Å; S39-Y41 PolarHBondContact O-N 2.87Å; S39-G42 PolarHBondContact O-N 3.04Å
40D55.7Low53.9Low146 Ų146124 Ų12478%0.78168%0.679SS**THydrogen-bonded Turntrans-76.6-16.1-178.8-147.9-111.2000113.1L38 G42L38-D40 VanDerWaalsContact C-N 3.29Å; L38-D40 PolarHBondContact O-N 2.76Å; D40-G42 VanDerWaalsContact C-N 3.26Å; D40-G42 PolarHBondContact O-N 3.23Å
41Y56.9Low53.4Low203 Ų203122.7 Ų122.780%0.79667%0.674SS**THydrogen-bonded Turntrans-92.231.1172.2-70.3-85.8000112.7S39S39-Y41 VanDerWaalsContact C-N 3.29Å; S39-Y41 PolarHBondContact O-N 2.87Å
42G63.7Low53.3Low48 Ų48126.3 Ų126.350%0.49569%0.693SS.*  trans-58.2138.316700000110S39 D40S39-G42 PolarHBondContact O-N 3.04Å; D40-G42 VanDerWaalsContact C-N 3.26Å; D40-G42 PolarHBondContact O-N 3.23Å
43P59.3Low52.7Low113 Ų113125.2 Ų125.273%0.73469%0.692SS**  trans-56.6137.3-176.623.3-32.9000109.8S45P43-S45 PolarHBondContact O-N 3.23Å
44P59.8Low52.2Low122 Ų122126.8 Ų126.879%0.79271%0.705SS**  trans-58.4114174.725.1-31.2000106.9L46P44-L46 PolarHBondContact O-N 3.44Å
45S62.1Low52Low118 Ų118123.3 Ų123.383%0.82571%0.707SS**  trans-57.5126.3170.5-67.60000106.7P43 G47P43-S45 PolarHBondContact O-N 3.23Å; S45-G47 PolarHBondContact O-N 3.27Å
46L54.5Low51.7Low153 Ų153121.9 Ų121.980%0.80171%0.707SS**  trans-68.861.8-175.5-145.881.2000110.4P44 Y48P44-L46 PolarHBondContact O-N 3.44Å; L46-Y48 HydrophobicContact CD2-CD1 4.28Å; L46-Y48 HydrophobicContact CD2-CE1 3.87Å; L46-Y48 HydrophobicContact CG-CD1 4.06Å; L46-Y48 HydrophobicContact CG-CE1 4.13Å; L46-Y48 PolarHBondContact O-N 3.38Å
47G49.1Very low51.6Low66 Ų66118.9 Ų118.968%0.6870%0.698SS**  trans-89.570.7175.500000109.6S45 T49S45-G47 PolarHBondContact O-N 3.27Å; G47-T49 VanDerWaalsContact C-N 3.35Å; G47-T49 PolarHBondContact O-N 3.21Å; G47-T49 VanDerWaalsContact O-N 3.13Å
48Y48Very low51.7Low173 Ų173114.4 Ų114.468%0.67868%0.677SS**  trans-78.890.7165.953.8-84.8000108.4L46 Q50L46-Y48 HydrophobicContact CD2-CD1 4.28Å; L46-Y48 HydrophobicContact CD2-CE1 3.87Å; L46-Y48 HydrophobicContact CG-CD1 4.06Å; L46-Y48 HydrophobicContact CG-CE1 4.13Å; L46-Y48 PolarHBondContact O-N 3.38Å; Y48-Q50 PolarHBondContact O-N 3.31Å
49T46.1Very low52Low135 Ų135115.4 Ų115.483%0.82868%0.679SS**  trans-67.4113.3151.748.50000106.9G47 G51G47-T49 VanDerWaalsContact C-N 3.35Å; G47-T49 PolarHBondContact O-N 3.21Å; G47-T49 VanDerWaalsContact O-N 3.13Å; T49-G51 VanDerWaalsContact C-N 3.33Å; T49-G51 PolarHBondContact O-N 3.47Å
50Q47.2Very low53.3Low185 Ų185115.3 Ų115.386%0.86468%0.678SS**  trans-6289.2178-176.4164.94500110.2Y48Y48-Q50 PolarHBondContact O-N 3.31Å
51G39.9Very low54.8Low56 Ų56110 Ų11058%0.57765%0.648SS**  trans-83.4108.8167.400000109.7T49 G53T49-G51 VanDerWaalsContact C-N 3.33Å; T49-G51 PolarHBondContact O-N 3.47Å; G51-G53 PolarHBondContact O-N 3.38Å
52T46.8Very low56.4Low145 Ų145107.2 Ų107.289%0.8964%0.637SS**  trans-50.1112.9166.941.10000111.8
53G39.2Very low57.8Low43 Ų43107.4 Ų107.444%0.44363%0.634SS.*  trans-164.5111.2170.200000109.6G51 S55G51-G53 PolarHBondContact O-N 3.38Å; G53-S55 PolarHBondContact O-N 3.47Å
54N42.4Very low59.5Low164 Ų164106.1 Ų106.188%0.87762%0.618SS**SBendtrans-69.146.2-172.3-72.95.9000114.4
55S45.4Very low61.3Low105 Ų105102 Ų10273%0.73459%0.589SS**  trans-142.532.6171.8-590000110.8G53 V57G53-S55 PolarHBondContact O-N 3.47Å; S55-V57 PolarHBondContact O-N 3.45Å
56Q47.7Very low62.9Low129 Ų129100.3 Ų100.360%0.60357%0.57SS**  trans-71.397.8166.6-68.5-172.4-54.900107.4P58Q56-P58 VanDerWaalsContact O-N 3.12Å
57V52.2Low64.9Low79 Ų7995.7 Ų95.748%0.47955%0.554SS.*  trans-43.7122.8141.7-179.20000104.3S55 Q59S55-V57 PolarHBondContact O-N 3.45Å; V57-Q59 PolarHBondContact O-N 3.47Å
58P57.6Low67.3Low37 Ų3793.4 Ų93.424%0.2453%0.526CS..  trans-50.2111.5-171.9-27.132.6000107.5Q56 S60 K61 E107Q56-P58 VanDerWaalsContact O-N 3.12Å; P58-S60 VanDerWaalsContact CB-OG 3.27Å; P58-S60 WeakPolarHBondContact CB-OG 3.49Å; P58-S60 CarbonylContact O-C 3.54Å; P58-S60 PolarHBondContact O-N 3.08Å; P58-K61 HydrophobicContact CB-CD 4.46Å; P58-K61 HydrophobicContact CB-CG 4.2Å; P58-K61 HydrophobicContact CG-CD 4.25Å; P58-K61 PolarHBondContact O-N 3.44Å; P58-E107 WeakPolarHBondContact CD-OE1 3.24Å; P58-E107 WeakPolarHBondContact CG-OE1 3.47Å
