Viewing 8DFR0.reduce3.noca-multi.table
| All-Atom Contacts |
Clashscore, all atoms: | 30.69 | 4th percentile* (N=819, 1.45Å - 1.95Å) |
| Clashscore is the number of serious steric overlaps (> 0.4 Å) per 1000 atoms. | |||
| Protein Geometry |
Rotamer outliers | 5.42% | Goal: <1% |
| Ramachandran outliers | 0.00% | Goal: <0.2% | |
| Ramachandran favored | 96.74% | Goal: >98% | |
| Cβ deviations >0.25Å | 15 | Goal: 0 | |
| MolProbity score | 2.73 | 8th percentile* (N=9248, 1.45Å - 1.95Å) | |
| Residues with bad bonds: | 0.54% | Goal: <5% | |
| Residues with bad angles: | 7.53% | Goal: <5% | |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 43.69 | Clashscore: 30.69 | Outliers: 0 of 184 | Outliers: 9 of 166 | Outliers: 15 of 176 | Outliers: 1 of 186 | Outliers: 14 of 186 | ||
| 1 | VAL | 68.81 | - | - | 1.4% (m) chi angles: 322.5 | 0.129Å | - | - |
| 2 | ARG | 100.55 | - | Favored (76.24%) General case / -70.3,-35.7 | 0.3% chi angles: 39.7,155.9,208.6,210.6 | 0.104Å | - | - |
| 3 | SER | 46.06 | - | Favored (26.65%) General case / -157.8,156.1 | 46.1% (p) chi angles: 76 | 0.074Å | - | - |
| 4 | LEU | 38.09 | - | Favored (29.74%) General case / -120.1,159.1 | 85.5% (mt) chi angles: 289.4,171.7 | 0.278Å | - | - |
| 5 | ASN | 26.68 | - | Favored (54.33%) General case / -130.3,141.2 | 62.7% (m-80) chi angles: 297.5,279 | 0.139Å | - | - |
| 6 | SER | 20.98 | - | Favored (51.32%) General case / -128.3,147.7 | 19.8% (m) chi angles: 284.5 | 0.268Å | - | 1 OUTLIER(S) worst is O-C-N: 4.315 σ |
| 7 | ILE | 24.66 | - | Favored (48.69%) General case / -134.4,137.8 | 21% (tt) chi angles: 187,168.9 | 0.099Å | - | - |
| 8 | VAL | 18.31 | - | Favored (32.49%) General case / -153.4,159.6 | 15% (p) chi angles: 63.5 | 0.181Å | - | 1 OUTLIER(S) worst is O-C-N: 4.026 σ |
| 9 | ALA | 19.13 | - | Favored (63.86%) General case / -121.6,130.7 | - | 0.159Å | - | - |
| 10 | VAL | 24.19 | 0.708Å HG21 with 14 MET HE1 | Favored (51.35%) General case / -130.2,156.4 | 28.5% (m) chi angles: 295.3 | 0.181Å | - | - |
| 11 | CYS | 28.25 | - | Allowed (1.74%) General case / -98.4,-169.1 | 18.1% (p) chi angles: 71.3 | 0.291Å | - | - |
| 12 | GLN | 56.9 | - | Favored (69.44%) General case / -65.5,-24.8 | 40.2% (mt-30) chi angles: 269,179.7,331.5 | 0.222Å | - | - |
| 13 | ASN | 52.82 | - | Favored (24.61%) General case / -91.2,10.0 | 0.2% chi angles: 26.8,269.3 | 0.062Å | - | - |
| 14 | MET | 49.87 | 0.942Å HE3 with 14 MET HA | Favored (7.92%) General case / 67.7,20.1 | 4.9% (mmm) chi angles: 298.8,303.9,341.6 | 0.228Å | - | - |
| 15 | GLY | 22.46 | - | Favored (29.93%) Glycine / -75.7,144.2 | - | - | - | - |
| 16 | ILE | 21.79 | 0.688Å O with 191 NDP NH2 | Favored (7.13%) General case / -120.9,-15.0 | 28.9% (pt) chi angles: 68.7,168 | 0.107Å | - | - |
| 17 | GLY | 19.87 | - | Favored (31.35%) Glycine / -157.2,161.4 | - | - | 1 OUTLIER(S) worst is CA--C: 4.054 σ | - |
| 18 | LYS | 50.36 | 0.599Å HE2 with 143 GLU CD | Favored (6.58%) General case / -151.9,122.6 | 36.6% (tptt) chi angles: 172,76.7,183.8,157.9 | 0.137Å | - | 1 OUTLIER(S) worst is O-C-N: 5.863 σ |
| 19 | ASP | 54.46 | - | Favored (24.35%) General case / 53.5,41.4 | 76.1% (m-20) chi angles: 297.9,145.8 | 0.132Å | - | - |
| 20 | GLY | 33.59 | - | Favored (85.39%) Glycine / 84.9,-2.4 | - | - | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 43.69 | Clashscore: 30.69 | Outliers: 0 of 184 | Outliers: 9 of 166 | Outliers: 15 of 176 | Outliers: 1 of 186 | Outliers: 14 of 186 | ||
