#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s64 s LEU 56 N 0.00 3.37 0.74 4.37 2.96 -1.26 -5.00 118.68 123.86 1s64 s LEU 56 Ca 0.00 0.18 -0.15 0.00 -0.22 0.00 0.00 54.13 53.94 1s64 s LEU 56 Cb 0.00 -2.98 0.04 0.00 0.50 0.00 0.00 46.19 43.75 1s64 s LEU 56 CO 0.00 -1.73 1.22 -0.55 -1.32 0.00 0.00 176.35 173.97 1s64 s SER 57 N 4.35 4.12 0.13 3.68 0.15 -1.26 -4.93 113.70 119.94 1s64 s SER 57 Ca 0.50 2.40 0.21 0.00 0.70 0.00 0.00 55.95 59.76 1s64 s SER 57 Cb -0.10 -2.59 0.87 0.00 -1.71 0.00 0.00 66.02 62.48 1s64 s SER 57 CO 0.24 -2.31 1.66 0.18 1.20 0.00 0.00 173.24 174.20 1s64 n LEU 58 N -2.73 0.39 -0.02 3.45 4.77 -1.26 -2.76 117.00 118.84 1s64 n LEU 58 Ca 0.14 0.58 0.03 0.00 -0.03 0.00 0.00 56.01 56.73 1s64 n LEU 58 Cb 0.50 -0.51 0.05 0.00 -2.33 0.00 0.00 43.42 41.13 1s64 n LEU 58 CO 0.48 -0.34 0.52 -0.90 -1.33 0.00 0.00 177.39 175.82 1s64 n ASP 59 N -1.91 2.12 -4.77 -1.43 5.75 -1.26 -4.98 116.55 110.07 1s64 n ASP 59 Ca 0.04 -2.36 -0.38 0.00 -0.01 0.00 0.00 54.79 52.07 1s64 n ASP 59 Cb 0.25 -0.14 -0.03 0.00 -1.03 0.00 0.00 41.12 40.17 1s64 n ASP 59 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1s64 s SER 60 N -1.62 6.70 0.36 -1.12 0.15 -1.11 -4.91 113.70 112.15 1s64 s SER 60 Ca 0.11 2.31 0.07 0.00 0.70 0.00 0.00 55.95 59.13 1s64 s SER 60 Cb 0.09 -2.61 0.76 0.00 -1.71 0.00 0.00 66.02 62.55 1s64 s SER 60 CO 0.01 -0.55 1.92 -0.65 1.20 0.00 0.00 173.24 175.18 1s64 h PRO 61 N 2.87 0.72 -0.73 5.44 0.11 -1.96 -1.67 132.00 136.78 1s64 h PRO 61 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1s64 h PRO 61 Cb 1.23 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1s64 h PRO 61 CO 0.63 0.48 0.00 0.25 -0.21 0.00 0.00 178.00 179.15 1s64 n THR 62 N -4.51 1.54 -2.05 -1.15 -2.24 -1.26 -4.95 114.28 99.66 1s64 n THR 62 Ca 0.13 -0.80 -0.41 0.00 -2.27 0.00 0.00 64.05 60.70 1s64 n THR 62 Cb 0.32 -0.32 -0.02 0.00 -2.10 0.00 0.00 70.33 68.22 1s64 n THR 62 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1s64 s TYR 63 N -1.98 2.98 -0.05 4.78 6.14 -0.63 -5.02 117.35 123.57 1s64 s TYR 63 Ca 0.32 1.29 0.03 0.00 0.64 0.00 0.00 57.07 59.35 1s64 s TYR 63 Cb 0.24 -3.76 0.00 0.00 0.42 0.00 0.00 41.96 38.86 1s64 s TYR 63 CO 0.10 -2.19 -0.15 0.08 0.64 0.00 0.00 175.55 174.03 1s64 s VAL 64 N -0.86 1.25 0.82 3.14 1.01 -1.26 -5.04 120.40 119.46 1s64 s VAL 64 Ca 0.52 -0.60 -0.14 0.00 0.00 0.00 0.00 61.98 61.76 1s64 s VAL 64 Cb -0.41 -1.10 0.04 0.00 0.00 0.00 0.00 36.38 34.91 1s64 s VAL 64 CO 0.52 0.37 0.87 0.18 0.00 0.00 0.00 175.10 177.04 1s64 n LEU 65 N 3.35 2.54 0.20 3.92 4.77 -1.26 -4.87 117.00 125.65 1s64 n LEU 65 Ca -0.19 0.53 0.06 0.00 -0.03 0.00 0.00 56.01 56.38 1s64 n LEU 65 Cb 0.53 -1.37 0.40 0.00 -2.33 0.00 0.00 43.42 40.64 1s64 n LEU 65 CO 0.25 -2.46 0.73 1.88 -1.33 0.00 0.00 177.39 176.46 1s64 h TYR 66 N -0.91 0.00 0.00 -1.77 0.05 -1.95 -2.44 116.97 109.95 1s64 h TYR 66 Ca -0.45 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.31 1s64 h TYR 66 Cb 1.31 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 39.05 1s64 h TYR 66 CO 0.42 0.35 -0.10 0.07 -1.05 0.00 0.00 178.16 177.85 1s64 h ARG 67 N 0.00 0.00 -0.63 4.88 0.11 -1.91 -2.33 114.38 114.50 1s64 h ARG 67 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1s64 h ARG 67 Cb 0.75 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.83 1s64 h ARG 67 CO 0.05 0.10 0.00 -0.25 0.10 0.00 0.00 179.97 179.96 1s64 n ASP 68 N -3.46 3.70 -4.77 0.08 8.00 -0.93 -4.94 116.55 114.24 1s64 n ASP 68 Ca -0.01 -1.99 -0.36 0.00 0.71 0.00 0.00 54.79 53.13 1s64 n ASP 68 Cb 0.25 -0.42 -0.07 0.00 -0.02 0.00 0.00 41.12 40.86 1s64 n ASP 68 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1s64 s ARG 69 N -1.03 4.07 0.17 -1.24 0.52 -0.88 -4.95 118.95 115.61 1s64 s ARG 69 Ca 0.43 0.04 -0.12 0.00 -0.52 0.00 0.00 55.73 55.56 1s64 s ARG 69 Cb 0.22 -3.36 0.07 0.00 0.52 0.00 0.00 34.95 32.40 1s64 s ARG 69 CO 0.29 0.40 1.70 0.00 0.02 0.00 0.00 175.30 177.71 1s64 h ALA 70 N 6.14 0.76 -0.00 2.13 0.00 -1.92 -2.58 119.26 123.79 1s64 h ALA 70 Ca -0.45 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1s64 h ALA 70 Cb 1.18 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 1s64 h ALA 70 CO 0.71 0.42 0.14 0.93 0.00 0.00 0.00 179.25 181.45 1s64 h GLU 71 N 0.82 0.00 -0.30 0.00 3.07 -1.94 -0.77 114.58 115.46 1s64 h GLU 71 Ca 0.19 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.05 1s64 h GLU 71 Cb 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.18 1s64 h GLU 71 CO -0.01 0.00 0.00 0.91 -1.40 0.00 0.00 179.01 178.51 1s64 n TRP 72 N -3.01 0.78 -0.15 4.33 7.02 -0.98 -4.65 117.44 120.77 1s64 n TRP 72 Ca -0.03 -0.72 -0.03 0.00 -1.02 0.00 0.00 57.50 55.70 1s64 n TRP 72 Cb 0.20 -0.20 0.18 0.00 -2.42 0.00 0.00 31.31 29.06 1s64 n TRP 72 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1s64 h ALA 73 N 1.95 1.19 0.00 6.99 0.00 -1.07 -2.85 119.26 125.47 1s64 h ALA 73 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1s64 h ALA 73 Cb 1.17 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1s64 h ALA 73 CO 0.14 0.56 0.00 0.38 0.00 0.00 0.00 179.25 180.33 1s64 h ASP 74 N 0.85 0.00 -3.21 0.00 3.04 -1.83 -3.44 116.42 111.84 1s64 h ASP 74 Ca 0.19 0.00 -0.58 0.00 -3.24 0.00 0.00 57.03 53.39 1s64 h ASP 74 Cb 0.28 0.00 -0.06 0.00 -1.04 0.00 0.00 39.33 38.51 1s64 h ASP 74 CO -0.00 0.00 -0.12 -0.63 -2.04 0.00 0.00 179.24 176.44 1s64 s ILE 75 N -3.55 5.02 -0.40 4.15 -1.09 -1.08 -5.06 121.20 119.20 1s64 s ILE 75 Ca 0.02 1.00 -0.17 0.00 -2.23 0.00 0.00 60.65 59.28 1s64 s ILE 75 Cb 0.09 -3.81 0.01 0.00 -1.58 0.00 0.00 42.46 37.17 1s64 s ILE 75 CO 0.50 0.46 0.41 -1.81 -1.23 0.00 0.00 174.94 173.27 1s64 s ASP 76 N -0.34 6.19 0.54 3.58 1.01 -1.26 -5.05 116.67 121.33 1s64 s ASP 76 Ca 0.26 -0.55 -0.21 0.00 0.71 0.00 0.00 52.55 52.76 1s64 s ASP 76 Cb -0.17 -2.21 -0.06 0.00 1.01 0.00 0.00 42.92 41.49 1s64 s ASP 76 CO 0.14 -0.50 1.22 -0.81 0.21 0.00 0.00 175.17 175.43 1s64 n PRO 77 N 5.51 1.47 -4.00 8.23 -0.04 -1.26 -4.76 135.00 140.15 1s64 n PRO 77 Ca -0.08 0.54 -0.34 0.00 -0.04 0.00 0.00 63.50 63.58 1s64 n PRO 77 Cb 0.48 -2.40 -0.14 0.00 -0.04 0.00 0.00 33.50 31.39 1s64 n PRO 77 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1s64 s VAL 78 N -1.33 3.05 0.44 0.52 1.01 0.69 -4.96 120.40 119.83 1s64 s VAL 78 Ca 0.71 -0.60 -0.06 0.00 0.00 0.00 0.00 61.98 62.03 1s64 s VAL 78 Cb -0.44 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 1s64 s VAL 78 CO 0.50 0.46 0.75 -2.16 0.00 0.00 0.00 175.10 174.65 1s64 s PRO 79 N 1.38 3.60 -0.04 2.72 0.04 -1.26 -4.31 135.00 137.13 1s64 s PRO 79 Ca 0.05 0.22 -0.20 0.00 0.04 0.00 0.00 61.00 61.11 1s64 s PRO 79 Cb -0.14 -2.41 -0.05 0.00 0.04 0.00 0.00 34.50 31.94 1s64 s PRO 79 CO -0.05 -0.12 0.56 -1.14 0.04 0.00 0.00 177.00 176.30 1s64 s GLN 80 N -4.42 4.30 -0.24 4.56 0.74 -1.26 -5.06 119.66 118.28 1s64 s GLN 80 Ca 0.48 0.66 -0.01 0.00 0.05 0.00 0.00 55.36 56.53 1s64 s GLN 80 Cb -0.10 -3.36 0.07 0.00 1.10 0.00 0.00 33.01 30.71 1s64 s GLN 80 CO 0.40 0.32 0.01 0.54 -0.55 0.00 0.00 175.29 176.01 1s64 s ASN 81 N 0.01 3.58 -0.02 6.67 2.20 -1.26 -4.99 114.94 121.13 1s64 s ASN 81 Ca 0.30 -1.18 0.04 0.00 -0.94 0.00 0.00 52.86 51.08 1s64 s ASN 81 Cb -0.17 -0.92 0.16 0.00 -2.00 0.00 0.00 41.25 38.31 1s64 s ASN 81 CO 0.15 -0.30 1.01 0.47 -2.94 0.00 0.00 177.10 175.49 1s64 n ASP 82 N 4.83 1.24 -0.15 3.54 9.92 -1.26 -5.03 116.55 129.64 1s64 n ASP 82 Ca -0.08 -2.07 0.01 0.00 -0.53 0.00 0.00 54.79 52.13 1s64 n ASP 82 Cb 0.45 -0.25 -0.00 0.00 -0.64 0.00 0.00 41.12 40.68 1s64 n ASP 82 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1s64 n GLY 83 N 0.56 -2.10 0.26 0.44 0.00 -1.26 -4.21 105.19 98.87 1s64 n GLY 83 Ca 0.06 -1.44 -0.08 0.00 0.00 0.00 0.00 46.02 44.56 1s64 n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1s64 h PRO 84 N 0.00 -0.20 -3.90 1.61 0.13 -2.06 -3.36 132.00 124.22 1s64 h PRO 84 Ca 0.00 0.01 -0.66 0.00 -0.87 0.00 0.00 66.00 64.49 1s64 h PRO 84 Cb 0.09 0.05 -0.39 0.00 0.13 0.00 0.00 31.00 30.87 1s64 h PRO 84 CO 0.00 -0.13 -0.61 -1.12 -0.23 0.00 0.00 178.00 175.91 1s64 s SER 85 N -5.07 4.68 0.20 1.44 0.01 -1.26 -5.10 113.70 108.61 1s64 s SER 85 Ca -0.15 -2.65 -0.30 0.00 1.31 0.00 0.00 55.95 54.16 1s64 s SER 85 Cb 0.13 -1.69 -0.08 0.00 0.21 0.00 0.00 66.02 64.58 1s64 s SER 85 CO 0.68 -0.33 1.17 -2.16 0.41 0.00 0.00 173.24 173.02 1s64 s PRO 86 N 0.22 4.52 -0.04 12.44 0.04 -1.26 -5.05 135.00 145.87 1s64 s PRO 86 Ca 0.14 1.86 0.00 0.00 0.04 0.00 0.00 61.00 63.04 1s64 s PRO 86 Cb -0.23 -3.23 -0.03 0.00 0.04 0.00 0.00 34.50 31.05 1s64 s PRO 86 CO -0.03 -0.03 0.00 0.08 0.04 0.00 0.00 177.00 177.06 1s64 s VAL 87 N -0.29 4.22 -1.36 -0.36 1.01 -1.26 -4.56 120.40 117.79 1s64 s VAL 87 Ca 0.51 -0.45 -0.15 0.00 0.00 0.00 0.00 61.98 61.89 1s64 s VAL 87 Cb -0.32 -2.83 0.02 0.00 0.00 0.00 0.00 36.38 33.24 1s64 s VAL 87 CO 0.38 0.47 0.39 0.52 0.00 0.00 0.00 175.10 176.87 1s64 n VAL 88 N 1.71 -2.47 -2.95 2.92 0.31 -1.26 -4.87 118.33 111.72 1s64 n VAL 88 Ca -0.16 -0.59 -0.40 0.00 -0.01 0.00 0.00 64.34 63.18 1s64 n VAL 88 Cb 0.53 -2.09 -0.04 0.00 -0.91 0.00 0.00 33.84 31.33 1s64 n VAL 88 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1s64 s GLN 89 N -7.13 4.48 -0.17 5.55 0.74 -1.26 -5.05 119.66 116.82 1s64 s GLN 89 Ca 0.23 1.06 -0.07 0.00 0.05 0.00 0.00 55.36 56.63 1s64 s GLN 89 Cb -0.12 -3.43 -0.04 0.00 1.10 0.00 0.00 33.01 30.53 1s64 s GLN 89 CO 0.96 0.10 0.06 0.42 -0.55 0.00 0.00 175.29 176.28 1s64 s ILE 90 N 0.60 4.75 0.04 -2.34 1.01 -1.26 -5.08 121.20 118.91 1s64 s ILE 90 Ca 0.41 -0.05 -0.24 0.00 0.00 0.00 0.00 60.65 60.77 1s64 s ILE 90 Cb -0.19 -3.12 -0.06 0.00 0.01 0.00 0.00 42.46 39.10 1s64 s ILE 90 CO 0.22 0.49 0.72 0.27 0.00 0.00 0.00 174.94 176.63 1s64 s ILE 91 N 0.15 4.75 0.05 2.92 -5.25 -1.26 -5.06 121.20 117.49 1s64 s ILE 91 Ca 0.04 1.53 0.06 0.00 -0.99 0.00 0.00 60.65 61.29 1s64 s ILE 91 Cb -0.12 -4.06 -0.03 0.00 2.95 0.00 0.00 42.46 41.19 1s64 s ILE 91 CO 0.01 0.40 -0.14 -0.31 -1.79 0.00 0.00 174.94 173.10 1s64 s TYR 92 N -0.21 2.66 0.80 1.37 1.51 -1.26 -5.12 117.35 117.10 1s64 s TYR 92 Ca 0.36 -0.19 -0.11 0.00 -1.01 0.00 0.00 57.07 56.11 1s64 s TYR 92 Cb -0.20 -1.48 0.07 0.00 -0.11 0.00 0.00 41.96 40.24 1s64 s TYR 92 CO 0.22 0.31 1.09 -1.54 -1.11 0.00 0.00 175.55 174.52 1s64 s SER 93 N -1.59 4.36 0.17 2.29 1.04 -1.26 -4.75 113.70 113.96 1s64 s SER 93 Ca 0.16 1.47 -0.15 0.00 0.48 0.00 0.00 55.95 57.92 1s64 s SER 93 Cb -0.11 -2.21 0.14 0.00 0.10 0.00 0.00 66.02 63.94 1s64 s SER 93 CO 0.07 -2.08 1.71 -0.33 0.98 0.00 0.00 173.24 173.60 1s64 h GLU 94 N -1.16 0.17 -0.38 4.02 4.39 -2.00 -0.40 114.58 119.22 1s64 h GLU 94 Ca -0.47 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.26 1s64 h GLU 94 Cb 1.26 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.84 1s64 h GLU 94 CO 0.56 0.11 0.17 -0.22 -1.16 0.00 0.00 179.01 178.48 1s64 h LYS 95 N 0.17 0.35 0.40 2.33 3.64 -1.99 -0.21 116.57 121.26 1s64 h LYS 95 Ca 0.21 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.55 1s64 h LYS 95 Cb 0.29 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1s64 h LYS 95 CO -0.31 0.23 -0.19 0.35 -2.27 0.00 0.00 