#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 3.56 0.42 4.37 2.96 -1.26 -5.01 118.68 123.72 1s64 s LEU 56 Ca 0.00 -0.41 -0.25 0.00 -0.22 0.00 0.00 54.13 53.25 1s64 s LEU 56 Cb 0.00 -2.71 -0.10 0.00 0.50 0.00 0.00 46.19 43.88 1s64 s LEU 56 CO 0.00 -1.61 1.17 -0.24 -1.32 0.00 0.00 176.35 174.35 1s64 n SER 57 N 8.63 2.05 0.30 3.68 2.88 -1.26 -4.90 113.62 125.01 1s64 n SER 57 Ca 0.03 1.08 0.20 0.00 -1.33 0.00 0.00 58.87 58.85 1s64 n SER 57 Cb 0.48 -1.44 0.92 0.00 -0.75 0.00 0.00 64.21 63.42 1s64 n SER 57 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1s64 h LEU 58 N 1.87 0.00 -3.08 2.46 3.38 -2.00 -2.54 115.31 115.40 1s64 h LEU 58 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1s64 h LEU 58 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 1s64 h LEU 58 CO 0.59 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.22 1s64 n ASP 59 N -3.07 3.00 -4.78 -0.43 5.68 -1.26 -4.95 116.55 110.74 1s64 n ASP 59 Ca -0.01 -2.70 -0.37 0.00 -0.50 0.00 0.00 54.79 51.21 1s64 n ASP 59 Cb 0.20 -0.37 -0.03 0.00 -1.14 0.00 0.00 41.12 39.78 1s64 n ASP 59 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1s64 s SER 60 N -1.89 6.54 0.48 -1.12 0.15 -0.96 -4.92 113.70 111.98 1s64 s SER 60 Ca 0.30 2.18 0.15 0.00 0.70 0.00 0.00 55.95 59.27 1s64 s SER 60 Cb 0.23 -2.60 1.15 0.00 -1.71 0.00 0.00 66.02 63.10 1s64 s SER 60 CO 0.07 -0.65 2.07 -0.65 1.20 0.00 0.00 173.24 175.28 1s64 h PRO 61 N 2.40 0.20 -0.65 5.44 0.11 -1.95 -1.72 132.00 135.83 1s64 h PRO 61 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1s64 h PRO 61 Cb 1.23 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1s64 h PRO 61 CO 0.62 0.13 0.00 0.25 -0.21 0.00 0.00 178.00 178.79 1s64 n THR 62 N -4.48 1.73 -1.69 -1.15 -2.24 -1.26 -4.99 114.28 100.20 1s64 n THR 62 Ca 0.03 -1.11 -0.40 0.00 -2.27 0.00 0.00 64.05 60.31 1s64 n THR 62 Cb 0.24 0.10 0.03 0.00 -2.10 0.00 0.00 70.33 68.59 1s64 n THR 62 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1s64 n TYR 63 N 1.07 1.83 -4.26 4.78 4.19 -0.65 -5.00 117.16 119.12 1s64 n TYR 63 Ca 0.24 0.48 -0.21 0.00 3.31 0.00 0.00 57.90 61.72 1s64 n TYR 63 Cb 0.85 -2.31 -0.16 0.00 0.49 0.00 0.00 39.34 38.20 1s64 n TYR 63 CO 0.00 0.00 0.00 0.08 0.91 0.00 0.00 176.86 177.85 1s64 s VAL 64 N -1.29 0.70 0.53 2.97 1.01 -1.26 -5.05 120.40 118.01 1s64 s VAL 64 Ca 0.67 -0.22 -0.20 0.00 0.00 0.00 0.00 61.98 62.23 1s64 s VAL 64 Cb -0.47 -0.69 -0.07 0.00 0.00 0.00 0.00 36.38 35.14 1s64 s VAL 64 CO 0.54 0.26 0.93 0.18 0.00 0.00 0.00 175.10 177.01 1s64 n LEU 65 N 4.01 2.99 0.14 3.92 4.77 -1.26 -4.83 117.00 126.73 1s64 n LEU 65 Ca -0.24 0.88 0.06 0.00 -0.03 0.00 0.00 56.01 56.68 1s64 n LEU 65 Cb 0.51 -1.35 0.53 0.00 -2.33 0.00 0.00 43.42 40.78 1s64 n LEU 65 CO 0.24 -1.85 1.10 1.88 -1.33 0.00 0.00 177.39 177.42 1s64 h TYR 66 N 0.84 0.24 0.00 -1.77 0.05 -1.95 -0.78 116.97 113.59 1s64 h TYR 66 Ca -0.47 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.32 1s64 h TYR 66 Cb 1.36 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 39.02 1s64 h TYR 66 CO 0.39 0.16 0.00 2.89 -1.05 0.00 0.00 178.16 180.55 1s64 n ARG 67 N -4.50 0.09 -0.14 4.88 1.85 -1.26 -1.91 116.66 115.67 1s64 n ARG 67 Ca -0.00 0.37 0.05 0.00 -1.00 0.00 0.00 57.85 57.27 1s64 n ARG 67 Cb 0.08 -1.68 0.13 0.00 -1.05 0.00 0.00 32.46 29.94 1s64 n ARG 67 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1s64 n ASP 68 N -1.85 2.70 -4.78 2.89 8.00 -0.31 -4.97 116.55 118.23 1s64 n ASP 68 Ca 0.02 -1.89 -0.37 0.00 0.71 0.00 0.00 54.79 53.26 1s64 n ASP 68 Cb 0.17 -0.18 -0.06 0.00 -0.02 0.00 0.00 41.12 41.03 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 -0.98 4.09 0.15 -1.24 0.52 -0.80 -4.95 118.95 115.74 1s64 s ARG 69 Ca 0.21 0.31 -0.13 0.00 -0.52 0.00 0.00 55.73 55.60 1s64 s ARG 69 Cb 0.11 -3.33 0.04 0.00 0.52 0.00 0.00 34.95 32.29 1s64 s ARG 69 CO 0.15 0.44 1.66 0.00 0.02 0.00 0.00 175.30 177.57 1s64 h ALA 70 N 5.76 0.69 0.00 2.13 0.00 -1.93 -2.63 119.26 123.28 1s64 h ALA 70 Ca -0.46 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.23 1s64 h ALA 70 Cb 1.19 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1s64 h ALA 70 CO 0.69 0.39 0.15 0.93 0.00 0.00 0.00 179.25 181.41 1s64 h GLU 71 N 0.73 0.00 -0.20 0.00 3.07 -1.94 -0.55 114.58 115.70 1s64 h GLU 71 Ca 0.16 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.02 1s64 h GLU 71 Cb 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.26 1s64 h GLU 71 CO 0.00 0.00 0.00 0.91 -1.40 0.00 0.00 179.01 178.52 1s64 n TRP 72 N -2.40 0.39 0.00 4.33 7.02 -1.00 -4.70 117.44 121.09 1s64 n TRP 72 Ca -0.02 -0.64 0.02 0.00 -1.02 0.00 0.00 57.50 55.84 1s64 n TRP 72 Cb 0.18 -0.11 0.37 0.00 -2.42 0.00 0.00 31.31 29.33 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 1.21 1.57 0.00 6.99 0.00 -1.04 -2.68 119.26 125.31 1s64 h ALA 73 Ca 0.00 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1s64 h ALA 73 Cb 0.86 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1s64 h ALA 73 CO 0.05 0.34 -0.23 0.38 0.00 0.00 0.00 179.25 179.79 1s64 h ASP 74 N 0.53 0.00 -3.38 0.00 -0.00 -1.84 -3.44 116.42 108.29 1s64 h ASP 74 Ca 0.13 0.00 -0.55 0.00 -0.00 0.00 0.00 57.03 56.61 1s64 h ASP 74 Cb 0.10 0.00 -0.05 0.00 -0.00 0.00 0.00 39.33 39.39 1s64 h ASP 74 CO -0.01 0.23 0.11 -0.63 -0.00 0.00 0.00 179.24 178.94 1s64 s ILE 75 N -3.74 4.91 -0.42 4.15 -1.09 -1.01 -5.04 121.20 118.97 1s64 s ILE 75 Ca -0.00 1.52 -0.17 0.00 -2.23 0.00 0.00 60.65 59.76 1s64 s ILE 75 Cb 0.11 -4.07 0.02 0.00 -1.58 0.00 0.00 42.46 36.94 1s64 s ILE 75 CO 0.64 0.31 0.43 -1.81 -1.23 0.00 0.00 174.94 173.27 1s64 s ASP 76 N 0.40 6.19 0.61 3.58 -0.00 -1.26 -5.05 116.67 121.13 1s64 s ASP 76 Ca 0.38 -0.66 -0.18 0.00 -0.00 0.00 0.00 52.55 52.08 1s64 s ASP 76 Cb -0.19 -2.22 -0.05 0.00 -0.00 0.00 0.00 42.92 40.47 1s64 s ASP 76 CO 0.20 -0.56 0.95 -0.81 -0.00 0.00 0.00 175.17 174.95 1s64 n PRO 77 N 5.57 0.87 -3.99 8.23 -0.04 -1.26 -4.79 135.00 139.58 1s64 n PRO 77 Ca -0.08 0.34 -0.34 0.00 -0.04 0.00 0.00 63.50 63.39 1s64 n PRO 77 Cb 0.47 -2.16 -0.15 0.00 -0.04 0.00 0.00 33.50 31.63 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 -1.52 2.69 0.57 0.52 1.01 -0.17 -4.96 120.40 118.54 1s64 s VAL 78 Ca 0.76 -1.11 -0.12 0.00 0.00 0.00 0.00 61.98 61.51 1s64 s VAL 78 Cb -0.41 -2.38 -0.05 0.00 0.00 0.00 0.00 36.38 33.54 1s64 s VAL 78 CO 0.47 0.20 0.98 -2.16 0.00 0.00 0.00 175.10 174.58 1s64 s PRO 79 N 1.29 3.68 0.09 2.72 0.04 -1.26 -4.46 135.00 137.10 1s64 s PRO 79 Ca -0.01 0.72 -0.17 0.00 0.04 0.00 0.00 61.00 61.59 1s64 s PRO 79 Cb -0.17 -2.14 -0.07 0.00 0.04 0.00 0.00 34.50 32.16 1s64 s PRO 79 CO -0.05 -0.43 0.54 -1.14 0.04 0.00 0.00 177.00 175.95 1s64 s GLN 80 N -4.81 4.07 -0.18 4.56 0.74 -1.26 -5.07 119.66 117.71 1s64 s GLN 80 Ca 0.55 0.59 -0.05 0.00 0.05 0.00 0.00 55.36 56.50 1s64 s GLN 80 Cb -0.11 -3.12 0.06 0.00 1.10 0.00 0.00 33.01 30.95 1s64 s GLN 80 CO 0.47 0.59 0.09 0.54 -0.55 0.00 0.00 175.29 176.43 1s64 s ASN 81 N -1.33 2.47 -0.03 6.67 2.20 -1.26 -5.00 114.94 118.66 1s64 s ASN 81 Ca 0.31 -0.68 0.05 0.00 -0.94 0.00 0.00 52.86 51.60 1s64 s ASN 81 Cb -0.17 -0.25 0.19 0.00 -2.00 0.00 0.00 41.25 39.01 1s64 s ASN 81 CO 0.18 -0.36 1.00 0.47 -2.94 0.00 0.00 177.10 175.45 1s64 n ASP 82 N 5.28 1.55 -0.53 3.54 9.92 -1.26 -5.03 116.55 130.03 1s64 n ASP 82 Ca -0.07 -2.11 0.05 0.00 -0.53 0.00 0.00 54.79 52.14 1s64 n ASP 82 Cb 0.48 -0.31 -0.01 0.00 -0.64 0.00 0.00 41.12 40.64 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 0.52 -1.95 0.41 0.44 0.00 -1.26 -4.08 105.19 99.27 1s64 n GLY 83 Ca 0.07 -1.34 -0.09 0.00 0.00 0.00 0.00 46.02 44.66 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 -0.16 -3.39 1.61 0.13 -2.06 -3.33 132.00 124.81 1s64 h PRO 84 Ca 0.01 0.01 -0.64 0.00 -0.87 0.00 0.00 66.00 64.51 1s64 h PRO 84 Cb 0.35 0.04 -0.41 0.00 0.13 0.00 0.00 31.00 31.11 1s64 h PRO 84 CO 0.00 -0.10 -0.62 -1.12 -0.23 0.00 0.00 178.00 175.93 1s64 s SER 85 N -5.26 4.36 0.40 1.44 0.01 -1.26 -5.10 113.70 108.28 1s64 s SER 85 Ca -0.14 -3.02 -0.26 0.00 1.31 0.00 0.00 55.95 53.85 1s64 s SER 85 Cb 0.13 -1.65 -0.09 0.00 0.21 0.00 0.00 66.02 64.62 1s64 s SER 85 CO 0.65 -0.24 1.24 -2.16 0.41 0.00 0.00 173.24 173.14 1s64 s PRO 86 N -0.30 4.01 -0.01 12.44 0.04 -1.25 -5.04 135.00 144.89 1s64 s PRO 86 Ca 0.17 2.01 0.04 0.00 0.04 0.00 0.00 61.00 63.26 1s64 s PRO 86 Cb -0.26 -2.73 -0.03 0.00 0.04 0.00 0.00 34.50 31.52 1s64 s PRO 86 CO -0.00 -0.41 -0.11 0.08 0.04 0.00 0.00 177.00 176.60 1s64 s VAL 87 N -1.32 3.31 -1.36 -0.36 1.01 -1.26 -4.65 120.40 115.77 1s64 s VAL 87 Ca 0.57 -0.83 -0.14 0.00 0.00 0.00 0.00 61.98 61.58 1s64 s VAL 87 Cb -0.35 -2.39 0.01 0.00 0.00 0.00 0.00 36.38 33.66 1s64 s VAL 87 CO 0.44 0.45 0.42 0.52 0.00 0.00 0.00 175.10 176.93 1s64 n VAL 88 N 1.80 -2.73 -3.00 2.92 0.31 -1.26 -4.89 118.33 111.48 1s64 n VAL 88 Ca -0.16 -0.60 -0.40 0.00 -0.01 0.00 0.00 64.34 63.17 1s64 n VAL 88 Cb 0.52 -2.28 -0.05 0.00 -0.91 0.00 0.00 33.84 31.13 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 -7.00 4.46 -0.18 5.55 0.74 -1.26 -5.06 119.66 116.91 1s64 s GLN 89 Ca 0.22 0.98 -0.08 0.00 0.05 0.00 0.00 55.36 56.53 1s64 s GLN 89 Cb -0.11 -3.42 -0.04 0.00 1.10 0.00 0.00 33.01 30.54 1s64 s GLN 89 CO 0.95 0.13 0.09 0.42 -0.55 0.00 0.00 175.29 176.32 1s64 s ILE 90 N 0.52 5.03 0.06 -2.34 1.01 -1.26 -5.08 121.20 119.14 1s64 s ILE 90 Ca 0.39 0.05 -0.24 0.00 0.00 0.00 0.00 60.65 60.85 1s64 s ILE 90 Cb -0.19 -3.27 -0.06 0.00 0.01 0.00 0.00 42.46 38.95 1s64 s ILE 90 CO 0.20 0.47 0.72 0.27 0.00 0.00 0.00 174.94 176.60 1s64 s ILE 91 N 0.23 4.69 0.06 2.92 -5.25 -1.26 -5.06 121.20 117.53 1s64 s ILE 91 Ca 0.06 1.53 0.07 0.00 -0.99 0.00 0.00 60.65 61.32 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 -0.00 0.43 -0.16 -0.31 -1.79 0.00 0.00 174.94 173.10 1s64 s TYR 92 N -0.41 2.60 0.80 1.37 1.51 -1.26 -5.12 117.35 116.84 1s64 s TYR 92 Ca 0.36 -0.23 -0.11 0.00 -1.01 0.00 0.00 57.07 56.08 1s64 s TYR 92 Cb -0.21 -1.45 0.07 0.00 -0.11 0.00 0.00 41.96 40.27 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 -1.67 4.46 0.17 2.29 1.04 -1.26 -4.76 113.70 113.96 1s64 s SER 93 Ca 0.16 1.43 -0.15 0.00 0.48 0.00 0.00 55.95 57.88 1s64 s SER 93 Cb -0.11 -2.18 0.13 0.00 0.10 0.00 0.00 66.02 63.96 1s64 s SER 93 CO 0.07 -2.01 1.71 -0.33 0.98 0.00 0.00 173.24 173.67 1s64 h GLU 94 N -1.11 0.16 -0.36 4.02 4.39 -2.00 -0.84 114.58 118.84 1s64 h GLU 94 Ca -0.47 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.25 1s64 h GLU 94 Cb 1.26 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.84 1s64 h GLU 94 CO 0.57 0.11 0.16 -0.22 -1.16 0.00 0.00 179.01 178.47 1s64 h LYS 95 N 0.17 0.33 0.46 2.33 3.64 -1.99 -0.33 116.57 121.18 1s64 h LYS 95 Ca 0.21 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1s64 h LYS 95 Cb 0.28 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1s64 h LYS 95 CO -0.30 0.22 -0.22 0.35 -2.27 0.00 0.00 179.45 177.22 1s64 h PHE 96 N 