#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ds4 n LEU 4 N 0.00 -3.41 -4.46 -4.42 0.00 -1.26 -4.34 117.00 99.11 1ds4 n LEU 4 Ca 0.00 0.83 -0.33 0.00 0.00 0.00 0.00 56.01 56.52 1ds4 n LEU 4 Cb 0.00 -1.72 -0.13 0.00 0.00 0.00 0.00 43.42 41.57 1ds4 n LEU 4 CO 0.00 -1.09 -0.44 -0.69 0.00 0.00 0.00 177.39 175.17 1ds4 s VAL 5 N -0.20 3.12 -0.29 1.96 1.01 -1.26 -4.73 120.40 120.02 1ds4 s VAL 5 Ca -0.04 -0.69 -0.01 0.00 0.00 0.00 0.00 61.98 61.25 1ds4 s VAL 5 Cb 0.00 -2.25 0.09 0.00 0.00 0.00 0.00 36.38 34.22 1ds4 s VAL 5 CO 0.11 0.58 0.07 -1.00 0.00 0.00 0.00 175.10 174.86 1ds4 s HIS 6 N -0.49 1.72 -0.09 5.22 3.76 -1.26 -5.07 115.29 119.08 1ds4 s HIS 6 Ca 0.06 -1.63 -0.23 0.00 -0.15 0.00 0.00 55.06 53.11 1ds4 s HIS 6 Cb -0.12 -1.63 -0.03 0.00 1.11 0.00 0.00 32.58 31.91 1ds4 s HIS 6 CO 0.02 -0.83 0.69 0.08 -0.85 0.00 0.00 174.74 173.85 1ds4 s VAL 7 N 1.61 5.04 0.17 -0.90 1.01 -1.26 -0.75 120.40 125.32 1ds4 s VAL 7 Ca 0.07 1.39 -0.30 0.00 0.00 0.00 0.00 61.98 63.14 1ds4 s VAL 7 Cb -0.17 -4.02 -0.08 0.00 0.00 0.00 0.00 36.38 32.10 1ds4 s VAL 7 CO -0.20 0.23 1.33 0.00 0.00 0.00 0.00 175.10 176.46 1ds4 s ALA 8 N 1.00 3.54 -0.25 5.51 0.00 0.10 -4.88 121.76 126.78 1ds4 s ALA 8 Ca 0.36 1.10 0.02 0.00 0.00 0.00 0.00 51.96 53.44 1ds4 s ALA 8 Cb -0.17 -3.50 0.07 0.00 0.00 0.00 0.00 23.12 19.51 1ds4 s ALA 8 CO 0.16 -0.56 -0.05 0.45 0.00 0.00 0.00 175.76 175.76 1ds4 s SER 9 N 0.62 4.11 0.17 0.00 0.15 0.63 -4.68 113.70 114.71 1ds4 s SER 9 Ca 0.59 -1.35 -0.33 0.00 0.70 0.00 0.00 55.95 55.56 1ds4 s SER 9 Cb -0.36 -1.31 -0.15 0.00 -1.71 0.00 0.00 66.02 62.49 1ds4 s SER 9 CO 0.35 -0.24 1.41 0.52 1.20 0.00 0.00 173.24 176.48 1ds4 n VAL 10 N 4.57 0.44 -1.60 4.45 0.31 -1.26 -4.30 118.33 120.94 1ds4 n VAL 10 Ca -0.11 -0.11 -0.50 0.00 -0.01 0.00 0.00 64.34 63.61 1ds4 n VAL 10 Cb 0.43 -1.26 -0.05 0.00 -0.91 0.00 0.00 33.84 32.05 1ds4 n VAL 10 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1ds4 n GLU 11 N 2.54 1.31 -1.68 5.55 4.71 -1.26 -4.71 120.64 127.10 1ds4 n GLU 11 Ca 0.15 0.47 -0.49 0.00 -0.01 0.00 0.00 57.16 57.28 1ds4 n GLU 11 Cb 0.27 -2.09 -0.05 0.00 -1.01 0.00 0.00 31.44 28.56 1ds4 n GLU 11 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 1ds4 n LYS 12 N 2.38 2.02 -0.89 3.49 4.81 -1.26 -1.41 118.16 127.30 1ds4 n LYS 12 Ca 0.17 0.74 0.00 0.00 -0.87 0.00 0.00 58.31 58.35 1ds4 n LYS 12 Cb 0.22 -2.54 0.00 0.00 0.02 0.00 0.00 35.03 32.74 1ds4 n LYS 12 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ds4 n GLY 13 N 4.04 0.67 3.84 3.14 0.00 -1.26 -5.00 105.19 110.61 1ds4 n GLY 13 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 1ds4 n GLY 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ds4 s ARG 14 N -0.31 4.02 0.07 1.61 1.81 -0.50 -5.07 118.95 120.58 1ds4 s ARG 14 Ca 0.00 0.95 0.01 0.00 -1.72 0.00 0.00 55.73 54.97 1ds4 s ARG 14 Cb 0.00 -2.19 -0.00 0.00 -0.45 0.00 0.00 34.95 32.31 1ds4 s ARG 14 CO 0.00 -0.15 0.07 -1.13 -0.68 0.00 0.00 175.30 173.41 1ds4 n SER 15 N -1.20 -0.19 -0.19 0.23 3.41 -1.26 -4.90 113.62 109.51 1ds4 n SER 15 Ca 0.06 -1.41 -0.03 0.00 -0.26 0.00 0.00 58.87 57.23 1ds4 n SER 15 Cb 0.54 0.40 0.03 0.00 -0.26 0.00 0.00 64.21 64.92 1ds4 n SER 15 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1ds4 h TYR 16 N 1.21 -0.64 -0.75 7.33 3.20 -1.99 -0.95 116.97 124.38 1ds4 h TYR 16 Ca -0.05 0.06 0.13 0.00 3.14 0.00 0.00 58.73 62.01 1ds4 h TYR 16 Cb 0.23 0.37 -0.05 0.00 1.54 0.00 0.00 36.73 38.82 1ds4 h TYR 16 CO 0.00 -0.33 0.50 0.93 -1.64 0.00 0.00 178.16 177.61 1ds4 h GLU 17 N -0.10 0.50 -0.57 1.82 3.07 -1.99 -0.10 114.58 117.21 1ds4 h GLU 17 Ca 0.26 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 59.06 1ds4 h GLU 17 Cb 0.51 -0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 28.28 1ds4 h GLU 17 CO -0.64 0.33 0.26 -0.44 -1.40 0.00 0.00 179.01 177.12 1ds4 h ASP 18 N 0.51 0.77 0.46 1.42 3.32 -1.57 -2.13 116.42 119.20 1ds4 h ASP 18 Ca 0.36 -0.15 -0.22 0.00 0.02 0.00 0.00 57.03 57.05 1ds4 h ASP 18 Cb 0.69 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 40.04 1ds4 h ASP 18 CO -0.13 0.70 -0.94 -0.26 -1.72 0.00 0.00 179.24 176.89 1ds4 h PHE 19 N 0.78 0.47 -0.38 4.55 0.04 -1.23 -2.59 116.94 118.58 1ds4 h PHE 19 Ca 0.19 -0.27 0.00 0.00 2.80 0.00 0.00 57.97 60.70 1ds4 h PHE 19 Cb 0.15 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.23 1ds4 h PHE 19 CO 0.00 1.09 0.25 0.37 -0.60 0.00 0.00 178.31 179.42 1ds4 h GLN 20 N 0.17 0.50 -0.53 1.51 5.75 -0.99 0.91 115.11 122.42 1ds4 h GLN 20 Ca -0.07 -0.03 -0.10 0.00 -0.15 0.00 0.00 58.65 58.30 1ds4 h GLN 20 Cb 1.59 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 30.00 1ds4 h GLN 20 CO 0.15 0.33 -0.06 0.87 -2.65 0.00 0.00 178.83 177.48 1ds4 h LYS 21 N 0.51 0.95 -0.33 1.69 1.57 -1.01 0.87 116.57 120.82 1ds4 h LYS 21 Ca 0.14 -0.31 -0.09 0.00 -1.87 0.00 0.00 60.65 58.51 1ds4 h LYS 21 Cb -0.05 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 1ds4 h LYS 21 CO -0.03 0.97 -0.15 0.28 -0.57 0.00 0.00 179.45 179.96 1ds4 h VAL 22 N 0.86 1.29 -0.25 0.50 2.07 -1.02 -2.33 116.25 117.37 1ds4 h VAL 22 Ca 0.15 -1.25 0.04 0.00 0.82 0.00 0.00 66.70 66.46 1ds4 h VAL 22 Cb 0.59 1.40 -0.07 0.00 -1.52 0.00 0.00 31.29 31.69 1ds4 h VAL 22 CO 0.04 0.40 -0.50 0.22 0.02 0.00 0.00 177.57 177.75 1ds4 h TYR 23 N 0.45 -1.50 -0.89 1.57 5.03 -0.62 -1.75 116.97 119.25 1ds4 h TYR 23 Ca 0.07 0.07 0.10 0.00 2.58 0.00 0.00 58.73 61.55 1ds4 h TYR 23 Cb 0.67 0.69 -0.08 0.00 1.55 0.00 0.00 36.73 39.57 1ds4 h TYR 23 CO 0.06 -0.47 0.54 -0.91 -1.32 0.00 0.00 178.16 176.06 1ds4 h ASN 24 N -0.44 0.79 -0.52 -2.11 2.35 -0.69 0.24 115.58 115.19 1ds4 h ASN 24 Ca 0.05 0.04 -0.09 0.00 -0.55 0.00 0.00 56.30 55.76 1ds4 h ASN 24 Cb 0.57 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.81 1ds4 h ASN 24 CO -0.47 0.45 0.01 0.00 -1.65 0.00 0.00 177.43 175.76 1ds4 h ALA 25 N 1.48 0.96 -0.01 -0.83 0.00 -1.09 0.35 119.26 120.11 1ds4 h ALA 25 Ca 0.43 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1ds4 h ALA 25 Cb 0.38 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ds4 h ALA 25 CO -0.24 0.63 0.00 0.82 0.00 0.00 0.00 179.25 180.46 1ds4 h ILE 26 N 0.88 1.10 -0.88 0.00 2.04 -0.38 -1.05 117.51 119.22 1ds4 h ILE 26 Ca 0.16 -0.30 0.01 0.00 1.00 0.00 0.00 64.86 65.73 1ds4 h ILE 26 Cb 0.51 1.29 -0.04 0.00 -0.74 0.00 0.00 36.82 37.83 1ds4 h ILE 26 CO 0.02 0.08 0.58 0.00 0.00 0.00 0.00 178.15 178.84 1ds4 h ALA 27 N 0.88 1.12 -0.29 1.87 0.00 -0.24 -0.16 119.26 122.45 1ds4 h ALA 27 Ca 0.00 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1ds4 h ALA 27 Cb 0.13 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1ds4 h ALA 27 CO -0.00 0.51 -0.22 -0.07 0.00 0.00 0.00 179.25 179.46 1ds4 h LEU 28 N 1.18 0.54 -0.55 0.00 4.07 -0.25 -1.92 115.31 118.39 1ds4 h LEU 28 Ca 0.33 -0.18 -0.16 0.00 0.08 0.00 0.00 57.88 57.95 1ds4 h LEU 28 Cb -0.12 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 41.46 1ds4 h LEU 28 CO -0.08 0.77 -0.67 0.50 -1.08 0.00 0.00 178.44 177.88 1ds4 h LYS 29 N 0.48 0.24 -0.46 1.13 3.64 -0.57 -2.02 116.57 119.01 1ds4 h LYS 29 Ca 0.07 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1ds4 h LYS 29 Cb 0.65 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 1ds4 h LYS 29 CO 0.05 0.82 0.30 -0.07 -2.27 0.00 0.00 179.45 178.28 1ds4 h LEU 30 N 0.17 0.55 -0.22 5.20 3.38 -0.74 -0.83 115.31 122.82 1ds4 h LEU 30 Ca -0.02 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.94 1ds4 h LEU 30 Cb 1.21 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 1ds4 h LEU 30 CO 0.10 0.42 0.08 -0.09 0.09 0.00 0.00 178.44 179.04 1ds4 h ARG 31 N 0.62 0.18 -0.05 1.13 2.43 -1.21 -3.28 114.38 114.20 1ds4 h ARG 31 Ca 0.17 -0.01 -0.21 0.00 -0.81 0.00 0.00 59.98 59.11 1ds4 h ARG 31 Cb -0.04 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1ds4 h ARG 31 CO -0.03 0.12 -0.86 1.49 -1.51 0.00 0.00 179.97 179.18 1ds4 h GLU 32 N 0.18 0.49 -2.28 0.20 4.57 -1.10 -3.32 114.58 113.33 1ds4 h GLU 32 Ca 0.09 -0.46 -0.78 0.00 -1.18 0.00 0.00 59.36 57.03 1ds4 h GLU 32 Cb 0.06 0.12 -0.24 0.00 -0.16 0.00 0.00 28.75 28.52 1ds4 h GLU 32 CO -0.09 1.10 1.27 -0.25 -1.18 0.00 0.00 179.01 179.86 1ds4 n ASP 33 N -3.81 7.48 0.18 1.04 8.00 -0.34 -4.75 116.55 124.35 1ds4 n ASP 33 Ca -0.06 -3.59 0.14 0.00 0.71 0.00 0.00 54.79 51.98 1ds4 n ASP 33 Cb 0.78 -1.19 0.50 0.00 -0.02 0.00 0.00 41.12 41.19 1ds4 n ASP 33 CO 0.00 0.00 0.00 -2.24 -0.39 0.00 0.00 177.20 174.57 1ds4 h ASP 34 N 4.10 0.00 1.46 -2.24 2.03 -1.72 -3.29 116.42 116.76 1ds4 h ASP 34 Ca 0.57 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 56.85 1ds4 h ASP 34 Cb 0.30 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.79 1ds4 h ASP 34 CO 1.25 0.00 -0.55 1.05 -1.03 0.00 0.00 179.24 179.97 1ds4 h GLU 35 N 0.00 0.00 -6.40 4.15 9.09 -1.90 -3.32 114.58 116.20 1ds4 h GLU 35 Ca 0.00 0.00 -0.63 0.00 0.05 0.00 0.00 59.36 58.78 1ds4 h GLU 35 Cb 0.53 0.00 0.08 0.00 -1.65 0.00 0.00 28.75 27.71 1ds4 h GLU 35 CO 0.00 0.05 0.38 0.98 0.05 0.00 0.00 179.01 180.47 1ds4 n TYR 36 N -2.92 1.56 -3.31 2.06 9.36 -1.24 -0.87 117.16 121.79 1ds4 n TYR 36 Ca 0.01 0.60 -0.16 0.00 3.32 0.00 0.00 57.90 61.68 1ds4 n TYR 36 Cb 0.57 -2.33 0.08 0.00 -0.63 0.00 0.00 39.34 37.03 1ds4 n TYR 36 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 1ds4 n ASP 37 N 2.10 -3.47 -3.83 2.98 -0.08 -1.26 -0.71 116.55 112.28 1ds4 n ASP 37 Ca 0.14 -0.62 -0.25 0.00 -1.51 0.00 0.00 54.79 52.55 1ds4 n ASP 37 Cb 0.26 -4.98 0.01 0.00 2.34 0.00 0.00 41.12 38.75 1ds4 n ASP 37 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1ds4 n ASN 38 N -3.09 -1.34 -1.47 1.67 4.13 -1.15 -1.90 115.26 112.12 1ds4 n ASN 38 Ca -0.21 -0.95 -0.16 0.00 1.68 0.00 0.00 54.58 54.94 1ds4 n ASN 38 Cb 0.65 -3.43 -0.04 0.00 -1.54 0.00 0.00 39.78 35.42 1ds4 n ASN 38 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1ds4 n TYR 39 N -4.32 -0.31 0.08 3.10 4.01 -0.05 -4.86 117.16 114.81 1ds4 n TYR 39 Ca -0.28 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.33 1ds4 n TYR 39 Cb 0.67 -2.98 -0.07 0.00 -0.31 0.00 0.00 39.34 36.65 1ds4 n TYR 39 