179.45 177.25 1s64 h PHE 96 N 0.36 -0.50 -0.39 1.91 3.57 -1.80 -2.25 116.94 117.84 1s64 h PHE 96 Ca 0.17 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.69 1s64 h PHE 96 Cb 0.10 0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.99 1s64 h PHE 96 CO -0.11 -0.22 0.26 -0.09 -2.23 0.00 0.00 178.31 175.92 1s64 h ARG 97 N -0.73 0.39 0.04 1.11 2.43 -1.01 -2.40 114.38 114.21 1s64 h ARG 97 Ca -0.06 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1s64 h ARG 97 Cb 0.51 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1s64 h ARG 97 CO 0.09 0.26 -0.02 0.22 -1.51 0.00 0.00 179.97 179.01 1s64 h ASP 98 N 0.40 -0.05 -0.30 -3.80 1.82 -0.85 0.16 116.42 113.81 1s64 h ASP 98 Ca 0.16 -0.24 0.04 0.00 -0.39 0.00 0.00 57.03 56.60 1s64 h ASP 98 Cb 0.14 0.01 -0.04 0.00 0.68 0.00 0.00 39.33 40.13 1s64 h ASP 98 CO -0.04 0.21 0.08 0.58 -1.61 0.00 0.00 179.24 178.46 1s64 h VAL 99 N -0.31 0.89 0.00 2.25 2.07 -1.00 -2.67 116.25 117.48 1s64 h VAL 99 Ca -0.01 -0.07 -0.06 0.00 0.82 0.00 0.00 66.70 67.38 1s64 h VAL 99 Cb 0.28 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1s64 h VAL 99 CO 0.01 0.04 -0.29 1.88 0.02 0.00 0.00 177.57 179.22 1s64 h TYR 100 N 0.20 0.00 -0.14 1.57 0.05 -1.42 -0.87 116.97 116.37 1s64 h TYR 100 Ca 0.14 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.82 1s64 h TYR 100 Cb 0.12 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.85 1s64 h TYR 100 CO -0.15 0.29 -0.34 -0.44 -1.05 0.00 0.00 178.16 176.47 1s64 h ASP 101 N 0.00 0.28 0.83 3.88 3.32 -0.63 -0.72 116.42 123.38 1s64 h ASP 101 Ca -0.00 -0.10 -0.23 0.00 0.02 0.00 0.00 57.03 56.71 1s64 h ASP 101 Cb 0.88 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 40.32 1s64 h ASP 101 CO 0.04 0.61 -1.25 1.88 -1.72 0.00 0.00 179.24 178.80 1s64 h TYR 102 N 0.24 0.00 -0.47 4.55 -1.99 -1.25 0.20 116.97 118.25 1s64 h TYR 102 Ca 0.03 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.74 1s64 h TYR 102 Cb 0.72 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.43 1s64 h TYR 102 CO 0.01 0.95 0.21 0.35 -0.00 0.00 0.00 178.16 179.68 1s64 h PHE 103 N 0.00 0.69 -0.94 4.88 3.57 -0.77 -0.99 116.94 123.38 1s64 h PHE 103 Ca -0.12 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.34 1s64 h PHE 103 Cb 1.83 -0.21 -0.05 0.00 2.79 0.00 0.00 35.95 40.31 1s64 h PHE 103 CO 0.00 0.56 0.60 0.00 -2.23 0.00 0.00 178.31 177.24 1s64 h ARG 104 N 0.61 1.26 0.18 1.11 3.08 -1.21 -0.17 114.38 119.26 1s64 h ARG 104 Ca 0.16 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 1s64 h ARG 104 Cb 0.14 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 29.92 1s64 h ARG 104 CO -0.02 0.86 -0.09 0.00 -1.07 0.00 0.00 179.97 179.66 1s64 h ALA 105 N 1.36 -0.25 -0.78 0.04 0.00 -1.34 0.70 119.26 119.01 1s64 h ALA 105 Ca 0.34 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1s64 h ALA 105 Cb -0.10 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1s64 h ALA 105 CO -0.07 -0.61 0.49 0.28 0.00 0.00 0.00 179.25 179.34 1s64 h VAL 106 N -0.30 1.21 0.29 0.00 2.07 -0.89 -2.69 116.25 115.94 1s64 h VAL 106 Ca -0.03 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 1s64 h VAL 106 Cb 0.23 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.10 1s64 h VAL 106 CO 0.04 0.21 -0.14 -0.07 0.02 0.00 0.00 177.57 177.64 1s64 h LEU 107 N 1.06 -0.33 -1.68 2.57 3.38 -0.84 -1.02 115.31 118.45 1s64 h LEU 107 Ca 0.28 -0.10 0.25 0.00 0.09 0.00 0.00 57.88 58.40 1s64 h LEU 107 Cb -0.07 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 40.70 1s64 h LEU 107 CO -0.06 -0.10 0.65 -0.61 0.09 0.00 0.00 178.44 178.41 1s64 h GLN 108 N -0.55 0.23 -0.17 1.13 4.15 -0.76 0.29 115.11 119.44 1s64 h GLN 108 Ca -0.04 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1s64 h GLN 108 Cb 0.40 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.04 1s64 h GLN 108 CO 0.07 0.15 0.00 0.54 -1.93 0.00 0.00 178.83 177.66 1s64 n ARG 109 N -4.43 2.39 -4.06 1.69 1.74 -1.02 -4.96 116.66 108.01 1s64 n ARG 109 Ca 0.21 -2.05 -0.29 0.00 -0.77 0.00 0.00 57.85 54.94 1s64 n ARG 109 Cb 0.87 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.80 1s64 n ARG 109 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1s64 n ASP 110 N 1.38 -1.48 -4.60 0.55 4.64 0.10 -4.85 116.55 112.29 1s64 n ASP 110 Ca 0.16 -1.01 -0.43 0.00 -1.38 0.00 0.00 54.79 52.13 1s64 n ASP 110 Cb 0.60 -2.94 -0.02 0.00 -1.04 0.00 0.00 41.12 37.72 1s64 n ASP 110 CO 0.00 0.00 0.00 -0.70 -0.82 0.00 0.00 177.20 175.68 1s64 s GLU 111 N -6.72 3.57 -1.36 -0.67 2.12 -0.78 -4.92 118.70 109.94 1s64 s GLU 111 Ca 0.28 0.84 -0.07 0.00 0.36 0.00 0.00 54.97 56.38 1s64 s GLU 111 Cb -0.15 -4.02 0.10 0.00 0.26 0.00 0.00 34.13 30.32 1s64 s GLU 111 CO 0.90 -1.58 2.32 0.54 -0.54 0.00 0.00 175.26 176.91 1s64 n ARG 112 N 8.10 4.17 -3.65 4.30 5.12 -1.26 -4.83 116.66 128.61 1s64 n ARG 112 Ca 0.16 -3.29 -0.21 0.00 -1.93 0.00 0.00 57.85 52.58 1s64 n ARG 112 Cb 0.48 -2.75 -0.04 0.00 -1.16 0.00 0.00 32.46 28.99 1s64 n ARG 112 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1s64 s SER 113 N 0.83 5.02 0.19 0.55 1.04 -1.26 -4.86 113.70 115.20 1s64 s SER 113 Ca 0.52 -0.74 0.03 0.00 0.48 0.00 0.00 55.95 56.23 1s64 s SER 113 Cb 0.16 -0.61 0.09 0.00 0.10 0.00 0.00 66.02 65.75 1s64 s SER 113 CO -0.06 -0.60 1.45 -0.33 0.98 0.00 0.00 173.24 174.67 1s64 h GLU 114 N 1.10 0.23 -0.24 4.02 4.39 -2.00 -2.52 114.58 119.58 1s64 h GLU 114 Ca -0.42 -0.21 -0.11 0.00 0.34 0.00 0.00 59.36 58.96 1s64 h GLU 114 Cb 1.26 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.95 1s64 h GLU 114 CO 0.59 0.89 -0.31 0.07 -1.16 0.00 0.00 179.01 179.08 1s64 h ARG 115 N 0.15 0.49 -0.50 2.33 0.11 -1.97 -2.14 114.38 112.84 1s64 h ARG 115 Ca -0.03 -0.21 -0.08 0.00 0.10 0.00 0.00 59.98 59.76 1s64 h ARG 115 Cb 1.35 -0.02 -0.02 0.00 1.11 0.00 0.00 29.97 32.39 1s64 h ARG 115 CO 0.12 0.75 -0.01 0.00 0.10 0.00 0.00 179.97 180.93 1s64 h ALA 116 N 1.25 0.67 -0.63 0.08 0.00 -1.85 -1.03 119.26 117.75 1s64 h ALA 116 Ca 0.05 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.71 1s64 h ALA 116 Cb 0.76 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 1s64 h ALA 116 CO 0.06 0.49 0.37 0.35 0.00 0.00 0.00 179.25 180.52 1s64 h PHE 117 N 0.75 0.68 -0.10 0.00 3.57 -1.12 -0.78 116.94 119.94 1s64 h PHE 117 Ca 0.14 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.58 1s64 h PHE 117 Cb 0.53 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 1s64 h PHE 117 CO 0.04 0.36 -0.33 0.87 -2.23 0.00 0.00 178.31 177.02 1s64 h LYS 118 N 0.70 0.19 -0.42 1.11 6.56 -1.11 -2.74 116.57 120.87 1s64 h LYS 118 Ca 0.27 -0.08 -0.07 0.00 -1.06 0.00 0.00 60.65 59.71 1s64 h LYS 118 Cb 0.10 -0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 31.73 1s64 h LYS 118 CO -0.14 0.51 -0.03 1.25 -2.06 0.00 0.00 179.45 178.98 1s64 h LEU 119 N 0.17 0.66 -1.59 2.94 5.85 0.18 -2.49 115.31 121.03 1s64 h LEU 119 Ca 0.02 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.54 1s64 h LEU 119 Cb 0.67 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 1s64 h LEU 119 CO 0.05 0.75 -0.21 0.71 -0.34 0.00 0.00 178.44 179.40 1s64 h THR 120 N 0.64 1.14 -0.67 1.05 1.35 -0.98 -1.52 112.91 113.92 1s64 h THR 120 Ca 0.13 -0.72 -0.04 0.00 -0.55 0.00 0.00 66.41 65.23 1s64 h THR 120 Cb 0.45 1.39 -0.03 0.00 -1.73 0.00 0.00 68.15 68.23 1s64 h THR 120 CO 0.02 0.21 0.27 -0.09 -0.25 0.00 0.00 175.52 175.68 1s64 h ARG 121 N 0.00 0.98 -0.08 4.72 2.43 -1.45 0.21 114.38 121.18 1s64 h ARG 121 Ca -0.00 -0.16 -0.22 0.00 -0.81 0.00 0.00 59.98 58.79 1s64 h ARG 121 Cb 0.37 -0.17 0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1s64 h ARG 121 CO 0.03 0.79 -0.81 -0.44 -1.51 0.00 0.00 179.97 178.03 1s64 h ASP 122 N 0.96 0.86 -0.80 -3.80 3.45 -1.37 -2.18 116.42 113.54 1s64 h ASP 122 Ca 0.23 -0.68 -0.01 0.00 0.43 0.00 0.00 57.03 57.00 1s64 h ASP 122 Cb 0.18 -0.26 -0.04 0.00 -0.56 0.00 0.00 39.33 38.65 1s64 h ASP 122 CO -0.02 1.41 0.47 0.00 -1.57 0.00 0.00 179.24 179.53 1s64 h ALA 123 N 0.47 1.30 -0.33 3.45 0.00 -1.01 -1.35 119.26 121.79 1s64 h ALA 123 Ca -0.08 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.59 1s64 h ALA 123 Cb 1.46 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1s64 h ALA 123 CO 0.16 0.59 -0.37 0.82 0.00 0.00 0.00 179.25 180.45 1s64 h ILE 124 N 1.12 1.28 -0.25 0.00 2.04 -0.94 -0.85 117.51 119.93 1s64 h ILE 124 Ca 0.29 -1.53 -0.07 0.00 1.00 0.00 0.00 64.86 64.55 1s64 h ILE 124 Cb -0.02 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 1s64 h ILE 124 CO -0.05 0.50 -0.14 -0.08 0.00 0.00 0.00 178.15 178.38 1s64 h GLU 125 N 0.64 0.41 -0.04 2.37 4.81 -0.71 -2.02 114.58 120.04 1s64 h GLU 125 Ca 0.06 -0.12 -0.20 0.00 -0.13 0.00 0.00 59.36 58.97 1s64 h GLU 125 Cb 0.91 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.25 1s64 h GLU 125 CO 0.08 0.56 -0.81 -0.07 -0.73 0.00 0.00 179.01 178.04 1s64 h LEU 126 N 0.38 0.47 -6.02 1.64 3.38 -1.01 -3.43 115.31 110.73 1s64 h LEU 126 Ca 0.07 -0.34 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 1s64 h LEU 126 Cb 0.49 -0.14 -0.20 0.00 0.09 0.00 0.00 40.66 40.89 1s64 h LEU 126 CO 0.03 1.10 -0.45 0.21 0.09 0.00 0.00 178.44 179.43 1s64 s ASN 127 N -7.00 -1.40 0.00 -0.43 2.47 -0.35 -5.01 114.94 103.22 1s64 s ASN 127 Ca -0.05 -0.57 0.20 0.00 0.42 0.00 0.00 52.86 52.86 1s64 s ASN 127 Cb 0.10 1.91 1.15 0.00 -1.45 0.00 0.00 41.25 42.95 1s64 s ASN 127 CO 0.85 -0.21 1.61 0.00 -3.72 0.00 0.00 177.10 175.63 1s64 n ALA 128 N 4.67 2.19 1.14 1.71 0.00 -0.79 -2.80 120.51 126.64 1s64 n ALA 128 Ca 0.09 -0.12 0.13 0.00 0.00 0.00 0.00 53.44 53.54 1s64 n ALA 128 Cb 0.56 -1.33 0.30 0.00 0.00 0.00 0.00 19.45 18.97 1s64 n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1s64 n ALA 129 N -1.10 2.51 -2.64 0.00 0.00 -1.26 -4.72 120.51 113.29 1s64 n ALA 129 Ca 0.13 -0.61 -0.42 0.00 0.00 0.00 0.00 53.44 52.55 1s64 n ALA 129 Cb 0.10 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.54 1s64 n ALA 129 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1s64 s ASN 130 N -1.91 6.24 0.47 0.00 3.84 -1.12 -4.87 114.94 117.59 1s64 s ASN 130 Ca 0.33 -0.81 0.14 0.00 0.21 0.00 0.00 52.86 52.73 1s64 s ASN 130 Cb 0.20 -2.52 1.12 0.00 -0.55 0.00 0.00 41.25 39.50 1s64 s ASN 130 CO 0.31 -1.66 2.09 0.10 -2.79 0.00 0.00 177.10 175.15 1s64 h TYR 131 N 9.83 0.22 -0.73 0.43 -0.00 -1.92 -2.07 116.97 122.73 1s64 h TYR 131 Ca -0.19 0.01 -0.06 0.00 0.00 0.00 0.00 58.73 58.49 1s64 h TYR 131 Cb 1.05 -0.07 -0.03 0.00 0.00 0.00 0.00 36.73 37.67 1s64 h TYR 131 CO 1.12 0.13 0.23 1.15 -0.00 0.00 0.00 178.16 180.79 1s64 h THR 132 N 0.23 1.26 -0.34 -0.90 2.02 -1.99 -1.16 112.91 112.02 1s64 h THR 132 Ca 0.10 -0.91 0.00 0.00 0.77 0.00 0.00 66.41 66.38 1s64 h THR 132 Cb 0.12 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 1s64 h THR 132 CO -0.02 0.36 0.22 0.58 0.37 0.00 0.00 175.52 177.03 1s64 h VAL 133 N 1.09 1.10 -0.59 3.16 2.07 -1.78 -0.77 116.25 120.52 1s64 h VAL 133 Ca 0.24 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.53 1s64 h VAL 133 Cb 0.31 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 1s64 h VAL 133 CO -0.01 0.09 0.22 -0.50 0.02 0.00 0.00 177.57 177.40 1s64 h TRP 134 N 0.46 0.88 0.01 1.57 4.06 -1.34 -0.06 115.95 121.52 1s64 h TRP 134 Ca 0.13 -0.06 -0.00 0.00 2.06 0.00 0.00 58.89 61.02 1s64 h TRP 134 Cb -0.04 -0.27 0.00 0.00 -1.00 0.00 0.00 29.16 27.86 1s64 h TRP 134 CO -0.05 0.69 -0.00 1.25 -3.56 0.00 0.00 178.44 176.77 1s64 h HIS 135 N 0.85 -0.01 -0.88 0.49 2.76 -0.77 -1.55 115.15 116.05 1s64 h HIS 135 Ca 0.20 -0.00 0.04 0.00 -2.20 0.00 0.00 60.37 58.41 1s64 h HIS 135 Cb 0.19 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.10 1s64 h HIS 135 CO 0.01 0.21 0.56 0.35 -1.30 0.00 0.00 177.93 177.77 1s64 h PHE 136 N -0.23 1.05 -0.84 5.26 3.57 -0.88 -0.04 116.94 124.82 1s64 h PHE 136 Ca -0.00 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.53 1s64 h PHE 136 Cb 0.23 -0.35 -0.04 0.00 2.79 0.00 0.00 35.95 38.58 1s64 h PHE 136 CO -0.00 0.59 0.55 -0.09 -2.23 0.00 0.00 178.31 177.12 1s64 h ARG 137 N 1.07 1.12 -0.42 1.11 2.43 -0.79 0.10 114.38 118.99 1s64 h ARG 137 Ca 0.36 -0.07 -0.11 0.00 -0.81 0.00 0.00 59.98 59.35 1s64 h ARG 137 Cb 0.05 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.33 1s64 h ARG 137 CO -0.13 0.75 -0.17 0.00 -1.51 0.00 0.00 179.97 178.91 1s64 h ARG 138 N 1.15 0.81 -0.45 0.20 3.08 -0.04 0.12 114.38 119.25 1s64 h ARG 138 Ca 0.31 -0.30 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1s64 h ARG 138 Cb -0.12 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 1s64 h ARG 138 CO -0.06 0.92 0.29 0.28 -1.07 0.00 0.00 179.97 180.32 1s64 h VAL 139 N 0.72 1.13 -0.61 2.04 2.07 -0.01 -2.39 116.25 119.19 1s64 h VAL 139 Ca 0.11 -0.25 -0.09 0.00 0.82 0.00 0.00 66.70 67.29 1s64 h VAL 139 Cb 0.67 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1s64 h VAL 139 CO 0.05 0.12 0.04 -0.07 0.02 0.00 0.00 177.57 177.73 1s64 h LEU 140 N 0.61 1.02 -1.32 2.57 3.38 -0.65 -0.40 115.31 120.51 1s64 h LEU 140 Ca 0.16 -0.29 0.11 0.00 0.09 0.00 0.00 57.88 57.96 1s64 h LEU 140 Cb -0.05 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.37 1s64 h LEU 140 CO -0.03 1.06 0.54 -0.07 0.09 0.00 0.00 178.44 180.02 1s64 h LEU 141 N 0.95 0.66 0.08 1.67 3.38 -0.37 0.28 115.31 121.96 1s64 h LEU 141 Ca 0.18 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 1s64 h LEU 141 Cb 0.51 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1s64 h LEU 141 CO 0.02 0.37 -0.04 0.03 0.09 0.00 0.00 178.44 178.91 1s64 h ARG 142 N 0.72 -0.11 -0.57 1.13 3.08 -1.05 -1.63 114.38 115.94 1s64 h ARG 142 Ca 0.40 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.57 1s64 h ARG 142 Cb 0.55 0.02 -0.11 0.00 0.08 0.00 0.00 29.97 30.52 1s64 h ARG 142 CO -0.16 0.21 -0.12 0.77 -1.07 0.00 0.00 179.97 179.60 1s64 h SER 143 N -0.99 -0.49 -0.04 7.04 0.02 -0.85 0.39 113.55 118.63 1s64 h SER 143 Ca -0.01 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1s64 h SER 143 Cb 0.37 0.34 0.00 0.00 0.14 0.00 0.00 62.40 63.25 1s64 h SER 143 CO 0.02 -0.18 0.00 0.18 -1.14 0.00 0.00 176.83 175.71 1s64 n LEU 144 N -5.38 0.94 -4.00 5.07 4.77 0.07 -4.94 117.00 113.53 1s64 n LEU 144 Ca 0.06 -0.35 -0.32 0.00 -0.03 0.00 0.00 56.01 55.37 1s64 n LEU 144 Cb 0.31 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.36 1s64 n LEU 144 CO 0.08 0.17 -0.24 0.00 -1.33 0.00 0.00 177.39 176.07 1s64 n GLN 145 N -0.23 -1.70 -1.75 3.23 6.02 0.12 -4.91 117.38 118.17 1s64 n GLN 145 Ca 0.19 0.28 -0.32 0.00 -0.01 0.00 0.00 57.00 57.14 1s64 n GLN 145 Cb 0.24 -3.81 0.04 0.00 1.02 0.00 0.00 30.24 27.73 1s64 n GLN 145 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1s64 s LYS 146 N -6.80 2.98 -0.26 -1.09 -0.14 -0.66 -4.94 119.74 108.84 1s64 s LYS 146 Ca 0.21 1.14 -0.29 0.00 -1.36 0.00 0.00 55.97 55.67 1s64 s LYS 146 Cb -0.09 -1.99 -0.03 0.00 -1.68 0.00 0.00 37.83 34.04 1s64 s LYS 146 CO 0.92 -1.07 1.83 0.34 -0.76 0.00 0.00 175.35 176.61 1s64 s ASP 147 N -3.17 5.98 0.47 2.83 3.68 -1.26 -4.85 116.67 120.34 1s64 s ASP 147 Ca 0.62 1.58 0.26 0.00 2.13 0.00 0.00 52.55 57.14 1s64 s ASP 147 Cb -0.16 -2.53 1.02 0.00 -1.45 0.00 0.00 42.92 39.81 1s64 s ASP 147 CO 0.46 -1.59 1.86 -0.07 0.13 0.00 0.00 175.17 175.96 1s64 h LEU 148 N 13.19 0.00 -1.05 -1.34 3.38 -1.95 -2.57 115.31 124.97 1s64 h LEU 148 Ca -0.36 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.51 1s64 h LEU 148 Cb 1.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 1s64 h LEU 148 CO 1.00 0.17 -0.46 -0.61 0.09 0.00 0.00 178.44 178.63 1s64 h GLN 149 N 0.00 0.00 -0.06 1.13 5.75 -2.00 -1.57 115.11 118.36 1s64 h GLN 149 Ca -0.00 0.00 -0.23 0.00 -0.15 0.00 0.00 58.65 58.27 1s64 h GLN 149 Cb 0.69 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.25 1s64 h GLN 149 CO 0.02 0.46 -0.88 1.49 -2.65 0.00 0.00 178.83 177.28 1s64 h GLU 150 N 0.00 0.59 0.00 1.69 4.57 -1.86 -3.00 114.58 116.57 1s64 h GLU 150 Ca -0.00 -0.55 -0.05 0.00 -1.18 0.00 0.00 59.36 57.57 1s64 h GLU 150 Cb 0.84 0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 29.56 1s64 h GLU 150 CO 0.06 1.17 -0.26 1.49 -1.18 0.00 0.00 179.01 180.30 1s64 h GLU 151 N 0.37 0.00 -0.65 1.92 4.57 -1.26 -2.00 114.58 117.53 1s64 h GLU 151 Ca -0.07 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.03 1s64 h GLU 151 Cb 1.50 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 30.07 1s64 h GLU 151 CO 0.17 0.26 0.11 0.52 -1.18 0.00 0.00 179.01 178.88 1s64 h MET 152 N 0.00 1.07 -0.58 1.92 2.86 -1.16 -0.73 114.93 118.31 1s64 h MET 152 Ca -0.00 -0.28 -0.10 0.00 -2.06 0.00 0.00 59.70 57.26 1s64 h MET 152 Cb 0.46 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.97 1s64 h MET 152 CO 0.03 0.98 -0.04 -0.91 1.06 0.00 0.00 176.91 178.03 1s64 h ASN 153 N 1.00 1.04 0.91 1.22 2.35 -1.30 -0.83 115.58 119.97 1s64 h ASN 153 Ca 0.20 -0.31 -0.04 0.00 -0.55 0.00 0.00 56.30 55.59 1s64 h ASN 153 Cb 0.43 -0.28 0.01 0.00 0.05 0.00 0.00 38.32 38.53 1s64 h ASN 153 CO 0.01 1.11 -0.44 0.22 -1.65 0.00 0.00 177.43 176.68 1s64 h TYR 154 N 0.95 -1.14 0.00 1.19 3.20 -0.99 -2.54 116.97 117.64 1s64 h TYR 154 Ca 0.16 -0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.98 1s64 h TYR 154 Cb 0.60 0.38 -0.00 0.00 1.54 0.00 0.00 36.73 39.24 1s64 h TYR 154 CO 0.04 -0.71 -0.10 0.97 -1.64 0.00 0.00 178.16 176.73 1s64 h ILE 155 N -1.23 1.04 -0.60 1.81 6.09 -1.15 -1.68 117.51 121.78 1s64 h ILE 155 Ca -0.13 -0.34 -0.06 0.00 -1.37 0.00 0.00 64.86 62.97 1s64 h ILE 155 Cb 0.94 1.19 -0.03 0.00 0.47 0.00 0.00 36.82 39.39 1s64 h ILE 155 CO 0.21 0.10 0.15 0.40 -3.07 0.00 0.00 178.15 175.93 1s64 h ILE 156 N 0.00 1.24 -0.08 2.19 2.04 -0.95 -1.17 117.51 120.79 1s64 h ILE 156 Ca -0.00 -0.88 -0.15 0.00 1.00 0.00 0.00 64.86 64.83 1s64 h ILE 156 Cb 0.18 0.62 0.01 0.00 -0.74 0.00 0.00 36.82 36.89 1s64 h ILE 156 CO 0.01 0.33 -0.55 0.00 0.00 0.00 0.00 178.15 177.94 1s64 h ALA 157 N 1.26 0.17 -0.44 1.87 0.00 -0.92 -2.98 119.26 118.22 1s64 h ALA 157 Ca 0.19 -0.53 0.05 0.00 0.00 0.00 0.00 54.91 54.62 1s64 h ALA 157 Cb 0.32 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1s64 h ALA 157 CO -0.00 0.39 0.19 0.82 0.00 0.00 0.00 179.25 180.65 1s64 h ILE 158 N 0.09 0.91 -0.78 0.00 1.08 -1.17 -2.57 117.51 115.07 1s64 h ILE 158 Ca -0.05 -0.13 -0.03 0.00 -0.39 0.00 0.00 64.86 64.26 1s64 h ILE 158 Cb 1.21 0.50 -0.04 0.00 -3.07 0.00 0.00 36.82 35.42 1s64 h ILE 158 CO 0.11 0.07 0.35 0.40 -0.69 0.00 0.00 178.15 178.39 1s64 h ILE 159 N 0.38 1.25 -0.42 -0.67 2.04 -1.28 -0.50 117.51 118.32 1s64 h ILE 159 Ca 0.20 -0.74 0.03 0.00 1.00 0.00 0.00 64.86 65.35 1s64 h ILE 159 Cb 0.16 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.51 1s64 h ILE 159 CO -0.18 0.31 0.28 -0.33 0.00 0.00 0.00 178.15 178.23 1s64 h GLU 160 N 1.11 0.44 0.00 2.37 5.08 -1.30 0.15 114.58 122.42 1s64 h GLU 160 Ca 0.26 -0.03 -0.18 0.00 -1.00 0.00 0.00 59.36 58.41 1s64 h GLU 160 Cb 0.15 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1s64 h GLU 160 CO -0.03 0.29 -0.98 0.93 -1.00 0.00 0.00 179.01 178.22 1s64 h GLU 161 N 0.46 0.00 -2.06 2.33 5.08 -1.11 -3.39 114.58 115.90 1s64 h GLU 161 Ca 0.17 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 58.00 1s64 h GLU 161 Cb 0.11 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 28.95 1s64 h GLU 161 CO -0.04 0.72 -1.05 1.04 -1.00 0.00 0.00 179.01 178.68 1s64 n GLN 162 N -3.23 1.38 0.02 2.33 6.02 -0.26 -4.97 117.38 118.68 1s64 n GLN 162 Ca -0.02 -3.67 0.01 0.00 -0.01 0.00 0.00 57.00 53.31 1s64 n GLN 162 Cb 0.88 -1.72 0.07 0.00 1.02 0.00 0.00 30.24 30.50 1s64 n GLN 162 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1s64 n PRO 163 N 0.50 0.02 -0.21 -1.09 -0.04 0.44 -2.07 135.00 132.54 1s64 n PRO 163 Ca 0.25 0.51 0.06 0.00 -0.04 0.00 0.00 63.50 64.29 1s64 n PRO 163 Cb 0.57 -1.57 0.18 0.00 -0.04 0.00 0.00 33.50 32.64 1s64 n PRO 163 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1s64 n LYS 164 N -1.58 2.87 -3.01 0.54 4.76 -1.26 -4.81 118.16 115.67 1s64 n LYS 164 Ca -0.00 -2.15 -0.41 0.00 -2.87 0.00 0.00 58.31 52.88 1s64 n LYS 164 Cb 0.01 -1.32 -0.05 0.00 -1.84 0.00 0.00 35.03 31.83 1s64 n LYS 164 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1s64 s ASN 165 N -1.02 6.79 0.18 4.39 3.84 -0.88 -4.97 114.94 123.27 1s64 s ASN 165 Ca 0.27 0.97 -0.11 0.00 0.21 0.00 0.00 52.86 54.20 1s64 s ASN 165 Cb 0.14 -2.40 0.09 0.00 -0.55 0.00 0.00 41.25 38.54 1s64 s ASN 165 CO 0.18 -0.36 1.74 1.88 -2.79 0.00 0.00 177.10 177.75 1s64 h TYR 166 N 7.49 0.95 -0.94 0.43 0.05 -1.93 -3.17 116.97 119.85 1s64 h TYR 166 Ca -0.29 -0.07 0.02 0.00 0.05 0.00 0.00 58.73 58.44 1s64 h TYR 166 Cb 1.13 -0.29 -0.05 0.00 1.01 0.00 0.00 36.73 38.53 1s64 h TYR 166 CO 0.72 0.74 0.62 1.96 -1.05 0.00 0.00 178.16 181.16 1s64 h GLN 167 N 0.88 1.21 -0.16 4.88 7.50 -1.93 -1.86 115.11 125.63 1s64 h GLN 167 Ca 0.21 -0.07 -0.12 0.00 0.50 0.00 0.00 58.65 59.17 1s64 h GLN 167 Cb 0.18 -0.27 -0.01 0.00 0.05 0.00 0.00 27.48 27.43 1s64 h GLN 167 CO -0.02 0.80 -0.43 -0.39 -1.50 0.00 0.00 178.83 177.30 1s64 h VAL 168 N 1.25 1.31 -0.12 -0.54 -1.51 -1.83 -0.94 116.25 113.88 1s64 h VAL 168 Ca 0.36 -1.59 -0.17 0.00 -1.23 0.00 0.00 66.70 64.07 1s64 h VAL 168 Cb -0.10 1.66 -0.01 0.00 -2.13 0.00 0.00 31.29 30.71 1s64 h VAL 168 CO -0.09 0.49 -0.64 -0.50 -1.23 0.00 0.00 177.57 175.60 1s64 h TRP 169 N 0.32 0.56 -0.49 5.19 4.06 -1.49 -2.13 115.95 121.97 1s64 h TRP 169 Ca 0.03 -0.22 -0.10 0.00 2.06 0.00 0.00 58.89 60.65 1s64 h TRP 169 Cb 0.89 -0.10 -0.02 0.00 -1.00 0.00 0.00 29.16 28.94 1s64 h TRP 169 CO 0.02 0.95 -0.09 1.25 -3.56 0.00 0.00 178.44 177.01 1s64 h HIS 170 N 0.31 1.03 -0.24 0.49 2.76 -1.15 -2.02 115.15 116.34 1s64 h HIS 170 Ca -0.01 -0.21 0.01 0.00 -2.20 0.00 0.00 60.37 57.95 1s64 h HIS 170 Cb 1.19 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 29.88 1s64 h HIS 170 CO 0.04 0.99 0.15 1.25 -1.30 0.00 0.00 177.93 179.06 1s64 h HIS 171 N 0.77 0.28 -0.81 5.26 6.17 -1.06 -1.44 115.15 124.33 1s64 h HIS 171 Ca 0.13 0.01 -0.01 0.00 0.71 0.00 0.00 60.37 61.20 1s64 h HIS 171 Cb 0.64 -0.09 -0.04 0.00 2.52 0.00 0.00 27.41 30.44 1s64 h HIS 171 CO 0.05 0.17 0.45 -0.09 0.71 0.00 0.00 177.93 179.21 1s64 h ARG 172 N 0.30 1.11 -0.60 5.26 2.43 -1.24 -1.90 114.38 119.74 1s64 h ARG 172 Ca 0.09 -0.12 -0.06 0.00 -0.81 0.00 0.00 59.98 59.08 1s64 h ARG 172 Cb -0.02 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.29 1s64 h