Viewing 1J3IA.reduce3.nohet-multi.table
| All-Atom Contacts |
Clashscore, all atoms: | 15.83 | 76th percentile* (N=350, 2.08Å - 2.58Å) |
| Clashscore is the number of serious steric overlaps (> 0.4 Å) per 1000 atoms. | |||
| Protein Geometry |
Rotamer outliers | 2.83% | Goal: <1% |
| Ramachandran outliers | 0.91% | Goal: <0.2% | |
| Ramachandran favored | 95.89% | Goal: >98% | |
| Cβ deviations >0.25Å | 1 | Goal: 0 | |
| MolProbity score | 2.33 | 74th percentile* (N=8627, 2.08Å - 2.58Å) | |
| Residues with bad bonds: | 0.00% | Goal: <5% | |
| Residues with bad angles: | 1.35% | Goal: <5% | |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 53.41 | Clashscore: 15.83 | Outliers: 2 of 219 | Outliers: 6 of 212 | Outliers: 1 of 215 | Outliers: 0 of 223 | Outliers: 3 of 223 | ||
| A 1 | MET | 95.65 | 0.808Å HG2 with A 2 MET H | - | 17.5% (ttm) chi angles: 190.5,168,256.8 | 0.035Å | - | - |
| A 2 | MET | 95.65 | 0.808Å H with A 1 MET HG2 | Allowed (1.47%) General case / -51.8,158.3 | 0% chi angles: 123.5,270.9,298.3 | 0.044Å | - | - |
| A 3 | GLU | 95.65 | 0.476Å N with A 2 MET HG2 | Favored (19.9%) General case / -103.7,156.9 | 1.5% (mt-10) chi angles: 335.9,166,147.3 | 0.097Å | - | - |
| A 4 | GLN | 94.42 | - | Favored (23.09%) General case / -94.4,147.4 | 14.8% (mt-30) chi angles: 262.4,192.6,289.5 | 0.007Å | - | - |
| A 5 | VAL | 80.06 | 0.449Å HG13 with A 9 PHE HD2 | Favored (3.07%) General case / -41.6,-56.2 | 22% (t) chi angles: 187.6 | 0.063Å | - | - |
| A 6 | CYS | 71.95 | 0.407Å HB3 with A 178 LEU HA | Favored (7.02%) General case / -45.6,-36.9 | 8.4% (p) chi angles: 80 | 0.03Å | - | - |
| A 7 | ASP | 69.53 | - | Favored (6.46%) General case / -73.8,-57.3 | 0.2% chi angles: 230.8,72.2 | 0.012Å | - | - |
| A 8 | VAL | 59.67 | 0.506Å HA with A 76 LYS HD3 | Favored (72.86%) General case / -54.8,-48.1 | 95.6% (t) chi angles: 176 | 0.05Å | - | - |
| A 9 | PHE | 53.04 | 0.449Å HD2 with A 5 VAL HG13 | Favored (39.51%) General case / -89.7,4.4 | 64.1% (m-85) chi angles: 298.2,115.2 | 0.098Å | - | - |
| A 10 | ASP | 52.09 | - | Allowed (1.65%) General case / 47.3,66.1 | 30.5% (m-20) chi angles: 298.1,105.6 | 0.011Å | - | - |
| A 11 | ILE | 39.86 | - | Favored (52.19%) General case / -99.1,124.6 | 59.1% (mt) chi angles: 306.2,173.7 | 0.035Å | - | - |
| A 12 | TYR | 44.29 | 0.625Å HD1 with A 181 LYS HB2 | Favored (32.59%) General case / -128.1,162.9 | 53.6% (m-85) chi angles: 308.2,96.4 | 0.113Å | - | - |
| A 13 | ALA | 35.5 | - | Favored (45.42%) General case / -118.3,143.8 | - | 0.084Å | - | - |
| A 14 | ILE | 30.96 | - | Favored (28.94%) General case / -138.4,129.3 | 11.5% (tt) chi angles: 177.9,160.8 | 0.041Å | - | - |
| A 15 | CYS | 37.64 | - | Favored (8.8%) General case / -151.7,178.3 | 28.6% (p) chi angles: 61.5 | 0.116Å | - | - |
| A 16 | ALA | 34.08 | 0.482Å HA with A 185 THR HB | Favored (29.08%) General case / -139.7,131.5 | - | 0.101Å | - | - |
| A 17 | CYS | 40.06 | - | Favored (54.4%) General case / -131.5,138.9 | 98.2% (m) chi angles: 294.3 | 0.059Å | - | - |
| A 18 | CYS | 39.61 | - | Favored (2.3%) General case / -108.4,-175.1 | 29.4% (p) chi angles: 62.3 | 0.045Å | - | - |
| A 19 | LYS | 46.28 | 0.442Å HG2 with A 36 THR HG22 | Favored (19.85%) General case / -91.1,150.8 | 44.6% (mtmt) chi angles: 288,176.3,305,194.2 | 0.042Å | - | - |
| A 20 | VAL | 61.77 | 0.781Å HG12 with A 22 SER H | Favored (37.89%) General case / -92.1,135.8 | 97.6% (t) chi angles: 178.6 | 0.048Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 53.41 | Clashscore: 15.83 | Outliers: 2 of 219 | Outliers: 6 of 212 | Outliers: 1 of 215 | Outliers: 0 of 223 | Outliers: 3 of 223 | ||
| A 21 | GLU | 84.4 | 0.795Å O with A 21 GLU HG2 | Favored (4.2%) General case / -68.8,1.6 | 18.8% (tt0) chi angles: 188.7,200.4,66.1 | 0.055Å | - | - |
| A 22 | SER | 91.87 | 0.781Å H with A 20 VAL HG12 | Favored (10.47%) General case / -49.8,125.5 | 22.3% (t) chi angles: 187.9 | 0.093Å | - | - |
| A 23 | LYS | 95.65 | 0.412Å O with A 23 LYS HG3 | Favored (2.38%) General case / -69.8,102.8 | 20% (pttp) chi angles: 50.9,176,175.4,53.9 | 0.022Å | - | - |