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 1ds4 h ILE 40 N 0.00 1.46 0.00 -0.72 2.04 -0.62 -3.47 117.51 116.20 1ds4 h ILE 40 Ca -0.35 -2.70 0.00 0.00 1.00 0.00 0.00 64.86 62.81 1ds4 h ILE 40 Cb 1.14 2.61 0.00 0.00 -0.74 0.00 0.00 36.82 39.83 1ds4 h ILE 40 CO 0.47 0.80 0.00 0.61 0.00 0.00 0.00 178.15 180.02 1ds4 n GLY 41 N 1.14 -0.72 0.67 5.37 0.00 0.11 -4.63 105.19 107.13 1ds4 n GLY 41 Ca -0.07 -1.72 0.11 0.00 0.00 0.00 0.00 46.02 44.34 1ds4 n GLY 41 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ds4 n TYR 42 N -0.71 0.22 0.32 1.61 4.02 -1.26 -4.45 117.16 116.91 1ds4 n TYR 42 Ca 0.00 -0.11 -0.18 0.00 -0.01 0.00 0.00 57.90 57.60 1ds4 n TYR 42 Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.23 1ds4 n TYR 42 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1ds4 h GLY 43 N 4.89 -1.06 0.58 2.72 0.00 -1.94 -2.37 103.07 105.90 1ds4 h GLY 43 Ca 0.00 0.46 0.06 0.00 0.00 0.00 0.00 47.33 47.85 1ds4 h GLY 43 CO 0.00 -0.36 0.18 -2.55 0.00 0.00 0.00 176.54 173.81 1ds4 h PRO 44 N -0.95 0.36 0.00 4.80 0.11 -1.89 -2.11 132.00 132.32 1ds4 h PRO 44 Ca -0.07 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.97 1ds4 h PRO 44 Cb 0.79 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.81 1ds4 h PRO 44 CO 0.03 0.24 -0.23 -0.24 -0.21 0.00 0.00 178.00 177.58 1ds4 h VAL 45 N 0.37 0.87 -0.26 3.15 3.04 -1.82 -0.77 116.25 120.83 1ds4 h VAL 45 Ca 0.23 -0.90 -0.13 0.00 -1.01 0.00 0.00 66.70 64.89 1ds4 h VAL 45 Cb 0.22 1.53 -0.01 0.00 -2.01 0.00 0.00 31.29 31.02 1ds4 h VAL 45 CO -0.22 0.23 -0.39 -0.07 -1.01 0.00 0.00 177.57 176.11 1ds4 h LEU 46 N 0.00 0.64 0.00 3.16 3.38 -0.92 0.87 115.31 122.43 1ds4 h LEU 46 Ca -0.00 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.63 1ds4 h LEU 46 Cb 0.51 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1ds4 h LEU 46 CO 0.03 0.96 -0.50 -0.37 0.09 0.00 0.00 178.44 178.65 1ds4 h VAL 47 N 0.50 0.36 -0.47 1.22 -1.51 -0.59 -2.00 116.25 113.75 1ds4 h VAL 47 Ca 0.04 -1.54 -0.14 0.00 -1.23 0.00 0.00 66.70 63.84 1ds4 h VAL 47 Cb 0.90 2.07 -0.01 0.00 -2.13 0.00 0.00 31.29 32.12 1ds4 h VAL 47 CO 0.08 0.20 -0.23 -0.09 -1.23 0.00 0.00 177.57 176.30 1ds4 h ARG 48 N 0.00 0.99 -0.52 5.19 2.43 -1.06 -1.95 114.38 119.45 1ds4 h ARG 48 Ca -0.02 -0.44 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 1ds4 h ARG 48 Cb 1.20 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.70 1ds4 h ARG 48 CO 0.03 1.11 0.33 1.25 -1.51 0.00 0.00 179.97 181.18 1ds4 h LEU 49 N 0.85 0.62 -1.00 3.80 5.85 -0.67 -0.78 115.31 123.98 1ds4 h LEU 49 Ca 0.10 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1ds4 h LEU 49 Cb 0.82 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.65 1ds4 h LEU 49 CO 0.07 0.47 0.48 0.00 -0.34 0.00 0.00 178.44 179.13 1ds4 h ALA 50 N 1.17 1.24 -0.27 1.25 0.00 -1.29 -1.51 119.26 119.85 1ds4 h ALA 50 Ca 0.19 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1ds4 h ALA 50 Cb -0.05 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 1ds4 h ALA 50 CO -0.04 0.63 -0.04 2.35 0.00 0.00 0.00 179.25 182.15 1ds4 h TRP 51 N 1.20 0.55 -0.64 0.00 -0.00 -0.98 -2.74 115.95 113.34 1ds4 h TRP 51 Ca 0.30 -0.11 -0.08 0.00 -0.00 0.00 0.00 58.89 59.01 1ds4 h TRP 51 Cb 0.00 -0.14 -0.03 0.00 -0.00 0.00 0.00 29.16 29.00 1ds4 h TRP 51 CO 0.01 0.69 0.10 0.45 -0.00 0.00 0.00 178.44 179.68 1ds4 h HIS 52 N 0.26 1.11 0.00 2.65 3.86 -0.89 0.37 115.15 122.51 1ds4 h HIS 52 Ca 0.07 -0.15 -0.06 0.00 -1.16 0.00 0.00 60.37 59.07 1ds4 h HIS 52 Cb 0.49 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.65 1ds4 h HIS 52 CO 0.05 0.94 -0.30 -0.84 0.86 0.00 0.00 177.93 178.64 1ds4 h ILE 53 N 0.98 0.81 0.03 2.45 -0.00 -1.32 -3.16 117.51 117.30 1ds4 h ILE 53 Ca 0.20 -1.23 -0.29 0.00 -0.00 0.00 0.00 64.86 63.54 1ds4 h ILE 53 Cb 0.43 1.76 -0.04 0.00 -0.00 0.00 0.00 36.82 38.97 1ds4 h ILE 53 CO 0.01 0.29 -1.57 0.28 -0.00 0.00 0.00 178.15 177.16 1ds4 h SER 54 N 0.00 0.10 0.00 2.16 0.02 -1.08 -3.23 113.55 111.52 1ds4 h SER 54 Ca -0.00 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 1ds4 h SER 54 Cb 0.73 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.24 1ds4 h SER 54 CO 0.04 1.16 0.00 0.61 -1.14 0.00 0.00 176.83 177.49 1ds4 n GLY 55 N 1.58 -0.79 0.05 -3.77 0.00 0.12 -2.27 105.19 100.11 1ds4 n GLY 55 Ca -0.15 -0.15 0.14 0.00 0.00 0.00 0.00 46.02 45.86 1ds4 n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ds4 n THR 56 N -0.97 0.00 -1.68 2.61 -2.24 -1.23 -4.56 114.28 106.20 1ds4 n THR 56 Ca 0.18 -0.03 -0.38 0.00 -2.27 0.00 0.00 64.05 61.56 1ds4 n THR 56 Cb 0.08 -0.28 0.06 0.00 -2.10 0.00 0.00 70.33 68.09 1ds4 n THR 56 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 1ds4 n TRP 57 N -1.17 1.48 -3.81 4.78 -0.00 -0.96 -4.19 117.44 113.56 1ds4 n TRP 57 Ca 0.13 0.43 -0.26 0.00 -0.00 0.00 0.00 57.50 57.80 1ds4 n TRP 57 Cb 0.27 -2.22 -0.17 0.00 -0.00 0.00 0.00 31.31 29.19 1ds4 n TRP 57 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 1ds4 s ASP 58 N -1.26 2.32 0.60 5.87 -1.08 0.37 -4.71 116.67 118.78 1ds4 s ASP 58 Ca 0.78 -0.45 0.31 0.00 -0.52 0.00 0.00 52.55 52.67 1ds4 s ASP 58 Cb -0.40 -0.66 1.80 0.00 -1.46 0.00 0.00 42.92 42.19 1ds4 s ASP 58 CO 0.44 -0.21 2.18 0.07 0.52 0.00 0.00 175.17 178.18 1ds4 h LYS 59 N 8.23 0.00 -0.33 4.34 2.10 -1.79 0.40 116.57 129.52 1ds4 h LYS 59 Ca -0.22 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.34 1ds4 h LYS 59 Cb 1.12 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.44 1ds4 h LYS 59 CO 0.34 0.00 -0.16 0.45 -2.00 0.00 0.00 179.45 178.08 1ds4 h HIS 60 N 0.00 0.80 0.00 0.07 3.86 -1.95 -3.35 115.15 114.58 1ds4 h HIS 60 Ca 0.04 -0.20 0.00 0.00 -1.16 0.00 0.00 60.37 59.05 1ds4 h HIS 60 Cb 0.26 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 28.54 1ds4 h HIS 60 CO 0.00 0.90 -0.06 -0.40 0.86 0.00 0.00 177.93 179.24 1ds4 n ASP 61 N -4.35 1.34 -4.12 2.45 5.68 -1.11 -4.99 116.55 111.46 1ds4 n ASP 61 Ca -0.03 -1.97 -0.33 0.00 -0.50 0.00 0.00 54.79 51.97 1ds4 n ASP 61 Cb 0.39 -0.11 -0.02 0.00 -1.14 0.00 0.00 41.12 40.24 1ds4 n ASP 61 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1ds4 n ASN 62 N -0.51 -2.66 -4.95 -1.12 5.15 0.11 -4.30 115.26 106.99 1ds4 n ASN 62 Ca 0.03 -0.99 -0.24 0.00 -0.60 0.00 0.00 54.58 52.79 1ds4 n ASN 62 Cb 0.44 -2.96 0.00 0.00 -0.53 0.00 0.00 39.78 36.73 1ds4 n ASN 62 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1ds4 s THR 63 N -3.48 4.50 0.00 -0.44 -4.23 -1.22 -4.89 115.64 105.88 1ds4 s THR 63 Ca 0.53 -0.44 0.00 0.00 -1.18 0.00 0.00 61.69 60.60 1ds4 s THR 63 Cb -0.29 -3.66 0.00 0.00 1.34 0.00 0.00 72.50 69.90 1ds4 s THR 63 CO 0.91 -0.46 0.00 0.61 -0.54 0.00 0.00 174.62 175.14 1ds4 n GLY 64 N -1.97 -0.21 0.00 3.99 0.00 -1.26 -0.48 105.19 105.26 1ds4 n GLY 64 Ca -0.01 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 44.98 1ds4 n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ds4 n GLY 65 N 0.00 -0.01 0.20 -0.02 0.00 -1.26 -4.68 105.19 99.42 1ds4 n GLY 65 Ca 0.00 -1.74 0.08 0.00 0.00 0.00 0.00 46.02 44.36 1ds4 n GLY 65 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ds4 h SER 66 N 0.00 0.00 -0.30 1.61 4.64 -1.76 -3.38 113.55 114.35 1ds4 h SER 66 Ca 0.00 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.39 1ds4 h SER 66 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.02 1ds4 h SER 66 CO 0.00 0.29 -0.14 0.22 -0.87 0.00 0.00 176.83 176.33 1ds4 h TYR 67 N 0.00 -0.34 -0.00 4.77 3.20 -1.85 -2.75 116.97 119.99 1ds4 h TYR 67 Ca -0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1ds4 h TYR 67 Cb 0.91 0.20 0.00 0.00 1.54 0.00 0.00 36.73 39.38 1ds4 h TYR 67 CO 0.00 -0.21 -0.03 0.41 -1.64 0.00 0.00 178.16 176.69 1ds4 n GLY 68 N -1.32 -1.19 3.68 1.82 0.00 -1.25 -2.51 105.19 104.42 1ds4 n GLY 68 Ca 0.00 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.59 1ds4 n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ds4 n GLY 69 N 1.27 -0.53 0.01 -0.02 0.00 -1.04 -1.67 105.19 103.21 1ds4 n GLY 69 Ca 0.15 0.23 0.14 0.00 0.00 0.00 0.00 46.02 46.54 1ds4 n GLY 69 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ds4 n THR 70 N -4.89 0.00 0.34 2.61 -2.24 -1.26 -3.27 114.28 105.56 1ds4 n THR 70 Ca 0.02 -0.00 0.20 0.00 -2.27 0.00 0.00 64.05 61.99 1ds4 n THR 70 Cb 0.55 -0.44 1.06 0.00 -2.10 0.00 0.00 70.33 69.40 1ds4 n THR 70 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1ds4 h TYR 71 N 0.03 0.00 0.00 4.78 3.20 -1.95 -1.61 116.97 121.42 1ds4 h TYR 71 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1ds4 h TYR 71 Cb 0.43 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.70 1ds4 h TYR 71 CO 0.00 0.00 0.00 2.89 -1.64 0.00 0.00 178.16 179.41 1ds4 n ARG 72 N -2.99 0.14 -3.46 1.82 1.85 -1.20 -3.51 116.66 109.31 1ds4 n ARG 72 Ca -0.03 0.38 -0.35 0.00 -1.00 0.00 0.00 57.85 56.86 1ds4 n ARG 72 Cb 0.19 -1.78 -0.06 0.00 -1.05 0.00 0.00 32.46 29.77 1ds4 n ARG 72 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1ds4 s PHE 73 N -3.24 3.57 0.22 2.89 0.08 -0.61 -4.93 117.98 115.97 1ds4 s PHE 73 Ca 0.05 0.91 -0.09 0.00 0.12 0.00 0.00 56.93 57.92 1ds4 s PHE 73 Cb 0.09 -2.26 0.32 0.00 -0.57 0.00 0.00 43.02 40.60 1ds4 s PHE 73 CO 0.36 0.45 1.72 -0.22 -0.10 0.00 0.00 175.22 177.43 1ds4 h LYS 74 N 3.48 0.32 -0.33 0.44 1.63 -1.87 -0.79 116.57 119.45 1ds4 h LYS 74 Ca -0.48 -0.02 0.06 0.00 -0.85 0.00 0.00 60.65 59.35 1ds4 h LYS 74 Cb 1.19 -0.07 -0.05 0.00 -0.60 0.00 0.00 32.23 32.69 1ds4 h LYS 74 CO 0.67 0.21 -0.00 -0.22 -3.45 0.00 0.00 179.45 176.65 1ds4 h LYS 75 N 0.33 0.09 -0.01 1.90 3.64 -1.94 0.47 116.57 121.04 1ds4 h LYS 75 Ca 0.33 -0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.59 1ds4 h LYS 75 Cb 0.47 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.28 1ds4 h LYS 75 CO -0.38 0.06 -0.45 1.49 -2.27 0.00 0.00 179.45 177.90 1ds4 h GLU 76 N 0.09 0.33 -0.77 1.90 4.81 -1.71 -2.12 114.58 117.10 1ds4 h GLU 76 Ca 0.16 -0.33 0.21 0.00 -0.13 0.00 0.00 59.36 59.27 1ds4 h GLU 76 Cb 0.22 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 1ds4 h GLU 76 CO -0.27 1.02 0.54 0.35 -0.73 0.00 0.00 179.01 179.92 1ds4 h PHE 77 N -0.24 0.08 -0.01 0.92 3.57 -0.90 -1.77 116.94 118.58 1ds4 h PHE 77 Ca -0.05 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.45 1ds4 h PHE 77 Cb 1.17 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.89 1ds4 h PHE 77 CO 0.15 0.02 -0.41 0.09 -2.23 0.00 0.00 178.31 175.94 1ds4 n ASN 78 N -4.34 1.72 -4.69 0.41 5.03 0.16 -4.87 115.26 108.68 1ds4 n ASN 78 Ca 0.15 -1.33 -0.58 0.00 0.87 0.00 0.00 54.58 53.70 1ds4 n ASN 78 Cb 0.80 0.37 -0.07 0.00 -1.02 0.00 0.00 39.78 39.85 1ds4 n ASN 78 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 1ds4 n ASP 79 N -0.21 2.16 -0.03 6.41 -0.08 -0.67 -4.81 116.55 119.32 1ds4 n ASP 79 Ca 0.10 1.09 0.20 0.00 -1.51 0.00 0.00 54.79 54.67 1ds4 n ASP 79 Cb 0.43 -1.12 0.67 0.00 2.34 0.00 0.00 41.12 43.44 1ds4 n ASP 79 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1ds4 h PRO 80 N 6.62 0.05 0.00 -0.67 0.11 -1.91 0.50 132.00 136.70 1ds4 h PRO 80 Ca -0.46 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1ds4 h PRO 80 Cb 1.33 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.42 1ds4 h PRO 80 CO 0.93 0.03 -0.01 0.77 -0.21 0.00 0.00 178.00 179.51 1ds4 h SER 81 N 0.05 0.00 -0.68 -2.05 0.02 -1.94 -2.21 113.55 106.74 1ds4 h SER 81 Ca 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1ds4 h SER 81 Cb 1.