#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 3.54 0.56 4.37 2.96 -1.26 -5.01 118.68 123.84 1s64 s LEU 56 Ca 0.00 -0.43 -0.20 0.00 -0.22 0.00 0.00 54.13 53.28 1s64 s LEU 56 Cb 0.00 -2.68 -0.05 0.00 0.50 0.00 0.00 46.19 43.96 1s64 s LEU 56 CO 0.00 -1.63 1.17 -0.24 -1.32 0.00 0.00 176.35 174.33 1s64 n SER 57 N 8.69 1.75 0.27 3.68 2.88 -1.26 -4.91 113.62 124.71 1s64 n SER 57 Ca 0.03 0.90 0.18 0.00 -1.33 0.00 0.00 58.87 58.65 1s64 n SER 57 Cb 0.48 -1.48 0.78 0.00 -0.75 0.00 0.00 64.21 63.24 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 0.99 0.00 -3.09 2.46 3.38 -1.99 -2.77 115.31 114.29 1s64 h LEU 58 Ca -0.49 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.45 1s64 h LEU 58 Cb 1.33 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.07 1s64 h LEU 58 CO 0.54 0.00 -0.13 -0.90 0.09 0.00 0.00 178.44 178.04 1s64 n ASP 59 N -2.97 2.47 -4.77 -0.43 5.68 -1.26 -4.96 116.55 110.31 1s64 n ASP 59 Ca -0.00 -3.37 -0.38 0.00 -0.50 0.00 0.00 54.79 50.54 1s64 n ASP 59 Cb 0.24 -0.50 -0.06 0.00 -1.14 0.00 0.00 41.12 39.66 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 -2.77 7.33 0.43 -1.12 0.15 -1.05 -4.92 113.70 111.76 1s64 s SER 60 Ca 0.37 1.98 0.16 0.00 0.70 0.00 0.00 55.95 59.16 1s64 s SER 60 Cb 0.33 -2.60 1.07 0.00 -1.71 0.00 0.00 66.02 63.11 1s64 s SER 60 CO 0.01 -0.08 1.93 -0.65 1.20 0.00 0.00 173.24 175.65 1s64 h PRO 61 N 3.48 0.38 -0.65 5.44 0.11 -1.95 -1.06 132.00 137.75 1s64 h PRO 61 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1s64 h PRO 61 Cb 1.20 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1s64 h PRO 61 CO 0.66 0.25 0.00 0.25 -0.21 0.00 0.00 178.00 178.95 1s64 n THR 62 N -4.47 2.06 -1.86 -1.15 -2.24 -1.26 -4.98 114.28 100.38 1s64 n THR 62 Ca 0.14 -1.11 -0.41 0.00 -2.27 0.00 0.00 64.05 60.40 1s64 n THR 62 Cb 0.52 -0.19 -0.00 0.00 -2.10 0.00 0.00 70.33 68.56 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 -2.25 2.64 -0.07 4.78 6.14 -0.41 -5.01 117.35 123.17 1s64 s TYR 63 Ca 0.45 1.24 0.03 0.00 0.64 0.00 0.00 57.07 59.43 1s64 s TYR 63 Cb 0.33 -3.93 0.01 0.00 0.42 0.00 0.00 41.96 38.79 1s64 s TYR 63 CO 0.16 -2.76 -0.14 0.08 0.64 0.00 0.00 175.55 173.53 1s64 s VAL 64 N -1.15 1.27 0.60 3.14 1.01 -1.26 -5.04 120.40 118.96 1s64 s VAL 64 Ca 0.54 -0.57 -0.19 0.00 0.00 0.00 0.00 61.98 61.77 1s64 s VAL 64 Cb -0.44 -1.14 -0.05 0.00 0.00 0.00 0.00 36.38 34.75 1s64 s VAL 64 CO 0.59 0.38 1.02 0.18 0.00 0.00 0.00 175.10 177.27 1s64 n LEU 65 N 3.69 3.97 0.16 3.92 4.77 -1.26 -4.85 117.00 127.40 1s64 n LEU 65 Ca -0.22 0.82 0.05 0.00 -0.03 0.00 0.00 56.01 56.64 1s64 n LEU 65 Cb 0.52 -1.41 0.52 0.00 -2.33 0.00 0.00 43.42 40.72 1s64 n LEU 65 CO 0.26 -1.70 1.03 1.88 -1.33 0.00 0.00 177.39 177.53 1s64 h TYR 66 N 0.58 0.18 0.00 -1.77 0.05 -1.96 -1.09 116.97 112.95 1s64 h TYR 66 Ca -0.49 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.29 1s64 h TYR 66 Cb 1.36 -0.06 0.00 0.00 1.01 0.00 0.00 36.73 39.04 1s64 h TYR 66 CO 0.38 0.18 0.00 2.89 -1.05 0.00 0.00 178.16 180.56 1s64 n ARG 67 N -4.44 0.10 -0.13 4.88 1.85 -1.26 -1.81 116.66 115.84 1s64 n ARG 67 Ca -0.01 0.37 0.07 0.00 -1.00 0.00 0.00 57.85 57.28 1s64 n ARG 67 Cb 0.14 -1.69 0.14 0.00 -1.05 0.00 0.00 32.46 29.99 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 -1.88 2.76 -4.75 2.89 8.00 -0.42 -4.97 116.55 118.18 1s64 n ASP 68 Ca 0.02 -1.82 -0.37 0.00 0.71 0.00 0.00 54.79 53.33 1s64 n ASP 68 Cb 0.18 -0.17 -0.06 0.00 -0.02 0.00 0.00 41.12 41.05 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 -1.09 4.20 0.22 -1.24 0.52 -0.75 -4.95 118.95 115.86 1s64 s ARG 69 Ca 0.24 0.28 -0.07 0.00 -0.52 0.00 0.00 55.73 55.66 1s64 s ARG 69 Cb 0.14 -3.38 0.18 0.00 0.52 0.00 0.00 34.95 32.41 1s64 s ARG 69 CO 0.19 0.31 1.82 0.00 0.02 0.00 0.00 175.30 177.64 1s64 h ALA 70 N 6.28 1.10 0.00 2.13 0.00 -1.93 -2.25 119.26 124.58 1s64 h ALA 70 Ca -0.43 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1s64 h ALA 70 Cb 1.18 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1s64 h ALA 70 CO 0.72 0.66 0.00 0.39 0.00 0.00 0.00 179.25 181.03 1s64 n GLU 71 N -4.31 0.07 -0.15 0.00 4.71 -1.26 -1.77 120.64 117.94 1s64 n GLU 71 Ca 0.08 0.47 0.05 0.00 -0.01 0.00 0.00 57.16 57.75 1s64 n GLU 71 Cb 0.14 -1.69 0.13 0.00 -1.01 0.00 0.00 31.44 29.01 1s64 n GLU 71 CO 0.00 0.00 0.00 0.91 0.09 0.00 0.00 177.13 178.13 1s64 n TRP 72 N -1.83 0.38 -0.21 -0.32 7.02 -0.85 -4.71 117.44 116.92 1s64 n TRP 72 Ca 0.01 -0.50 0.05 0.00 -1.02 0.00 0.00 57.50 56.04 1s64 n TRP 72 Cb 0.09 -0.03 0.32 0.00 -2.42 0.00 0.00 31.31 29.26 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 1.68 1.63 0.00 6.99 0.00 -1.27 -2.55 119.26 125.74 1s64 h ALA 73 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1s64 h ALA 73 Cb 0.69 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1s64 h ALA 73 CO 0.00 0.27 0.00 0.38 0.00 0.00 0.00 179.25 179.90 1s64 h ASP 74 N 0.85 0.00 -3.21 0.00 -0.00 -1.84 -3.44 116.42 108.77 1s64 h ASP 74 Ca 0.32 0.00 -0.59 0.00 -0.00 0.00 0.00 57.03 56.76 1s64 h ASP 74 Cb 0.18 0.00 -0.07 0.00 -0.00 0.00 0.00 39.33 39.44 1s64 h ASP 74 CO -0.10 0.00 -0.19 -0.63 -0.00 0.00 0.00 179.24 178.32 1s64 s ILE 75 N -3.34 5.14 -0.29 4.15 -1.09 -0.96 -5.06 121.20 119.75 1s64 s ILE 75 Ca 0.05 0.85 -0.15 0.00 -2.23 0.00 0.00 60.65 59.18 1s64 s ILE 75 Cb 0.10 -3.75 -0.03 0.00 -1.58 0.00 0.00 42.46 37.19 1s64 s ILE 75 CO 0.49 0.43 0.37 -1.81 -1.23 0.00 0.00 174.94 173.18 1s64 s ASP 76 N -0.03 6.23 0.53 3.58 1.01 -1.26 -5.05 116.67 121.67 1s64 s ASP 76 Ca 0.24 0.15 -0.22 0.00 0.71 0.00 0.00 52.55 53.43 1s64 s ASP 76 Cb -0.15 -2.21 -0.05 0.00 1.01 0.00 0.00 42.92 41.52 1s64 s ASP 76 CO 0.10 -0.23 1.28 -2.16 0.21 0.00 0.00 175.17 174.38 1s64 s PRO 77 N 2.07 3.30 -0.28 8.23 0.04 -1.26 -4.76 135.00 142.34 1s64 s PRO 77 Ca 0.14 2.04 -0.04 0.00 0.04 0.00 0.00 61.00 63.18 1s64 s PRO 77 Cb -0.16 -2.26 0.02 0.00 0.04 0.00 0.00 34.50 32.15 1s64 s PRO 77 CO 0.11 -1.00 0.01 0.08 0.04 0.00 0.00 177.00 176.24 1s64 s VAL 78 N -1.41 3.37 0.56 -0.36 1.01 -0.18 -4.97 120.40 118.41 1s64 s VAL 78 Ca 0.70 -0.94 -0.12 0.00 0.00 0.00 0.00 61.98 61.61 1s64 s VAL 78 Cb -0.35 -2.76 -0.05 0.00 0.00 0.00 0.00 36.38 33.21 1s64 s VAL 78 CO 0.42 0.09 0.98 -2.16 0.00 0.00 0.00 175.10 174.43 1s64 s PRO 79 N 1.39 3.73 0.01 2.72 0.04 -1.26 -4.47 135.00 137.16 1s64 s PRO 79 Ca 0.00 0.76 -0.17 0.00 0.04 0.00 0.00 61.00 61.64 1s64 s PRO 79 Cb -0.17 -2.14 -0.06 0.00 0.04 0.00 0.00 34.50 32.17 1s64 s PRO 79 CO -0.01 -0.40 0.48 -1.14 0.04 0.00 0.00 177.00 175.96 1s64 s GLN 80 N -4.67 4.08 -0.15 4.56 0.74 -1.26 -5.07 119.66 117.89 1s64 s GLN 80 Ca 0.56 0.54 -0.02 0.00 0.05 0.00 0.00 55.36 56.48 1s64 s GLN 80 Cb -0.11 -3.26 0.05 0.00 1.10 0.00 0.00 33.01 30.80 1s64 s GLN 80 CO 0.44 0.60 0.01 0.54 -0.55 0.00 0.00 175.29 176.33 1s64 s ASN 81 N -0.85 2.51 -0.00 6.67 2.20 -1.26 -4.99 114.94 119.21 1s64 s ASN 81 Ca 0.26 -0.58 0.08 0.00 -0.94 0.00 0.00 52.86 51.68 1s64 s ASN 81 Cb -0.17 -0.60 0.24 0.00 -2.00 0.00 0.00 41.25 38.71 1s64 s ASN 81 CO 0.15 -0.25 1.18 0.47 -2.94 0.00 0.00 177.10 175.71 1s64 n ASP 82 N 5.05 1.48 -0.23 3.54 10.43 -1.26 -5.04 116.55 130.52 1s64 n ASP 82 Ca -0.09 -2.02 0.00 0.00 2.57 0.00 0.00 54.79 55.26 1s64 n ASP 82 Cb 0.48 -0.20 -0.00 0.00 1.84 0.00 0.00 41.12 43.24 1s64 n ASP 82 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1s64 n GLY 83 N 0.89 -1.87 0.42 0.44 0.00 -1.26 -4.17 105.19 99.63 1s64 n GLY 83 Ca 0.09 -1.34 -0.13 0.00 0.00 0.00 0.00 46.02 44.64 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 -0.51 -3.93 1.61 0.13 -2.06 -3.36 132.00 123.88 1s64 h PRO 84 Ca 0.00 0.03 -0.65 0.00 -0.87 0.00 0.00 66.00 64.51 1s64 h PRO 84 Cb 0.02 0.12 -0.40 0.00 0.13 0.00 0.00 31.00 30.87 1s64 h PRO 84 CO 0.00 -0.34 -0.64 -1.12 -0.23 0.00 0.00 178.00 175.67 1s64 s SER 85 N -4.85 4.58 0.45 1.44 0.01 -1.26 -5.10 113.70 108.96 1s64 s SER 85 Ca -0.16 -2.65 -0.23 0.00 1.31 0.00 0.00 55.95 54.23 1s64 s SER 85 Cb 0.09 -1.66 -0.08 0.00 0.21 0.00 0.00 66.02 64.58 1s64 s SER 85 CO 0.64 -0.31 1.14 -2.16 0.41 0.00 0.00 173.24 172.96 1s64 s PRO 86 N 0.22 3.83 -0.04 12.44 0.04 -1.26 -5.05 135.00 145.18 1s64 s PRO 86 Ca 0.14 1.71 0.05 0.00 0.04 0.00 0.00 61.00 62.94 1s64 s PRO 86 Cb -0.23 -2.42 -0.02 0.00 0.04 0.00 0.00 34.50 31.87 1s64 s PRO 86 CO -0.03 -0.47 -0.19 0.08 0.04 0.00 0.00 177.00 176.43 1s64 s VAL 87 N -1.58 2.68 -1.32 -0.36 1.01 -1.26 -4.68 120.40 114.88 1s64 s VAL 87 Ca 0.63 -0.87 -0.13 0.00 0.00 0.00 0.00 61.98 61.61 1s64 s VAL 87 Cb -0.27 -2.01 0.01 0.00 0.00 0.00 0.00 36.38 34.11 1s64 s VAL 87 CO 0.33 0.59 0.49 0.52 0.00 0.00 0.00 175.10 177.03 1s64 n VAL 88 N 2.38 -3.31 -2.96 2.92 0.31 -1.26 -4.88 118.33 111.53 1s64 n VAL 88 Ca -0.17 -0.64 -0.40 0.00 -0.01 0.00 0.00 64.34 63.12 1s64 n VAL 88 Cb 0.52 -2.69 -0.04 0.00 -0.91 0.00 0.00 33.84 30.71 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 -6.77 4.48 -0.19 5.55 0.74 -1.26 -5.05 119.66 117.15 1s64 s GLN 89 Ca 0.23 1.03 -0.09 0.00 0.05 0.00 0.00 55.36 56.59 1s64 s GLN 89 Cb -0.10 -3.43 -0.05 0.00 1.10 0.00 0.00 33.01 30.53 1s64 s GLN 89 CO 0.92 0.08 0.10 0.42 -0.55 0.00 0.00 175.29 176.26 1s64 s ILE 90 N 0.67 5.10 0.06 -2.34 1.01 -1.26 -5.08 121.20 119.36 1s64 s ILE 90 Ca 0.41 0.08 -0.25 0.00 0.00 0.00 0.00 60.65 60.89 1s64 s ILE 90 Cb -0.19 -3.32 -0.06 0.00 0.01 0.00 0.00 42.46 38.91 1s64 s ILE 90 CO 0.21 0.45 0.75 0.27 0.00 0.00 0.00 174.94 176.62 1s64 s ILE 91 N 0.38 4.70 0.04 2.92 -5.25 -1.26 -5.06 121.20 117.66 1s64 s ILE 91 Ca 0.06 1.61 0.06 0.00 -0.99 0.00 0.00 60.65 61.38 1s64 s ILE 91 Cb -0.12 -4.10 -0.03 0.00 2.95 0.00 0.00 42.46 41.16 1s64 s ILE 91 CO -0.01 0.39 -0.13 -0.31 -1.79 0.00 0.00 174.94 173.09 1s64 s TYR 92 N -0.21 2.69 0.79 1.37 1.51 -1.26 -5.12 117.35 117.12 1s64 s TYR 92 Ca 0.38 -0.17 -0.11 0.00 -1.01 0.00 0.00 57.07 56.15 1s64 s TYR 92 Cb -0.21 -1.51 0.06 0.00 -0.11 0.00 0.00 41.96 40.20 1s64 s TYR 92 CO 0.23 0.31 1.09 -1.54 -1.11 0.00 0.00 175.55 174.53 1s64 s SER 93 N -1.52 4.47 0.19 2.29 1.04 -1.26 -4.75 113.70 114.16 1s64 s SER 93 Ca 0.16 1.56 -0.13 0.00 0.48 0.00 0.00 55.95 58.02 1s64 s SER 93 Cb -0.11 -2.31 0.19 0.00 0.10 0.00 0.00 66.02 63.89 1s64 s SER 93 CO 0.07 -2.02 1.71 -0.33 0.98 0.00 0.00 173.24 173.66 1s64 h GLU 94 N -1.12 0.21 -0.45 4.02 4.39 -2.00 -0.44 114.58 119.20 1s64 h GLU 94 Ca -0.46 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.25 1s64 h GLU 94 Cb 1.25 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.82 1s64 h GLU 94 CO 0.55 0.14 0.25 -0.22 -1.16 0.00 0.00 179.01 178.58 1s64 h LYS 95 N 0.22 0.49 0.39 2.33 3.64 -1.99 -0.34 116.57 121.31 1s64 h LYS 95 Ca 0.25 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.58 1s64 h LYS 95 Cb 0.33 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1s64 h LYS 95 CO -0.33 0.33 -0.19 0.35 -2.27 0.00 0.00 179.45 177.34 1s64 h PHE 96 N 0.51 -0.48 -0.30 1.91 3.57 -1.77 -2.30 116.94 118.08 1s64 h PHE 96 Ca 0.18 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.69 1s64 h PHE 96 Cb 0.04 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 1s64 h PHE 96 CO -0.08 -0.20 0.20 -0.09 -2.23 0.00 0.00 178.31 175.91 1s64 h ARG 97 N -0.72 0.32 -0.17 1.11 2.43 -1.02 -2.33 114.38 113.99 1s64 h ARG 97 Ca -0.05 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.06 1s64 h ARG 97 Cb 0.50 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1s64 h ARG 97 CO 0.09 0.21 -0.03 0.22 -1.51 0.00 0.00 179.97 178.95 1s64 h ASP 98 N 0.33 0.32 -0.17 -3.80 1.82 -0.90 0.31 116.42 114.33 1s64 h ASP 98 Ca 0.12 -0.35 0.00 0.00 -0.39 0.00 0.00 57.03 56.41 1s64 h ASP 98 Cb 0.08 -0.09 -0.01 0.00 0.68 0.00 0.00 39.33 39.99 1s64 h ASP 98 CO -0.03 0.60 0.11 0.58 -1.61 0.00 0.00 179.24 178.89 1s64 h VAL 99 N 0.04 1.04 0.00 2.25 2.07 -0.99 -2.85 116.25 117.82 1s64 h VAL 99 Ca 0.05 -0.08 -0.05 0.00 0.82 0.00 0.00 66.70 67.43 1s64 h VAL 99 Cb 0.45 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1s64 h VAL 99 CO 0.01 0.04 -0.24 1.88 0.02 0.00 0.00 177.57 179.29 1s64 h TYR 100 N 0.22 0.00 -0.10 1.57 0.05 -1.40 -0.59 116.97 116.72 1s64 h TYR 100 Ca 0.06 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.74 1s64 h TYR 100 Cb -0.02 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.70 1s64 h TYR 100 CO -0.07 0.24 -0.41 -0.44 -1.05 0.00 0.00 178.16 176.43 1s64 h ASP 101 N 0.00 0.24 0.79 3.88 3.32 -0.72 -0.93 116.42 122.99 1s64 h ASP 101 Ca -0.00 -0.10 -0.24 0.00 0.02 0.00 0.00 57.03 56.71 1s64 h ASP 101 Cb 0.80 -0.07 -0.04 0.00 0.22 0.00 0.00 39.33 40.25 1s64 h ASP 101 CO 0.03 0.63 -1.29 1.88 -1.72 0.00 0.00 179.24 178.77 1s64 h TYR 102 N 0.19 0.01 -0.41 4.55 -1.99 -1.26 -0.44 116.97 117.63 1s64 h TYR 102 Ca 0.02 -0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.73 1s64 h TYR 102 Cb 0.81 -0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.52 1s64 h TYR 102 CO 0.01 1.01 0.22 0.35 -0.00 0.00 0.00 178.16 179.75 1s64 h PHE 103 N 0.00 0.56 -1.00 4.88 3.57 -0.78 -1.14 116.94 123.03 1s64 h PHE 103 Ca -0.12 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.38 1s64 h PHE 103 Cb 1.87 -0.18 -0.05 0.00 2.79 0.00 0.00 35.95 40.38 1s64 h PHE 103 CO 0.00 0.44 0.66 0.00 -2.23 0.00 0.00 178.31 177.18 1s64 h ARG 104 N 0.52 1.29 0.22 1.11 3.08 -1.24 -0.36 114.38 119.00 1s64 h ARG 104 Ca 0.14 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 1s64 h ARG 104 Cb 0.07 -0.29 0.00 0.00 0.08 0.00 0.00 29.97 29.83 1s64 h ARG 104 CO -0.02 0.85 -0.11 0.00 -1.07 0.00 0.00 179.97 179.63 1s64 h ALA 105 N 1.38 -0.30 -0.94 0.04 0.00 -1.32 0.39 119.26 118.51 1s64 h ALA 105 Ca 0.38 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1s64 h ALA 105 Cb -0.11 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1s64 h ALA 105 CO -0.09 -0.66 0.55 0.28 0.00 0.00 0.00 179.25 179.32 1s64 h VAL 106 N -0.30 1.26 0.09 0.00 2.07 -0.88 -2.68 116.25 115.81 1s64 h VAL 106 Ca -0.03 -0.60 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 1s64 h VAL 106 Cb 0.23 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 29.96 1s64 h VAL 106 CO 0.05 0.28 -0.04 -0.07 0.02 0.00 0.00 177.57 177.81 1s64 h LEU 107 N 1.30 -0.10 -1.71 2.57 3.38 -0.85 -1.24 115.31 118.65 1s64 h LEU 107 Ca 0.33 -0.24 0.19 0.00 0.09 0.00 0.00 57.88 58.26 1s64 h LEU 107 Cb -0.03 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.70 1s64 h LEU 107 CO -0.06 0.19 0.55 -0.61 0.09 0.00 0.00 178.44 178.59 1s64 h GLN 108 N -0.40 0.25 -0.19 1.13 4.15 -0.80 0.17 115.11 119.41 1s64 h GLN 108 Ca -0.01 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1s64 h GLN 108 Cb 0.34 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.97 1s64 h GLN 108 CO 0.02 0.16 0.00 0.54 -1.93 0.00 0.00 178.83 177.62 1s64 n ARG 109 N -4.43 2.41 -4.10 1.69 1.74 -1.02 -4.96 116.66 107.98 1s64 n ARG 109 Ca 0.16 -2.08 -0.30 0.00 -0.77 0.00 0.00 57.85 54.86 1s64 n ARG 109 Cb 0.70 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.61 