| A 24 | ASN | 95.65 | 0.658Å ND2 with A 27 LYS HA | Favored (41.49%) General case / -65.3,131.0 | 4.4% (p30) chi angles: 41.3,3.7 | 0.102Å | - | - |
| A 25 | GLU | 95.65 | - | Favored (2.48%) General case / -82.2,17.2 | 43.7% (tt0) chi angles: 190.4,156.5,1.1 | 0.102Å | - | - |
| A 26 | GLY | 95.65 | 0.498Å H with A 24 ASN C | Allowed (0.27%) Glycine / -156.9,61.9 | - | - | - | - |
| A 27 | LYS | 95.65 | 0.658Å HA with A 24 ASN ND2 | Favored (9.33%) General case / -50.3,-27.7 | 35.1% (ttpt) chi angles: 197.5,170.8,66.9,175.8 | 0.058Å | - | - |
| A 28 | LYS | 95.65 | 0.447Å N with A 26 GLY C | Favored (5.94%) General case / -72.3,108.7 | 58.5% (tttm) chi angles: 181,184.1,177.6,300.5 | 0.033Å | - | - |
| A 29 | ASN | 92.37 | - | Allowed (0.78%) General case / 67.7,56.6 | 3% (m120) chi angles: 277.9,47.9 | 0.04Å | - | - |
| A 30 | GLU | 77.99 | - | Favored (14.98%) General case / -92.8,162.3 | 6.9% (pt-20) chi angles: 64.1,159.9,116.2 | 0.025Å | - | - |
| A 31 | VAL | 62.59 | - | Favored (30.15%) General case / -96.3,142.7 | 56.8% (t) chi angles: 170.8 | 0.034Å | - | - |
| A 32 | PHE | 51.11 | - | Favored (43.87%) General case / -123.4,152.0 | 90.7% (m-85) chi angles: 297.5,104.6 | 0.052Å | - | - |
| A 33 | ASN | 56.64 | 0.41Å OD1 with A 35 TYR HB3 | Favored (10.47%) General case / -161.8,175.4 | 26.6% (p30) chi angles: 55.6,43.9 | 0.007Å | - | - |
| A 34 | ASN | 48.56 | - | Favored (66.84%) General case / -54.0,-38.5 | 80.5% (m-20) chi angles: 300.3,324.3 | 0.041Å | - | - |
| A 35 | TYR | 58.04 | 0.41Å HB3 with A 33 ASN OD1 | Favored (5.05%) General case / -57.2,-12.9 | 7.1% (t80) chi angles: 197,47.5 | 0.031Å | - | - |
| A 36 | THR | 39.18 | 0.442Å HG22 with A 19 LYS HG2 | Favored (82.55%) General case / -60.9,-36.9 | 21% (m) chi angles: 290.2 | 0.092Å | - | - |
| A 37 | PHE | 36.47 | - | Favored (14.17%) General case / -96.3,100.1 | 98% (m-85) chi angles: 296.7,99.1 | 0.037Å | - | - |
| A 38 | ARG | 52.33 | - | Allowed (0.85%) General case / -145.9,-1.4 | 30.7% (ptt-85) chi angles: 65.1,181.8,175.9,288.3 | 0.01Å | - | - |
| A 39 | GLY | 39.71 | - | Favored (6.48%) Glycine / -71.2,113.9 | - | - | - | - |
| A 40 | LEU | 40.04 | - | Favored (5.57%) General case / -96.2,-53.1 | 14.9% (mt) chi angles: 274.6,179.8 | 0.046Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 53.41 | Clashscore: 15.83 | Outliers: 2 of 219 | Outliers: 6 of 212 | Outliers: 1 of 215 | Outliers: 0 of 223 | Outliers: 3 of 223 | ||
| A 41 | GLY | 43.83 | 0.755Å HA2 with A 47 PRO HD3 | Favored (24.48%) Glycine / -149.4,-179.2 | - | - | - | - |
| A 42 | ASN | 46.66 | - | Favored (2.24%) General case / -160.7,119.5 | 55.8% (t30) chi angles: 189,54 | 0.049Å | - | - |
| A 43 | LYS | 56.04 | - | Favored (25.08%) General case / 56.1,39.9 | 55.8% (mttp) chi angles: 293.3,177.8,179.4,52.1 | 0.018Å | - | - |
| A 44 | GLY | 47.29 | - | Favored (79.49%) Glycine / 83.8,-4.1 | - | - | - | - |
| A 45 | VAL | 46.47 | - | Favored (3.96%) General case / -132.4,-177.3 | 17.7% (m) chi angles: 291.6 | 0.017Å | - | - |
| A 46 | LEU | 43.44 | - | Favored (94.05%) Pre-proline / -73.3,137.6 | 93.5% (mt) chi angles: 299.7,177.4 | 0.007Å | - | - |
| A 47 | PRO | 40.63 | 0.755Å HD3 with A 41 GLY HA2 | Favored (99.15%) Proline / -57.6,-32.4 | 52.5% (Cg_exo) chi angles: 336.3 | 0.024Å | - | - |
| A 48 | TRP | 44.83 | 0.743Å O with A 49 LYS HB2 | Favored (46.9%) General case / -96.0,3.0 | 30.3% (p90) chi angles: 49.9,84.5 | 0.108Å | - | - |
| A 49 | LYS | 69.45 | 0.743Å HB2 with A 48 TRP O | OUTLIER (0.03%) General case / 77.2,-80.6 | 16.9% (mttm) chi angles: 293.3,180.3,190.1,343.5 | 0.05Å | - | - |
| A 50 | CYS | 67.44 | - | Favored (34.78%) General case / -147.3,148.6 | 0% chi angles: 121.1 | 0.042Å | - | - |
| A 51 | ASN | 45.03 | - | Favored (4.77%) General case / -142.4,105.9 | 21% (t-20) chi angles: 185.9,288.4 | 0.083Å | - | - |
| A 52 | SER | 38.33 | - | Favored (80.84%) General case / -61.0,-36.1 | 0% chi angles: 10.3 | 0.125Å | - | - |
| A 53 | LEU | 32.28 | - | Favored (81.3%) General case / -67.7,-44.4 | 20.9% (tp) chi angles: 192,69.5 | 0.043Å | - | - |