59Q63.1Low69.6Low124 Ų12489.6 Ų89.658%0.57952%0.517SS*.Hα-helixtrans-57.2-24.1-172.6-173.8166.7-2300110V57 A63V57-Q59 PolarHBondContact O-N 3.47Å; Q59-A63 WeakPolarHBondContact O-CB 3.5Å; Q59-A63 PolarHBondContact O-N 3.25Å
60S81.7Confident72.1Confident77 Ų7789 Ų8954%0.53850%0.504SS..Hα-helixtrans-54.6-49.5165.546.90000114.9P58 A63 E64P58-S60 VanDerWaalsContact CB-OG 3.27Å; P58-S60 WeakPolarHBondContact CB-OG 3.49Å; P58-S60 CarbonylContact O-C 3.54Å; P58-S60 PolarHBondContact O-N 3.08Å; S60-A63 PolarHBondContact O-N 3.17Å; S60-E64 VanDerWaalsContact O-CB 3.23Å; S60-E64 WeakPolarHBondContact O-CB 3.32Å; S60-E64 PolarHBondContact O-N 2.99Å
61K88.5Confident74.5Confident35 Ų3585 Ų8515%0.15249%0.486CS..Hα-helixtrans-66.4-39.8-179.1-71.5-176.6-180172.40112P58 L65 L100 E107P58-K61 HydrophobicContact CB-CD 4.46Å; P58-K61 HydrophobicContact CB-CG 4.2Å; P58-K61 HydrophobicContact CG-CD 4.25Å; P58-K61 PolarHBondContact O-N 3.44Å; K61-L65 WeakPolarHBondContact O-CB 3.48Å; K61-L65 PolarHBondContact O-N 2.8Å; K61-L100 HydrophobicContact CB-CD1 4.33Å; K61-L100 HydrophobicContact CG-CD1 4.17Å; K61-L100 WeakPolarHBondContact O-CD2 3.28Å; K61-E107 IonicContact NZ-OE1 3.45Å; K61-E107 PolarHBondContact NZ-OE1 3.37Å; K61-E107 IonicContact NZ-OE2 3.53Å; K61-E107 PolarHBondContact NZ-OE2 3.48Å; K61-E107 VanDerWaalsContact NZ-OE2 3.16Å
62Y90.5Very high77.3Confident144 Ų14483.7 Ų83.757%0.56547%0.466SS*.Hα-helixtrans-68.1-44.4175.1-179.8-105.1000111.6E64 L65 L66Y62-E64 VanDerWaalsContact C-N 3.33Å; Y62-E64 PolarHBondContact O-N 3.42Å; Y62-L65 PolarHBondContact O-N 3.01Å; Y62-L66 HydrophobicContact CD1-CD1 3.96Å; Y62-L66 HydrophobicContact CD1-CG 4.41Å; Y62-L66 HydrophobicContact CE1-CD1 3.43Å; Y62-L66 VanDerWaalsContact CE1-CD1 3.43Å; Y62-L66 HydrophobicContact CE1-CG 4.03Å; Y62-L66 HydrophobicContact CE2-CG 4.5Å; Y62-L66 WeakPolarHBondContact O-CG 3.46Å; Y62-L66 PolarHBondContact O-N 3.28Å
63A92.6Very high79.8Confident52 Ų5279.1 Ų79.143%0.4345%0.447SS..Hα-helixtrans-61.2-40.6175.400000112.3Q59 S60 L66 A67Q59-A63 WeakPolarHBondContact O-CB 3.5Å; Q59-A63 PolarHBondContact O-N 3.25Å; S60-A63 PolarHBondContact O-N 3.17Å; A63-L66 PolarHBondContact O-N 3.47Å; A63-A67 PolarHBondContact O-N 2.99Å
64E95.3Very high82.6Confident86 Ų8682.2 Ų82.240%0.40245%0.448SS..Hα-helixtrans-63.7-42.5175.3-177.6171.5-167.100111.6S60 Y62 L66 A67 I68 H96 L100S60-E64 VanDerWaalsContact O-CB 3.23Å; S60-E64 WeakPolarHBondContact O-CB 3.32Å; S60-E64 PolarHBondContact O-N 2.99Å; Y62-E64 VanDerWaalsContact C-N 3.33Å; Y62-E64 PolarHBondContact O-N 3.42Å; E64-L66 VanDerWaalsContact C-N 3.34Å; E64-L66 PolarHBondContact O-N 3.16Å; E64-A67 PolarHBondContact O-N 3.13Å; E64-I68 HydrophobicContact CG-CD1 4.2Å; E64-I68 VanDerWaalsContact O-CG1 3.31Å; E64-I68 WeakPolarHBondContact O-CG1 3.39Å; E64-I68 PolarHBondContact O-N 3.05Å; E64-H96 IonicContact OE1-CE1 2.69Å; E64-H96 PolarHBondContact OE1-CE1 2.9Å; E64-H96 IonicContact OE1-NE2 3.16Å; E64-L100 HydrophobicContact CB-CD2 4.08Å; E64-L100 HydrophobicContact CG-CD2 3.92Å
65L96.8Very high85.3Confident35 Ų3576.1 Ų76.118%0.18342%0.415CS..Hα-helixtrans-61.2-43.5175.5-174.161.6000111.8K61 Y62 A67 I68 I69 A97 L100 V101K61-L65 WeakPolarHBondContact O-CB 3.48Å; K61-L65 PolarHBondContact O-N 2.8Å; Y62-L65 PolarHBondContact O-N 3.01Å; L65-A67 VanDerWaalsContact C-N 3.33Å; L65-A67 PolarHBondContact O-N 3.48Å; L65-I68 PolarHBondContact O-N 3.48Å; L65-I69 HydrophobicContact CD1-CD1 4.46Å; L65-I69 HydrophobicContact CG-CD1 4.05Å; L65-I69 VanDerWaalsContact O-CG1 3.29Å; L65-I69 WeakPolarHBondContact O-CG1 3.45Å; L65-I69 PolarHBondContact O-N 2.92Å; L65-A97 HydrophobicContact CD1-CB 3.76Å; L65-L100 HydrophobicContact CB-CD2 3.83Å; L65-L100 HydrophobicContact CD1-CD2 4.3Å; L65-V101 HydrophobicContact CD1-CG2 4.1Å; L65-V101 HydrophobicContact CD2-CG2 3.89Å
66L96.6Very high87.8Confident83 Ų8374.5 Ų74.544%0.43540%0.397SS..Hα-helixtrans-60.5-43.1175.6-70.8179.6000111.7Y62 A63 E64 I68 I69 E70Y62-L66 HydrophobicContact CD1-CD1 3.96Å; Y62-L66 HydrophobicContact CD1-CG 4.41Å; Y62-L66 HydrophobicContact CE1-CD1 3.43Å; Y62-L66 VanDerWaalsContact CE1-CD1 3.43Å; Y62-L66 HydrophobicContact CE1-CG 4.03Å; Y62-L66 HydrophobicContact CE2-CG 4.5Å; Y62-L66 WeakPolarHBondContact O-CG 3.46Å; Y62-L66 PolarHBondContact O-N 3.28Å; A63-L66 PolarHBondContact O-N 3.47Å; E64-L66 VanDerWaalsContact C-N 3.34Å; E64-L66 PolarHBondContact O-N 3.16Å; L66-I68 PolarHBondContact O-N 3.34Å; L66-I69 PolarHBondContact O-N 3.21Å; L66-E70 PolarHBondContact O-N 2.69Å