| 21 | ASN | 66.14 | 0.585Å CG with 22 LEU H | Allowed (1.59%) General case / -135.6,-167.6 | 46.4% (t30) chi angles: 200.6,46.5 | 0.245Å | - | - |
| 22 | LEU | 31.58 | 0.585Å H with 21 ASN CG | Favored (69.67%) Pre-proline / -82.3,153.7 | 72.9% (mt) chi angles: 299.5,183.6 | 0.07Å | - | - |
| 23 | PRO | 27.59 | 0.442Å HD3 with 22 LEU HA | Favored (23.02%) Proline / -72.2,-25.5 | 19.5% (Cg_exo) chi angles: 344.9 | 0.101Å | - | - |
| 24 | TRP | 27.94 | - | Favored (35.73%) Pre-proline / -110.2,156.3 | 16.7% (p90) chi angles: 45.5,82.2 | 0.101Å | - | - |
| 25 | PRO | 27.81 | 0.507Å CB with 26 PRO HD2 | Favored (21.55%) Proline / -72.3,170.8 | 16.9% (Cg_exo) chi angles: 346 | 0.145Å | - | - |
| 26 | PRO | 32.56 | 0.507Å HD2 with 25 PRO CB | Favored (52.17%) Proline / -60.9,132.6 | 9.2% (Cg_endo) chi angles: 12.6 | 0.151Å | - | - |
| 27 | LEU | 30.91 | - | Favored (15.88%) General case / -118.6,106.5 | 43.4% (mt) chi angles: 298.4,164.2 | 0.086Å | - | - |
| 28 | ARG | 78.1 | 0.692Å CZ with 32 LYS CE | Favored (72.59%) General case / -56.1,-50.2 | 27.3% (ttt180) chi angles: 184.4,208.9,176,208.4 | 0.054Å | - | - |
| 29 | ASN | 56.56 | 0.754Å HB2 with 172 GLU OE1 | Favored (76.81%) General case / -65.5,-32.5 | 34.8% (m-80) chi angles: 280.7,271.8 | 0.193Å | - | - |
| 30 | GLU | 62 | - | Favored (71.39%) General case / -69.5,-46.4 | 3.1% (tm-20) chi angles: 208.7,287.8,117.6 | 0.169Å | - | - |
| 31 | TYR | 66.48 | - | Favored (77.28%) General case / -56.6,-48.3 | 22.9% (t80) chi angles: 181.3,48.5 | 0.236Å | - | - |
| 32 | LYS | 63 | 0.692Å CE with 28 ARG CZ | Favored (74.03%) General case / -57.2,-37.5 | 7.3% (mttp) chi angles: 288.2,205.2,228,87 | 0.108Å | - | - |
| 33 | TYR | 31.53 | - | Favored (83.55%) General case / -64.1,-47.4 | 91.2% (t80) chi angles: 178.2,75.6 | 0.048Å | - | - |
| 34 | PHE | 25.82 | - | Favored (77.14%) General case / -59.5,-50.1 | 44.6% (t80) chi angles: 165.9,83 | 0.124Å | - | - |
| 35 | GLN | 50.15 | - | Favored (76.87%) General case / -55.8,-46.5 | 14.3% (mm100) chi angles: 295.4,274.9,65.9 | 0.062Å | - | - |
| 36 | ARG | 79.62 | - | Favored (83.71%) General case / -67.2,-44.2 | 0.7% chi angles: 168.4,194.9,29.3,140.4 | 0.086Å | - | - |
| 37 | MET | 41.1 | - | Favored (79.32%) General case / -66.4,-46.7 | 95.4% (mmm) chi angles: 295.8,294.5,295.1 | 0.07Å | - | - |
| 38 | THR | 26.23 | - | Favored (65.51%) General case / -73.5,-29.7 | 63.1% (p) chi angles: 62.8 | 0.159Å | - | - |
| 39 | SER | 38.37 | - | Favored (24.87%) General case / -85.4,-27.6 | 49.8% (m) chi angles: 301.7 | 0.22Å | - | - |
| 40 | THR | 32.57 | 0.443Å O with 111 MET HE2 | Favored (9.21%) General case / -71.6,113.1 | 27.5% (m) chi angles: 307.9 | 0.131Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 43.69 | Clashscore: 30.69 | Outliers: 0 of 184 | Outliers: 9 of 166 | Outliers: 15 of 176 | Outliers: 1 of 186 | Outliers: 14 of 186 | ||
| 41 | SER | 44.98 | - | Favored (28.17%) General case / -95.5,143.8 | 38.1% (t) chi angles: 176.2 | 0.115Å | - | - |
| 42 | HIS | 69.52 | 0.783Å O with 43 VAL CG2 | Allowed (1.96%) General case / -97.3,35.9 | 36.3% (m80) chi angles: 296.5,129.3 | 0.117Å | - | - |
| 43 | VAL | 53.48 | 0.783Å CG2 with 42 HIS O | Favored (5.8%) General case / -161.5,134.9 | 47.5% (t) chi angles: 168.2 | 0.203Å | - | - |