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.56 1ds4 h SER 81 CO -0.02 0.01 0.00 0.59 -1.14 0.00 0.00 176.83 176.28 1ds4 n ASN 82 N -3.30 4.50 -4.70 3.07 3.02 0.18 -4.98 115.26 113.05 1ds4 n ASN 82 Ca -0.02 -2.29 -0.43 0.00 -0.03 0.00 0.00 54.58 51.81 1ds4 n ASN 82 Cb 0.12 -0.55 -0.03 0.00 -0.61 0.00 0.00 39.78 38.71 1ds4 n ASN 82 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ds4 n ALA 83 N 1.32 2.38 0.00 5.41 0.00 -0.83 -0.73 120.51 128.05 1ds4 n ALA 83 Ca 0.25 0.35 0.00 0.00 0.00 0.00 0.00 53.44 54.05 1ds4 n ALA 83 Cb 0.80 -2.55 0.00 0.00 0.00 0.00 0.00 19.45 17.69 1ds4 n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ds4 n GLY 84 N 4.10 3.29 0.11 0.00 0.00 -1.26 -4.81 105.19 106.62 1ds4 n GLY 84 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 1ds4 n GLY 84 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ds4 n LEU 85 N 0.00 0.64 -0.02 0.99 4.77 0.09 -2.42 117.00 121.04 1ds4 n LEU 85 Ca 0.00 0.63 0.15 0.00 -0.03 0.00 0.00 56.01 56.76 1ds4 n LEU 85 Cb 0.00 -0.51 0.59 0.00 -2.33 0.00 0.00 43.42 41.17 1ds4 n LEU 85 CO 0.00 -0.43 1.18 1.56 -1.33 0.00 0.00 177.39 178.36 1ds4 h GLN 86 N 0.00 0.21 -0.80 3.23 7.50 -1.91 -0.54 115.11 122.80 1ds4 h GLN 86 Ca 0.00 -0.01 -0.01 0.00 0.50 0.00 0.00 58.65 59.13 1ds4 h GLN 86 Cb 0.45 -0.05 -0.04 0.00 0.05 0.00 0.00 27.48 27.89 1ds4 h GLN 86 CO 0.00 0.14 0.47 -0.91 -1.50 0.00 0.00 178.83 177.03 1ds4 h ASN 87 N 0.22 0.96 -0.43 1.46 2.35 -1.88 0.47 115.58 118.73 1ds4 h ASN 87 Ca 0.25 -0.07 -0.13 0.00 -0.55 0.00 0.00 56.30 55.79 1ds4 h ASN 87 Cb 0.69 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.80 1ds4 h ASN 87 CO -0.05 0.75 -0.24 1.23 -1.65 0.00 0.00 177.43 177.47 1ds4 h GLY 88 N 1.09 1.03 1.44 2.83 0.00 -1.31 -1.71 103.07 106.44 1ds4 h GLY 88 Ca 0.28 -0.93 -0.09 0.00 0.00 0.00 0.00 47.33 46.59 1ds4 h GLY 88 CO -0.05 0.85 -0.14 -2.75 0.00 0.00 0.00 176.54 174.44 1ds4 h PHE 89 N 0.82 0.73 -0.32 5.60 3.57 -0.82 -2.50 116.94 124.02 1ds4 h PHE 89 Ca 0.10 -0.13 -0.15 0.00 3.53 0.00 0.00 57.97 61.32 1ds4 h PHE 89 Cb 0.81 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.36 1ds4 h PHE 89 CO 0.05 0.77 -0.40 0.87 -2.23 0.00 0.00 178.31 177.37 1ds4 h LYS 90 N 0.60 0.77 -0.72 1.11 1.57 -0.78 -2.00 116.57 117.12 1ds4 h LYS 90 Ca 0.10 -0.41 0.09 0.00 -1.87 0.00 0.00 60.65 58.57 1ds4 h LYS 90 Cb 0.59 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.84 1ds4 h LYS 90 CO 0.04 1.03 0.36 0.35 -0.57 0.00 0.00 179.45 180.66 1ds4 h PHE 91 N 0.63 0.64 0.00 -1.35 3.04 -1.00 -2.90 116.94 116.00 1ds4 h PHE 91 Ca 0.05 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.03 1ds4 h PHE 91 Cb 0.96 -0.18 0.00 0.00 2.56 0.00 0.00 35.95 39.29 1ds4 h PHE 91 CO 0.05 0.23 -0.11 -0.07 -2.02 0.00 0.00 178.31 176.39 1ds4 h LEU 92 N 0.61 0.00 -0.26 0.59 3.38 -1.01 -3.35 115.31 115.27 1ds4 h LEU 92 Ca 0.35 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.37 1ds4 h LEU 92 Cb 0.37 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.05 1ds4 h LEU 92 CO -0.27 0.01 -0.23 -0.33 0.09 0.00 0.00 178.44 177.70 1ds4 h GLU 93 N 0.00 -0.22 0.00 1.13 5.08 -1.16 0.13 114.58 119.55 1ds4 h GLU 93 Ca 0.00 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1ds4 h GLU 93 Cb 0.89 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 1ds4 h GLU 93 CO 0.00 -0.15 -0.01 -1.00 -1.00 0.00 0.00 179.01 176.86 1ds4 h PRO 94 N -0.23 0.00 -0.11 2.33 0.13 -1.75 -0.18 132.00 132.20 1ds4 h PRO 94 Ca 0.14 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 65.05 1ds4 h PRO 94 Cb 0.45 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.59 1ds4 h PRO 94 CO -0.40 0.01 -0.79 0.82 -0.23 0.00 0.00 178.00 177.40 1ds4 h ILE 95 N 0.00 1.29 -0.49 -3.56 5.03 -1.26 -2.00 117.51 116.52 1ds4 h ILE 95 Ca -0.00 -2.01 -0.04 0.00 -0.12 0.00 0.00 64.86 62.69 1ds4 h ILE 95 Cb 0.01 2.12 -0.02 0.00 -3.03 0.00 0.00 36.82 35.89 1ds4 h ILE 95 CO 0.00 0.63 0.13 -0.74 -0.68 0.00 0.00 178.15 177.50 1ds4 h HIS 96 N 0.43 0.75 -0.24 1.37 2.76 -0.20 -0.52 115.15 119.50 1ds4 h HIS 96 Ca -0.07 -0.06 -0.10 0.00 -2.20 0.00 0.00 60.37 57.94 1ds4 h HIS 96 Cb 1.44 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 30.16 1ds4 h HIS 96 CO 0.10 0.62 -0.29 0.87 -1.30 0.00 0.00 177.93 177.93 1ds4 h LYS 97 N 0.71 0.47 0.01 5.26 1.79 -0.91 -2.06 116.57 121.85 1ds4 h LYS 97 Ca 0.16 -0.19 -0.21 0.00 -2.18 0.00 0.00 60.65 58.23 1ds4 h LYS 97 Cb 0.24 -0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 30.87 1ds4 h LYS 97 CO -0.01 0.72 -0.93 1.49 -1.08 0.00 0.00 179.45 179.64 1ds4 h GLU 98 N 0.41 0.28 -2.22 3.15 4.81 -0.83 -3.36 114.58 116.82 1ds4 h GLU 98 Ca 0.05 -0.32 -0.61 0.00 -0.13 0.00 0.00 59.36 58.36 1ds4 h GLU 98 Cb 0.72 0.09 -0.42 0.00 0.63 0.00 0.00 28.75 29.78 1ds4 h GLU 98 CO 0.06 1.03 -0.54 1.19 -0.73 0.00 0.00 179.01 180.02 1ds4 n PHE 99 N -3.68 3.62 0.27 0.92 3.72 -0.25 -4.92 117.46 117.14 1ds4 n PHE 99 Ca -0.05 -4.10 0.12 0.00 -0.05 0.00 0.00 57.45 53.36 1ds4 n PHE 99 Cb 0.84 -0.58 0.55 0.00 -0.94 0.00 0.00 39.48 39.34 1ds4 n PHE 99 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1ds4 n PRO 100 N 0.85 0.17 0.13 -1.08 -0.04 -0.79 -2.31 135.00 131.93 1ds4 n PRO 100 Ca 0.30 0.54 0.13 0.00 -0.04 0.00 0.00 63.50 64.43 1ds4 n PRO 100 Cb 0.41 -1.93 0.37 0.00 -0.04 0.00 0.00 33.50 32.30 1ds4 n PRO 100 CO 0.00 0.00 0.00 0.11 -0.04 0.00 0.00 175.50 175.57 1ds4 h TRP 101 N 0.00 0.00 -3.78 0.54 5.08 -1.91 -3.45 115.95 112.42 1ds4 h TRP 101 Ca 0.00 0.00 -0.48 0.00 1.08 0.00 0.00 58.89 59.49 1ds4 h TRP 101 Cb 0.17 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.31 1ds4 h TRP 101 CO 0.00 0.00 0.31 -1.50 -1.28 0.00 0.00 178.44 175.97 1ds4 s ILE 102 N -3.12 4.21 0.73 0.12 2.07 -0.98 -4.93 121.20 119.29 1ds4 s ILE 102 Ca 0.10 1.86 -0.11 0.00 -1.41 0.00 0.00 60.65 61.09 1ds4 s ILE 102 Cb 0.11 -4.11 0.03 0.00 0.13 0.00 0.00 42.46 38.61 1ds4 s ILE 102 CO 0.61 0.30 1.07 -0.94 -1.91 0.00 0.00 174.94 174.07 1ds4 s SER 103 N -1.44 5.03 0.19 4.50 1.04 -1.26 -4.88 113.70 116.89 1ds4 s SER 103 Ca 0.45 1.68 -0.08 0.00 0.48 0.00 0.00 55.95 58.49 1ds4 s SER 103 Cb -0.21 -2.49 0.11 0.00 0.10 0.00 0.00 66.02 63.52 1ds4 s SER 103 CO 0.26 -1.68 1.66 0.28 0.98 0.00 0.00 173.24 174.75 1ds4 h SER 104 N -0.88 1.03 -0.69 7.02 0.02 -1.90 -1.33 113.55 116.82 1ds4 h SER 104 Ca -0.44 -0.28 -0.05 0.00 -0.84 0.00 0.00 61.79 60.18 1ds4 h SER 104 Cb 1.22 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 63.45 1ds4 h SER 104 CO 0.55 1.07 0.23 1.23 -1.14 0.00 0.00 176.83 178.76 1ds4 h GLY 105 N 1.00 1.15 1.26 -3.77 0.00 -1.79 -0.10 103.07 100.82 1ds4 h GLY 105 Ca 0.18 -0.67 -0.08 0.00 0.00 0.00 0.00 47.33 46.76 1ds4 h GLY 105 CO 0.03 0.63 0.01 -0.55 0.00 0.00 0.00 176.54 176.65 1ds4 h ASP 106 N 1.01 0.87 -0.26 0.19 5.19 -1.77 -1.32 116.42 120.33 1ds4 h ASP 106 Ca 0.22 -0.22 -0.15 0.00 -0.62 0.00 0.00 57.03 56.27 1ds4 h ASP 106 Cb 0.28 -0.23 -0.00 0.00 0.18 0.00 0.00 39.33 39.56 1ds4 h ASP 106 CO -0.01 0.92 -0.42 0.25 -3.12 0.00 0.00 179.24 176.87 1ds4 h LEU 107 N 0.83 0.81 -0.44 1.55 5.85 -0.87 0.16 115.31 123.21 1ds4 h LEU 107 Ca 0.16 -0.52 -0.03 0.00 0.84 0.00 0.00 57.88 58.33 1ds4 h LEU 107 Cb 0.48 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1ds4 h LEU 107 CO 0.02 1.18 0.18 -0.26 -0.34 0.00 0.00 178.44 179.21 1ds4 h PHE 108 N 0.47 0.67 -0.14 1.25 0.04 -0.92 0.11 116.94 118.41 1ds4 h PHE 108 Ca 0.02 -0.05 -0.19 0.00 2.80 0.00 0.00 57.97 60.55 1ds4 h PHE 108 Cb 1.01 -0.20 -0.00 0.00 2.20 0.00 0.00 35.95 38.96 1ds4 h PHE 108 CO 0.08 0.58 -0.68 0.66 -0.60 0.00 0.00 178.31 178.35 1ds4 h SER 109 N 0.57 0.66 0.56 2.17 4.64 -1.19 -2.68 113.55 118.28 1ds4 h SER 109 Ca 0.15 -0.40 -0.10 0.00 -0.47 0.00 0.00 61.79 60.97 1ds4 h SER 109 Cb 0.19 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1ds4 h SER 109 CO -0.01 1.15 -0.46 0.25 -0.87 0.00 0.00 176.83 176.89 1ds4 h LEU 110 N 0.40 0.00 -1.45 5.97 5.85 -0.51 -1.92 115.31 123.65 1ds4 h LEU 110 Ca -0.02 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.72 1ds4 h LEU 110 Cb 1.26 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.25 1ds4 h LEU 110 CO 0.13 0.46 0.39 1.23 -0.34 0.00 0.00 178.44 180.30 1ds4 h GLY 111 N 1.58 0.81 0.97 3.75 0.00 -0.45 0.00 103.07 109.73 1ds4 h GLY 111 Ca -0.00 -0.29 -0.16 0.00 0.00 0.00 0.00 47.33 46.88 1ds4 h GLY 111 CO 0.06 0.26 -0.52 -1.33 0.00 0.00 0.00 176.54 175.01 1ds4 h GLY 112 N 0.73 0.69 0.99 4.60 0.00 -1.16 -1.93 103.07 107.00 1ds4 h GLY 112 Ca 0.23 -0.91 -0.00 0.00 0.00 0.00 0.00 47.33 46.65 1ds4 h GLY 112 CO -0.06 0.82 0.31 -2.08 0.00 0.00 0.00 176.54 175.53 1ds4 h VAL 113 N 0.30 1.14 -0.06 4.60 2.07 -1.20 -1.41 116.25 121.69 1ds4 h VAL 113 Ca -0.02 -0.31 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 1ds4 h VAL 113 Cb 1.15 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 