#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2red n ASP 1421N 0.00 0.00 0.00 7.83 8.00 -1.25 -5.07 116.55 126.06 2red n ASP 1421Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2red n ASP 1421Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2red n ASP 1421CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2red n GLY 1422N 5.00 -0.60 0.13 0.44 0.00 -1.26 -4.81 105.19 104.10 2red n GLY 1422Ca 0.00 -0.05 -0.20 0.00 0.00 0.00 0.00 46.02 45.78 2red n GLY 1422CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2red n ARG 1423N 0.00 0.73 -1.99 1.61 0.63 -1.26 -4.79 116.66 111.59 2red n ARG 1423Ca 0.00 0.24 -0.42 0.00 -0.92 0.00 0.00 57.85 56.74 2red n ARG 1423Cb 0.00 -1.67 -0.03 0.00 0.45 0.00 0.00 32.46 31.21 2red n ARG 1423CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 2red s ILE 1424N -2.55 3.46 -0.21 5.15 1.09 -1.26 -0.02 121.20 126.86 2red s ILE 1424Ca -0.24 0.66 0.09 0.00 -1.10 0.00 0.00 60.65 60.06 2red s ILE 1424Cb 0.07 -3.42 -0.19 0.00 -1.06 0.00 0.00 42.46 37.85 2red s ILE 1424CO 0.74 -0.04 -0.07 1.17 -0.10 0.00 0.00 174.94 176.63 2red n LYS 1425N 6.73 0.78 -3.89 2.79 4.81 0.17 -3.81 118.16 125.74 2red n LYS 1425Ca 0.17 0.06 -0.11 0.00 -0.87 0.00 0.00 58.31 57.56 2red n LYS 1425Cb 0.42 -1.48 -0.12 0.00 0.02 0.00 0.00 35.03 33.88 2red n LYS 1425CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2red s GLU 1426N -2.46 0.21 0.03 1.64 2.02 -0.85 -0.52 118.70 118.76 2red s GLU 1426Ca -0.21 -0.20 -0.00 0.00 0.02 0.00 0.00 54.97 54.58 2red s GLU 1426Cb 0.07 0.08 -0.02 0.00 0.10 0.00 0.00 34.13 34.36 2red s GLU 1426CO 0.65 -0.04 -0.03 0.54 0.02 0.00 0.00 175.26 176.40 2red s VAL 1427N -0.64 0.14 0.08 2.63 0.11 -1.26 -0.23 120.40 121.24 2red s VAL 1427Ca -0.07 -1.06 -0.26 0.00 -2.93 0.00 0.00 61.98 57.66 2red s VAL 1427Cb -0.04 -0.47 0.08 0.00 -1.53 0.00 0.00 36.38 34.42 2red s VAL 1427CO 0.00 -0.58 0.73 -0.94 -3.33 0.00 0.00 175.10 170.98 2red s SER 1428N -1.70 -0.48 -0.42 3.54 1.04 -0.54 -4.79 113.70 110.35 2red s SER 1428Ca -0.12 0.01 -0.25 0.00 0.48 0.00 0.00 55.95 56.06 2red s SER 1428Cb -0.07 0.50 0.02 0.00 0.10 0.00 0.00 66.02 66.57 2red s SER 1428CO -0.02 -0.81 0.92 -0.69 0.98 0.00 0.00 173.24 173.61 2red s VAL 1429N -3.44 4.53 -0.06 5.02 1.01 -1.26 -0.84 120.40 125.36 2red s VAL 1429Ca 0.03 0.91 -0.17 0.00 0.00 0.00 0.00 61.98 62.75 2red s VAL 1429Cb -0.01 -4.38 -0.31 0.00 0.00 0.00 0.00 36.38 31.68 2red s VAL 1429CO -0.11 -0.70 0.76 0.15 0.00 0.00 0.00 175.10 175.19 2red h PHE 1430N 8.83 0.61 -1.47 5.22 3.57 -0.41 -3.48 116.94 129.81 2red h PHE 1430Ca -0.24 -0.44 0.00 0.00 3.53 0.00 0.00 57.97 60.82 2red h PHE 1430Cb 1.08 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.79 2red h PHE 1430CO 0.85 1.49 0.00 -2.37 -2.23 0.00 0.00 178.31 176.06 2red n THR 1431N -3.91 0.00 -3.73 4.41 5.66 -1.19 -5.00 114.28 110.53 2red n THR 1431Ca -0.20 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.70 2red n THR 1431Cb 0.93 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.68 2red n THR 1431CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 2red s TYR 1432N -5.49 -0.14 0.15 1.09 -0.85 -1.26 -0.79 117.35 110.06 2red s TYR 1432Ca 0.00 -0.20 -0.17 0.00 -0.52 0.00 0.00 57.07 56.18 2red s TYR 1432Cb 0.00 0.41 0.04 0.00 0.38 0.00 0.00 41.96 42.78 2red s TYR 1432CO 0.00 -0.92 0.45 -3.38 -1.52 0.00 0.00 175.55 170.18 2red s HIS 1433N -3.87 -0.20 -1.67 -3.49 -3.43 -0.34 -4.99 115.29 97.31 2red s HIS 1433Ca 0.09 -0.12 0.00 0.00 -0.80 0.00 0.00 55.06 54.23 2red s HIS 1433Cb -0.01 0.32 0.00 0.00 -1.43 0.00 0.00 32.58 31.46 2red s HIS 1433CO -0.03 -0.77 0.00 1.63 -2.00 0.00 0.00 174.74 173.57 2red n LYS 1434N -0.27 0.00 -2.50 -0.38 4.76 -1.26 -1.19 118.16 117.32 2red n LYS 1434Ca -0.14 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.29 2red n LYS 1434Cb 0.64 0.00 -0.01 0.00 -1.84 0.00 0.00 35.03 33.82 2red n LYS 