0.34 -0.58 -0.56 1.91 3.57 -1.82 -2.24 116.94 117.56 1s64 h PHE 96 Ca 0.15 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.70 1s64 h PHE 96 Cb 0.08 0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.98 1s64 h PHE 96 CO -0.11 -0.30 0.37 -0.09 -2.23 0.00 0.00 178.31 175.95 1s64 h ARG 97 N -0.75 0.54 -0.01 1.11 2.43 -1.09 -2.37 114.38 114.23 1s64 h ARG 97 Ca -0.06 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1s64 h ARG 97 Cb 0.54 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1s64 h ARG 97 CO 0.10 0.35 0.00 0.22 -1.51 0.00 0.00 179.97 179.14 1s64 h ASP 98 N 0.55 0.01 -0.27 -3.80 1.82 -0.88 0.48 116.42 114.34 1s64 h ASP 98 Ca 0.24 -0.24 0.03 0.00 -0.39 0.00 0.00 57.03 56.66 1s64 h ASP 98 Cb 0.25 -0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.22 1s64 h ASP 98 CO -0.07 0.26 0.09 0.58 -1.61 0.00 0.00 179.24 178.48 1s64 h VAL 99 N -0.23 0.92 0.00 2.25 2.07 -1.01 -2.76 116.25 117.50 1s64 h VAL 99 Ca 0.00 -0.07 -0.06 0.00 0.82 0.00 0.00 66.70 67.39 1s64 h VAL 99 Cb 0.25 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1s64 h VAL 99 CO 0.00 0.04 -0.31 1.88 0.02 0.00 0.00 177.57 179.20 1s64 h TYR 100 N 0.20 0.00 -0.08 1.57 0.05 -1.40 -0.74 116.97 116.57 1s64 h TYR 100 Ca 0.12 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.81 1s64 h TYR 100 Cb 0.09 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.82 1s64 h TYR 100 CO -0.13 0.31 -0.36 -0.44 -1.05 0.00 0.00 178.16 176.48 1s64 h ASP 101 N 0.00 0.17 0.75 3.88 3.32 -0.63 -0.55 116.42 123.37 1s64 h ASP 101 Ca -0.00 -0.06 -0.25 0.00 0.02 0.00 0.00 57.03 56.74 1s64 h ASP 101 Cb 0.87 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.34 1s64 h ASP 101 CO 0.04 0.52 -1.34 1.88 -1.72 0.00 0.00 179.24 178.62 1s64 h TYR 102 N 0.14 0.00 -0.45 4.55 -1.99 -1.24 -0.39 116.97 117.60 1s64 h TYR 102 Ca 0.02 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.73 1s64 h TYR 102 Cb 0.71 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.41 1s64 h TYR 102 CO 0.01 0.99 0.21 0.35 -0.00 0.00 0.00 178.16 179.72 1s64 h PHE 103 N 0.00 0.66 -0.98 4.88 3.57 -0.75 -0.93 116.94 123.39 1s64 h PHE 103 Ca -0.14 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.33 1s64 h PHE 103 Cb 1.88 -0.20 -0.05 0.00 2.79 0.00 0.00 35.95 40.37 1s64 h PHE 103 CO 0.00 0.54 0.65 0.00 -2.23 0.00 0.00 178.31 177.27 1s64 h ARG 104 N 0.59 1.27 0.03 1.11 3.08 -1.18 -0.25 114.38 119.02 1s64 h ARG 104 Ca 0.15 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 1s64 h ARG 104 Cb 0.14 -0.29 0.00 0.00 0.08 0.00 0.00 29.97 29.90 1s64 h ARG 104 CO -0.02 0.84 -0.01 0.00 -1.07 0.00 0.00 179.97 179.71 1s64 h ALA 105 N 1.37 -0.04 -0.82 0.04 0.00 -1.32 0.38 119.26 118.88 1s64 h ALA 105 Ca 0.37 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 1s64 h ALA 105 Cb -0.12 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1s64 h ALA 105 CO -0.09 -0.49 0.42 0.28 0.00 0.00 0.00 179.25 179.38 1s64 h VAL 106 N -0.10 1.25 0.17 0.00 2.07 -0.82 -2.74 116.25 116.07 1s64 h VAL 106 Ca -0.00 -0.65 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 1s64 h VAL 106 Cb 0.09 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 1s64 h VAL 106 CO 0.01 0.28 -0.08 -0.07 0.02 0.00 0.00 177.57 177.73 1s64 h LEU 107 N 1.15 -0.19 -1.64 2.57 3.38 -0.85 -1.20 115.31 118.53 1s64 h LEU 107 Ca 0.28 -0.19 0.23 0.00 0.09 0.00 0.00 57.88 58.30 1s64 h LEU 107 Cb 0.07 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 1s64 h LEU 107 CO -0.04 0.08 0.62 -0.61 0.09 0.00 0.00 178.44 178.58 1s64 h GLN 108 N -0.47 0.27 -0.26 1.13 4.15 -0.84 0.21 115.11 119.31 1s64 h GLN 108 Ca -0.02 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.38 1s64 h GLN 108 Cb 0.36 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.99 1s64 h GLN 108 CO 0.04 0.18 0.00 0.54 -1.93 0.00 0.00 178.83 177.66 1s64 n ARG 109 N -4.45 2.46 -4.13 1.69 1.74 -1.04 -4.96 116.66 107.96 1s64 n ARG 109 Ca 0.20 -2.17 -0.31 0.00 -0.77 0.00 0.00 57.85 54.80 1s64 n ARG 109 Cb 0.80 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.70 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 1.46 -1.27 -4.60 0.55 4.64 0.73 -4.84 116.55 113.22 1s64 n ASP 110 Ca 0.18 -1.06 -0.43 0.00 -1.38 0.00 0.00 54.79 52.10 1s64 n ASP 110 Cb 0.61 -2.66 -0.02 0.00 -1.04 0.00 0.00 41.12 38.01 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 -6.85 3.52 -1.37 -0.67 2.12 -0.82 -4.92 118.70 109.70 1s64 s GLU 111 Ca 0.31 0.83 -0.08 0.00 0.36 0.00 0.00 54.97 56.39 1s64 s GLU 111 Cb -0.17 -4.04 0.09 0.00 0.26 0.00 0.00 34.13 30.27 1s64 s GLU 111 CO 0.93 -1.64 2.35 0.54 -0.54 0.00 0.00 175.26 176.90 1s64 n ARG 112 N 8.18 4.08 -3.62 4.30 5.12 -1.26 -4.83 116.66 128.63 1s64 n ARG 112 Ca 0.16 -3.20 -0.21 0.00 -1.93 0.00 0.00 57.85 52.66 1s64 n ARG 112 Cb 0.48 -2.78 -0.03 0.00 -1.16 0.00 0.00 32.46 28.97 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 0.99 5.05 0.18 0.55 1.04 -1.26 -4.86 113.70 115.39 1s64 s SER 113 Ca 0.53 -0.72 -0.01 0.00 0.48 0.00 0.00 55.95 56.23 1s64 s SER 113 Cb 0.16 -0.62 0.07 0.00 0.10 0.00 0.00 66.02 65.73 1s64 s SER 113 CO -0.06 -0.61 1.44 -0.33 0.98 0.00 0.00 173.24 174.66 1s64 h GLU 114 N 1.08 0.38 -0.25 4.02 4.39 -2.00 -2.43 114.58 119.77 1s64 h GLU 114 Ca -0.42 -0.31 -0.09 0.00 0.34 0.00 0.00 59.36 58.88 1s64 h GLU 114 Cb 1.26 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.96 1s64 h GLU 114 CO 0.58 0.95 -0.24 0.07 -1.16 0.00 0.00 179.01 179.21 1s64 h ARG 115 N 0.26 0.47 -0.46 2.33 0.11 -1.97 -2.04 114.38 113.07 1s64 h ARG 115 Ca -0.03 -0.17 -0.09 0.00 0.10 0.00 0.00 59.98 59.78 1s64 h ARG 115 Cb 1.30 -0.03 -0.02 0.00 1.11 0.00 0.00 29.97 32.33 1s64 h ARG 115 CO 0.12 0.68 -0.08 0.00 0.10 0.00 0.00 179.97 180.80 1s64 h ALA 116 N 1.33 0.63 -0.52 0.08 0.00 -1.85 -0.98 119.26 117.95 1s64 h ALA 116 Ca 0.06 -0.32 0.05 0.00 0.00 0.00 0.00 54.91 54.70 1s64 h ALA 116 Cb 0.65 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 1s64 h ALA 116 CO 0.05 0.50 0.25 0.35 0.00 0.00 0.00 179.25 180.40 1s64 h PHE 117 N 0.71 0.46 -0.26 0.00 3.57 -1.01 -0.99 116.94 119.43 1s64 h PHE 117 Ca 0.12 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 1s64 h PHE 117 Cb 0.61 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 1s64 h PHE 117 CO 0.05 0.21 -0.17 0.87 -2.23 0.00 0.00 178.31 177.04 1s64 h LYS 118 N 0.49 0.46 -0.62 1.11 1.57 -1.15 -2.64 116.57 115.80 1s64 h LYS 118 Ca 0.23 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.83 1s64 h LYS 118 Cb 0.16 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 1s64 h LYS 118 CO -0.18 0.62 0.25 1.25 -0.57 0.00 0.00 179.45 180.83 1s64 h LEU 119 N 0.42 0.82 -1.76 2.94 5.85 0.08 -2.24 115.31 121.43 1s64 h LEU 119 Ca 0.07 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 1s64 h LEU 119 Cb 0.55 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.36 1s64 h LEU 119 CO 0.04 0.73 -0.15 0.71 -0.34 0.00 0.00 178.44 179.43 1s64 h THR 120 N 0.88 1.01 -0.75 1.05 1.35 -0.91 -1.48 112.91 114.07 1s64 h THR 120 Ca 0.21 -0.51 -0.04 0.00 -0.55 0.00 0.00 66.41 65.51 1s64 h THR 120 Cb 0.17 1.28 -0.03 0.00 -1.73 0.00 0.00 68.15 67.84 1s64 h THR 120 CO -0.02 0.14 0.30 -0.09 -0.25 0.00 0.00 175.52 175.60 1s64 h ARG 121 N 0.00 1.12 -0.17 4.72 2.43 -1.40 0.40 114.38 121.48 1s64 h ARG 121 Ca -0.00 -0.20 -0.12 0.00 -0.81 0.00 0.00 59.98 58.85 1s64 h ARG 121 Cb 0.27 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1s64 h ARG 121 CO 0.02 0.91 -0.36 -0.44 -1.51 0.00 0.00 179.97 178.59 1s64 h ASP 122 N 1.09 0.60 -0.94 -3.80 3.45 -1.31 -2.13 116.42 113.39 1s64 h ASP 122 Ca 0.25 -0.56 0.02 0.00 0.43 0.00 0.00 57.03 57.17 1s64 h ASP 122 Cb 0.21 -0.17 -0.05 0.00 -0.56 0.00 0.00 39.33 38.76 1s64 h ASP 122 CO -0.02 1.05 0.62 0.00 -1.57 0.00 0.00 179.24 179.32 1s64 h ALA 123 N 0.57 1.21 -0.43 3.45 0.00 -1.05 -0.95 119.26 122.05 1s64 h ALA 123 Ca 0.00 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1s64 h ALA 123 Cb 0.96 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1s64 h ALA 123 CO 0.08 0.54 -0.21 0.82 0.00 0.00 0.00 179.25 180.49 1s64 h ILE 124 N 1.24 1.27 -0.45 0.00 2.04 -0.90 -0.52 117.51 120.18 1s64 h ILE 124 Ca 0.35 -1.34 -0.06 0.00 1.00 0.00 0.00 64.86 64.82 1s64 h ILE 124 Cb -0.09 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 1s64 h ILE 124 CO -0.09 0.45 0.04 -0.08 0.00 0.00 0.00 178.15 178.47 1s64 h GLU 125 N 0.75 0.71 -0.10 2.37 4.81 -0.66 -1.97 114.58 120.50 1s64 h GLU 125 Ca 0.10 -0.16 -0.18 0.00 -0.13 0.00 0.00 59.36 58.99 1s64 h GLU 125 Cb 0.74 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.02 1s64 h GLU 125 CO 0.06 0.70 -0.69 -0.07 -0.73 0.00 0.00 179.01 178.27 1s64 h LEU 126 N 0.68 0.54 -6.03 1.64 3.38 -0.90 -3.43 115.31 111.19 1s64 h LEU 126 Ca 0.14 -0.34 -0.05 0.00 0.09 0.00 0.00 57.88 57.72 1s64 h LEU 126 Cb 0.36 -0.16 -0.21 0.00 0.09 0.00 0.00 40.66 40.75 1s64 h LEU 126 CO 0.01 1.07 -0.44 0.21 0.09 0.00 0.00 178.44 179.38 1s64 s ASN 127 N -6.97 -1.35 0.00 -0.43 2.47 -0.23 -5.01 114.94 103.41 1s64 s ASN 127 Ca -0.06 -0.44 0.24 0.00 0.42 0.00 0.00 52.86 53.02 1s64 s ASN 127 Cb 0.10 1.88 1.38 0.00 -1.45 0.00 0.00 41.25 43.17 1s64 s ASN 127 CO 0.84 -0.23 1.79 0.00 -3.72 0.00 0.00 177.10 175.78 1s64 n ALA 128 N 4.83 2.35 1.23 1.71 0.00 -0.77 -2.99 120.51 126.87 1s64 n ALA 128 Ca 0.08 -0.14 0.13 0.00 0.00 0.00 0.00 53.44 53.51 1s64 n ALA 128 Cb 0.55 -1.39 0.29 0.00 0.00 0.00 0.00 19.45 18.91 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 -1.05 2.63 -2.61 0.00 0.00 -1.26 -4.72 120.51 113.50 1s64 n ALA 129 Ca 0.17 -0.56 -0.41 0.00 0.00 0.00 0.00 53.44 52.63 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 -2.07 6.24 0.45 0.00 3.84 -1.16 -4.88 114.94 117.36 1s64 s ASN 130 Ca 0.31 -0.78 0.11 0.00 0.21 0.00 0.00 52.86 52.72 1s64 s ASN 130 Cb 0.20 -2.53 1.01 0.00 -0.55 0.00 0.00 41.25 39.38 1s64 s ASN 130 CO 0.35 -1.69 2.07 0.10 -2.79 0.00 0.00 177.10 175.14 1s64 h TYR 131 N 9.87 0.36 -0.82 0.43 -0.00 -1.92 -2.09 116.97 122.80 1s64 h TYR 131 Ca -0.18 0.01 -0.04 0.00 0.00 0.00 0.00 58.73 58.53 1s64 h TYR 131 Cb 1.04 -0.12 -0.04 0.00 0.00 0.00 0.00 36.73 37.62 1s64 h TYR 131 CO 1.14 0.21 0.37 1.15 -0.00 0.00 0.00 178.16 181.03 1s64 h THR 132 N 0.37 1.26 -0.47 -0.90 2.02 -1.99 -0.94 112.91 112.25 1s64 h THR 132 Ca 0.14 -0.76 -0.01 0.00 0.77 0.00 0.00 66.41 66.55 1s64 h THR 132 Cb 0.09 0.24 -0.02 0.00 -1.74 0.00 0.00 68.15 66.72 1s64 h THR 132 CO -0.03 0.32 0.25 0.58 0.37 0.00 0.00 175.52 177.00 1s64 h VAL 133 N 1.17 1.18 -0.54 3.16 2.07 -1.79 -0.54 116.25 120.96 1s64 h VAL 133 Ca 0.28 -0.48 -0.06 0.00 0.82 0.00 0.00 66.70 67.26 1s64 h VAL 133 Cb 0.15 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1s64 h VAL 133 CO -0.03 0.19 0.09 -0.50 0.02 0.00 0.00 177.57 177.34 1s64 h TRP 134 N 0.63 0.89 0.01 1.57 4.06 -1.35 -0.34 115.95 121.42 1s64 h TRP 134 Ca 0.17 -0.10 -0.00 0.00 2.06 0.00 0.00 58.89 61.02 1s64 h TRP 134 