67A97.2Very high90.2Very high56 Ų5678.7 Ų78.746%0.46341%0.407SS..Hα-helixtrans-61.8-43.3176.500000111.8A63 E64 L65 I69 E70 E71A63-A67 PolarHBondContact O-N 2.99Å; E64-A67 PolarHBondContact O-N 3.13Å; L65-A67 VanDerWaalsContact C-N 3.33Å; L65-A67 PolarHBondContact O-N 3.48Å; A67-I69 VanDerWaalsContact C-N 3.33Å; A67-I69 PolarHBondContact O-N 3.13Å; A67-E70 PolarHBondContact O-N 3.28Å; A67-E71 WeakPolarHBondContact O-CG 3.43Å; A67-E71 PolarHBondContact O-N 3.28Å
68I97.9Very high92.4Very high18 Ų1877.2 Ų77.29%0.09240%0.4CS..Hα-helixtrans-61.1-43.9175.9-64.1161.6000110.7E64 L65 L66 E70 E71 L72 G93 H96 A97 L100E64-I68 HydrophobicContact CG-CD1 4.2Å; E64-I68 VanDerWaalsContact O-CG1 3.31Å; E64-I68 WeakPolarHBondContact O-CG1 3.39Å; E64-I68 PolarHBondContact O-N 3.05Å; L65-I68 PolarHBondContact O-N 3.48Å; L66-I68 PolarHBondContact O-N 3.34Å; I68-E70 VanDerWaalsContact C-N 3.35Å; I68-E70 PolarHBondContact O-N 3.25Å; I68-E71 PolarHBondContact O-N 2.76Å; I68-L72 HydrophobicContact CG2-CD1 3.99Å; I68-L72 HydrophobicContact CG2-CG 4.22Å; I68-L72 WeakPolarHBondContact O-CB 3.39Å; I68-L72 VanDerWaalsContact O-CG 3.24Å; I68-L72 WeakPolarHBondContact O-CG 3.36Å; I68-L72 PolarHBondContact O-N 3.25Å; I68-G93 WeakPolarHBondContact CG2-O 3.31Å; I68-H96 HydrophobicContact CD1-CB 4.46Å; I68-H96 VanDerWaalsContact CD1-ND1 3.34Å; I68-H96 WeakPolarHBondContact CD1-ND1 3.38Å; I68-A97 HydrophobicContact CG2-CB 3.93Å; I68-L100 HydrophobicContact CD1-CD2 4Å
69I97.9Very high94.4Very high93 Ų9376.6 Ų76.648%0.47740%0.395SS..Hα-helixtrans-62.4-42.5179-68.9165.1000111.1L65 L66 A67 L72 G73L65-I69 HydrophobicContact CD1-CD1 4.46Å; L65-I69 HydrophobicContact CG-CD1 4.05Å; L65-I69 VanDerWaalsContact O-CG1 3.29Å; L65-I69 WeakPolarHBondContact O-CG1 3.45Å; L65-I69 PolarHBondContact O-N 2.92Å; L66-I69 PolarHBondContact O-N 3.21Å; A67-I69 VanDerWaalsContact C-N 3.33Å; A67-I69 PolarHBondContact O-N 3.13Å; I69-L72 PolarHBondContact O-N 3.34Å; I69-G73 PolarHBondContact O-N 3.47Å; I69-G73 VanDerWaalsContact O-N 3.09Å
70E97.9Very high96.1Very high122 Ų12280.3 Ų80.357%0.5741%0.405SS*.Hα-helixtrans-61-46.3176.9-166.9-171.396.100111.5L66 A67 I68 G73 K74L66-E70 PolarHBondContact O-N 2.69Å; A67-E70 PolarHBondContact O-N 3.28Å; I68-E70 VanDerWaalsContact C-N 3.35Å; I68-E70 PolarHBondContact O-N 3.25Å; E70-G73 PolarHBondContact O-N 3.03Å; E70-K74 PolarHBondContact O-N 3.3Å; E70-K74 IonicContact OE1-NZ 3.7Å; E70-K74 PolarHBondContact OE1-NZ 3.47Å
71E98.1Very high96.9Very high101 Ų10180.9 Ų80.947%0.47242%0.415SS..Hα-helixtrans-63.5-41.5177.4-71.5-64.5101.800112A67 I68 G73 K74 E75A67-E71 WeakPolarHBondContact O-CG 3.43Å; A67-E71 PolarHBondContact O-N 3.28Å; I68-E71 PolarHBondContact O-N 2.76Å; E71-G73 VanDerWaalsContact C-N 3.25Å; E71-G73 PolarHBondContact O-N 2.99Å; E71-K74 WeakPolarHBondContact O-CB 3.26Å; E71-K74 PolarHBondContact O-N 3.39Å; E71-K74 VanDerWaalsContact O-N 3.11Å; E71-K74 WeakPolarHBondContact OE1-CD 3.35Å; E71-K74 WeakPolarHBondContact OE1-CE 3.35Å; E71-K74 IonicContact OE1-NZ 3.93Å; E71-K74 PolarHBondContact OE1-NZ 3.03Å; E71-E75 PolarHBondContact O-N 2.96Å
72L98.6Very high97.3Very high29 Ų2981.9 Ų81.915%0.15244%0.435CS..Hα-helixtrans-58-39.8175.3-74.2174.7000111.7I68 I69 K74 E75 I76 L90 I94I68-L72 HydrophobicContact CG2-CD1 3.99Å; I68-L72 HydrophobicContact CG2-CG 4.22Å; I68-L72 WeakPolarHBondContact O-CB 3.39Å; I68-L72 VanDerWaalsContact O-CG 3.24Å; I68-L72 WeakPolarHBondContact O-CG 3.36Å; I68-L72 PolarHBondContact O-N 3.25Å; I69-L72 PolarHBondContact O-N 3.34Å; L72-K74 VanDerWaalsContact C-N 3.29Å; L72-K74 PolarHBondContact O-N 3.31Å; L72-E75 PolarHBondContact O-N 3.28Å; L72-I76 WeakPolarHBondContact O-CG1 3.46Å; L72-I76 PolarHBondContact O-N 3.19Å; L72-L90 HydrophobicContact CB-CD1 4.3Å; L72-L90 HydrophobicContact CD2-CD1 3.67Å; L72-L90 HydrophobicContact CD2-CG 4.31Å; L72-L90 WeakPolarHBondContact CD2-O 3.44Å; L72-L90 WeakPolarHBondContact O-CD1 3.24Å; L72-I94 HydrophobicContact CD1-CG1 4.17Å; L72-I94 HydrophobicContact CD2-CG1 4.05Å
