#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nqb n ARG 1430N 0.00 0.00 0.00 1.64 1.74 -1.26 -5.08 116.66 113.70 2nqb n ARG 1430Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2nqb n ARG 1430Cb 0.00 -0.35 0.00 0.00 -1.02 0.00 0.00 32.46 31.09 2nqb n ARG 1430CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2nqb n LYS 1431N 0.86 0.00 -2.65 5.56 5.02 -1.26 -5.18 118.16 120.51 2nqb n LYS 1431Ca -0.01 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.94 2nqb n LYS 1431Cb 0.24 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.20 2nqb n LYS 1431CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2nqb s GLU 1432N 0.00 4.04 0.17 1.97 2.02 -1.26 -5.07 118.70 120.57 2nqb s GLU 1432Ca 0.00 1.30 -0.24 0.00 0.02 0.00 0.00 54.97 56.05 2nqb s GLU 1432Cb 0.00 -2.23 0.06 0.00 0.10 0.00 0.00 34.13 32.06 2nqb s GLU 1432CO 0.00 -0.22 0.81 -1.54 0.02 0.00 0.00 175.26 174.34 2nqb s SER 1433N -1.97 -0.30 0.00 -0.19 1.04 -1.26 -5.04 113.70 105.99 2nqb s SER 1433Ca 0.63 -0.34 0.19 0.00 0.48 0.00 0.00 55.95 56.92 2nqb s SER 1433Cb -0.15 0.57 0.53 0.00 0.10 0.00 0.00 66.02 67.07 2nqb s SER 1433CO 0.19 -1.01 1.44 -1.22 0.98 0.00 0.00 173.24 173.61 2nqb n TYR 1434N -0.42 0.50 -0.27 5.02 4.02 -1.26 -4.63 117.16 120.12 2nqb n TYR 1434Ca -0.08 -0.25 0.05 0.00 -0.01 0.00 0.00 57.90 57.62 2nqb n TYR 1434Cb 0.61 0.00 0.16 0.00 -0.02 0.00 0.00 39.34 40.09 2nqb n TYR 1434CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2nqb h ALA 1435N 4.14 0.77 -0.61 -0.72 0.00 -1.96 -0.24 119.26 120.63 2nqb h ALA 1435Ca 0.00 0.26 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 2nqb h ALA 1435Cb 0.72 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 2nqb h ALA 1435CO 0.00 -0.43 0.06 -0.84 0.00 0.00 0.00 179.25 178.04 2nqb h ILE 1436N 0.08 1.26 -0.11 0.00 3.07 -2.00 -0.54 117.51 119.26 2nqb h ILE 1436Ca 0.42 -1.05 -0.18 0.00 1.55 0.00 0.00 64.86 65.60 2nqb h ILE 1436Cb 0.74 0.72 -0.00 0.00 -0.27 0.00 0.00 36.82 38.00 2nqb h ILE 1436CO -0.71 0.39 -0.67 1.88 -1.05 0.00 0.00 178.15 177.99 2nqb h TYR 1437N 0.95 0.60 -0.29 0.16 -1.99 -1.71 -1.56 116.97 113.13 2nqb h TYR 1437Ca 0.18 -0.25 -0.02 0.00 2.00 0.00 0.00 58.73 60.64 2nqb h TYR 1437Cb 0.46 -0.10 -0.01 0.00 2.00 0.00 0.00 36.73 39.08 2nqb h TYR 1437CO 0.03 0.99 0.09 0.82 -0.00 0.00 0.00 178.16 180.10 2nqb h ILE 1438N 0.33 1.20 -0.38 -2.88 2.04 -0.84 -0.97 117.51 116.00 2nqb h ILE 1438Ca -0.02 -0.64 0.02 0.00 1.00 0.00 0.00 64.86 65.23 2nqb h ILE 1438Cb 1.23 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 38.35 2nqb h ILE 1438CO 0.12 0.21 0.20 0.22 0.00 0.00 0.00 178.15 178.90 2nqb h TYR 1439N 0.32 0.37 -0.67 1.37 3.20 -1.01 0.51 116.97 121.07 2nqb h TYR 1439Ca 0.10 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.00 2nqb h TYR 1439Cb 0.24 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.36 2nqb h TYR 1439CO 0.00 0.20 0.42 1.15 -1.64 0.00 0.00 178.16 178.30 2nqb h THR 1440N 0.41 1.12 -0.30 1.81 2.02 -1.09 -0.99 112.91 115.89 2nqb h THR 1440Ca 0.16 -0.29 -0.06 0.00 0.77 0.00 0.00 66.41 66.99 2nqb h THR 1440Cb 0.05 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.64 2nqb h THR 1440CO -0.10 0.15 -0.08 0.58 0.37 0.00 0.00 175.52 176.44 2nqb h VAL 1441N 0.84 1.21 -0.97 3.16 2.07 -0.71 -2.54 116.25 