Cb 0.08 -0.25 0.00 0.00 -1.00 0.00 0.00 29.16 27.99 1s64 h TRP 134 CO -0.01 0.77 -0.00 1.25 -3.56 0.00 0.00 178.44 176.88 1s64 h HIS 135 N 0.82 -0.01 -0.99 0.49 2.76 -0.72 -1.44 115.15 116.06 1s64 h HIS 135 Ca 0.17 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.37 1s64 h HIS 135 Cb 0.36 0.00 -0.06 0.00 1.55 0.00 0.00 27.41 29.26 1s64 h HIS 135 CO 0.02 0.17 0.65 0.35 -1.30 0.00 0.00 177.93 177.82 1s64 h PHE 136 N -0.19 1.22 -0.88 5.26 3.57 -0.89 -0.27 116.94 124.76 1s64 h PHE 136 Ca -0.00 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 1s64 h PHE 136 Cb 0.18 -0.41 -0.04 0.00 2.79 0.00 0.00 35.95 38.47 1s64 h PHE 136 CO -0.02 0.71 0.51 -0.09 -2.23 0.00 0.00 178.31 177.20 1s64 h ARG 137 N 1.26 1.21 -0.56 1.11 2.43 -0.80 -0.40 114.38 118.63 1s64 h ARG 137 Ca 0.39 -0.12 -0.09 0.00 -0.81 0.00 0.00 59.98 59.35 1s64 h ARG 137 Cb -0.02 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.26 1s64 h ARG 137 CO -0.12 0.86 -0.02 0.00 -1.51 0.00 0.00 179.97 179.18 1s64 h ARG 138 N 1.22 0.99 -0.38 0.20 3.08 -0.04 0.15 114.38 119.60 1s64 h ARG 138 Ca 0.31 -0.31 0.01 0.00 0.07 0.00 0.00 59.98 60.06 1s64 h ARG 138 Cb -0.02 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 1s64 h ARG 138 CO -0.06 0.99 0.23 0.28 -1.07 0.00 0.00 179.97 180.34 1s64 h VAL 139 N 0.90 1.05 -0.65 2.04 2.07 -0.34 -2.32 116.25 119.00 1s64 h VAL 139 Ca 0.16 -0.16 -0.08 0.00 0.82 0.00 0.00 66.70 67.44 1s64 h VAL 139 Cb 0.56 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 1s64 h VAL 139 CO 0.03 0.08 0.10 -0.07 0.02 0.00 0.00 177.57 177.74 1s64 h LEU 140 N 0.46 1.03 -1.45 2.57 3.38 -0.73 -0.16 115.31 120.41 1s64 h LEU 140 Ca 0.15 -0.26 0.10 0.00 0.09 0.00 0.00 57.88 57.96 1s64 h LEU 140 Cb -0.00 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.42 1s64 h LEU 140 CO -0.06 1.03 0.48 -0.07 0.09 0.00 0.00 178.44 179.91 1s64 h LEU 141 N 0.99 0.55 0.08 1.67 3.38 -0.29 0.40 115.31 122.09 1s64 h LEU 141 Ca 0.20 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 1s64 h LEU 141 Cb 0.44 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1s64 h LEU 141 CO 0.01 0.33 -0.04 0.03 0.09 0.00 0.00 178.44 178.86 1s64 h ARG 142 N 0.61 -0.11 -0.58 1.13 3.08 -0.96 -1.63 114.38 115.92 1s64 h ARG 142 Ca 0.34 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.52 1s64 h ARG 142 Cb 0.50 0.02 -0.10 0.00 0.08 0.00 0.00 29.97 30.47 1s64 h ARG 142 CO -0.12 0.21 -0.06 0.77 -1.07 0.00 0.00 179.97 179.70 1s64 h SER 143 N -0.99 -0.39 -0.08 7.04 0.02 -0.79 0.53 113.55 118.89 1s64 h SER 143 Ca -0.01 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1s64 h SER 143 Cb 0.37 0.30 0.00 0.00 0.14 0.00 0.00 62.40 63.21 1s64 h SER 143 CO 0.02 -0.15 0.00 0.18 -1.14 0.00 0.00 176.83 175.74 1s64 n LEU 144 N -5.33 1.17 -4.02 5.07 4.77 0.11 -4.94 117.00 113.83 1s64 n LEU 144 Ca 0.07 -0.45 -0.36 0.00 -0.03 0.00 0.00 56.01 55.24 1s64 n LEU 144 Cb 0.32 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.36 1s64 n LEU 144 CO 0.10 0.23 -0.23 0.00 -1.33 0.00 0.00 177.39 176.16 1s64 n GLN 145 N -0.04 -1.19 -1.74 3.23 6.02 0.18 -4.91 117.38 118.93 1s64 n GLN 145 Ca 0.17 0.22 -0.32 0.00 -0.01 0.00 0.00 57.00 57.07 1s64 n GLN 145 Cb 0.27 -3.48 0.04 0.00 1.02 0.00 0.00 30.24 28.09 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 -6.94 3.01 -0.26 -1.09 -0.14 -0.65 -4.94 119.74 108.72 1s64 s LYS 146 Ca 0.29 1.10 -0.29 0.00 -1.36 0.00 0.00 55.97 55.72 1s64 s LYS 146 Cb -0.14 -2.00 -0.03 0.00 -1.68 0.00 0.00 37.83 33.99 1s64 s LYS 146 CO 0.94 -1.05 1.79 0.34 -0.76 0.00 0.00 175.35 176.61 1s64 s ASP 147 N -3.27 6.05 0.50 2.83 3.68 -1.26 -4.86 116.67 120.33 1s64 s ASP 147 Ca 0.61 1.55 0.29 0.00 2.13 0.00 0.00 52.55 57.13 1s64 s ASP 147 Cb -0.15 -2.53 1.08 0.00 -1.45 0.00 0.00 42.92 39.87 1s64 s ASP 147 CO 0.47 -1.54 1.88 -0.07 0.13 0.00 0.00 175.17 176.04 1s64 h LEU 148 N 12.97 0.00 -0.98 -1.34 3.38 -1.95 -2.61 115.31 124.77 1s64 h LEU 148 Ca -0.35 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.51 1s64 h LEU 148 Cb 1.17 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 1s64 h LEU 148 CO 1.01 0.09 -0.50 -0.61 0.09 0.00 0.00 178.44 178.51 1s64 h GLN 149 N 0.00 0.00 -0.08 1.13 5.75 -2.00 -1.45 115.11 118.46 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 0.66 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.22 1s64 h GLN 149 CO 0.01 0.50 -0.87 1.49 -2.65 0.00 0.00 178.83 177.32 1s64 h GLU 150 N 0.00 0.66 -0.02 1.69 4.57 -1.87 -2.99 114.58 116.62 1s64 h GLU 150 Ca -0.01 -0.60 -0.06 0.00 -1.18 0.00 0.00 59.36 57.51 1s64 h GLU 150 Cb 0.90 0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 29.63 1s64 h GLU 150 CO 0.07 1.21 -0.28 1.49 -1.18 0.00 0.00 179.01 180.32 1s64 h GLU 151 N 0.42 0.03 -0.69 1.92 4.57 -1.28 -1.99 114.58 117.55 1s64 h GLU 151 Ca -0.07 -0.01 -0.06 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 30.06 1s64 h GLU 151 CO 0.17 0.31 0.18 0.52 -1.18 0.00 0.00 179.01 179.00 1s64 h MET 152 N 0.03 1.09 -0.60 1.92 2.86 -1.13 -0.65 114.93 118.45 1s64 h MET 152 Ca 0.00 -0.25 -0.09 0.00 -2.06 0.00 0.00 59.70 57.30 1s64 h MET 152 Cb 0.51 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 1s64 h MET 152 CO 0.04 0.96 0.02 -0.91 1.06 0.00 0.00 176.91 178.07 1s64 h ASN 153 N 1.04 1.03 0.81 1.22 2.35 -1.30 -0.83 115.58 119.91 1s64 h ASN 153 Ca 0.22 -0.30 -0.04 0.00 -0.55 0.00 0.00 56.30 55.63 1s64 h ASN 153 Cb 0.35 -0.28 0.01 0.00 0.05 0.00 0.00 38.32 38.45 1s64 h ASN 153 CO -0.00 1.08 -0.41 0.22 -1.65 0.00 0.00 177.43 176.67 1s64 h TYR 154 N 0.96 -1.06 0.00 1.19 3.20 -0.99 -2.48 116.97 117.79 1s64 h TYR 154 Ca 0.17 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.99 1s64 h TYR 154 Cb 0.54 0.36 -0.00 0.00 1.54 0.00 0.00 36.73 39.16 1s64 h TYR 154 CO 0.04 -0.65 -0.14 0.97 -1.64 0.00 0.00 178.16 176.74 1s64 h ILE 155 N -1.12 0.93 -0.62 1.81 6.09 -1.12 -1.79 117.51 121.70 1s64 h ILE 155 Ca -0.11 -0.49 -0.08 0.00 -1.37 0.00 0.00 64.86 62.81 1s64 h ILE 155 Cb 0.86 1.28 -0.02 0.00 0.47 0.00 0.00 36.82 39.41 1s64 h ILE 155 CO 0.17 0.13 0.08 0.40 -3.07 0.00 0.00 178.15 175.86 1s64 h ILE 156 N 0.00 1.26 -0.12 2.19 2.04 -0.91 -1.23 117.51 120.74 1s64 h ILE 156 Ca -0.00 -1.03 -0.12 0.00 1.00 0.00 0.00 64.86 64.71 1s64 h ILE 156 Cb 0.27 0.70 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1s64 h ILE 156 CO 0.02 0.38 -0.38 0.00 0.00 0.00 0.00 178.15 178.17 1s64 h ALA 157 N 1.12 0.20 -0.50 1.87 0.00 -0.93 -2.97 119.26 118.07 1s64 h ALA 157 Ca 0.19 -0.45 0.05 0.00 0.00 0.00 0.00 54.91 54.70 1s64 h ALA 157 Cb 0.44 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 1s64 h ALA 157 CO 0.01 0.29 0.23 0.82 0.00 0.00 0.00 179.25 180.61 1s64 h ILE 158 N 0.05 0.92 -0.68 0.00 1.08 -1.20 -2.51 117.51 115.17 1s64 h ILE 158 Ca -0.01 -0.15 -0.05 0.00 -0.39 0.00 0.00 64.86 64.26 1s64 h ILE 158 Cb 1.00 0.43 -0.03 0.00 -3.07 0.00 0.00 36.82 35.16 1s64 h ILE 158 CO 0.08 0.08 0.24 0.40 -0.69 0.00 0.00 178.15 178.26 1s64 h ILE 159 N 0.45 1.24 -0.51 -0.67 2.04 -1.27 -0.89 117.51 117.89 1s64 h ILE 159 Ca 0.23 -0.79 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 1s64 h ILE 159 Cb 0.17 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 1s64 h ILE 159 CO -0.18 0.31 0.29 -0.33 0.00 0.00 0.00 178.15 178.25 1s64 h GLU 160 N 0.99 0.70 0.00 2.37 5.08 -1.28 0.11 114.58 122.53 1s64 h GLU 160 Ca 0.22 -0.06 -0.16 0.00 -1.00 0.00 0.00 59.36 58.36 1s64 h GLU 160 Cb 0.23 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1s64 h GLU 160 CO -0.01 0.50 -0.80 0.93 -1.00 0.00 0.00 179.01 178.62 1s64 h GLU 161 N 0.71 0.00 -2.05 2.33 5.08 -1.13 -3.38 114.58 116.14 1s64 h GLU 161 Ca 0.18 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 58.01 1s64 h GLU 161 Cb -0.00 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 28.85 1s64 h GLU 161 CO -0.03 0.75 -1.05 1.04 -1.00 0.00 0.00 179.01 178.72 1s64 n GLN 162 N -3.28 1.24 0.01 2.33 6.02 -0.39 -4.97 117.38 118.34 1s64 n GLN 162 Ca 0.00 -3.58 0.02 0.00 -0.01 0.00 0.00 57.00 53.43 1s64 n GLN 162 Cb 0.85 -1.61 0.11 0.00 1.02 0.00 0.00 30.24 30.60 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 0.74 0.01 -0.20 -1.09 -0.04 0.31 -2.33 135.00 132.41 1s64 n PRO 163 Ca 0.24 0.46 0.07 0.00 -0.04 0.00 0.00 63.50 64.23 1s64 n PRO 163 Cb 0.56 -1.53 0.17 0.00 -0.04 0.00 0.00 33.50 32.66 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 -1.56 2.74 -2.95 0.54 4.76 -1.26 -4.81 118.16 115.62 1s64 n LYS 164 Ca 0.01 -2.11 -0.41 0.00 -2.87 0.00 0.00 58.31 52.93 1s64 n LYS 164 Cb 0.04 -1.32 -0.05 0.00 -1.84 0.00 0.00 35.03 31.87 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 -1.01 6.81 0.19 4.39 3.84 -0.98 -4.97 114.94 123.20 1s64 s ASN 165 Ca 0.27 1.00 -0.12 0.00 0.21 0.00 0.00 52.86 54.22 1s64 s ASN 165 Cb 0.14 -2.42 0.10 0.00 -0.55 0.00 0.00 41.25 38.53 1s64 s ASN 165 CO 0.19 -0.44 1.80 1.88 -2.79 0.00 0.00 177.10 177.74 1s64 h TYR 166 N 7.60 0.88 -0.95 0.43 0.05 -1.93 -3.15 116.97 119.91 1s64 h TYR 166 Ca -0.26 -0.02 0.03 0.00 0.05 0.00 0.00 58.73 58.53 1s64 h TYR 166 Cb 1.11 -0.28 -0.05 0.00 1.01 0.00 0.00 36.73 38.52 1s64 h TYR 166 CO 0.74 0.63 0.62 1.96 -1.05 0.00 0.00 178.16 181.05 1s64 h GLN 167 N 0.87 1.17 -0.17 4.88 7.50 -1.93 -1.91 115.11 125.53 1s64 h GLN 167 Ca 0.23 -0.07 -0.13 0.00 0.50 0.00 0.00 58.65 59.17 1s64 h GLN 167 Cb 0.04 -0.26 -0.01 0.00 0.05 0.00 0.00 27.48 27.29 1s64 h GLN 167 CO -0.04 0.78 -0.47 -0.39 -1.50 0.00 0.00 178.83 177.21 1s64 h VAL 168 N 1.21 1.32 -0.20 -0.54 -1.51 -1.83 -1.04 116.25 113.65 1s64 h VAL 168 Ca 0.37 -1.68 -0.17 0.00 -1.23 0.00 0.00 66.70 64.00 1s64 h VAL 168 Cb -0.02 1.71 -0.00 0.00 -2.13 0.00 0.00 31.29 30.84 1s64 h VAL 168 CO -0.11 0.51 -0.55 -0.50 -1.23 0.00 0.00 177.57 175.69 1s64 h TRP 169 N 0.34 0.77 -0.52 5.19 4.06 -1.49 -2.20 115.95 122.11 1s64 h TRP 169 Ca 0.02 -0.27 -0.07 0.00 2.06 0.00 0.00 58.89 60.63 1s64 h TRP 169 Cb 0.96 -0.15 -0.02 0.00 -1.00 0.00 0.00 29.16 28.95 1s64 h TRP 169 CO 0.03 1.03 0.06 1.25 -3.56 0.00 0.00 178.44 177.24 1s64 h HIS 170 N 0.47 0.93 -0.43 0.49 2.76 -1.19 -1.83 115.15 116.35 1s64 h HIS 170 Ca 0.01 -0.14 0.02 0.00 -2.20 0.00 0.00 60.37 58.06 1s64 h HIS 170 Cb 1.11 -0.25 -0.03 0.00 1.55 0.00 0.00 27.41 29.78 1s64 h HIS 170 CO 0.05 0.85 0.26 1.25 -1.30 0.00 0.00 177.93 179.04 1s64 h HIS 171 N 0.75 0.48 -0.81 5.26 6.17 -1.09 -1.38 115.15 124.53 1s64 h HIS 171 Ca 0.15 0.02 -0.04 0.00 0.71 0.00 0.00 60.37 61.21 1s64 h HIS 171 Cb 0.44 -0.15 -0.04 0.00 2.52 0.00 0.00 27.41 30.18 1s64 h HIS 171 CO 0.03 0.28 0.36 -0.09 0.71 0.00 0.00 177.93 179.22 1s64 h ARG 172 N 0.51 1.18 -0.70 5.26 2.43 -1.21 -1.96 114.38 119.90 1s64 h ARG 172 Ca 0.17 -0.19 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 1s64 h ARG 172 Cb 0.01 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.33 1s64 h ARG 172 CO -0.08 0.93 0.22 -0.09 -1.51 0.00 0.00 179.97 179.45 1s64 h ARG 173 N 1.16 1.08 -0.72 0.20 