73G98.4Very high97.7Very high49 Ų4976.9 Ų76.951%0.50542%0.421SS..Hα-helixtrans-59.9-36.6176.700000113.5I69 E70 E71 E75I69-G73 PolarHBondContact O-N 3.47Å; I69-G73 VanDerWaalsContact O-N 3.09Å; E70-G73 PolarHBondContact O-N 3.03Å; E71-G73 VanDerWaalsContact C-N 3.25Å; E71-G73 PolarHBondContact O-N 2.99Å; G73-E75 VanDerWaalsContact C-N 3.32Å; G73-E75 PolarHBondContact O-N 3.1Å
74K98.4Very high98Very high108 Ų10883 Ų8347%0.4744%0.438SS..Hα-helixtrans-67.6-32.7177.8-63170.5-168.21620111.8E70 E71 L72 P78E70-K74 PolarHBondContact O-N 3.3Å; E70-K74 IonicContact OE1-NZ 3.7Å; E70-K74 PolarHBondContact OE1-NZ 3.47Å; E71-K74 WeakPolarHBondContact O-CB 3.26Å; E71-K74 PolarHBondContact O-N 3.39Å; E71-K74 VanDerWaalsContact O-N 3.11Å; E71-K74 WeakPolarHBondContact OE1-CD 3.35Å; E71-K74 WeakPolarHBondContact OE1-CE 3.35Å; E71-K74 IonicContact OE1-NZ 3.93Å; E71-K74 PolarHBondContact OE1-NZ 3.03Å; L72-K74 VanDerWaalsContact C-N 3.29Å; L72-K74 PolarHBondContact O-N 3.31Å; K74-P78 VanDerWaalsContact O-CD 3.24Å; K74-P78 WeakPolarHBondContact O-CD 3.21Å
75E98.6Very high98.2Very high36 Ų3681.5 Ų81.517%0.16844%0.437CS..Hα-helixtrans-82-13-177-61.4-58.494.300114.4E71 L72 G73 P78 T79 A86 R89 L90E71-E75 PolarHBondContact O-N 2.96Å; L72-E75 PolarHBondContact O-N 3.28Å; G73-E75 VanDerWaalsContact C-N 3.32Å; G73-E75 PolarHBondContact O-N 3.1Å; E75-P78 WeakPolarHBondContact O-CD 3.23Å; E75-T79 VanDerWaalsContact O-CB 3.28Å; E75-T79 WeakPolarHBondContact O-CB 3.27Å; E75-T79 PolarHBondContact O-N 3.32Å; E75-T79 PolarHBondContact O-OG1 2.96Å; E75-A86 WeakPolarHBondContact OE2-CA 3.5Å; E75-A86 WeakPolarHBondContact OE2-CB 3.5Å; E75-R89 HydrophobicContact CG-CB 4.04Å; E75-R89 WeakPolarHBondContact OE2-CB 3.29Å; E75-R89 WeakPolarHBondContact OE2-CD 3.5Å; E75-R89 IonicContact OE2-NH1 2.8Å; E75-L90 HydrophobicContact CB-CB 4.28Å; E75-L90 HydrophobicContact CB-CD1 4.03Å
76I98.5Very high98.2Very high71 Ų7180 Ų8036%0.36443%0.429SS..Hα-helixtrans-60.9-56.3-176.8-64.2-61.4000112.1L72 T79 Y80 L90L72-I76 WeakPolarHBondContact O-CG1 3.46Å; L72-I76 PolarHBondContact O-N 3.19Å; I76-T79 WeakPolarHBondContact O-CB 3.21Å; I76-T79 PolarHBondContact O-N 3.16Å; I76-Y80 HydrophobicContact CG2-CD2 3.76Å; I76-Y80 HydrophobicContact CG2-CE2 3.63Å; I76-Y80 VanDerWaalsContact O-CD2 3.26Å; I76-Y80 WeakPolarHBondContact O-CD2 3.26Å; I76-Y80 PolarHBondContact O-N 3.26Å; I76-Y80 VanDerWaalsContact O-N 3.1Å; I76-L90 HydrophobicContact CD1-CD1 3.7Å; I76-L90 HydrophobicContact CD1-CD2 4.18Å
77R98.6Very high98.3Very high217 Ų21779.7 Ų79.782%0.81943%0.427SS*.Hα-helixtrans-61.6-48.1-176.9-72.3179.3177-87.20.6112.3T79 Y80 A81R77-T79 VanDerWaalsContact C-N 3.26Å; R77-T79 PolarHBondContact O-N 2.69Å; R77-Y80 PolarHBondContact O-N 2.98Å; R77-A81 PolarHBondContact O-N 3.48Å
78P98.4Very high98.4Very high49 Ų4981.7 Ų81.732%0.31843%0.426SS..Hα-helixtrans-60.8-33.3175.8-24.734.9000113.7K74 E75 A81 G82 S83 A86K74-P78 VanDerWaalsContact O-CD 3.24Å; K74-P78 WeakPolarHBondContact O-CD 3.21Å; E75-P78 WeakPolarHBondContact O-CD 3.23Å; P78-A81 CarbonylContact O-C 3.59Å; P78-A81 PolarHBondContact O-N 3Å; P78-G82 PolarHBondContact O-N 3.49Å; P78-S83 WeakPolarHBondContact O-CB 3.22Å; P78-S83 PolarHBondContact O-N 2.99Å; P78-A86 HydrophobicContact CB-CB 3.69Å
79T98.7Very high98.4Very high23 Ų2387.3 Ų87.314%0.14145%0.446CS..Hα-helixtrans-65.4-45.3176.3-62.10000111.5E75 I76 R77 A81 G82 M87 L90E75-T79 VanDerWaalsContact O-CB 3.28Å; E75-T79 WeakPolarHBondContact O-CB 3.27Å; E75-T79 PolarHBondContact O-N 3.32Å; E75-T79 PolarHBondContact O-OG1 2.96Å; I76-T79 WeakPolarHBondContact O-CB 3.21Å; I76-T79 PolarHBondContact O-N 3.16Å; R77-T79 VanDerWaalsContact C-N 3.26Å; R77-T79 PolarHBondContact O-N 2.69Å; T79-A81 PolarHBondContact O-N 3.23Å; T79-G82 PolarHBondContact O-N 3.35Å; T79-M87 HydrophobicContact CG2-CB 4.12Å; T79-M87 HydrophobicContact CG2-CE 4.17Å; T79-M87 PolarHBondContact OG1-N 3.45Å; T79-L90 HydrophobicContact CG2-CD2 4.13Å
80Y98.5Very high98.5Very high202 Ų20284.2 Ų84.279%0.79243%0.431SS*.Hα-helixtrans-65.8-27.7174.8-77.8-68.2000113I76 R77 G82I76-Y80 HydrophobicContact CG2-CD2 3.76Å; I76-Y80 HydrophobicContact CG2-CE2 3.63Å; I76-Y80 VanDerWaalsContact O-CD2 3.26Å; I76-Y80 WeakPolarHBondContact O-CD2 3.26Å; I76-Y80 PolarHBondContact O-N 3.26Å; I76-Y80 VanDerWaalsContact O-N 3.1Å; R77-Y80 PolarHBondContact O-N 2.98Å; Y80-G82 PolarHBondContact O-N 3.45Å