ARG 172 CO -0.04 0.81 0.13 -0.09 -1.51 0.00 0.00 179.97 179.28 1s64 h ARG 173 N 1.12 0.97 -0.69 0.20 2.43 -0.89 -1.02 114.38 116.51 1s64 h ARG 173 Ca 0.29 -0.24 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1s64 h ARG 173 Cb 0.01 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.41 1s64 h ARG 173 CO -0.05 0.90 0.39 0.28 -1.51 0.00 0.00 179.97 179.98 1s64 h VAL 174 N 0.88 1.21 -0.32 0.20 2.07 -0.86 -1.40 116.25 118.04 1s64 h VAL 174 Ca 0.19 -0.50 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 1s64 h VAL 174 Cb 0.37 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1s64 h VAL 174 CO 0.00 0.22 0.19 -0.07 0.02 0.00 0.00 177.57 177.94 1s64 h LEU 175 N 0.94 0.38 -1.34 2.57 3.38 -0.96 -0.68 115.31 119.61 1s64 h LEU 175 Ca 0.24 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 1s64 h LEU 175 Cb 0.01 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1s64 h LEU 175 CO -0.04 0.32 0.11 0.58 0.09 0.00 0.00 178.44 179.50 1s64 h VAL 176 N 0.41 1.17 -0.31 1.22 2.07 -0.94 -0.12 116.25 119.75 1s64 h VAL 176 Ca 0.11 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 67.01 1s64 h VAL 176 Cb 0.01 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1s64 h VAL 176 CO -0.02 0.21 0.03 -0.33 0.02 0.00 0.00 177.57 177.48 1s64 h GLU 177 N 0.55 0.53 -0.16 1.57 5.08 -0.73 0.12 114.58 121.53 1s64 h GLU 177 Ca 0.13 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1s64 h GLU 177 Cb 0.19 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1s64 h GLU 177 CO -0.01 0.64 0.10 -1.49 -1.00 0.00 0.00 179.01 177.26 1s64 h TRP 178 N 0.34 0.20 0.00 4.33 6.55 -0.48 -2.87 115.95 124.02 1s64 h TRP 178 Ca 0.09 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.93 1s64 h TRP 178 Cb 0.39 -0.07 0.00 0.00 -0.86 0.00 0.00 29.16 28.62 1s64 h TRP 178 CO 0.03 0.14 0.00 -0.07 -1.05 0.00 0.00 178.44 177.49 1s64 h LEU 179 N 0.20 0.00 2.54 -4.49 3.38 -1.00 -3.46 115.31 112.48 1s64 h LEU 179 Ca 0.06 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.79 1s64 h LEU 179 Cb -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1s64 h LEU 179 CO -0.01 0.00 -0.31 0.29 0.09 0.00 0.00 178.44 178.50 1s64 n LYS 180 N -2.67 -2.27 -4.02 1.13 4.76 0.40 -4.92 118.16 110.57 1s64 n LYS 180 Ca 0.04 0.58 -0.31 0.00 -2.87 0.00 0.00 58.31 55.74 1s64 n LYS 180 Cb 0.41 -5.18 -0.15 0.00 -1.84 0.00 0.00 35.03 28.27 1s64 n LYS 180 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1s64 s ASP 181 N -2.04 4.43 0.00 4.39 3.68 -1.21 -4.97 116.67 120.95 1s64 s ASP 181 Ca 0.01 -1.60 0.22 0.00 2.13 0.00 0.00 52.55 53.30 1s64 s ASP 181 Cb -0.00 -1.48 0.47 0.00 -1.45 0.00 0.00 42.92 40.46 1s64 s ASP 181 CO 0.01 -0.26 1.42 -0.81 0.13 0.00 0.00 175.17 175.65 1s64 n PRO 182 N 4.43 2.54 -0.07 4.34 -0.04 -1.26 -4.64 135.00 140.30 1s64 n PRO 182 Ca -0.08 -2.36 0.25 0.00 -0.04 0.00 0.00 63.50 61.27 1s64 n PRO 182 Cb 0.42 -1.51 0.72 0.00 -0.04 0.00 0.00 33.50 33.09 1s64 n PRO 182 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1s64 h SER 183 N 4.26 0.00 0.45 3.54 4.64 -2.01 -2.03 113.55 122.41 1s64 h SER 183 Ca 0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 1s64 h SER 183 Cb 0.97 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.03 1s64 h SER 183 CO 0.00 0.00 -1.69 0.00 -0.87 0.00 0.00 176.83 174.27 1s64 n GLN 184 N -4.00 0.64 -0.06 4.77 6.02 -1.26 -4.71 117.38 118.78 1s64 n GLN 184 Ca 0.14 0.09 -0.12 0.00 -0.01 0.00 0.00 57.00 57.10 1s64 n GLN 184 Cb 0.86 -1.70 -0.08 0.00 1.02 0.00 0.00 30.24 30.33 1s64 n GLN 184 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1s64 h GLU 185 N 0.00 -0.40 -0.86 -1.09 4.39 -1.69 -2.01 114.58 112.91 1s64 h GLU 185 Ca -0.20 0.03 0.13 0.00 0.34 0.00 0.00 59.36 59.66 1s64 h GLU 185 Cb 1.57 0.09 -0.07 0.00 -0.10 0.00 0.00 28.75 30.25 1s64 h GLU 185 CO 0.03 -0.27 0.56 -0.07 -1.16 0.00 0.00 179.01 178.10 1s64 h LEU 186 N -0.42 0.65 -0.06 1.33 3.38 -1.84 -0.38 115.31 117.97 1s64 h LEU 186 Ca 0.04 0.03 -0.25 0.00 0.09 0.00 0.00 57.88 57.79 1s64 h LEU 186 Cb 0.54 -0.10 0.02 0.00 0.09 0.00 0.00 40.66 41.21 1s64 h LEU 186 CO -0.43 0.35 -0.95 -0.08 0.09 0.00 0.00 178.44 177.42 1s64 h GLU 187 N 0.70 0.73 -0.29 1.13 4.81 -1.84 -2.08 114.58 117.75 1s64 h GLU 187 Ca 0.42 -0.71 -0.01 0.00 -0.13 0.00 0.00 59.36 58.93 1s64 h GLU 187 Cb 0.64 0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 1s64 h GLU 187 CO -0.18 1.30 0.15 0.35 -0.73 0.00 0.00 179.01 179.89 1s64 h PHE 188 N 0.45 0.40 -0.68 0.92 3.57 -0.60 -2.11 116.94 118.88 1s64 h PHE 188 Ca -0.10 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.32 1s64 h PHE 188 Cb 1.59 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 40.18 1s64 h PHE 188 CO 0.10 0.34 0.17 0.82 -2.23 0.00 0.00 178.31 177.51 1s64 h ILE 189 N 0.34 1.26 -0.21 1.41 2.04 -1.14 -2.00 117.51 119.19 1s64 h ILE 189 Ca 0.10 -0.94 -0.00 0.00 1.00 0.00 0.00 64.86 65.02 1s64 h ILE 189 Cb 0.08 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1s64 h ILE 189 CO -0.01 0.36 0.12 0.00 0.00 0.00 0.00 178.15 178.62 1s64 h ALA 190 N 1.16 1.82 -0.18 1.87 0.00 -1.06 0.15 119.26 123.02 1s64 h ALA 190 Ca 0.22 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.98 1s64 h ALA 190 Cb 0.35 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1s64 h ALA 190 CO 0.00 0.16 -0.33 -0.44 0.00 0.00 0.00 179.25 178.64 1s64 h ASP 191 N 0.29 0.61 -0.44 0.00 3.32 -0.70 -1.89 116.42 117.61 1s64 h ASP 191 Ca 0.08 -0.54 -0.04 0.00 0.02 0.00 0.00 57.03 56.55 1s64 h ASP 191 Cb -0.00 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 1s64 h ASP 191 CO -0.01 1.03 0.13 0.40 -1.72 0.00 0.00 179.24 179.07 1s64 h ILE 192 N 0.20 1.22 0.00 0.35 1.08 -0.83 -1.66 117.51 117.88 1s64 h ILE 192 Ca 0.01 -0.75 0.00 0.00 -0.39 0.00 0.00 64.86 63.73 1s64 h ILE 192 Cb 0.92 0.88 0.00 0.00 -3.07 0.00 0.00 36.82 35.55 1s64 h ILE 192 CO 0.07 0.27 0.00 -0.07 -0.69 0.00 0.00 178.15 177.73 1s64 h LEU 193 N 0.57 0.00 -0.26 1.44 3.38 -0.69 -0.56 115.31 119.19 1s64 h LEU 193 Ca 0.14 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 1s64 h LEU 193 Cb 0.28 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1s64 h LEU 193 CO -0.00 0.00 -0.41 -1.13 0.09 0.00 0.00 178.44 176.98 1s64 h ASN 194 N 0.00 0.00 0.67 -0.43 -0.73 -0.44 -1.59 115.58 113.06 1s64 h ASN 194 Ca 0.00 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.17 1s64 h ASN 194 Cb 0.20 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.79 1s64 h ASN 194 CO 0.00 0.41 -1.33 0.00 -0.37 0.00 0.00 177.43 176.15 1s64 n GLN 195 N -3.27 0.62 -3.21 6.67 10.64 -0.28 -4.75 117.38 123.80 1s64 n GLN 195 Ca 0.02 0.02 -0.00 0.00 -1.83 0.00 0.00 57.00 55.20 1s64 n GLN 195 Cb 0.65 -1.73 -0.01 0.00 -0.86 0.00 0.00 30.24 28.29 1s64 n GLN 195 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1s64 s ASP 196 N -5.09 -1.29 0.00 2.61 2.15 -0.80 -5.03 116.67 109.23 1s64 s ASP 196 Ca -0.03 -0.64 0.06 0.00 0.43 0.00 0.00 52.55 52.37 1s64 s ASP 196 Cb 0.11 1.85 0.36 0.00 -0.30 0.00 0.00 42.92 44.94 1s64 s ASP 196 CO 0.83 -0.21 0.94 0.00 -0.17 0.00 0.00 175.17 176.56 1s64 n ALA 197 N 4.63 1.63 -0.21 3.66 0.00 -0.60 -2.31 120.51 127.31 1s64 n ALA 197 Ca 0.10 -0.04 0.01 0.00 0.00 0.00 0.00 53.44 53.51 1s64 n ALA 197 Cb 0.55 -1.10 0.01 0.00 0.00 0.00 0.00 19.45 18.91 1s64 n ALA 197 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1s64 n LYS 198 N -1.12 2.54 -1.57 0.00 5.02 -1.26 -4.82 118.16 116.94 1s64 n LYS 198 Ca 0.04 -1.51 -0.45 0.00 -2.02 0.00 0.00 58.31 54.38 1s64 n LYS 198 Cb 0.03 -1.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.01 1s64 n LYS 198 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1s64 n ASN 199 N -0.54 3.06 -0.24 4.39 2.85 -0.98 -4.83 115.26 118.97 1s64 n ASN 199 Ca 0.02 0.32 0.01 0.00 -0.11 0.00 0.00 54.58 54.81 1s64 n ASN 199 Cb 0.31 -1.48 0.24 0.00 1.24 0.00 0.00 39.78 40.09 1s64 n ASN 199 CO 0.00 0.00 0.00 0.22 -2.11 0.00 0.00 177.26 175.37 1s64 h TYR 200 N 14.00 0.98 -0.57 1.20 3.20 -1.94 -2.44 116.97 131.40 1s64 h TYR 200 Ca -0.39 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.49 1s64 h TYR 200 Cb 1.26 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 39.17 1s64 h TYR 200 CO 0.94 0.60 0.27 0.45 -1.64 0.00 0.00 178.16 178.78 1s64 h HIS 201 N 1.04 0.82 -0.28 -3.82 3.86 -1.88 -1.49 115.15 113.40 1s64 h HIS 201 Ca 0.31 -0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.46 1s64 h HIS 201 Cb -0.05 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.16 1s64 h HIS 201 CO -0.00 0.63 0.12 0.00 0.86 0.00 0.00 177.93 179.55 1s64 h ALA 202 N 1.11 0.36 -0.39 2.45 0.00 -1.76 -1.16 119.26 119.85 1s64 h ALA 202 Ca 0.19 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 1s64 h ALA 202 Cb 0.12 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1s64 h ALA 202 CO -0.02 -0.07 -0.03 -1.49 0.00 0.00 0.00 179.25 177.64 1s64 h TRP 203 N 0.31 0.68 -0.27 0.00 4.06 -1.35 0.24 115.95 119.61 1s64 h TRP 203 Ca 0.09 -0.09 -0.04 0.00 2.06 0.00 0.00 58.89 60.92 1s64 h TRP 203 Cb 0.14 -0.19 -0.01 0.00 -1.00 0.00 0.00 29.16 28.11 1s64 h TRP 203 CO -0.01 0.67 0.02 0.37 -3.56 0.00 0.00 178.44 175.93 1s64 h GLN 204 N 0.60 0.47 -0.70 0.49 4.15 -1.02 -1.09 115.11 118.01 1s64 h GLN 204 Ca 0.12 -0.14 -0.06 0.00 0.77 0.00 0.00 58.65 59.34 1s64 h GLN 204 Cb 0.43 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.04 1s64 h GLN 204 CO 0.02 0.60 0.21 1.25 -1.93 0.00 0.00 178.83 178.98 1s64 h HIS 205 N 0.27 1.15 -0.83 3.99 2.76 -0.95 -1.64 115.15 119.90 1s64 h HIS 205 Ca 0.08 -0.12 -0.03 0.00 -2.20 0.00 0.00 60.37 58.10 1s64 h HIS 205 Cb 0.38 -0.33 -0.04 0.00 1.55 0.00 0.00 27.41 28.97 1s64 h HIS 205 CO 0.03 0.92 0.39 -0.09 -1.30 0.00 0.00 177.93 177.88 1s64 h ARG 206 N 1.04 1.20 -0.21 5.26 2.43 -0.72 -0.86 114.38 122.51 1s64 h ARG 206 Ca 0.23 -0.18 -0.13 0.00 -0.81 0.00 0.00 59.98 59.09 1s64 h ARG 206 Cb 0.32 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 1s64 h ARG 206 CO -0.00 0.93 -0.41 1.96 -1.51 0.00 0.00 179.97 180.93 1s64 h GLN 207 N 1.18 0.48 -0.07 0.20 4.20 -0.89 -1.86 115.11 118.34 1s64 h GLN 207 Ca 0.28 -0.24 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 1s64 h GLN 207 Cb 0.13 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.91 1s64 h GLN 207 CO -0.03 0.81 0.01 2.35 -0.67 0.00 0.00 178.83 181.30 1s64 h TRP 208 N 0.40 0.13 0.21 2.96 7.01 -0.81 -1.66 115.95 124.19 1s64 h TRP 208 Ca 0.03 -0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.01 1s64 h TRP 208 Cb 0.89 -0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.91 1s64 h TRP 208 CO 0.03 0.33 -0.15 0.28 -2.79 0.00 0.00 178.44 176.14 1s64 h VAL 209 N -0.11 0.69 -0.65 2.65 2.07 -1.10 0.11 116.25 119.90 1s64 h VAL 209 Ca 0.02 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.63 1s64 h VAL 209 Cb 0.27 0.69 -0.07 0.00 -1.52 0.00 0.00 31.29 30.66 1s64 h VAL 209 CO 0.00 0.00 0.30 0.40 0.02 0.00 0.00 177.57 178.29 1s64 h ILE 210 N -0.36 0.85 -0.07 4.57 2.04 -1.33 -1.05 117.51 122.15 1s64 h ILE 210 Ca -0.02 -0.18 -0.02 0.00 1.00 0.00 0.00 64.86 65.64 1s64 h ILE 210 Cb 0.31 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 36.66 1s64 h ILE 210 CO 0.01 0.10 -0.05 -0.61 0.00 0.00 0.00 178.15 177.59 1s64 h GLN 211 N 0.53 0.16 -0.23 2.37 5.75 -1.11 -0.42 115.11 122.15 1s64 h GLN 211 Ca 0.31 -0.08 -0.05 0.00 -0.15 0.00 0.00 58.65 58.69 1s64 h GLN 211 Cb 0.33 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.86 1s64 h GLN 211 CO -0.26 0.57 -0.07 1.49 -2.65 0.00 0.00 178.83 177.91 1s64 h GLU 212 N -0.25 0.36 -0.11 1.69 4.57 -0.56 -3.13 114.58 117.16 1s64 h GLU 212 Ca 0.01 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1s64 h GLU 212 Cb 0.54 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.07 1s64 h GLU 212 CO 0.01 0.45 0.00 1.19 -1.18 0.00 0.00 179.01 179.49 1s64 n PHE 213 N -4.28 0.28 -3.81 0.92 3.01 -0.42 -5.02 117.46 108.14 1s64 n PHE 213 Ca 0.00 -0.76 -0.37 0.00 1.01 0.00 0.00 57.45 57.34 1s64 n PHE 213 Cb 0.26 -0.14 0.04 0.00 -0.01 0.00 0.00 39.48 39.63 1s64 n PHE 213 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 1s64 n ARG 214 N -0.66 -0.88 -2.45 -1.08 0.63 -0.32 -4.91 116.66 106.99 1s64 n ARG 214 Ca 0.12 0.33 -0.35 0.00 -0.92 0.00 0.00 57.85 57.03 1s64 n ARG 214 Cb 0.55 -3.56 0.01 0.00 0.45 0.00 0.00 32.46 29.91 1s64 n ARG 214 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1s64 n LEU 215 N -4.47 6.33 0.09 6.15 4.77 -0.33 -4.75 117.00 124.81 1s64 n LEU 215 Ca -0.10 -5.25 -0.02 0.00 -0.03 0.00 0.00 56.01 50.61 1s64 n LEU 215 Cb 0.58 -0.88 -0.05 0.00 -2.33 0.00 0.00 43.42 40.74 1s64 n LEU 215 CO 0.70 2.06 0.25 -0.50 -1.33 0.00 0.00 177.39 178.57 1s64 h TRP 216 N 3.28 0.00 -0.72 -1.77 4.06 -1.91 -3.41 115.95 115.48 1s64 h TRP 216 Ca 0.42 0.00 0.23 0.00 2.06 0.00 0.00 58.89 61.60 1s64 h TRP 216 Cb 0.38 0.00 -0.13 0.00 -1.00 0.00 0.00 29.16 28.41 1s64 h TRP 216 CO 1.09 0.73 0.14 -0.25 -3.56 0.00 0.00 178.44 176.59 1s64 n ASP 217 N -3.25 0.03 -0.23 -3.49 8.00 -1.26 -2.23 116.55 114.12 1s64 n ASP 217 Ca -0.00 1.22 0.02 0.00 0.71 0.00 0.00 54.79 56.74 1s64 n ASP 217 Cb 0.84 -0.49 0.04 0.00 -0.02 0.00 0.00 41.12 41.48 1s64 n ASP 217 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1s64 n ASN 218 N -4.88 1.78 -0.21 -2.24 4.13 -1.26 -4.74 115.26 107.84 1s64 n ASN 218 Ca 0.20 -1.50 -0.08 0.00 1.68 0.00 0.00 54.58 54.89 1s64 n ASN 218 Cb 0.68 -0.04 0.03 0.00 -1.54 0.00 0.00 39.78 38.91 1s64 n ASN 218 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 1s64 h GLU 219 N 0.93 0.93 0.00 3.52 4.57 -1.69 -2.11 114.58 120.74 1s64 h GLU 219 Ca 0.00 -0.20 -0.00 0.00 -1.18 0.00 0.00 59.36 57.98 1s64 h GLU 219 Cb 0.35 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 28.80 1s64 h GLU 219 CO 0.00 0.83 -0.02 1.25 -1.18 0.00 0.00 179.01 179.89 1s64 h LEU 220 N 0.86 0.00 -0.13 1.64 5.85 -1.85 0.15 115.31 121.82 1s64 h LEU 220 Ca 0.19 0.00 -0.24 0.00 0.84 0.00 0.00 57.88 58.68 1s64 h LEU 220 Cb 0.28 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.32 1s64 h LEU 220 CO -0.01 0.02 -0.98 -0.61 -0.34 0.00 0.00 178.44 176.53 1s64 h GLN 221 N 0.00 0.45 -0.60 1.25 4.15 -1.81 -2.02 115.11 116.54 1s64 h GLN 221 Ca -0.00 -0.50 -0.06 0.00 0.77 0.00 0.00 58.65 58.86 1s64 h GLN 221 Cb 0.04 0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.85 1s64 h GLN 221 CO 0.00 1.15 0.13 -0.92 -1.93 0.00 0.00 178.83 177.26 1s64 h TYR 222 N 0.25 1.01 -0.41 3.99 3.20 -0.42 -1.61 116.97 122.98 1s64 h TYR 222 Ca -0.09 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 61.64 1s64 h TYR 222 Cb 1.62 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 39.59 1s64 h TYR 222 CO 0.07 0.86 0.22 0.28 -1.64 0.00 0.00 178.16 177.95 1s64 h VAL 223 N 0.87 1.16 -0.99 1.81 2.07 -0.75 -1.62 116.25 118.79 1s64 h VAL 223 Ca 0.19 -0.42 0.03 0.00 0.82 0.00 0.00 66.70 67.32 1s64 h VAL 223 Cb 0.37 0.69 -0.06 0.00 -1.52 0.00 0.00 31.29 30.78 1s64 h VAL 223 CO 0.00 0.17 0.65 0.44 0.02 0.00 0.00 177.57 178.85 1s64 h ASP 224 N 0.52 1.09 -0.33 0.57 3.32 -1.08 -0.59 116.42 119.92 1s64 h ASP 224 Ca 0.14 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.14 1s64 h ASP 224 Cb 0.07 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1s64 h ASP 224 CO -0.02 0.75 0.06 1.56 -1.72 0.00 0.00 179.24 179.87 1s64 h GLN 225 N 1.26 0.54 0.00 3.56 1.08 -0.88 -2.88 115.11 117.79 1s64 h GLN 225 Ca 0.39 -0.14 -0.11 0.00 -1.45 0.00 0.00 58.65 57.34 1s64 h GLN 225 Cb -0.02 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.33 1s64 h GLN 225 CO -0.12 0.62 -0.54 -0.07 -0.95 0.00 0.00 178.83 177.77 1s64 h LEU 226 N 0.37 0.00 -1.19 1.46 3.38 -0.90 -2.70 115.31 115.74 1s64 h LEU 226 Ca 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1s64 h LEU 226 Cb 0.33 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1s64 h LEU 226 CO 0.00 0.54 -0.08 -0.07 0.09 0.00 0.00 178.44 178.92 1s64 h LEU 227 N 0.00 0.00 0.01 1.67 3.38 -1.04 -1.82 115.31 117.51 1s64 h LEU 227 Ca -0.01 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.70 1s64 h LEU 227 Cb 0.97 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.73 1s64 h LEU 227 CO 0.07 0.08 -1.14 0.11 0.09 0.00 0.00 178.44 177.66 1s64 h LYS 228 N 0.00 0.43 -0.19 1.13 1.57 -1.27 -2.15 116.57 116.09 1s64 h LYS 228 Ca -0.00 -0.57 -0.11 0.00 -1.87 0.00 0.00 60.65 58.10 1s64 h LYS 228 Cb 0.65 0.19 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 1s64 h LYS 228 CO 0.01 1.23 -0.35 0.93 -0.57 0.00 0.00 179.45 180.69 1s64 h GLU 229 N 0.19 0.41 -0.81 3.15 5.08 -1.21 -3.41 114.58 117.97 1s64 h GLU 229 Ca -0.13 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1s64 h GLU 229 Cb 1.81 -0.01 -0.19 0.00 0.50 0.00 0.00 28.75 30.86 1s64 h GLU 229 CO 0.20 0.71 -0.36 0.34 -1.00 0.00 0.00 179.01 178.90 1s64 s ASP 230 N -6.85 -1.26 0.00 1.42 2.15 -0.72 -5.01 116.67 106.40 1s64 s ASP 230 Ca -0.06 -0.54 0.04 0.00 0.43 0.00 0.00 52.55 52.42 1s64 s ASP 230 Cb 0.13 1.62 0.18 0.00 -0.30 0.00 0.00 42.92 44.55 1s64 s ASP 230 CO 0.79 -0.15 1.07 0.55 -0.17 0.00 0.00 175.17 177.26 1s64 n VAL 231 N 4.37 1.51 1.20 1.11 3.14 -0.81 -1.60 118.33 127.25 1s64 n VAL 231 Ca 0.09 0.38 0.13 0.00 -2.96 0.00 0.00 64.34 61.98 1s64 n VAL 231 Cb 0.58 -1.31 0.26 0.00 -1.06 0.00 0.00 33.84 32.31 1s64 n VAL 231 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1s64 n ARG 232 N -1.44 1.37 -2.00 1.45 1.74 -1.26 -4.76 116.66 111.76 1s64 n ARG 232 Ca 0.01 -0.98 -0.40 0.00 -0.77 0.00 0.00 57.85 55.72 1s64 n ARG 232 Cb 0.04 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 29.97 1s64 n ARG 232 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1s64 s ASN 233 N -2.30 5.44 0.50 0.55 3.84 -0.63 -4.83 114.94 117.51 1s64 s ASN 233 Ca 0.26 0.70 0.14 0.00 0.21 0.00 0.00 52.86 54.18 1s64 s ASN 233 Cb 0.19 -2.53 1.19 0.00 -0.55 0.00 0.00 41.25 39.56 1s64 s ASN 233 CO 0.46 -2.18 2.13 -1.13 -2.79 0.00 0.00 177.10 173.59 1s64 h ASN 234 N 14.50 0.08 -0.59 -4.21 -1.24 -1.90 -2.28 115.58 119.95 1s64 h ASN 234 Ca -0.28 -0.00 -0.05 0.00 0.71 0.00 0.00 56.30 56.67 1s64 h ASN 234 Cb 1.17 -0.02 -0.03 0.00 0.73 0.00 0.00 38.32 40.17 1s64 h ASN 234 CO 1.15 0.06 0.17 0.28 -1.29 0.00 0.00 177.43 177.81 1s64 h SER 235 N 0.10 0.89 -0.22 1.15 0.02 -1.89 -2.16 113.55 111.45 1s64 h SER 235 Ca 0.03 -0.16 -0.17 0.00 -0.84 0.00 0.00 61.79 60.64 1s64 h SER 235 Cb -0.01 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.30 1s64 h SER 235 CO -0.01 0.85 -0.52 0.58 -1.14 0.00 0.00 176.83 176.60 1s64 h VAL 236 N 0.92 1.28 -0.45 2.27 2.07 -1.73 -1.57 116.25 119.05 1s64 h VAL 236 Ca 0.20 -1.71 -0.05 0.00 0.82 0.00 0.00 66.70 65.96 1s64 h VAL 236 Cb 0.30 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 1s64 h VAL 236 CO -0.00 0.55 0.06 -0.50 0.02 0.00 0.00 177.57 177.69 1s64 h TRP 237 N 0.62 0.72 -0.58 1.57 4.06 -1.39 -0.24 115.95 120.71 1s64 h TRP 237 Ca 0.02 -0.07 -0.08 0.00 2.06 0.00 0.00 58.89 60.82 1s64 h TRP 237 Cb 1.10 -0.21 -0.02 0.00 -1.00 0.00 0.00 29.16 29.03 1s64 h TRP 237 CO 0.06 0.65 0.06 -0.97 -3.56 0.00 0.00 178.44 174.68 1s64 h ASN 238 N 0.67 0.95 -0.84 -3.49 -1.24 -1.16 -2.56 115.58 107.90 1s64 h ASN 238 Ca 0.14 -0.28 -0.03 0.00 0.71 0.00 0.00 56.30 56.84 1s64 h ASN 238 Cb 0.33 -0.25 -0.04 0.00 0.73 0.00 0.00 38.32 39.09 1s64 h ASN 238 CO 0.01 0.99 0.40 -0.61 -1.29 0.00 0.00 177.43 176.93 1s64 h GLN 239 N 0.88 1.22 -0.44 6.67 5.75 -0.49 -1.16 115.11 127.55 1s64 h GLN 239 Ca 0.17 -0.18 0.04 0.00 -0.15 0.00 0.00 58.65 58.53 1s64 h GLN 239 Cb 0.47 -0.22 -0.04 0.00 1.07 0.00 0.00 27.48 28.76 1s64 h GLN 239 CO 0.02 0.94 0.21 -0.09 -2.65 0.00 0.00 178.83 177.26 1s64 h ARG 240 N 1.20 0.42 -0.10 1.69 2.43 -0.76 0.39 114.38 119.65 1s64 h ARG 240 Ca 0.29 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.35 1s64 h ARG 240 Cb 0.13 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1s64 h ARG 240 CO -0.04 0.28 -0.32 1.25 -1.51 0.00 0.00 179.97 179.63 1s64 h HIS 241 N 0.43 0.21 0.02 2.20 2.76 -1.08 -2.20 115.15 117.49 1s64 h HIS 241 Ca 0.19 -0.04 -0.00 0.00 -2.20 0.00 0.00 60.37 58.31 1s64 h HIS 241 Cb 0.10 -0.05 0.00 0.00 1.55 0.00 0.00 27.41 29.01 1s64 h HIS 241 CO -0.10 0.49 -0.01 0.35 -1.30 0.00 0.00 177.93 177.35 1s64 h PHE 242 N 0.17 -0.02 0.60 5.26 3.57 -0.10 -1.22 116.94 125.19 1s64 h PHE 242 Ca 0.02 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 1s64 h PHE 242 Cb 0.65 0.01 0.01 0.00 2.79 0.00 0.00 35.95 39.40 1s64 h PHE 242 CO 0.01 0.16 -0.29 0.28 -2.23 0.00 0.00 178.31 176.25 1s64 h VAL 243 N -0.21 0.40 -0.01 1.41 2.07 -0.85 -2.83 116.25 116.23 1s64 h VAL 243 Ca -0.00 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1s64 h VAL 243 Cb 0.20 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.40 1s64 h VAL 243 CO 0.00 0.01 -0.01 0.40 0.02 0.00 0.00 177.57 178.00 1s64 h ILE 244 N -0.86 0.98 0.00 4.57 2.04 -1.45 -1.93 117.51 120.85 1s64 h ILE 244 Ca -0.08 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.78 1s64 h ILE 244 Cb 0.64 0.98 0.00 0.00 -0.74 0.00 0.00 36.82 37.69 1s64 h ILE 244 CO 0.13 0.00 0.00 -1.54 0.00 0.00 0.00 178.15 176.74 1s64 n SER 245 N -5.10 0.47 -0.58 1.72 3.41 -0.46 -0.45 113.62 112.63 1s64 n SER 245 Ca -0.07 0.64 0.10 0.00 -0.26 0.00 0.00 58.87 59.29 1s64 n SER 245 Cb 0.04 -0.73 0.03 0.00 -0.26 0.00 0.00 64.21 63.29 1s64 n SER 245 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1s64 n ASN 246 N -2.05 2.17 0.00 4.04 3.02 -0.95 -4.43 115.26 117.06 1s64 n ASN 246 Ca 0.01 -1.59 0.00 0.00 -0.03 0.00 0.00 54.58 52.98 1s64 n ASN 246 Cb 0.16 0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.63 1s64 n ASN 246 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1s64 n THR 247 N 0.38 0.00 0.05 3.41 -2.24 -0.76 -4.93 114.28 110.19 1s64 n THR 247 Ca 0.10 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.79 1s64 n THR 247 Cb 0.45 -0.06 0.07 0.00 -2.10 0.00 0.00 70.33 68.69 1s64 n THR 247 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1s64 h THR 248 N 0.00 1.37 0.00 4.28 1.35 -1.78 -3.50 112.91 114.63 1s64 h THR 248 Ca 0.00 -1.99 0.00 0.00 -0.55 0.00 0.00 66.41 63.87 1s64 h THR 248 Cb 0.00 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.40 1s64 h THR 248 CO 0.00 0.60 0.00 0.61 -0.25 0.00 0.00 175.52 176.48 1s64 n GLY 249 N 0.37 -0.72 0.45 5.82 0.00 0.40 -4.69 105.19 106.83 1s64 n GLY 249 Ca -0.03 -1.73 0.05 0.00 0.00 0.00 0.00 