31.37 1ds4 h VAL 113 CO 0.11 0.14 0.03 0.74 0.02 0.00 0.00 177.57 178.62 1ds4 h THR 114 N 0.67 1.09 -0.28 2.57 2.02 -0.90 -1.46 112.91 116.61 1ds4 h THR 114 Ca 0.18 -0.25 0.03 0.00 0.77 0.00 0.00 66.41 67.14 1ds4 h THR 114 Cb -0.03 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 1ds4 h THR 114 CO -0.04 0.07 0.10 0.00 0.37 0.00 0.00 175.52 176.03 1ds4 h ALA 115 N 0.93 0.32 -0.53 6.16 0.00 -1.26 0.98 119.26 125.86 1ds4 h ALA 115 Ca 0.02 0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1ds4 h ALA 115 Cb 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1ds4 h ALA 115 CO -0.00 -0.30 0.30 0.28 0.00 0.00 0.00 179.25 179.53 1ds4 h VAL 116 N 0.23 1.02 -0.40 0.00 2.07 -1.05 -0.64 116.25 117.48 1ds4 h VAL 116 Ca 0.12 -0.20 -0.14 0.00 0.82 0.00 0.00 66.70 67.30 1ds4 h VAL 116 Cb 0.08 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 1ds4 h VAL 116 CO -0.12 0.11 -0.31 1.56 0.02 0.00 0.00 177.57 178.83 1ds4 h GLN 117 N 0.59 0.90 -0.01 1.57 4.20 -0.90 0.67 115.11 122.14 1ds4 h GLN 117 Ca 0.22 -0.42 -0.11 0.00 0.06 0.00 0.00 58.65 58.40 1ds4 h GLN 117 Cb 0.06 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 1ds4 h GLN 117 CO -0.12 1.08 -0.51 0.93 -0.67 0.00 0.00 178.83 179.54 1ds4 h GLU 118 N 0.75 0.02 -0.74 1.46 4.39 -0.56 -2.33 114.58 117.57 1ds4 h GLU 118 Ca 0.08 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.77 1ds4 h GLU 118 Cb 0.88 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.53 1ds4 h GLU 118 CO 0.08 0.53 0.00 -1.33 -1.16 0.00 0.00 179.01 177.13 1ds4 n MET 119 N -3.93 1.26 -1.66 2.33 2.81 -0.27 -4.83 117.12 112.83 1ds4 n MET 119 Ca -0.01 -0.23 -0.04 0.00 -1.81 0.00 0.00 57.70 55.60 1ds4 n MET 119 Cb 0.53 -1.43 -0.01 0.00 -0.71 0.00 0.00 33.22 31.60 1ds4 n MET 119 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1ds4 n GLN 120 N -0.05 -0.32 -0.10 0.03 6.02 -0.88 -0.72 117.38 121.37 1ds4 n GLN 120 Ca 0.02 0.40 0.00 0.00 -0.01 0.00 0.00 57.00 57.42 1ds4 n GLN 120 Cb 0.26 -4.12 0.00 0.00 1.02 0.00 0.00 30.24 27.40 1ds4 n GLN 120 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ds4 n GLY 121 N -1.65 -0.47 3.81 1.08 0.00 0.22 -4.71 105.19 103.46 1ds4 n GLY 121 Ca -0.05 -1.73 -0.30 0.00 0.00 0.00 0.00 46.02 43.95 1ds4 n GLY 121 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ds4 s PRO 122 N -1.44 2.00 0.26 1.61 0.04 -1.26 -4.74 135.00 131.47 1ds4 s PRO 122 Ca 0.00 0.57 -0.30 0.00 0.04 0.00 0.00 61.00 61.31 1ds4 s PRO 122 Cb 0.00 -1.91 -0.10 0.00 0.04 0.00 0.00 34.50 32.53 1ds4 s PRO 122 CO 0.00 -1.66 1.35 0.15 0.04 0.00 0.00 177.00 176.88 1ds4 s LYS 123 N -5.20 4.34 -0.32 4.56 -0.14 -1.26 -4.48 119.74 117.24 1ds4 s LYS 123 Ca 0.61 2.19 -0.01 0.00 -1.36 0.00 0.00 55.97 57.39 1ds4 s LYS 123 Cb -0.14 -3.13 0.06 0.00 -1.68 0.00 0.00 37.83 32.95 1ds4 s LYS 123 CO 0.54 -0.28 0.03 0.42 -0.76 0.00 0.00 175.35 175.30 1ds4 s ILE 124 N -0.32 2.93 0.30 2.17 -1.09 -1.26 -4.82 121.20 119.11 1ds4 s ILE 124 Ca 0.55 -1.59 -0.29 0.00 -2.23 0.00 0.00 60.65 57.09 1ds4 s ILE 124 Cb -0.39 -2.78 -0.13 0.00 -1.58 0.00 0.00 42.46 37.58 1ds4 s ILE 124 CO 0.44 -0.24 1.30 -2.65 -1.23 0.00 0.00 174.94 172.57 1ds4 n PRO 125 N 4.58 2.01 -4.21 2.79 -0.02 -1.26 -4.72 135.00 134.16 1ds4 n PRO 125 Ca -0.10 0.71 -0.16 0.00 -2.02 0.00 0.00 63.50 61.92 1ds4 n PRO 125 Cb 0.43 -2.30 -0.14 0.00 -0.02 0.00 0.00 33.50 31.47 1ds4 n PRO 125 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 1ds4 s TRP 126 N -0.70 0.57 0.01 6.00 -0.00 -0.38 -4.77 118.94 119.67 1ds4 s TRP 126 Ca 0.61 -0.13 0.07 0.00 -0.00 0.00 0.00 56.10 56.65 1ds4 s TRP 126 Cb -0.61 -0.36 -0.03 0.00 -0.00 0.00 0.00 33.47 32.46 1ds4 s TRP 126 CO 0.57 -0.01 -0.19 1.03 -0.00 0.00 0.00 176.95 178.35 1ds4 s ARG 127 N -0.22 2.14 0.50 5.86 1.81 -1.26 -0.63 118.95 127.15 1ds4 s ARG 127 Ca 0.02 -0.92 0.03 0.00 -1.72 0.00 0.00 55.73 53.14 1ds4 s ARG 127 Cb -0.03 -2.19 0.02 0.00 -0.45 0.00 0.00 34.95 32.31 1ds4 s ARG 127 CO -0.00 0.56 0.70 0.00 -0.68 0.00 0.00 175.30 175.87 1ds4 n GLY 129 N -2.16 1.20 3.76 0.00 0.00 -1.26 -4.72 105.19 102.01 1ds4 n GLY 129 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 1ds4 n GLY 129 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ds4 s ARG 130 N 0.00 3.19 -0.08 1.61 0.52 -1.26 -0.27 118.95 122.66 1ds4 s ARG 130 Ca 0.00 1.93 0.02 0.00 -0.52 0.00 0.00 55.73 57.16 1ds4 s ARG 130 Cb 0.00 -2.12 0.01 0.00 0.52 0.00 0.00 34.95 33.36 1ds4 s ARG 130 CO 0.00 -1.06 -0.14 0.08 0.02 0.00 0.00 175.30 174.21 1ds4 s VAL 131 N -1.50 1.31 0.34 3.52 1.01 -1.05 -4.65 120.40 119.38 1ds4 s VAL 131 Ca 0.73 -0.56 -0.29 0.00 0.00 0.00 0.00 61.98 61.86 1ds4 s VAL 131 Cb -0.33 -1.19 -0.12 0.00 0.00 0.00 0.00 36.38 34.74 1ds4 s VAL 131 CO 0.37 0.40 1.50 0.47 0.00 0.00 0.00 175.10 177.84 1ds4 n ASP 132 N 3.95 3.66 -4.38 3.32 9.92 -1.26 -3.82 116.55 127.94 1ds4 n ASP 132 Ca -0.21 1.19 -0.20 0.00 -0.53 0.00 0.00 54.79 55.05 1ds4 n ASP 132 Cb 0.52 -1.59 -0.10 0.00 -0.64 0.00 0.00 41.12 39.31 1ds4 n ASP 132 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1ds4 s THR 133 N -0.67 1.86 0.95 -3.53 -4.23 -0.67 -4.99 115.64 104.36 1ds4 s THR 133 Ca 0.58 -2.24 -0.11 0.00 -1.18 0.00 0.00 61.69 58.74 1ds4 s THR 133 Cb -0.50 -2.14 0.16 0.00 1.34 0.00 0.00 72.50 71.36 1ds4 s THR 133 CO 0.58 -0.53 1.09 -2.84 -0.54 0.00 0.00 174.62 172.38 1ds4 s PRO 134 N -3.63 0.81 0.56 3.99 0.02 -1.26 -4.83 135.00 130.67 1ds4 s PRO 134 Ca 0.25 0.97 0.26 0.00 0.02 0.00 0.00 61.00 62.50 1ds4 s PRO 134 Cb -0.01 -1.75 1.53 0.00 0.02 0.00 0.00 34.50 34.29 1ds4 s PRO 134 CO 0.09 -2.59 2.09 1.49 -0.33 0.00 0.00 177.00 177.75 1ds4 h GLU 135 N -1.81 0.00 -0.00 5.54 4.81 -1.98 0.26 114.58 121.40 1ds4 h GLU 135 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1ds4 h GLU 135 Cb 1.29 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.67 1ds4 h GLU 135 CO 0.51 0.00 -0.00 -0.40 -0.73 0.00 0.00 179.01 178.39 1ds4 n ASP 136 N -4.08 0.03 -0.85 1.04 5.75 -1.26 -2.63 116.55 114.55 1ds4 n ASP 136 Ca 0.03 -0.70 0.12 0.00 -0.01 0.00 0.00 54.79 54.22 1ds4 n ASP 136 Cb 0.34 -0.10 0.28 0.00 -1.03 0.00 0.00 41.12 40.61 1ds4 n ASP 136 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1ds4 n THR 137 N -1.08 0.23 -2.17 2.12 -2.24 0.91 -4.93 114.28 107.12 1ds4 n THR 137 Ca 0.20 -0.51 -0.42 0.00 -2.27 0.00 0.00 64.05 61.06 1ds4 n THR 137 Cb 0.16 0.87 -0.03 0.00 -2.10 0.00 0.00 70.33 69.23 1ds4 n THR 137 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1ds4 s THR 138 N -1.77 3.43 0.78 4.28 2.01 -1.08 -4.71 115.64 118.59 1ds4 s THR 138 Ca 0.34 0.96 -0.11 0.00 0.31 0.00 0.00 61.69 63.19 1ds4 s THR 138 Cb 0.20 -3.61 0.06 0.00 0.01 0.00 0.00 72.50 69.16 1ds4 s THR 138 CO 0.30 0.04 1.09 -2.16 -0.69 0.00 0.00 174.62 173.20 1ds4 s PRO 139 N 1.70 2.17 0.66 4.92 0.04 -1.26 -5.01 135.00 138.22 1ds4 s PRO 139 Ca 0.65 1.15 -0.14 0.00 0.04 0.00 0.00 61.00 62.70 1ds4 s PRO 139 Cb -0.35 -1.89 -0.00 0.00 0.04 0.00 0.00 34.50 32.30 1ds4 s PRO 139 CO 0.29 -1.70 1.09 -0.51 0.04 0.00 0.00 177.00 176.21 1ds4 s ASP 140 N -3.39 5.23 0.48 6.66 -0.00 -1.26 -4.67 116.67 119.72 1ds4 s ASP 140 Ca 0.61 1.89 -0.23 0.00 -0.00 0.00 0.00 52.55 54.82 1ds4 s ASP 140 Cb -0.17 -2.54 -0.08 0.00 -0.00 0.00 0.00 42.92 40.13 1ds4 s ASP 140 CO 0.56 -1.55 1.23 0.59 -0.00 0.00 0.00 175.17 176.01 1ds4 n ASN 141 N -2.53 2.25 0.00 0.27 5.03 -1.26 -4.28 115.26 114.74 1ds4 n ASN 141 Ca 0.09 1.03 0.00 0.00 0.87 0.00 0.00 54.58 56.57 1ds4 n ASN 141 Cb 0.52 -1.49 0.00 0.00 -1.02 0.00 0.00 39.78 37.79 1ds4 n ASN 141 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ds4 n GLY 142 N 0.89 1.16 0.00 7.41 0.00 -1.26 -5.00 105.19 108.39 1ds4 n GLY 142 Ca 0.09 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.21 1ds4 n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ds4 n ARG 143 N -0.13 0.04 -3.19 1.61 1.74 -1.26 -4.91 116.66 110.56 1ds4 n ARG 143 Ca 0.00 -0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.78 1ds4 n ARG 143 Cb 0.00 -1.51 -0.04 0.00 -1.02 0.00 0.00 32.46 29.89 1ds4 n ARG 143 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ds4 s LEU 144 N -3.11 4.01 0.31 0.55 1.43 -1.26 -4.74 118.68 115.87 1ds4 s LEU 144 Ca 0.08 0.91 -0.24 0.00 -1.03 0.00 0.00 54.13 53.86 1ds4 s LEU 144 Cb 0.16 -3.74 -0.10 0.00 0.03 0.00 0.00 46.19 42.55 1ds4 s LEU 144 CO 0.81 -0.24 0.89 -2.16 0.23 0.00 0.00 176.35 175.88 1ds4 s PRO 145 N -3.48 4.45 0.73 1.29 0.04 -1.26 -5.05 135.00 131.72 1ds4 s PRO 145 Ca 0.47 1.18 -0.11 0.00 0.04 0.00 0.00 61.00 62.58 1ds4 s PRO 145 Cb -0.11 -2.73 0.03 0.00 0.04 0.00 0.00 34.50 31.73 1ds4 s PRO 145 CO 0.28 0.27 1.07 -0.51 0.04 0.00 0.00 177.00 178.15 1ds4 s ASP 146 N -1.71 5.03 0.00 6.66 1.01 -1.26 -4.98 116.67 121.42 1ds4 s ASP 146 Ca 0.50 1.54 0.17 0.00 0.71 0.00 0.00 52.55 55.47 1ds4 s ASP 146 Cb -0.17 -2.36 -0.14 0.00 1.01 0.00 0.00 42.92 41.27 1ds4 s ASP 146 CO 0.22 -1.66 0.78 0.00 0.21 0.00 0.00 175.17 174.71 1ds4 n ALA 147 N -3.26 3.97 -0.39 5.23 0.00 -1.26 -4.49 120.51 120.31 1ds4 n ALA 147 Ca 0.07 -0.51 -0.04 0.00 0.00 0.00 0.00 53.44 52.97 1ds4 n ALA 147 Cb 0.54 -0.62 0.21 0.00 0.00 0.00 0.00 19.45 19.58 1ds4 n ALA 147 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1ds4 n ASP 148 N -1.04 3.95 -3.90 0.00 5.75 -1.26 -2.40 116.55 117.65 1ds4 n ASP 148 Ca 0.04 -2.83 -0.20 0.00 -0.01 0.00 0.00 54.79 51.79 1ds4 n ASP 148 Cb 0.30 -0.67 -0.02 0.00 -1.03 0.00 0.00 41.12 39.69 1ds4 n ASP 148 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1ds4 n LYS 149 N -0.01 1.04 -2.26 0.11 4.76 -1.26 -4.95 118.16 115.59 1ds4 n LYS 149 Ca 0.28 -2.45 -0.07 0.00 -2.87 0.00 0.00 58.31 53.20 1ds4 n LYS 149 Cb 1.07 0.45 -0.01 0.00 -1.84 0.00 0.00 35.03 34.71 1ds4 n LYS 149 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1ds4 n ASP 150 N -1.57 1.76 -0.20 4.39 5.75 -1.26 -3.59 116.55 121.83 1ds4 n ASP 150 Ca -0.08 -1.46 -0.07 0.00 -0.01 0.00 0.00 54.79 53.17 1ds4 n ASP 150 Cb 0.44 0.03 0.03 0.00 -1.03 0.00 0.00 41.12 40.58 1ds4 n ASP 150 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ds4 h ALA 151 N 0.86 0.72 -0.94 2.12 