2.43 -0.77 -1.08 114.38 116.69 1s64 h ARG 173 Ca 0.27 -0.23 -0.04 0.00 -0.81 0.00 0.00 59.98 59.18 1s64 h ARG 173 Cb 0.16 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.52 1s64 h ARG 173 CO -0.03 0.93 0.31 0.28 -1.51 0.00 0.00 179.97 179.95 1s64 h VAL 174 N 1.03 1.24 -0.35 0.20 2.07 -0.96 -1.57 116.25 117.92 1s64 h VAL 174 Ca 0.23 -0.74 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1s64 h VAL 174 Cb 0.29 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1s64 h VAL 174 CO -0.01 0.30 0.18 -0.07 0.02 0.00 0.00 177.57 178.00 1s64 h LEU 175 N 1.02 0.44 -1.30 2.57 3.38 -0.90 -0.63 115.31 119.90 1s64 h LEU 175 Ca 0.24 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1s64 h LEU 175 Cb 0.18 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1s64 h LEU 175 CO -0.02 0.41 0.13 0.58 0.09 0.00 0.00 178.44 179.63 1s64 h VAL 176 N 0.43 1.18 -0.42 1.22 2.07 -1.00 -0.00 116.25 119.73 1s64 h VAL 176 Ca 0.12 -0.60 -0.08 0.00 0.82 0.00 0.00 66.70 66.96 1s64 h VAL 176 Cb 0.08 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 1s64 h VAL 176 CO -0.02 0.22 -0.05 -0.33 0.02 0.00 0.00 177.57 177.41 1s64 h GLU 177 N 0.60 0.78 -0.22 1.57 5.08 -0.84 0.14 114.58 121.70 1s64 h GLU 177 Ca 0.14 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 1s64 h GLU 177 Cb 0.19 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1s64 h GLU 177 CO -0.01 0.88 0.11 -1.49 -1.00 0.00 0.00 179.01 177.50 1s64 h TRP 178 N 0.60 0.31 0.00 4.33 6.55 -0.37 -2.95 115.95 124.42 1s64 h TRP 178 Ca 0.11 -0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.94 1s64 h TRP 178 Cb 0.56 -0.10 0.00 0.00 -0.86 0.00 0.00 29.16 28.77 1s64 h TRP 178 CO 0.04 0.30 0.00 -0.07 -1.05 0.00 0.00 178.44 177.66 1s64 h LEU 179 N 0.23 0.00 2.58 -4.49 3.38 -0.96 -3.46 115.31 112.59 1s64 h LEU 179 Ca 0.08 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.79 1s64 h LEU 179 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1s64 h LEU 179 CO -0.01 0.00 -0.33 0.29 0.09 0.00 0.00 178.44 178.48 1s64 n LYS 180 N -2.76 -2.18 -4.01 1.13 4.76 0.50 -4.92 118.16 110.67 1s64 n LYS 180 Ca 0.04 0.62 -0.31 0.00 -2.87 0.00 0.00 58.31 55.79 1s64 n LYS 180 Cb 0.44 -5.22 -0.15 0.00 -1.84 0.00 0.00 35.03 28.26 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 -2.03 4.44 0.00 4.39 3.68 -1.21 -4.97 116.67 120.97 1s64 s ASP 181 Ca 0.00 -1.65 0.23 0.00 2.13 0.00 0.00 52.55 53.26 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 0.00 -0.28 1.43 -0.81 0.13 0.00 0.00 175.17 175.64 1s64 n PRO 182 N 4.43 2.56 -0.22 4.34 -0.04 -1.26 -4.64 135.00 140.17 1s64 n PRO 182 Ca -0.07 -2.37 0.28 0.00 -0.04 0.00 0.00 63.50 61.31 1s64 n PRO 182 Cb 0.42 -1.52 0.70 0.00 -0.04 0.00 0.00 33.50 33.05 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 4.43 0.07 0.64 3.54 4.64 -2.01 -2.03 113.55 122.83 1s64 h SER 183 Ca 0.00 0.01 -0.18 0.00 -0.47 0.00 0.00 61.79 61.15 1s64 h SER 183 Cb 0.99 -0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.05 1s64 h SER 183 CO 0.00 0.02 -1.49 0.00 -0.87 0.00 0.00 176.83 174.49 1s64 n GLN 184 N -4.30 0.62 -0.06 4.77 6.02 -1.26 -4.70 117.38 118.47 1s64 n GLN 184 Ca 0.20 0.21 -0.10 0.00 -0.01 0.00 0.00 57.00 57.31 1s64 n GLN 184 Cb 0.98 -1.79 -0.07 0.00 1.02 0.00 0.00 30.24 30.38 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 -0.32 -0.86 -1.09 4.39 -1.69 -2.00 114.58 113.01 1s64 h GLU 185 Ca -0.19 0.02 0.15 0.00 0.34 0.00 0.00 59.36 59.69 1s64 h GLU 185 Cb 1.64 0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 30.29 1s64 h GLU 185 CO 0.05 -0.21 0.56 -0.07 -1.16 0.00 0.00 179.01 178.18 1s64 h LEU 186 N -0.33 0.56 -0.05 1.33 3.38 -1.84 -0.43 115.31 117.93 1s64 h LEU 186 Ca 0.04 0.04 -0.22 0.00 0.09 0.00 0.00 57.88 57.82 1s64 h LEU 186 Cb 0.44 -0.07 0.02 0.00 0.09 0.00 0.00 40.66 41.13 1s64 h LEU 186 CO -0.37 0.27 -0.84 -0.08 0.09 0.00 0.00 178.44 177.51 1s64 h GLU 187 N 0.59 0.66 -0.45 1.13 4.81 -1.83 -2.03 114.58 117.46 1s64 h GLU 187 Ca 0.44 -0.64 -0.01 0.00 -0.13 0.00 0.00 59.36 59.01 1s64 h GLU 187 Cb 0.82 0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.34 1s64 h GLU 187 CO -0.18 1.25 0.25 0.35 -0.73 0.00 0.00 179.01 179.94 1s64 h PHE 188 N 0.32 0.62 -0.64 0.92 3.57 -0.58 -2.15 116.94 119.01 1s64 h PHE 188 Ca -0.09 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.32 1s64 h PHE 188 Cb 1.50 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 40.02 1s64 h PHE 188 CO 0.11 0.46 0.08 0.82 -2.23 0.00 0.00 178.31 177.55 1s64 h ILE 189 N 0.60 1.26 -0.14 1.41 2.04 -1.14 -2.19 117.51 119.34 1s64 h ILE 189 Ca 0.16 -1.05 -0.00 0.00 1.00 0.00 0.00 64.86 64.97 1s64 h ILE 189 Cb 0.04 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 1s64 h ILE 189 CO -0.03 0.39 0.08 0.00 0.00 0.00 0.00 178.15 178.59 1s64 h ALA 190 N 1.08 1.87 -0.15 1.87 0.00 -1.03 0.14 119.26 123.06 1s64 h ALA 190 Ca 0.19 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1s64 h ALA 190 Cb 0.46 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1s64 h ALA 190 CO 0.02 0.11 -0.20 -0.44 0.00 0.00 0.00 179.25 178.74 1s64 h ASP 191 N 0.19 0.43 -0.49 0.00 5.19 -0.81 -2.03 116.42 118.91 1s64 h ASP 191 Ca 0.05 -0.51 -0.04 0.00 -0.62 0.00 0.00 57.03 55.91 1s64 h ASP 191 Cb 0.00 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 39.37 1s64 h ASP 191 CO -0.01 0.86 0.14 0.40 -3.12 0.00 0.00 179.24 177.51 1s64 h ILE 192 N 0.01 1.23 0.00 0.35 1.08 -0.86 -1.39 117.51 117.94 1s64 h ILE 192 Ca 0.02 -0.79 0.00 0.00 -0.39 0.00 0.00 64.86 63.69 1s64 h ILE 192 Cb 0.76 0.82 0.00 0.00 -3.07 0.00 0.00 36.82 35.33 1s64 h ILE 192 CO 0.05 0.29 0.00 0.18 -0.69 0.00 0.00 178.15 177.97 1s64 n LEU 193 N -4.49 0.65 0.12 1.44 4.77 0.44 -1.36 117.00 118.57 1s64 n LEU 193 Ca 0.01 0.71 -0.02 0.00 -0.03 0.00 0.00 56.01 56.69 1s64 n LEU 193 Cb 0.20 -0.69 0.05 0.00 -2.33 0.00 0.00 43.42 40.66 1s64 n LEU 193 CO 0.39 -0.74 0.38 -1.13 -1.33 0.00 0.00 177.39 174.97 1s64 h ASN 194 N 0.00 0.00 0.91 -1.43 -0.73 -0.48 -1.64 115.58 112.21 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 0.22 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.81 1s64 h ASN 194 CO 0.00 0.70 -1.05 0.00 -0.37 0.00 0.00 177.43 176.71 1s64 n GLN 195 N -3.46 0.58 -3.18 6.67 6.02 -0.46 -4.73 117.38 118.82 1s64 n GLN 195 Ca 0.00 0.10 0.02 0.00 -0.01 0.00 0.00 57.00 57.10 1s64 n GLN 195 Cb 0.75 -1.80 -0.01 0.00 1.02 0.00 0.00 30.24 30.21 1s64 n GLN 195 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1s64 s ASP 196 N -5.21 -1.49 0.00 1.08 -1.08 -0.84 -5.03 116.67 104.10 1s64 s ASP 196 Ca -0.01 -0.58 0.06 0.00 -0.52 0.00 0.00 52.55 51.51 1s64 s ASP 196 Cb 0.10 1.91 0.36 0.00 -1.46 0.00 0.00 42.92 43.83 1s64 s ASP 196 CO 0.80 -0.19 0.89 0.00 0.52 0.00 0.00 175.17 177.19 1s64 n ALA 197 N 4.57 1.67 -0.24 3.66 0.00 -0.62 -2.30 120.51 127.25 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 0.57 -1.10 0.01 0.00 0.00 0.00 0.00 19.45 18.93 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 -1.07 2.43 -1.55 0.00 5.02 -1.26 -4.82 118.16 116.91 1s64 n LYS 198 Ca 0.04 -1.45 -0.45 0.00 -2.02 0.00 0.00 58.31 54.43 1s64 n LYS 198 Cb 0.03 -0.97 -0.04 0.00 -0.02 0.00 0.00 35.03 34.03 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 -0.50 2.85 -0.29 4.39 2.85 -0.97 -4.84 115.26 118.75 1s64 n ASN 199 Ca 0.01 0.22 0.03 0.00 -0.11 0.00 0.00 54.58 54.74 1s64 n ASN 199 Cb 0.32 -1.47 0.24 0.00 1.24 0.00 0.00 39.78 40.12 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 14.56 1.02 -0.62 1.20 3.20 -1.95 -2.40 116.97 131.98 1s64 h TYR 200 Ca -0.36 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.52 1s64 h TYR 200 Cb 1.27 -0.34 -0.03 0.00 1.54 0.00 0.00 36.73 39.17 1s64 h TYR 200 CO 0.95 0.55 0.33 0.45 -1.64 0.00 0.00 178.16 178.80 1s64 h HIS 201 N 1.02 0.86 -0.27 -3.82 3.86 -1.88 -1.45 115.15 113.47 1s64 h HIS 201 Ca 0.37 -0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.53 1s64 h HIS 201 Cb 0.15 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.33 1s64 h HIS 201 CO -0.00 0.63 0.07 0.00 0.86 0.00 0.00 177.93 179.49 1s64 h ALA 202 N 1.15 0.36 -0.41 2.45 0.00 -1.77 -1.38 119.26 119.67 1s64 h ALA 202 Ca 0.22 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1s64 h ALA 202 Cb 0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1s64 h ALA 202 CO -0.03 0.01 -0.03 -1.49 0.00 0.00 0.00 179.25 177.70 1s64 h TRP 203 N 0.27 0.71 -0.14 0.00 4.06 -1.31 -0.03 115.95 119.51 1s64 h TRP 203 Ca 0.09 -0.10 -0.01 0.00 2.06 0.00 0.00 58.89 60.92 1s64 h TRP 203 Cb 0.27 -0.20 -0.01 0.00 -1.00 0.00 0.00 29.16 28.23 1s64 h TRP 203 CO 0.01 0.69 0.03 0.37 -3.56 0.00 0.00 178.44 175.99 1s64 h GLN 204 N 0.63 0.23 -0.88 0.49 4.15 -1.11 -0.85 115.11 117.77 1s64 h GLN 204 Ca 0.12 -0.06 -0.03 0.00 0.77 0.00 0.00 58.65 59.46 1s64 h GLN 204 Cb 0.44 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.06 1s64 h GLN 204 CO 0.02 0.39 0.44 1.25 -1.93 0.00 0.00 178.83 179.01 1s64 h HIS 205 N 0.03 1.24 -0.54 3.99 2.76 -1.00 -1.21 115.15 120.43 1s64 h HIS 205 Ca 0.04 -0.05 -0.03 0.00 -2.20 0.00 0.00 60.37 58.14 1s64 h HIS 205 Cb 0.27 -0.39 -0.02 0.00 1.55 0.00 0.00 27.41 28.81 1s64 h HIS 205 CO 0.01 0.88 0.22 -0.09 -1.30 0.00 0.00 177.93 177.65 1s64 h ARG 206 N 1.24 0.80 -0.31 5.26 2.43 -0.77 -0.74 114.38 122.29 1s64 h ARG 206 Ca 0.30 -0.14 -0.09 0.00 -0.81 0.00 0.00 59.98 59.24 1s64 h ARG 206 Cb 0.08 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1s64 h ARG 206 CO -0.04 0.69 -0.19 1.96 -1.51 0.00 0.00 179.97 180.88 1s64 h GLN 207 N 0.72 0.56 0.07 0.20 4.20 -0.79 -1.64 115.11 118.44 1s64 h GLN 207 Ca 0.18 -0.20 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 1s64 h GLN 207 Cb 0.19 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.92 1s64 h GLN 207 CO -0.02 0.73 -0.04 2.35 -0.67 0.00 0.00 178.83 181.18 1s64 h TRP 208 N 0.51 -0.09 0.05 2.96 7.01 -0.76 -1.69 115.95 123.94 1s64 h TRP 208 Ca 0.08 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.09 1s64 h TRP 208 Cb 0.61 0.03 -0.02 0.00 -2.10 0.00 0.00 29.16 27.68 1s64 h TRP 208 CO 0.02 0.14 -0.13 0.28 -2.79 0.00 0.00 178.44 175.96 1s64 h VAL 209 N -0.32 0.68 -0.64 2.65 2.07 -1.05 0.14 116.25 119.80 1s64 h VAL 209 Ca -0.01 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.58 1s64 h VAL 209 Cb 0.27 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 30.67 1s64 h VAL 209 CO 0.02 0.00 0.32 0.40 0.02 0.00 0.00 177.57 178.33 1s64 h ILE 210 N -0.25 0.90 -0.11 4.57 2.04 -1.29 -1.00 117.51 122.38 1s64 h ILE 210 Ca 0.03 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 65.64 1s64 h ILE 210 Cb 0.28 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 36.63 1s64 h ILE 210 CO -0.09 0.11 -0.12 -0.61 0.00 0.00 0.00 178.15 177.43 1s64 h GLN 211 N 0.58 0.27 -0.49 2.37 5.75 -1.04 -0.53 115.11 122.02 1s64 h GLN 211 Ca 0.30 -0.15 -0.05 0.00 -0.15 0.00 0.00 58.65 58.60 1s64 h GLN 211 Cb 0.25 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.79 