| A 54 | ASP | 33.34 | - | Favored (86.41%) General case / -64.1,-36.4 | 14.3% (t70) chi angles: 169.6,63.7 | 0.032Å | - | - |
| A 55 | MET | 56.84 | - | Favored (91.34%) General case / -65.8,-43.4 | 52.8% (tpp) chi angles: 185.5,64.2,63.2 | 0.058Å | - | - |
| A 56 | LYS | 44.69 | - | Favored (97.58%) General case / -63.7,-40.3 | 76.9% (tttt) chi angles: 167.7,173.4,178.2,169.4 | 0.048Å | - | - |
| A 57 | TYR | 32.11 | - | Favored (80.3%) General case / -67.3,-45.4 | 84.3% (t80) chi angles: 175.1,82.6 | 0.036Å | - | - |
| A 58 | PHE | 33.94 | - | Favored (87.84%) General case / -59.4,-40.8 | 36.4% (t80) chi angles: 164.5,83.5 | 0.053Å | - | - |
| A 59 | CYS | 54.1 | 0.482Å O with A 63 THR HG23 | Favored (79.29%) General case / -68.7,-43.6 | 42.6% (t) chi angles: 177 | 0.037Å | - | - |
| A 60 | ALA | 38.01 | - | Favored (90.01%) General case / -61.9,-46.7 | - | 0.02Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 53.41 | Clashscore: 15.83 | Outliers: 2 of 219 | Outliers: 6 of 212 | Outliers: 1 of 215 | Outliers: 0 of 223 | Outliers: 3 of 223 | ||
| A 61 | VAL | 33.37 | - | Favored (73.89%) General case / -68.5,-46.6 | 80.7% (t) chi angles: 174.6 | 0.05Å | - | - |
| A 62 | THR | 35.78 | - | Favored (56.87%) General case / -74.7,-11.1 | 75% (p) chi angles: 60 | 0.133Å | - | - |
| A 63 | THR | 43.04 | 0.482Å HG23 with A 59 CYS O | Favored (13.32%) General case / -106.3,-18.7 | 50.7% (p) chi angles: 65.8 | 0.043Å | - | - |
| A 64 | TYR | 40.06 | - | Favored (35.75%) General case / -63.6,129.0 | 89.3% (t80) chi angles: 179.8,79.6 | 0.084Å | - | - |
| A 65 | VAL | 43.21 | 0.505Å HG11 with A 98 LEU HB3 | Favored (48.5%) General case / -134.9,144.8 | 23.8% (t) chi angles: 163.5 | 0.082Å | - | - |
| A 66 | ASN | 55.13 | - | Favored (7.34%) General case / -124.6,99.9 | 29.3% (t-20) chi angles: 179.4,314 | 0.076Å | - | - |
| A 67 | GLU | 73.06 | - | Favored (72.38%) General case / -56.1,-38.5 | 1.9% (mt-10) chi angles: 288.4,233.7,60.8 | 0.065Å | - | - |
| A 68 | SER | 64.25 | - | Favored (62.66%) General case / -66.0,-14.8 | 25% (p) chi angles: 78.6 | 0.016Å | - | - |
| A 69 | LYS | 69.56 | - | Favored (25.61%) General case / -97.0,-10.5 | 91.5% (mttt) chi angles: 290,190.4,181,186.4 | 0.085Å | - | - |
| A 70 | TYR | 69.18 | - | Favored (77.43%) General case / -60.8,-50.1 | 28.6% (t80) chi angles: 180.9,51.7 | 0.064Å | - | - |
| A 71 | GLU | 84.53 | - | Favored (12.61%) General case / -45.3,-49.2 | 35.4% (mt-10) chi angles: 281.3,189.5,46 | 0.019Å | - | - |
| A 72 | LYS | 82.09 | - | Favored (73.31%) General case / -56.3,-38.8 | 5% (ttpm?) chi angles: 179.3,181.1,70.3,250.1 | 0.05Å | - | - |
| A 73 | LEU | 71.61 | - | Favored (66.82%) General case / -74.3,-36.0 | 90.3% (mt) chi angles: 298.4,173.2 | 0.01Å | - | - |
| A 74 | LYS | 74.84 | - | Favored (80.56%) General case / -62.5,-48.9 | 60.4% (tttp) chi angles: 191.9,171.8,175.3,65 | 0.051Å | - | - |
| A 75 | TYR | 83.87 | - | Favored (78.07%) General case / -59.2,-49.8 | 76.2% (t80) chi angles: 173.6,72.2 | 0.055Å | - | - |
| A 76 | LYS | 68.28 | 0.506Å HD3 with A 8 VAL HA | Favored (64.88%) General case / -52.9,-50.2 | 9.5% (ttmt) chi angles: 184.3,230.1,302.8,186.5 | 0.02Å | - | - |
| A 77 | ARG | 65.76 | - | Favored (89.12%) General case / -67.1,-39.9 | 94.3% (mtt180) chi angles: 294.3,165.5,191.8,174 | 0.027Å | - | - |
| A 78 | CYS | 71.08 | - | Favored (36.56%) General case / -61.6,-56.1 | 29.8% (m) chi angles: 281.2 | 0.054Å | - | - |
| A 79 | LYS | 80.39 | - | Favored (46.39%) General case / -50.1,-41.6 | 87.2% (tttt) chi angles: 181.5,183.7,184.6,177.9 | 0.015Å | - | - |
| A 80 | TYR | 71.56 | - | Favored (71.26%) General case / -65.5,-27.9 | 67.8% (t80) chi angles: 170.1,81 | 0.012Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 53.41 | Clashscore: 15.83 | Outliers: 2 of 219 | Outliers: 6 of 212 | Outliers: 1 of 215 | Outliers: 0 of 223 | Outliers: 3 of 223 | ||
| A 81 | LEU | 80.35 | 0.43Å O with A 83 LYS HG2 | Favored (33.08%) General case / -102.1,9.7 | 24.8% (mt) chi angles: 299.3,160.5 | 0.019Å | - | - |