1434CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2red n LYS 1435N 0.00 -1.76 -4.80 1.97 4.76 -1.24 -4.85 118.16 112.22 2red n LYS 1435Ca 0.00 1.39 -0.27 0.00 -2.87 0.00 0.00 58.31 56.56 2red n LYS 1435Cb 0.00 -1.78 -0.17 0.00 -1.84 0.00 0.00 35.03 31.24 2red n LYS 1435CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2red s TYR 1436N -0.17 1.88 0.00 2.13 2.02 -1.26 -4.97 117.35 116.98 2red s TYR 1436Ca -0.04 -0.74 0.00 0.00 -0.37 0.00 0.00 57.07 55.92 2red s TYR 1436Cb 0.00 -1.32 0.00 0.00 -0.40 0.00 0.00 41.96 40.24 2red s TYR 1436CO 0.10 -0.34 0.00 0.09 -1.57 0.00 0.00 175.55 173.83 2red n ASN 1437N 3.73 0.00 0.00 2.29 3.02 -1.26 -4.89 115.26 118.15 2red n ASN 1437Ca -0.21 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.34 2red n ASN 1437Cb 0.52 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.69 2red n ASN 1437CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 2red n PRO 1438N -0.62 0.00 0.00 3.52 -0.02 -1.26 -4.72 135.00 131.90 2red n PRO 1438Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2red n PRO 1438Cb 0.00 -0.39 0.00 0.00 -0.02 0.00 0.00 33.50 33.09 2red n PRO 1438CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2red n ASP 1439N -0.28 0.00 -2.58 2.55 5.75 -1.26 -4.57 116.55 116.17 2red n ASP 1439Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 54.79 54.76 2red n ASP 1439Cb 0.00 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.10 2red n ASP 1439CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2red n LYS 1440N -0.97 -1.16 -4.19 0.11 4.76 -1.26 -5.09 118.16 110.36 2red n LYS 1440Ca 0.00 -0.10 -0.11 0.00 -2.87 0.00 0.00 58.31 55.23 2red n LYS 1440Cb 0.00 -0.09 -0.10 0.00 -1.84 0.00 0.00 35.03 33.00 2red n LYS 1440CO 0.00 0.00 0.00 -3.38 -1.37 0.00 0.00 177.40 172.65 2red s HIS 1441N -1.11 1.02 0.10 2.13 -3.43 -1.26 -4.87 115.29 107.87 2red s HIS 1441Ca 0.04 -1.11 -0.07 0.00 -0.80 0.00 0.00 55.06 53.12 2red s HIS 1441Cb -0.00 -0.59 -0.06 0.00 -1.43 0.00 0.00 32.58 30.51 2red s HIS 1441CO 0.03 -0.35 0.37 0.71 -2.00 0.00 0.00 174.74 173.51 2red s TYR 1442N -3.83 3.53 -0.07 0.38 1.51 -1.26 -3.74 117.35 113.87 2red s TYR 1442Ca 0.23 0.65 0.05 0.00 -1.01 0.00 0.00 57.07 56.99 2red s TYR 1442Cb 0.07 -2.07 -0.01 0.00 -0.11 0.00 0.00 41.96 39.84 2red s TYR 1442CO 0.02 0.49 -0.22 -1.50 -1.11 0.00 0.00 175.55 173.23 2red s ILE 1443N -1.51 2.35 -0.14 2.71 2.07 -0.33 -4.30 121.20 122.05 2red s ILE 1443Ca 0.36 -0.96 -0.07 0.00 -1.41 0.00 0.00 60.65 58.58 2red s ILE 1443Cb -0.13 -1.89 -0.04 0.00 0.13 0.00 0.00 42.46 40.53 2red s ILE 1443CO 0.21 0.57 0.11 -0.31 -1.91 0.00 0.00 174.94 173.61 2red s TYR 1444N -0.16 3.48 -0.25 3.50 1.51 -0.01 -1.20 117.35 124.23 2red s TYR 1444Ca -0.03 0.41 -0.12 0.00 -1.01 0.00 0.00 57.07 56.32 2red s TYR 1444Cb -0.14 -1.98 -0.05 0.00 -0.11 0.00 0.00 41.96 39.69 2red s TYR 1444CO 0.04 0.57 0.21 0.08 -1.11 0.00 0.00 175.55 175.34 2red s VAL 1445N -0.62 5.31 -0.16 0.71 1.01 0.03 -0.84 120.40 125.83 2red s VAL 1445Ca 0.12 0.27 -0.03 0.00 0.00 0.00 0.00 61.98 62.34 2red s VAL 1445Cb -0.12 -3.55 -0.02 0.00 0.00 0.00 0.00 36.38 32.69 2red s VAL 1445CO 0.02 0.29 -0.04 -0.69 0.00 0.00 0.00 175.10 174.68 2red s VAL 1446N 1.37 3.79 -0.16 2.92 1.01 0.59 0.39 120.40 130.32 2red s VAL 1446Ca 0.09 -0.39 -0.06 0.00 0.00 0.00 0.00 61.98 61.62 2red s VAL 1446Cb -0.15 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 2red s VAL 1446CO 0.07 0.48 0.06 -0.60 0.00 0.00 0.00 175.10 175.12 2red s ARG 1447N 0.50 3.73 -0.09 2.72 3.52 -0.02 -1.21 118.95 128.10 2red s ARG 1447Ca -0.04 -0.32 0.01 0.00 -0.13 0.00 0.00 55.73 55.25 2red s ARG 1447Cb -0.14 -3.14 0.02 0.00 -1.56 0.00 0.00 34.95 30.13 2red s ARG 1447CO 0.03 0.42 -0.11 0.42 -0.81 0.00 0.00 175.30 175.24 2red s ILE 1448N -0.05 1.17 -0.18 4.11 -1.09 0.20 -1.47 121.20 123.88 2red s ILE 1448Ca 0.06 -0.46 -0.03 0.00 -2.23 0.00 0.00 60.65 57.99 2red s ILE 1448Cb -0.12 -1.09 -0.02 0.00 -1.58 0.00 0.00 42.46 39.65 2red s ILE 1448CO 0.01 0.37 -0.05 -0.22 -1.23 0.00 0.00 174.94 173.83 2red s LEU 1449N 0.99 3.05 0.02 2.97 2.96 0.69 -1.16 118.68 128.19 2red s LEU 1449Ca -0.08 -0.26 0.02 0.00 -0.22 0.00 0.00 54.13 53.58 2red s LEU 1449Cb -0.15 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 2red s LEU 1449CO -0.00 0.08 0.02 -0.13 -1.32 0.00 0.00 176.35 175.00 2red s ARG 1450N 0.86 2.82 0.58 1.98 0.52 -1.26 0.43 118.95 124.88 2red s ARG 1450Ca -0.01 -0.62 0.28 0.00 -0.52 0.00 0.00 55.73 54.86 2red s ARG 1450Cb -0.15 -2.69 1.61 0.00 0.52 0.00 0.00 34.95 34.24 2red s ARG 1450CO 0.01 0.61 2.08 0.93 0.02 0.00 0.00 175.30 178.95 2red h GLU 1451N 4.10 0.00 0.00 3.54 5.08 -0.75 -2.51 114.58 124.04 2red h GLU 1451Ca -0.49 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 57.86 2red h GLU 1451Cb 1.17 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.42 2red h GLU 1451CO 0.59 0.00 -0.08 0.78 -1.00 0.00 0.00 179.01 179.31 2red h GLY 1452N 0.00 0.00 -3.19 -3.84 0.00 -1.96 -3.46 103.07 90.62 2red h GLY 1452Ca 0.11 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.82 2red h GLY 1452CO -0.00 0.00 -0.72 1.62 0.00 0.00 0.00 176.54 177.44 2red s GLN 1453N -3.19 2.04 -0.06 4.80 0.74 -0.95 -5.05 119.66 118.00 2red s GLN 1453Ca 0.06 -1.34 -0.13 0.00 0.05 0.00 0.00 55.36 54.01 2red s GLN 1453Cb 0.05 -2.12 -0.30 0.00 1.10 0.00 0.00 33.01 31.75 2red s GLN 1453CO 0.68 0.41 0.67 0.82 -0.55 0.00 0.00 175.29 177.32 2red h ILE 1454N 2.60 0.99 -3.13 -2.34 1.08 -1.90 -3.43 117.51 111.37 2red h ILE 1454Ca -0.46 -2.50 -0.59 0.00 -0.39 0.00 0.00 64.86 60.93 2red h ILE 1454Cb 1.22 2.78 -0.04 0.00 -3.07 0.00 0.00 36.82 37.71 2red h ILE 1454CO 0.55 0.82 -0.28 -1.61 -0.69 0.00 0.00 178.15 176.94 2red s GLU 1455N -2.55 3.69 0.79 2.37 0.41 -1.26 -5.05 118.70 117.09 2red s GLU 1455Ca -0.16 0.05 -0.10 0.00 -0.41 0.00 0.00 54.97 54.34 2red s GLU 1455Cb 0.05 -2.92 0.07 0.00 -1.78 0.00 0.00 34.13 29.54 2red s GLU 1455CO 0.84 0.51 1.10 -1.25 -0.49 0.00 0.00 175.26 175.97 2red s PRO 1456N -2.27 2.13 0.27 0.39 0.04 -1.26 -4.80 135.00 129.50 2red s PRO 1456Ca 0.37 1.21 0.07 0.00 0.04 0.00 0.00 61.00 62.69 2red s PRO 1456Cb -0.13 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 2red s PRO 1456CO 0.21 -1.74 0.23 -1.12 0.04 0.00 0.00 177.00 174.61 2red s SER 1457N -3.31 5.54 -0.03 6.66 0.01 -0.31 -4.94 113.70 117.32 2red s SER 1457Ca 0.62 -0.27 0.02 0.00 1.31 0.00 0.00 55.95 57.62 2red s SER 1457Cb -0.18 -1.36 0.01 0.00 0.21 0.00 0.00 66.02 64.71 2red s SER 1457CO 0.56 -0.10 -0.07 -0.36 0.41 0.00 0.00 173.24 173.68 2red s PHE 1458N -2.15 0.83 0.24 2.43 0.40 -1.26 -0.63 117.98 117.82 2red s PHE 1458Ca 0.35 -0.22 0.06 0.00 -0.60 0.00 0.00 56.93 56.52 2red s PHE 1458Cb -0.08 -0.64 -0.05 0.00 0.51 0.00 0.00 43.02 42.76 2red s PHE 1458CO 0.26 -0.14 -0.08 0.14 0.70 0.00 0.00 175.22 176.10 2red s VAL 1459N 0.49 1.54 -0.14 -0.44 -7.23 -0.35 -4.60 120.40 109.68 2red s VAL 1459Ca -0.07 -2.14 0.01 0.00 -1.81 0.00 0.00 61.98 57.98 2red s VAL 1459Cb -0.11 -2.25 0.02 0.00 0.56 0.00 0.00 36.38 34.60 2red s VAL 1459CO 0.01 -0.44 -0.16 -0.36 -0.31 0.00 0.00 175.10 173.83 2red s PHE 1460N -3.09 2.23 -0.04 2.82 0.40 1.00 -0.30 117.98 121.01 2red s PHE 1460Ca 0.26 -1.18 -0.02 0.00 -0.60 0.00 0.00 56.93 55.39 2red s PHE 1460Cb 0.02 -1.60 0.02 0.00 0.51 0.00 0.00 43.02 41.97 2red s PHE 1460CO 0.09 -0.61 0.08 1.03 0.70 0.00 0.00 175.22 176.50 2red s ARG 1461N 1.22 0.05 0.71 0.44 1.81 -0.02 -4.59 118.95 118.57 2red s ARG 1461Ca -0.00 0.20 -0.11 0.00 -1.72 0.00 0.00 55.73 54.10 2red s ARG 1461Cb -0.14 -0.10 0.03 0.00 -0.45 0.00 0.00 34.95 34.29 2red s ARG 1461CO -0.07 -0.10 1.08 0.95 -0.68 0.00 0.00 175.30 176.49 2red s THR 1462N 0.64 3.24 0.26 0.02 -4.23 -1.26 -0.83 115.64 113.47 2red s THR 1462Ca -0.05 0.32 -0.02 0.00 -1.18 0.00 0.00 61.69 60.76 2red s THR 1462Cb -0.07 -3.38 0.24 0.00 1.34 0.00 0.00 72.50 70.63 2red s THR 1462CO -0.02 -0.49 1.80 0.15 -0.54 0.00 0.00 174.62 175.51 2red h PHE 1463N -0.65 0.90 -0.31 3.99 3.57 -1.98 -1.66 116.94 120.79 2red h PHE 1463Ca -0.45 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.03 2red h PHE 1463Cb 1.27 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.72 2red h PHE 1463CO 0.46 0.31 -0.02 -0.44 -2.23 0.00 0.00 178.31 176.40 2red h ASP 1464N 0.78 0.45 -0.71 0.41 3.32 -1.93 -1.15 116.42 117.59 2red h ASP 1464Ca 0.44 -0.08 -0.06 0.00 0.02 0.00 0.00 57.03 57.35 2red h ASP 1464Cb 0.50 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 2red h ASP 1464CO -0.29 0.53 0.19 -0.33 -1.72 0.00 0.00 179.24 177.62 2red h GLU 1465N 0.46 1.13 -0.43 3.56 5.08 -1.69 -0.05 114.58 122.64 2red h GLU 1465Ca 0.10 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.15 2red h GLU 1465Cb 0.33 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 2red h GLU 1465CO 0.01 0.98 0.07 0.74 -1.00 0.00 0.00 179.01 179.81 2red h PHE 1466N 1.07 0.77 -0.52 4.33 -1.00 -0.86 -0.76 116.94 119.98 2red h PHE 1466Ca 0.23 -0.11 -0.08 0.00 2.81 0.00 0.00 57.97 60.82 2red h PHE 1466Cb 0.35 -0.21 -0.02 0.00 3.61 0.00 0.00 35.95 39.67 2red h PHE 1466CO 0.03 0.74 0.01 0.37 -1.61 0.00 0.00 178.31 177.84 2red h GLN 1467N 0.58 0.87 -0.52 1.51 5.75 -1.04 -1.34 115.11 120.92 2red h GLN 1467Ca 0.13 -0.24 -0.07 0.00 -0.15 0.00 0.00 58.65 58.32 2red h GLN 1467Cb 0.39 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.82 2red h GLN 1467CO 0.01 0.86 0.05 1.49 -2.65 0.00 0.00 178.83 178.59 2red h GLU 1468N 0.81 0.88 -0.13 1.69 4.81 -0.93 0.90 114.58 122.61 2red h GLU 1468Ca 0.15 -0.26 0.02 0.00 -0.13 0.00 0.00 59.36 59.14 2red h GLU 1468Cb 0.47 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 2red h GLU 1468CO 0.02 0.89 0.02 1.25 -0.73 0.00 0.00 179.01 180.46 2red h LEU 1469N 0.76 0.01 -0.58 1.64 5.85 -0.72 0.20 115.31 122.46 2red h LEU 1469Ca 0.15 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.92 2red h LEU 1469Cb 0.46 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.47 2red h LEU 1469CO 0.02 0.02 0.35 -0.74 -0.34 0.00 0.00 178.44 177.75 2red h HIS 1470N 0.08 0.65 -0.87 1.25 2.76 -0.91 -0.92 115.15 117.20 2red h HIS 1470Ca 0.06 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.26 2red h HIS 1470Cb 0.05 -0.21 -0.04 0.00 1.55 0.00 0.00 27.41 28.76 2red h HIS 1470CO -0.12 0.37 0.58 -0.91 -1.30 0.00 0.00 177.93 176.55 2red h ASN 1471N 0.69 1.00 -0.20 3.26 2.35 -0.54 -1.56 115.58 120.58 2red h ASN 1471Ca 0.23 -0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.91 2red h ASN 1471Cb 0.03 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.14 2red h ASN 1471CO -0.10 0.72 -0.08 0.11 -1.65 0.00 0.00 177.43 176.43 2red h LYS 1472N 1.17 0.41 -0.94 0.81 1.57 -0.66 -3.00 116.57 115.92 2red h LYS 1472Ca 0.32 -0.17 0.09 0.00 -1.87 0.00 0.00 60.65 59.02 2red h LYS 1472Cb -0.12 -0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.10 2red h LYS 1472CO -0.07 0.68 0.61 -0.07 -0.57 0.00 0.00 179.45 180.03 2red h LEU 1473N 0.11 0.90 -2.08 2.94 3.38 -0.99 -1.76 115.31 117.81 2red h LEU 1473Ca 0.05 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2red h LEU 1473Cb 0.55 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 2red h LEU 1473CO 0.03 0.54 -0.08 0.28 0.09 0.00 0.00 178.44 179.30 2red h SER 1474N 1.00 0.00 -0.35 -0.43 0.02 -1.19 0.33 113.55 112.92 2red h SER 1474Ca 0.43 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.37 2red h SER 1474Cb 0.32 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.85 2red h SER 1474CO -0.18 0.08 0.19 0.40 -1.14 0.00 0.00 176.83 176.18 2red h ILE 1475N 0.00 1.14 0.00 3.27 1.08 -1.18 -3.30 117.51 118.51 2red h ILE 1475Ca -0.00 -0.35 0.00 0.00 -0.39 0.00 0.00 64.86 64.11 2red h ILE 1475Cb 0.19 0.74 0.00 0.00 -3.07 0.00 0.00 36.82 34.68 2red h ILE 1475CO 0.01 0.14 -1.74 