1s64 h GLN 211 CO -0.22 0.70 0.11 1.49 -2.65 0.00 0.00 178.83 178.26 1s64 h GLU 212 N -0.14 0.75 -0.18 1.69 4.57 -0.50 -3.13 114.58 117.65 1s64 h GLU 212 Ca 0.02 -0.15 0.00 0.00 -1.18 0.00 0.00 59.36 58.05 1s64 h GLU 212 Cb 0.65 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.13 1s64 h GLU 212 CO 0.03 0.69 0.00 1.19 -1.18 0.00 0.00 179.01 179.74 1s64 n PHE 213 N -4.29 0.53 -3.92 0.92 3.01 -0.40 -5.01 117.46 108.30 1s64 n PHE 213 Ca 0.03 -0.82 -0.38 0.00 1.01 0.00 0.00 57.45 57.30 1s64 n PHE 213 Cb 0.22 -0.20 0.02 0.00 -0.01 0.00 0.00 39.48 39.51 1s64 n PHE 213 CO 0.00 0.00 0.00 2.89 1.01 0.00 0.00 176.76 180.66 1s64 n ARG 214 N -0.60 -0.75 -2.34 -1.08 1.85 -0.35 -4.90 116.66 108.49 1s64 n ARG 214 Ca 0.16 0.35 -0.35 0.00 -1.00 0.00 0.00 57.85 57.01 1s64 n ARG 214 Cb 0.69 -2.74 0.02 0.00 -1.05 0.00 0.00 32.46 29.38 1s64 n ARG 214 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1s64 n LEU 215 N -4.18 6.44 0.11 2.89 4.77 -0.39 -4.75 117.00 121.88 1s64 n LEU 215 Ca -0.16 -5.16 -0.01 0.00 -0.03 0.00 0.00 56.01 50.65 1s64 n LEU 215 Cb 0.60 -0.88 -0.03 0.00 -2.33 0.00 0.00 43.42 40.78 1s64 n LEU 215 CO 0.70 2.01 0.34 -0.50 -1.33 0.00 0.00 177.39 178.61 1s64 h TRP 216 N 3.16 0.00 -0.66 -1.77 4.06 -1.91 -3.41 115.95 115.42 1s64 h TRP 216 Ca 0.44 0.00 0.15 0.00 2.06 0.00 0.00 58.89 61.55 1s64 h TRP 216 Cb 0.36 0.00 -0.13 0.00 -1.00 0.00 0.00 29.16 28.40 1s64 h TRP 216 CO 1.08 0.70 -0.09 -0.25 -3.56 0.00 0.00 178.44 176.32 1s64 n ASP 217 N -3.27 -0.17 -0.43 -3.49 8.00 -1.26 -2.31 116.55 113.61 1s64 n ASP 217 Ca 0.01 1.13 0.05 0.00 0.71 0.00 0.00 54.79 56.70 1s64 n ASP 217 Cb 0.82 -0.37 0.05 0.00 -0.02 0.00 0.00 41.12 41.60 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 -5.00 1.95 -0.21 -2.24 4.13 -1.26 -4.73 115.26 107.90 1s64 n ASN 218 Ca 0.13 -1.48 -0.07 0.00 1.68 0.00 0.00 54.58 54.84 1s64 n ASN 218 Cb 0.41 -0.02 0.03 0.00 -1.54 0.00 0.00 39.78 38.66 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 2.04 0.87 -0.05 3.52 4.57 -1.70 -2.13 114.58 121.70 1s64 h GLU 219 Ca 0.00 -0.14 0.02 0.00 -1.18 0.00 0.00 59.36 58.05 1s64 h GLU 219 Cb 0.46 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.90 1s64 h GLU 219 CO 0.00 0.72 0.04 1.25 -1.18 0.00 0.00 179.01 179.84 1s64 h LEU 220 N 0.81 0.00 -0.11 1.64 5.85 -1.85 0.16 115.31 121.81 1s64 h LEU 220 Ca 0.20 0.00 -0.24 0.00 0.84 0.00 0.00 57.88 58.68 1s64 h LEU 220 Cb 0.15 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.19 1s64 h LEU 220 CO -0.02 0.00 -0.98 -0.61 -0.34 0.00 0.00 178.44 176.49 1s64 h GLN 221 N 0.00 0.51 -0.63 1.25 4.15 -1.79 -2.01 115.11 116.60 1s64 h GLN 221 Ca 0.03 -0.55 -0.07 0.00 0.77 0.00 0.00 58.65 58.83 1s64 h GLN 221 Cb 0.10 0.16 -0.03 0.00 0.21 0.00 0.00 27.48 27.92 1s64 h GLN 221 CO -0.00 1.18 0.14 -0.92 -1.93 0.00 0.00 178.83 177.30 1s64 h TYR 222 N 0.29 1.07 -0.30 3.99 3.20 -0.39 -1.54 116.97 123.28 1s64 h TYR 222 Ca -0.10 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 61.63 1s64 h TYR 222 Cb 1.62 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 39.58 1s64 h TYR 222 CO 0.07 0.90 0.15 0.28 -1.64 0.00 0.00 178.16 177.93 1s64 h VAL 223 N 0.93 1.15 -0.84 1.81 2.07 -0.75 -1.67 116.25 118.95 1s64 h VAL 223 Ca 0.19 -0.41 0.02 0.00 0.82 0.00 0.00 66.70 67.32 1s64 h VAL 223 Cb 0.38 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 1s64 h VAL 223 CO 0.01 0.15 0.55 0.44 0.02 0.00 0.00 177.57 178.74 1s64 h ASP 224 N 0.36 0.94 -0.40 0.57 3.32 -1.09 -0.59 116.42 119.53 1s64 h ASP 224 Ca 0.10 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.09 1s64 h ASP 224 Cb 0.10 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 1s64 h ASP 224 CO -0.01 0.67 0.08 -0.61 -1.72 0.00 0.00 179.24 177.65 1s64 h GLN 225 N 1.10 0.64 0.00 3.56 4.15 -0.88 -2.86 115.11 120.82 1s64 h GLN 225 Ca 0.32 -0.16 -0.12 0.00 0.77 0.00 0.00 58.65 59.46 1s64 h GLN 225 Cb -0.07 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.52 1s64 h GLN 225 CO -0.08 0.68 -0.56 -0.07 -1.93 0.00 0.00 178.83 176.87 1s64 h LEU 226 N 0.50 0.00 -1.18 -2.39 3.38 -0.81 -2.75 115.31 112.06 1s64 h LEU 226 Ca 0.12 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 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 0.56 -0.08 -0.07 0.09 0.00 0.00 178.44 178.94 1s64 h LEU 227 N 0.00 0.00 0.04 1.67 3.38 -1.03 -1.79 115.31 117.58 1s64 h LEU 227 Ca -0.01 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.70 1s64 h LEU 227 Cb 1.07 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.83 1s64 h LEU 227 CO 0.07 0.08 -1.17 0.11 0.09 0.00 0.00 178.44 177.63 1s64 h LYS 228 N 0.00 0.39 -0.13 1.13 6.56 -1.26 -2.17 116.57 121.08 1s64 h LYS 228 Ca -0.00 -0.55 -0.11 0.00 -1.06 0.00 0.00 60.65 58.93 1s64 h LYS 228 Cb 0.65 0.19 -0.01 0.00 -0.57 0.00 0.00 32.23 32.49 1s64 h LYS 228 CO 0.01 1.23 -0.41 0.93 -2.06 0.00 0.00 179.45 179.15 1s64 h GLU 229 N 0.16 0.30 -0.79 3.15 5.08 -1.21 -3.41 114.58 117.85 1s64 h GLU 229 Ca -0.14 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1s64 h GLU 229 Cb 1.85 -0.00 -0.19 0.00 0.50 0.00 0.00 28.75 30.91 1s64 h GLU 229 CO 0.20 0.67 -0.35 0.34 -1.00 0.00 0.00 179.01 178.87 1s64 s ASP 230 N -6.87 -1.23 0.00 1.42 2.15 -0.71 -5.01 116.67 106.41 1s64 s ASP 230 Ca -0.05 -0.50 0.06 0.00 0.43 0.00 0.00 52.55 52.49 1s64 s ASP 230 Cb 0.13 1.60 0.27 0.00 -0.30 0.00 0.00 42.92 44.62 1s64 s ASP 230 CO 0.78 -0.15 1.11 0.55 -0.17 0.00 0.00 175.17 177.29 1s64 n VAL 231 N 4.39 1.25 1.13 1.11 3.14 -0.82 -1.84 118.33 126.69 1s64 n VAL 231 Ca 0.09 0.31 0.12 0.00 -2.96 0.00 0.00 64.34 61.90 1s64 n VAL 231 Cb 0.58 -1.21 0.21 0.00 -1.06 0.00 0.00 33.84 32.35 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 -1.39 0.87 -1.96 1.45 1.74 -1.26 -4.76 116.66 111.35 1s64 n ARG 232 Ca 0.02 -0.61 -0.40 0.00 -0.77 0.00 0.00 57.85 56.09 1s64 n ARG 232 Cb 0.06 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 29.98 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 -2.55 5.42 0.48 0.55 3.84 -0.77 -4.84 114.94 117.08 1s64 s ASN 233 Ca 0.21 0.83 0.15 0.00 0.21 0.00 0.00 52.86 54.25 1s64 s ASN 233 Cb 0.19 -2.52 1.13 0.00 -0.55 0.00 0.00 41.25 39.49 1s64 s ASN 233 CO 0.57 -2.16 2.08 -1.13 -2.79 0.00 0.00 177.10 173.66 1s64 h ASN 234 N 14.66 0.03 -0.60 -4.21 -1.24 -1.90 -2.39 115.58 119.93 1s64 h ASN 234 Ca -0.29 -0.00 -0.06 0.00 0.71 0.00 0.00 56.30 56.66 1s64 h ASN 234 Cb 1.18 -0.01 -0.03 0.00 0.73 0.00 0.00 38.32 40.19 1s64 h ASN 234 CO 1.13 0.10 0.14 0.28 -1.29 0.00 0.00 177.43 177.80 1s64 h SER 235 N 0.04 0.93 -0.29 1.15 0.02 -1.89 -2.12 113.55 111.39 1s64 h SER 235 Ca 0.01 -0.19 -0.17 0.00 -0.84 0.00 0.00 61.79 60.60 1s64 h SER 235 Cb 0.13 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.42 1s64 h SER 235 CO 0.01 0.91 -0.48 0.58 -1.14 0.00 0.00 176.83 176.70 1s64 h VAL 236 N 0.94 1.28 -0.39 2.27 2.07 -1.75 -1.32 116.25 119.35 1s64 h VAL 236 Ca 0.20 -1.67 -0.04 0.00 0.82 0.00 0.00 66.70 66.01 1s64 h VAL 236 Cb 0.35 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 1s64 h VAL 236 CO 0.00 0.55 0.07 -0.50 0.02 0.00 0.00 177.57 177.71 1s64 h TRP 237 N 0.69 0.61 -0.43 1.57 4.06 -1.39 -0.10 115.95 120.95 1s64 h TRP 237 Ca 0.03 -0.05 -0.07 0.00 2.06 0.00 0.00 58.89 60.87 1s64 h TRP 237 Cb 1.08 -0.18 -0.02 0.00 -1.00 0.00 0.00 29.16 29.05 1s64 h TRP 237 CO 0.07 0.54 0.01 -0.97 -3.56 0.00 0.00 178.44 174.53 1s64 h ASN 238 N 0.58 0.74 -0.98 -3.49 -1.24 -1.11 -2.57 115.58 107.51 1s64 h ASN 238 Ca 0.13 -0.30 0.00 0.00 0.71 0.00 0.00 56.30 56.84 1s64 h ASN 238 Cb 0.26 -0.20 -0.05 0.00 0.73 0.00 0.00 38.32 39.07 1s64 h ASN 238 CO 0.00 0.86 0.63 -0.61 -1.29 0.00 0.00 177.43 177.02 1s64 h GLN 239 N 0.60 1.30 -0.41 6.67 5.75 -0.43 -0.82 115.11 127.78 1s64 h GLN 239 Ca 0.12 -0.09 0.03 0.00 -0.15 0.00 0.00 58.65 58.56 1s64 h GLN 239 Cb 0.48 -0.29 -0.03 0.00 1.07 0.00 0.00 27.48 28.71 1s64 h GLN 239 CO 0.02 0.88 0.20 -0.09 -2.65 0.00 0.00 178.83 177.20 1s64 h ARG 240 N 1.34 0.40 -0.02 1.69 2.43 -0.77 0.45 114.38 119.90 1s64 h ARG 240 Ca 0.36 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.42 1s64 h ARG 240 Cb -0.12 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.33 1s64 h ARG 240 CO -0.07 0.26 -0.37 1.25 -1.51 0.00 0.00 179.97 179.53 1s64 h HIS 241 N 0.41 0.04 -0.04 2.20 2.76 -1.04 -2.12 115.15 117.36 1s64 h HIS 241 Ca 0.17 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.33 1s64 h HIS 241 Cb 0.08 -0.01 -0.00 0.00 1.55 0.00 0.00 27.41 29.03 1s64 h HIS 241 CO -0.10 0.40 0.01 0.35 -1.30 0.00 0.00 177.93 177.29 1s64 h PHE 242 N 0.03 0.08 0.47 5.26 3.57 -0.07 -1.73 116.94 124.55 1s64 h PHE 242 Ca 0.00 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 1s64 h PHE 242 Cb 0.68 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.40 1s64 h PHE 242 CO 0.00 0.30 -0.23 0.28 -2.23 0.00 0.00 178.31 176.44 1s64 h VAL 243 N -0.17 0.52 -0.05 1.41 2.07 -0.78 -2.84 116.25 116.42 1s64 h VAL 243 Ca 0.01 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1s64 h VAL 243 Cb 0.26 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 1s64 h VAL 243 CO 0.00 0.03 0.03 0.40 0.02 0.00 0.00 177.57 178.05 1s64 h ILE 244 N -0.74 1.01 0.00 4.57 2.04 -1.45 -2.15 117.51 120.80 1s64 h ILE 244 Ca -0.06 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1s64 h ILE 244 Cb 0.54 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 1s64 h ILE 244 CO 0.11 0.01 0.00 -1.54 0.00 0.00 0.00 178.15 176.73 1s64 n SER 245 N -5.06 0.63 -0.82 1.72 3.41 -0.65 -0.11 113.62 112.74 1s64 n SER 245 Ca -0.06 0.69 0.10 0.00 -0.26 0.00 0.00 58.87 59.34 1s64 n SER 245 Cb 0.03 -0.81 0.08 0.00 -0.26 0.00 0.00 64.21 63.26 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 -2.23 2.71 0.00 4.04 3.02 -0.99 -4.42 115.26 117.40 1s64 n ASN 246 Ca 0.01 -1.86 0.00 0.00 -0.03 0.00 0.00 54.58 52.70 1s64 n ASN 246 Cb 0.18 0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 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 1.15 0.00 0.07 3.41 -2.24 -0.83 -4.94 114.28 110.90 1s64 n THR 247 Ca 0.12 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.80 1s64 n THR 247 Cb 0.52 -0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.75 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 1.43 0.00 4.28 1.35 -1.77 -3.50 112.91 114.70 1s64 h THR 248 Ca 0.00 -2.37 0.00 0.00 -0.55 0.00 0.00 66.41 63.49 1s64 h THR 248 Cb 0.00 2.