| A 82 | ASN | 89.28 | 0.404Å HB2 with A 81 LEU O | Favored (5.75%) General case / 64.8,14.0 | 70.2% (m-20) chi angles: 286.1,305.8 | 0.006Å | - | - |
| A 83 | LYS | 95.39 | 0.44Å O with A 84 GLU HB3 | Favored (5.05%) General case / -104.5,176.6 | 24.8% (mmtm) chi angles: 319.1,280,182.8,273.9 | 0.097Å | - | - |
| A 84 | GLU | 95.65 | 0.44Å HB3 with A 83 LYS O | Favored (2.63%) General case / -176.7,163.9 | 1% chi angles: 73.4,304.5,313.3 | 0.042Å | - | - |
| A 85 | THR | 95.65 | - | - | 25.9% (m) chi angles: 308.5 | 0.043Å | - | - |
| A 96 | LYS | 82.53 | 0.45Å HB3 with A 97 LYS H | - | 1.2% (mptm?) chi angles: 268,63.2,190.1,301.7 | 0.015Å | - | - |
| A 97 | LYS | 78.25 | 0.45Å H with A 96 LYS HB3 | Favored (34.72%) General case / -80.9,140.4 | 86% (tttt) chi angles: 188.2,179.7,183.2,181.2 | 0.083Å | - | - |
| A 98 | LEU | 57.15 | 0.505Å HB3 with A 65 VAL HG11 | Favored (52.49%) General case / -59.8,137.5 | 20.3% (tp) chi angles: 192.5,56.3 | 0.035Å | - | - |
| A 99 | GLN | 41.92 | 0.438Å HG3 with A 97 LYS O | Favored (32.53%) General case / -140.8,164.6 | 82.3% (mt-30) chi angles: 302.6,186.3,326.3 | 0.071Å | - | - |
| A 100 | ASN | 42.57 | 0.493Å OD1 with A 159 TYR HB3 | Favored (11.04%) General case / -95.5,167.7 | 80.2% (m-20) chi angles: 291.3,309.6 | 0.121Å | - | - |
| A 101 | VAL | 33.88 | - | Favored (49.58%) General case / -113.1,140.5 | 46.4% (t) chi angles: 168 | 0.127Å | - | - |
| A 102 | VAL | 33.49 | - | Favored (62.74%) General case / -124.7,130.4 | 17.6% (m) chi angles: 291.6 | 0.024Å | - | - |
| A 103 | VAL | 34.23 | - | Favored (62.34%) General case / -117.7,126.5 | 48.8% (t) chi angles: 182.6 | 0.086Å | - | - |
| A 104 | MET | 39.31 | - | Favored (36.93%) General case / -138.9,163.8 | 10% (ptp) chi angles: 74.6,198.6,84.4 | 0.058Å | - | - |
| A 105 | GLY | 38.1 | - | Favored (36.99%) Glycine / -86.5,159.3 | - | - | - | - |
| A 106 | ARG | 51.27 | 0.741Å HH11 with A 106 ARG HG2 | Favored (68.06%) General case / -52.9,-45.3 | 29% (ttp85) chi angles: 188.9,194.1,66.5,54.1 | 0.014Å | - | - |
| A 107 | THR | 40.17 | - | Favored (91.9%) General case / -60.7,-40.3 | 28.6% (m) chi angles: 307.6 | 0.038Å | - | - |
| A 108 | SER | 48.26 | - | Favored (95.28%) General case / -65.5,-40.8 | 74.6% (m) chi angles: 294.2 | 0.027Å | - | - |
| A 109 | TRP | 37.54 | 0.551Å CE2 with A 117 LYS HD2 | Favored (87.23%) General case / -58.7,-42.0 | 22% (t-105) chi angles: 164.2,266.5 | 0.035Å | - | - |
| A 110 | GLU | 53.16 | 0.428Å HG3 with A 106 ARG O | Favored (62.91%) General case / -72.8,-16.9 | 42.4% (mt-10) chi angles: 307.8,192.7,138.4 | 0.04Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 53.41 | Clashscore: 15.83 | Outliers: 2 of 219 | Outliers: 6 of 212 | Outliers: 1 of 215 | Outliers: 0 of 223 | Outliers: 3 of 223 | ||
| A 111 | SER | 45.49 | - | Favored (51.84%) General case / -83.8,-11.2 | 78.1% (p) chi angles: 59 | 0.029Å | - | - |
| A 112 | ILE | 45.7 | 0.41Å HA with A 113 PRO HD3 | Favored (64.17%) Pre-proline / -85.0,134.6 | 72% (mt) chi angles: 303.1,173.7 | 0.039Å | - | - |
| A 113 | PRO | 47.35 | 0.41Å HD3 with A 112 ILE HA | Favored (63.95%) Proline / -63.4,136.2 | 87.3% (Cg_exo) chi angles: 331.3 | 0.034Å | - | - |
| A 114 | LYS | 70.11 | - | Allowed (1.06%) General case / -36.1,-47.6 | 19.4% (tttp) chi angles: 189.5,211.5,188.7,70.5 | 0.02Å | - | - |
| A 115 | LYS | 64.12 | 0.466Å HE3 with A 116 PHE CZ | Favored (14.96%) General case / -62.6,-9.5 | 62.3% (pttt) chi angles: 61,173.7,179.3,177.8 | 0.076Å | - | - |
| A 116 | PHE | 56.52 | 0.466Å CZ with A 115 LYS HE3 | Favored (16.82%) General case / -107.7,-5.2 | 31.6% (m-85) chi angles: 295.4,127.8 | 0.014Å | - | - |
| A 117 | LYS | 48.86 | 0.551Å HD2 with A 109 TRP CE2 | Favored (23.91%) Pre-proline / -102.4,135.0 | 58% (mtmt) chi angles: 291.1,184.5,293.9,188.1 | 0.047Å | - | - |
| A 118 | PRO | 41.59 | - | Favored (41.2%) Proline / -77.2,155.2 | 84% (Cg_endo) chi angles: 31.4 | 0.026Å | - | - |
| A 119 | LEU | 38.03 | - | Favored (23.94%) General case / -54.3,128.1 | 65.1% (mt) chi angles: 303.2,172.4 | 0.016Å | - | - |