| 44 | GLU | 90.82 | - | Favored (37.27%) General case / -78.3,140.8 | 20.6% (pt-20) chi angles: 66.7,195,176.9 | 0.173Å | - | - |
| 45 | GLY | 59.66 | - | Favored (72.29%) Glycine / 93.8,-5.3 | - | - | - | - |
| 46 | LYS | 57.86 | - | Favored (22.47%) General case / -120.0,163.2 | 46.8% (mttt) chi angles: 299.2,184.8,146.4,185.5 | 0.025Å | - | - |
| 47 | GLN | 59.76 | - | Favored (43.45%) General case / -134.4,161.7 | 22.7% (mt-30) chi angles: 263,168.7,353 | 0.169Å | - | - |
| 48 | ASN | 28.31 | 0.561Å ND2 with 111 MET H | Favored (19.02%) General case / -87.5,156.8 | 7.8% (m120) chi angles: 290.2,166 | 0.03Å | - | - |
| 49 | ALA | 26.28 | - | Favored (38.61%) General case / -110.9,144.2 | - | 0.082Å | - | - |
| 50 | VAL | 23.88 | 0.424Å HA with 113 TRP O | Favored (58.61%) General case / -122.6,137.7 | 3.9% (m) chi angles: 283.6 | 0.098Å | - | - |
| 51 | ILE | 24.57 | - | Favored (60.69%) General case / -115.8,133.3 | 77.7% (mt) chi angles: 301.6,173.9 | 0.145Å | - | 1 OUTLIER(S) worst is O-C-N: 5.563 σ |
| 52 | MET | 26.19 | - | Favored (33.67%) General case / -145.8,161.1 | 12.7% (ptp) chi angles: 70.9,186.4,91.5 | 0.105Å | - | 1 OUTLIER(S) worst is O-C-N: 4.093 σ |
| 53 | GLY | 22.54 | - | Favored (55.19%) Glycine / -80.4,171.4 | - | - | - | - |
| 54 | LYS | 23.95 | - | Favored (79.21%) General case / -68.8,-35.6 | 34.4% (ttpt) chi angles: 189.9,179.3,67.6,191.4 | 0.254Å | - | - |
| 55 | LYS | 51.66 | - | Favored (65.87%) General case / -73.9,-31.3 | 56.6% (tttt) chi angles: 183.6,172.1,162.5,155.9 | 0.137Å | - | - |
| 56 | THR | 22.65 | - | Favored (81.87%) General case / -66.9,-45.3 | 30.2% (m) chi angles: 292.2 | 0.102Å | - | - |
| 57 | TRP | 23.34 | 0.625Å CE2 with 65 ARG HD3 | Favored (64.28%) General case / -52.7,-49.7 | 65.4% (t-105) chi angles: 172,256 | 0.087Å | - | - |
| 58 | PHE | 30.59 | - | Favored (58.04%) General case / -74.0,-11.7 | 54.1% (m-85) chi angles: 285.5,109.5 | 0.095Å | - | - |
| 59 | SER | 30.34 | - | Favored (54.69%) General case / -78.9,-15.6 | 6.8% (p) chi angles: 85.7 | 0.134Å | - | - |
| 60 | ILE | 27.41 | 0.409Å HA with 61 PRO HD3 | Favored (66.74%) Pre-proline / -84.3,134.4 | 64.7% (mt) chi angles: 303.8,167.3 | 0.162Å | - | 1 OUTLIER(S) worst is O-C-N: -4.253 σ |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 43.69 | Clashscore: 30.69 | Outliers: 0 of 184 | Outliers: 9 of 166 | Outliers: 15 of 176 | Outliers: 1 of 186 | Outliers: 14 of 186 | ||
| 61 | PRO | 28.31 | 0.409Å HD3 with 60 ILE HA | Favored (50.07%) Proline / -53.0,135.2 | 84.2% (Cg_exo) chi angles: 330.3 | 0.02Å | - | - |
| 62 | GLU | 78.27 | 0.403Å OE2 with 63 LYS CE | Favored (65.75%) General case / -52.9,-41.2 | 16.1% (tt0) chi angles: 186.8,201.4,85.9 | 0.109Å | - | - |
| 63 | LYS | 52.65 | 0.403Å CE with 62 GLU OE2 | Favored (60.68%) General case / -70.7,-12.1 | 17.9% (mmtp) chi angles: 298.9,326.9,181.9,73.3 | 0.294Å | - | - |
| 64 | ASN | 45.86 | - | Favored (38.86%) General case / -98.5,6.7 | 80% (m-20) chi angles: 287.3,354.1 | 0.097Å | - | - |
| 65 | ARG | 38.82 | 0.625Å HD3 with 57 TRP CE2 | Favored (31.57%) Pre-proline / -103.3,149.2 | 37.2% (mtt180) chi angles: 285.3,182.8,209.4,138.5 | 0.253Å | - | - |
| 66 | PRO | 29.84 | - | Favored (30.73%) Proline / -73.9,167.4 | 7.5% (Cg_endo) chi angles: 40.8 | 0.099Å | - | - |
| 67 | LEU | 26.64 | - | Favored (8.42%) General case / -60.7,118.8 | 96.6% (mt) chi angles: 296.6,177.9 | 0.071Å | - | - |