81A98.5Very high98.5Very high90 Ų9084.1 Ų84.174%0.74443%0.428SS*.THydrogen-bonded Turntrans-752.7170.600000113.8R77 P78 T79R77-A81 PolarHBondContact O-N 3.48Å; P78-A81 CarbonylContact O-C 3.59Å; P78-A81 PolarHBondContact O-N 3Å; T79-A81 PolarHBondContact O-N 3.23Å
82G98.3Very high98.5Very high56 Ų5685.8 Ų85.858%0.57743%0.431SS*.THydrogen-bonded Turntrans87.413.2176.100000115.2P78 T79 Y80 K84P78-G82 PolarHBondContact O-N 3.49Å; T79-G82 PolarHBondContact O-N 3.35Å; Y80-G82 PolarHBondContact O-N 3.45Å; G82-K84 PolarHBondContact O-N 3.45Å
83S98.6Very high98.5Very high39 Ų3985.1 Ų85.127%0.27343%0.431SS..  trans-68.6114.3177.1179.40000111.5P78 S85 A86 M87P78-S83 WeakPolarHBondContact O-CB 3.22Å; P78-S83 PolarHBondContact O-N 2.99Å; S83-S85 PolarHBondContact OG-OG 3.25Å; S83-A86 PolarHBondContact O-N 3.3Å; S83-A86 PolarHBondContact OG-N 2.99Å; S83-M87 WeakPolarHBondContact O-CB 3.26Å; S83-M87 PolarHBondContact O-N 2.76Å
84K98.6Very high98.5Very high180 Ų18087.2 Ų87.278%0.78343%0.429SS*.Hα-helixtrans-63.9-41.4177.4-66.6-176.6-179.2177.40112.3G82 M87 E88G82-K84 PolarHBondContact O-N 3.45Å; K84-M87 WeakPolarHBondContact O-CB 3.33Å; K84-M87 PolarHBondContact O-N 2.94Å; K84-E88 PolarHBondContact O-N 3.46Å
85S98.5Very high98.5Very high55 Ų5587.1 Ų87.139%0.38543%0.433SS..Hα-helixtrans-67.5-38.9-179.5640000111.5S83 E88 R89S83-S85 PolarHBondContact OG-OG 3.25Å; S85-E88 PolarHBondContact O-N 3.41Å; S85-R89 WeakPolarHBondContact O-CG 3.48Å; S85-R89 PolarHBondContact O-N 3.46Å; S85-R89 PolarHBondContact OG-NH1 2.88Å
86A98.5Very high98.5Very high2 Ų289.7 Ų89.72%0.01745%0.445CS..Hα-helixtrans-67.4-40.9176.300000112.2E75 P78 S83 E88 R89 L90E75-A86 WeakPolarHBondContact OE2-CA 3.5Å; E75-A86 WeakPolarHBondContact OE2-CB 3.5Å; P78-A86 HydrophobicContact CB-CB 3.69Å; S83-A86 PolarHBondContact O-N 3.3Å; S83-A86 PolarHBondContact OG-N 2.99Å; A86-E88 VanDerWaalsContact C-N 3.28Å; A86-E88 PolarHBondContact O-N 2.82Å; A86-R89 PolarHBondContact O-N 3.38Å; A86-L90 WeakPolarHBondContact O-CB 3.49Å; A86-L90 PolarHBondContact O-N 2.95Å
87M98.5Very high98.5Very high78 Ų7887 Ų8738%0.38443%0.433SS..Hα-helixtrans-57.1-42.8172.9177.9176.3-68.100112T79 S83 K84 L90 K91T79-M87 HydrophobicContact CG2-CB 4.12Å; T79-M87 HydrophobicContact CG2-CE 4.17Å; T79-M87 PolarHBondContact OG1-N 3.45Å; S83-M87 WeakPolarHBondContact O-CB 3.26Å; S83-M87 PolarHBondContact O-N 2.76Å; K84-M87 WeakPolarHBondContact O-CB 3.33Å; K84-M87 PolarHBondContact O-N 2.94Å; M87-L90 PolarHBondContact O-N 3.03Å; M87-K91 HydrophobicContact CG-CD 4.3Å; M87-K91 WeakPolarHBondContact O-CG 3.47Å; M87-K91 PolarHBondContact O-N 3.43Å
88E98.7Very high98.5Very high97 Ų9783.6 Ų83.645%0.45342%0.42SS..Hα-helixtrans-66.3-41.9177.2-76.4-160.478.800112.6K84 S85 A86 L90 K91 R92K84-E88 PolarHBondContact O-N 3.46Å; S85-E88 PolarHBondContact O-N 3.41Å; A86-E88 VanDerWaalsContact C-N 3.28Å; A86-E88 PolarHBondContact O-N 2.82Å; E88-L90 VanDerWaalsContact C-N 3.32Å; E88-K91 PolarHBondContact O-N 3.3Å; E88-R92 WeakPolarHBondContact O-CB 3.42Å; E88-R92 WeakPolarHBondContact O-CG 3.4Å; E88-R92 PolarHBondContact O-N 2.94Å; E88-R92 IonicContact OE1-CZ 3.39Å; E88-R92 IonicContact OE1-NH1 3.9Å; E88-R92 PolarHBondContact OE1-NH1 2.97Å; E88-R92 IonicContact OE1-NH2 2.68Å; E88-R92 PolarHBondContact OE1-NH2 3.22Å; E88-R92 IonicContact OE2-NH2 2.82Å
89R98.7Very high98.4Very high136 Ų13682.6 Ų82.651%0.51342%0.418SS..Hα-helixtrans-61-43.5174.7-70.9-171.3-171.390.60111.3E75 S85 A86 K91 R92 G93E75-R89 HydrophobicContact CG-CB 4.04Å; E75-R89 WeakPolarHBondContact OE2-CB 3.29Å; E75-R89 WeakPolarHBondContact OE2-CD 3.5Å; E75-R89 IonicContact OE2-NH1 2.8Å; S85-R89 WeakPolarHBondContact O-CG 3.48Å; S85-R89 PolarHBondContact O-N 3.46Å; S85-R89 PolarHBondContact OG-NH1 2.88Å; A86-R89 PolarHBondContact O-N 3.38Å; R89-K91 PolarHBondContact O-N 3.1Å; R89-R92 PolarHBondContact O-N 3.02Å; R89-G93 PolarHBondContact O-N 3.45Å