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 1.40 -1.08 -4.60 0.55 4.64 0.59 -4.85 116.55 113.20 1s64 n ASP 110 Ca 0.17 -1.05 -0.43 0.00 -1.38 0.00 0.00 54.79 52.10 1s64 n ASP 110 Cb 0.60 -2.74 -0.02 0.00 -1.04 0.00 0.00 41.12 37.92 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 -6.80 3.57 -1.34 -0.67 2.12 -0.78 -4.92 118.70 109.88 1s64 s GLU 111 Ca 0.24 0.85 -0.07 0.00 0.36 0.00 0.00 54.97 56.35 1s64 s GLU 111 Cb -0.13 -4.02 0.11 0.00 0.26 0.00 0.00 34.13 30.35 1s64 s GLU 111 CO 0.92 -1.57 2.26 0.54 -0.54 0.00 0.00 175.26 176.87 1s64 n ARG 112 N 8.09 4.12 -3.75 4.30 5.12 -1.26 -4.83 116.66 128.45 1s64 n ARG 112 Ca 0.16 -3.33 -0.22 0.00 -1.93 0.00 0.00 57.85 52.52 1s64 n ARG 112 Cb 0.48 -2.77 -0.04 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 0.80 4.95 0.20 0.55 1.04 -1.26 -4.86 113.70 115.11 1s64 s SER 113 Ca 0.50 -0.76 -0.00 0.00 0.48 0.00 0.00 55.95 56.17 1s64 s SER 113 Cb 0.15 -0.63 0.13 0.00 0.10 0.00 0.00 66.02 65.77 1s64 s SER 113 CO -0.06 -0.55 1.49 -0.33 0.98 0.00 0.00 173.24 174.77 1s64 h GLU 114 N 1.18 0.40 -0.35 4.02 4.39 -2.00 -2.34 114.58 119.88 1s64 h GLU 114 Ca -0.42 -0.29 -0.09 0.00 0.34 0.00 0.00 59.36 58.90 1s64 h GLU 114 Cb 1.26 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.94 1s64 h GLU 114 CO 0.60 0.91 -0.17 0.07 -1.16 0.00 0.00 179.01 179.25 1s64 h ARG 115 N 0.29 0.65 -0.53 2.33 0.11 -1.97 -1.93 114.38 113.33 1s64 h ARG 115 Ca -0.01 -0.23 -0.07 0.00 0.10 0.00 0.00 59.98 59.77 1s64 h ARG 115 Cb 1.18 -0.05 -0.02 0.00 1.11 0.00 0.00 29.97 32.20 1s64 h ARG 115 CO 0.11 0.79 0.07 0.00 0.10 0.00 0.00 179.97 181.04 1s64 h ALA 116 N 1.23 0.71 -0.62 0.08 0.00 -1.85 -0.60 119.26 118.22 1s64 h ALA 116 Ca 0.09 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.80 1s64 h ALA 116 Cb 0.62 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 1s64 h ALA 116 CO 0.04 0.46 0.35 0.35 0.00 0.00 0.00 179.25 180.45 1s64 h PHE 117 N 0.77 0.64 -0.13 0.00 3.57 -0.97 -1.25 116.94 119.57 1s64 h PHE 117 Ca 0.16 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.59 1s64 h PHE 117 Cb 0.43 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 1s64 h PHE 117 CO 0.03 0.33 -0.31 0.87 -2.23 0.00 0.00 178.31 177.00 1s64 h LYS 118 N 0.66 0.26 -0.35 1.11 1.57 -1.00 -2.74 116.57 116.08 1s64 h LYS 118 Ca 0.27 -0.10 -0.06 0.00 -1.87 0.00 0.00 60.65 58.89 1s64 h LYS 118 Cb 0.13 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1s64 h LYS 118 CO -0.15 0.55 -0.03 1.25 -0.57 0.00 0.00 179.45 180.50 1s64 h LEU 119 N 0.23 0.54 -1.51 2.94 5.85 -0.00 -2.40 115.31 120.95 1s64 h LEU 119 Ca 0.03 -0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.59 1s64 h LEU 119 Cb 0.67 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 1s64 h LEU 119 CO 0.05 0.63 -0.24 0.71 -0.34 0.00 0.00 178.44 179.25 1s64 h THR 120 N 0.54 1.17 -0.89 1.05 1.35 -1.00 -1.57 112.91 113.56 1s64 h THR 120 Ca 0.11 -0.83 -0.02 0.00 -0.55 0.00 0.00 66.41 65.12 1s64 h THR 120 Cb 0.39 1.44 -0.04 0.00 -1.73 0.00 0.00 68.15 68.20 1s64 h THR 120 CO 0.02 0.24 0.48 -0.09 -0.25 0.00 0.00 175.52 175.92 1s64 h ARG 121 N 0.01 1.24 -0.16 4.72 2.43 -1.44 0.70 114.38 121.88 1s64 h ARG 121 Ca -0.00 -0.15 -0.17 0.00 -0.81 0.00 0.00 59.98 58.85 1s64 h ARG 121 Cb 0.43 -0.24 0.01 0.00 -0.42 0.00 0.00 29.97 29.74 1s64 h ARG 121 CO 0.03 0.91 -0.56 -0.44 -1.51 0.00 0.00 179.97 178.40 1s64 h ASP 122 N 1.24 0.76 -0.85 -3.80 3.45 -1.38 -2.14 116.42 113.71 1s64 h ASP 122 Ca 0.31 -0.61 -0.01 0.00 0.43 0.00 0.00 57.03 57.16 1s64 h ASP 122 Cb 0.03 -0.22 -0.04 0.00 -0.56 0.00 0.00 39.33 38.54 1s64 h ASP 122 CO -0.05 1.24 0.50 0.00 -1.57 0.00 0.00 179.24 179.35 1s64 h ALA 123 N 0.54 1.27 -0.40 3.45 0.00 -1.00 -1.23 119.26 121.90 1s64 h ALA 123 Ca -0.03 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.65 1s64 h ALA 123 Cb 1.18 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1s64 h ALA 123 CO 0.12 0.61 -0.26 0.82 0.00 0.00 0.00 179.25 180.54 1s64 h ILE 124 N 1.18 1.27 -0.59 0.00 2.04 -0.83 -0.38 117.51 120.21 1s64 h ILE 124 Ca 0.30 -1.40 -0.05 0.00 1.00 0.00 0.00 64.86 64.71 1s64 h ILE 124 Cb -0.02 1.24 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 1s64 h ILE 124 CO -0.05 0.47 0.18 -0.08 0.00 0.00 0.00 178.15 178.67 1s64 h GLU 125 N 0.72 0.89 -0.11 2.37 4.81 -0.68 -1.88 114.58 120.71 1s64 h GLU 125 Ca 0.09 -0.17 -0.19 0.00 -0.13 0.00 0.00 59.36 58.96 1s64 h GLU 125 Cb 0.80 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 30.04 1s64 h GLU 125 CO 0.07 0.77 -0.71 -0.07 -0.73 0.00 0.00 179.01 178.34 1s64 h LEU 126 N 0.87 0.60 -6.08 1.64 3.38 -0.99 -3.42 115.31 111.30 1s64 h LEU 126 Ca 0.20 -0.38 -0.11 0.00 0.09 0.00 0.00 57.88 57.67 1s64 h LEU 126 Cb 0.25 -0.18 -0.22 0.00 0.09 0.00 0.00 40.66 40.61 1s64 h LEU 126 CO -0.01 1.13 -0.49 0.21 0.09 0.00 0.00 178.44 179.37 1s64 s ASN 127 N -6.99 -0.96 0.00 -0.43 2.47 -0.17 -5.01 114.94 103.84 1s64 s ASN 127 Ca -0.07 -0.77 0.19 0.00 0.42 0.00 0.00 52.86 52.63 1s64 s ASN 127 Cb 0.10 1.68 1.07 0.00 -1.45 0.00 0.00 41.25 42.65 1s64 s ASN 127 CO 0.85 -0.21 1.57 0.00 -3.72 0.00 0.00 177.10 175.59 1s64 n ALA 128 N 4.57 2.13 1.13 1.71 0.00 -0.74 -2.78 120.51 126.53 1s64 n ALA 128 Ca 0.10 -0.11 0.13 0.00 0.00 0.00 0.00 53.44 53.55 1s64 n ALA 128 Cb 0.54 -1.31 0.29 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 -1.13 2.50 -2.63 0.00 0.00 -1.26 -4.72 120.51 113.27 1s64 n ALA 129 Ca 0.12 -0.62 -0.42 0.00 0.00 0.00 0.00 53.44 52.53 1s64 n ALA 129 Cb 0.11 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.55 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 -1.90 6.27 0.45 0.00 3.84 -1.12 -4.88 114.94 117.60 1s64 s ASN 130 Ca 0.33 -0.87 0.12 0.00 0.21 0.00 0.00 52.86 52.65 1s64 s ASN 130 Cb 0.20 -2.53 1.03 0.00 -0.55 0.00 0.00 41.25 39.41 1s64 s ASN 130 CO 0.31 -1.65 2.07 0.10 -2.79 0.00 0.00 177.10 175.14 1s64 h TYR 131 N 9.83 0.32 -0.73 0.43 -0.00 -1.91 -2.09 116.97 122.82 1s64 h TYR 131 Ca -0.15 0.01 -0.03 0.00 0.00 0.00 0.00 58.73 58.56 1s64 h TYR 131 Cb 1.04 -0.11 -0.03 0.00 0.00 0.00 0.00 36.73 37.63 1s64 h TYR 131 CO 1.14 0.19 0.35 1.15 -0.00 0.00 0.00 178.16 180.99 1s64 h THR 132 N 0.34 1.24 -0.49 -0.90 2.02 -1.99 -1.09 112.91 112.03 1s64 h THR 132 Ca 0.13 -0.67 0.00 0.00 0.77 0.00 0.00 66.41 66.64 1s64 h THR 132 Cb 0.09 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 1s64 h THR 132 CO -0.03 0.28 0.32 0.58 0.37 0.00 0.00 175.52 177.04 1s64 h VAL 133 N 1.03 1.13 -0.62 3.16 2.07 -1.79 -0.50 116.25 120.73 1s64 h VAL 133 Ca 0.25 -0.26 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 1s64 h VAL 133 Cb 0.12 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 1s64 h VAL 133 CO -0.03 0.13 0.17 -0.50 0.02 0.00 0.00 177.57 177.36 1s64 h TRP 134 N 0.66 0.99 -0.08 1.57 4.06 -1.33 -0.24 115.95 121.57 1s64 h TRP 134 Ca 0.18 -0.09 -0.01 0.00 2.06 0.00 0.00 58.89 61.03 1s64 h TRP 134 Cb -0.06 -0.29 -0.00 0.00 -1.00 0.00 0.00 29.16 27.81 1s64 h TRP 134 CO -0.04 0.80 0.03 1.25 -3.56 0.00 0.00 178.44 176.92 1s64 h HIS 135 N 0.92 0.13 -0.99 0.49 2.76 -0.73 -1.40 115.15 116.34 1s64 h HIS 135 Ca 0.20 -0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.38 1s64 h HIS 135 Cb 0.30 -0.04 -0.05 0.00 1.55 0.00 0.00 27.41 29.16 1s64 h HIS 135 CO 0.02 0.27 0.65 0.35 -1.30 0.00 0.00 177.93 177.92 1s64 h PHE 136 N -0.04 1.23 -0.71 5.26 3.57 -0.87 -0.38 116.94 124.99 1s64 h PHE 136 Ca 0.03 