| 68 | LYS | 68.98 | 0.628Å HE2 with 69 ASP OD2 | Favored (31.6%) General case / -57.6,143.4 | 19.4% (tttt) chi angles: 168.1,195.7,152.3,209 | 0.064Å | - | - |
| 69 | ASP | 53.95 | 0.628Å OD2 with 68 LYS HE2 | Favored (7.1%) General case / 66.3,16.5 | 51.8% (m-20) chi angles: 291.2,120.4 | 0.175Å | - | - |
| 70 | ARG | 27.91 | - | Favored (54.94%) General case / -132.7,154.4 | 26.8% (mtm180) chi angles: 283.2,145.1,288.8,191.6 | 0.114Å | - | - |
| 71 | ILE | 36.46 | 0.739Å HD13 with 108 LYS HZ1 | Favored (31.71%) General case / -87.2,120.4 | 18.1% (mt) chi angles: 292.5,148.9 | 0.14Å | - | - |
| 72 | ASN | 27.71 | 0.43Å HD22 with 72 ASN N | Favored (45.7%) General case / -95.8,122.8 | 1% chi angles: 291.7,223.5 | 0.019Å | - | - |
| 73 | ILE | 30.16 | 0.423Å HG12 with 88 TYR HB2 | Favored (62.02%) General case / -119.6,126.1 | 93% (mt) chi angles: 295.2,173.5 | 0.089Å | - | - |
| 74 | VAL | 26.71 | - | Favored (39.65%) General case / -107.0,140.9 | 93.9% (t) chi angles: 176.9 | 0.128Å | - | - |
| 75 | LEU | 26.59 | - | Favored (48.04%) General case / -102.4,134.7 | 44.5% (mt) chi angles: 298.1,188.1 | 0.1Å | - | - |
| 76 | SER | 28.41 | - | Favored (4.01%) General case / -166.0,138.0 | 40.3% (t) chi angles: 176.7 | 0.247Å | - | - |
| 77 | ARG | 80.21 | - | Favored (24.72%) General case / -94.1,-14.6 | 12.1% (mtt180) chi angles: 289.3,137.7,197.2,152.5 | 0.097Å | - | 1 OUTLIER(S) worst is O-C-N: 4.751 σ |
| 78 | GLU | 41.8 | - | Favored (10.35%) General case / -97.7,-38.2 | 58.8% (mt-10) chi angles: 305.6,175.3,22.1 | 0.185Å | - | - |
| 79 | LEU | 37.43 | - | Favored (45.3%) General case / -72.8,145.5 | 59% (mt) chi angles: 306.3,181.4 | 0.093Å | - | - |
| 80 | LYS | 86.75 | - | Favored (13.3%) General case / -93.6,-35.3 | 29.7% (tptt) chi angles: 178.1,82.2,185,203.3 | 0.069Å | - | 1 OUTLIER(S) worst is CA-C-N: -4.283 σ |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 43.69 | Clashscore: 30.69 | Outliers: 0 of 184 | Outliers: 9 of 166 | Outliers: 15 of 176 | Outliers: 1 of 186 | Outliers: 14 of 186 | ||
| 81 | GLU | 91.97 | - | Favored (50.2%) General case / -138.2,156.3 | 0.4% chi angles: 228.1,203.4,6.3 | 0.195Å | - | - |
| 82 | ALA | 43.08 | - | Favored (79.11%) Pre-proline / -57.5,135.6 | - | 0.085Å | - | - |
| 83 | PRO | 38.06 | - | Favored (70.08%) Proline / -60.9,152.9 | 11.9% (Cg_exo) chi angles: 349 | 0.052Å | - | - |
| 84 | LYS | 75.24 | 0.489Å HD2 with 85 GLY N | Favored (6.86%) General case / -51.1,122.0 | 19.2% (tptt) chi angles: 178.1,35.8,187.6,160.6 | 0.095Å | - | - |
| 85 | GLY | 35.49 | 0.489Å N with 84 LYS HD2 | Favored (36.38%) Glycine / 99.3,-23.8 | - | - | - | - |
| 86 | ALA | 31.57 | - | Favored (32.5%) General case / -78.3,149.7 | - | 0.148Å | - | - |
| 87 | HIS | 36.5 | - | Favored (35.03%) General case / -80.2,-38.4 | 40.7% (m80) chi angles: 302,115 | 0.112Å | - | - |
| 88 | TYR | 47.92 | 0.423Å HB2 with 73 ILE HG12 | Favored (30.75%) General case / -151.6,153.3 | 91.5% (m-85) chi angles: 299.9,92.8 | 0.132Å | - | - |
| 89 | LEU | 39.21 | 0.589Å HG with 91 LYS HE3 | Favored (55.9%) General case / -119.9,139.0 | 7.7% (tp) chi angles: 155.5,61.9 | 0.052Å | - | - |
| 90 | SER | 34.14 | - | Favored (54.63%) General case / -135.2,152.7 | 50.2% (m) chi angles: 300.3 | 0.198Å | - | - |
| 91 | LYS | 66.33 | 0.589Å HE3 with 89 LEU HG | Favored (32.35%) General case / -99.6,-1.8 | 0.1% chi angles: 292.5,97.4,213.7,152.3 | 0.245Å | - | - |