119.31 2nqb h VAL 1441Ca 0.26 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.87 2nqb h VAL 1441Cb -0.02 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.78 2nqb h VAL 1441CO -0.09 0.30 0.62 0.25 0.02 0.00 0.00 177.57 178.67 2nqb h LEU 1442N 0.45 1.14 -1.00 2.57 5.85 0.40 -2.56 115.31 122.16 2nqb h LEU 1442Ca 0.09 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 2nqb h LEU 1442Cb 0.42 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 2nqb h LEU 1442CO 0.02 0.85 -0.18 0.11 -0.34 0.00 0.00 178.44 178.90 2nqb h LYS 1443N 1.33 0.00 -0.10 1.25 1.79 -0.94 0.25 116.57 120.14 2nqb h LYS 1443Ca 0.35 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.60 2nqb h LYS 1443Cb -0.11 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.55 2nqb h LYS 1443CO -0.07 0.18 -0.82 1.96 -1.08 0.00 0.00 179.45 179.62 2nqb h GLN 1444N 0.00 0.66 0.23 3.15 4.20 -1.31 -2.34 115.11 119.70 2nqb h GLN 1444Ca -0.00 -0.57 -0.33 0.00 0.06 0.00 0.00 58.65 57.80 2nqb h GLN 1444Cb 0.77 0.13 0.03 0.00 0.30 0.00 0.00 27.48 28.71 2nqb h GLN 1444CO 0.02 1.19 -1.52 0.28 -0.67 0.00 0.00 178.83 178.13 2nqb h VAL 1445N 0.43 1.21 -2.41 -0.54 2.07 -1.32 -3.42 116.25 112.26 2nqb h VAL 1445Ca -0.06 -2.64 -0.57 0.00 0.82 0.00 0.00 66.70 64.25 2nqb h VAL 1445Cb 1.44 2.99 -0.38 0.00 -1.52 0.00 0.00 31.29 33.82 2nqb h VAL 1445CO 0.16 0.82 -0.90 -1.00 0.02 0.00 0.00 177.57 176.66 2nqb s HIS 1446N -2.58 0.80 0.55 1.57 3.76 0.85 -5.00 115.29 115.24 2nqb s HIS 1446Ca -0.11 -1.91 0.29 0.00 -0.15 0.00 0.00 55.06 53.18 2nqb s HIS 1446Cb 0.04 -0.86 1.46 0.00 1.11 0.00 0.00 32.58 34.33 2nqb s HIS 1446CO 0.92 -0.84 1.92 -1.35 -0.85 0.00 0.00 174.74 174.53 2nqb h PRO 1447N 6.29 0.00 -0.36 8.40 0.11 -1.60 -1.98 132.00 142.87 2nqb h PRO 1447Ca 0.16 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.27 2nqb h PRO 1447Cb 0.95 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.05 2nqb h PRO 1447CO 0.31 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 177.85 2nqb n ASP 1448N -4.13 4.43 -4.52 -2.05 8.00 -1.26 -4.93 116.55 112.10 2nqb n ASP 1448Ca 0.13 -3.01 -0.33 0.00 0.71 0.00 0.00 54.79 52.30 2nqb n ASP 1448Cb 0.79 -0.59 -0.12 0.00 -0.02 0.00 0.00 41.12 41.18 2nqb n ASP 1448CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2nqb s THR 1449N -2.82 3.28 0.57 -3.53 2.01 -0.74 -5.13 115.64 109.28 2nqb s THR 1449Ca 0.46 -0.70 0.07 0.00 0.31 0.00 0.00 61.69 61.83 2nqb s THR 1449Cb 0.37 -2.32 0.07 0.00 0.01 0.00 0.00 72.50 70.62 2nqb s THR 1449CO 0.11 0.55 0.59 -0.83 -0.69 0.00 0.00 174.62 174.35 2nqb s GLY 1450N -0.89 2.10 -0.12 4.40 0.00 -1.26 -4.86 107.32 106.68 2nqb s GLY 1450Ca 0.13 -1.61 -0.07 0.00 0.00 0.00 0.00 44.72 43.16 2nqb s GLY 1450CO 0.02 -1.85 0.30 -1.50 0.00 0.00 0.00 173.10 170.06 2nqb s ILE 1451N -2.76 -0.03 0.92 0.90 2.07 -1.26 -5.16 121.20 115.88 2nqb s ILE 1451Ca 0.45 0.10 -0.12 0.00 -1.41 0.00 0.00 60.65 59.67 2nqb s ILE 1451Cb -0.04 -0.45 0.14 0.00 0.13 0.00 0.00 42.46 42.25 2nqb s ILE 1451CO 0.29 0.04 1.11 -0.94 -1.91 0.00 0.00 174.94 173.53 2nqb s SER 1452N 1.06 3.41 0.07 4.50 1.04 -1.26 -4.84 113.70 117.68 2nqb s SER 1452Ca -0.07 1.14 -0.23 0.00 0.48 0.00 0.00 55.95 57.26 2nqb s SER 1452Cb -0.08 -1.78 -0.16 0.00 0.10 0.00 0.00 66.02 64.10 2nqb s SER 1452CO -0.08 -2.63 1.63 