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 1s64 h PHE 136 Cb 0.20 -0.41 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 1s64 h PHE 136 CO -0.01 0.75 0.39 -0.09 -2.23 0.00 0.00 178.31 177.12 1s64 h ARG 137 N 1.30 0.98 -0.53 1.11 2.43 -0.78 -0.21 114.38 118.69 1s64 h ARG 137 Ca 0.37 -0.10 -0.12 0.00 -0.81 0.00 0.00 59.98 59.31 1s64 h ARG 137 Cb -0.10 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.24 1s64 h ARG 137 CO -0.09 0.72 -0.15 0.00 -1.51 0.00 0.00 179.97 178.93 1s64 h ARG 138 N 0.99 1.03 -0.35 0.20 3.08 -0.05 0.95 114.38 120.23 1s64 h ARG 138 Ca 0.25 -0.41 0.02 0.00 0.07 0.00 0.00 59.98 59.92 1s64 h ARG 138 Cb 0.02 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 1s64 h ARG 138 CO -0.04 1.09 0.18 0.28 -1.07 0.00 0.00 179.97 180.41 1s64 h VAL 139 N 0.90 0.99 -0.68 2.04 2.07 -0.40 -2.38 116.25 118.79 1s64 h VAL 139 Ca 0.13 -0.13 -0.07 0.00 0.82 0.00 0.00 66.70 67.46 1s64 h VAL 139 Cb 0.73 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 1s64 h VAL 139 CO 0.06 0.07 0.17 -0.07 0.02 0.00 0.00 177.57 177.81 1s64 h LEU 140 N 0.37 1.03 -1.29 2.57 3.38 -0.80 -0.23 115.31 120.34 1s64 h LEU 140 Ca 0.15 -0.23 0.11 0.00 0.09 0.00 0.00 57.88 58.00 1s64 h LEU 140 Cb 0.05 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.47 1s64 h LEU 140 CO -0.10 0.99 0.55 -0.07 0.09 0.00 0.00 178.44 179.91 1s64 h LEU 141 N 1.02 0.69 0.09 1.67 3.38 -0.36 0.44 115.31 122.24 1s64 h LEU 141 Ca 0.21 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 1s64 h LEU 141 Cb 0.36 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1s64 h LEU 141 CO 0.00 0.39 -0.04 -0.09 0.09 0.00 0.00 178.44 178.79 1s64 h ARG 142 N 0.75 -0.11 -0.63 1.13 2.43 -1.03 -1.47 114.38 115.45 1s64 h ARG 142 Ca 0.41 0.01 0.13 0.00 -0.81 0.00 0.00 59.98 59.72 1s64 h ARG 142 Cb 0.54 0.03 -0.11 0.00 -0.42 0.00 0.00 29.97 30.00 1s64 h ARG 142 CO -0.17 0.18 -0.03 0.77 -1.51 0.00 0.00 179.97 179.21 1s64 h SER 143 N -1.00 -0.33 -0.05 -3.80 0.02 -0.81 1.00 113.55 108.58 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 0.34 0.30 0.00 0.00 0.14 0.00 0.00 62.40 63.18 1s64 h SER 143 CO 0.02 -0.14 0.00 0.18 -1.14 0.00 0.00 176.83 175.75 1s64 n LEU 144 N -5.31 1.03 -3.95 5.07 4.77 0.13 -4.94 117.00 113.80 1s64 n LEU 144 Ca 0.09 -0.38 -0.30 0.00 -0.03 0.00 0.00 56.01 55.39 1s64 n LEU 144 Cb 0.36 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 1s64 n LEU 144 CO 0.09 0.19 -0.22 0.00 -1.33 0.00 0.00 177.39 176.12 1s64 n GLN 145 N -0.16 -2.14 -1.85 3.23 6.02 0.34 -4.91 117.38 117.91 1s64 n GLN 145 Ca 0.19 0.34 -0.32 0.00 -0.01 0.00 0.00 57.00 57.19 1s64 n GLN 145 Cb 0.26 -4.07 0.03 0.00 1.02 0.00 0.00 30.24 27.48 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 -6.63 3.04 -0.28 -1.09 -0.14 -0.59 -4.94 119.74 109.12 1s64 s LYS 146 Ca 0.17 1.23 -0.28 0.00 -1.36 0.00 0.00 55.97 55.74 1s64 s LYS 146 Cb -0.07 -1.99 -0.03 0.00 -1.68 0.00 0.00 37.83 34.05 1s64 s LYS 146 CO 0.91 -1.04 1.90 0.34 -0.76 0.00 0.00 175.35 176.70 1s64 s ASP 147 N -2.87 5.83 0.49 2.83 3.68 -1.26 -4.85 116.67 120.53 1s64 s ASP 147 Ca 0.64 1.53 0.28 0.00 2.13 0.00 0.00 52.55 57.13 1s64 s ASP 147 Cb -0.17 -2.52 1.13 0.00 -1.45 0.00 0.00 42.92 39.90 1s64 s ASP 147 CO 0.42 -1.72 1.90 -0.07 0.13 0.00 0.00 175.17 175.83 1s64 h LEU 148 N 13.79 0.00 -1.01 -1.34 3.38 -1.95 -2.58 115.31 125.61 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 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 1s64 h LEU 148 CO 1.01 0.12 -0.46 -0.61 0.09 0.00 0.00 178.44 178.59 1s64 h GLN 149 N 0.00 0.08 -0.08 1.13 5.75 -2.00 -1.54 115.11 118.45 1s64 h GLN 149 Ca -0.00 -0.04 -0.23 0.00 -0.15 0.00 0.00 58.65 58.23 1s64 h GLN 149 Cb 0.63 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.19 1s64 h GLN 149 CO 0.02 0.53 -0.86 1.49 -2.65 0.00 0.00 178.83 177.36 1s64 h GLU 150 N 0.07 0.63 0.00 1.69 4.57 -1.86 -2.97 114.58 116.70 1s64 h GLU 150 Ca 0.00 -0.57 -0.05 0.00 -1.18 0.00 0.00 59.36 57.55 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 1.19 -0.25 1.49 -1.18 0.00 0.00 179.01 180.32 1s64 h GLU 151 N 0.40 0.00 -0.55 1.92 4.57 -1.26 -1.74 114.58 117.92 1s64 h GLU 151 Ca -0.07 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.04 1s64 h GLU 151 Cb 1.48 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 30.05 1s64 h GLU 151 CO 0.16 0.25 0.04 0.52 -1.18 0.00 0.00 179.01 178.81 1s64 h MET 152 N 0.00 0.91 -0.54 1.92 2.86 -1.13 -0.57 114.93 118.36 1s64 h MET 152 Ca -0.00 -0.24 -0.10 0.00 -2.06 0.00 0.00 59.70 57.29 1s64 h MET 152 Cb 0.45 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 1s64 h MET 152 CO 0.03 0.88 -0.07 -0.91 1.06 0.00 0.00 176.91 177.90 1s64 h ASN 153 N 0.85 1.00 0.91 1.22 2.35 -1.24 -0.92 115.58 119.75 1s64 h ASN 153 Ca 0.17 -0.34 -0.04 0.00 -0.55 0.00 0.00 56.30 55.54 1s64 h ASN 153 Cb 0.44 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.54 1s64 h ASN 153 CO 0.02 1.10 -0.49 0.22 -1.65 0.00 0.00 177.43 176.62 1s64 h TYR 154 N 0.88 -1.29 0.00 1.19 3.20 -0.91 -2.46 116.97 117.58 1s64 h TYR 154 Ca 0.15 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 1s64 h TYR 154 Cb 0.63 0.44 -0.00 0.00 1.54 0.00 0.00 36.73 39.34 1s64 h TYR 154 CO 0.04 -0.76 -0.05 0.97 -1.64 0.00 0.00 178.16 176.72 1s64 h ILE 155 N -1.29 0.94 -0.58 1.81 6.09 -1.13 -1.43 117.51 121.92 1s64 h ILE 155 Ca -0.12 -0.16 -0.07 0.00 -1.37 0.00 0.00 64.86 63.14 1s64 h ILE 155 Cb 1.01 1.09 -0.02 0.00 0.47 0.00 0.00 36.82 39.37 1s64 h ILE 155 CO 0.17 0.04 0.09 0.40 -3.07 0.00 0.00 178.15 175.78 1s64 h ILE 156 N 0.00 1.25 -0.10 2.19 2.04 -0.88 -1.15 117.51 120.86 1s64 h ILE 156 Ca -0.00 -0.96 -0.15 0.00 1.00 0.00 0.00 64.86 64.75 1s64 h ILE 156 Cb 0.09 0.71 0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1s64 h ILE 156 CO 0.01 0.35 -0.54 0.00 0.00 0.00 0.00 178.15 177.97 1s64 h ALA 157 N 1.21 0.19 -0.45 1.87 0.00 -0.83 -2.98 119.26 118.27 1s64 h ALA 157 Ca 0.18 -0.52 0.04 0.00 0.00 0.00 0.00 54.91 54.61 1s64 h ALA 157 Cb 0.40 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 1s64 h ALA 157 CO 0.01 0.41 0.23 0.82 0.00 0.00 0.00 179.25 180.71 1s64 h ILE 158 N 0.13 0.97 -0.65 0.00 1.08 -1.17 -2.55 117.51 115.33 1s64 h ILE 158 Ca -0.04 -0.16 -0.04 0.00 -0.39 0.00 0.00 64.86 64.23 1s64 h ILE 158 Cb 1.19 0.47 -0.03 0.00 -3.07 0.00 0.00 36.82 35.38 1s64 h ILE 158 CO 0.11 0.08 0.23 0.40 -0.69 0.00 0.00 178.15 178.29 1s64 h ILE 159 N 0.46 1.23 -0.35 -0.67 2.04 -1.27 -0.52 117.51 118.43 1s64 h ILE 159 Ca 0.20 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.26 1s64 h ILE 159 Cb 0.10 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 1s64 h ILE 159 CO -0.14 0.30 0.13 -0.33 0.00 0.00 0.00 178.15 178.12 1s64 h GLU 160 N 0.95 0.49 0.00 2.37 5.08 -1.30 0.11 114.58 122.29 1s64 h GLU 160 Ca 0.22 -0.06 -0.15 0.00 -1.00 0.00 0.00 59.36 58.36 1s64 h GLU 160 Cb 0.23 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1s64 h GLU 160 CO -0.01 0.42 -0.82 0.93 -1.00 0.00 0.00 179.01 178.53 1s64 h GLU 161 N 0.49 0.00 -2.04 2.33 5.08 -1.10 -3.38 114.58 115.96 1s64 h GLU 161 Ca 0.12 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.96 1s64 h GLU 161 Cb 0.12 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 28.97 1s64 h GLU 161 CO -0.01 0.61 -1.08 1.04 -1.00 0.00 0.00 179.01 178.57 1s64 n GLN 162 N -3.20 1.21 0.06 2.33 6.02 -0.26 -4.97 117.38 118.58 1s64 n GLN 162 Ca -0.01 -3.56 0.04 0.00 -0.01 0.00 0.00 57.00 53.47 1s64 n GLN 162 Cb 