| 92 | SER | 29.01 | - | Favored (22.69%) General case / -162.2,165.2 | 80.6% (p) chi angles: 60.2 | 0.044Å | - | - |
| 93 | LEU | 34.46 | - | Favored (95.33%) General case / -61.7,-40.5 | 64.8% (tp) chi angles: 178.8,61.4 | 0.029Å | - | - |
| 94 | ASP | 58.63 | - | Favored (73.61%) General case / -54.7,-45.7 | 7.6% (m-20) chi angles: 304.7,88.6 | 0.037Å | - | - |
| 95 | ASP | 50.5 | - | Favored (96.56%) General case / -61.0,-42.1 | 43.7% (m-20) chi angles: 275.7,157.1 | 0.024Å | - | - |
| 96 | ALA | 31.9 | - | Favored (88.14%) General case / -66.5,-37.9 | - | 0.115Å | - | - |
| 97 | LEU | 39.72 | - | Favored (95.1%) General case / -64.3,-43.8 | 71% (mt) chi angles: 291.7,180.6 | 0.251Å | - | - |
| 98 | ALA | 43.88 | - | Favored (71.91%) General case / -57.0,-51.2 | - | 0.098Å | - | - |
| 99 | LEU | 45.45 | - | Favored (18.02%) General case / -47.8,-52.4 | 26.6% (tp) chi angles: 166.2,62.4 | 0.165Å | - | - |
| 100 | LEU | 50.16 | 0.539Å HD23 with 105 LEU HD12 | Favored (79.6%) General case / -59.8,-36.9 | 29.9% (mt) chi angles: 281.1,177.5 | 0.15Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 43.69 | Clashscore: 30.69 | Outliers: 0 of 184 | Outliers: 9 of 166 | Outliers: 15 of 176 | Outliers: 1 of 186 | Outliers: 14 of 186 | ||
| 101 | ASP | 70.25 | 0.627Å HA with 106 LYS HE2 | Favored (65.07%) General case / -70.3,-17.0 | 84.3% (m-20) chi angles: 289.3,152.1 | 0.111Å | - | - |
| 102 | SER | 74.96 | 0.74Å HB3 with 103 PRO HD2 | Favored (19.91%) Pre-proline / -61.1,161.1 | 4.1% (p) chi angles: 89.3 | 0.346Å | - | - |
| 103 | PRO | 85.46 | 0.74Å HD2 with 102 SER HB3 | Allowed (1.28%) Proline / -46.4,-63.7 | 51.2% (Cg_exo) chi angles: 335.2 | 0.06Å | - | 1 OUTLIER(S) worst is C-N-CA: 4.49 σ |
| 104 | GLU | 115.41 | 0.724Å HG2 with 105 LEU HD23 | Favored (46.44%) General case / -51.4,-51.7 | 8.9% (tt0) chi angles: 149.4,175.2,7.9 | 0.039Å | - | - |
| 105 | LEU | 75.89 | 0.724Å HD23 with 104 GLU HG2 | Favored (7.06%) General case / -70.8,-57.6 | 0.2% chi angles: 279.6,229.9 | 0.139Å | - | - |
| 106 | LYS | 81.99 | 0.627Å HE2 with 101 ASP HA | Allowed (1.01%) General case / -35.6,-50.3 | 13.9% (tppt?) chi angles: 188,75,82.6,173.8 | 0.229Å | - | - |
| 107 | SER | 66.41 | - | Favored (55.41%) General case / -78.9,-14.2 | 9.3% (p) chi angles: 84.5 | 0.026Å | - | - |
| 108 | LYS | 84.8 | 0.739Å HZ1 with 71 ILE HD13 | Favored (21.97%) General case / -94.8,-16.1 | 12.8% (ttpt) chi angles: 196.5,201.3,48.5,153 | 0.119Å | - | - |
| 109 | VAL | 40.6 | 0.502Å HG22 with 71 ILE HD12 | Favored (57.23%) General case / -108.4,134.1 | 60.3% (t) chi angles: 171 | 0.271Å | - | - |
| 110 | ASP | 35.76 | - | Allowed (0.24%) General case / -96.8,-90.2 | 49.7% (t0) chi angles: 180.4,13.6 | 0.253Å | - | - |
| 111 | MET | 43.34 | 1.096Å HE3 with 113 TRP HE1 | Favored (20.18%) General case / -103.5,156.4 | 57.5% (mtm) chi angles: 301,190.1,302.8 | 0.219Å | - | - |
| 112 | VAL | 27.46 | - | Favored (62.75%) General case / -114.6,128.1 | 59.7% (t) chi angles: 181 | 0.049Å | - | - |
| 113 | TRP | 27.05 | 1.096Å HE1 with 111 MET HE3 | Favored (62.77%) General case / -120.7,133.1 | 76.2% (m95) chi angles: 282.4,90.7 | 0.211Å | - | 1 OUTLIER(S) worst is O-C-N: 5.706 σ |
| 114 | ILE | 28.28 | 0.488Å HG23 with 120 VAL HG12 | Favored (50.89%) General case / -97.3,127.4 | 30.7% (mm) chi angles: 301.4,309.6 | 0.155Å | - | 1 OUTLIER(S) worst is O-C-N: 4.733 σ |