0.00 -1.91 -1.33 119.26 118.79 1ds4 h ALA 151 Ca -0.09 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1ds4 h ALA 151 Cb 0.29 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 1ds4 h ALA 151 CO 0.14 0.26 0.58 0.78 0.00 0.00 0.00 179.25 181.00 1ds4 h GLY 152 N 0.76 1.36 0.90 0.00 0.00 -1.96 -0.40 103.07 103.72 1ds4 h GLY 152 Ca 0.20 -0.56 0.01 0.00 0.00 0.00 0.00 47.33 46.98 1ds4 h GLY 152 CO -0.03 0.54 0.08 -1.82 0.00 0.00 0.00 176.54 175.32 1ds4 h TYR 153 N 1.30 0.15 -0.27 5.60 5.03 -1.65 -2.26 116.97 124.87 1ds4 h TYR 153 Ca 0.34 0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.65 1ds4 h TYR 153 Cb -0.07 -0.04 -0.01 0.00 1.55 0.00 0.00 36.73 38.16 1ds4 h TYR 153 CO 0.00 0.08 0.15 0.28 -1.32 0.00 0.00 178.16 177.35 1ds4 h VAL 154 N 0.18 1.13 -0.03 1.81 2.07 -0.82 0.29 116.25 120.89 1ds4 h VAL 154 Ca 0.08 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.25 1ds4 h VAL 154 Cb 0.03 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1ds4 h VAL 154 CO -0.06 0.13 0.02 -0.09 0.02 0.00 0.00 177.57 177.58 1ds4 h ARG 155 N 0.32 0.04 -0.56 1.57 2.43 -1.03 -2.02 114.38 115.12 1ds4 h ARG 155 Ca 0.10 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 1ds4 h ARG 155 Cb 0.08 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 1ds4 h ARG 155 CO -0.01 0.05 0.28 1.15 -1.51 0.00 0.00 179.97 179.92 1ds4 h THR 156 N 0.01 1.20 -0.34 0.20 2.02 -1.29 -2.70 112.91 112.01 1ds4 h THR 156 Ca 0.01 -0.55 0.07 0.00 0.77 0.00 0.00 66.41 66.71 1ds4 h THR 156 Cb 0.02 0.53 -0.07 0.00 -1.74 0.00 0.00 68.15 66.90 1ds4 h THR 156 CO -0.00 0.22 -0.09 0.15 0.37 0.00 0.00 175.52 176.17 1ds4 h PHE 157 N 0.76 -0.20 0.00 3.16 3.57 -0.01 -2.89 116.94 121.33 1ds4 h PHE 157 Ca 0.19 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.73 1ds4 h PHE 157 Cb 0.10 0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.98 1ds4 h PHE 157 CO -0.01 -0.16 0.00 0.74 -2.23 0.00 0.00 178.31 176.66 1ds4 h PHE 158 N -0.01 0.00 -0.80 0.41 0.04 -1.29 -2.58 116.94 112.70 1ds4 h PHE 158 Ca 0.16 0.00 0.15 0.00 2.80 0.00 0.00 57.97 61.09 1ds4 h PHE 158 Cb 0.26 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.35 1ds4 h PHE 158 CO -0.32 0.00 0.53 1.96 -0.60 0.00 0.00 178.31 179.88 1ds4 h GLN 159 N 0.00 0.47 0.00 1.51 4.20 -1.25 0.17 115.11 120.21 1ds4 h GLN 159 Ca 0.00 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 1ds4 h GLN 159 Cb 0.85 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.52 1ds4 h GLN 159 CO 0.00 0.31 -0.09 -0.09 -0.67 0.00 0.00 178.83 178.29 1ds4 h ARG 160 N 0.49 0.00 -0.67 1.46 2.43 -1.55 -1.39 114.38 115.15 1ds4 h ARG 160 Ca 0.40 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.57 1ds4 h ARG 160 Cb 0.85 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.40 1ds4 h ARG 160 CO -0.15 0.09 0.00 1.28 -1.51 0.00 0.00 179.97 179.69 1ds4 n LEU 161 N -3.65 4.11 -3.38 3.80 4.77 0.52 -2.44 117.00 120.72 1ds4 n LEU 161 Ca -0.02 -2.06 -0.24 0.00 -0.03 0.00 0.00 56.01 53.65 1ds4 n LEU 161 Cb 0.21 -0.51 0.03 0.00 -2.33 0.00 0.00 43.42 40.82 1ds4 n LEU 161 CO 0.29 0.83 0.06 -3.20 -1.33 0.00 0.00 177.39 174.05 1ds4 n ASN 162 N 1.27 -5.44 -4.69 -1.43 5.15 -0.52 -4.99 115.26 104.60 1ds4 n ASN 162 Ca 0.24 -0.45 -0.35 0.00 -0.60 0.00 0.00 54.58 53.41 1ds4 n ASN 162 Cb 0.72 -4.37 -0.09 0.00 -0.53 0.00 0.00 39.78 35.50 1ds4 n ASN 162 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 1ds4 s MET 163 N -6.07 3.20 0.29 1.20 -1.94 -0.72 -5.01 119.30 110.25 1ds4 s MET 163 Ca 0.45 -0.37 0.03 0.00 -1.71 0.00 0.00 55.69 54.09 1ds4 s MET 163 Cb -0.21 -2.90 0.05 0.00 2.01 0.00 0.00 34.83 33.77 1ds4 s MET 163 CO 0.56 0.64 0.40 0.27 -0.01 0.00 0.00 175.02 176.87 1ds4 n ASN 164 N 2.36 0.81 -0.11 3.03 0.23 -1.26 -4.01 115.26 116.31 1ds4 n ASN 164 Ca -0.18 -1.62 -0.06 0.00 -0.53 0.00 0.00 54.58 52.19 1ds4 n ASN 164 Cb 0.54 -0.23 0.02 0.00 -2.08 0.00 0.00 39.78 38.02 1ds4 n ASN 164 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1ds4 h ASP 165 N -0.08 0.21 -0.23 0.53 3.32 -1.99 0.11 116.42 118.29 1ds4 h ASP 165 Ca -0.13 0.03 -0.17 0.00 0.02 0.00 0.00 57.03 56.77 1ds4 h ASP 165 Cb 0.55 -0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.10 1ds4 h ASP 165 CO 0.17 0.16 -0.51 -0.09 -1.72 0.00 0.00 179.24 177.25 1ds4 h ARG 166 N 0.33 0.82 -0.74 3.56 2.43 -1.96 -1.38 114.38 117.45 1ds4 h ARG 166 Ca 0.16 -0.49 -0.04 0.00 -0.81 0.00 0.00 59.98 58.80 1ds4 h ARG 166 Cb 0.11 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 1ds4 h ARG 166 CO -0.14 1.13 0.30 0.93 -1.51 0.00 0.00 179.97 180.68 1ds4 h GLU 167 N 0.64 1.09 -0.41 0.20 5.08 -1.85 -1.93 114.58 117.39 1ds4 h GLU 167 Ca 0.02 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.16 1ds4 h GLU 167 Cb 1.10 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.15 1ds4 h GLU 167 CO 0.11 0.88 0.10 0.28 -1.00 0.00 0.00 179.01 179.38 1ds4 h VAL 168 N 1.07 1.23 -0.15 3.13 2.07 -0.44 -1.53 116.25 121.62 1ds4 h VAL 168 Ca 0.25 -0.79 -0.12 0.00 0.82 0.00 0.00 66.70 66.86 1ds4 h VAL 168 Cb 0.19 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1ds4 h VAL 168 CO -0.02 0.27 -0.44 0.58 0.02 0.00 0.00 177.57 177.99 1ds4 h VAL 169 N 0.53 1.32 -0.42 2.57 2.07 -1.15 -1.82 116.25 119.34 1ds4 h VAL 169 Ca 0.13 -1.61 -0.13 0.00 0.82 0.00 0.00 66.70 65.91 1ds4 h VAL 169 Cb 0.31 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 1ds4 h VAL 169 CO 0.00 0.49 -0.27 0.00 0.02 0.00 0.00 177.57 177.81 1ds4 h ALA 170 N 1.24 0.73 0.01 1.67 0.00 -1.22 -2.89 119.26 118.80 1ds4 h ALA 170 Ca 0.02 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 1ds4 h ALA 170 Cb 0.89 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1ds4 h ALA 170 CO 0.07 0.66 -0.01 -0.07 0.00 0.00 0.00 179.25 179.91 1ds4 h LEU 171 N 0.76 -0.02 -0.70 0.00 4.07 -1.06 -3.09 115.31 115.28 1ds4 h LEU 171 Ca 0.09 -0.35 -0.01 0.00 0.08 0.00 0.00 57.88 57.69 1ds4 h LEU 171 Cb 0.83 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.54 1ds4 h LEU 171 CO 0.07 0.34 0.39 0.24 -1.08 0.00 0.00 178.44 178.40 1ds4 h MET 172 N -0.37 0.96 -0.00 1.13 2.86 -1.39 -2.13 114.93 115.99 1ds4 h MET 172 Ca -0.00 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 1ds4 h MET 172 Cb 0.36 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.83 1ds4 h MET 172 CO 0.00 0.71 0.02 0.78 1.06 0.00 0.00 176.91 179.49 1ds4 h GLY 173 N 0.95 0.00 -4.62 8.32 0.00 -1.53 -3.45 103.07 102.74 1ds4 h GLY 173 Ca 0.25 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.51 1ds4 h GLY 173 CO -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 176.54 176.40 1ds4 n ALA 174 N -2.09 -0.78 -0.21 3.60 0.00 -0.80 -1.46 120.51 118.77 1ds4 n ALA 174 Ca -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1ds4 n ALA 174 Cb 0.09 -0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.40 1ds4 n ALA 174 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ds4 n GLY 175 N -0.96 1.05 1.93 0.00 0.00 -1.21 -3.53 105.19 102.47 1ds4 n GLY 175 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 1ds4 n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ds4 n ALA 176 N 0.69 -0.62 -2.66 4.61 0.00 -0.54 -0.09 120.51 121.91 1ds4 n ALA 176 Ca 0.00 0.02 -0.34 0.00 0.00 0.00 0.00 53.44 53.12 1ds4 n ALA 176 Cb 0.00 -1.45 -0.10 0.00 0.00 0.00 0.00 19.45 17.91 1ds4 n ALA 176 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ds4 s LEU 177 N -3.39 3.45 0.00 0.00 1.43 -1.23 -4.35 118.68 114.59 1ds4 s LEU 177 Ca 0.06 0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.22 1ds4 s LEU 177 Cb -0.02 -1.83 0.00 0.00 0.03 0.00 0.00 46.19 44.37 1ds4 s LEU 177 CO 0.25 0.35 0.00 0.61 0.23 0.00 0.00 176.35 177.79 1ds4 n GLY 178 N 1.99 1.89 3.65 -3.19 0.00 -0.43 -4.94 105.19 104.15 1ds4 n GLY 178 Ca -0.18 -0.48 -0.04 0.00 0.00 0.00 0.00 46.02 45.33 1ds4 n GLY 178 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ds4 s LYS 179 N 0.00 0.87 0.18 1.61 -2.85 -1.26 -4.43 119.74 113.85 1ds4 s LYS 179 Ca 0.00 -0.43 -0.14 0.00 -1.00 0.00 0.00 55.97 54.39 1ds4 s LYS 179 Cb 0.00 0.32 -0.07 0.00 -2.06 0.00 0.00 37.83 36.02 1ds4 s LYS 179 CO 0.00 -0.39 0.59 0.95 0.10 0.00 0.00 175.35 176.59 1ds4 s THR 180 N -3.00 4.82 -0.11 3.79 -4.23 -0.08 -4.93 115.64 111.90 1ds4 s THR 180 Ca 0.10 0.84 0.02 0.00 -1.18 0.00 0.00 61.69 61.47 1ds4 s THR 180 Cb -0.00 -3.72 0.01 0.00 1.34 0.00 0.00 72.50 70.13 1ds4 s THR 180 CO -0.02 0.16 -0.17 -1.00 -0.54 0.00 0.00 174.62 173.04 1ds4 s HIS 181 N -1.57 2.10 0.23 3.99 0.09 -1.01 -0.98 115.29 118.14 1ds4 s HIS 181 Ca 0.41 -0.97 -0.07 0.00 -0.00 0.00 0.00 55.06 54.44 1ds4 s HIS 181 Cb -0.14 -1.48 0.29 0.00 -0.00 0.00 0.00 32.58 31.24 1ds4 s HIS 181 CO 0.20 -0.47 1.86 1.25 -0.00 0.00 0.00 174.74 177.57 1ds4 h LEU 182 N 7.28 0.86 -0.93 0.89 5.85 -1.51 -1.65 115.31 126.09 1ds4 h LEU 182 Ca -0.30 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.43 1ds4 h LEU 182 Cb 1.19 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.04 1ds4 h LEU 182 CO 0.50 0.57 0.00 0.11 -0.34 0.00 0.00 178.44 179.28 1ds4 h LYS 183 N 1.00 0.00 0.05 1.25 6.56 -1.97 0.80 116.57 124.26 1ds4 h LYS 183 Ca 0.35 0.00 -0.31 0.00 -1.06 0.00 0.00 60.65 59.63 1ds4 h LYS 183 Cb 0.09 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 31.72 1ds4 h LYS 183 CO -0.14 0.00 -1.73 0.09 -2.06 0.00 0.00 179.45 175.61 1ds4 n ASN 184 N -2.53 1.98 0.00 0.86 3.02 -0.67 -4.81 115.26 113.11 1ds4 n ASN 184 Ca 0.02 0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.87 1ds4 n ASN 184 Cb 0.26 -0.89 0.00 0.00 -0.61 0.00 0.00 39.78 38.55 1ds4 n ASN 184 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1ds4 n SER 185 N -3.98 0.70 0.00 6.41 3.41 -0.90 -4.69 113.62 114.57 1ds4 n SER 185 Ca -0.35 -0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.02 1ds4 n SER 185 Cb 0.86 0.62 0.00 0.00 -0.26 0.00 0.00 64.21 65.43 1ds4 n SER 185 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ds4 n GLY 186 N 0.83 0.59 3.18 5.00 0.00 0.27 -5.03 105.19 110.03 1ds4 n GLY 186 Ca 0.00 -0.30 -0.18 0.00 0.00 0.00 0.00 46.02 45.54 1ds4 n GLY 186 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ds4 