0.82 -1.64 0.23 0.00 1.02 0.00 0.00 30.24 30.67 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 0.61 0.05 -0.19 -1.09 -0.04 0.34 -2.19 135.00 132.50 1s64 n PRO 163 Ca 0.25 0.55 0.07 0.00 -0.04 0.00 0.00 63.50 64.32 1s64 n PRO 163 Cb 0.58 -1.69 0.17 0.00 -0.04 0.00 0.00 33.50 32.52 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 -1.79 2.60 -2.91 0.54 4.76 -1.26 -4.81 118.16 115.30 1s64 n LYS 164 Ca -0.01 -2.06 -0.41 0.00 -2.87 0.00 0.00 58.31 52.96 1s64 n LYS 164 Cb 0.02 -1.32 -0.04 0.00 -1.84 0.00 0.00 35.03 31.85 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 6.86 0.20 4.39 3.84 -0.93 -4.97 114.94 123.32 1s64 s ASN 165 Ca 0.27 1.07 -0.10 0.00 0.21 0.00 0.00 52.86 54.30 1s64 s ASN 165 Cb 0.14 -2.44 0.13 0.00 -0.55 0.00 0.00 41.25 38.53 1s64 s ASN 165 CO 0.19 -0.45 1.80 1.88 -2.79 0.00 0.00 177.10 177.72 1s64 h TYR 166 N 7.54 1.00 -0.99 0.43 0.05 -1.93 -3.16 116.97 119.91 1s64 h TYR 166 Ca -0.26 -0.04 0.01 0.00 0.05 0.00 0.00 58.73 58.49 1s64 h TYR 166 Cb 1.11 -0.31 -0.05 0.00 1.01 0.00 0.00 36.73 38.49 1s64 h TYR 166 CO 0.74 0.73 0.65 1.96 -1.05 0.00 0.00 178.16 181.19 1s64 h GLN 167 N 0.98 1.29 -0.19 4.88 7.50 -1.93 -1.89 115.11 125.75 1s64 h GLN 167 Ca 0.25 -0.08 -0.14 0.00 0.50 0.00 0.00 58.65 59.18 1s64 h GLN 167 Cb 0.09 -0.29 -0.01 0.00 0.05 0.00 0.00 27.48 27.32 1s64 h GLN 167 CO -0.03 0.85 -0.47 -0.39 -1.50 0.00 0.00 178.83 177.29 1s64 h VAL 168 N 1.33 1.32 -0.28 -0.54 -1.51 -1.83 -1.01 116.25 113.73 1s64 h VAL 168 Ca 0.37 -1.68 -0.16 0.00 -1.23 0.00 0.00 66.70 64.00 1s64 h VAL 168 Cb -0.14 1.68 -0.01 0.00 -2.13 0.00 0.00 31.29 30.70 1s64 h VAL 168 CO -0.08 0.52 -0.48 -0.50 -1.23 0.00 0.00 177.57 175.80 1s64 h TRP 169 N 0.39 0.90 -0.55 5.19 4.06 -1.49 -2.12 115.95 122.33 1s64 h TRP 169 Ca 0.02 -0.30 -0.04 0.00 2.06 0.00 0.00 58.89 60.64 1s64 h TRP 169 Cb 0.97 -0.18 -0.02 0.00 -1.00 0.00 0.00 29.16 28.93 1s64 h TRP 169 CO 0.03 1.07 0.18 1.25 -3.56 0.00 0.00 178.44 177.42 1s64 h HIS 170 N 0.58 0.88 -0.44 0.49 2.76 -1.21 -1.72 115.15 116.50 1s64 h HIS 170 Ca 0.03 -0.08 0.02 0.00 -2.20 0.00 0.00 60.37 58.14 1s64 h HIS 170 Cb 1.04 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 29.71 1s64 h HIS 170 CO 0.05 0.74 0.26 1.25 -1.30 0.00 0.00 177.93 178.94 1s64 h HIS 171 N 0.77 0.49 -0.76 5.26 6.17 -1.06 -1.41 115.15 124.60 1s64 h HIS 171 Ca 0.18 0.02 -0.04 0.00 0.71 0.00 0.00 60.37 61.23 1s64 h HIS 171 Cb 0.26 -0.16 -0.03 0.00 2.52 0.00 0.00 27.41 30.00 1s64 h HIS 171 CO 0.02 0.28 0.31 -0.09 0.71 0.00 0.00 177.93 179.16 1s64 h ARG 172 N 0.53 1.13 -0.63 5.26 2.43 -1.16 -1.84 114.38 120.11 1s64 h ARG 172 Ca 0.18 -0.19 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 1s64 h ARG 172 Cb 0.01 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.35 1s64 h ARG 172 CO -0.08 0.91 0.20 -0.09 -1.51 0.00 0.00 179.97 179.39 1s64 h ARG 173 N 1.11 0.97 -0.68 0.20 2.43 -0.80 -1.19 114.38 116.41 1s64 h ARG 173 Ca 0.26 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1s64 h ARG 173 Cb 0.19 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.57 1s64 h ARG 173 CO -0.02 0.86 0.39 0.28 -1.51 0.00 0.00 179.97 179.96 1s64 h VAL 174 N 0.90 1.21 -0.29 0.20 2.07 -0.90 -1.39 116.25 118.05 1s64 h VAL 174 Ca 0.20 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1s64 h VAL 174 Cb 0.29 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 1s64 h VAL 174 CO -0.01 0.22 0.19 -0.07 0.02 0.00 0.00 177.57 177.92 1s64 h LEU 175 N 0.93 0.33 -1.34 2.57 3.38 -0.95 -0.50 115.31 119.73 1s64 h LEU 175 Ca 0.24 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 1s64 h LEU 175 Cb 0.02 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1s64 h LEU 175 CO -0.04 0.25 0.10 0.58 0.09 0.00 0.00 178.44 179.43 1s64 h VAL 176 N 0.38 1.17 -0.34 1.22 2.07 -0.99 0.00 116.25 119.77 1s64 h VAL 176 Ca 0.10 -0.58 -0.06 0.00 0.82 0.00 0.00 66.70 66.99 1s64 h VAL 176 Cb -0.03 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1s64 h VAL 176 CO -0.02 0.21 -0.00 -0.33 0.02 0.00 0.00 177.57 177.45 1s64 h GLU 177 N 0.54 0.60 -0.26 1.57 5.08 -0.72 0.63 114.58 122.02 1s64 h GLU 177 Ca 0.13 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 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 0.73 0.15 -1.49 -1.00 0.00 0.00 179.01 177.39 1s64 h TRP 178 N 0.41 0.35 0.00 4.33 6.55 -0.38 -2.86 115.95 124.35 1s64 h TRP 178 Ca 0.10 -0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.93 1s64 h TRP 178 Cb 0.46 -0.11 0.00 0.00 -0.86 0.00 0.00 29.16 28.64 1s64 h TRP 178 CO 0.04 0.28 0.00 -0.07 -1.05 0.00 0.00 178.44 177.64 1s64 h LEU 179 N 0.32 0.00 2.48 -4.49 3.38 -0.97 -3.46 115.31 112.57 1s64 h LEU 179 Ca 0.09 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.82 1s64 h LEU 179 Cb 0.04 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1s64 h LEU 179 CO -0.02 0.00 -0.31 0.29 0.09 0.00 0.00 178.44 178.49 1s64 n LYS 180 N -2.58 -2.16 -4.01 1.13 4.76 0.21 -4.92 118.16 110.59 1s64 n LYS 180 Ca 0.04 0.61 -0.31 0.00 -2.87 0.00 0.00 58.31 55.77 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 -2.03 4.40 0.00 4.39 3.68 -1.21 -4.97 116.67 120.93 1s64 s ASP 181 Ca 0.00 -1.60 0.22 0.00 2.13 0.00 0.00 52.55 53.30 1s64 s ASP 181 Cb 0.00 -1.46 0.54 0.00 -1.45 0.00 0.00 42.92 40.55 1s64 s ASP 181 CO 0.00 -0.27 1.47 -0.81 0.13 0.00 0.00 175.17 175.68 1s64 n PRO 182 N 4.45 2.63 -0.06 4.34 -0.04 -1.26 -4.64 135.00 140.41 1s64 n PRO 182 Ca -0.07 -2.48 0.24 0.00 -0.04 0.00 0.00 63.50 61.15 1s64 n PRO 182 Cb 0.42 -1.53 0.72 0.00 -0.04 0.00 0.00 33.50 33.07 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 4.27 0.00 0.53 3.54 4.64 -2.01 -2.11 113.55 122.41 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 0.98 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.04 1s64 h SER 183 CO 0.00 0.00 -1.60 0.00 -0.87 0.00 0.00 176.83 174.36 1s64 n GLN 184 N -4.15 0.63 -0.06 4.77 6.02 -1.26 -4.70 117.38 118.63 1s64 n GLN 184 Ca 0.13 0.13 -0.12 0.00 -0.01 0.00 0.00 57.00 57.13 1s64 n GLN 184 Cb 0.78 -1.73 -0.09 0.00 1.02 0.00 0.00 30.24 30.22 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 -0.41 -0.87 -1.09 4.39 -1.71 -1.94 114.58 112.95 1s64 h GLU 185 Ca -0.19 0.03 0.12 0.00 0.34 0.00 0.00 59.36 59.66 1s64 h GLU 185 Cb 1.58 0.09 -0.07 0.00 -0.10 0.00 0.00 28.75 30.26 1s64 h GLU 185 CO 0.04 -0.27 0.56 -0.07 -1.16 0.00 0.00 179.01 178.10 1s64 h LEU 186 N -0.43 0.69 -0.10 1.33 3.38 -1.84 -0.33 115.31 118.01 1s64 h LEU 186 Ca 0.04 0.03 -0.22 0.00 0.09 0.00 0.00 57.88 57.82 1s64 h LEU 186 Cb 0.55 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 41.21 1s64 h LEU 186 CO -0.44 0.37 -0.81 -0.08 0.09 0.00 0.00 178.44 177.58 1s64 h GLU 187 N 0.74 0.73 -0.20 1.13 4.81 -1.83 -2.03 114.58 117.92 1s64 h GLU 187 Ca 0.42 -0.65 -0.00 0.00 -0.13 0.00 0.00 59.36 59.01 1s64 h GLU 187 Cb 0.59 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.11 1s64 h GLU 187 CO -0.18 1.25 0.12 0.35 -0.73 0.00 0.00 179.01 179.81 1s64 h PHE 188 N 0.42 0.26 -0.64 0.92 3.57 -0.63 -2.08 116.94 118.76 1s64 h PHE 188 Ca -0.07 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.38 1s64 h PHE 188 Cb 1.45 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 40.08 1s64 h PHE 188 CO 0.10 0.20 0.21 0.82 -2.23 0.00 0.00 178.31 177.41 1s64 h ILE 189 N 0.24 1.24 -0.12 1.41 2.04 -1.13 -1.86 117.51 119.32 1s64 h ILE 189 Ca 0.07 -0.79 -0.03 0.00 1.00 0.00 0.00 64.86 65.11 1s64 h ILE 189 Cb 0.01 