90L98.6Very high98.2Very high28 Ų2881.8 Ų81.815%0.14741%0.413CS..Hα-helixtrans-59.1-48.5176.6-167.474.5000111.4L72 E75 I76 T79 A86 M87 E88 R92 G93 I94L72-L90 HydrophobicContact CB-CD1 4.3Å; L72-L90 HydrophobicContact CD2-CD1 3.67Å; L72-L90 HydrophobicContact CD2-CG 4.31Å; L72-L90 WeakPolarHBondContact CD2-O 3.44Å; L72-L90 WeakPolarHBondContact O-CD1 3.24Å; E75-L90 HydrophobicContact CB-CB 4.28Å; E75-L90 HydrophobicContact CB-CD1 4.03Å; I76-L90 HydrophobicContact CD1-CD1 3.7Å; I76-L90 HydrophobicContact CD1-CD2 4.18Å; T79-L90 HydrophobicContact CG2-CD2 4.13Å; A86-L90 WeakPolarHBondContact O-CB 3.49Å; A86-L90 PolarHBondContact O-N 2.95Å; M87-L90 PolarHBondContact O-N 3.03Å; E88-L90 VanDerWaalsContact C-N 3.32Å; L90-R92 PolarHBondContact O-N 3.32Å; L90-G93 PolarHBondContact O-N 2.92Å; L90-I94 HydrophobicContact CG-CD1 4.17Å; L90-I94 WeakPolarHBondContact O-CD1 3.47Å; L90-I94 VanDerWaalsContact O-CG1 3.26Å; L90-I94 WeakPolarHBondContact O-CG1 3.46Å; L90-I94 PolarHBondContact O-N 3.19Å
91K98.6Very high98.1Very high120 Ų12075 Ų7552%0.52239%0.393SS..Hα-helixtrans-59.8-45.8176.1-73.2173.3-177.1175.10111.8M87 E88 R89 I94 I95M87-K91 HydrophobicContact CG-CD 4.3Å; M87-K91 WeakPolarHBondContact O-CG 3.47Å; M87-K91 PolarHBondContact O-N 3.43Å; E88-K91 PolarHBondContact O-N 3.3Å; R89-K91 PolarHBondContact O-N 3.1Å; K91-I94 PolarHBondContact O-N 3.49Å; K91-I95 WeakPolarHBondContact O-CD1 3.34Å; K91-I95 WeakPolarHBondContact O-CG1 3.45Å; K91-I95 PolarHBondContact O-N 3.31Å; K91-I95 VanDerWaalsContact O-N 3.1Å
92R98.5Very high98Very high137 Ų13778.1 Ų78.152%0.51739%0.385SS..Hα-helixtrans-62.5-46.2179.2-77.4-170.2-87.3-965.2111.7E88 R89 L90 I94 I95 H96E88-R92 WeakPolarHBondContact O-CB 3.42Å; E88-R92 WeakPolarHBondContact O-CG 3.4Å; E88-R92 PolarHBondContact O-N 2.94Å; E88-R92 IonicContact OE1-CZ 3.39Å; E88-R92 IonicContact OE1-NH1 3.9Å; E88-R92 PolarHBondContact OE1-NH1 2.97Å; E88-R92 IonicContact OE1-NH2 2.68Å; E88-R92 PolarHBondContact OE1-NH2 3.22Å; E88-R92 IonicContact OE2-NH2 2.82Å; R89-R92 PolarHBondContact O-N 3.02Å; L90-R92 PolarHBondContact O-N 3.32Å; R92-I94 PolarHBondContact O-N 3.35Å; R92-I95 PolarHBondContact O-N 3.22Å; R92-H96 WeakPolarHBondContact O-CB 3.34Å; R92-H96 PolarHBondContact O-N 3.09Å
93G98.3Very high97.8Very high15 Ų1580.7 Ų80.716%0.15538%0.382CS..Hα-helixtrans-63.5-38.8178.300000112.8I68 R89 L90 H96 A97I68-G93 WeakPolarHBondContact CG2-O 3.31Å; R89-G93 PolarHBondContact O-N 3.45Å; L90-G93 PolarHBondContact O-N 2.92Å; G93-H96 PolarHBondContact O-N 3.39Å; G93-A97 WeakPolarHBondContact O-CB 3.38Å; G93-A97 PolarHBondContact O-N 3.36Å
94I98.4Very high97.4Very high93 Ų9380 Ų8048%0.47738%0.377SS..Hα-helixtrans-63.9-44175.8-68.3165.1000111.1L72 L90 K91 R92 H96 R98L72-I94 HydrophobicContact CD1-CG1 4.17Å; L72-I94 HydrophobicContact CD2-CG1 4.05Å; L90-I94 HydrophobicContact CG-CD1 4.17Å; L90-I94 WeakPolarHBondContact O-CD1 3.47Å; L90-I94 VanDerWaalsContact O-CG1 3.26Å; L90-I94 WeakPolarHBondContact O-CG1 3.46Å; L90-I94 PolarHBondContact O-N 3.19Å; K91-I94 PolarHBondContact O-N 3.49Å; R92-I94 PolarHBondContact O-N 3.35Å; I94-H96 VanDerWaalsContact C-N 3.33Å; I94-R98 WeakPolarHBondContact O-CB 3.48Å; I94-R98 PolarHBondContact O-N 3.39Å
95I98.5Very high97.1Very high106 Ų10676.5 Ų76.554%0.54437%0.367SS..Hα-helixtrans-63.1-43.6177.2-68.1162.5000110.3K91 R92 R98 G99K91-I95 WeakPolarHBondContact O-CD1 3.34Å; K91-I95 WeakPolarHBondContact O-CG1 3.45Å; K91-I95 PolarHBondContact O-N 3.31Å; K91-I95 VanDerWaalsContact O-N 3.1Å; R92-I95 PolarHBondContact O-N 3.22Å; I95-R98 PolarHBondContact O-N 3.11Å; I95-G99 PolarHBondContact O-N 2.68Å
96H98.1Very high96.8Very high89 Ų8976 Ų7641%0.41237%0.366SS..Hα-helixtrans-62.9-51.9179.9-172.5-156.9000111.6E64 I68 R92 G93 I94 R98 G99 L100E64-H96 IonicContact OE1-CE1 2.69Å; E64-H96 PolarHBondContact OE1-CE1 2.9Å; E64-H96 IonicContact OE1-NE2 3.16Å; I68-H96 HydrophobicContact CD1-CB 4.46Å; I68-H96 VanDerWaalsContact CD1-ND1 3.34Å; I68-H96 WeakPolarHBondContact CD1-ND1 3.38Å; R92-H96 WeakPolarHBondContact O-CB 3.34Å; R92-H96 PolarHBondContact O-N 3.09Å; G93-H96 PolarHBondContact O-N 3.39Å; I94-H96 VanDerWaalsContact C-N 3.33Å; H96-R98 PolarHBondContact O-N 3.37Å; H96-G99 WeakPolarHBondContact O-CA 3.33Å; H96-G99 PolarHBondContact O-N 3.05Å; H96-L100 PolarHBondContact O-N 2.95Å