s TYR 187 N -2.00 1.22 -0.02 1.61 2.02 -1.26 -4.57 117.35 114.35 1ds4 s TYR 187 Ca 0.00 -0.48 0.00 0.00 -0.37 0.00 0.00 57.07 56.22 1ds4 s TYR 187 Cb 0.00 -0.68 0.03 0.00 -0.40 0.00 0.00 41.96 40.91 1ds4 s TYR 187 CO 0.00 0.06 0.01 -2.00 -1.57 0.00 0.00 175.55 172.05 1ds4 s GLU 188 N -1.88 0.16 0.00 -0.62 2.56 -1.26 -1.15 118.70 116.50 1ds4 s GLU 188 Ca -0.01 0.12 0.00 0.00 0.00 0.00 0.00 54.97 55.08 1ds4 s GLU 188 Cb -0.09 -0.38 0.00 0.00 2.00 0.00 0.00 34.13 35.66 1ds4 s GLU 188 CO 0.02 -0.14 0.00 0.41 -0.56 0.00 0.00 175.26 174.99 1ds4 n GLY 189 N 4.12 2.54 3.92 -1.50 0.00 -0.16 -4.87 105.19 109.25 1ds4 n GLY 189 Ca -0.27 -2.11 -0.26 0.00 0.00 0.00 0.00 46.02 43.38 1ds4 n GLY 189 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ds4 s PRO 190 N -2.16 3.31 0.23 1.61 0.04 -1.26 -0.91 135.00 135.87 1ds4 s PRO 190 Ca 0.00 -0.03 0.19 0.00 0.04 0.00 0.00 61.00 61.21 1ds4 s PRO 190 Cb 0.00 -2.42 0.05 0.00 0.04 0.00 0.00 34.50 32.17 1ds4 s PRO 190 CO 0.00 -0.28 1.20 -1.49 0.04 0.00 0.00 177.00 176.47 1ds4 h TRP 191 N 0.23 0.00 -2.74 0.56 6.55 -1.78 0.24 115.95 119.00 1ds4 h TRP 191 Ca -0.47 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.37 1ds4 h TRP 191 Cb 1.23 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.53 1ds4 h TRP 191 CO 0.53 0.28 0.27 0.41 -1.05 0.00 0.00 178.44 178.88 1ds4 n GLY 192 N 1.23 1.08 0.08 1.49 0.00 -1.26 -4.62 105.19 103.20 1ds4 n GLY 192 Ca -0.01 -1.20 -0.10 0.00 0.00 0.00 0.00 46.02 44.71 1ds4 n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ds4 h ALA 193 N 2.00 0.31 -1.77 4.61 0.00 -1.95 -3.39 119.26 119.07 1ds4 h ALA 193 Ca -0.27 -0.96 -0.74 0.00 0.00 0.00 0.00 54.91 52.94 1ds4 h ALA 193 Cb 1.02 -0.03 -0.32 0.00 0.00 0.00 0.00 17.79 18.45 1ds4 h ALA 193 CO 0.34 1.19 0.44 0.00 0.00 0.00 0.00 179.25 181.22 1ds4 n ALA 194 N -2.44 5.27 1.42 0.00 0.00 -1.26 -4.86 120.51 118.65 1ds4 n ALA 194 Ca -0.05 -4.71 0.02 0.00 0.00 0.00 0.00 53.44 48.70 1ds4 n ALA 194 Cb 0.98 -1.80 0.07 0.00 0.00 0.00 0.00 19.45 18.70 1ds4 n ALA 194 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1ds4 n ASN 195 N 0.47 0.94 -0.17 0.00 6.94 -1.26 -1.89 115.26 120.28 1ds4 n ASN 195 Ca 0.35 -2.02 0.07 0.00 -0.02 0.00 0.00 54.58 52.96 1ds4 n ASN 195 Cb 0.33 -0.14 0.09 0.00 -2.36 0.00 0.00 39.78 37.70 1ds4 n ASN 195 CO 0.00 0.00 0.00 -0.46 -1.03 0.00 0.00 177.26 175.77 1ds4 n ASN 196 N -0.02 1.70 -4.27 0.53 0.23 -1.26 -1.32 115.26 110.84 1ds4 n ASN 196 Ca 0.05 -2.72 -0.33 0.00 -0.53 0.00 0.00 54.58 51.06 1ds4 n ASN 196 Cb 0.16 -0.34 -0.16 0.00 -2.08 0.00 0.00 39.78 37.36 1ds4 n ASN 196 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1ds4 s VAL 197 N -2.01 2.57 -0.23 3.53 1.01 -0.79 -4.69 120.40 119.79 1ds4 s VAL 197 Ca 0.22 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 61.09 1ds4 s VAL 197 Cb 0.19 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 1ds4 s VAL 197 CO 0.02 0.53 1.63 0.12 0.00 0.00 0.00 175.10 177.40 1ds4 s PHE 198 N 0.58 2.08 0.27 5.22 2.19 0.11 -4.78 117.98 123.65 1ds4 s PHE 198 Ca -0.10 0.55 0.03 0.00 0.33 0.00 0.00 56.93 57.74 1ds4 s PHE 198 Cb -0.16 -4.00 -0.04 0.00 -1.31 0.00 0.00 43.02 37.51 1ds4 s PHE 198 CO 0.03 -2.94 0.20 0.95 1.83 0.00 0.00 175.22 175.30 1ds4 s THR 199 N 5.33 0.02 -0.94 0.12 -4.23 0.87 -4.63 115.64 112.18 1ds4 s THR 199 Ca 0.72 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 59.33 1ds4 s THR 199 Cb -0.25 -2.50 0.48 0.00 1.34 0.00 0.00 72.50 71.57 1ds4 s THR 199 CO 0.30 0.00 1.29 -0.46 -0.54 0.00 0.00 174.62 175.20 1ds4 n ASN 200 N -0.89 3.51 0.30 3.99 6.94 -1.26 -3.36 115.26 124.49 1ds4 n ASN 200 Ca 0.04 -2.41 0.17 0.00 -0.02 0.00 0.00 54.58 52.36 1ds4 n ASN 200 Cb 0.64 -0.53 0.97 0.00 -2.36 0.00 0.00 39.78 38.50 1ds4 n ASN 200 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 1ds4 h GLU 201 N 2.51 0.00 -0.63 -3.83 4.81 -1.91 -2.34 114.58 113.19 1ds4 h GLU 201 Ca 0.00 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.28 1ds4 h GLU 201 Cb 1.19 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.52 1ds4 h GLU 201 CO 0.22 0.03 0.36 0.35 -0.73 0.00 0.00 179.01 179.23 1ds4 h PHE 202 N 0.00 0.66 -0.22 0.92 3.57 -1.82 0.08 116.94 120.14 1ds4 h PHE 202 Ca -0.00 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.44 1ds4 h PHE 202 Cb 0.10 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 38.63 1ds4 h PHE 202 CO 0.00 0.34 -0.17 1.88 -2.23 0.00 0.00 178.31 178.13 1ds4 h TYR 203 N 0.68 0.59 -0.41 0.41 0.05 -1.76 -0.83 116.97 115.71 1ds4 h TYR 203 Ca 0.27 -0.16 0.04 0.00 0.05 0.00 0.00 58.73 58.93 1ds4 h TYR 203 Cb 0.13 -0.13 -0.04 0.00 1.01 0.00 0.00 36.73 37.70 1ds4 h TYR 203 CO -0.07 0.82 0.17 -0.07 -1.05 0.00 0.00 178.16 177.95 1ds4 h LEU 204 N 0.19 0.22 -0.50 3.88 3.38 -1.48 -1.72 115.31 119.26 1ds4 h LEU 204 Ca 0.04 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.91 1ds4 h LEU 204 Cb 0.70 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1ds4 h LEU 204 CO 0.04 0.16 -0.23 0.78 0.09 0.00 0.00 178.44 179.29 1ds4 h ASN 205 N 0.35 1.01 -0.85 -0.43 2.35 -0.87 0.24 115.58 117.38 1ds4 h ASN 205 Ca 0.18 -0.39 0.01 0.00 -0.55 0.00 0.00 56.30 55.56 1ds4 h ASN 205 Cb 0.13 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.18 1ds4 h ASN 205 CO -0.16 1.18 0.56 -0.07 -1.65 0.00 0.00 177.43 177.30 1ds4 h LEU 206 N 0.84 0.97 0.07 1.61 3.38 -0.88 -0.34 115.31 120.96 1ds4 h LEU 206 Ca 0.11 -0.02 -0.29 0.00 0.09 0.00 0.00 57.88 57.77 1ds4 h LEU 206 Cb 0.81 -0.24 0.03 0.00 0.09 0.00 0.00 40.66 41.34 1ds4 h LEU 206 CO 0.07 0.70 -1.17 -0.07 0.09 0.00 0.00 178.44 178.06 1ds4 h LEU 207 N 1.15 0.89 0.00 1.67 3.38 -0.89 -3.39 115.31 118.12 1ds4 h LEU 207 Ca 0.32 -0.78 -0.09 0.00 0.09 0.00 0.00 57.88 57.42 1ds4 h LEU 207 Cb -0.12 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.34 1ds4 h LEU 207 CO -0.07 1.58 -2.07 0.59 0.09 0.00 0.00 178.44 178.55 1ds4 n ASN 208 N -3.81 0.10 -4.82 -0.43 5.03 0.81 -4.97 115.26 107.17 1ds4 n ASN 208 Ca -0.13 0.00 -0.31 0.00 0.87 0.00 0.00 54.58 55.02 1ds4 n ASN 208 Cb 0.95 1.74 0.06 0.00 -1.02 0.00 0.00 39.78 41.51 1ds4 n ASN 208 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1ds4 s GLU 209 N -3.24 2.69 -0.49 3.52 0.41 -0.15 -5.00 118.70 116.44 1ds4 s GLU 209 Ca -0.08 0.87 -0.16 0.00 -0.41 0.00 0.00 54.97 55.18 1ds4 s GLU 209 Cb 0.12 -1.97 0.08 0.00 -1.78 0.00 0.00 34.13 30.58 1ds4 s GLU 209 CO 0.87 -1.25 0.46 0.34 -0.49 0.00 0.00 175.26 175.20 1ds4 s ASP 210 N -3.82 6.17 -0.07 -0.19 2.15 -1.26 -4.97 116.67 114.68 1ds4 s ASP 210 Ca 0.59 -1.34 -0.12 0.00 0.43 0.00 0.00 52.55 52.10 1ds4 s ASP 210 Cb -0.14 -2.21 -0.05 0.00 -0.30 0.00 0.00 42.92 40.22 1ds4 s ASP 210 CO 0.55 -0.74 0.30 0.26 -0.17 0.00 0.00 175.17 175.37 1ds4 s TRP 211 N 1.84 3.64 -0.06 -5.34 0.52 -1.26 -4.31 118.94 113.96 1ds4 s TRP 211 Ca 0.06 0.78 0.05 0.00 0.02 0.00 0.00 56.10 57.01 1ds4 s TRP 211 Cb -0.24 -2.18 -0.01 0.00 -1.15 0.00 0.00 33.47 29.89 1ds4 s TRP 211 CO 0.07 0.61 -0.22 0.15 0.02 0.00 0.00 176.95 177.58 1ds4 s LYS 212 N -0.80 2.37 -0.48 4.98 3.01 0.39 -4.90 119.74 124.31 1ds4 s LYS 212 Ca 0.20 -0.79 -0.29 0.00 -1.01 0.00 0.00 55.97 54.08 1ds4 s LYS 212 Cb -0.15 -1.98 0.02 0.00 -1.01 0.00 0.00 37.83 34.72 1ds4 s LYS 212 CO 0.09 0.29 1.26 -1.17 0.51 0.00 0.00 175.35 176.33 1ds4 s LEU 213 N 0.01 3.57 0.35 3.17 2.96 -1.26 -0.49 118.68 126.99 1ds4 s LEU 213 Ca -0.07 0.51 0.03 0.00 -0.22 0.00 0.00 54.13 54.39 1ds4 s LEU 213 Cb -0.14 -3.45 -0.05 0.00 0.50 0.00 0.00 46.19 43.05 1ds4 s LEU 213 CO 0.04 -1.39 0.08 -1.61 -1.32 0.00 0.00 176.35 172.15 1ds4 s GLU 214 N 4.78 1.72 -0.13 1.98 2.02 -0.04 -4.95 118.70 124.08 1ds4 s GLU 214 Ca 0.52 -1.98 -0.06 0.00 0.02 0.00 0.00 54.97 53.47 1ds4 s GLU 214 Cb -0.09 -0.75 -0.04 0.00 0.10 0.00 0.00 34.13 33.35 1ds4 s GLU 214 CO 0.31 -0.28 0.08 0.15 0.02 0.00 0.00 175.26 175.53 1ds4 s LYS 215 N -3.86 3.47 0.74 1.61 1.02 -1.26 -0.81 119.74 120.65 1ds4 s LYS 215 Ca 0.33 -0.27 0.00 0.00 0.02 0.00 0.00 55.97 56.05 1ds4 s LYS 215 Cb 0.07 -3.09 0.15 0.00 -0.52 0.00 0.00 37.83 34.44 1ds4 s LYS 215 CO 0.15 0.61 1.02 0.54 -0.92 0.00 0.00 175.35 176.75 1ds4 s ASN 216 N -0.58 4.22 0.00 2.83 2.20 0.28 -4.92 114.94 118.97 1ds4 s ASN 216 Ca 0.11 -0.54 0.08 0.00 -0.94 0.00 0.00 52.86 51.58 1ds4 s ASN 216 Cb -0.12 0.26 0.39 0.00 -2.00 0.00 0.00 41.25 39.79 1ds4 s ASN 216 CO 0.02 -1.97 1.22 0.47 -2.94 0.00 0.00 177.10 173.90 1ds4 n ASP 217 N -2.87 0.00 -1.30 3.54 8.00 -1.26 -0.74 116.55 121.92 1ds4 n ASP 217 Ca 0.17 0.35 0.12 0.00 0.71 0.00 0.00 54.79 56.14 1ds4 n ASP 217 Cb 0.61 -0.40 0.30 0.00 -0.02 0.00 0.00 41.12 41.60 1ds4 n ASP 217 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ds4 n ALA 218 N -1.40 2.39 -2.06 2.24 0.00 -1.26 -4.93 120.51 115.50 1ds4 n ALA 218 Ca 0.03 -1.21 -0.13 0.00 0.00 0.00 0.00 53.44 52.14 1ds4 n ALA 218 Cb 0.09 -0.93 -0.02 0.00 0.00 0.00 0.00 19.45 18.59 1ds4 n ALA 218 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1ds4 n ASN 219 N 1.60 -4.08 -4.65 0.00 5.15 0.08 -5.03 115.26 108.34 1ds4 n ASN 219 Ca 0.23 0.06 -0.33 0.00 -0.60 0.00 0.00 54.58 53.94 1ds4 n ASN 219 Cb 0.61 -3.16 -0.10 0.00 -0.53 0.00 0.00 39.78 36.61 1ds4 n ASN 219 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1ds4 s ASN 220 N -2.52 4.94 0.27 1.20 0.01 -1.26 -4.86 114.94 112.72 1ds4 s ASN 220 Ca 0.00 -0.04 -0.29 0.00 -0.71 0.00 0.00 52.86 51.83 1ds4 s ASN 220 Cb 0.00 -1.26 -0.09 0.00 0.41 0.00 0.00 41.25 40.31 1ds4 s ASN 220 CO 0.00 0.30 0.98 -1.61 -1.51 0.00 0.00 177.10 175.26 1ds4 s GLU 221 N -1.38 4.73 0.04 -0.60 2.02 -1.26 -0.55 118.70 121.70 1ds4 s GLU 221 Ca 0.17 1.52 -0.18 0.00 0.02 0.00 0.00 54.97 56.50 1ds4 s GLU 221 Cb -0.11 -3.13 0.04 0.00 0.10 0.00 0.00 34.13 31.02 1ds4 s GLU 221 CO 0.08 0.38 0.42 1.14 0.02 0.00 0.00 175.26 177.29 1ds4 s GLN 222 N -1.47 0.92 -0.09 1.61 -2.07 0.01 -4.62 119.66 113.96 1ds4 s GLN 222 Ca 0.44 -0.35 -0.24 0.00 -1.82 0.00 0.00 55.36 53.39 1ds4 s GLN 222 Cb -0.25 0.41 -0.03 0.00 -1.09 0.00 0.00 33.01 32.05 1ds4 s GLN 222 CO 0.32 -0.31 0.75 -1.58 -1.32 0.00 0.00 175.29 173.15 1ds4 s TRP 