2.30 -0.69 0.00 0.00 178.15 178.17 2red n ILE 1476N -4.78 0.00 -4.64 -0.67 -5.35 -0.81 -4.95 119.36 98.16 2red n ILE 1476Ca -0.01 -0.38 -0.30 0.00 -0.27 0.00 0.00 62.75 61.79 2red n ILE 1476Cb 0.08 0.22 -0.13 0.00 -1.74 0.00 0.00 39.64 38.07 2red n ILE 1476CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2red s PHE 1477N -3.31 2.40 0.58 4.28 0.40 0.11 -5.12 117.98 117.32 2red s PHE 1477Ca -0.05 -0.35 -0.19 0.00 -0.60 0.00 0.00 56.93 55.74 2red s PHE 1477Cb 0.13 -1.36 -0.04 0.00 0.51 0.00 0.00 43.02 42.26 2red s PHE 1477CO 0.84 0.24 1.23 -1.25 0.70 0.00 0.00 175.22 176.98 2red s PRO 1478N -1.62 3.00 0.64 0.24 0.04 -1.26 -4.44 135.00 131.60 2red s PRO 1478Ca 0.14 1.88 0.42 0.00 0.04 0.00 0.00 61.00 63.47 2red s PRO 1478Cb -0.10 -1.98 2.16 0.00 0.04 0.00 0.00 34.50 34.62 2red s PRO 1478CO 0.05 -1.20 2.27 -0.07 0.04 0.00 0.00 177.00 178.10 2red h LEU 1479N 0.98 0.00 -1.77 -3.56 3.38 -1.93 -2.56 115.31 109.85 2red h LEU 1479Ca -0.50 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.43 2red h LEU 1479Cb 1.30 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.04 2red h LEU 1479CO 0.55 0.00 -0.16 4.11 0.09 0.00 0.00 178.44 183.04 2red h TRP 1480N 0.00 0.00 0.00 1.13 5.08 -1.99 -1.96 115.95 118.20 2red h TRP 1480Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2red h TRP 1480Cb 0.13 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.29 2red h TRP 1480CO 0.00 0.16 0.00 1.63 -1.28 0.00 0.00 178.44 178.95 2red n LYS 1481N -4.03 0.08 -4.30 0.12 5.02 -0.96 -4.87 118.16 109.21 2red n LYS 1481Ca -0.02 0.18 -0.25 0.00 -2.02 0.00 0.00 58.31 56.20 2red n LYS 1481Cb 0.24 -1.61 -0.09 0.00 -0.02 0.00 0.00 35.03 33.55 2red n LYS 1481CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2red s LEU 1482N -3.51 3.04 0.73 -0.35 1.43 -0.74 -4.74 118.68 114.55 2red s LEU 1482Ca 0.10 -0.62 -0.14 0.00 -1.03 0.00 0.00 54.13 52.44 2red s LEU 1482Cb 0.13 -1.66 0.04 0.00 0.03 0.00 0.00 46.19 44.74 2red s LEU 1482CO 0.44 0.07 1.14 -2.84 0.23 0.00 0.00 176.35 175.39 2red s PRO 1483N -3.15 2.28 0.31 1.29 0.02 -1.26 -4.98 135.00 129.51 2red s PRO 1483Ca 0.27 1.50 -0.29 0.00 0.02 0.00 0.00 61.00 62.50 2red s PRO 1483Cb -0.08 -1.88 -0.11 0.00 0.02 0.00 0.00 34.50 32.46 2red s PRO 1483CO 0.17 -1.67 1.49 0.20 -0.33 0.00 0.00 177.00 176.86 2red s GLY 1484N -2.53 2.49 -0.16 0.52 0.00 -1.26 -5.01 107.32 101.38 2red s GLY 1484Ca 0.69 1.47 -0.08 0.00 0.00 0.00 0.00 44.72 46.80 2red s GLY 1484CO 0.47 2.33 0.12 -0.12 0.00 0.00 0.00 173.10 175.90 2red s PHE 1485N -0.43 3.46 -1.15 1.90 5.36 -1.26 -4.86 117.98 121.00 2red s PHE 1485Ca 0.58 0.38 -0.13 0.00 -0.96 0.00 0.00 56.93 56.79 2red s PHE 1485Cb -0.45 -2.04 -0.07 0.00 -0.34 0.00 0.00 43.02 40.12 2red s PHE 1485CO 0.51 0.47 2.26 -0.35 -1.46 0.00 0.00 175.22 176.65 2red n PRO 1486N 2.81 2.43 -1.88 10.12 -0.04 -1.26 -4.94 135.00 142.25 2red n PRO 1486Ca -0.18 -1.99 -0.41 0.00 -0.04 0.00 0.00 63.50 60.88 2red n PRO 1486Cb 0.53 -2.85 -0.01 0.00 -0.04 0.00 0.00 33.50 31.13 2red n PRO 1486CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 2red s ASN 1487N 3.56 6.44 0.00 3.54 3.84 -1.26 -4.96 114.94 126.10 2red s ASN 1487Ca 0.52 2.96 0.00 0.00 0.21 0.00 0.00 52.86 56.56 2red s ASN 1487Cb 0.14 -2.66 0.00 0.00 -0.55 0.00 0.00 41.25 38.18 2red s ASN 1487CO -0.01 -0.80 0.00 -1.14 -2.79 0.00 0.00 177.10 172.36 2red n ARG 1488N 0.59 0.00 -0.73 0.43 0.63 -1.26 -5.26 116.66 111.07 2red n ARG 1488Ca 0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.94 2red n ARG 1488Cb 0.40 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.31 2red n ARG 1488CO 0.00 0.00 0.00 -0.12 -2.51 0.00 0.00 177.63 175.00 2red n MET 1489N 0.00 0.00 -0.12 -0.14 1.56 -1.26 -5.10 117.12 112.06 2red n MET 1489Ca 0.00 0.25 0.00 0.00 -0.27 0.00 0.00 57.70 57.68 2red n MET 1489Cb 0.00 -0.47 0.00 0.00 2.15 0.00 0.00 33.22 34.90 2red n MET 1489CO 0.00 0.00 0.00 2.89 -0.73 