| A 120 | SER | 42.17 | - | Favored (44.45%) General case / -60.6,143.3 | 54.1% (p) chi angles: 55 | 0.027Å | - | - |
| A 121 | ASN | 46.47 | - | Favored (8.68%) General case / 57.6,23.9 | 35.2% (m120) chi angles: 300.9,111.6 | 0.019Å | - | - |
| A 122 | ARG | 35.89 | - | Favored (43.28%) General case / -139.9,145.3 | 63.6% (mtm180) chi angles: 287.6,155.1,283.8,184.3 | 0.028Å | - | - |
| A 123 | ILE | 33.14 | - | Favored (18.44%) General case / -82.1,111.9 | 81.3% (mt) chi angles: 294.8,164.3 | 0.115Å | - | - |
| A 124 | ASN | 35.77 | 0.519Å HD22 with A 124 ASN N | Favored (38.84%) General case / -85.3,132.6 | 0.9% chi angles: 296.6,227.8 | 0.028Å | - | - |
| A 125 | VAL | 36.44 | - | Favored (60.22%) General case / -128.1,132.0 | 60.5% (t) chi angles: 181.2 | 0.044Å | - | - |
| A 126 | ILE | 40.03 | - | Favored (63.36%) General case / -122.7,132.3 | 39.2% (mt) chi angles: 309.8,169.7 | 0.052Å | - | - |
| A 127 | LEU | 42.4 | 0.97Å HD23 with A 143 ILE HG13 | Favored (43.92%) General case / -93.0,129.6 | 38.6% (mt) chi angles: 281.8,168.2 | 0.069Å | - | - |
| A 128 | SER | 46.34 | - | Favored (12.58%) General case / -163.9,151.2 | 22.6% (t) chi angles: 186.5 | 0.028Å | - | - |
| A 129 | ARG | 57.03 | - | Favored (3.2%) General case / -116.2,-41.4 | 59.6% (mtt85) chi angles: 290.8,189.6,196.8,83 | 0.06Å | - | - |
| A 130 | THR | 51.43 | - | Favored (59.61%) General case / -74.3,-21.4 | 6.9% (p) chi angles: 79.2 | 0.057Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 53.41 | Clashscore: 15.83 | Outliers: 2 of 219 | Outliers: 6 of 212 | Outliers: 1 of 215 | Outliers: 0 of 223 | Outliers: 3 of 223 | ||
| A 131 | LEU | 47.4 | - | Favored (35.97%) General case / -119.3,152.6 | 79.8% (mt) chi angles: 300.7,182 | 0.025Å | - | - |
| A 132 | LYS | 58.71 | - | Favored (12.35%) General case / -127.3,172.6 | 56.3% (mttm) chi angles: 293.2,164.1,173.6,299.6 | 0.058Å | - | - |
| A 133 | LYS | 56.8 | - | Favored (34.97%) General case / -53.7,-28.4 | 22.1% (pttm) chi angles: 68.8,165,189.4,296.4 | 0.054Å | - | - |
| A 134 | GLU | 59.29 | - | Favored (68.42%) General case / -67.0,-23.7 | 18.5% (mp0) chi angles: 290.6,70.5,48.2 | 0.068Å | - | - |
| A 135 | ASP | 51.78 | - | Favored (46.22%) General case / -83.8,-2.3 | 45.9% (m-20) chi angles: 300.9,115.2 | 0.032Å | - | - |
| A 136 | PHE | 38.07 | - | Favored (55.97%) General case / -118.2,138.4 | 88.6% (m-85) chi angles: 296.2,83.1 | 0.054Å | - | - |
| A 137 | ASP | 42.37 | - | Favored (18.66%) General case / -94.0,-23.6 | 21.9% (t0) chi angles: 181.2,42.4 | 0.086Å | - | - |
| A 138 | GLU | 44.02 | - | Favored (32.89%) General case / -72.9,157.1 | 39.9% (mp0) chi angles: 306.4,86.1,1.1 | 0.054Å | - | - |
| A 139 | ASP | 36.81 | - | Favored (3.82%) General case / -76.8,89.8 | 46.2% (t0) chi angles: 175.7,170.1 | 0.111Å | - | - |
| A 140 | VAL | 35.72 | - | Favored (32.17%) General case / -148.5,162.2 | 18% (m) chi angles: 304.6 | 0.066Å | - | - |
| A 141 | TYR | 38.26 | - | Favored (56.64%) General case / -108.2,134.4 | 76.6% (m-85) chi angles: 287.1,87.7 | 0.144Å | - | - |
| A 142 | ILE | 45 | - | Favored (54.31%) General case / -110.6,137.1 | 27.4% (mm) chi angles: 306.9,309.8 | 0.082Å | - | - |
| A 143 | ILE | 44.33 | 0.97Å HG13 with A 127 LEU HD23 | Favored (44.5%) General case / -137.7,141.9 | 27.7% (pt) chi angles: 55.1,177.9 | 0.022Å | - | - |
| A 144 | ASN | 54.67 | - | Favored (25.23%) General case / -108.2,11.9 | 51.1% (p-10) chi angles: 65.4,359.9 | 0.006Å | - | - |
| A 145 | LYS | 60.41 | - | Favored (16.67%) General case / -153.0,139.7 | 20.8% (mtmm) chi angles: 265.5,180.4,287.6,294.7 | 0.1Å | - | - |
| A 146 | VAL | 49.74 | - | Favored (81.27%) General case / -59.2,-38.4 | 78.9% (t) chi angles: 174.4 | 0.052Å | - | - |
| A 147 | GLU | 61.39 | - | Favored (68.68%) General case / -57.2,-33.4 | 2.2% (mp0) chi angles: 304.1,88.3,101.9 | 0.027Å | - | - |
| A 148 | ASP | 60.09 | - | Favored (67.02%) General case / -68.9,-24.1 | 81.5% (m-20) chi angles: 291.2,148.2 | 0.056Å | - | - |
| A 149 | LEU | 45.69 | - | Favored (83.37%) General case / -67.5,-43.8 | 24.9% (tp) chi angles: 165.8,64.3 | 0.065Å | - | - |