223 N -2.44 3.55 0.10 9.60 0.52 -0.53 -0.86 118.94 128.88 1ds4 s TRP 223 Ca -0.06 1.28 0.09 0.00 0.02 0.00 0.00 56.10 57.43 1ds4 s TRP 223 Cb -0.01 -2.88 -0.03 0.00 -1.15 0.00 0.00 33.47 29.40 1ds4 s TRP 223 CO -0.02 0.00 -0.22 -0.51 0.02 0.00 0.00 176.95 176.22 1ds4 s ASP 224 N 0.91 2.67 0.11 2.95 1.01 0.36 -0.23 116.67 124.45 1ds4 s ASP 224 Ca 0.39 -0.67 0.10 0.00 0.71 0.00 0.00 52.55 53.08 1ds4 s ASP 224 Cb -0.18 -0.16 -0.04 0.00 1.01 0.00 0.00 42.92 43.55 1ds4 s ASP 224 CO 0.18 0.09 -0.26 -0.94 0.21 0.00 0.00 175.17 174.45 1ds4 s SER 225 N -1.83 3.14 0.57 0.27 1.04 -0.37 -0.46 113.70 116.06 1ds4 s SER 225 Ca 0.08 -0.70 0.26 0.00 0.48 0.00 0.00 55.95 56.06 1ds4 s SER 225 Cb -0.10 -0.22 1.63 0.00 0.10 0.00 0.00 66.02 67.43 1ds4 s SER 225 CO 0.04 0.18 2.19 0.50 0.98 0.00 0.00 173.24 177.13 1ds4 h LYS 226 N 4.12 0.00 0.00 4.02 3.64 -1.89 0.12 116.57 126.58 1ds4 h LYS 226 Ca -0.49 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1ds4 h LYS 226 Cb 1.17 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1ds4 h LYS 226 CO 0.40 0.00 0.00 0.43 -2.27 0.00 0.00 179.45 178.01 1ds4 n SER 227 N -4.05 0.00 0.00 4.20 7.64 -1.26 -4.85 113.62 115.31 1ds4 n SER 227 Ca -0.02 0.14 0.00 0.00 1.01 0.00 0.00 58.87 60.01 1ds4 n SER 227 Cb 0.15 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.04 1ds4 n SER 227 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ds4 n GLY 228 N -0.10 0.75 3.98 0.23 0.00 0.42 -5.05 105.19 105.41 1ds4 n GLY 228 Ca 0.06 -0.18 -0.20 0.00 0.00 0.00 0.00 46.02 45.70 1ds4 n GLY 228 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ds4 s TYR 229 N -2.00 3.04 0.04 1.61 2.02 -1.23 -4.56 117.35 116.28 1ds4 s TYR 229 Ca 0.00 -0.08 -0.03 0.00 -0.37 0.00 0.00 57.07 56.59 1ds4 s TYR 229 Cb 0.00 -2.31 -0.02 0.00 -0.40 0.00 0.00 41.96 39.22 1ds4 s TYR 229 CO 0.00 -0.36 0.02 0.00 -1.57 0.00 0.00 175.55 173.64 1ds4 s MET 230 N -4.44 0.56 -0.02 -0.62 0.23 0.07 -1.23 119.30 113.85 1ds4 s MET 230 Ca 0.50 -0.93 0.03 0.00 -1.03 0.00 0.00 55.69 54.26 1ds4 s MET 230 Cb -0.10 0.20 0.00 0.00 -1.53 0.00 0.00 34.83 33.41 1ds4 s MET 230 CO 0.35 -0.12 -0.09 -1.64 -2.03 0.00 0.00 175.02 171.49 1ds4 s MET 231 N -3.00 0.89 0.60 3.16 -1.94 0.68 -4.22 119.30 115.47 1ds4 s MET 231 Ca -0.02 -0.30 -0.18 0.00 -1.71 0.00 0.00 55.69 53.48 1ds4 s MET 231 Cb 0.01 -0.84 -0.03 0.00 2.01 0.00 0.00 34.83 35.98 1ds4 s MET 231 CO -0.07 0.13 1.16 -0.51 -0.01 0.00 0.00 175.02 175.72 1ds4 s LEU 232 N 0.09 3.60 0.33 -0.03 1.43 -1.26 -1.45 118.68 121.39 1ds4 s LEU 232 Ca -0.01 2.22 0.12 0.00 -1.03 0.00 0.00 54.13 55.42 1ds4 s LEU 232 Cb -0.07 -4.58 0.98 0.00 0.03 0.00 0.00 46.19 42.55 1ds4 s LEU 232 CO 0.00 -1.53 1.70 -0.65 0.23 0.00 0.00 176.35 176.10 1ds4 h PRO 233 N 0.70 0.45 -0.10 1.29 0.11 -1.81 0.27 132.00 132.91 1ds4 h PRO 233 Ca -0.49 -0.03 -0.14 0.00 0.11 0.00 0.00 66.00 65.45 1ds4 h PRO 233 Cb 1.27 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1ds4 h PRO 233 CO 0.55 0.30 -0.56 1.79 -0.21 0.00 0.00 178.00 179.87 1ds4 h THR 234 N 0.46 1.36 -0.15 -1.15 1.35 -1.53 -1.91 112.91 111.35 1ds4 h THR 234 Ca 0.69 -1.86 -0.01 0.00 -0.55 0.00 0.00 66.41 64.67 1ds4 h THR 234 Cb 1.43 1.90 -0.01 0.00 -1.73 0.00 0.00 68.15 69.75 1ds4 h THR 234 CO -0.54 0.56 0.05 0.44 -0.25 0.00 0.00 175.52 175.78 1ds4 h ASP 235 N 0.23 0.21 0.17 5.36 3.32 -0.90 -3.04 116.42 121.77 1ds4 h ASP 235 Ca 0.00 -0.19 -0.02 0.00 0.02 0.00 0.00 57.03 56.84 1ds4 h ASP 235 Cb 1.05 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.54 1ds4 h ASP 235 CO 0.09 0.34 -0.11 0.22 -1.72 0.00 0.00 179.24 178.06 1ds4 h TYR 236 N 0.07 0.00 0.00 4.55 3.20 -0.71 -1.03 116.97 123.05 1ds4 h TYR 236 Ca 0.05 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1ds4 h TYR 236 Cb 0.20 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.47 1ds4 h TYR 236 CO -0.01 0.11 0.00 0.66 -1.64 0.00 0.00 178.16 177.29 1ds4 h SER 237 N 0.00 0.00 0.95 -2.11 4.64 -1.22 -1.42 113.55 114.39 1ds4 h SER 237 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ds4 h SER 237 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1ds4 h SER 237 CO 0.01 0.00 0.00 -0.07 -0.87 0.00 0.00 176.83 175.90 1ds4 h LEU 238 N 0.00 0.00 -0.65 5.97 3.38 -1.27 -1.22 115.31 121.52 1ds4 h LEU 238 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ds4 h LEU 238 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1ds4 h LEU 238 CO 0.00 0.00 -0.42 2.30 0.09 0.00 0.00 178.44 180.41 1ds4 n ILE 239 N -2.58 0.00 0.11 1.22 -5.35 -0.55 -1.45 119.36 110.76 1ds4 n ILE 239 Ca 0.02 -0.29 -0.21 0.00 -0.27 0.00 0.00 62.75 62.00 1ds4 n ILE 239 Cb 0.28 1.14 -0.15 0.00 -1.74 0.00 0.00 39.64 39.17 1ds4 n ILE 239 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 1ds4 h GLN 240 N 1.29 0.40 -6.20 6.28 4.20 -1.20 -3.45 115.11 116.43 1ds4 h GLN 240 Ca 0.00 -0.68 -0.56 0.00 0.06 0.00 0.00 58.65 57.47 1ds4 h GLN 240 Cb 0.48 0.25 -0.04 0.00 0.30 0.00 0.00 27.48 28.47 1ds4 h GLN 240 CO 0.00 1.30 0.42 0.34 -0.67 0.00 0.00 178.83 180.23 1ds4 s ASP 241 N -7.31 7.18 0.45 1.46 -1.08 -0.53 -4.96 116.67 111.89 1ds4 s ASP 241 Ca -0.09 1.44 0.14 0.00 -0.52 0.00 0.00 52.55 53.52 1ds4 s ASP 241 Cb 0.06 -2.52 1.02 0.00 -1.46 0.00 0.00 42.92 40.01 1ds4 s ASP 241 CO 0.90 -0.35 2.01 1.55 0.52 0.00 0.00 175.17 179.80 1ds4 h PRO 242 N 7.03 0.05 -0.06 4.34 0.13 -1.90 0.18 132.00 141.77 1ds4 h PRO 242 Ca -0.34 -0.01 -0.20 0.00 -0.87 0.00 0.00 66.00 64.58 1ds4 h PRO 242 Cb 1.17 -0.01 0.01 0.00 0.13 0.00 0.00 31.00 32.30 1ds4 h PRO 242 CO 0.81 0.18 -0.76 0.87 -0.23 0.00 0.00 178.00 178.87 1ds4 h LYS 243 N 0.05 0.61 -0.27 0.86 6.56 -1.93 -2.66 116.57 119.80 1ds4 h LYS 243 Ca 0.01 -0.58 -0.01 0.00 -1.06 0.00 0.00 60.65 59.00 1ds4 h LYS 243 Cb 0.26 0.15 -0.01 0.00 -0.57 0.00 0.00 32.23 32.05 1ds4 h LYS 243 CO 0.02 1.20 0.12 1.88 -2.06 0.00 0.00 179.45 180.61 1ds4 h TYR 244 N 0.24 0.39 -0.99 -1.35 0.05 -1.74 -3.06 116.97 110.50 1ds4 h TYR 244 Ca -0.08 -0.02 0.12 0.00 0.05 0.00 0.00 58.73 58.80 1ds4 h TYR 244 Cb 1.42 -0.12 -0.08 0.00 1.01 0.00 0.00 36.73 38.96 1ds4 h TYR 244 CO 0.11 0.37 0.63 1.25 -1.05 0.00 0.00 178.16 179.47 1ds4 h LEU 245 N 0.29 0.91 -1.08 3.88 5.85 0.52 0.23 115.31 125.90 1ds4 h LEU 245 Ca 0.09 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 1ds4 h LEU 245 Cb 0.13 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1ds4 h LEU 245 CO -0.01 0.48 -0.21 0.77 -0.34 0.00 0.00 178.44 179.14 1ds4 h SER 246 N 0.97 0.00 0.71 1.25 4.64 -1.37 -1.58 113.55 118.17 1ds4 h SER 246 Ca 0.49 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.55 1ds4 h SER 246 Cb 0.50 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 1ds4 h SER 246 CO -0.26 0.21 -1.24 0.40 -0.87 0.00 0.00 176.83 175.07 1ds4 h ILE 247 N 0.00 1.48 -0.29 0.95 2.04 -0.86 -2.26 117.51 118.56 1ds4 h ILE 247 Ca -0.00 -3.12 0.03 0.00 1.00 0.00 0.00 64.86 62.77 1ds4 h ILE 247 Cb 0.75 2.86 -0.03 0.00 -0.74 0.00 0.00 36.82 39.67 1ds4 h ILE 247 CO 0.03 0.89 0.11 0.58 0.00 0.00 0.00 178.15 179.76 1ds4 h VAL 248 N 0.05 0.94 -0.57 1.67 2.07 -0.26 -1.84 116.25 118.31 1ds4 h VAL 248 Ca -0.12 -0.09 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1ds4 h VAL 248 Cb 1.92 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 32.33 1ds4 h VAL 248 CO 0.17 0.05 0.29 0.11 0.02 0.00 0.00 177.57 178.20 1ds4 h LYS 249 N 0.25 0.80 0.14 1.57 1.57 -1.26 -0.94 116.57 118.71 1ds4 h LYS 249 Ca 0.13 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1ds4 h LYS 249 Cb 0.08 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.23 1ds4 h LYS 249 CO -0.12 0.61 -0.07 1.49 -0.57 0.00 0.00 179.45 180.80 1ds4 h GLU 250 N 0.80 -0.18 0.00 3.15 4.81 -0.94 -2.06 114.58 120.16 1ds4 h GLU 250 Ca 0.20 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.37 1ds4 h GLU 250 Cb 0.07 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1ds4 h GLU 250 CO -0.03 -0.06 -0.35 1.88 -0.73 0.00 0.00 179.01 179.72 1ds4 h TYR 251 N -0.27 0.00 0.00 0.92 0.05 -1.18 -1.78 116.97 114.71 1ds4 h TYR 251 Ca -0.02 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.74 1ds4 h TYR 251 Cb 0.21 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.95 1ds4 h TYR 251 CO -0.04 0.35 -0.10 0.00 -1.05 0.00 0.00 178.16 177.32 1ds4 h ALA 252 N 1.65 1.05 -0.31 3.88 0.00 -0.91 -3.14 119.26 121.47 1ds4 h ALA 252 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1ds4 h ALA 252 Cb 0.88 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1ds4 h ALA 252 CO 0.05 0.13 0.00 0.09 0.00 0.00 0.00 179.25 179.51 1ds4 n ASN 253 N -3.29 2.88 -3.26 0.00 3.02 -0.80 -4.83 115.26 108.98 1ds4 n ASN 253 Ca -0.00 -1.88 -0.06 0.00 -0.03 0.00 0.00 54.58 52.62 1ds4 n ASN 253 Cb 0.33 -0.21 -0.04 0.00 -0.61 0.00 0.00 39.78 39.26 1ds4 n ASN 253 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ds4 s ASP 254 N -1.06 -0.49 0.22 6.41 -1.08 -0.73 -5.03 116.67 114.92 1ds4 s ASP 254 Ca 0.26 -0.96 -0.08 0.00 -0.52 0.00 0.00 52.55 51.24 1ds4 s ASP 254 Cb 0.14 1.43 0.22 0.00 -1.46 0.00 0.00 42.92 43.25 1ds4 s ASP 254 CO 0.19 -0.22 1.88 1.56 0.52 0.00 0.00 175.17 179.10 1ds4 h GLN 255 N 7.17 1.03 -0.26 4.34 4.20 -1.88 -2.34 115.11 127.37 1ds4 h GLN 255 Ca 0.04 -0.06 -0.15 0.00 0.06 0.00 0.00 58.65 58.53 1ds4 h GLN 255 Cb 1.13 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.67 1ds4 h GLN 255 CO 0.15 0.68 -0.45 0.22 -0.67 0.00 0.00 178.83 178.76 1ds4 h ASP 256 N 1.06 0.73 -0.45 1.46 3.58 -1.95 -0.53 116.42 120.32 1ds4 h ASP 256 Ca 0.32 -0.35 -0.04 0.00 0.42 0.00 0.00 57.03 57.38 1ds4 h ASP 256 Cb -0.05 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 40.78 1ds4 h ASP 256 CO -0.09 1.07 0.13 0.50 -2.88 0.00 0.00 179.24 177.97 1ds4 h LYS 257 N 0.54 0.71 -0.51 0.28 1.63 -1.91 -0.44 116.57 116.87 1ds4 h LYS 257 Ca 0.03 -0.16 0.00 0.00 -0.85 0.00 0.00 60.65 59.68 1ds4 h LYS 257 Cb 1.00 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 32.50 1ds4 h LYS 257 CO 0.09 0.69 0.33 0.35 -3.45 0.00 0.00 179.45 177.46 1ds4 h PHE 258 N 0.59 0.65 -0.35 1.91 3.57 -1.30 -0.56 116.94 121.45 1ds4 h PHE 258 Ca 0.14 