0.00 0.00 175.97 178.13 2red n ARG 1493N 0.64 -0.23 -0.19 2.12 -4.01 -1.26 -5.22 116.66 108.50 2red n ARG 1493Ca 0.00 0.00 -0.04 0.00 -1.04 0.00 0.00 57.85 56.77 2red n ARG 1493Cb 0.00 0.00 0.03 0.00 -3.04 0.00 0.00 32.46 29.45 2red n ARG 1493CO 0.00 0.00 0.00 2.41 -3.04 0.00 0.00 177.63 177.00 2red n THR 1494N 0.00 0.00 -0.57 8.89 -1.04 -1.26 -4.79 114.28 115.51 2red n THR 1494Ca 0.00 -0.09 -0.23 0.00 -2.04 0.00 0.00 64.05 61.69 2red n THR 1494Cb 0.00 -1.35 -0.03 0.00 -1.82 0.00 0.00 70.33 67.13 2red n THR 1494CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2red n HIS 1495N -2.63 0.89 -3.10 -1.42 1.44 -1.26 -4.86 115.22 104.28 2red n HIS 1495Ca 0.02 -1.32 0.00 0.00 -2.01 0.00 0.00 57.72 54.41 2red n HIS 1495Cb 0.08 -1.25 0.00 0.00 0.12 0.00 0.00 29.99 28.94 2red n HIS 1495CO 0.00 0.00 0.00 0.44 -2.81 0.00 0.00 176.34 173.97 2red n ILE 1496N 5.15 0.00 -1.63 0.61 -0.00 -1.26 -2.83 119.36 119.40 2red n ILE 1496Ca 0.33 0.00 -0.09 0.00 -0.00 0.00 0.00 62.75 62.98 2red n ILE 1496Cb 0.18 0.00 0.15 0.00 -0.00 0.00 0.00 39.64 39.97 2red n ILE 1496CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 2red n LYS 1497N 13.71 2.30 0.14 6.28 4.76 -1.26 -4.23 118.16 139.86 2red n LYS 1497Ca 0.00 -3.49 0.13 0.00 -2.87 0.00 0.00 58.31 52.08 2red n LYS 1497Cb 0.00 -1.93 0.42 0.00 -1.84 0.00 0.00 35.03 31.68 2red n LYS 1497CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 2red h ASP 1498N 1.39 0.00 -0.29 4.39 3.32 -1.94 -3.21 116.42 120.08 2red h ASP 1498Ca 0.24 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.26 2red h ASP 1498Cb 1.41 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.94 2red h ASP 1498CO 0.49 0.00 0.07 0.58 -1.72 0.00 0.00 179.24 178.66 2red h VAL 1499N 0.00 1.22 -0.56 -1.35 2.07 -1.73 0.76 116.25 116.65 2red h VAL 1499Ca 0.00 -0.72 0.09 0.00 0.82 0.00 0.00 66.70 66.89 2red h VAL 1499Cb 0.66 1.13 -0.07 0.00 -1.52 0.00 0.00 31.29 31.50 2red h VAL 1499CO 0.00 0.24 0.19 0.00 0.02 0.00 0.00 177.57 178.01 2red h ALA 1500N 0.90 0.70 -0.36 1.67 0.00 -1.87 0.25 119.26 120.55 2red h ALA 1500Ca 0.09 0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.93 2red h ALA 1500Cb 0.29 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2red h ALA 1500CO 0.00 -0.22 -0.38 0.00 0.00 0.00 0.00 179.25 178.65 2red h ALA 1501N 1.40 0.65 -0.34 0.00 0.00 -1.64 -1.83 119.26 117.49 2red h ALA 1501Ca 0.28 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.75 2red h ALA 1501Cb 0.35 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2red h ALA 1501CO -0.30 0.67 0.22 -0.22 0.00 0.00 0.00 179.25 179.62 2red h LYS 1502N 0.70 0.44 0.00 0.00 3.64 -0.24 -3.01 116.57 118.10 2red h LYS 1502Ca 0.06 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.36 2red h LYS 1502Cb 0.95 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.67 2red h LYS 1502CO 0.09 0.29 -0.25 0.00 -2.27 0.00 0.00 179.45 177.31 2red h ARG 1503N 0.45 0.00 -0.76 1.90 3.08 -0.30 -2.28 114.38 116.47 2red h ARG 1503Ca 0.13 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.21 2red h ARG 1503Cb -0.04 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 29.97 2red h ARG 1503CO -0.04 0.25 0.48 -0.22 -1.07 0.00 0.00 179.97 179.37 2red h LYS 1504N 0.00 0.91 0.00 0.04 3.64 -1.19 0.16 116.57 120.13 2red h LYS 1504Ca -0.00 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2red h LYS 1504Cb 0.45 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 2red h LYS 1504CO 0.03 0.60 -0.00 0.82 -2.27 0.00 0.00 179.45 178.63 2red h ILE 1505N 0.93 1.45 -0.62 2.00 2.04 -1.48 -2.54 117.51 119.29 2red h ILE 1505Ca 0.31 -1.35 -0.05 0.00 1.00 0.00 0.00 64.86 64.77 2red h ILE 1505Cb 0.03 2.37 -0.03 0.00 -0.74 0.00 0.00 36.82 38.45 2red h ILE 1505CO -0.12 0.35 0.20 -0.33 0.00 0.00 0.00 178.15 178.25 2red h GLU 1506N -0.58 0.94 -0.14 2.37 5.08 -1.20 0.04 114.58 121.09 2red h GLU 1506Ca -0.00 -0.18 -0.21 0.00 -1.00 0.00 