| 115 | VAL | 20.46 | - | Favored (10.96%) General case / -120.7,17.3 | 15.9% (m) chi angles: 305.6 | 0.191Å | - | - |
| 116 | GLY | 18.9 | - | Favored (28.84%) Glycine / 101.9,178.1 | - | - | - | 1 OUTLIER(S) worst is O-C-N: 4.886 σ |
| 117 | GLY | 18.54 | - | Favored (18.93%) Glycine / -86.6,-150.6 | - | - | - | - |
| 118 | THR | 24.03 | - | Favored (2.93%) General case / -43.2,-58.5 | 38.1% (m) chi angles: 306 | 0.086Å | - | - |
| 119 | ALA | 24.14 | - | Favored (70.03%) General case / -66.8,-26.9 | - | 0.139Å | - | - |
| 120 | VAL | 21.75 | 0.488Å HG12 with 114 ILE HG23 | Favored (68.5%) General case / -71.8,-44.5 | 38.7% (t) chi angles: 185.3 | 0.147Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 43.69 | Clashscore: 30.69 | Outliers: 0 of 184 | Outliers: 9 of 166 | Outliers: 15 of 176 | Outliers: 1 of 186 | Outliers: 14 of 186 | ||
| 121 | TYR | 23.15 | 0.426Å O with 125 MET HG3 | Favored (94.22%) General case / -60.5,-45.1 | 26.1% (m-85) chi angles: 287.1,127.6 | 0.118Å | - | - |
| 122 | LYS | 61.55 | - | Favored (92.33%) General case / -60.4,-45.7 | 16.2% (tttt) chi angles: 195.3,205.1,183.3,222.3 | 0.141Å | - | - |
| 123 | ALA | 28.13 | - | Favored (98.56%) General case / -63.8,-42.2 | - | 0.13Å | - | - |
| 124 | ALA | 27.39 | - | Favored (95.39%) General case / -64.9,-39.4 | - | 0.087Å | - | - |
| 125 | MET | 51.54 | 0.486Å CE with 149 PRO HG2 | Favored (73.01%) General case / -67.7,-30.7 | 75.2% (mtm) chi angles: 298,188.7,293.9 | 0.214Å | - | - |
| 126 | GLU | 56.49 | - | Favored (57.7%) General case / -75.2,-22.5 | 94.3% (mt-10) chi angles: 294.2,180.9,156.9 | 0.087Å | - | - |
| 127 | LYS | 65.65 | - | Favored (99.8%) Pre-proline / -66.7,136.3 | 27.6% (mmtp) chi angles: 299.9,303.3,201.2,75.1 | 0.117Å | - | - |
| 128 | PRO | 41.42 | 0.611Å O with 186 VAL HG11 | Favored (5.63%) Proline / -82.5,68.8 | 41.8% (Cg_endo) chi angles: 36.2 | 0.071Å | - | - |
| 129 | ILE | 52.65 | 0.931Å C with 186 VAL HG21 | Favored (39.86%) General case / -143.8,147.5 | 0% chi angles: 129,153.2 | 0.264Å | - | - |
| 130 | ASN | 52.4 | 0.488Å OD1 with 186 VAL HB | Favored (26.08%) General case / -52.4,133.3 | 3% (m120) chi angles: 278.1,45.8 | 0.17Å | - | - |
| 131 | HIS | 29.99 | - | Favored (12.67%) General case / -154.0,136.3 | 5.5% (t-160) chi angles: 194.3,158.4 | 0.268Å | - | - |
| 132 | ARG | 68.85 | - | Favored (62.61%) General case / -112.6,129.1 | 65.3% (mtm-85) chi angles: 279.3,199.3,280.3,264 | 0.109Å | - | - |
| 133 | LEU | 31.04 | 0.531Å HG with 135 VAL HG23 | Favored (60.78%) General case / -115.3,124.8 | 34.3% (tp) chi angles: 171.4,56.5 | 0.261Å | - | - |
| 134 | PHE | 27.51 | - | Favored (26.11%) General case / -104.1,109.2 | 70.7% (m-85) chi angles: 292.5,79.5 | 0.067Å | - | - |
| 135 | VAL | 26.23 | 0.531Å HG23 with 133 LEU HG | Favored (59.49%) General case / -113.4,133.9 | 80.4% (t) chi angles: 179.1 | 0.14Å | - | - |
| 136 | THR | 23.02 | - | Favored (35.62%) General case / -101.4,115.0 | 56% (m) chi angles: 304.5 | 0.09Å | - | - |
| 137 | ARG | 38.52 | - | Favored (33.68%) General case / -96.6,114.8 | 10.4% (mtt180) chi angles: 294.5,225.9,174.8,227.8 | 0.173Å | - | - |
| 138 | ILE | 34.15 | - | Favored (39.94%) General case / -91.8,123.3 | 80.5% (mt) chi angles: 289.9,171.2 | 0.139Å | - | - |
| 139 | LEU | 32.06 | 0.97Å HD21 with 178 LYS HE3 | Favored (2.4%) General case / -87.0,52.2 | 63.8% (mt) chi angles: 305.9,179.8 | 0.124Å | - | - |