| A 150 | ILE | 43.71 | 0.41Å HD12 with A 5 VAL HG11 | Favored (97.25%) General case / -61.3,-43.9 | 21.3% (mm) chi angles: 311.7,308.5 | 0.019Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 53.41 | Clashscore: 15.83 | Outliers: 2 of 219 | Outliers: 6 of 212 | Outliers: 1 of 215 | Outliers: 0 of 223 | Outliers: 3 of 223 | ||
| A 151 | VAL | 45.94 | - | Favored (87.54%) General case / -59.8,-47.0 | 98.9% (t) chi angles: 176.5 | 0.02Å | - | - |
| A 152 | LEU | 44.99 | - | Favored (84.7%) General case / -58.1,-46.5 | 63.3% (tp) chi angles: 179.3,63.7 | 0.024Å | - | - |
| A 153 | LEU | 48.88 | 0.414Å HD23 with A 153 LEU HA | Favored (66.82%) General case / -56.1,-33.7 | 65.8% (mt) chi angles: 292.5,182.5 | 0.016Å | - | - |
| A 154 | GLY | 50.42 | - | Favored (70.77%) Glycine / -67.5,-22.7 | - | - | - | - |
| A 155 | LYS | 57.41 | - | Favored (17.91%) General case / -94.4,-24.7 | 89.7% (mttt) chi angles: 294.7,170.5,179,165.8 | 0.036Å | - | - |
| A 156 | LEU | 54.18 | - | Favored (19.41%) General case / -86.9,157.7 | 81.5% (mt) chi angles: 297.6,170.1 | 0.017Å | - | - |
| A 157 | ASN | 57.05 | - | Favored (25.01%) General case / -108.2,108.8 | 84.8% (m-20) chi angles: 288.7,319.8 | 0.117Å | - | - |
| A 158 | TYR | 48.53 | - | Favored (21.11%) General case / -146.9,168.7 | 24.1% (p90) chi angles: 67.6,104.4 | 0.048Å | - | - |
| A 159 | TYR | 44.17 | 0.636Å CE2 with A 160 LYS HE3 | Allowed (0.63%) General case / -89.8,-74.9 | 43.5% (t80) chi angles: 186.1,60.5 | 0.067Å | - | - |
| A 160 | LYS | 45.11 | 0.636Å HE3 with A 159 TYR CE2 | Favored (33.92%) General case / -128.1,162.4 | 94.8% (mttt) chi angles: 298.3,177.5,177.6,187.6 | 0.028Å | - | - |
| A 161 | CYS | 35.24 | - | Favored (44.33%) General case / -119.2,117.8 | 31.8% (t) chi angles: 173.1 | 0.044Å | - | - |
| A 162 | PHE | 33.06 | - | Favored (60.76%) General case / -108.0,125.9 | 94% (m-85) chi angles: 291.9,96.4 | 0.042Å | - | - |
| A 163 | ILE | 35.57 | - | Favored (29.9%) General case / -88.0,118.4 | 25.9% (mm) chi angles: 300.1,311 | 0.139Å | - | 1 OUTLIER(S) worst is N-CA-C: -4.221 σ |
| A 164 | ILE | 33.21 | - | Favored (16.11%) General case / -109.2,21.2 | 16.7% (pt) chi angles: 69.7,182.1 | 0.1Å | - | - |
| A 165 | GLY | 35.68 | - | Favored (19.21%) Glycine / 112.8,176.5 | - | - | - | - |
| A 166 | GLY | 35.59 | - | Favored (10.33%) Glycine / -89.4,-142.3 | - | - | - | - |
| A 167 | SER | 46.33 | - | Favored (97.94%) General case / -64.2,-42.1 | 53.3% (p) chi angles: 74.5 | 0.047Å | - | - |
| A 168 | VAL | 41.12 | - | Favored (90.98%) General case / -66.3,-42.3 | 53.1% (t) chi angles: 170.4 | 0.043Å | - | - |
| A 169 | VAL | 39.1 | 0.523Å O with A 173 PHE HD1 | Favored (96.18%) General case / -63.0,-44.8 | 66.3% (t) chi angles: 179.7 | 0.025Å | - | - |
| A 170 | TYR | 43.13 | - | Favored (84.42%) General case / -59.9,-48.0 | 29.9% (m-85) chi angles: 290.8,127.5 | 0.121Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 53.41 | Clashscore: 15.83 | Outliers: 2 of 219 | Outliers: 6 of 212 | Outliers: 1 of 215 | Outliers: 0 of 223 | Outliers: 3 of 223 | ||
| A 171 | GLN | 63.26 | 0.517Å O with A 175 GLU HG3 | Favored (38.14%) General case / -49.2,-48.5 | 20.1% (tm0?) chi angles: 201.6,279.7,336.2 | 0.042Å | - | - |
| A 172 | GLU | 65.88 | 0.449Å O with A 176 LYS HG3 | Favored (58.25%) General case / -76.7,-28.8 | 11.2% (pt-20) chi angles: 64.7,200,135.4 | 0.084Å | - | - |
| A 173 | PHE | 47.25 | 0.523Å HD1 with A 169 VAL O | Favored (70.49%) General case / -71.5,-32.3 | 32.8% (m-85) chi angles: 277.8,81.3 | 0.036Å | - | - |
| A 174 | LEU | 51.09 | - | Favored (55.84%) General case / -72.9,-47.6 | 57.6% (mt) chi angles: 286.2,165.8 | 0.035Å | - | - |
| A 175 | GLU | 70.85 | 0.517Å HG3 with A 171 GLN O | Favored (77.04%) General case / -58.7,-37.1 | 60.1% (mt-10) chi angles: 295.6,195.9,148.1 | 0.088Å | - | - |
| A 176 | LYS | 69.4 | 0.449Å HG3 with A 172 GLU O | Favored (25.07%) General case / -84.8,5.5 | 51.6% (mttm) chi angles: 301.8,188.5,191.3,281.5 | 0.025Å | - | - |