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.60 1s64 h ILE 189 CO -0.01 0.31 -0.06 0.00 0.00 0.00 0.00 178.15 178.39 1s64 h ALA 190 N 1.30 1.68 -0.15 1.87 0.00 -1.03 0.12 119.26 123.04 1s64 h ALA 190 Ca 0.21 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1s64 h ALA 190 Cb 0.24 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1s64 h ALA 190 CO -0.01 0.24 -0.18 -0.44 0.00 0.00 0.00 179.25 178.86 1s64 h ASP 191 N 0.18 0.42 -0.39 0.00 3.32 -0.67 -2.04 116.42 117.25 1s64 h ASP 191 Ca 0.04 -0.50 -0.02 0.00 0.02 0.00 0.00 57.03 56.58 1s64 h ASP 191 Cb 0.22 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 1s64 h ASP 191 CO 0.01 0.83 0.18 0.40 -1.72 0.00 0.00 179.24 178.94 1s64 h ILE 192 N 0.01 1.18 0.00 0.35 1.08 -0.91 -1.07 117.51 118.15 1s64 h ILE 192 Ca 0.02 -0.51 0.00 0.00 -0.39 0.00 0.00 64.86 63.98 1s64 h ILE 192 Cb 0.73 0.80 0.00 0.00 -3.07 0.00 0.00 36.82 35.28 1s64 h ILE 192 CO 0.04 0.19 0.00 0.18 -0.69 0.00 0.00 178.15 177.87 1s64 n LEU 193 N -4.69 0.50 0.13 1.44 4.77 0.36 -1.11 117.00 118.40 1s64 n LEU 193 Ca -0.00 0.68 0.01 0.00 -0.03 0.00 0.00 56.01 56.67 1s64 n LEU 193 Cb 0.12 -0.68 0.02 0.00 -2.33 0.00 0.00 43.42 40.55 1s64 n LEU 193 CO 0.36 -0.71 0.44 -1.13 -1.33 0.00 0.00 177.39 175.02 1s64 h ASN 194 N 0.00 0.00 0.72 -1.43 -0.00 -0.43 -1.99 115.58 112.45 1s64 h ASN 194 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 56.30 56.27 1s64 h ASN 194 Cb 0.16 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 38.47 1s64 h ASN 194 CO 0.00 0.57 -1.31 0.00 -0.00 0.00 0.00 177.43 176.69 1s64 n GLN 195 N -3.26 0.62 -3.21 6.67 6.02 -0.27 -4.75 117.38 119.20 1s64 n GLN 195 Ca 0.02 0.06 0.00 0.00 -0.01 0.00 0.00 57.00 57.07 1s64 n GLN 195 Cb 0.75 -1.75 -0.01 0.00 1.02 0.00 0.00 30.24 30.25 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 -5.24 -1.32 0.00 1.08 2.15 -0.82 -5.03 116.67 107.49 1s64 s ASP 196 Ca -0.03 -0.65 0.07 0.00 0.43 0.00 0.00 52.55 52.37 1s64 s ASP 196 Cb 0.10 1.86 0.37 0.00 -0.30 0.00 0.00 42.92 44.96 1s64 s ASP 196 CO 0.82 -0.20 0.95 0.00 -0.17 0.00 0.00 175.17 176.56 1s64 n ALA 197 N 4.61 1.65 -0.23 3.66 0.00 -0.75 -2.27 120.51 127.18 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 -1.11 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 -1.11 2.51 -1.55 0.00 5.02 -1.26 -4.82 118.16 116.94 1s64 n LYS 198 Ca 0.04 -1.51 -0.44 0.00 -2.02 0.00 0.00 58.31 54.37 1s64 n LYS 198 Cb 0.03 -1.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.00 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 -0.55 2.80 -0.25 4.39 2.85 -0.96 -4.83 115.26 118.72 1s64 n ASN 199 Ca 0.02 0.19 0.05 0.00 -0.11 0.00 0.00 54.58 54.72 1s64 n ASN 199 Cb 0.32 -1.47 0.29 0.00 1.24 0.00 0.00 39.78 40.16 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 14.75 0.92 -0.56 1.20 3.20 -1.95 -2.37 116.97 132.16 1s64 h TYR 200 Ca -0.35 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.51 1s64 h TYR 200 Cb 1.27 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 39.21 1s64 h TYR 200 CO 0.95 0.48 0.23 0.45 -1.64 0.00 0.00 178.16 178.63 1s64 h HIS 201 N 0.91 0.85 -0.17 -3.82 3.86 -1.88 -1.62 115.15 113.28 1s64 h HIS 201 Ca 0.35 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.49 1s64 h HIS 201 Cb 0.22 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 1s64 h HIS 201 CO -0.00 0.69 0.07 0.00 0.86 0.00 0.00 177.93 179.55 1s64 h ALA 202 N 1.08 0.23 -0.59 2.45 0.00 -1.75 -1.39 119.26 119.28 1s64 h ALA 202 Ca 0.19 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1s64 h ALA 202 Cb 0.19 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1s64 h ALA 202 CO -0.02 -0.18 0.16 -1.49 0.00 0.00 0.00 179.25 177.72 1s64 h TRP 203 N 0.13 0.93 -0.32 0.00 4.06 -1.37 0.14 115.95 119.52 1s64 h TRP 203 Ca 0.06 -0.08 -0.02 0.00 2.06 0.00 0.00 58.89 60.90 1s64 h TRP 203 Cb 0.17 -0.27 -0.01 0.00 -1.00 0.00 0.00 29.16 28.05 1s64 h TRP 203 CO -0.01 0.76 0.12 0.37 -3.56 0.00 0.00 178.44 176.11 1s64 h GLN 204 N 0.87 0.48 -0.71 0.49 4.15 -1.11 -0.60 115.11 118.68 1s64 h GLN 204 Ca 0.19 -0.09 -0.06 0.00 0.77 0.00 0.00 58.65 59.46 1s64 h GLN 204 Cb 0.28 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.87 1s64 h GLN 204 CO -0.00 0.50 0.22 1.25 -1.93 0.00 0.00 178.83 178.86 1s64 h HIS 205 N 0.36 1.15 -0.65 3.99 2.76 -0.99 -1.56 115.15 120.20 1s64 h HIS 205 Ca 0.10 -0.12 -0.02 0.00 -2.20 0.00 0.00 60.37 58.13 1s64 h HIS 205 Cb 0.20 -0.33 -0.03 0.00 1.55 0.00 0.00 27.41 28.80 1s64 h HIS 205 CO -0.00 0.92 0.32 -0.09 -1.30 0.00 0.00 177.93 177.78 1s64 h ARG 206 N 1.05 0.93 -0.19 5.26 2.43 -0.64 -0.81 114.38 122.40 1s64 h ARG 206 Ca 0.23 -0.13 -0.10 0.00 -0.81 0.00 0.00 59.98 59.17 1s64 h ARG 206 Cb 0.31 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 1s64 h ARG 206 CO -0.01 0.73 -0.30 1.96 -1.51 0.00 0.00 179.97 180.85 1s64 h GLN 207 N 0.90 0.38 -0.10 0.20 4.20 -0.82 -1.66 115.11 118.22 1s64 h GLN 207 Ca 0.22 -0.15 -0.02 0.00 0.06 0.00 0.00 58.65 58.77 1s64 h GLN 207 Cb 0.10 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 1s64 h GLN 207 CO -0.03 0.65 -0.01 2.35 -0.67 0.00 0.00 178.83 181.12 1s64 h TRP 208 N 0.33 0.19 0.12 2.96 7.01 -0.76 -1.75 115.95 124.05 1s64 h TRP 208 Ca 0.05 -0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.00 1s64 h TRP 208 Cb 0.70 -0.05 0.00 0.00 -2.10 0.00 0.00 29.16 27.71 1s64 h TRP 208 CO 0.02 0.45 -0.06 0.28 -2.79 0.00 0.00 178.44 176.33 1s64 h VAL 209 N -0.12 0.88 -0.64 2.65 2.07 -1.04 0.14 116.25 120.20 1s64 h VAL 209 Ca 0.03 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.60 1s64 h VAL 209 Cb 0.37 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 1s64 h VAL 209 CO 0.01 0.00 0.34 0.40 0.02 0.00 0.00 177.57 178.34 1s64 h ILE 210 N -0.16 0.96 -0.05 4.57 2.04 -1.32 -1.15 117.51 122.39 1s64 h ILE 210 Ca -0.02 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.61 1s64 h ILE 210 Cb 0.13 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 36.47 1s64 h ILE 210 CO 0.02 0.12 -0.05 -0.61 0.00 0.00 0.00 178.15 177.63 1s64 h GLN 211 N 0.64 0.12 -0.48 2.37 5.75 -1.12 -0.56 115.11 121.84 1s64 h GLN 211 Ca 0.29 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.69 1s64 h GLN 211 Cb 0.19 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.72 1s64 h GLN 211 CO -0.18 0.57 0.17 1.49 -2.65 0.00 0.00 178.83 178.22 1s64 h GLU 212 N -0.32 0.69 -0.17 1.69 4.57 -0.57 -3.09 114.58 117.38 1s64 h GLU 212 Ca 0.01 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 58.08 1s64 h GLU 212 Cb 0.54 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.01 1s64 h GLU 212 CO 0.01 0.58 0.00 1.19 -1.18 0.00 0.00 179.01 179.62 1s64 n PHE 213 N -4.34 0.47 -3.90 0.92 3.01 -0.45 -5.01 117.46 108.15 1s64 n PHE 213 Ca 0.04 -0.81 -0.37 0.00 1.01 0.00 0.00 57.45 57.32 1s64 n PHE 213 Cb 0.17 -0.19 0.02 0.00 -0.01 0.00 0.00 39.48 39.47 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 -0.62 -0.78 -2.36 -1.08 1.85 -0.35 -4.90 116.66 108.43 1s64 n ARG 214 Ca 0.16 0.36 -0.35 0.00 -1.00 0.00 0.00 57.85 57.02 1s64 n ARG 214 Cb 0.66 -2.84 0.01 0.00 -1.05 0.00 0.00 32.46 29.25 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 -4.17 6.31 0.15 2.89 4.77 -0.40 -4.75 117.00 121.79 1s64 n LEU 215 Ca -0.16 -5.17 0.04 0.00 -0.03 0.00 0.00 56.01 50.69 1s64 n LEU 215 Cb 0.60 -0.85 0.04 0.00 -2.33 0.00 0.00 43.42 40.88 1s64 n LEU 215 CO 0.70 2.03 0.47 -0.50 -1.33 0.00 0.00 177.39 178.76 1s64 h TRP 216 N 3.12 0.00 -0.79 -1.77 4.06 -1.91 -3.40 115.95 115.26 1s64 h TRP 216 Ca 0.43 0.00 0.21 0.00 2.06 0.00 0.00 58.89 61.59 1s64 h TRP 216 Cb 0.39 0.00 -0.15 0.00 -1.00 0.00 0.00 29.16 28.40 1s64 h TRP 216 CO 1.07 0.41 -0.01 -0.25 -3.56 0.00 0.00 178.44 176.10 1s64 n ASP 217 N -3.17 -0.11 -0.35 -3.49 8.00 -1.26 -2.40 116.55 113.77 1s64 n ASP 217 Ca 0.02 1.35 0.04 0.00 0.71 0.00 0.00 54.79 56.90 1s64 n ASP 217 Cb 0.70 -0.48 0.04 0.00 -0.02 0.00 0.00 41.12 41.36 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 -5.14 1.81 -0.23 -2.24 4.13 -1.26 -4.73 115.26 107.61 1s64 n ASN 218 Ca 0.18 -1.42 -0.07 0.00 1.68 0.00 0.00 54.58 54.95 1s64 n ASN 218 Cb 0.59 -0.02 0.04 0.00 -1.54 0.00 0.00 39.78 38.85 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 1.65 0.92 -0.03 3.52 4.57 -1.71 -2.09 114.58 121.41 1s64 h GLU 219 Ca 0.00 -0.15 0.01 0.00 -1.18 0.00 0.00 59.36 58.04 1s64 h GLU 219 Cb 0.39 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 28.82 1s64 h GLU 219 CO 0.00 0.76 0.02 1.25 -1.18 0.00 0.00 179.01 179.86 1s64 h LEU 220 N 0.87 0.00 -0.15 1.64 5.85 -1.85 0.15 115.31 121.83 1s64 h LEU 220 Ca 0.21 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.70 1s64 h LEU 220 Cb 0.16 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 -0.95 -0.61 -0.34 0.00 0.00 178.44 176.52 1s64 h GLN 221 N 0.00 0.50 -0.55 1.25 4.15 -1.79 -2.02 115.11 116.65 1s64 h GLN 221 Ca 0.01 -0.52 -0.06 0.00 0.77 0.00 0.00 58.65 58.85 1s64 h GLN 221 Cb 0.05 0.14 -0.02 0.00 0.21 0.00 0.00 27.48 27.87 1s64 h GLN 221 CO -0.00 1.16 0.11 -0.92 -1.93 0.00 0.00 178.83 177.24 1s64 h TYR 222 N 0.29 0.95 -0.45 3.99 3.20 -0.43 -1.77 116.97 122.75 1s64 h TYR 222 Ca -0.09 -0.12 -0.00 0.00 3.14 0.00 0.00 58.73 61.65 1s64 h TYR 222 Cb 1.58 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 39.57 1s64 h TYR 222 CO 0.07 0.83 0.26 0.28 -1.64 0.00 0.00 178.16 177.97 1s64 h VAL 223 N 0.79 1.15 -0.65 1.81 2.07 -0.75 -1.60 116.25 119.07 1s64 h VAL 223 Ca 0.17 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 1s64 h VAL 223 Cb 0.38 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 1s64 h VAL 223 CO 0.01 0.15 0.33 0.44 0.02 0.00 0.00 177.57 178.52 1s64 h ASP 224 N 0.59 0.81 -0.37 0.57 3.32 -1.12 -0.57 116.42 119.66 1s64 h ASP 224 Ca 0.16 -0.07 -0.05 0.00 0.02 0.00 0.00 57.03 57.09 1s64 h ASP 224 Cb 0.01 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 1s64 h ASP 224 CO -0.03 0.68 0.05 -0.61 -1.72 0.00 0.00 179.24 177.61 1s64 h GLN 225 N 0.91 0.61 0.00 3.56 4.15 -0.86 -2.89 115.11 120.59 1s64 h GLN 225 Ca 0.23 -0.17 -0.12 0.00 0.77 0.00 0.00 58.65 59.35 1s64 h GLN 225 Cb 0.07 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.67 1s64 h GLN 225 CO -0.03 0.69 -0.58 -0.07 -1.93 0.00 0.00 178.83 176.90 1s64 h LEU 226 N 0.45 0.00 -1.26 -2.39 3.38 -0.90 -2.72 115.31 111.88 1s64 h LEU 226 Ca 0.11 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 1s64 h LEU 226 Cb 0.38 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1s64 h LEU 226 CO 0.01 0.58 -0.00 -0.07 0.09 0.00 0.00 178.44 179.05 1s64 h LEU 227 N 0.00 0.00 0.12 1.67 3.38 -1.03 -1.79 115.31 117.66 1s64 h LEU 227 Ca -0.01 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.68 1s64 h LEU 227 Cb 1.04 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.80 1s64 h LEU 227 CO 0.08 0.00 -1.25 0.11 0.09 0.00 0.00 178.44 177.46 1s64 h LYS 228 N 0.00 0.36 -0.14 1.13 6.56 -1.28 -2.16 116.57 121.05 1s64 h LYS 228 Ca -0.00 -0.57 -0.12 0.00 -1.06 0.00 0.00 60.65 58.90 1s64 h LYS 228 Cb 0.58 0.21 -0.01 0.00 -0.57 0.00 0.00 32.23 32.44 1s64 h LYS 228 CO 0.00 1.26 -0.42 0.93 -2.06 0.00 0.00 179.45 179.16 1s64 h GLU 229 N 0.12 0.32 -0.82 3.15 5.08 -1.22 -3.41 114.58 117.79 1s64 h GLU 229 Ca -0.15 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.04 1s64 h GLU 229 Cb 1.96 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 31.02 1s64 h GLU 229 CO 0.22 0.69 -0.37 0.34 -1.00 0.00 0.00 179.01 178.89 1s64 s ASP 230 N -6.87 -1.27 0.00 1.42 2.15 -0.71 -5.01 116.67 106.38 1s64 s ASP 230 Ca -0.05 -0.59 0.05 0.00 0.43 0.00 0.00 52.55 52.38 1s64 s ASP 230 Cb 0.13 1.63 0.20 0.00 -0.30 0.00 0.00 42.92 44.58 1s64 s ASP 230 CO 0.79 -0.15 1.11 0.55 -0.17 0.00 0.00 175.17 177.30 1s64 n VAL 231 N 4.32 1.55 1.20 1.11 3.14 -0.81 -1.74 118.33 127.10 1s64 n VAL 231 Ca 0.10 0.39 0.13 0.00 -2.96 0.00 0.00 64.34 61.99 1s64 n VAL 231 Cb 0.58 -1.31 0.28 0.00 -1.06 0.00 0.00 33.84 32.33 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 -1.46 1.11 -1.99 1.45 1.74 -1.26 -4.77 116.66 111.48 1s64 n ARG 232 Ca 0.01 -0.76 -0.40 0.00 -0.77 0.00 0.00 57.85 55.94 1s64 n ARG 232 Cb 0.05 -1.48 -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 -2.41 5.41 0.53 0.55 3.84 -0.71 -4.84 114.94 117.30 1s64 s ASN 233 Ca 0.25 0.72 0.21 0.00 0.21 0.00 0.00 52.86 54.24 1s64 s ASN 233 Cb 0.19 -2.53 1.40 0.00 -0.55 0.00 0.00 41.25 39.77 1s64 s ASN 233 CO 0.50 -2.20 2.15 -1.13 -2.79 0.00 0.00 177.10 173.63 1s64 h ASN 234 N 14.66 0.00 -0.51 -4.21 -1.24 -1.90 -2.30 115.58 120.07 1s64 h ASN 234 Ca -0.28 0.00 -0.09 0.00 0.71 0.00 0.00 56.30 56.64 1s64 h ASN 234 Cb 1.17 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.20 1s64 h ASN 234 CO 1.15 0.04 -0.00 0.28 -1.29 0.00 0.00 177.43 177.61 1s64 h SER 235 N 0.00 0.92 -0.30 1.15 0.02 -1.89 -2.28 113.55 111.17 1s64 h SER 235 Ca -0.00 -0.25 -0.18 0.00 -0.84 0.00 0.00 61.79 60.53 1s64 h SER 235 Cb 0.09 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.38 1s64 h SER 235 CO 0.01 0.98 -0.49 0.58 -1.14 0.00 0.00 176.83 176.77 1s64 h VAL 236 N 0.87 1.27 -0.44 2.27 2.07 -1.73 -1.47 116.25 119.10 1s64 h VAL 236 Ca 0.16 -1.67 -0.04 0.00 0.82 0.00 0.00 66.70 65.97 1s64 h VAL 236 Cb 0.52 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 1s64 h VAL 236 CO 0.03 0.55 0.11 -0.50 0.02 0.00 0.00 177.57 177.78 1s64 h TRP 237 N 0.69 0.65 -0.56 1.57 4.06 -1.42 0.05 115.95 120.99 1s64 h TRP 237 Ca 0.03 -0.05 -0.10 0.00 2.06 0.00 0.00 58.89 60.84 1s64 h TRP 237 Cb 1.09 -0.20 -0.02 0.00 -1.00 0.00 0.00 29.16 29.03 1s64 h TRP 237 CO 0.07 0.56 -0.03 -0.97 -3.56 0.00 0.00 178.44 174.50 1s64 h ASN 238 N 0.63 1.00 -0.72 -3.49 -1.24 -1.16 -2.60 115.58 108.01 1s64 h ASN 238 Ca 0.15 -0.32 -0.03 0.00 0.71 0.00 0.00 56.30 56.81 1s64 h ASN 238 Cb 0.23 -0.27 -0.03 0.00 0.73 0.00 0.00 38.32 38.98 1s64 h ASN 238 CO -0.00 1.08 0.34 -0.61 -1.29 0.00 0.00 177.43 176.94 1s64 h GLN 239 N 0.90 1.04 -0.33 6.67 5.75 -0.26 -1.04 115.11 127.84 1s64 h GLN 239 Ca 0.15 -0.16 0.05 0.00 -0.15 0.00 0.00 58.65 58.54 1s64 h GLN 239 Cb 0.59 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 28.91 1s64 h GLN 239 CO 0.04 0.82 0.08 -0.09 -2.65 0.00 0.00 178.83 177.03 1s64 h ARG 240 N 1.01 0.20 -0.05 1.69 2.43 -0.77 0.55 114.38 119.44 1s64 h ARG 240 Ca 0.25 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.34 1s64 h ARG 240 Cb 0.13 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1s64 h ARG 240 CO -0.03 0.13 -0.28 1.25 -1.51 0.00 0.00 179.97 179.53 1s64 h HIS 241 N 0.21 0.10 -0.10 2.20 2.76 -1.10 -2.05 115.15 117.17 1s64 h HIS 241 Ca 0.16 -0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 1s64 h HIS 241 Cb 0.16 -0.03 -0.00 0.00 1.55 0.00 0.00 27.41 29.09 1s64 h HIS 241 CO -0.17 0.37 0.02 0.35 -1.30 0.00 0.00 177.93 177.21 1s64 h PHE 242 N 0.08 0.16 0.60 5.26 3.57 0.14 -1.45 116.94 125.31 1s64 h PHE 242 Ca 0.01 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 1s64 h