46.02 44.31 1s64 n GLY 249 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1s64 n TYR 250 N -0.69 0.05 0.32 1.61 4.02 -1.26 -4.53 117.16 116.69 1s64 n TYR 250 Ca 0.00 -0.06 0.15 0.00 -0.01 0.00 0.00 57.90 57.98 1s64 n TYR 250 Cb 0.00 -0.00 0.65 0.00 -0.02 0.00 0.00 39.34 39.96 1s64 n TYR 250 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1s64 h SER 251 N 2.07 0.00 -3.30 7.72 4.64 -2.00 -3.39 113.55 119.29 1s64 h SER 251 Ca 0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 1s64 h SER 251 Cb 0.48 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.49 1s64 h SER 251 CO 0.00 0.00 0.95 -0.62 -0.87 0.00 0.00 176.83 176.29 1s64 s ASP 252 N -4.99 6.48 0.54 4.97 3.68 -1.26 -4.90 116.67 121.19 1s64 s ASP 252 Ca 0.02 0.16 0.35 0.00 2.13 0.00 0.00 52.55 55.21 1s64 s ASP 252 Cb 0.09 -2.55 1.52 0.00 -1.45 0.00 0.00 42.92 40.54 1s64 s ASP 252 CO 0.45 -1.42 1.82 0.03 0.13 0.00 0.00 175.17 176.17 1s64 h ARG 253 N 9.47 0.02 -0.19 4.34 3.08 -1.98 0.39 114.38 129.51 1s64 h ARG 253 Ca -0.25 -0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.66 1s64 h ARG 253 Cb 1.06 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.10 1s64 h ARG 253 CO 1.17 0.01 -0.50 0.00 -1.07 0.00 0.00 179.97 179.58 1s64 h ALA 254 N 1.44 0.78 -0.05 0.04 0.00 -1.93 -1.41 119.26 118.13 1s64 h ALA 254 Ca 0.55 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1s64 h ALA 254 Cb 2.16 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.86 1s64 h ALA 254 CO -0.02 0.67 -0.15 0.28 0.00 0.00 0.00 179.25 180.03 1s64 h VAL 255 N 0.40 1.44 -0.58 0.00 2.07 -0.62 -1.97 116.25 116.99 1s64 h VAL 255 Ca 0.02 -1.53 0.07 0.00 0.82 0.00 0.00 66.70 66.08 1s64 h VAL 255 Cb 1.02 2.31 -0.06 0.00 -1.52 0.00 0.00 31.29 33.04 1s64 h VAL 255 CO 0.09 0.42 0.26 0.25 0.02 0.00 0.00 177.57 178.61 1s64 h LEU 256 N -0.33 0.33 -0.44 2.57 5.85 -1.22 -0.08 115.31 121.98 1s64 h LEU 256 Ca -0.00 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 1s64 h LEU 256 Cb 0.76 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 1s64 h LEU 256 CO 0.03 0.21 0.20 -0.08 -0.34 0.00 0.00 178.44 178.46 1s64 h GLU 257 N 0.48 0.65 -0.65 1.25 4.81 -1.27 0.24 114.58 120.08 1s64 h GLU 257 Ca 0.28 -0.11 0.03 0.00 -0.13 0.00 0.00 59.36 59.43 1s64 h GLU 257 Cb 0.26 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 1s64 h GLU 257 CO -0.23 0.57 0.40 -0.09 -0.73 0.00 0.00 179.01 178.93 1s64 h ARG 258 N 0.57 0.77 -0.16 1.92 2.43 -0.56 -0.67 114.38 118.69 1s64 h ARG 258 Ca 0.15 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.22 1s64 h ARG 258 Cb 0.15 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1s64 h ARG 258 CO -0.02 0.51 -0.10 0.93 -1.51 0.00 0.00 179.97 179.78 1s64 h GLU 259 N 0.79 0.35 -0.95 0.20 4.39 -0.72 -0.10 114.58 118.55 1s64 h GLU 259 Ca 0.26 -0.16 0.01 0.00 0.34 0.00 0.00 59.36 59.80 1s64 h GLU 259 Cb 0.02 -0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.61 1s64 h GLU 259 CO -0.10 0.69 0.62 0.28 -1.16 0.00 0.00 179.01 179.33 1s64 h VAL 260 N 0.02 1.25 -0.26 3.13 2.07 -0.83 -0.34 116.25 121.28 1s64 h VAL 260 Ca 0.03 -0.48 -0.03 0.00 0.82 0.00 0.00 66.70 67.04 1s64 h VAL 260 Cb 0.60 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 1s64 h VAL 260 CO 0.03 0.25 0.04 -0.61 0.02 0.00 0.00 177.57 177.30 1s64 h GLN 261 N 1.30 0.43 -0.56 1.57 5.75 -1.04 -1.83 115.11 120.74 1s64 h GLN 261 Ca 0.35 -0.12 0.04 0.00 -0.15 0.00 0.00 58.65 58.77 1s64 h GLN 261 Cb -0.12 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.33 1s64 h GLN 261 CO -0.07 0.55 0.31 -0.92 -2.65 0.00 0.00 178.83 176.05 1s64 h TYR 262 N 0.25 0.57 -0.23 3.99 3.20 -0.54 -1.85 116.97 122.35 1s64 h TYR 262 Ca 0.08 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.94 1s64 h TYR 262 Cb 0.33 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.42 1s64 h TYR 262 CO 0.02 0.29 0.04 1.15 -1.64 0.00 0.00 178.16 178.02 1s64 h THR 263 N 0.59 1.22 -0.63 1.81 2.02 -0.96 -2.05 112.91 114.92 1s64 h THR 263 Ca 0.24 -0.74 0.07 0.00 0.77 0.00 0.00 66.41 66.74 1s64 h THR 263 Cb 0.11 1.27 -0.04 0.00 -1.74 0.00 0.00 68.15 67.75 1s64 h THR 263 CO -0.14 0.24 0.42 -0.07 0.37 0.00 0.00 175.52 176.33 1s64 h LEU 264 N 0.19 0.54 -0.52 2.58 3.38 -1.10 0.29 115.31 120.67 1s64 h LEU 264 Ca 0.07 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 1s64 h LEU 264 Cb 0.31 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1s64 h LEU 264 CO 0.00 0.35 0.01 -0.33 0.09 0.00 0.00 178.44 178.56 1s64 h GLU 265 N 0.61 0.92 -0.39 1.13 4.39 -1.00 -0.42 114.58 119.82 1s64 h GLU 265 Ca 0.28 -0.29 -0.12 0.00 0.34 0.00 0.00 59.36 59.57 1s64 h GLU 265 Cb 0.30 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 1s64 h GLU 265 CO -0.08 0.94 -0.23 0.52 -1.16 0.00 0.00 179.01 178.99 1s64 h MET 266 N 0.79 0.79 -0.68 2.33 2.86 -0.36 -2.55 114.93 118.10 1s64 h MET 266 Ca 0.15 -0.32 -0.08 0.00 -2.06 0.00 0.00 59.70 57.39 1s64 h MET 266 Cb 0.52 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.11 1s64 h MET 266 CO 0.03 0.94 0.12 0.82 1.06 0.00 0.00 176.91 179.88 1s64 h ILE 267 N 0.68 1.26 -0.36 -1.22 2.04 -0.25 -2.00 117.51 117.66 1s64 h ILE 267 Ca 0.09 -1.02 -0.03 0.00 1.00 0.00 0.00 64.86 64.90 1s64 h ILE 267 Cb 0.74 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 1s64 h ILE 267 CO 0.06 0.39 0.09 0.11 0.00 0.00 0.00 178.15 178.80 1s64 h LYS 268 N 1.04 0.53 -0.18 2.37 1.57 -0.85 0.19 116.57 121.24 1s64 h LYS 268 Ca 0.21 -0.08 -0.18 0.00 -1.87 0.00 0.00 60.65 58.73 1s64 h LYS 268 Cb 0.43 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 1s64 h LYS 268 CO 0.01 0.49 -0.61 -0.07 -0.57 0.00 0.00 179.45 178.70 1s64 h LEU 269 N 0.52 0.70 -6.14 2.94 4.07 -1.04 -3.39 115.31 112.98 1s64 h LEU 269 Ca 0.12 -0.40 -0.47 0.00 0.08 0.00 0.00 57.88 57.21 1s64 h LEU 269 Cb 0.19 -0.20 -0.33 0.00 1.08 0.00 0.00 40.66 41.40 1s64 h LEU 269 CO -0.00 1.14 -0.83 -0.69 -1.08 0.00 0.00 178.44 176.98 1s64 s VAL 270 N -3.93 -0.03 0.52 1.22 1.01 -0.80 -5.02 120.40 113.37 1s64 s VAL 270 Ca -0.08 -1.99 0.24 0.00 0.00 0.00 0.00 61.98 60.15 1s64 s VAL 270 Cb 0.11 -0.92 0.39 0.00 0.00 0.00 0.00 36.38 35.95 1s64 s VAL 270 CO 0.86 -0.89 2.00 1.55 0.00 0.00 0.00 175.10 178.62 1s64 h PRO 271 N 5.89 0.02 -3.68 2.72 0.13 -0.85 -3.29 132.00 132.94 1s64 h PRO 271 Ca 0.18 -0.00 -0.78 0.00 -0.87 0.00 0.00 66.00 64.52 1s64 h PRO 271 Cb 0.98 -0.01 -0.24 0.00 0.13 0.00 0.00 31.00 31.86 1s64 h PRO 271 CO 0.27 0.02 0.96 1.58 -0.23 0.00 0.00 178.00 180.59 1s64 n HIS 272 N -4.40 4.19 -3.45 1.56 -0.00 -1.26 -4.88 115.22 106.99 1s64 n HIS 272 Ca 0.09 -3.32 -0.22 0.00 0.46 0.00 0.00 57.72 54.73 1s64 n HIS 272 Cb 0.56 -1.75 -0.12 0.00 -0.12 0.00 0.00 29.99 28.57 1s64 n HIS 272 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1s64 s ASN 273 N 0.88 2.40 0.30 0.26 2.47 -1.24 -5.03 114.94 114.98 1s64 s ASN 273 Ca 0.35 -1.01 0.03 0.00 0.42 0.00 0.00 52.86 52.64 1s64 s ASN 273 Cb -0.02 0.16 0.60 0.00 -1.45 0.00 0.00 41.25 40.54 1s64 s ASN 273 CO -0.01 -0.40 1.85 -0.08 -3.72 0.00 0.00 177.10 174.75 1s64 h GLU 274 N 8.26 0.92 -0.29 0.43 4.81 -1.94 -2.69 114.58 124.08 1s64 h GLU 274 Ca -0.15 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.06 1s64 h GLU 274 Cb 1.05 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 30.19 1s64 h GLU 274 CO 0.37 0.61 0.09 0.77 -0.73 0.00 0.00 179.01 180.12 1s64 h SER 275 N 0.95 0.08 -0.34 1.04 0.02 -1.92 0.21 113.55 113.59 1s64 h SER 275 Ca 0.47 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.45 1s64 h SER 275 Cb 0.48 0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 1s64 h SER 275 CO -0.23 0.08 0.19 0.00 -1.14 0.00 0.00 176.83 175.72 1s64 h ALA 276 N 1.20 0.44 -0.53 3.77 0.00 -1.78 -1.73 119.26 120.62 1s64 h ALA 276 Ca 0.13 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1s64 h ALA 276 Cb 0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1s64 h ALA 276 CO -0.15 -0.04 0.10 -1.49 0.00 0.00 0.00 179.25 177.67 1s64 h TRP 277 N 0.43 0.87 -0.33 0.00 4.06 -1.28 -1.63 115.95 118.07 1s64 h TRP 277 Ca 0.12 -0.09 -0.08 0.00 2.06 0.00 0.00 58.89 60.89 1s64 h TRP 277 Cb 0.06 -0.25 -0.02 0.00 -1.00 0.00 0.00 29.16 27.96 1s64 h TRP 277 CO -0.03 0.75 -0.14 -0.91 -3.56 0.00 0.00 178.44 174.55 1s64 h ASN 278 N 0.80 0.57 0.12 -3.49 2.35 -0.28 -1.19 115.58 114.45 1s64 h ASN 278 Ca 0.17 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 1s64 h ASN 278 Cb 0.34 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1s64 h ASN 278 CO 0.00 0.74 -0.06 0.22 -1.65 0.00 0.00 177.43 176.68 1s64 h TYR 279 N 0.53 -0.15 -0.33 1.19 3.20 -0.89 0.26 116.97 120.79 1s64 h TYR 279 Ca 0.09 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.02 1s64 h TYR 279 Cb 0.55 0.05 -0.06 0.00 1.54 0.00 0.00 36.73 38.81 1s64 h TYR 279 CO 0.02 0.16 -0.06 1.25 -1.64 0.00 0.00 178.16 177.89 1s64 h LEU 280 N -0.46 -0.27 -0.79 2.82 5.85 -1.15 -0.62 115.31 120.69 1s64 h LEU 280 Ca -0.02 0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.69 1s64 h LEU 280 Cb 0.38 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 1s64 h LEU 280 CO 0.03 -0.09 -0.28 0.50 -0.34 0.00 0.00 178.44 178.26 1s64 h LYS 281 N 0.02 0.60 -0.63 1.25 3.64 -1.19 -3.14 116.57 117.12 1s64 h LYS 281 Ca 0.16 -0.25 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1s64 h LYS 281 Cb 0.24 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 1s64 h LYS 281 CO -0.33 0.82 0.40 0.78 -2.27 0.00 0.00 179.45 178.86 1s64 h GLY 282 N 1.01 0.90 1.33 5.01 0.00 0.72 0.19 103.07 112.24 1s64 h GLY 282 Ca 0.07 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1s64 h GLY 282 CO 0.06 0.34 -0.02 0.29 0.00 0.00 0.00 176.54 177.21 1s64 n ILE 283 N -4.62 0.00 -0.01 2.60 -5.35 -0.36 -3.98 119.36 107.64 1s64 n ILE 283 Ca 0.05 -0.01 -0.01 0.00 -0.27 0.00 0.00 62.75 62.51 1s64 n ILE 283 Cb 0.03 -0.41 -0.02 0.00 -1.74 0.00 0.00 39.64 37.51 1s64 n ILE 283 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1s64 n LEU 284 N -1.16 0.00 -0.29 7.28 4.77 -1.00 -4.78 117.00 121.82 1s64 n LEU 284 Ca 0.16 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.30 1s64 n LEU 284 Cb 0.23 0.04 0.42 0.00 -2.33 0.00 0.00 43.42 41.79 1s64 n LEU 284 CO 0.22 0.04 1.22 0.06 -1.33 0.00 0.00 177.39 177.60 1s64 h GLN 285 N 0.00 0.56 0.00 3.23 3.07 -0.76 -1.06 115.11 120.16 1s64 h GLN 285 Ca -0.05 -0.03 -0.04 0.00 0.09 0.00 0.00 58.65 58.62 1s64 h GLN 285 Cb 0.87 -0.13 -0.01 0.00 0.08 0.00 0.00 27.48 28.30 1s64 h GLN 285 CO 0.00 0.37 -0.26 -0.44 0.09 0.00 0.00 178.83 178.60 1s64 h ASP 286 N 0.58 0.00 1.31 0.06 3.45 -1.84 -3.08 116.42 116.90 1s64 h ASP 286 Ca 0.51 0.00 -0.13 0.00 0.43 0.00 0.00 57.03 57.84 1s64 h ASP 286 Cb 1.02 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.77 1s64 h ASP 286 CO -0.25 0.18 -0.60 0.03 -1.57 0.00 0.00 179.24 177.02 1s64 h ARG 287 N 0.00 0.00 0.00 3.56 2.47 -1.53 -3.49 114.38 115.39 1s64 h ARG 287 Ca -0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 1s64 h ARG 287 Cb 1.14 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.46 1s64 h ARG 287 CO 0.02 0.60 0.00 0.41 0.56 0.00 0.00 179.97 181.57 1s64 n GLY 288 N 1.15 1.55 0.36 0.04 0.00 -0.69 -4.85 105.19 