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.66 1ds4 h PHE 258 Cb 0.29 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 1ds4 h PHE 258 CO 0.02 0.42 0.23 0.74 -2.23 0.00 0.00 178.31 177.48 1ds4 h PHE 259 N 0.69 0.43 -0.48 0.41 -1.00 -0.64 0.97 116.94 117.31 1ds4 h PHE 259 Ca 0.18 0.01 -0.07 0.00 2.81 0.00 0.00 57.97 60.90 1ds4 h PHE 259 Cb -0.06 -0.14 -0.02 0.00 3.61 0.00 0.00 35.95 39.34 1ds4 h PHE 259 CO -0.04 0.27 0.02 0.87 -1.61 0.00 0.00 178.31 177.83 1ds4 h LYS 260 N 0.46 0.83 -0.67 1.51 1.57 -0.94 -0.98 116.57 118.35 1ds4 h LYS 260 Ca 0.13 -0.25 -0.08 0.00 -1.87 0.00 0.00 60.65 58.58 1ds4 h LYS 260 Cb -0.05 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 1ds4 h LYS 260 CO -0.03 0.86 0.10 -0.44 -0.57 0.00 0.00 179.45 179.37 1ds4 h ASP 261 N 0.69 1.06 -0.50 0.86 5.19 -0.95 -2.57 116.42 120.20 1ds4 h ASP 261 Ca 0.14 -0.26 -0.06 0.00 -0.62 0.00 0.00 57.03 56.22 1ds4 h ASP 261 Cb 0.47 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.68 1ds4 h ASP 261 CO 0.02 1.06 0.07 0.15 -3.12 0.00 0.00 179.24 177.42 1ds4 h PHE 262 N 1.03 0.89 -0.59 4.55 3.57 -0.66 -1.46 116.94 124.28 1ds4 h PHE 262 Ca 0.20 -0.13 0.02 0.00 3.53 0.00 0.00 57.97 61.60 1ds4 h PHE 262 Cb 0.45 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 38.91 1ds4 h PHE 262 CO 0.03 0.82 0.36 1.03 -2.23 0.00 0.00 178.31 178.32 1ds4 h SER 263 N 0.71 0.59 0.31 0.41 0.87 -0.96 0.12 113.55 115.61 1ds4 h SER 263 Ca 0.15 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 1ds4 h SER 263 Cb 0.41 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 1ds4 h SER 263 CO 0.01 0.42 -0.24 0.11 -0.53 0.00 0.00 176.83 176.60 1ds4 h LYS 264 N 0.72 -0.54 -0.06 2.24 1.57 -1.36 -2.06 116.57 117.07 1ds4 h LYS 264 Ca 0.23 0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.95 1ds4 h LYS 264 Cb 0.01 0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1ds4 h LYS 264 CO -0.09 -0.36 -0.43 0.00 -0.57 0.00 0.00 179.45 178.00 1ds4 h ALA 265 N 0.07 1.16 -0.26 3.86 0.00 -0.93 -0.87 119.26 122.29 1ds4 h ALA 265 Ca -0.02 -0.41 -0.12 0.00 0.00 0.00 0.00 54.91 54.36 1ds4 h ALA 265 Cb 0.49 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1ds4 h ALA 265 CO -0.01 0.58 -0.30 0.35 0.00 0.00 0.00 179.25 179.88 1ds4 h PHE 266 N 0.12 0.79 -0.77 0.00 3.57 -0.75 0.77 116.94 120.68 1ds4 h PHE 266 Ca 0.01 -0.25 -0.04 0.00 3.53 0.00 0.00 57.97 61.22 1ds4 h PHE 266 Cb 0.81 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.36 1ds4 h PHE 266 CO 0.01 0.99 0.32 1.49 -2.23 0.00 0.00 178.31 178.89 1ds4 h GLU 267 N 0.37 1.14 -0.14 1.11 4.81 -1.24 -0.16 114.58 120.47 1ds4 h GLU 267 Ca 0.03 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 1ds4 h GLU 267 Cb 0.87 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.06 1ds4 h GLU 267 CO 0.07 0.92 0.09 -0.22 -0.73 0.00 0.00 179.01 179.14 1ds4 h LYS 268 N 1.11 0.19 -0.36 1.92 3.64 -0.98 -0.49 116.57 121.59 1ds4 h LYS 268 Ca 0.26 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.68 1ds4 h LYS 268 Cb 0.19 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.92 1ds4 h LYS 268 CO -0.02 0.14 0.07 1.25 -2.27 0.00 0.00 179.45 178.61 1ds4 h LEU 269 N 0.19 -0.00 -1.61 5.20 5.85 -0.63 -0.00 115.31 124.30 1ds4 h LEU 269 Ca 0.05 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1ds4 h LEU 269 Cb -0.01 0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 1ds4 h LEU 269 CO -0.01 0.04 -0.04 -0.07 -0.34 0.00 0.00 178.44 178.02 1ds4 h LEU 270 N 0.19 0.00 -0.01 2.25 3.38 -0.46 -3.08 115.31 117.57 1ds4 h LEU 270 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1ds4 h LEU 270 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1ds4 h LEU 270 CO -0.23 0.04 -0.86 -0.62 0.09 0.00 0.00 178.44 176.86 1ds4 n GLU 271 N -3.17 0.96 -1.62 1.13 1.02 -0.24 -4.64 120.64 114.08 1ds4 n GLU 271 Ca -0.00 -0.01 -0.49 0.00 -0.02 0.00 0.00 57.16 56.65 1ds4 n GLU 271 Cb 0.29 -1.36 -0.05 0.00 -0.02 0.00 0.00 31.44 30.30 1ds4 n GLU 271 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1ds4 n ASN 272 N -1.42 2.06 0.00 1.62 3.02 -0.07 -1.98 115.26 118.48 1ds4 n ASN 272 Ca 0.03 1.12 0.00 0.00 -0.03 0.00 0.00 54.58 55.71 1ds4 n ASN 272 Cb 0.29 -1.29 0.00 0.00 -0.61 0.00 0.00 39.78 38.17 1ds4 n ASN 272 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ds4 n GLY 273 N 2.52 0.80 3.56 7.41 0.00 -1.26 -4.41 105.19 113.81 1ds4 n GLY 273 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 1ds4 n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ds4 s ILE 274 N -2.45 4.32 -0.24 -0.61 1.01 -0.84 -4.29 121.20 118.10 1ds4 s ILE 274 Ca 0.00 -0.20 -0.16 0.00 0.00 0.00 0.00 60.65 60.29 1ds4 s ILE 274 Cb 0.00 -2.92 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 1ds4 s ILE 274 CO 0.00 0.47 0.40 -0.89 0.00 0.00 0.00 174.94 174.92 1ds4 s THR 275 N 0.41 5.18 -0.29 2.92 2.01 0.07 -4.96 115.64 120.98 1ds4 s THR 275 Ca -0.00 0.66 -0.10 0.00 0.31 0.00 0.00 61.69 62.55 1ds4 s THR 275 Cb -0.13 -3.72 -0.03 0.00 0.01 0.00 0.00 72.50 68.63 1ds4 s THR 275 CO 0.02 0.19 0.16 -0.36 -0.69 0.00 0.00 174.62 173.94 1ds4 s PHE 276 N 1.74 3.17 0.61 4.92 0.08 -1.26 -0.72 117.98 126.52 1ds4 s PHE 276 Ca 0.17 -0.28 -0.18 0.00 0.12 0.00 0.00 56.93 56.77 1ds4 s PHE 276 Cb -0.15 -2.35 -0.05 0.00 -0.57 0.00 0.00 43.02 39.90 1ds4 s PHE 276 CO 0.09 -0.33 0.82 -2.30 -0.10 0.00 0.00 175.22 173.40 1ds4 n PRO 277 N 5.01 0.71 0.12 0.24 -0.02 -1.26 -4.83 135.00 134.96 1ds4 n PRO 277 Ca -0.14 0.28 0.17 0.00 -2.02 0.00 0.00 63.50 61.79 1ds4 n PRO 277 Cb 0.51 -2.03 0.74 0.00 -0.02 0.00 0.00 33.50 32.70 1ds4 n PRO 277 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1ds4 h LYS 278 N 0.27 0.00 -0.09 -0.52 1.79 -2.01 0.16 116.57 116.17 1ds4 h LYS 278 Ca -0.48 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 1ds4 h LYS 278 Cb 1.37 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.02 1ds4 h LYS 278 CO 0.49 0.00 0.00 -0.40 -1.08 0.00 0.00 179.45 178.46 1ds4 n ASP 279 N -4.13 1.85 -4.67 0.86 5.68 -1.26 -4.94 116.55 109.95 1ds4 n ASP 279 Ca 0.05 -1.65 -0.35 0.00 -0.50 0.00 0.00 54.79 52.34 1ds4 n ASP 279 Cb 0.43 -0.05 0.11 0.00 -1.14 0.00 0.00 41.12 40.47 1ds4 n ASP 279 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ds4 n ALA 280 N 0.44 0.05 -1.41 2.12 0.00 0.55 -4.96 120.51 117.31 1ds4 n ALA 280 Ca 0.18 -0.25 -0.34 0.00 0.00 0.00 0.00 53.44 53.02 1ds4 n ALA 280 Cb 0.39 -2.22 0.08 0.00 0.00 0.00 0.00 19.45 17.71 1ds4 n ALA 280 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1ds4 s PRO 281 N -3.79 2.26 0.88 0.00 0.02 -1.26 -5.00 135.00 128.11 1ds4 s PRO 281 Ca 0.74 1.74 -0.11 0.00 0.02 0.00 0.00 61.00 63.40 1ds4 s PRO 281 Cb -0.32 -1.85 0.12 0.00 0.02 0.00 0.00 34.50 32.48 1ds4 s PRO 281 CO 0.49 -1.74 1.10 -1.12 -0.33 0.00 0.00 177.00 175.40 1ds4 s SER 282 N -2.03 3.43 0.37 2.53 0.01 -1.26 -4.95 113.70 111.80 1ds4 s SER 282 Ca 0.74 1.84 -0.28 0.00 1.31 0.00 0.00 55.95 59.57 1ds4 s SER 282 Cb -0.29 -2.44 -0.11 0.00 0.21 0.00 0.00 66.02 63.39 1ds4 s SER 282 CO 0.44 -2.72 1.41 -2.65 0.41 0.00 0.00 173.24 170.12 1ds4 n PRO 283 N -3.97 2.43 -3.00 12.44 -0.02 -1.26 -4.94 135.00 136.69 1ds4 n PRO 283 Ca 0.09 0.85 -0.39 0.00 -2.02 0.00 0.00 63.50 62.03 1ds4 n PRO 283 Cb 0.53 -2.54 -0.06 0.00 -0.02 0.00 0.00 33.50 31.41 1ds4 n PRO 283 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1ds4 s PHE 284 N -1.12 3.89 -0.37 6.00 0.08 0.19 -4.81 117.98 121.85 1ds4 s PHE 284 Ca 0.55 1.61 -0.08 0.00 0.12 0.00 0.00 56.93 59.13 1ds4 s PHE 284 Cb -0.51 -2.75 0.05 0.00 -0.57 0.00 0.00 43.02 39.24 1ds4 s PHE 284 CO 0.63 0.51 0.17 0.42 -0.10 0.00 0.00 175.22 176.85 1ds4 s ILE 285 N -1.17 4.04 0.39 0.64 -1.09 -1.26 -1.25 121.20 121.50 1ds4 s ILE 285 Ca 0.36 -1.19 -0.21 0.00 -2.23 0.00 0.00 60.65 57.38 1ds4 s ILE 285 Cb -0.23 -3.35 -0.10 0.00 -1.58 0.00 0.00 42.46 37.19 1ds4 s ILE 285 CO 0.26 -0.30 0.90 -0.36 -1.23 0.00 0.00 174.94 174.21 1ds4 s PHE 286 N 1.43 3.39 0.23 3.97 0.08 -1.26 -5.03 117.98 120.79 1ds4 s PHE 286 Ca 0.01 1.56 -0.30 0.00 0.12 0.00 0.00 56.93 58.32 1ds4 s PHE 286 Cb -0.21 -2.80 -0.09 0.00 -0.57 0.00 0.00 43.02 39.36 1ds4 s PHE 286 CO 0.03 -0.01 0.95 0.15 -0.10 0.00 0.00 175.22 176.25 1ds4 s LYS 287 N -2.92 4.84 0.85 0.44 -0.14 -1.26 -4.98 119.74 116.57 1ds4 s LYS 287 Ca 0.58 1.51 -0.12 0.00 -1.36 0.00 0.00 55.97 56.58 1ds4 s LYS 287 Cb -0.11 -3.28 0.10 0.00 -1.68 0.00 0.00 37.83 32.86 1ds4 s LYS 287 CO 0.16 0.48 1.10 0.95 -0.76 0.00 0.00 175.35 177.27 1ds4 s THR 288 N -1.11 2.80 0.17 2.17 -4.23 -1.26 -4.90 115.64 109.29 1ds4 s THR 288 Ca 0.42 0.26 -0.14 0.00 -1.18 0.00 0.00 61.69 61.04 1ds4 s THR 288 Cb -0.26 -2.87 0.08 0.00 1.34 0.00 0.00 72.50 70.79 1ds4 s THR 288 CO 0.32 -0.34 1.73 -0.07 -0.54 0.00 0.00 174.62 175.72 1ds4 h LEU 289 N -1.35 0.03 -1.21 4.79 3.38 -1.97 -2.04 115.31 116.94 1ds4 h LEU 289 Ca -0.48 0.07 0.10 0.00 0.09 0.00 0.00 57.88 57.66 1ds4 h LEU 289 Cb 1.28 0.10 -0.06 0.00 0.09 0.00 0.00 40.66 42.06 1ds4 h LEU 289 CO 0.57 0.05 0.57 -0.08 0.09 0.00 0.00 178.44 179.64 1ds4 h GLU 290 N 0.24 0.84 0.00 1.13 4.81 -1.93 0.14 114.58 119.81 1ds4 h GLU 290 Ca 0.22 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.37 1ds4 h GLU 290 Cb 0.27 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.45 1ds4 h GLU 290 CO -0.27 0.56 -0.12 0.93 -0.73 0.00 0.00 179.01 179.38 1ds4 h GLU 291 N 0.87 0.00 -0.01 1.92 5.08 -1.74 -2.89 114.58 117.81 1ds4 h GLU 291 Ca 0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.77 1ds4 h GLU 291 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1ds4 h GLU 291 CO -0.17 0.12 -0.07 1.04 -1.00 0.00 0.00 179.01 178.92 1ds4 n GLN 292 N -3.23 1.53 -1.76 2.33 6.02 -0.15 -4.92 117.38 117.20 1ds4 n GLN 292 Ca 0.01 -0.95 -0.17 0.00 -0.01 0.00 0.00 57.00 55.88 1ds4 n GLN 292 Cb 0.40 -1.48 -0.05 0.00 1.02 0.00 0.00 30.24 30.13 1ds4 n GLN 292 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ds4 n GLY 293 N 1.24 0.99 0.67 1.08 0.00 -0.47 -5.07 105.19 103.64 1ds4 n GLY 293 Ca 0.17 -0.22 0.13 0.00 0.00 0.00 0.00 46.02 46.10 1ds4 n GLY 293 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36