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.72 1s64 h THR 248 CO 0.00 0.70 0.00 0.61 -0.25 0.00 0.00 175.52 176.58 1s64 n GLY 249 N 0.73 -2.94 0.39 5.82 0.00 0.84 -4.69 105.19 105.34 1s64 n GLY 249 Ca -0.04 -1.73 0.05 0.00 0.00 0.00 0.00 46.02 44.29 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 -0.63 0.03 0.30 1.61 4.02 -1.26 -4.55 117.16 116.68 1s64 n TYR 250 Ca 0.00 -0.04 0.17 0.00 -0.01 0.00 0.00 57.90 58.02 1s64 n TYR 250 Cb 0.00 -0.00 0.73 0.00 -0.02 0.00 0.00 39.34 40.05 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 1.84 0.00 -3.29 7.72 4.64 -2.00 -3.39 113.55 119.08 1s64 h SER 251 Ca 0.00 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.77 1s64 h SER 251 Cb 0.42 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.44 1s64 h SER 251 CO 0.00 0.00 0.98 -0.62 -0.87 0.00 0.00 176.83 176.32 1s64 s ASP 252 N -5.35 6.46 0.52 4.97 3.68 -1.26 -4.89 116.67 120.80 1s64 s ASP 252 Ca 0.01 0.23 0.35 0.00 2.13 0.00 0.00 52.55 55.27 1s64 s ASP 252 Cb 0.09 -2.55 1.49 0.00 -1.45 0.00 0.00 42.92 40.50 1s64 s ASP 252 CO 0.49 -1.45 1.77 0.03 0.13 0.00 0.00 175.17 176.14 1s64 h ARG 253 N 9.65 0.07 -0.23 4.34 3.08 -1.98 0.48 114.38 129.78 1s64 h ARG 253 Ca -0.25 -0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.66 1s64 h ARG 253 Cb 1.06 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 1s64 h ARG 253 CO 1.17 0.04 -0.43 0.00 -1.07 0.00 0.00 179.97 179.69 1s64 h ALA 254 N 1.42 0.83 -0.05 0.04 0.00 -1.93 -1.53 119.26 118.05 1s64 h ALA 254 Ca 0.62 -0.45 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1s64 h ALA 254 Cb 2.30 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.99 1s64 h ALA 254 CO -0.08 0.65 -0.17 0.28 0.00 0.00 0.00 179.25 179.93 1s64 h VAL 255 N 0.45 1.46 -0.45 0.00 2.07 -0.44 -2.02 116.25 117.32 1s64 h VAL 255 Ca 0.03 -1.61 0.07 0.00 0.82 0.00 0.00 66.70 66.02 1s64 h VAL 255 Cb 0.93 2.39 -0.06 0.00 -1.52 0.00 0.00 31.29 33.03 1s64 h VAL 255 CO 0.08 0.44 0.10 0.25 0.02 0.00 0.00 177.57 178.46 1s64 h LEU 256 N -0.35 0.03 -0.48 2.57 5.85 -1.26 0.05 115.31 121.72 1s64 h LEU 256 Ca -0.01 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1s64 h LEU 256 Cb 0.81 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.92 1s64 h LEU 256 CO 0.04 0.05 0.25 -0.08 -0.34 0.00 0.00 178.44 178.35 1s64 h GLU 257 N 0.24 0.67 -0.68 1.25 4.22 -1.31 0.73 114.58 119.70 1s64 h GLU 257 Ca 0.22 -0.09 0.03 0.00 0.08 0.00 0.00 59.36 59.60 1s64 h GLU 257 Cb 0.27 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 1s64 h GLU 257 CO -0.28 0.54 0.42 -0.09 -2.18 0.00 0.00 179.01 177.42 1s64 h ARG 258 N 0.63 0.79 -0.16 1.92 2.43 -0.57 -0.89 114.38 118.53 1s64 h ARG 258 Ca 0.17 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.22 1s64 h ARG 258 Cb 0.08 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.45 1s64 h ARG 258 CO -0.02 0.52 -0.17 0.93 -1.51 0.00 0.00 179.97 179.72 1s64 h GLU 259 N 0.81 0.40 -0.92 0.20 4.39 -0.61 -0.57 114.58 118.28 1s64 h GLU 259 Ca 0.27 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1s64 h GLU 259 Cb 0.03 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.65 1s64 h GLU 259 CO -0.11 0.78 0.58 0.28 -1.16 0.00 0.00 179.01 179.38 1s64 h VAL 260 N 0.04 1.25 -0.39 3.13 2.07 -0.74 -0.59 116.25 121.01 1s64 h VAL 260 Ca 0.02 -0.49 -0.10 0.00 0.82 0.00 0.00 66.70 66.96 1s64 h VAL 260 Cb 0.72 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 1s64 h VAL 260 CO 0.04 0.25 -0.13 -0.61 0.02 0.00 0.00 177.57 177.14 1s64 h GLN 261 N 1.26 0.78 -0.62 1.57 5.75 -1.10 -2.00 115.11 120.75 1s64 h GLN 261 Ca 0.33 -0.31 0.01 0.00 -0.15 0.00 0.00 58.65 58.53 1s64 h GLN 261 Cb -0.10 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.38 1s64 h GLN 261 CO -0.07 0.93 0.41 -0.92 -2.65 0.00 0.00 178.83 176.53 1s64 h TYR 262 N 0.58 0.78 -0.14 3.99 3.20 -0.57 -2.04 116.97 122.78 1s64 h TYR 262 Ca 0.09 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 1s64 h TYR 262 Cb 0.66 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.66 1s64 h TYR 262 CO 0.05 0.49 0.01 1.15 -1.64 0.00 0.00 178.16 178.23 1s64 h THR 263 N 0.84 1.23 -0.74 1.81 2.02 -1.05 -2.09 112.91 114.93 1s64 h THR 263 Ca 0.23 -0.75 0.10 0.00 0.77 0.00 0.00 66.41 66.76 1s64 h THR 263 Cb -0.10 1.46 -0.05 0.00 -1.74 0.00 0.00 68.15 67.72 1s64 h THR 263 CO -0.05 0.22 0.49 -0.07 0.37 0.00 0.00 175.52 176.48 1s64 h LEU 264 N -0.00 0.58 -0.51 2.58 3.38 -1.20 0.36 115.31 120.50 1s64 h LEU 264 Ca 0.04 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1s64 h LEU 264 Cb 0.32 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1s64 h LEU 264 CO 0.00 0.35 -0.00 -0.33 0.09 0.00 0.00 178.44 178.55 1s64 h GLU 265 N 0.65 0.91 -0.31 1.13 4.39 -1.08 -0.35 114.58 119.92 1s64 h GLU 265 Ca 0.34 -0.29 -0.12 0.00 0.34 0.00 0.00 59.36 59.63 1s64 h GLU 265 Cb 0.47 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 1s64 h GLU 265 CO -0.12 0.94 -0.29 0.52 -1.16 0.00 0.00 179.01 178.89 1s64 h MET 266 N 0.78 0.63 -0.59 2.33 2.86 -0.31 -2.51 114.93 118.11 1s64 h MET 266 Ca 0.14 -0.27 -0.08 0.00 -2.06 0.00 0.00 59.70 57.43 1s64 h MET 266 Cb 0.53 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.15 1s64 h MET 266 CO 0.03 0.85 0.05 0.82 1.06 0.00 0.00 176.91 179.72 1s64 h ILE 267 N 0.54 1.26 -0.26 -1.22 2.04 -0.08 -2.16 117.51 117.64 1s64 h ILE 267 Ca 0.07 -1.06 -0.03 0.00 1.00 0.00 0.00 64.86 64.84 1s64 h ILE 267 Cb 0.77 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 1s64 h ILE 267 CO 0.06 0.39 0.04 0.11 0.00 0.00 0.00 178.15 178.75 1s64 h LYS 268 N 0.91 0.37 -0.11 2.37 1.57 -0.81 0.19 116.57 121.06 1s64 h LYS 268 Ca 0.17 -0.06 -0.18 0.00 -1.87 0.00 0.00 60.65 58.72 1s64 h LYS 268 Cb 0.48 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.72 1s64 h LYS 268 CO 0.02 0.37 -0.70 -0.07 -0.57 0.00 0.00 179.45 178.50 1s64 h LEU 269 N 0.37 0.57 -6.14 2.94 4.07 -1.03 -3.39 115.31 112.69 1s64 h LEU 269 Ca 0.09 -0.36 -0.42 0.00 0.08 0.00 0.00 57.88 57.27 1s64 h LEU 269 Cb 0.19 -0.17 -0.31 0.00 1.08 0.00 0.00 40.66 41.44 1s64 h LEU 269 CO -0.00 1.09 -0.77 -0.69 -1.08 0.00 0.00 178.44 177.00 1s64 s VAL 270 N -3.71 -0.18 0.54 1.22 1.01 -0.85 -5.03 120.40 113.40 1s64 s VAL 270 Ca -0.07 -1.62 0.22 0.00 0.00 0.00 0.00 61.98 60.52 1s64 s VAL 270 Cb 0.10 -0.79 0.33 0.00 0.00 0.00 0.00 36.38 36.03 1s64 s VAL 270 CO 0.85 -0.74 2.11 1.55 0.00 0.00 0.00 175.10 178.86 1s64 h PRO 271 N 6.21 0.00 -3.52 2.72 0.13 -0.86 -3.30 132.00 133.38 1s64 h PRO 271 Ca 0.13 0.00 -0.79 0.00 -0.87 0.00 0.00 66.00 64.47 1s64 h PRO 271 Cb 1.01 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 31.89 1s64 h PRO 271 CO 0.23 0.00 0.96 1.58 -0.23 0.00 0.00 178.00 180.54 1s64 n HIS 272 N -4.28 3.83 -3.48 1.56 -0.00 -1.26 -4.85 115.22 106.74 1s64 n HIS 272 Ca 0.01 -3.19 -0.22 0.00 0.46 0.00 0.00 57.72 54.78 1s64 n HIS 272 Cb 0.28 -1.67 -0.12 0.00 -0.12 0.00 0.00 29.99 28.36 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 0.41 2.42 0.26 0.26 2.47 -1.24 -5.03 114.94 114.49 1s64 s ASN 273 Ca 0.34 -0.90 -0.02 0.00 0.42 0.00 0.00 52.86 52.70 1s64 s ASN 273 Cb -0.01 0.12 0.44 0.00 -1.45 0.00 0.00 41.25 40.34 1s64 s ASN 273 CO 0.01 -0.40 1.84 -0.08 -3.72 0.00 0.00 177.10 174.76 1s64 h GLU 274 N 8.33 0.96 -0.40 0.43 4.81 -1.94 -2.72 114.58 124.06 1s64 h GLU 274 Ca -0.16 -0.06 0.06 0.00 -0.13 0.00 0.00 59.36 59.06 1s64 h GLU 274 Cb 1.06 -0.22 -0.05 0.00 0.63 0.00 0.00 28.75 30.17 1s64 h GLU 274 CO 0.37 0.64 0.11 0.77 -0.73 0.00 0.00 179.01 180.16 1s64 h SER 275 N 0.99 0.07 -0.44 1.04 0.02 -1.92 0.21 113.55 113.53 1s64 h SER 275 Ca 0.43 0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 61.42 1s64 h SER 275 Cb 0.31 0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.90 1s64 h SER 275 CO -0.22 0.08 0.17 0.00 -1.14 0.00 0.00 176.83 175.72 1s64 h ALA 276 N 1.29 0.57 -0.30 3.77 0.00 -1.79 -1.75 119.26 121.05 1s64 h ALA 276 Ca 0.19 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1s64 h ALA 276 Cb 0.21 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1s64 h ALA 276 CO -0.23 0.18 -0.16 -1.49 0.00 0.00 0.00 179.25 177.55 1s64 h TRP 277 N 0.56 0.58 -0.23 0.00 4.06 -1.25 -1.69 115.95 117.96 1s64 h TRP 277 Ca 0.14 -0.10 -0.11 0.00 2.06 0.00 0.00 58.89 60.89 1s64 h TRP 277 Cb 0.20 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 28.20 1s64 h TRP 277 CO 0.00 0.67 -0.30 -0.91 -3.56 0.00 0.00 178.44 174.33 1s64 h ASN 278 N 0.48 0.49 0.07 -3.49 2.35 -0.30 -1.45 115.58 113.73 1s64 h ASN 278 Ca 0.08 -0.18 -0.00 0.00 -0.55 0.00 0.00 56.30 55.65 1s64 h ASN 278 Cb 0.56 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.80 1s64 h ASN 278 CO 0.04 0.77 -0.03 0.22 -1.65 0.00 0.00 177.43 176.77 1s64 h TYR 279 N 0.41 -0.09 -0.25 1.19 3.20 -0.99 0.24 116.97 120.68 1s64 h TYR 279 Ca 0.05 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.98 1s64 h TYR 279 Cb 0.74 0.03 -0.06 0.00 1.54 0.00 0.00 36.73 38.98 1s64 h TYR 279 CO 0.02 0.27 -0.15 1.25 -1.64 0.00 0.00 178.16 177.91 1s64 h LEU 280 N -0.46 -0.49 -0.85 2.82 5.85 -1.20 -0.71 115.31 120.28 1s64 h LEU 280 Ca -0.01 0.11 -0.10 0.00 0.84 0.00 0.00 57.88 58.72 1s64 h LEU 280 Cb 0.39 0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 1s64 h LEU 280 CO 0.02 -0.19 -0.23 0.50 -0.34 0.00 0.00 178.44 178.20 1s64 h LYS 281 N -0.13 0.60 -0.64 1.25 3.64 -1.26 -3.11 116.57 116.93 1s64 h LYS 281 Ca 0.14 -0.23 0.01 0.00 -1.27 0.00 0.00 60.65 59.29 1s64 h LYS 281 Cb 0.33 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.09 1s64 h LYS 281 CO -0.33 0.78 0.42 0.78 -2.27 0.00 0.00 179.45 178.83 1s64 h GLY 282 N 1.00 0.91 1.10 5.01 0.00 0.59 0.18 103.07 111.85 1s64 h GLY 282 Ca 0.08 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1s64 h GLY 282 CO 0.05 0.34 -0.03 0.29 0.00 0.00 0.00 176.54 177.18 1s64 n ILE 283 N -4.63 0.00 -0.01 2.60 -5.35 -0.38 -4.01 119.36 107.58 1s64 n ILE 283 Ca 0.05 -0.03 -0.00 0.00 -0.27 0.00 0.00 62.75 62.50 1s64 n ILE 283 Cb 0.02 -0.33 -0.01 0.00 -1.74 0.00 0.00 39.64 37.58 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 -1.03 0.00 -0.29 7.28 4.77 -0.99 -4.78 117.00 121.95 1s64 n LEU 284 Ca 0.17 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.29 1s64 n LEU 284 Cb 0.22 0.03 0.39 0.00 -2.33 0.00 0.00 43.42 41.72 1s64 n LEU 284 CO 0.21 0.03 1.22 0.06 -1.33 0.00 0.00 177.39 177.58 1s64 h GLN 285 N 0.00 0.65 0.00 3.23 3.07 -0.80 -1.63 115.11 119.63 1s64 h GLN 285 Ca -0.03 -0.04 -0.07 0.00 0.09 0.00 0.00 58.65 58.60 1s64 h GLN 285 Cb 0.72 -0.15 -0.01 0.00 0.08 0.00 0.00 27.48 28.13 1s64 h GLN 285 CO 0.00 0.43 -0.40 -0.44 0.09 0.00 0.00 178.83 178.51 1s64 h ASP 286 N 0.67 0.00 1.17 0.06 3.45 -1.84 -3.09 116.42 116.84 1s64 h ASP 286 Ca 0.49 0.00 -0.12 0.00 0.43 0.00 0.00 57.03 57.83 1s64 h ASP 286 Cb 0.87 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.62 1s64 h ASP 286 CO -0.25 0.34 -0.59 0.03 -1.57 0.00 0.00 179.24 177.20 1s64 h ARG 287 N 0.00 0.00 0.00 3.56 2.47 -1.64 -3.48 114.38 115.29 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 1.27 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.59 1s64 h ARG 287 CO 0.04 0.59 0.00 0.41 0.56 0.00 0.00 179.97 181.58 1s64 n GLY 288 N 0.96 1.60 0.38 0.04 0.00 -0.71 -4.86 105.19 102.60 1s64 n GLY 288 Ca 0.01 -0.80 0.18 0.00 0.00 0.00 0.00 46.02 45.41 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 0.18 0.00 0.99 3.38 -1.76 -1.32 115.31 116.78 