102.74 1s64 n GLY 288 Ca 0.01 -0.84 0.13 0.00 0.00 0.00 0.00 46.02 45.32 1s64 n GLY 288 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1s64 h LEU 289 N 0.00 0.34 0.00 0.99 3.38 -1.76 -1.56 115.31 116.70 1s64 h LEU 289 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1s64 h LEU 289 Cb 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1s64 h LEU 289 CO 0.00 0.20 0.00 -1.54 0.09 0.00 0.00 178.44 177.19 1s64 n SER 290 N -4.47 0.00 -0.14 -0.43 3.41 -1.26 -2.96 113.62 107.77 1s64 n SER 290 Ca 0.10 0.38 0.15 0.00 -0.26 0.00 0.00 58.87 59.24 1s64 n SER 290 Cb 0.40 -0.44 0.83 0.00 -0.26 0.00 0.00 64.21 64.74 1s64 n SER 290 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1s64 n ARG 291 N -1.44 1.18 -3.50 4.33 1.74 -0.59 -4.42 116.66 113.96 1s64 n ARG 291 Ca 0.05 -0.27 -0.29 0.00 -0.77 0.00 0.00 57.85 56.57 1s64 n ARG 291 Cb 0.18 -1.49 -0.08 0.00 -1.02 0.00 0.00 32.46 30.05 1s64 n ARG 291 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1s64 n TYR 292 N -0.67 3.51 -0.33 -1.55 4.01 -1.16 -4.95 117.16 116.02 1s64 n TYR 292 Ca 0.22 -4.06 0.17 0.00 -0.16 0.00 0.00 57.90 54.08 1s64 n TYR 292 Cb 0.18 -0.67 0.37 0.00 -0.31 0.00 0.00 39.34 38.91 1s64 n TYR 292 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1s64 h PRO 293 N 4.65 0.42 0.00 -0.72 0.13 -1.86 0.34 132.00 134.94 1s64 h PRO 293 Ca 0.19 -0.02 -0.08 0.00 -0.87 0.00 0.00 66.00 65.22 1s64 h PRO 293 Cb 0.68 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.71 1s64 h PRO 293 CO 0.86 0.27 -0.37 -0.91 -0.23 0.00 0.00 178.00 177.63 1s64 h ASN 294 N 0.43 0.00 -0.12 1.44 4.21 -1.98 -2.97 115.58 116.59 1s64 h ASN 294 Ca 0.63 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 58.12 1s64 h ASN 294 Cb 1.27 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.47 1s64 h ASN 294 CO -0.54 0.37 -0.00 0.25 -1.29 0.00 0.00 177.43 176.21 1s64 h LEU 295 N 0.00 0.20 -0.34 1.61 5.85 -1.33 -0.76 115.31 120.53 1s64 h LEU 295 Ca -0.00 -0.31 0.07 0.00 0.84 0.00 0.00 57.88 58.47 1s64 h LEU 295 Cb 0.77 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.67 1s64 h LEU 295 CO 0.05 0.47 -0.14 0.25 -0.34 0.00 0.00 178.44 178.72 1s64 h LEU 296 N -0.07 -0.49 -0.29 2.25 5.85 -1.38 -0.23 115.31 120.96 1s64 h LEU 296 Ca 0.03 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.87 1s64 h LEU 296 Cb 0.37 0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1s64 h LEU 296 CO 0.01 -0.18 0.17 0.78 -0.34 0.00 0.00 178.44 178.88 1s64 h ASN 297 N -0.08 0.35 -0.55 1.25 -0.26 -1.45 -0.98 115.58 113.86 1s64 h ASN 297 Ca 0.17 -0.06 0.02 0.00 -0.56 0.00 0.00 56.30 55.86 1s64 h ASN 297 Cb 0.34 -0.09 -0.03 0.00 -1.06 0.00 0.00 38.32 37.48 1s64 h ASN 297 CO -0.40 0.31 0.36 1.56 -1.06 0.00 0.00 177.43 178.21 1s64 h GLN 298 N 0.36 0.68 -0.13 0.81 4.20 -0.51 -1.05 115.11 119.47 1s64 h GLN 298 Ca 0.10 -0.04 -0.16 0.00 0.06 0.00 0.00 58.65 58.61 1s64 h GLN 298 Cb 0.03 -0.15 0.01 0.00 0.30 0.00 0.00 27.48 27.66 1s64 h GLN 298 CO -0.02 0.45 -0.53 -0.07 -0.67 0.00 0.00 178.83 177.99 1s64 h LEU 299 N 0.70 0.70 -2.20 1.46 3.38 -0.67 -2.93 115.31 115.75 1s64 h LEU 299 Ca 0.21 -0.62 -0.00 0.00 0.09 0.00 0.00 57.88 57.55 1s64 h LEU 299 Cb -0.02 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 1s64 h LEU 299 CO -0.05 1.20 -0.01 -0.07 0.09 0.00 0.00 178.44 179.60 1s64 h LEU 300 N 0.24 0.00 -0.01 1.67 3.38 -0.70 0.10 115.31 119.99 1s64 h LEU 300 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1s64 h LEU 300 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1s64 h LEU 300 CO 0.11 0.01 0.00 0.47 0.09 0.00 0.00 178.44 179.12 1s64 n ASP 301 N -4.18 0.29 0.01 -0.43 9.92 -0.44 -3.24 116.55 118.48 1s64 n ASP 301 Ca -0.03 0.53 0.03 0.00 -0.53 0.00 0.00 54.79 54.79 1s64 n ASP 301 Cb 0.10 -0.61 -0.11 0.00 -0.64 0.00 0.00 41.12 39.86 1s64 n ASP 301 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1s64 n LEU 302 N -1.77 0.45 -0.28 0.64 4.77 0.32 -4.40 117.00 116.72 1s64 n LEU 302 Ca 0.06 0.19 0.09 0.00 -0.03 0.00 0.00 56.01 56.33 1s64 n LEU 302 Cb 0.37 0.11 0.24 0.00 -2.33 0.00 0.00 43.42 41.81 1s64 n LEU 302 CO 0.28 0.12 0.93 -0.61 -1.33 0.00 0.00 177.39 176.78 1s64 h GLN 303 N 0.00 0.22 -0.22 3.23 4.15 -1.42 -0.89 115.11 120.18 1s64 h GLN 303 Ca -0.17 -0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.27 1s64 h GLN 303 Cb 1.46 -0.05 -0.07 0.00 0.21 0.00 0.00 27.48 29.03 1s64 h GLN 303 CO 0.02 0.14 -0.51 -1.35 -1.93 0.00 0.00 178.83 175.21 1s64 h PRO 304 N 0.22 -0.46 0.00 -2.39 0.11 -1.77 -3.28 132.00 124.43 1s64 h PRO 304 Ca 0.49 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.63 1s64 h PRO 304 Cb 0.92 0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1s64 h PRO 304 CO -0.61 -0.30 -0.57 -1.13 -0.21 0.00 0.00 178.00 175.18 1s64 n SER 305 N -5.19 1.14 -1.49 -2.05 3.41 -1.06 -4.67 113.62 103.71 1s64 n SER 305 Ca -0.05 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1s64 n SER 305 Cb 0.34 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.67 1s64 n SER 305 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1s64 n HIS 306 N -3.65 0.00 -1.54 7.33 8.25 -0.36 -4.91 115.22 120.34 1s64 n HIS 306 Ca -0.08 -0.56 -0.30 0.00 -0.26 0.00 0.00 57.72 56.52 1s64 n HIS 306 Cb 0.30 -0.35 0.07 0.00 1.12 0.00 0.00 29.99 31.13 1s64 n HIS 306 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1s64 s SER 307 N 1.73 4.89 -0.17 0.41 0.15 -1.19 -4.73 113.70 114.79 1s64 s SER 307 Ca 0.00 1.49 -0.35 0.00 0.70 0.00 0.00 55.95 57.79 1s64 s SER 307 Cb 0.00 -2.29 0.14 0.00 -1.71 0.00 0.00 66.02 62.16 1s64 s SER 307 CO 0.00 -1.74 1.25 -0.94 1.20 0.00 0.00 173.24 173.01 1s64 s SER 308 N -3.81 -0.10 0.49 5.45 1.04 -1.26 -4.88 113.70 110.62 1s64 s SER 308 Ca 0.60 -0.03 0.21 0.00 0.48 0.00 0.00 55.95 57.20 1s64 s SER 308 Cb -0.14 0.13 1.25 0.00 0.10 0.00 0.00 66.02 67.35 1s64 s SER 308 CO 0.55 -0.22 2.05 1.55 0.98 0.00 0.00 173.24 178.15 1s64 h PRO 309 N 2.00 0.00 -0.54 4.02 0.13 -1.95 -2.35 132.00 133.31 1s64 h PRO 309 Ca -0.13 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.95 1s64 h PRO 309 Cb 1.17 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 1s64 h PRO 309 CO 0.23 0.14 0.14 1.88 -0.23 0.00 0.00 178.00 180.16 1s64 h TYR 310 N 0.00 0.90 -0.14 1.56 0.99 -1.95 0.20 116.97 118.53 1s64 h TYR 310 Ca -0.00 -0.10 -0.02 0.00 2.00 0.00 0.00 58.73 60.60 1s64 h TYR 310 Cb 0.29 -0.26 -0.00 0.00 1.00 0.00 0.00 36.73 37.76 1s64 h TYR 310 CO 0.00 0.78 0.00 1.25 -0.00 0.00 0.00 178.16 180.20 1s64 h LEU 311 N 0.76 0.23 -0.88 3.88 6.46 -1.80 -1.08 115.31 122.88 1s64 h LEU 311 Ca 0.17 -0.30 0.07 0.00 -0.12 0.00 0.00 57.88 57.70 1s64 h LEU 311 Cb 0.33 -0.06 -0.06 0.00 -0.73 0.00 0.00 40.66 40.13 1s64 h LEU 311 CO 0.00 0.48 0.55 0.40 -0.62 0.00 0.00 178.44 179.24 1s64 h ILE 312 N -0.02 1.03 -0.46 4.05 1.08 -1.27 -0.56 117.51 121.37 1s64 h ILE 312 Ca 0.04 -0.34 -0.08 0.00 -0.39 0.00 0.00 64.86 64.10 1s64 h ILE 312 Cb 0.36 -0.04 -0.02 0.00 -3.07 0.00 0.00 36.82 34.05 1s64 h ILE 312 CO 0.01 0.18 -0.02 0.00 -0.69 0.00 0.00 178.15 177.62 1s64 h ALA 313 N 1.42 1.10 -0.18 1.87 0.00 -0.79 -1.49 119.26 121.18 1s64 h ALA 313 Ca 0.39 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1s64 h ALA 313 Cb 0.20 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1s64 h ALA 313 CO -0.18 0.57 0.08 0.35 0.00 0.00 0.00 179.25 180.07 1s64 h PHE 314 N 0.72 0.27 -0.41 0.00 3.57 0.17 -1.40 116.94 119.85 1s64 h PHE 314 Ca 0.14 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.68 1s64 h PHE 314 Cb 0.47 -0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.08 1s64 h PHE 314 CO 0.02 0.30 0.12 -0.07 -2.23 0.00 0.00 178.31 176.46 1s64 h LEU 315 N 0.15 0.11 -0.57 0.59 3.38 -0.85 0.68 115.31 118.81 1s64 h LEU 315 Ca 0.06 0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.15 1s64 h LEU 315 Cb 0.14 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 40.88 1s64 h LEU 315 CO -0.01 0.09 0.25 0.58 0.09 0.00 0.00 178.44 179.45 1s64 h VAL 316 N 0.28 0.87 -0.32 1.22 2.07 -1.01 -0.24 116.25 119.11 1s64 h VAL 316 Ca 0.19 -0.16 -0.06 0.00 0.82 0.00 0.00 66.70 67.49 1s64 h VAL 316 Cb 0.20 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 1s64 h VAL 316 CO -0.22 0.09 -0.06 0.44 0.02 0.00 0.00 177.57 177.84 1s64 h ASP 317 N 0.47 0.49 -0.04 0.57 3.45 -0.27 0.10 116.42 121.19 1s64 h ASP 317 Ca 0.27 -0.11 -0.01 0.00 0.43 0.00 0.00 57.03 57.61 1s64 h ASP 317 Cb 0.25 -0.13 -0.00 0.00 -0.56 0.00 0.00 39.33 38.89 1s64 h ASP 317 CO -0.23 0.60 0.00 0.40 -1.57 0.00 0.00 179.24 178.44 1s64 h ILE 318 N 0.48 1.23 -0.88 0.35 2.04 0.05 -1.33 117.51 119.46 1s64 h ILE 318 Ca 0.10 -0.71 0.04 0.00 1.00 0.00 0.00 64.86 65.29 1s64 h ILE 318 Cb 0.41 1.63 -0.05 0.00 -0.74 0.00 0.00 36.82 38.07 1s64 h ILE 318 CO 0.02 0.19 0.56 1.88 0.00 0.00 0.00 178.15 180.81 1s64 h TYR 319 N -0.20 1.06 -0.84 1.37 0.99 -0.68 -1.50 116.97 117.16 1s64 h TYR 319 Ca 0.01 0.03 -0.03 0.00 2.00 0.00 0.00 58.73 60.74 1s64 h TYR 319 Cb 0.30 -0.35 -0.04 0.00 1.00 0.00 0.00 36.73 37.65 1s64 h TYR 319 CO 0.02 0.60 0.40 1.49 -0.00 0.00 0.00 178.16 180.68 1s64 h GLU 320 N 1.09 1.22 -0.44 4.88 4.81 -0.63 -0.78 114.58 124.72 1s64 h GLU 320 Ca 0.35 -0.18 -0.05 0.00 -0.13 0.00 0.00 59.36 59.36 1s64 h GLU 320 Cb 0.02 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.16 1s64 h GLU 320 CO -0.12 0.94 0.08 0.22 -0.73 0.00 0.00 179.01 179.40 1s64 h ASP 321 N 1.20 0.62 0.32 1.04 -0.00 -0.31 -0.70 116.42 118.59 1s64 h ASP 321 Ca 0.29 -0.11 -0.02 0.00 -0.00 0.00 0.00 57.03 57.20 1s64 h ASP 321 Cb 0.12 -0.16 0.00 0.00 -0.00 0.00 0.00 39.33 39.29 1s64 h ASP 321 CO -0.04 0.64 -0.15 0.24 -0.00 0.00 0.00 179.24 179.93 1s64 h MET 322 N 0.65 -0.42 -0.73 0.28 2.86 -0.38 -2.22 114.93 114.97 1s64 h MET 322 Ca 0.14 0.03 0.17 0.00 -2.06 0.00 0.00 59.70 57.98 1s64 h MET 322 Cb 0.28 0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.99 1s64 h MET 322 CO 0.00 -0.18 0.50 -0.07 1.06 0.00 0.00 176.91 178.22 1s64 h LEU 323 N -0.59 0.26 -1.04 1.22 3.38 -0.83 0.22 115.31 117.92 1s64 h LEU 323 Ca -0.04 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 1s64 h LEU 323 Cb 0.43 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1s64 h LEU 323 CO 0.07 0.13 -0.38 -0.08 0.09 0.00 0.00 178.44 178.26 1s64 h GLU 324 N 0.27 0.18 -1.71 1.13 4.57 -0.75 -3.23 114.58 115.04 1s64 h GLU 324 Ca 0.36 -0.08 -0.72 0.00 -1.18 0.00 0.00 59.36 57.74 1s64 h GLU 324 Cb 1.02 -0.01 -0.31 0.00 -0.16 0.00 0.00 28.75 29.29 1s64 h GLU 324 CO -0.09 0.55 0.66 0.09 -1.18 0.00 0.00 179.01 179.04 1s64 n ASN 325 N -4.05 6.98 -3.22 1.04 3.02 0.76 -4.95 115.26 114.84 1s64 n ASN 325 Ca -0.01 -3.81 -0.11 0.00 -0.03 0.00 0.00 54.58 50.62 1s64 n ASN 325 Cb 0.45 -0.92 0.00 0.00 -0.61 0.00 0.00 39.78 38.70 1s64 n ASN 325 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1s64 n GLN 326 N -0.60 -0.61 -1.97 3.52 10.64 -1.21 -4.90 117.38 122.26 1s64 n GLN 326 Ca 0.52 0.10 -0.30 0.00 -1.83 0.00 0.00 57.00 55.50 1s64 n GLN 326 Cb 0.40 -0.64 0.20 0.00 -0.86 0.00 0.00 30.24 29.34 1s64 n GLN 326 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1s64 s ASP 328 N -4.95 7.03 -0.42 0.00 -0.00 -1.26 -3.95 