0.00 59.36 57.97 2red h GLU 1506Cb 0.58 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.69 2red h GLU 1506CO 0.00 0.81 -0.76 -0.07 -1.00 0.00 0.00 179.01 177.99 2red h LEU 1507N 0.91 0.83 -0.55 1.33 3.38 -0.78 0.84 115.31 121.27 2red h LEU 1507Ca 0.21 -0.54 0.00 0.00 0.09 0.00 0.00 57.88 57.64 2red h LEU 1507Cb 0.25 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2red h LEU 1507CO -0.01 1.32 0.35 -1.13 0.09 0.00 0.00 178.44 179.07 2red h ASN 1508N 0.48 0.64 -0.86 -0.43 -0.73 -1.19 -0.06 115.58 113.43 2red h ASN 1508Ca -0.04 -0.03 -0.02 0.00 1.87 0.00 0.00 56.30 58.07 2red h ASN 1508Cb 1.37 -0.16 -0.04 0.00 0.27 0.00 0.00 38.32 39.76 2red h ASN 1508CO 0.15 0.48 0.45 0.28 -0.37 0.00 0.00 177.43 178.41 2red h SER 1509N 0.74 1.10 -0.12 1.15 0.02 -0.75 -1.24 113.55 114.45 2red h SER 1509Ca 0.20 -0.12 0.04 0.00 -0.84 0.00 0.00 61.79 61.07 2red h SER 1509Cb -0.06 -0.28 -0.05 0.00 0.14 0.00 0.00 62.40 62.15 2red h SER 1509CO -0.04 0.91 -0.20 0.22 -1.14 0.00 0.00 176.83 176.57 2red h TYR 1510N 1.22 -0.53 -0.88 3.45 3.20 -0.53 -1.84 116.97 121.06 2red h TYR 1510Ca 0.30 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.21 2red h TYR 1510Cb 0.07 0.25 -0.05 0.00 1.54 0.00 0.00 36.73 38.55 2red h TYR 1510CO 0.01 -0.28 0.58 -0.07 -1.64 0.00 0.00 178.16 176.76 2red h LEU 1511N -0.26 1.00 -0.39 2.82 3.38 -0.79 0.31 115.31 121.38 2red h LEU 1511Ca 0.10 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2red h LEU 1511Cb 0.40 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2red h LEU 1511CO -0.27 0.72 0.21 1.56 0.09 0.00 0.00 178.44 180.74 2red h GLN 1512N 1.18 0.54 -0.86 1.13 1.08 -1.04 -1.54 115.11 115.60 2red h GLN 1512Ca 0.33 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.44 2red h GLN 1512Cb -0.11 -0.10 -0.04 0.00 -0.05 0.00 0.00 27.48 27.17 2red h GLN 1512CO -0.08 0.45 0.45 0.77 -0.95 0.00 0.00 178.83 179.47 2red h SER 1513N 0.49 1.08 -0.36 1.46 0.02 -0.99 -1.65 113.55 113.61 2red h SER 1513Ca 0.14 -0.11 -0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2red h SER 1513Cb 0.07 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 2red h SER 1513CO -0.02 0.88 0.22 0.25 -1.14 0.00 0.00 176.83 177.02 2red h LEU 1514N 1.20 0.43 -0.54 5.07 6.46 -0.69 -1.96 115.31 125.27 2red h LEU 1514Ca 0.30 -0.05 0.00 0.00 -0.12 0.00 0.00 57.88 58.01 2red h LEU 1514Cb 0.05 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 39.88 2red h LEU 1514CO -0.05 0.35 0.00 0.24 -0.62 0.00 0.00 178.44 178.37 2red h MET 1515N 0.46 0.00 -0.64 1.25 2.86 -1.14 -2.63 114.93 115.10 2red h MET 1515Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 2red h MET 1515Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 2red h MET 1515CO -0.02 0.00 0.00 0.09 1.06 0.00 0.00 176.91 178.04 2red n ASN 1516N -2.53 4.89 -4.69 1.22 5.03 -0.63 -4.90 115.26 113.65 2red n ASN 1516Ca 0.03 -2.59 -0.29 0.00 0.87 0.00 0.00 54.58 52.60 2red n ASN 1516Cb 0.35 -0.61 0.13 0.00 -1.02 0.00 0.00 39.78 38.62 2red n ASN 1516CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2red s ALA 1517N -2.14 2.26 0.64 5.41 0.00 -0.80 -5.01 121.76 122.12 2red s ALA 1517Ca 0.50 -0.72 -0.17 0.00 0.00 0.00 0.00 51.96 51.56 2red s ALA 1517Cb 0.34 -2.95 -0.06 0.00 0.00 0.00 0.00 23.12 20.46 2red s ALA 1517CO 0.20 -2.05 0.58 -1.13 0.00 0.00 0.00 175.76 173.36 2red n SER 1518N -3.58 -0.91 -0.08 0.00 3.41 -1.26 -4.59 113.62 106.62 2red n SER 1518Ca 0.09 0.68 0.00 0.00 -0.26 0.00 0.00 58.87 59.38 2red n SER 1518Cb 0.60 -1.22 0.30 0.00 -0.26 0.00 0.00 64.21 63.63 2red n SER 1518CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2red h THR 1519N -0.01 1.18 -0.92 6.66 2.02 -1.96 -0.74 112.91 119.14 2red h THR 1519Ca -0.46 -0.54 0.20 0.00 0.77 0.00 0.00 66.41 66.38 2red h THR 1519Cb 1.37 0.58 -0.07 0.00 -1.74 0.00 0.00 68.15 68.29 2red h THR 1519CO 0.45 0.21 0.60 -2.24 0.37 0.00 0.00 175.52 174.92 2red h ASP 1520N 