| A 177 | LYS | 63.08 | - | Favored (21.65%) General case / 52.3,45.5 | 27.4% (mttm) chi angles: 313.3,207.1,187.2,311.6 | 0.028Å | - | - |
| A 178 | LEU | 55.18 | 0.407Å HA with A 6 CYS HB3 | Favored (37.11%) General case / -98.5,-1.1 | 43.3% (mt) chi angles: 293.9,162.2 | 0.037Å | - | - |
| A 179 | ILE | 49.85 | - | Favored (48.96%) General case / -97.5,123.9 | 32% (mm) chi angles: 310.6,301.7 | 0.025Å | - | - |
| A 180 | LYS | 58.41 | - | Favored (19.51%) General case / -91.7,-26.7 | 74.7% (tttt) chi angles: 169,173.6,164.8,173.7 | 0.09Å | - | - |
| A 181 | LYS | 42.4 | 0.625Å HB2 with A 12 TYR HD1 | Favored (20.06%) General case / -158.7,151.2 | 82.6% (mttt) chi angles: 279.2,190.2,177.5,171.2 | 0.149Å | - | - |
| A 182 | ILE | 39.69 | - | Favored (28.63%) General case / -123.2,114.6 | 54.6% (mt) chi angles: 307.1,174.7 | 0.11Å | - | - |
| A 183 | TYR | 36.25 | - | Favored (14.18%) General case / -90.7,100.6 | 86.3% (m-85) chi angles: 289.9,94.9 | 0.104Å | - | - |
| A 184 | PHE | 32.41 | - | Favored (52.8%) General case / -105.5,119.0 | 8% (t80) chi angles: 200.9,104.9 | 0.122Å | - | - |
| A 185 | THR | 31.66 | 0.482Å HB with A 16 ALA HA | Favored (47.38%) General case / -95.2,127.7 | 25.6% (m) chi angles: 291.6 | 0.11Å | - | - |
| A 186 | ARG | 30.66 | - | Favored (28.01%) General case / -102.4,110.6 | 74.8% (mtm180) chi angles: 297.1,186.1,295.7,192.1 | 0.036Å | - | - |
| A 187 | ILE | 33.92 | - | Favored (20.73%) General case / -90.8,106.7 | 13.2% (mm) chi angles: 302.3,283.6 | 0.149Å | - | - |
| A 188 | ASN | 35.04 | - | Favored (4.3%) General case / -82.0,61.9 | 59.2% (t30) chi angles: 192.5,21.3 | 0.116Å | - | - |
| A 189 | SER | 42.07 | - | Favored (29.38%) General case / -158.8,161.8 | 3.6% (p) chi angles: 40.9 | 0.056Å | - | - |
| A 190 | THR | 40.92 | - | Favored (32.01%) General case / -102.2,143.1 | 11.6% (m) chi angles: 312.7 | 0.035Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 53.41 | Clashscore: 15.83 | Outliers: 2 of 219 | Outliers: 6 of 212 | Outliers: 1 of 215 | Outliers: 0 of 223 | Outliers: 3 of 223 | ||
| A 191 | TYR | 43.47 | - | Favored (31.91%) General case / -150.9,162.7 | 25.1% (m-85) chi angles: 310.5,82.2 | 0.067Å | - | - |
| A 192 | GLU | 61.27 | - | Favored (41.61%) General case / -72.9,130.2 | 33.7% (tt0) chi angles: 175.3,178.1,118.8 | 0.101Å | - | - |
| A 193 | CYS | 47.61 | - | Favored (48.81%) General case / -139.4,154.0 | 51.3% (m) chi angles: 306.8 | 0.065Å | - | - |
| A 194 | ASP | 51.87 | - | Favored (5.27%) General case / -123.3,-18.7 | 12.4% (p30) chi angles: 50.6,34.3 | 0.099Å | - | - |
| A 195 | VAL | 46.36 | - | Favored (48.34%) General case / -125.6,150.5 | 23.7% (m) chi angles: 293.3 | 0.06Å | - | - |
| A 196 | PHE | 44.44 | - | Favored (41.82%) General case / -134.9,162.5 | 15.6% (m-85) chi angles: 315.6,94.9 | 0.068Å | - | - |
| A 197 | PHE | 45.12 | - | Favored (74.43%) Pre-proline / -81.3,150.4 | 32.8% (t80) chi angles: 195.6,72.7 | 0.095Å | - | - |
| A 198 | PRO | 51.52 | - | Favored (63.93%) Proline / -71.9,149.9 | 36.7% (Cg_exo) chi angles: 340.8 | 0.027Å | - | - |
| A 199 | GLU | 68.61 | - | Favored (23.59%) General case / -62.8,125.2 | 10.3% (tt0) chi angles: 170.1,149.1,43 | 0.072Å | - | - |
| A 200 | ILE | 61.65 | - | Favored (40.25%) General case / -82.6,131.9 | 73.5% (mt) chi angles: 293.1,177.2 | 0.023Å | - | - |
| A 201 | ASN | 67.41 | 0.47Å OD1 with A 203 ASN HB2 | Favored (21.95%) General case / -80.4,116.5 | 31.7% (t-20) chi angles: 186.1,304.8 | 0.037Å | - | - |
| A 202 | GLU | 79.23 | - | Favored (36.39%) General case / -61.2,-15.5 | 1.6% (tp10) chi angles: 201.7,70.9,133.9 | 0.006Å | - | - |
| A 203 | ASN | 71.9 | 0.47Å HB2 with A 201 ASN OD1 | Favored (29.56%) General case / -89.6,-16.1 | 71.4% (m-20) chi angles: 287.1,304.6 | 0.012Å | - | - |
| A 204 | GLU | 77.82 | - | Favored (10.61%) General case / -100.7,-30.6 | 50% (mt-10) chi angles: 286.6,181.7,46.2 | 0.088Å | - | - |
| A 205 | TYR | 52.47 | - | Favored (47.06%) General case / -135.3,138.1 | 75.1% (m-85) chi angles: 288.9,101.6 | 0.069Å | - | - |
| A 206 | GLN | 63.98 | - | Favored (51.44%) General case / -133.0,139.3 | 9.7% (pt20) chi angles: 77.4,169.7,52.1 | 0.029Å | - | - |