116.67 113.12 1s64 s ASP 328 Ca 0.76 1.22 -0.02 0.00 -0.00 0.00 0.00 52.55 54.51 1s64 s ASP 328 Cb -0.02 -2.37 0.00 0.00 -0.00 0.00 0.00 42.92 40.53 1s64 s ASP 328 CO 0.53 0.19 0.27 0.59 -0.00 0.00 0.00 175.17 176.75 1s64 n ASN 329 N 2.21 -3.09 -0.32 0.27 3.02 -1.26 -4.84 115.26 111.25 1s64 n ASN 329 Ca -0.08 -0.12 0.01 0.00 -0.03 0.00 0.00 54.58 54.35 1s64 n ASN 329 Cb 0.51 -1.80 0.07 0.00 -0.61 0.00 0.00 39.78 37.95 1s64 n ASN 329 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1s64 h LYS 330 N -0.61 -0.03 -0.47 3.52 3.64 -1.98 0.33 116.57 120.96 1s64 h LYS 330 Ca -0.16 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.19 1s64 h LYS 330 Cb 1.11 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.91 1s64 h LYS 330 CO 0.16 -0.02 0.17 0.93 -2.27 0.00 0.00 179.45 178.42 1s64 h GLU 331 N -0.03 0.68 -0.09 1.90 5.08 -1.92 -0.75 114.58 119.46 1s64 h GLU 331 Ca 0.37 -0.10 -0.19 0.00 -1.00 0.00 0.00 59.36 58.43 1s64 h GLU 331 Cb 0.62 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 1s64 h GLU 331 CO -0.90 0.58 -0.75 0.22 -1.00 0.00 0.00 179.01 177.16 1s64 h ASP 332 N 0.67 0.57 0.02 1.42 3.58 -0.85 -2.91 116.42 118.93 1s64 h ASP 332 Ca 0.16 -0.38 -0.00 0.00 0.42 0.00 0.00 57.03 57.23 1s64 h ASP 332 Cb 0.17 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1s64 h ASP 332 CO -0.01 1.13 -0.01 0.40 -2.88 0.00 0.00 179.24 177.87 1s64 h ILE 333 N 0.32 1.20 -1.01 2.25 1.08 -0.54 -2.62 117.51 118.19 1s64 h ILE 333 Ca -0.04 -0.68 0.24 0.00 -0.39 0.00 0.00 64.86 63.99 1s64 h ILE 333 Cb 1.34 1.65 -0.10 0.00 -3.07 0.00 0.00 36.82 36.65 1s64 h ILE 333 CO 0.13 0.17 0.64 0.25 -0.69 0.00 0.00 178.15 178.66 1s64 h LEU 334 N -0.33 0.53 -0.53 1.44 5.85 -1.15 0.24 115.31 121.36 1s64 h LEU 334 Ca -0.00 0.09 -0.14 0.00 0.84 0.00 0.00 57.88 58.66 1s64 h LEU 334 Cb 0.31 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1s64 h LEU 334 CO 0.01 0.13 -0.69 0.78 -0.34 0.00 0.00 178.44 178.33 1s64 h ASN 335 N 0.48 0.00 -0.29 1.25 2.35 -1.33 -1.17 115.58 116.88 1s64 h ASN 335 Ca 0.59 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 56.22 1s64 h ASN 335 Cb 1.33 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.69 1s64 h ASN 335 CO -0.32 0.69 -0.24 0.11 -1.65 0.00 0.00 177.43 176.01 1s64 h LYS 336 N 0.00 0.78 0.49 0.81 1.57 -0.19 -0.87 116.57 119.16 1s64 h LYS 336 Ca -0.01 -0.32 -0.02 0.00 -1.87 0.00 0.00 60.65 58.43 1s64 h LYS 336 Cb 1.27 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.56 1s64 h LYS 336 CO 0.09 0.94 -0.24 0.00 -0.57 0.00 0.00 179.45 179.67 1s64 h ALA 337 N 1.05 -0.66 -1.00 3.86 0.00 -1.17 -2.66 119.26 118.67 1s64 h ALA 337 Ca 0.09 -0.19 0.16 0.00 0.00 0.00 0.00 54.91 54.97 1s64 h ALA 337 Cb 0.76 0.26 -0.10 0.00 0.00 0.00 0.00 17.79 18.71 1s64 h ALA 337 CO 0.06 -0.69 0.62 -0.07 0.00 0.00 0.00 179.25 179.17 1s64 h LEU 338 N -1.02 0.84 -0.80 0.00 3.38 -1.21 0.15 115.31 116.65 1s64 h LEU 338 Ca -0.07 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1s64 h LEU 338 Cb 0.60 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 1s64 h LEU 338 CO 0.11 0.36 0.49 -0.33 0.09 0.00 0.00 178.44 179.16 1s64 h GLU 339 N 0.85 1.08 -0.29 1.13 5.08 -1.14 -1.81 114.58 119.48 1s64 h GLU 339 Ca 0.55 -0.10 -0.13 0.00 -1.00 0.00 0.00 59.36 58.68 1s64 h GLU 339 Cb 0.74 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 1s64 h GLU 339 CO -0.34 0.76 -0.33 -0.07 -1.00 0.00 0.00 179.01 178.03 1s64 h LEU 340 N 1.10 0.80 -0.72 1.33 3.38 -0.43 -2.03 115.31 118.74 1s64 h LEU 340 Ca 0.29 -0.48 0.09 0.00 0.09 0.00 0.00 57.88 57.87 1s64 h LEU 340 Cb -0.05 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 40.41 1s64 h LEU 340 CO -0.05 1.12 0.36 0.00 0.09 0.00 0.00 178.44 179.96 1s64 h GLU 342 N 0.61 0.25 -0.40 0.00 4.57 -1.22 -0.67 114.58 117.72 1s64 h GLU 342 Ca 0.35 -0.12 -0.12 0.00 -1.18 0.00 0.00 59.36 58.30 1s64 h GLU 342 Cb 0.37 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.94 1s64 h GLU 342 CO -0.27 0.61 -0.22 0.82 -1.18 0.00 0.00 179.01 178.78 1s64 h ILE 343 N 0.21 1.27 0.29 2.32 2.04 -0.42 0.65 117.51 123.88 1s64 h ILE 343 Ca 0.02 -1.33 -0.01 0.00 1.00 0.00 0.00 64.86 64.53 1s64 h ILE 343 Cb 0.79 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 38.07 1s64 h ILE 343 CO 0.06 0.45 -0.14 -0.07 0.00 0.00 0.00 178.15 178.45 1s64 h LEU 344 N 0.70 -0.33 -0.67 1.44 3.38 -0.57 -1.19 115.31 118.06 1s64 h LEU 344 Ca 0.10 -0.14 0.01 0.00 0.09 0.00 0.00 57.88 57.94 1s64 h LEU 344 Cb 0.73 0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 1s64 h LEU 344 CO 0.06 -0.04 0.44 0.00 0.09 0.00 0.00 178.44 178.98 1s64 h ALA 345 N -0.02 0.85 0.10 1.53 0.00 -1.05 0.33 119.26 121.00 1s64 h ALA 345 Ca -0.04 -0.04 -0.28 0.00 0.00 0.00 0.00 54.91 54.55 1s64 h ALA 345 Cb 0.45 -0.27 0.02 0.00 0.00 0.00 0.00 17.79 17.99 1s64 h ALA 345 CO 0.07 0.27 -1.18 0.87 0.00 0.00 0.00 179.25 179.27 1s64 h LYS 346 N 0.90 0.46 0.00 0.00 6.56 -0.90 -3.38 116.57 120.22 1s64 h LYS 346 Ca 0.25 -0.63 0.00 0.00 -1.06 0.00 0.00 60.65 59.20 1s64 h LYS 346 Cb -0.10 0.21 0.00 0.00 -0.57 0.00 0.00 32.23 31.77 1s64 h LYS 346 CO -0.06 1.27 0.00 -0.85 -2.06 0.00 0.00 179.45 177.75 1s64 n GLU 347 N -3.70 3.56 -0.00 3.15 0.28 -0.55 -4.86 120.64 118.52 1s64 n GLU 347 Ca -0.11 0.00 -0.15 0.00 -0.16 0.00 0.00 57.16 56.74 1s64 n GLU 347 Cb 0.97 -0.40 -0.14 0.00 1.43 0.00 0.00 31.44 33.30 1s64 n GLU 347 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1s64 n LYS 348 N -0.13 0.70 -2.75 3.44 4.76 -0.60 -4.59 118.16 118.99 1s64 n LYS 348 Ca 0.00 0.28 -0.11 0.00 -2.87 0.00 0.00 58.31 55.62 1s64 n LYS 348 Cb 0.00 -1.76 0.02 0.00 -1.84 0.00 0.00 35.03 31.46 1s64 n LYS 348 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1s64 n ASP 349 N -3.28 1.29 -0.34 4.39 4.64 0.12 -4.64 116.55 118.73 1s64 n ASP 349 Ca -0.24 -2.76 0.17 0.00 -1.38 0.00 0.00 54.79 50.57 1s64 n ASP 349 Cb 1.05 -0.52 0.37 0.00 -1.04 0.00 0.00 41.12 40.98 1s64 n ASP 349 CO 0.00 0.00 0.00 0.71 -0.82 0.00 0.00 177.20 177.09 1s64 h THR 350 N 2.65 0.53 -0.19 5.18 1.35 -1.71 -0.66 112.91 120.06 1s64 h THR 350 Ca -0.07 -0.19 0.05 0.00 -0.55 0.00 0.00 66.41 65.66 1s64 h THR 350 Cb 1.15 -0.07 -0.01 0.00 -1.73 0.00 0.00 68.15 67.49 1s64 h THR 350 CO 0.49 0.10 0.26 -0.29 -0.25 0.00 0.00 175.52 175.84 1s64 h ILE 351 N 0.55 0.33 -0.41 6.82 2.10 -1.91 0.36 117.51 125.36 1s64 h ILE 351 Ca 0.63 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.57 1s64 h ILE 351 Cb 1.19 0.78 0.00 0.00 -1.09 0.00 0.00 36.82 37.70 1s64 h ILE 351 CO -0.48 0.00 0.00 0.54 -1.08 0.00 0.00 178.15 177.13 1s64 n ARG 352 N -3.57 3.76 -0.29 2.19 1.74 -0.26 -4.74 116.66 115.50 1s64 n ARG 352 Ca 0.02 -2.95 0.04 0.00 -0.77 0.00 0.00 57.85 54.19 1s64 n ARG 352 Cb 0.38 -2.00 0.13 0.00 -1.02 0.00 0.00 32.46 29.95 1s64 n ARG 352 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 1s64 h LYS 353 N 2.83 0.02 0.00 5.56 2.10 -0.27 0.41 116.57 127.21 1s64 h LYS 353 Ca 0.00 -0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.58 1s64 h LYS 353 Cb 1.64 -0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.95 1s64 h LYS 353 CO 0.32 0.01 -0.33 0.93 -2.00 0.00 0.00 179.45 178.39 1s64 h GLU 354 N 0.02 0.00 -0.03 0.07 5.08 -1.85 -2.12 114.58 115.75 1s64 h GLU 354 Ca 0.41 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.75 1s64 h GLU 354 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1s64 h GLU 354 CO -0.82 0.33 -0.06 -0.92 -1.00 0.00 0.00 179.01 176.53 1s64 h TYR 355 N 0.00 0.11 -0.80 4.33 3.20 -0.63 -2.20 116.97 120.98 1s64 h TYR 355 Ca -0.00 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.82 1s64 h TYR 355 Cb 0.69 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.90 1s64 h TYR 355 CO 0.00 0.67 0.49 -1.49 -1.64 0.00 0.00 178.16 176.19 1s64 h TRP 356 N -0.48 1.05 0.00 -3.82 -0.00 -1.00 0.77 115.95 112.48 1s64 h TRP 356 Ca -0.00 -0.00 -0.08 0.00 -0.00 0.00 0.00 58.89 58.81 1s64 h TRP 356 Cb 0.67 -0.35 -0.01 0.00 -0.00 0.00 0.00 29.16 29.47 1s64 h TRP 356 CO 0.13 0.70 -0.38 0.00 -0.00 0.00 0.00 178.44 178.90 1s64 h ARG 357 N 1.10 0.00 -0.30 0.49 3.08 -1.45 0.85 114.38 118.14 1s64 h ARG 357 Ca 0.29 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.21 1s64 h ARG 357 Cb -0.05 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 1s64 h ARG 357 CO -0.05 0.38 -0.32 -0.92 -1.07 0.00 0.00 179.97 177.98 1s64 h TYR 358 N 0.00 0.76 -0.17 3.04 3.20 -0.58 -1.05 116.97 122.18 1s64 h TYR 358 Ca -0.00 -0.20 -0.07 0.00 3.14 0.00 0.00 58.73 61.60 1s64 h TYR 358 Cb 0.68 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.78 1s64 h TYR 358 CO 0.00 0.89 -0.16 0.82 -1.64 0.00 0.00 178.16 178.07 1s64 h ILE 359 N 0.55 1.34 -0.07 1.81 1.08 0.02 -2.09 117.51 120.15 1s64 h ILE 359 Ca 0.06 -1.32 0.04 0.00 -0.39 0.00 0.00 64.86 63.25 1s64 h ILE 359 Cb 0.82 1.83 -0.05 0.00 -3.07 0.00 0.00 36.82 36.35 1s64 h ILE 359 CO 0.07 0.39 -0.24 1.23 -0.69 0.00 0.00 178.15 178.91 1s64 h GLY 360 N 0.05 -0.30 0.45 5.37 0.00 -0.71 -0.33 103.07 107.59 1s64 h GLY 360 Ca 0.03 0.29 0.11 0.00 0.00 0.00 0.00 47.33 47.76 1s64 h GLY 360 CO 0.04 -0.20 0.52 3.21 0.00 0.00 0.00 176.54 180.11 1s64 h ARG 361 N -0.34 0.81 -0.55 4.80 3.08 -1.18 -1.27 114.38 119.73 1s64 h ARG 361 Ca 0.08 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.06 1s64 h ARG 361 Cb 0.45 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 1s64 h ARG 361 CO -0.26 0.53 0.23 0.77 -1.07 0.00 0.00 179.97 180.18 1s64 h SER 362 N 0.83 0.71 -0.16 7.04 0.02 -0.47 -2.25 113.55 119.26 1s64 h SER 362 Ca 0.45 -0.08 -0.05 0.00 -0.84 0.00 0.00 61.79 61.26 1s64 h SER 362 Cb 0.47 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.82 1s64 h SER 362 CO -0.28 0.63 -0.11 -0.07 -1.14 0.00 0.00 176.83 175.86 1s64 h LEU 363 N 0.78 0.37 0.04 5.07 3.38 0.03 -2.99 115.31 122.00 1s64 h LEU 363 Ca 0.19 -0.44 0.01 0.00 0.09 0.00 0.00 57.88 57.73 1s64 h LEU 363 Cb 0.13 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1s64 h LEU 363 CO -0.02 0.74 -0.10 1.56 0.09 0.00 0.00 178.44 180.71 1s64 h GLN 364 N 0.01 -0.18 0.00 1.13 7.50 -1.18 -0.17 115.11 122.21 1s64 h GLN 364 Ca 0.03 0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.19 1s64 h GLN 364 Cb 0.61 0.04 0.00 0.00 0.05 0.00 0.00 27.48 28.19 1s64 h GLN 364 CO 0.03 -0.12 0.00 -1.13 -1.50 0.00 0.00 178.83 176.11 1s64 n SER 365 N -5.22 0.00 -0.01 1.46 3.41 -0.87 -2.53 113.62 109.87 1s64 n SER 365 Ca -0.06 -0.27 0.03 0.00 -0.26 0.00 0.00 58.87 58.31 1s64 n SER 365 Cb 0.15 -0.11 -0.07 0.00 -0.26 0.00 0.00 64.21 63.92 1s64 n SER 365 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1s64 n LYS 366 N -1.11 0.53 -3.30 4.33 3.00 -0.67 -4.84 118.16 116.10 1s64 n LYS 366 Ca 0.10 -0.07 -0.25 0.00 -0.00 0.00 0.00 58.31 58.08 1s64 n LYS 366 Cb 0.08 -1.20 -0.08 0.00 0.00 0.00 0.00 35.03 33.82 1s64 n LYS 366 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1s64 n HIS 367 N -1.85 0.21 -1.59 5.64 8.25 -0.16 -5.09 115.22 120.63 1s64 n HIS 367 Ca -0.03 -3.62 0.00 0.00 -0.26 0.00 0.00 57.72 53.81 1s64 n HIS 367 Cb 0.28 -0.25 0.00 0.00 1.12 0.00 0.00 29.99 31.14 1s64 n HIS 367 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41