0.28 0.98 0.00 0.00 173.24 173.42 2nqb h SER 1453N -1.55 0.02 -0.63 7.02 0.02 -2.01 -0.67 113.55 115.74 2nqb h SER 1453Ca -0.51 -0.11 0.04 0.00 -0.84 0.00 0.00 61.79 60.36 2nqb h SER 1453Cb 1.32 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 63.81 2nqb h SER 1453CO 0.59 0.13 0.37 0.11 -1.14 0.00 0.00 176.83 176.90 2nqb h LYS 1454N -0.09 0.70 -0.59 3.45 1.57 -1.99 0.32 116.57 119.94 2nqb h LYS 1454Ca 0.01 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 2nqb h LYS 1454Cb 0.11 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 2nqb h LYS 1454CO -0.00 0.46 0.24 0.00 -0.57 0.00 0.00 179.45 179.58 2nqb h ALA 1455N 1.29 1.32 -0.30 3.86 0.00 -1.89 -0.93 119.26 122.60 2nqb h ALA 1455Ca 0.26 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 2nqb h ALA 1455Cb 0.07 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2nqb h ALA 1455CO -0.13 0.51 -0.26 1.98 0.00 0.00 0.00 179.25 181.35 2nqb h MET 1456N 0.84 0.60 -0.56 0.00 1.85 -0.10 -0.81 114.93 116.75 2nqb h MET 1456Ca 0.20 -0.24 -0.09 0.00 -0.61 0.00 0.00 59.70 58.96 2nqb h MET 1456Cb 0.16 -0.03 -0.02 0.00 0.43 0.00 0.00 31.60 32.14 2nqb h MET 1456CO -0.02 0.80 -0.02 1.03 -0.40 0.00 0.00 176.91 178.31 2nqb h SER 1457N 0.52 0.96 -0.37 1.39 0.87 -0.02 -0.43 113.55 116.47 2nqb h SER 1457Ca 0.07 -0.27 -0.03 0.00 -1.23 0.00 0.00 61.79 60.33 2nqb h SER 1457Cb 0.73 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 2nqb h SER 1457CO 0.06 1.03 0.10 0.40 -0.53 0.00 0.00 176.83 177.88 2nqb h ILE 1458N 0.90 1.22 -0.92 2.23 2.04 -0.85 -0.92 117.51 121.21 2nqb h ILE 1458Ca 0.16 -0.75 -0.00 0.00 1.00 0.00 0.00 64.86 65.27 2nqb h ILE 1458Cb 0.55 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 2nqb h ILE 1458CO 0.03 0.26 0.56 0.24 0.00 0.00 0.00 178.15 179.23 2nqb h MET 1459N 0.45 1.25 -0.44 2.37 2.86 -0.85 -0.16 114.93 120.41 2nqb h MET 1459Ca 0.12 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.62 2nqb h MET 1459Cb 0.29 -0.26 -0.02 0.00 0.06 0.00 0.00 31.60 31.67 2nqb h MET 1459CO 0.00 0.87 0.17 -0.97 1.06 0.00 0.00 176.91 178.04 2nqb h ASN 1460N 1.27 0.61 -0.69 1.22 -1.24 -0.76 -0.85 115.58 115.16 2nqb h ASN 1460Ca 0.33 -0.18 0.02 0.00 0.71 0.00 0.00 56.30 57.18 2nqb h ASN 1460Cb -0.06 -0.16 -0.04 0.00 0.73 0.00 0.00 38.32 38.80 2nqb h ASN 1460CO -0.06 0.62 0.44 0.28 -1.29 0.00 0.00 177.43 177.43 2nqb h SER 1461N 0.57 0.75 -0.09 1.15 0.02 -0.59 -1.23 113.55 114.12 2nqb h SER 1461Ca 0.15 -0.01 0.02 0.00 -0.84 0.00 0.00 61.79 61.10 2nqb h SER 1461Cb 0.21 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 2nqb h SER 1461CO -0.01 0.53 -0.03 0.15 -1.14 0.00 0.00 176.83 176.33 2nqb h PHE 1462N 0.89 -0.07 -0.86 3.45 3.57 -0.68 0.22 116.94 123.46 2nqb h PHE 1462Ca 0.26 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.76 2nqb h PHE 1462Cb -0.05 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.70 2nqb h PHE 1462CO -0.03 -0.05 0.49 0.28 -2.23 0.00 0.00 178.31 176.76 2nqb h VAL 1463N -0.02 1.25 -0.46 1.41 2.07 -0.85 -0.46 116.25 119.18 2nqb h VAL 1463Ca 0.05 -0.58 -0.13 0.00 0.82 0.00 0.00 66.70 66.86 2nqb h VAL 1463Cb 0.09 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 29.91 2nqb h VAL 1463CO -0.10 0.27 -0.21 0.78 0.02 0.00 0.00 177.57 178.33 2nqb h ASN 1464N 1.19 0.96 -0.15 0.57 2.35 -0.96 -1.29 115.58 118.24 2nqb h ASN 1464Ca 0.30 -0.35 -0.00 0.00 -0.55 0.00 0.00 56.30 55.70 2nqb h ASN 1464Cb -0.00 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.10 2nqb h ASN 1464CO -0.05 1.13 0.09 -0.78 -1.65 0.00 0.00 177.43 176.17 2nqb h ASP 1465N 0.81 0.18 -0.44 5.81 1.82 -0.10 -1.13 116.42 123.37 2nqb h ASP 1465Ca 0.11 -0.04 0.01 0.00 -0.39 0.00 0.00 57.03 56.72 2nqb h ASP 1465Cb 0.77 -0.05 -0.02 0.00 0.68 0.00 0.00 39.33 40.71 2nqb h ASP 1465CO 0.06 0.17 0.28 0.40 -1.61 0.00 0.00 179.24 178.54 2nqb h ILE 1466N 0.18 1.09 -0.10 2.25 1.08 -0.96 -0.85 117.51 120.20 2nqb h ILE 1466Ca 0.06 -0.19 0.03 0.00 -0.39 0.00 0.00 64.86 64.36 2nqb h ILE 1466Cb 0.02 0.47 -0.03 0.00 -3.07 0.00 0.00 36.82 34.21 2nqb h ILE 1466CO -0.01 0.10 -0.09 0.15 -0.69 0.00 0.00 178.15 177.62 2nqb h PHE 1467N 0.57 -0.21 -0.48 1.37 3.57 -0.97 -1.92 116.94 118.87 2nqb h PHE 1467Ca 0.17 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 2nqb h PHE 1467Cb -0.04 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 2nqb h PHE 1467CO -0.06 -0.13 0.25 0.93 -2.23 0.00 0.00 178.31 177.07 2nqb h GLU 1468N -0.10 0.68 -0.16 1.11 5.08 -0.91 0.27 114.58 120.56 2nqb h GLU 1468Ca 0.07 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2nqb h GLU 1468Cb 0.20 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 2nqb h GLU 1468CO -0.16 0.56 0.09 0.00 -1.00 0.00 0.00 179.01 178.50 2nqb h ARG 1469N 0.64 0.21 -0.24 2.33 3.08 -1.00 -0.25 114.38 119.15 2nqb h ARG 1469Ca 0.17 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.18 2nqb h ARG 1469Cb 0.08 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 2nqb h ARG 1469CO -0.02 0.18 0.07 0.82 -1.07 0.00 0.00 179.97 179.95 2nqb h ILE 1470N 0.18 1.20 -0.90 2.04 2.04 -1.20 -1.76 117.51 119.11 2nqb h ILE 1470Ca 0.06 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.29 2nqb h ILE 1470Cb 0.02 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.22 2nqb h ILE 1470CO -0.01 0.20 0.57 0.00 0.00 0.00 0.00 178.15 178.91 2nqb h ALA 1471N 0.90 1.14 -0.42 1.87 0.00 -0.86 -0.92 119.26 120.97 2nqb h ALA 1471Ca 0.08 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 2nqb h ALA 1471Cb 0.24 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2nqb h ALA 1471CO -0.00 0.58 -0.15 0.00 0.00 0.00 0.00 179.25 179.68 2nqb h ALA 1472N 1.31 0.58 -0.63 0.00 0.00 -0.88 -0.35 119.26 119.29 2nqb h ALA 1472Ca 0.33 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2nqb h ALA 1472Cb -0.09 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2nqb h ALA 1472CO -0.07 0.50 0.21 1.49 0.00 0.00 0.00 179.25 181.38 2nqb h GLU 1473N 0.65 0.98 -0.73 0.00 4.57 -0.98 -1.52 114.58 117.55 2nqb h GLU 1473Ca 0.10 -0.20 -0.06 0.00 -1.18 0.00 0.00 59.36 58.02 2nqb h GLU 1473Cb 0.69 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 29.11 2nqb h GLU 1473CO 0.05 0.85 0.24 0.00 -1.18 0.00 0.00 179.01 178.97 2nqb h ALA 1474N 1.08 1.04 -0.14 2.92 0.00 -1.07 0.14 119.26 123.23 2nqb h ALA 1474Ca 0.21 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.94 2nqb h ALA 1474Cb 0.27 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 2nqb h ALA 1474CO -0.01 0.65 -0.10 1.03 0.00 0.00 0.00 179.25 180.82 2nqb h SER 1475N 1.08 -0.32 -0.09 0.00 0.87 -0.68 -0.39 113.55 114.04 2nqb h SER 