| A 207 | ILE | 41.31 | - | Favored (32.82%) General case / -67.9,127.9 | 98.3% (mt) chi angles: 296.9,171.4 | 0.069Å | - | - |
| A 208 | ILE | 45.56 | 0.609Å HD13 with A 227 LYS HD2 | Favored (11.1%) General case / -114.7,-8.9 | 16.3% (pt) chi angles: 48.9,166.9 | 0.041Å | - | - |
| A 209 | SER | 39.65 | - | Favored (13.79%) General case / -158.7,144.5 | 53.1% (m) chi angles: 300 | 0.029Å | - | - |
| A 210 | VAL | 36.74 | - | Favored (41.11%) General case / -136.2,133.9 | 22.7% (m) chi angles: 302.7 | 0.037Å | - | - |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 53.41 | Clashscore: 15.83 | Outliers: 2 of 219 | Outliers: 6 of 212 | Outliers: 1 of 215 | Outliers: 0 of 223 | Outliers: 3 of 223 | ||
| A 211 | SER | 28.81 | - | Favored (4.35%) General case / -87.7,-174.5 | 58.7% (p) chi angles: 72.9 | 0.071Å | - | - |
| A 212 | ASP | 35.03 | - | Favored (14.83%) General case / -71.4,168.1 | 64.1% (t0) chi angles: 185.7,1 | 0.143Å | - | - |
| A 213 | VAL | 26.25 | - | Favored (30.43%) General case / -103.3,144.7 | 68.3% (t) chi angles: 171.6 | 0.016Å | - | - |
| A 214 | TYR | 30.61 | 0.489Å O with A 220 THR HA | Favored (22.68%) General case / -136.1,169.4 | 36.9% (m-85) chi angles: 308.2,82.7 | 0.133Å | - | - |
| A 215 | THR | 32.44 | - | Favored (62.84%) General case / -125.1,132.8 | 2.7% (m) chi angles: 281.5 | 0.035Å | - | - |
| A 216 | SER | 32.9 | - | Favored (5.72%) General case / -159.3,130.7 | 41.1% (t) chi angles: 177.2 | 0.043Å | - | - |
| A 217 | ASN | 35.86 | - | Favored (14.57%) General case / 56.3,49.0 | 9.8% (m120) chi angles: 303.9,78.7 | 0.022Å | - | - |
| A 218 | ASN | 52.82 | - | Favored (15.67%) General case / 60.4,30.7 | 73.8% (m-20) chi angles: 289.5,303.7 | 0.089Å | - | - |
| A 219 | THR | 34.38 | - | Favored (25.67%) General case / -156.3,153.5 | 6.8% (t) chi angles: 178.2 | 0.049Å | - | - |
| A 220 | THR | 30.16 | 0.489Å HA with A 214 TYR O | Favored (13.95%) General case / -93.6,164.0 | 33.6% (p) chi angles: 52 | 0.081Å | - | - |
| A 221 | LEU | 29.77 | - | Favored (10.42%) General case / -168.5,158.4 | 2.1% (pt?) chi angles: 66.7,158.3 | 0.108Å | - | - |
| A 222 | ASP | 32.74 | - | Favored (14%) General case / -144.4,173.1 | 52.5% (p30) chi angles: 67.2,9.3 | 0.118Å | - | - |
| A 223 | PHE | 29.37 | - | Favored (61.38%) General case / -126.1,130.2 | 29.8% (m-85) chi angles: 311.6,92.1 | 0.085Å | - | - |
| A 224 | ILE | 32.69 | - | Favored (39.53%) General case / -126.9,159.8 | 36% (pt) chi angles: 67.4,172.4 | 0.049Å | - | - |
| A 225 | ILE | 37.71 | - | Favored (56.09%) General case / -125.4,123.8 | 70.8% (mt) chi angles: 303.2,174.2 | 0.08Å | - | - |
| A 226 | TYR | 45.07 | - | Favored (36.13%) General case / -99.4,139.8 | 66.9% (m-85) chi angles: 285.4,85.5 | 0.113Å | - | - |
| A 227 | LYS | 61.1 | 0.609Å HD2 with A 208 ILE HD13 | Favored (54.47%) General case / -117.5,139.4 | 77.5% (tttt) chi angles: 196,167.1,180.2,178.6 | 0.029Å | - | - |
| A 228 | LYS | 66.7 | - | Favored (4.35%) General case / -58.3,116.2 | 24.3% (tptp) chi angles: 188.6,71.1,165.8,77.7 | 0.128Å | - | - |
| A 229 | THR | 77.97 | - | Favored (55.27%) General case / -63.1,136.5 | 6.6% (p) chi angles: 42.6 | 0.094Å | - | - |
| A 230 | ASN | 93.76 | - | Favored (10.47%) General case / -54.9,122.5 | 41.7% (m-20) chi angles: 312,306.2 | 0.243Å | - | 1 OUTLIER(S) worst is N-CA-C: -4.017 σ |
| # | Res | High B | Clash > 0.4Å | Ramachandran | Rotamer | Cβ deviation | Bond lengths. | Bond angles. |
| Avg: 53.41 | Clashscore: 15.83 | Outliers: 2 of 219 | Outliers: 6 of 212 | Outliers: 1 of 215 | Outliers: 0 of 223 | Outliers: 3 of 223 | ||
| A 231 | ASN | 95.65 | - | OUTLIER (0.02%) General case / -28.4,-33.2 | 5% (p30) chi angles: 76.3,97.4 | 0.279Å | - | 1 OUTLIER(S) worst is N-CA-C: 6.434 σ |
| A 232 | LYS | 95.65 | 0.414Å O with A 233 MET C | Favored (5.13%) General case / -97.3,87.2 | 48.9% (mttp) chi angles: 309.3,176.9,187.6,58.3 | 0.037Å | - | - |
| A 233 | MET | 95.65 | 0.414Å C with A 232 LYS O | - | 3.7% (mpp?) chi angles: 298.5,72.2,93.4 | 0.053Å | - | - |