97A98.2Very high96.3Very high15 Ų1579.5 Ų79.512%0.12438%0.381CS..Hα-helixtrans-54.6-42.7175.600000111.6L65 I68 G93 G99 L100 V101L65-A97 HydrophobicContact CD1-CB 3.76Å; I68-A97 HydrophobicContact CG2-CB 3.93Å; G93-A97 WeakPolarHBondContact O-CB 3.38Å; G93-A97 PolarHBondContact O-N 3.36Å; A97-G99 PolarHBondContact O-N 3.35Å; A97-L100 PolarHBondContact O-N 3.49Å; A97-V101 VanDerWaalsContact O-CG2 3.26Å; A97-V101 WeakPolarHBondContact O-CG2 3.47Å; A97-V101 PolarHBondContact O-N 3.29Å
98R98Very high95.9Very high146 Ų14679.5 Ų79.555%0.55139%0.386SS*.Hα-helixtrans-64.3-39.1177.6-167.4-177.874.6179.22112.5I94 I95 H96 R102I94-R98 WeakPolarHBondContact O-CB 3.48Å; I94-R98 PolarHBondContact O-N 3.39Å; I95-R98 PolarHBondContact O-N 3.11Å; H96-R98 PolarHBondContact O-N 3.37Å; R98-R102 WeakPolarHBondContact O-CG 3.5Å; R98-R102 PolarHBondContact O-N 3.3Å
99G96.8Very high95.5Very high27 Ų2780.2 Ų80.228%0.27839%0.39SS..Hα-helixtrans-61.2-53174.100000111.2I95 H96 A97 V101 R102 E103I95-G99 PolarHBondContact O-N 2.68Å; H96-G99 WeakPolarHBondContact O-CA 3.33Å; H96-G99 PolarHBondContact O-N 3.05Å; A97-G99 PolarHBondContact O-N 3.35Å; G99-V101 VanDerWaalsContact C-N 3.32Å; G99-V101 PolarHBondContact O-N 3.37Å; G99-R102 WeakPolarHBondContact O-CB 3.36Å; G99-R102 PolarHBondContact O-N 3.37Å; G99-E103 PolarHBondContact O-N 3.26Å; G99-E103 VanDerWaalsContact O-N 3.1Å
100L95.8Very high95.1Very high6 Ų683 Ų833%0.03140%0.4CS..Hα-helixtrans-57.4-42.4-178.9-170.666.7000112.7K61 E64 L65 I68 H96 A97 R102 E103 C104K61-L100 HydrophobicContact CB-CD1 4.33Å; K61-L100 HydrophobicContact CG-CD1 4.17Å; K61-L100 WeakPolarHBondContact O-CD2 3.28Å; E64-L100 HydrophobicContact CB-CD2 4.08Å; E64-L100 HydrophobicContact CG-CD2 3.92Å; L65-L100 HydrophobicContact CB-CD2 3.83Å; L65-L100 HydrophobicContact CD1-CD2 4.3Å; I68-L100 HydrophobicContact CD1-CD2 4Å; H96-L100 PolarHBondContact O-N 2.95Å; A97-L100 PolarHBondContact O-N 3.49Å; L100-R102 PolarHBondContact O-N 3.1Å; L100-E103 PolarHBondContact O-N 2.69Å; L100-C104 PolarHBondContact O-N 3.46Å; L100-C104 PolarHBondContact O-SG 2.82Å
101V95.9Very high94.6Very high60 Ų6086 Ų8636%0.36442%0.416SS..Hα-helixtrans-63.6-39.8176.9170.60000111.7L65 A97 G99 E103 C104 L105L65-V101 HydrophobicContact CD1-CG2 4.1Å; L65-V101 HydrophobicContact CD2-CG2 3.89Å; A97-V101 VanDerWaalsContact O-CG2 3.26Å; A97-V101 WeakPolarHBondContact O-CG2 3.47Å; A97-V101 PolarHBondContact O-N 3.29Å; G99-V101 VanDerWaalsContact C-N 3.32Å; G99-V101 PolarHBondContact O-N 3.37Å; V101-E103 VanDerWaalsContact C-N 3.32Å; V101-E103 PolarHBondContact O-N 2.97Å; V101-C104 PolarHBondContact O-N 3.05Å; V101-L105 HydrophobicContact CG1-CD1 4.26Å; V101-L105 WeakPolarHBondContact O-CG 3.44Å; V101-L105 PolarHBondContact O-N 3.04Å
102R96Very high94Very high156 Ų15684.4 Ų84.459%0.58943%0.425SS*.Hα-helixtrans-63.3-40.9176.4-71.3171.1176.7-171.7-4.3111.4R98 G99 L100 L105 A106R98-R102 WeakPolarHBondContact O-CG 3.5Å; R98-R102 PolarHBondContact O-N 3.3Å; G99-R102 WeakPolarHBondContact O-CB 3.36Å; G99-R102 PolarHBondContact O-N 3.37Å; L100-R102 PolarHBondContact O-N 3.1Å; R102-L105 PolarHBondContact O-N 3.34Å; R102-A106 WeakPolarHBondContact O-CB 3.5Å; R102-A106 PolarHBondContact O-N 3.19Å
103E93.3Very high93.3Very high109 Ų10988 Ų8851%0.50944%0.439SS..Hα-helixtrans-64.9-40176-66.917982.900111.9G99 L100 V101 A106 E107G99-E103 PolarHBondContact O-N 3.26Å; G99-E103 VanDerWaalsContact O-N 3.1Å; L100-E103 PolarHBondContact O-N 2.69Å; V101-E103 VanDerWaalsContact C-N 3.32Å; V101-E103 PolarHBondContact O-N 2.97Å; E103-A106 PolarHBondContact O-N 2.83Å; E103-E107 WeakPolarHBondContact O-CB 3.4Å; E103-E107 PolarHBondContact O-N 2.93Å
104C91.8Very high91.6Very high24 Ų2494.4 Ų94.416%0.16248%0.481CS..Hα-helixtrans-63.1-42.4175.6-670000112.4L100 V101 E107 T108L100-C104 PolarHBondContact O-N 3.46Å; L100-C104 PolarHBondContact O-SG 2.82Å; V101-C104 PolarHBondContact O-N 3.05Å; C104-E107 PolarHBondContact O-N 2.98Å; C104-T108 WeakPolarHBondContact O-CB 3.16Å; C104-T108 PolarHBondContact O-N 3.45Å; C104-T108 PolarHBondContact O-OG1 3.4Å
105L92.4Very high91.2Very high108 Ų10894.5 Ų94.557%0.56548%0.482SS*.Hα-helixtrans-62.6-50177.1-71.8172.5000110.8V101 R102 E107 T108 E109V101-L105 HydrophobicContact CG1-CD1 4.26Å; V101-L105 WeakPolarHBondContact O-CG 3.44Å; V101-L105 PolarHBondContact O-N 3.04Å; R102-L105 PolarHBondContact O-N 3.34Å; L105-E107 VanDerWaalsContact C-N 3.3Å; L105-E107 PolarHBondContact O-N 3.25Å; L105-T108 WeakPolarHBondContact O-CB 3.35Å; L105-T108 PolarHBondContact O-N 3.34Å; L105-T108 VanDerWaalsContact O-N 3.16Å; L105-E109 WeakPolarHBondContact O-CG 3.33Å; L105-E109 PolarHBondContact O-N 2.97Å