1475Ca 0.24 0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.87 2nqb h SER 1475Cb 0.29 0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 62.41 2nqb h SER 1475CO -0.01 -0.13 0.05 0.03 -0.53 0.00 0.00 176.83 176.24 2nqb h ARG 1476N -0.10 0.12 -0.61 2.24 3.08 -0.75 -1.27 114.38 117.09 2nqb h ARG 1476Ca 0.09 -0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.25 2nqb h ARG 1476Cb 0.23 -0.02 -0.09 0.00 0.08 0.00 0.00 29.97 30.16 2nqb h ARG 1476CO -0.20 0.12 0.09 -0.07 -1.07 0.00 0.00 179.97 178.83 2nqb h LEU 1477N 0.08 -0.09 -0.64 3.04 3.38 -0.37 0.23 115.31 120.93 2nqb h LEU 1477Ca 0.03 0.13 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 2nqb h LEU 1477Cb 0.04 0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2nqb h LEU 1477CO -0.01 -0.04 -0.03 0.00 0.09 0.00 0.00 178.44 178.46 2nqb h ALA 1478N 1.51 0.85 -0.48 1.53 0.00 -0.88 -2.78 119.26 119.01 2nqb h ALA 1478Ca 0.32 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 2nqb h ALA 1478Cb 0.50 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2nqb h ALA 1478CO -0.45 0.66 -0.11 1.25 0.00 0.00 0.00 179.25 180.60 2nqb h HIS 1479N 0.94 1.05 -0.73 0.00 -0.00 -0.14 0.19 115.15 116.46 2nqb h HIS 1479Ca 0.16 -0.22 -0.00 0.00 -0.00 0.00 0.00 60.37 60.31 2nqb h HIS 1479Cb 0.58 -0.26 -0.04 0.00 -0.00 0.00 0.00 27.41 27.70 2nqb h HIS 1479CO 0.04 1.01 0.45 1.88 -0.00 0.00 0.00 177.93 181.31 2nqb h TYR 1480N 0.78 0.94 -0.49 5.26 0.05 -0.52 -2.24 116.97 120.74 2nqb h TYR 1480Ca 0.12 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.91 2nqb h TYR 1480Cb 0.67 -0.31 0.00 0.00 1.01 0.00 0.00 36.73 38.10 2nqb h TYR 1480CO 0.05 0.62 0.00 0.09 -1.05 0.00 0.00 178.16 177.86 2nqb n ASN 1481N -4.40 4.77 -4.03 3.88 3.02 -1.06 -4.94 115.26 112.51 2nqb n ASN 1481Ca 0.08 -2.69 -0.27 0.00 -0.03 0.00 0.00 54.58 51.66 2nqb n ASN 1481Cb 0.06 -0.63 -0.03 0.00 -0.61 0.00 0.00 39.78 38.56 2nqb n ASN 1481CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2nqb n LYS 1482N 0.60 -2.92 -4.58 3.52 5.02 -0.84 -4.97 118.16 113.98 2nqb n LYS 1482Ca 0.23 0.35 -0.34 0.00 -2.02 0.00 0.00 58.31 56.54 2nqb n LYS 1482Cb 0.99 -4.44 -0.11 0.00 -0.02 0.00 0.00 35.03 31.45 2nqb n LYS 1482CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2nqb s ARG 1483N -6.72 2.71 0.17 1.97 1.81 0.61 -5.02 118.95 114.50 2nqb s ARG 1483Ca 0.07 -0.58 0.23 0.00 -1.72 0.00 0.00 55.73 53.73 2nqb s ARG 1483Cb -0.04 -2.58 0.11 0.00 -0.45 0.00 0.00 34.95 31.99 2nqb s ARG 1483CO 0.91 0.65 1.14 0.77 -0.68 0.00 0.00 175.30 178.09 2nqb h SER 1484N 5.08 0.00 -3.79 0.23 0.02 -1.93 -3.39 113.55 109.77 2nqb h SER 1484Ca -0.49 -0.09 -0.69 0.00 -0.84 0.00 0.00 61.79 59.69 2nqb h SER 1484Cb 1.17 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 63.51 2nqb h SER 1484CO 0.53 0.05 -0.73 -0.89 -1.14 0.00 0.00 176.83 174.65 2nqb s THR 1485N -3.29 3.44 -0.38 -2.27 2.01 -1.26 -5.09 115.64 108.79 2nqb s THR 1485Ca 0.02 -0.65 -0.14 0.00 0.31 0.00 0.00 61.69 61.23 2nqb s THR 1485Cb 0.11 -2.41 0.01 0.00 0.01 0.00 0.00 72.50 70.22 2nqb s THR 1485CO 0.77 0.55 0.28 -0.63 -0.69 0.00 0.00 174.62 174.89 2nqb s ILE 1486N -0.83 5.26 0.47 1.82 1.01 -1.26 -4.88 121.20 122.79 2nqb s ILE 1486Ca 0.13 -0.49 0.06 0.00 0.00 0.00 0.00 60.65 60.35 2nqb s ILE 1486Cb -0.11 -3.84 -0.01 0.00 