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 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1s64 h LEU 289 CO 0.00 0.10 0.00 -1.54 0.09 0.00 0.00 178.44 177.09 1s64 n SER 290 N -4.42 0.00 -0.39 -0.43 3.41 -1.26 -3.15 113.62 107.38 1s64 n SER 290 Ca 0.12 0.10 0.12 0.00 -0.26 0.00 0.00 58.87 58.94 1s64 n SER 290 Cb 0.58 -0.33 0.49 0.00 -0.26 0.00 0.00 64.21 64.69 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 -1.33 1.52 -3.59 4.33 1.74 -0.50 -4.49 116.66 114.34 1s64 n ARG 291 Ca 0.09 -0.77 -0.27 0.00 -0.77 0.00 0.00 57.85 56.13 1s64 n ARG 291 Cb 0.18 -1.40 -0.10 0.00 -1.02 0.00 0.00 32.46 30.12 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 -0.03 3.28 -0.35 -1.55 4.01 -1.19 -4.97 117.16 116.36 1s64 n TYR 292 Ca 0.17 -4.18 0.16 0.00 -0.16 0.00 0.00 57.90 53.89 1s64 n TYR 292 Cb 0.27 -0.56 0.38 0.00 -0.31 0.00 0.00 39.34 39.11 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 0.61 0.00 -0.72 0.13 -1.87 -0.58 132.00 134.22 1s64 h PRO 293 Ca 0.18 -0.04 -0.07 0.00 -0.87 0.00 0.00 66.00 65.21 1s64 h PRO 293 Cb 0.71 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 31.69 1s64 h PRO 293 CO 0.77 0.40 -0.31 -0.91 -0.23 0.00 0.00 178.00 177.72 1s64 h ASN 294 N 0.63 0.00 -0.21 1.44 2.35 -1.99 -2.96 115.58 114.83 1s64 h ASN 294 Ca 0.62 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.35 1s64 h ASN 294 Cb 1.14 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.50 1s64 h ASN 294 CO -0.43 0.31 0.06 0.25 -1.65 0.00 0.00 177.43 175.97 1s64 h LEU 295 N 0.00 0.32 -0.17 1.61 5.85 -1.51 0.05 115.31 121.46 1s64 h LEU 295 Ca -0.00 -0.22 0.05 0.00 0.84 0.00 0.00 57.88 58.54 1s64 h LEU 295 Cb 0.68 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.58 1s64 h LEU 295 CO 0.04 0.46 -0.16 0.25 -0.34 0.00 0.00 178.44 178.69 1s64 h LEU 296 N 0.17 -0.50 -0.62 2.25 5.85 -1.46 -0.79 115.31 120.21 1s64 h LEU 296 Ca 0.07 0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.78 1s64 h LEU 296 Cb 0.26 0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 1s64 h LEU 296 CO 0.00 -0.20 -0.05 0.78 -0.34 0.00 0.00 178.44 178.63 1s64 h ASN 297 N -0.18 1.02 -0.17 1.25 2.35 -1.48 -1.13 115.58 117.25 1s64 h ASN 297 Ca 0.11 -0.31 -0.03 0.00 -0.55 0.00 0.00 56.30 55.52 1s64 h ASN 297 Cb 0.34 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 1s64 h ASN 297 CO -0.28 1.10 0.03 1.56 -1.65 0.00 0.00 177.43 178.19 1s64 h GLN 298 N 0.94 0.39 0.00 0.81 4.20 -0.60 -1.64 115.11 119.21 1s64 h GLN 298 Ca 0.16 -0.06 -0.18 0.00 0.06 0.00 0.00 58.65 58.63 1s64 h GLN 298 Cb 0.60 -0.07 0.01 0.00 0.30 0.00 0.00 27.48 28.33 1s64 h GLN 298 CO 0.04 0.40 -0.69 -0.07 -0.67 0.00 0.00 178.83 177.84 1s64 h LEU 299 N 0.38 0.60 -2.33 1.46 3.38 -0.90 -3.08 115.31 114.82 1s64 h LEU 299 Ca 0.09 -0.76 0.03 0.00 0.09 0.00 0.00 57.88 57.33 1s64 h LEU 299 Cb 0.21 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1s64 h LEU 299 CO 0.00 1.28 0.11 -0.07 0.09 0.00 0.00 178.44 179.86 1s64 h LEU 300 N -0.02 0.00 0.00 1.67 3.38 -0.83 0.80 115.31 120.31 1s64 h LEU 300 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1s64 h LEU 300 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1s64 h LEU 300 CO 0.14 0.00 -0.18 0.44 0.09 0.00 0.00 178.44 178.93 1s64 h ASP 301 N 0.00 0.00 0.86 -0.43 3.32 -1.23 -3.23 116.42 115.72 1s64 h ASP 301 Ca 0.05 -0.04 -0.18 0.00 0.02 0.00 0.00 57.03 56.88 1s64 h ASP 301 Cb 0.27 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.79 1s64 h ASP 301 CO -0.00 0.02 -1.23 -0.07 -1.72 0.00 0.00 179.24 176.24 1s64 h LEU 302 N 0.00 0.00 -0.93 1.55 3.38 -0.77 -3.37 115.31 115.17 1s64 h LEU 302 Ca 0.00 0.00 0.26 0.00 0.09 0.00 0.00 57.88 58.23 1s64 h LEU 302 Cb 0.81 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.42 1s64 h LEU 302 CO 0.00 0.68 0.37 1.56 0.09 0.00 0.00 178.44 181.14 1s64 h GLN 303 N 0.00 0.27 -0.09 1.13 4.20 -1.48 -0.76 115.11 118.37 1s64 h GLN 303 Ca -0.13 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.59 1s64 h GLN 303 Cb 1.63 -0.06 -0.06 0.00 0.30 0.00 0.00 27.48 29.29 1s64 h GLN 303 CO 0.06 0.18 -0.50 -1.35 -0.67 0.00 0.00 178.83 176.55 1s64 h PRO 304 N 0.28 -0.56 0.00 1.46 0.11 -1.78 -3.29 132.00 128.21 1s64 h PRO 304 Ca 0.62 0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.77 1s64 h PRO 304 Cb 1.30 0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.54 1s64 h PRO 304 CO -0.62 -0.37 -0.81 -1.13 -0.21 0.00 0.00 178.00 174.85 1s64 n SER 305 N -5.45 1.78 -1.29 -2.05 3.41 -0.99 -4.66 113.62 104.38 1s64 n SER 305 Ca -0.06 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.85 1s64 n SER 305 Cb 0.38 -0.66 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 -4.27 0.00 -1.40 7.33 8.25 -0.33 -4.91 115.22 119.89 1s64 n HIS 306 Ca -0.11 -0.50 -0.31 0.00 -0.26 0.00 0.00 57.72 56.54 1s64 n HIS 306 Cb 0.42 -0.30 0.07 0.00 1.12 0.00 0.00 29.99 31.30 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 1.44 4.84 -0.19 0.41 0.15 -1.21 -4.74 113.70 114.40 1s64 s SER 307 Ca 0.00 1.77 -0.34 0.00 0.70 0.00 0.00 55.95 58.08 1s64 s SER 307 Cb 0.00 -2.52 0.14 0.00 -1.71 0.00 0.00 66.02 61.94 1s64 s SER 307 CO 0.00 -1.81 1.20 -0.94 1.20 0.00 0.00 173.24 172.89 1s64 s SER 308 N -3.46 -0.14 0.48 5.45 1.04 -1.26 -4.85 113.70 110.96 1s64 s SER 308 Ca 0.61 0.02 0.14 0.00 0.48 0.00 0.00 55.95 57.19 1s64 s SER 308 Cb -0.16 0.15 1.14 0.00 0.10 0.00 0.00 66.02 67.24 1s64 s SER 308 CO 0.54 -0.23 2.10 1.55 0.98 0.00 0.00 173.24 178.18 1s64 h PRO 309 N 2.03 0.19 -0.76 4.02 0.13 -1.94 -1.93 132.00 133.74 1s64 h PRO 309 Ca -0.10 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.99 1s64 h PRO 309 Cb 1.17 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.22 1s64 h PRO 309 CO 0.23 0.13 0.36 1.88 -0.23 0.00 0.00 178.00 180.37 1s64 h TYR 310 N 0.20 1.10 -0.19 1.56 0.99 -1.95 -0.57 116.97 118.10 1s64 h TYR 310 Ca 0.08 -0.06 -0.05 0.00 2.00 0.00 0.00 58.73 60.71 1s64 h TYR 310 Cb 0.08 -0.34 -0.01 0.00 1.00 0.00 0.00 36.73 37.47 1s64 h TYR 310 CO -0.00 0.81 -0.06 1.25 -0.00 0.00 0.00 178.16 180.16 1s64 h LEU 311 N 1.07 0.39 -0.80 3.88 6.46 -1.72 -0.54 115.31 124.05 1s64 h LEU 311 Ca 0.26 -0.38 0.04 0.00 -0.12 0.00 0.00 57.88 57.68 1s64 h LEU 311 Cb 0.13 -0.11 -0.05 0.00 -0.73 0.00 0.00 40.66 39.90 1s64 h LEU 311 CO -0.03 0.68 0.51 0.40 -0.62 0.00 0.00 178.44 179.38 1s64 h ILE 312 N 0.09 1.11 -0.62 4.05 1.08 -1.25 -0.03 117.51 121.94 1s64 h ILE 312 Ca 0.05 -0.34 -0.04 0.00 -0.39 0.00 0.00 64.86 64.14 1s64 h ILE 312 Cb 0.52 0.04 -0.03 0.00 -3.07 0.00 0.00 36.82 34.28 1s64 h ILE 312 CO 0.02 0.18 0.23 0.00 -0.69 0.00 0.00 178.15 177.89 1s64 h ALA 313 N 1.34 0.81 -0.52 1.87 0.00 -0.96 -1.11 119.26 120.69 1s64 h ALA 313 Ca 0.32 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 55.07 1s64 h ALA 313 Cb 0.03 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1s64 h ALA 313 CO -0.12 0.45 0.32 0.35 0.00 0.00 0.00 179.25 180.25 1s64 h PHE 314 N 0.88 0.60 -0.69 0.00 3.57 -0.01 -0.66 116.94 120.64 1s64 h PHE 314 Ca 0.21 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.72 1s64 h PHE 314 Cb 0.24 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.75 1s64 h PHE 314 CO 0.01 0.35 0.42 -0.07 -2.23 0.00 0.00 178.31 176.79 1s64 h LEU 315 N 0.64 0.83 -0.58 0.59 3.38 -0.65 0.05 115.31 119.56 1s64 h LEU 315 Ca 0.20 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.14 1s64 h LEU 315 Cb -0.01 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 1s64 h LEU 315 CO -0.08 0.64 0.36 0.58 0.09 0.00 0.00 178.44 180.03 1s64 h VAL 316 N 0.94 1.07 -0.74 1.22 2.07 -0.60 0.02 116.25 120.23 1s64 h VAL 316 Ca 0.25 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 1s64 h VAL 316 Cb -0.03 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.01 1s64 h VAL 316 CO -0.05 0.13 0.33 0.44 0.02 0.00 0.00 177.57 178.44 1s64 h ASP 317 N 0.70 0.98 -0.27 0.57 3.45 -0.42 0.96 116.42 122.39 1s64 h ASP 317 Ca 0.23 -0.13 -0.01 0.00 0.43 0.00 0.00 57.03 57.55 1s64 h ASP 317 Cb 0.02 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 38.53 1s64 h ASP 317 CO -0.10 0.84 0.11 0.40 -1.57 0.00 0.00 179.24 178.93 1s64 h ILE 318 N 1.06 1.17 -0.92 0.35 2.04 -0.32 -0.79 117.51 120.09 1s64 h ILE 318 Ca 0.25 -0.51 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 1s64 h ILE 318 Cb 0.15 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.20 1s64 h ILE 318 CO -0.03 0.17 0.55 1.88 0.00 0.00 0.00 178.15 180.73 1s64 h TYR 319 N 0.28 1.21 -0.30 1.37 0.99 -0.51 -2.15 116.97 117.86 1s64 h TYR 319 Ca 0.09 -0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.72 1s64 h TYR 319 Cb 0.17 -0.40 -0.01 0.00 1.00 0.00 0.00 36.73 37.49 1s64 h TYR 319 CO -0.01 0.81 -0.21 1.49 -0.00 0.00 0.00 178.16 180.23 1s64 h GLU 320 N 1.27 0.57 -0.35 4.88 4.81 -0.46 -1.86 114.58 123.44 1s64 h GLU 320 Ca 0.33 -0.21 -0.07 0.00 -0.13 0.00 0.00 59.36 59.28 1s64 h GLU 320 Cb -0.05 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1s64 h GLU 320 CO -0.06 0.75 -0.07 0.22 -0.73 0.00 0.00 179.01 179.11 1s64 h ASP 321 N 0.51 0.57 0.43 1.04 -0.00 -0.67 -1.41 116.42 116.88 1s64 h ASP 321 Ca 0.08 -0.14 -0.02 0.00 -0.00 0.00 0.00 57.03 56.95 1s64 h ASP 321 Cb 0.65 -0.15 0.00 0.00 -0.00 0.00 0.00 39.33 39.83 1s64 h ASP 321 CO 0.05 0.69 -0.21 0.24 -0.00 0.00 0.00 179.24 180.01 1s64 h MET 322 N 0.55 -0.56 -0.85 0.28 2.86 -0.93 -2.21 114.93 114.07 1s64 h MET 322 Ca 0.11 0.04 0.18 0.00 -2.06 0.00 0.00 59.70 57.96 1s64 h MET 322 Cb 0.46 0.13 -0.06 0.00 0.06 0.00 0.00 31.60 32.19 1s64 h MET 322 CO 0.02 -0.29 0.56 -0.07 1.06 0.00 0.00 176.91 178.20 1s64 h LEU 323 N -0.74 0.42 -0.94 1.22 3.38 -1.17 0.14 115.31 117.61 1s64 h LEU 323 Ca -0.06 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 1s64 h LEU 323 Cb 0.52 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1s64 h LEU 323 CO 0.10 0.19 -0.06 -0.08 0.09 0.00 0.00 178.44 178.67 1s64 h GLU 324 N 0.43 0.70 -1.62 1.13 4.57 -0.96 -3.16 114.58 115.68 1s64 h GLU 324 Ca 0.43 -0.20 -0.69 0.00 -1.18 0.00 0.00 59.36 57.72 1s64 h GLU 324 Cb 1.03 -0.07 -0.26 0.00 -0.16 0.00 0.00 28.75 29.28 1s64 h GLU 324 CO -0.16 0.76 0.90 0.09 -1.18 0.00 0.00 179.01 179.42 1s64 n ASN 325 N -4.20 7.44 -3.51 1.04 3.02 0.47 -4.93 115.26 114.59 1s64 n ASN 325 Ca 0.02 -3.72 -0.16 0.00 -0.03 0.00 0.00 54.58 50.69 1s64 n ASN 325 Cb 0.32 -1.05 0.00 0.00 -0.61 0.00 0.00 39.78 38.44 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 -0.49 -0.68 -1.95 3.52 10.64 -1.19 -4.90 117.38 122.32 1s64 n GLN 326 Ca 0.55 -0.01 -0.30 0.00 -1.83 0.00 0.00 57.00 55.42 1s64 n GLN 326 Cb 0.43 -0.70 0.20 0.00 -0.86 0.00 0.00 30.24 29.32 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 -5.90 7.24 -0.52 0.00 -0.00 -1.26 -3.93 116.67 112.30 1s64 s ASP 328 Ca 0.76 1.47 -0.03 0.00 -0.00 0.00 0.00 52.55 54.75 1s64 s ASP 328 Cb -0.02 -2.44 0.00 0.00 -0.00 0.00 0.00 42.92 40.46 1s64 s ASP 328 CO 0.53 0.19 0.36 0.59 -0.00 0.00 0.00 175.17 176.84 1s64 n