0.69 0.49 0.01 4.18 2.03 -1.96 -1.38 116.42 120.49 2red h ASP 1520Ca 0.17 0.05 -0.15 0.00 -0.73 0.00 0.00 57.03 56.37 2red h ASP 1520Cb 0.12 -0.04 -0.02 0.00 -0.83 0.00 0.00 39.33 38.56 2red h ASP 1520CO -0.02 0.19 -0.80 0.58 -1.03 0.00 0.00 179.24 178.16 2red h VAL 1521N 0.49 1.26 0.00 4.15 2.07 -1.63 -3.30 116.25 119.29 2red h VAL 1521Ca 0.49 -2.27 -0.05 0.00 0.82 0.00 0.00 66.70 65.68 2red h VAL 1521Cb 1.11 2.73 -0.01 0.00 -1.52 0.00 0.00 31.29 33.59 2red h VAL 1521CO -0.21 0.47 -0.26 0.00 0.02 0.00 0.00 177.57 177.59 2red h ALA 1522N -0.25 1.48 -0.30 1.67 0.00 -1.07 -2.76 119.26 118.04 2red h ALA 1522Ca -0.21 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2red h ALA 1522Cb 1.25 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2red h ALA 1522CO -0.10 0.33 0.00 0.39 0.00 0.00 0.00 179.25 179.87 2red n GLU 1523N -4.10 3.10 -2.22 0.00 1.02 -0.53 -4.73 120.64 113.17 2red n GLU 1523Ca -0.02 -2.83 -0.28 0.00 -0.02 0.00 0.00 57.16 54.01 2red n GLU 1523Cb 0.32 -1.85 0.03 0.00 -0.02 0.00 0.00 31.44 29.92 2red n GLU 1523CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2red h ASP 1525N -0.27 0.87 -0.72 0.00 1.82 -1.91 -0.71 116.42 115.50 2red h ASP 1525Ca -0.45 0.01 -0.04 0.00 -0.39 0.00 0.00 57.03 56.15 2red h ASP 1525Cb 1.24 -0.18 -0.03 0.00 0.68 0.00 0.00 39.33 41.04 2red h ASP 1525CO 0.62 0.55 0.29 -0.07 -1.61 0.00 0.00 179.24 179.02 2red h LEU 1526N 0.98 1.00 -0.02 2.28 3.38 -1.94 -0.09 115.31 120.92 2red h LEU 1526Ca 0.39 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 2red h LEU 1526Cb 0.23 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 2red h LEU 1526CO -0.15 0.90 -0.02 0.58 0.09 0.00 0.00 178.44 179.85 2red h VAL 1527N 1.04 1.39 -0.58 1.22 2.07 -1.75 -2.22 116.25 117.42 2red h VAL 1527Ca 0.24 -1.19 0.10 0.00 0.82 0.00 0.00 66.70 66.68 2red h VAL 1527Cb 0.22 2.16 -0.08 0.00 -1.52 0.00 0.00 31.29 32.06 2red h VAL 1527CO -0.02 0.31 0.13 0.00 0.02 0.00 0.00 177.57 178.02 2red h THR 1529N 0.27 1.01 -0.93 0.00 2.02 -1.04 -2.45 112.91 111.80 2red h THR 1529Ca 0.30 -0.10 0.19 0.00 0.77 0.00 0.00 66.41 67.57 2red h THR 1529Cb 0.43 0.69 -0.08 0.00 -1.74 0.00 0.00 68.15 67.45 2red h THR 1529CO -0.37 0.05 0.60 0.15 0.37 0.00 0.00 175.52 176.32 2red h PHE 1530N 0.30 0.72 -0.01 3.16 3.57 -0.90 -1.90 116.94 121.88 2red h PHE 1530Ca 0.10 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.63 2red h PHE 1530Cb 0.01 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.53 2red h PHE 1530CO -0.08 0.19 -0.17 1.19 -2.23 0.00 0.00 178.31 177.21 2red n PHE 1531N -4.58 0.00 -3.64 0.41 0.99 -0.95 -4.86 117.46 104.83 2red n PHE 1531Ca 0.20 0.00 -0.37 0.00 -0.00 0.00 0.00 57.45 57.28 2red n PHE 1531Cb 0.63 -0.13 -0.07 0.00 -1.00 0.00 0.00 39.48 38.91 2red n PHE 1531CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.76 175.75 2red s HIS 1532N -2.44 3.52 0.00 1.38 3.76 -0.71 -4.92 115.29 115.88 2red s HIS 1532Ca 0.28 0.59 0.00 0.00 -0.15 0.00 0.00 55.06 55.78 2red s HIS 1532Cb 0.20 -2.21 0.00 0.00 1.11 0.00 0.00 32.58 31.68 2red s HIS 1532CO 0.48 0.42 0.00 0.41 -0.85 0.00 0.00 174.74 175.21 2red n GLY 1533N 2.85 -0.68 0.29 -2.22 0.00 -1.26 -4.78 105.19 99.38 2red n GLY 1533Ca -0.15 -1.03 -0.04 0.00 0.00 0.00 0.00 46.02 44.80 2red n GLY 1533CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2red h SER 1534N 0.00 -0.85 0.00 1.61 0.02 -1.93 -3.33 113.55 109.07 2red h SER 1534Ca 0.00 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 2red h SER 1534Cb 0.00 0.46 0.00 0.00 0.14 0.00 0.00 62.40 63.00 2red h SER 1534CO 0.00 -0.26 -0.83 1.41 -1.14 0.00 0.00 176.83 176.01 2red n HIS 1535N -5.42 0.00 0.00 3.45 -0.00 -1.26 -0.00 115.22 111.98 2red n HIS 1535Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.76 2red n HIS 1535Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.32 2red n HIS 1535CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06