0.01 0.00 0.00 42.46 38.50 2nqb s ILE 1486CO 0.02 -0.19 0.26 0.42 0.00 0.00 0.00 174.94 175.45 2nqb s THR 1487N 1.70 2.01 0.52 2.92 -4.23 -1.26 -4.98 115.64 112.31 2nqb s THR 1487Ca 0.05 -1.62 0.27 0.00 -1.18 0.00 0.00 61.69 59.22 2nqb s THR 1487Cb -0.18 -2.63 0.44 0.00 1.34 0.00 0.00 72.50 71.47 2nqb s THR 1487CO 0.10 0.00 1.92 0.77 -0.54 0.00 0.00 174.62 176.87 2nqb h SER 1488N 1.15 0.07 -0.38 3.99 4.64 -2.00 0.41 113.55 121.42 2nqb h SER 1488Ca -0.41 0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 60.85 2nqb h SER 1488Cb 1.28 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 63.34 2nqb h SER 1488CO 0.65 0.03 0.01 -0.09 -0.87 0.00 0.00 176.83 176.55 2nqb h ARG 1489N 0.07 0.76 -0.29 4.77 2.43 -1.99 -1.14 114.38 118.98 2nqb h ARG 1489Ca 0.38 -0.20 -0.17 0.00 -0.81 0.00 0.00 59.98 59.18 2nqb h ARG 1489Cb 1.41 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.87 2nqb h ARG 1489CO -0.03 0.77 -0.49 0.93 -1.51 0.00 0.00 179.97 179.63 2nqb h GLU 1490N 0.72 0.81 -0.64 0.20 3.07 -1.30 -2.33 114.58 115.10 2nqb h GLU 1490Ca 0.14 -0.48 -0.01 0.00 -0.50 0.00 0.00 59.36 58.52 2nqb h GLU 1490Cb 0.43 0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 28.35 2nqb h GLU 1490CO 0.02 1.11 0.38 0.82 -1.40 0.00 0.00 179.01 179.94 2nqb h ILE 1491N 0.64 1.19 0.09 3.13 1.08 -1.21 -0.73 117.51 121.70 2nqb h ILE 1491Ca 0.03 -0.44 -0.00 0.00 -0.39 0.00 0.00 64.86 64.05 2nqb h ILE 1491Cb 1.08 0.32 0.00 0.00 -3.07 0.00 0.00 36.82 35.15 2nqb h ILE 1491CO 0.11 0.20 -0.04 -0.61 -0.69 0.00 0.00 178.15 177.12 2nqb h GLN 1492N 0.88 -0.11 -0.80 2.37 4.15 -1.11 0.10 115.11 120.58 2nqb h GLN 1492Ca 0.23 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.65 2nqb h GLN 1492Cb -0.01 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.67 2nqb h GLN 1492CO -0.04 0.03 0.46 1.15 -1.93 0.00 0.00 178.83 178.50 2nqb h THR 1493N -0.23 1.23 -0.77 2.39 2.02 -1.31 -1.02 112.91 115.22 2nqb h THR 1493Ca -0.01 -0.55 0.01 0.00 0.77 0.00 0.00 66.41 66.64 2nqb h THR 1493Cb 0.19 0.14 -0.04 0.00 -1.74 0.00 0.00 68.15 66.70 2nqb h THR 1493CO 0.02 0.25 0.51 0.00 0.37 0.00 0.00 175.52 176.67 2nqb h ALA 1494N 1.24 0.98 -0.31 6.16 0.00 -0.93 -0.85 119.26 125.56 2nqb h ALA 1494Ca 0.28 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.15 2nqb h ALA 1494Cb -0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 2nqb h ALA 1494CO -0.05 0.37 0.20 0.28 0.00 0.00 0.00 179.25 180.05 2nqb h VAL 1495N 1.03 1.06 -0.22 0.00 2.07 -0.12 0.82 116.25 120.89 2nqb h VAL 1495Ca 0.29 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.64 2nqb h VAL 1495Cb -0.10 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 2nqb h VAL 1495CO -0.07 0.07 -0.01 0.03 0.02 0.00 0.00 177.57 177.62 2nqb h ARG 1496N 0.40 0.32 -0.05 1.57 3.08 -0.65 0.07 114.38 119.12 2nqb h ARG 1496Ca 0.12 -0.05 -0.21 0.00 0.07 0.00 0.00 59.98 59.91 2nqb h ARG 1496Cb -0.03 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 29.96 2nqb h ARG 1496CO -0.04 0.36 -0.83 -0.07 -1.07 0.00 0.00 179.97 178.33 2nqb h LEU 1497N 0.32 0.55 0.02 3.04 3.38 -0.53 -3.38 115.31 118.71 2nqb h LEU 1497Ca 0.07 -0.39 -0.31 0.00 0.09 0.00 0.00 57.88 57.34 2nqb h LEU 1497Cb 0.23 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 2nqb h LEU 1497CO 0.01 1.16 -1.81 