| 140 | HIS | 47.12 | 0.63Å CD2 with 139 LEU C | Favored (24.57%) General case / -155.4,168.1 | 62.8% (m-70) chi angles: 299.6,258.2 | 0.166Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 43.69 | Clashscore: 30.69 | Outliers: 0 of 184 | Outliers: 9 of 166 | Outliers: 15 of 176 | Outliers: 1 of 186 | Outliers: 14 of 186 | ||
| 141 | GLU | 75.7 | - | Favored (49.41%) General case / -111.8,139.7 | 16.2% (mt-10) chi angles: 296.9,153.1,132.5 | 0.122Å | - | - |
| 142 | PHE | 38.03 | - | Favored (47.37%) General case / -128.8,157.7 | 90.5% (m-85) chi angles: 298.2,85.3 | 0.102Å | - | - |
| 143 | GLU | 78.61 | 0.599Å CD with 18 LYS HE2 | Favored (43.94%) General case / -76.2,131.2 | 17.3% (pt-20) chi angles: 54.1,170.5,0.8 | 0.093Å | - | - |
| 144 | SER | 29.37 | - | Favored (49.63%) General case / -132.7,158.5 | 49.6% (m) chi angles: 300.9 | 0.201Å | - | - |
| 145 | ASP | 32.41 | - | Favored (8.53%) General case / -125.5,5.5 | 46.1% (p30) chi angles: 65.5,16.1 | 0.153Å | - | - |
| 146 | THR | 25.53 | - | Favored (26.42%) General case / -142.8,134.7 | 78.8% (m) chi angles: 303 | 0.218Å | - | - |
| 147 | PHE | 32.41 | - | Favored (43.03%) General case / -128.3,159.3 | 89.4% (m-85) chi angles: 296.1,83.6 | 0.093Å | - | 1 OUTLIER(S) worst is O-C-N: 4.599 σ |
| 148 | PHE | 23.45 | 0.599Å HE2 with 151 ILE HG22 | Favored (81.49%) Pre-proline / -79.5,140.6 | 33.9% (t80) chi angles: 192.9,65.3 | 0.173Å | - | 1 OUTLIER(S) worst is O-C-N: 4.361 σ |
| 149 | PRO | 26.7 | 0.49Å HD2 with 148 PHE CD1 | Favored (30.83%) Proline / -65.0,164.8 | 13.7% (Cg_endo) chi angles: 16 | 0.059Å | - | - |
| 150 | GLU | 56.76 | - | Favored (46.57%) General case / -72.5,133.7 | 54.2% (mt-10) chi angles: 282.6,196.5,10.3 | 0.09Å | - | - |
| 151 | ILE | 47.26 | 0.723Å CD1 with 156 PHE HB2 | Favored (41.45%) General case / -94.7,134.6 | 0.6% chi angles: 113,99.9 | 0.202Å | - | - |
| 152 | ASP | 41.79 | - | Favored (8.27%) General case / -80.7,99.4 | 53.6% (t0) chi angles: 187.8,157 | 0.104Å | - | - |
| 153 | TYR | 37.06 | - | Favored (17.78%) General case / -64.5,-8.2 | 15.4% (m-30) chi angles: 289.4,150.8 | 0.117Å | - | - |
| 154 | LYS | 44.08 | - | Favored (31.48%) General case / -84.1,-23.5 | 28.8% (mtmm) chi angles: 301,173.3,307.8,287.6 | 0.067Å | - | - |
| 155 | ASP | 50.57 | - | Favored (8.4%) General case / -98.8,-44.8 | 66.4% (m-20) chi angles: 277,170.1 | 0.182Å | - | - |
| 156 | PHE | 35.77 | 0.723Å HB2 with 151 ILE CD1 | Favored (25.89%) General case / -93.4,110.7 | 42.4% (m-85) chi angles: 279.4,88.2 | 0.068Å | - | - |
| 157 | LYS | 64.84 | - | Favored (42.76%) General case / -97.0,135.1 | 36.6% (mmtt) chi angles: 309.8,301.7,191.2,151.1 | 0.228Å | - | - |
| 158 | LEU | 38.68 | - | Favored (34.57%) General case / -71.1,127.8 | 19.6% (tp) chi angles: 178,49 | 0.194Å | - | - |
| 159 | LEU | 40.69 | - | Favored (28.15%) General case / -83.6,147.0 | 64.5% (mt) chi angles: 303.6,183.6 | 0.103Å | - | - |
| 160 | THR | 55.48 | - | Favored (27.77%) General case / -89.2,-17.7 | 30.3% (p) chi angles: 70.1 | 0.091Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 43.69 | Clashscore: 30.69 | Outliers: 0 of 184 | Outliers: 9 of 166 | Outliers: 15 of 176 | Outliers: 1 of 186 | Outliers: 14 of 186 | ||
| 161 | GLU | 73.86 | 0.423Å CG with 162 TYR N | Favored (24.48%) General case / -154.2,149.6 | 9.1% (tt0) chi angles: 151.1,190.8,164.1 | 0.201Å | - | - |