ASN 329 N 1.92 -3.47 -0.34 0.27 3.02 -1.26 -4.82 115.26 110.58 1s64 n ASN 329 Ca -0.07 -0.17 0.02 0.00 -0.03 0.00 0.00 54.58 54.34 1s64 n ASN 329 Cb 0.50 -2.15 0.08 0.00 -0.61 0.00 0.00 39.78 37.61 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 -0.83 -0.02 0.00 3.52 3.64 -1.98 0.41 116.57 121.31 1s64 h LYS 330 Ca -0.20 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.12 1s64 h LYS 330 Cb 1.13 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.95 1s64 h LYS 330 CO 0.21 -0.01 -0.27 1.49 -2.27 0.00 0.00 179.45 178.59 1s64 h GLU 331 N -0.02 0.00 0.11 1.90 4.57 -1.92 -1.25 114.58 117.97 1s64 h GLU 331 Ca 0.39 0.00 -0.27 0.00 -1.18 0.00 0.00 59.36 58.31 1s64 h GLU 331 Cb 0.64 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.23 1s64 h GLU 331 CO -0.94 0.27 -1.19 0.22 -1.18 0.00 0.00 179.01 176.19 1s64 h ASP 332 N 0.00 0.44 -0.20 1.04 3.58 -0.67 -2.97 116.42 117.64 1s64 h ASP 332 Ca -0.00 -0.45 -0.04 0.00 0.42 0.00 0.00 57.03 56.96 1s64 h ASP 332 Cb 0.54 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.44 1s64 h ASP 332 CO 0.03 1.33 -0.04 0.40 -2.88 0.00 0.00 179.24 178.09 1s64 h ILE 333 N 0.10 1.28 -0.86 2.25 1.08 -0.65 -2.66 117.51 118.05 1s64 h ILE 333 Ca -0.12 -0.99 0.15 0.00 -0.39 0.00 0.00 64.86 63.51 1s64 h ILE 333 Cb 1.90 1.52 -0.10 0.00 -3.07 0.00 0.00 36.82 37.08 1s64 h ILE 333 CO 0.20 0.30 0.44 0.25 -0.69 0.00 0.00 178.15 178.65 1s64 h LEU 334 N 0.11 0.53 -1.13 1.44 5.85 -1.29 0.16 115.31 120.98 1s64 h LEU 334 Ca 0.05 0.10 -0.08 0.00 0.84 0.00 0.00 57.88 58.79 1s64 h LEU 334 Cb 0.47 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 1s64 h LEU 334 CO 0.02 0.21 -0.26 0.78 -0.34 0.00 0.00 178.44 178.85 1s64 h ASN 335 N 0.62 0.29 0.13 1.25 2.35 -1.36 -1.04 115.58 117.81 1s64 h ASN 335 Ca 0.48 -0.09 -0.13 0.00 -0.55 0.00 0.00 56.30 56.01 1s64 h ASN 335 Cb 0.69 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 1s64 h ASN 335 CO -0.37 0.55 -0.46 0.11 -1.65 0.00 0.00 177.43 175.61 1s64 h LYS 336 N 0.26 0.40 0.14 0.81 1.57 -0.64 -1.64 116.57 117.47 1s64 h LYS 336 Ca 0.04 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1s64 h LYS 336 Cb 0.60 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1s64 h LYS 336 CO 0.04 0.78 -0.07 0.00 -0.57 0.00 0.00 179.45 179.63 1s64 h ALA 337 N 1.19 -0.19 -1.01 3.86 0.00 -0.90 -2.73 119.26 119.48 1s64 h ALA 337 Ca 0.02 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 54.80 1s64 h ALA 337 Cb 0.93 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.72 1s64 h ALA 337 CO 0.08 -0.35 0.64 -0.07 0.00 0.00 0.00 179.25 179.55 1s64 h LEU 338 N -0.70 0.99 -1.11 0.00 3.38 -1.21 0.14 115.31 116.80 1s64 h LEU 338 Ca -0.02 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1s64 h LEU 338 Cb 0.51 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1s64 h LEU 338 CO 0.03 0.58 0.38 -0.33 0.09 0.00 0.00 178.44 179.19 1s64 h GLU 339 N 1.09 1.00 -0.04 1.13 5.08 -1.30 -1.12 114.58 120.42 1s64 h GLU 339 Ca 0.47 -0.12 -0.20 0.00 -1.00 0.00 0.00 59.36 58.51 1s64 h GLU 339 Cb 0.33 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 1s64 h GLU 339 CO -0.22 0.74 -0.82 -0.07 -1.00 0.00 0.00 179.01 177.65 1s64 h LEU 340 N 1.00 0.44 -0.47 1.33 3.38 -0.72 -2.14 115.31 118.12 1s64 h LEU 340 Ca 0.25 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1s64 h LEU 340 Cb 0.05 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1s64 h LEU 340 CO -0.04 1.08 0.22 0.00 0.09 0.00 0.00 178.44 179.80 1s64 h GLU 342 N 0.62 0.89 -0.52 0.00 4.57 -1.17 -0.54 114.58 118.43 1s64 h GLU 342 Ca 0.16 -0.24 -0.05 0.00 -1.18 0.00 0.00 59.36 58.05 1s64 h GLU 342 Cb 0.12 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.59 1s64 h GLU 342 CO -0.02 0.87 0.12 0.82 -1.18 0.00 0.00 179.01 179.62 1s64 h ILE 343 N 0.83 1.22 -0.14 2.32 2.04 -1.01 0.21 117.51 123.00 1s64 h ILE 343 Ca 0.16 -0.81 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 1s64 h ILE 343 Cb 0.45 0.70 -0.00 0.00 -0.74 0.00 0.00 36.82 37.22 1s64 h ILE 343 CO 0.02 0.30 -0.03 -0.07 0.00 0.00 0.00 178.15 178.37 1s64 h LEU 344 N 0.78 0.26 -0.00 1.44 3.38 -0.65 -0.97 115.31 119.54 1s64 h LEU 344 Ca 0.17 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 1s64 h LEU 344 Cb 0.30 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 1s64 h LEU 344 CO -0.00 0.56 0.00 0.00 0.09 0.00 0.00 178.44 179.09 1s64 h ALA 345 N 0.71 0.01 -0.01 1.53 0.00 -0.78 0.42 119.26 121.14 1s64 h ALA 345 Ca 0.04 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.66 1s64 h ALA 345 Cb 0.45 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1s64 h ALA 345 CO 0.01 -0.39 -0.79 0.87 0.00 0.00 0.00 179.25 178.96 1s64 h LYS 346 N -0.21 0.15 0.00 0.00 6.56 -0.65 -3.36 116.57 119.06 1s64 h LYS 346 Ca 0.00 -0.14 0.00 0.00 -1.06 0.00 0.00 60.65 59.45 1s64 h LYS 346 Cb 0.22 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 31.91 1s64 h LYS 346 CO -0.00 0.86 0.00 -0.85 -2.06 0.00 0.00 179.45 177.40 1s64 n GLU 347 N -3.69 0.00 0.01 3.15 -0.00 -0.66 -4.88 120.64 114.57 1s64 n GLU 347 Ca -0.03 0.00 -0.10 0.00 -0.00 0.00 0.00 57.16 57.04 1s64 n GLU 347 Cb 0.75 -0.41 -0.14 0.00 -0.00 0.00 0.00 31.44 31.64 1s64 n GLU 347 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 1s64 h LYS 348 N 0.00 0.05 -1.20 3.44 1.79 -1.17 -3.41 116.57 116.07 1s64 h LYS 348 Ca 0.00 -0.08 -0.38 0.00 -2.18 0.00 0.00 60.65 58.01 1s64 h LYS 348 Cb 0.00 0.03 -0.36 0.00 -1.58 0.00 0.00 32.23 30.32 1s64 h LYS 348 CO 0.00 0.74 -1.06 -3.47 -1.08 0.00 0.00 179.45 174.58 1s64 n ASP 349 N -3.20 0.62 -0.13 0.86 4.64 0.15 -4.61 116.55 114.87 1s64 n ASP 349 Ca -0.13 -2.87 0.18 0.00 -1.38 0.00 0.00 54.79 50.59 1s64 n ASP 349 Cb 1.02 -0.23 0.57 0.00 -1.04 0.00 0.00 41.12 41.44 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 2.18 0.75 0.00 5.18 1.35 -1.69 -1.63 112.91 119.04 1s64 h THR 350 Ca -0.04 -0.09 -0.00 0.00 -0.55 0.00 0.00 66.41 65.72 1s64 h THR 350 Cb 1.11 0.45 -0.00 0.00 -1.73 0.00 0.00 68.15 67.98 1s64 h THR 350 CO 0.42 0.05 -0.00 -0.29 -0.25 0.00 0.00 175.52 175.45 1s64 h ILE 351 N 0.27 0.14 -0.33 6.82 2.10 -1.90 0.28 117.51 124.90 1s64 h ILE 351 Ca 0.36 -0.01 -0.02 0.00 1.08 0.00 0.00 64.86 66.27 1s64 h ILE 351 Cb 1.00 1.01 -0.01 0.00 -1.09 0.00 0.00 36.82 37.73 1s64 h ILE 351 CO -0.09 0.00 0.01 0.54 -1.08 0.00 0.00 178.15 177.53 1s64 n ARG 352 N -3.28 3.20 -0.38 2.19 1.74 -0.62 -4.77 116.66 114.73 1s64 n ARG 352 Ca -0.03 -2.92 -0.03 0.00 -0.77 0.00 0.00 57.85 54.10 1s64 n ARG 352 Cb 0.08 -1.92 0.01 0.00 -1.02 0.00 0.00 32.46 29.61 1s64 n ARG 352 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1s64 n LYS 353 N -0.36 -0.27 0.22 5.56 4.81 0.99 -0.27 118.16 128.84 1s64 n LYS 353 Ca 0.24 1.50 0.09 0.00 -0.87 0.00 0.00 58.31 59.27 1s64 n LYS 353 Cb 0.97 -2.23 0.48 0.00 0.02 0.00 0.00 35.03 34.26 1s64 n LYS 353 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1s64 h GLU 354 N 0.00 0.00 -0.05 1.64 5.08 -1.86 -2.40 114.58 116.99 1s64 h GLU 354 Ca 0.30 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.58 1s64 h GLU 354 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1s64 h GLU 354 CO -0.96 0.25 -0.31 -0.92 -1.00 0.00 0.00 179.01 176.06 1s64 h TYR 355 N 0.00 0.41 -0.44 4.33 3.20 -1.00 -2.18 116.97 121.30 1s64 h TYR 355 Ca -0.00 -0.19 -0.05 0.00 3.14 0.00 0.00 58.73 61.63 1s64 h TYR 355 Cb 0.71 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.89 1s64 h TYR 355 CO 0.00 0.94 0.05 -1.49 -1.64 0.00 0.00 178.16 176.02 1s64 h TRP 356 N -0.22 0.70 -0.51 -3.82 4.06 -0.98 0.87 115.95 116.05 1s64 h TRP 356 Ca -0.02 -0.07 -0.09 0.00 2.06 0.00 0.00 58.89 60.77 1s64 h TRP 356 Cb 0.98 -0.20 -0.02 0.00 -1.00 0.00 0.00 29.16 28.92 1s64 h TRP 356 CO 0.14 0.63 -0.02 0.00 -3.56 0.00 0.00 178.44 175.63 1s64 h ARG 357 N 0.65 0.88 -0.59 0.49 2.47 -1.45 0.45 114.38 117.28 1s64 h ARG 357 Ca 0.14 -0.26 -0.06 0.00 -1.26 0.00 0.00 59.98 58.53 1s64 h ARG 357 Cb 0.32 -0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.53 1s64 h ARG 357 CO 0.01 0.89 0.12 -0.92 0.56 0.00 0.00 179.97 180.62 1s64 h TYR 358 N 0.81 1.02 -0.34 3.04 3.20 -0.65 -0.58 116.97 123.48 1s64 h TYR 358 Ca 0.15 -0.13 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 1s64 h TYR 358 Cb 0.52 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 1s64 h TYR 358 CO 0.03 0.88 0.14 0.82 -1.64 0.00 0.00 178.16 178.39 1s64 h ILE 359 N 0.87 1.18 0.15 1.81 1.08 -0.40 -1.12 117.51 121.07 1s64 h ILE 359 Ca 0.18 -0.53 0.02 0.00 -0.39 0.00 0.00 64.86 64.14 1s64 h ILE 359 Cb 0.39 0.91 -0.04 0.00 -3.07 0.00 0.00 36.82 35.01 1s64 h ILE 359 CO 0.01 0.19 -0.38 1.23 -0.69 0.00 0.00 178.15 178.51 1s64 h GLY 360 N 0.40 -0.76 0.33 5.37 0.00 -0.57 -0.35 103.07 107.50 1s64 h GLY 360 Ca 0.11 0.45 0.13 0.00 0.00 0.00 0.00 47.33 48.02 1s64 h GLY 360 CO -0.01 -0.27 0.44 3.21 0.00 0.00 0.00 176.54 179.91 1s64 h ARG 361 N -0.62 0.65 -0.92 4.80 3.08 -0.96 -1.19 114.38 119.22 1s64 h ARG 361 Ca 0.02 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1s64 h ARG 361 Cb 0.64 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.50 1s64 h ARG 361 CO -0.21 0.43 0.55 0.77 -1.07 0.00 0.00 179.97 180.45 1s64 h SER 362 N 0.67 1.11 -0.54 7.04 0.02 -0.40 -1.78 113.55 119.66 1s64 h SER 362 Ca 0.43 -0.07 -0.06 0.00 -0.84 0.00 0.00 61.79 61.26 1s64 h SER 362 Cb 0.55 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 1s64 h SER 362 CO -0.32 0.85 0.11 -0.07 -1.14 0.00 0.00 176.83 176.26 1s64 h LEU 363 N 1.27 0.84 -0.03 5.07 3.38 0.12 -2.89 115.31 123.08 1s64 h LEU 363 Ca 0.33 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1s64 h LEU 363 Cb -0.05 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.47 1s64 h LEU 363 CO -0.06 0.87 -0.01 -0.61 0.09 0.00 0.00 178.44 178.72 1s64 h GLN 364 N 0.78 0.05 0.00 1.13 4.15 -1.08 -1.51 115.11 118.63 1s64 h GLN 364 Ca 0.17 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.57 1s64 h GLN 364 Cb 0.37 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.06 1s64 h GLN 364 CO 0.01 0.43 0.00 -1.13 -1.93 0.00 0.00 178.83 176.20 1s64 n SER 365 N -4.86 0.00 -0.01 -0.69 3.41 -0.70 -2.09 113.62 108.68 1s64 n SER 365 Ca -0.08 0.04 0.04 0.00 -0.26 0.00 0.00 58.87 58.61 1s64 n SER 365 Cb 0.22 -0.20 -0.09 0.00 -0.26 0.00 0.00 64.21 63.88 1s64 n SER 365 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1s64 n LYS 366 N -1.20 0.64 -3.22 4.33 4.01 -1.04 -4.81 118.16 116.87 1s64 n LYS 366 Ca 0.05 -0.09 -0.24 0.00 -0.51 0.00 0.00 58.31 57.52 1s64 n LYS 366 Cb 0.06 -1.28 -0.06 0.00 -0.51 0.00 0.00 35.03 33.24 1s64 n LYS 366 CO 0.00 0.00 0.00 0.72 -1.11 0.00 0.00 177.40 177.01 1s64 n HIS 367 N -1.98 0.91 -1.58 2.13 8.25 -0.60 -5.09 115.22 117.26 1s64 n HIS 367 Ca -0.05 -3.77 0.00 0.00 -0.26 0.00 0.00 57.72 53.65 1s64 n HIS 367 Cb 0.39 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 31.08 1s64 n HIS 367 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41