0.18 0.09 0.00 0.00 178.44 178.06 2nqb n LEU 1498N -3.81 1.16 -4.90 1.67 4.77 0.22 -4.95 117.00 111.17 2nqb n LEU 1498Ca -0.06 0.35 -0.34 0.00 -0.03 0.00 0.00 56.01 55.93 2nqb n LEU 1498Cb 0.77 -0.05 -0.05 0.00 -2.33 0.00 0.00 43.42 41.76 2nqb n LEU 1498CO 0.50 0.49 -0.12 -0.76 -1.33 0.00 0.00 177.39 176.16 2nqb s LEU 1499N -6.22 4.37 0.47 2.23 1.43 -0.03 -5.07 118.68 115.85 2nqb s LEU 1499Ca -0.09 0.42 -0.23 0.00 -1.03 0.00 0.00 54.13 53.21 2nqb s LEU 1499Cb 0.08 -2.62 -0.07 0.00 0.03 0.00 0.00 46.19 43.61 2nqb s LEU 1499CO 0.81 0.26 1.19 -2.84 0.23 0.00 0.00 176.35 176.01 2nqb s PRO 1500N -1.85 3.66 0.00 1.29 0.02 -1.26 -4.47 135.00 132.39 2nqb s PRO 1500Ca 0.27 1.84 0.00 0.00 0.02 0.00 0.00 61.00 63.13 2nqb s PRO 1500Cb -0.13 -2.38 0.00 0.00 0.02 0.00 0.00 34.50 32.01 2nqb s PRO 1500CO 0.17 -0.65 0.00 0.41 -0.33 0.00 0.00 177.00 176.60 2nqb n GLY 1501N 0.48 0.00 0.22 0.52 0.00 -1.26 -1.47 105.19 103.68 2nqb n GLY 1501Ca 0.08 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.03 2nqb n GLY 1501CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2nqb h GLU 1502N 0.00 0.71 -0.65 1.61 4.57 -2.00 -1.95 114.58 116.88 2nqb h GLU 1502Ca 0.00 -0.04 0.08 0.00 -1.18 0.00 0.00 59.36 58.22 2nqb h GLU 1502Cb 0.00 -0.16 -0.07 0.00 -0.16 0.00 0.00 28.75 28.36 2nqb h GLU 1502CO 0.00 0.48 0.31 1.25 -1.18 0.00 0.00 179.01 179.86 2nqb h LEU 1503N 0.73 0.39 -0.28 1.64 5.85 -1.61 -1.66 115.31 120.36 2nqb h LEU 1503Ca 0.20 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 2nqb h LEU 1503Cb -0.08 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 2nqb h LEU 1503CO -0.04 0.23 0.14 0.00 -0.34 0.00 0.00 178.44 178.43 2nqb h ALA 1504N 1.40 0.36 -0.39 1.25 0.00 -0.98 -0.03 119.26 120.88 2nqb h ALA 1504Ca 0.32 -0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.22 2nqb h ALA 1504Cb 0.33 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 17.92 2nqb h ALA 1504CO -0.26 -0.08 -0.26 -0.22 0.00 0.00 0.00 179.25 178.43 2nqb h LYS 1505N 0.32 -0.19 -0.28 0.00 3.64 -0.56 0.28 116.57 119.78 2nqb h LYS 1505Ca 0.10 0.01 -0.19 0.00 -1.27 0.00 0.00 60.65 59.30 2nqb h LYS 1505Cb 0.11 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2nqb h LYS 1505CO -0.01 -0.13 -0.56 0.45 -2.27 0.00 0.00 179.45 176.93 2nqb h HIS 1506N -0.20 1.11 -0.86 1.91 3.86 -1.23 -2.36 115.15 117.38 2nqb h HIS 1506Ca 0.18 -0.40 -0.00 0.00 -1.16 0.00 0.00 60.37 58.99 2nqb h HIS 1506Cb 0.49 -0.21 -0.04 0.00 1.06 0.00 0.00 27.41 28.71 2nqb h HIS 1506CO -0.48 1.24 0.53 0.00 0.86 0.00 0.00 177.93 180.08 2nqb h ALA 1507N 0.67 1.09 -0.57 2.45 0.00 -0.43 0.17 119.26 122.64 2nqb h ALA 1507Ca 0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2nqb h ALA 1507Cb 1.17 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 2nqb h ALA 1507CO 0.12 0.54 0.28 0.28 0.00 0.00 0.00 179.25 180.47 2nqb h VAL 1508N 1.18 1.21 -0.32 0.00 2.07 -0.37 0.82 116.25 120.83 2nqb h VAL 1508Ca 0.31 -0.58 -0.05 0.00 0.82 0.00 0.00 66.70 67.20 2nqb h VAL 1508Cb -0.07 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 2nqb h VAL 1508CO -0.06 0.23 0.02 0.77 0.02 0.00 0.00 177.57 178.55 2nqb h SER 1509N 0.78 0.55 -0.87 0.57 4.64 -0.82 -0.30 113.55 118.10 2nqb h SER 1509Ca 0.20 -0.30 -0.00 0.00 -0.47 0.00 0.00 61.79 61.22 2nqb h SER 1509Cb 0.11 -0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 62.02 2nqb h SER 1509CO -0.03 0.71 0.53 -0.33 -0.87 0.00 0.00 176.83 176.84 2nqb h GLU 1510N 0.37 1.17 -0.02 4.77 4.39 -0.49 -0.38 114.58 124.39 2nqb h GLU 1510Ca 0.09 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 2nqb h GLU 1510Cb 0.42 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 2nqb h GLU 1510CO 0.01 0.82 0.00 0.78 -1.16 0.00 0.00 179.01 179.46 2nqb h GLY 1511N 1.19 0.05 1.20 -3.84 0.00 -0.60 -2.10 103.07 98.98 2nqb h GLY 1511Ca 0.31 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.61 2nqb h GLY 1511CO -0.06 0.03 0.50 -0.84 0.00 0.00 0.00 176.54 176.17 2nqb h THR 1512N -0.23 1.21 -0.62 4.70 2.02 -0.88 -2.19 112.91 116.92 2nqb h THR 1512Ca 0.01 -0.44 -0.09 0.00 0.77 0.00 0.00 66.41 66.66 2nqb h THR 1512Cb 0.29 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.76 2nqb h THR 1512CO 0.00 0.22 0.02 0.50 0.37 0.00 0.00 175.52 176.63 2nqb h LYS 1513N 1.09 1.08 -0.32 6.66 3.64 -0.96 -0.63 116.57 127.13 2nqb h LYS 1513Ca 0.29 -0.33 -0.14 0.00 -1.27 0.00 0.00 60.65 59.19 2nqb h LYS 1513Cb -0.08 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 2nqb h LYS 1513CO -0.06 1.04 -0.37 0.00 -2.27 0.00 0.00 179.45 177.79 2nqb h ALA 1514N 1.00 0.73 -0.35 5.00 0.00 -1.02 -0.13 119.26 124.48 2nqb h ALA 1514Ca 0.18 -0.44 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 2nqb h ALA 1514Cb 0.54 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2nqb h ALA 1514CO 0.03 0.66 -0.16 0.28 0.00 0.00 0.00 179.25 180.06 2nqb h VAL 1515N 0.63 1.29 0.52 0.00 2.07 -1.29 0.41 116.25 119.88 2nqb h VAL 1515Ca 0.06 -1.27 -0.02 0.00 0.82 0.00 0.00 66.70 66.28 2nqb h VAL 1515Cb 0.92 1.36 -0.00 0.00 -1.52 0.00 0.00 31.29 32.05 2nqb h VAL 1515CO 0.08 0.42 -0.30 0.74 0.02 0.00 0.00 177.57 178.53 2nqb h THR 1516N 0.52 0.39 -0.14 2.57 2.02 -0.98 0.30 112.91 117.59 2nqb h THR 1516Ca 0.08 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.30 2nqb h THR 1516Cb 0.70 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 2nqb h THR 1516CO 0.05 0.00 0.10 0.50 0.37 0.00 0.00 175.52 176.54 2nqb h LYS 1517N -0.77 0.01 -0.21 6.66 3.64 -0.98 0.12 116.57 125.05 2nqb h LYS 1517Ca -0.06 -0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.12 2nqb h LYS 1517Cb 0.62 -0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.44 2nqb h LYS 1517CO 0.08 0.01 -0.64 -0.92 -2.27 0.00 0.00 179.45 175.70 2nqb h TYR 1518N 0.01 1.05 -0.01 1.91 3.20 -0.27 -3.25 116.97 119.61 2nqb h TYR 1518Ca 0.07 -0.42 -0.22 0.00 3.14 0.00 0.00 58.73 61.29 2nqb h TYR 1518Cb 0.25 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.34 2nqb h TYR 1518CO -0.00 1.25 -0.91 1.15 -1.64 0.00 0.00 178.16 178.00 2nqb h THR 1519N 0.56 1.41 0.00 1.81 2.02 -0.00 -3.32 112.91 115.38 2nqb h THR 1519Ca -0.02 -2.45 -0.51 0.00 0.77 0.00 0.00 66.41 64.19 2nqb h THR 1519Cb 1.26 2.40 0.00 0.00 -1.74 0.00 0.00 68.15 70.08 2nqb h THR 1519CO 0.14 0.73 2.61 -1.20 0.37 0.00 0.00 175.52 178.17 2nqb n SER 1520N -3.74 7.48 0.00 4.18 7.64 0.34 -5.10 113.62 124.42 2nqb n SER 1520Ca -0.06 -2.52 0.00 0.00 1.01 0.00 0.00 58.87 57.30 2nqb n SER 1520Cb 0.82 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.55 2nqb n SER 1520CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49