| 162 | TYR | 40.63 | 0.423Å N with 161 GLU CG | Favored (7.66%) Pre-proline / -152.4,131.3 | 56.9% (t80) chi angles: 189.6,80.8 | 0.113Å | - | - |
| 163 | PRO | 51.06 | - | Favored (5.15%) Proline / -49.0,115.6 | 1.1% (Cg_endo) chi angles: 4 | 0.104Å | - | - |
| 164 | GLY | 50.87 | - | Favored (75.61%) Glycine / 85.4,12.8 | - | - | - | - |
| 165 | VAL | 41.56 | - | Favored (39.98%) Pre-proline / -118.9,116.1 | 30.3% (t) chi angles: 164.9 | 0.112Å | - | - |
| 166 | PRO | 40.21 | - | Favored (66.48%) Proline / -55.0,143.2 | 32% (Cg_exo) chi angles: 338.9 | 0.153Å | - | - |
| 167 | ALA | 50.05 | - | Favored (14.5%) General case / -89.0,-40.6 | - | 0.104Å | - | - |
| 168 | ASP | 70.25 | - | Favored (20.47%) General case / -64.5,158.3 | 15.6% (m-20) chi angles: 305.5,174.5 | 0.04Å | - | - |
| 169 | ILE | 36.13 | - | Favored (45.33%) General case / -67.4,132.9 | 15.5% (mt) chi angles: 289,188.1 | 0.125Å | - | - |
| 170 | GLN | 43.83 | - | Favored (15%) General case / -98.0,162.3 | 53% (mm-40) chi angles: 313.3,286.9,296.7 | 0.178Å | - | - |
| 171 | GLU | 60.64 | - | Favored (30.85%) General case / -144.2,140.6 | 83.2% (tt0) chi angles: 185.4,181.8,9.7 | 0.226Å | - | - |
| 172 | GLU | 46.93 | 0.754Å OE1 with 29 ASN HB2 | Favored (9.54%) General case / -157.9,137.1 | 61.9% (tt0) chi angles: 174.1,164.4,12.3 | 0.177Å | - | - |
| 173 | ASP | 41.19 | - | Favored (19.25%) General case / 51.3,40.4 | 52.6% (m-20) chi angles: 300.1,118.1 | 0.033Å | - | - |
| 174 | GLY | 28.58 | - | Favored (62.02%) Glycine / 74.2,1.3 | - | - | - | - |
| 175 | ILE | 41.98 | - | Favored (41.81%) General case / -107.2,140.0 | 5.9% (mm) chi angles: 294.3,322.2 | 0.263Å | - | - |
| 176 | GLN | 30.1 | - | Favored (26.61%) General case / -106.8,150.4 | 81.1% (mt-30) chi angles: 288.3,182.7,294.3 | 0.197Å | - | - |
| 177 | TYR | 38.1 | - | Favored (32.15%) General case / -154.6,160.6 | 51.5% (p90) chi angles: 58.4,87.6 | 0.031Å | - | - |
| 178 | LYS | 73.92 | 0.97Å HE3 with 139 LEU HD21 | Favored (49.66%) General case / -134.1,146.9 | 1.2% (pttt) chi angles: 31.2,164.1,173.7,133.9 | 0.131Å | - | - |
| 179 | PHE | 31.97 | - | Favored (46.09%) General case / -95.1,131.4 | 64.5% (m-85) chi angles: 299.7,114.4 | 0.027Å | - | - |
| 180 | GLU | 39.65 | - | Favored (52.95%) General case / -130.0,151.1 | 90.1% (mt-10) chi angles: 299.5,179.1,153 | 0.084Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 43.69 | Clashscore: 30.69 | Outliers: 0 of 184 | Outliers: 9 of 166 | Outliers: 15 of 176 | Outliers: 1 of 186 | Outliers: 14 of 186 | ||
| 181 | VAL | 25.93 | - | Favored (52.85%) General case / -130.0,127.4 | 40.8% (t) chi angles: 184.7 | 0.073Å | - | - |
| 182 | TYR | 25.67 | 0.446Å HB2 with 133 LEU HB3 | Favored (37.37%) General case / -117.6,148.1 | 71.7% (m-85) chi angles: 287,84.3 | 0.265Å | - | - |
| 183 | GLN | 55.74 | - | Favored (39.17%) General case / -136.3,132.5 | 25.5% (tt0) chi angles: 181.3,160.8,275.2 | 0.125Å | - | - |
| 184 | LYS | 37.19 | - | Favored (61.92%) General case / -110.4,127.9 | 41.1% (tttt) chi angles: 169.3,179.9,154.1,158 | 0.092Å | - | - |
| 185 | SER | 50.45 | - | Favored (61.43%) General case / -109.2,128.9 | 58.8% (m) chi angles: 290.5 | 0.023Å | - | - |
| 186 | VAL | 67.22 | 0.931Å HG21 with 129 ILE C | - | 80.9% (t) chi angles: 179.1 | 0.128Å | - | - |
| 191 | NDP | 29.04 | 0.688Å NH2 with 16 ILE O | - | - | - | - | - |