106A91.3Very high90.9Very high44 Ų4493.9 Ų93.936%0.36448%0.478SS..Hα-helixtrans-61.6-37.4179.900000112.7R102 E103 R110R102-A106 WeakPolarHBondContact O-CB 3.5Å; R102-A106 PolarHBondContact O-N 3.19Å; E103-A106 PolarHBondContact O-N 2.83Å; A106-R110 WeakPolarHBondContact O-CG 3.43Å; A106-R110 PolarHBondContact O-N 2.84Å; A106-R110 VanDerWaalsContact O-N 3.13Å
107E88.8Confident90.5Very high75 Ų7594.2 Ų94.235%0.3548%0.482SS..Hα-helixtrans-67.5-41.4175.9-17316065.900111.9P58 K61 E103 C104 L105 E109 R110 N111P58-E107 WeakPolarHBondContact CD-OE1 3.24Å; P58-E107 WeakPolarHBondContact CG-OE1 3.47Å; K61-E107 IonicContact NZ-OE1 3.45Å; K61-E107 PolarHBondContact NZ-OE1 3.37Å; K61-E107 IonicContact NZ-OE2 3.53Å; K61-E107 PolarHBondContact NZ-OE2 3.48Å; K61-E107 VanDerWaalsContact NZ-OE2 3.16Å; E103-E107 WeakPolarHBondContact O-CB 3.4Å; E103-E107 PolarHBondContact O-N 2.93Å; C104-E107 PolarHBondContact O-N 2.98Å; L105-E107 VanDerWaalsContact C-N 3.3Å; L105-E107 PolarHBondContact O-N 3.25Å; E107-E109 VanDerWaalsContact C-N 3.34Å; E107-E109 PolarHBondContact O-N 3.05Å; E107-R110 PolarHBondContact O-N 3.31Å; E107-N111 WeakPolarHBondContact O-CB 3.41Å; E107-N111 PolarHBondContact O-N 3.03Å
108T89.1Confident90Very high78 Ų7898.8 Ų98.848%0.47950%0.503SS..Hα-helixtrans-62.3-42.4175.7-54.80000111.2C104 L105 R110 N111 A112C104-T108 WeakPolarHBondContact O-CB 3.16Å; C104-T108 PolarHBondContact O-N 3.45Å; C104-T108 PolarHBondContact O-OG1 3.4Å; L105-T108 WeakPolarHBondContact O-CB 3.35Å; L105-T108 PolarHBondContact O-N 3.34Å; L105-T108 VanDerWaalsContact O-N 3.16Å; T108-R110 VanDerWaalsContact C-N 3.33Å; T108-R110 PolarHBondContact O-N 3.06Å; T108-N111 PolarHBondContact O-N 3.19Å; T108-A112 WeakPolarHBondContact O-CB 3.13Å; T108-A112 PolarHBondContact O-N 3.45Å
109E90.2Very high89.5Confident113 Ų11395.9 Ų95.953%0.52850%0.5SS..Hα-helixtrans-63.2-36.8176.4-71.3-178.894.500112.9L105 E107 R113L105-E109 WeakPolarHBondContact O-CG 3.33Å; L105-E109 PolarHBondContact O-N 2.97Å; E107-E109 VanDerWaalsContact C-N 3.34Å; E107-E109 PolarHBondContact O-N 3.05Å; E109-R113 WeakPolarHBondContact O-CG 3.46Å; E109-R113 PolarHBondContact O-N 3.32Å
110R90.4Very high89Confident193 Ų193100.5 Ų100.573%0.72852%0.515SS*.Hα-helixtrans-68.2-43.7173.8-74.3-177.4-176.5-142.52.6111.6A106 E107 T108 A112 R113 S114A106-R110 WeakPolarHBondContact O-CG 3.43Å; A106-R110 PolarHBondContact O-N 2.84Å; A106-R110 VanDerWaalsContact O-N 3.13Å; E107-R110 PolarHBondContact O-N 3.31Å; T108-R110 VanDerWaalsContact C-N 3.33Å; T108-R110 PolarHBondContact O-N 3.06Å; R110-A112 VanDerWaalsContact C-N 3.27Å; R110-A112 PolarHBondContact O-N 3.35Å; R110-R113 PolarHBondContact O-N 3.44Å; R110-S114 PolarHBondContact O-N 3.45Å; R110-S114 VanDerWaalsContact O-N 3.14Å; R110-S114 PolarHBondContact O-OG 2.8Å
111N87.3Confident88.5Confident93 Ų93107.2 Ų107.250%0.49755%0.549SS..Hα-helixtrans-66.5-29.8-178.4-148.478.8000112.5E107 T108 R113E107-N111 WeakPolarHBondContact O-CB 3.41Å; E107-N111 PolarHBondContact O-N 3.03Å; T108-N111 PolarHBondContact O-N 3.19Å; N111-R113 VanDerWaalsContact C-N 3.31Å
112A86.3Confident88Confident86 Ų86110.8 Ų110.871%0.71156%0.564SS**THydrogen-bonded Turntrans-77.3-13.7173.700000114T108 R110T108-A112 WeakPolarHBondContact O-CB 3.13Å; T108-A112 PolarHBondContact O-N 3.45Å; R110-A112 VanDerWaalsContact C-N 3.27Å; R110-A112 PolarHBondContact O-N 3.35Å
113R84Confident87.3Confident213 Ų213107.1 Ų107.180%0.80456%0.562SS**THydrogen-bonded Turntrans-100.2-10.6176.7-71.1177.1-175.6-158.54.1113.2E109 R110 N111E109-R113 WeakPolarHBondContact O-CG 3.46Å; E109-R113 PolarHBondContact O-N 3.32Å; R110-R113 PolarHBondContact O-N 3.44Å; N111-R113 VanDerWaalsContact C-N 3.31Å
114S62.7Low86.7Confident149 Ų149106.9 Ų106.9100%1.04257%0.566SS**  trans-91.20176.9-53.20000109.9R110R110-S114 PolarHBondContact O-N 3.45Å; R110-S114 VanDerWaalsContact O-N 3.14Å; R110-S114 PolarHBondContact O-OG 2.8Å

Retrieved 114 of 114 residues in 17.8 ms (Link to these results)