PHE 242 Cb 0.55 -0.05 0.01 0.00 2.79 0.00 0.00 35.95 39.25 1s64 h PHE 242 CO 0.00 0.32 -0.29 0.28 -2.23 0.00 0.00 178.31 176.40 1s64 h VAL 243 N -0.05 0.36 -0.07 1.41 2.07 -0.73 -2.94 116.25 116.30 1s64 h VAL 243 Ca 0.03 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.38 1s64 h VAL 243 Cb 0.24 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1s64 h VAL 243 CO 0.00 0.03 -0.01 0.40 0.02 0.00 0.00 177.57 178.00 1s64 h ILE 244 N -0.93 0.94 0.00 4.57 2.04 -1.43 -1.98 117.51 120.72 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 0.66 0.93 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1s64 h ILE 244 CO 0.13 0.00 0.00 -1.54 0.00 0.00 0.00 178.15 176.75 1s64 n SER 245 N -5.12 0.38 -0.75 1.72 3.41 -0.55 -0.35 113.62 112.37 1s64 n SER 245 Ca -0.05 0.61 0.10 0.00 -0.26 0.00 0.00 58.87 59.26 1s64 n SER 245 Cb 0.06 -0.69 0.08 0.00 -0.26 0.00 0.00 64.21 63.40 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 -1.94 2.55 0.00 4.04 3.02 -0.88 -4.43 115.26 117.61 1s64 n ASN 246 Ca 0.02 -1.78 0.00 0.00 -0.03 0.00 0.00 54.58 52.79 1s64 n ASN 246 Cb 0.16 0.03 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 1.01 0.00 0.02 3.41 -2.24 -0.79 -4.94 114.28 110.75 1s64 n THR 247 Ca 0.11 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.80 1s64 n THR 247 Cb 0.47 -0.01 0.06 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 1.33 0.00 4.28 1.35 -1.78 -3.50 112.91 114.59 1s64 h THR 248 Ca 0.00 -1.84 0.00 0.00 -0.55 0.00 0.00 66.41 64.02 1s64 h THR 248 Cb 0.00 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 68.24 1s64 h THR 248 CO 0.00 0.57 0.00 0.61 -0.25 0.00 0.00 175.52 176.45 1s64 n GLY 249 N 0.27 -3.12 0.42 5.82 0.00 0.52 -4.70 105.19 104.42 1s64 n GLY 249 Ca -0.03 -1.77 0.05 0.00 0.00 0.00 0.00 46.02 44.27 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 -0.58 0.01 0.31 1.61 4.02 -1.26 -4.54 117.16 116.72 1s64 n TYR 250 Ca 0.00 -0.01 0.17 0.00 -0.01 0.00 0.00 57.90 58.05 1s64 n TYR 250 Cb 0.00 -0.00 0.72 0.00 -0.02 0.00 0.00 39.34 40.04 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 2.06 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 -0.55 0.00 -0.47 0.00 0.00 61.79 60.77 1s64 h SER 251 Cb 0.44 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.46 1s64 h SER 251 CO 0.00 0.00 0.97 -0.62 -0.87 0.00 0.00 176.83 176.31 1s64 s ASP 252 N -5.19 6.48 0.53 4.97 3.68 -1.26 -4.89 116.67 120.99 1s64 s ASP 252 Ca 0.01 0.19 0.35 0.00 2.13 0.00 0.00 52.55 55.23 1s64 s ASP 252 Cb 0.09 -2.55 1.52 0.00 -1.45 0.00 0.00 42.92 40.53 1s64 s ASP 252 CO 0.47 -1.44 1.79 0.03 0.13 0.00 0.00 175.17 176.15 1s64 h ARG 253 N 9.52 0.04 -0.17 4.34 3.08 -1.98 0.42 114.38 129.62 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 1.18 0.02 -0.49 0.00 -1.07 0.00 0.00 179.97 179.61 1s64 h ALA 254 N 1.42 0.84 -0.00 0.04 0.00 -1.93 -1.54 119.26 118.09 1s64 h ALA 254 Ca 0.59 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1s64 h ALA 254 Cb 2.26 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.96 1s64 h ALA 254 CO -0.04 0.67 -0.00 0.28 0.00 0.00 0.00 179.25 180.15 1s64 h VAL 255 N 0.35 1.52 -0.55 0.00 2.07 -0.56 -2.12 116.25 116.97 1s64 h VAL 255 Ca 0.02 -1.54 0.09 0.00 0.82 0.00 0.00 66.70 66.09 1s64 h VAL 255 Cb 0.99 2.57 -0.07 0.00 -1.52 0.00 0.00 31.29 33.26 1s64 h VAL 255 CO 0.09 0.40 0.14 0.25 0.02 0.00 0.00 177.57 178.47 1s64 h LEU 256 N -0.65 0.07 -0.56 2.57 5.85 -1.25 0.31 115.31 121.64 1s64 h LEU 256 Ca -0.00 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1s64 h LEU 256 Cb 0.66 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.77 1s64 h LEU 256 CO 0.00 0.05 0.29 -0.08 -0.34 0.00 0.00 178.44 178.36 1s64 h GLU 257 N 0.29 0.79 -0.60 1.25 4.57 -1.32 0.66 114.58 120.21 1s64 h GLU 257 Ca 0.28 -0.10 0.02 0.00 -1.18 0.00 0.00 59.36 58.37 1s64 h GLU 257 Cb 0.37 -0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 28.78 1s64 h GLU 257 CO -0.33 0.63 0.38 -0.09 -1.18 0.00 0.00 179.01 178.42 1s64 h ARG 258 N 0.75 0.75 -0.10 1.92 2.43 -0.55 -0.98 114.38 118.59 1s64 h ARG 258 Ca 0.19 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.28 1s64 h ARG 258 Cb 0.08 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1s64 h ARG 258 CO -0.03 0.49 -0.08 0.93 -1.51 0.00 0.00 179.97 179.78 1s64 h GLU 259 N 0.77 0.23 -0.86 0.20 4.39 -0.62 -0.61 114.58 118.08 1s64 h GLU 259 Ca 0.23 -0.11 0.01 0.00 0.34 0.00 0.00 59.36 59.84 1s64 h GLU 259 Cb -0.03 -0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.58 1s64 h GLU 259 CO -0.08 0.62 0.57 0.28 -1.16 0.00 0.00 179.01 179.24 1s64 h VAL 260 N -0.15 1.20 -0.36 3.13 2.07 -0.78 -0.60 116.25 120.76 1s64 h VAL 260 Ca 0.02 -0.39 -0.12 0.00 0.82 0.00 0.00 66.70 67.03 1s64 h VAL 260 Cb 0.56 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 1s64 h VAL 260 CO 0.02 0.21 -0.23 -0.61 0.02 0.00 0.00 177.57 176.98 1s64 h GLN 261 N 1.14 0.79 -0.52 1.57 5.75 -1.12 -1.99 115.11 120.73 1s64 h GLN 261 Ca 0.32 -0.37 0.00 0.00 -0.15 0.00 0.00 58.65 58.45 1s64 h GLN 261 Cb -0.10 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.41 1s64 h GLN 261 CO -0.07 1.00 0.34 -0.92 -2.65 0.00 0.00 178.83 176.53 1s64 h TYR 262 N 0.58 0.66 -0.20 3.99 3.20 -0.50 -2.03 116.97 122.67 1s64 h TYR 262 Ca 0.07 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.93 1s64 h TYR 262 Cb 0.79 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.83 1s64 h TYR 262 CO 0.06 0.42 0.03 1.15 -1.64 0.00 0.00 178.16 178.18 1s64 h THR 263 N 0.71 1.22 -0.54 1.81 2.02 -1.07 -2.00 112.91 115.06 1s64 h THR 263 Ca 0.19 -0.73 0.07 0.00 0.77 0.00 0.00 66.41 66.71 1s64 h THR 263 Cb -0.08 1.32 -0.03 0.00 -1.74 0.00 0.00 68.15 67.62 1s64 h THR 263 CO -0.04 0.23 0.36 -0.07 0.37 0.00 0.00 175.52 176.36 1s64 h LEU 264 N 0.13 0.40 -0.43 2.58 3.38 -1.20 0.30 115.31 120.47 1s64 h LEU 264 Ca 0.06 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1s64 h LEU 264 Cb 0.31 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1s64 h LEU 264 CO 0.00 0.26 -0.12 -0.33 0.09 0.00 0.00 178.44 178.34 1s64 h GLU 265 N 0.45 0.84 -0.40 1.13 4.39 -1.01 -0.95 114.58 119.03 1s64 h GLU 265 Ca 0.24 -0.33 -0.12 0.00 0.34 0.00 0.00 59.36 59.49 1s64 h GLU 265 Cb 0.35 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1s64 h GLU 265 CO -0.06 0.96 -0.22 0.52 -1.16 0.00 0.00 179.01 179.05 1s64 h MET 266 N 0.67 0.81 -0.73 2.33 2.86 -0.33 -2.55 114.93 117.98 1s64 h MET 266 Ca 0.11 -0.33 -0.06 0.00 -2.06 0.00 0.00 59.70 57.35 1s64 h MET 266 Cb 0.67 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.26 1s64 h MET 266 CO 0.05 0.95 0.21 0.82 1.06 0.00 0.00 176.91 180.00 1s64 h ILE 267 N 0.70 1.26 -0.23 -1.22 2.04 -0.32 -1.94 117.51 117.80 1s64 h ILE 267 Ca 0.10 -0.94 -0.04 0.00 1.00 0.00 0.00 64.86 64.97 1s64 h ILE 267 Cb 0.74 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1s64 h ILE 267 CO 0.06 0.37 -0.02 0.11 0.00 0.00 0.00 178.15 178.66 1s64 h LYS 268 N 1.10 0.35 -0.13 2.37 1.57 -0.93 0.22 116.57 121.12 1s64 h LYS 268 Ca 0.23 -0.06 -0.19 0.00 -1.87 0.00 0.00 60.65 58.76 1s64 h LYS 268 Cb 0.34 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 1s64 h LYS 268 CO -0.00 0.40 -0.70 -0.07 -0.57 0.00 0.00 179.45 178.51 1s64 h LEU 269 N 0.34 0.66 -6.12 2.94 4.07 -1.01 -3.39 115.31 112.79 1s64 h LEU 269 Ca 0.08 -0.41 -0.45 0.00 0.08 0.00 0.00 57.88 57.17 1s64 h LEU 269 Cb 0.27 -0.19 -0.32 0.00 1.08 0.00 0.00 40.66 41.50 1s64 h LEU 269 CO 0.01 1.16 -0.80 -0.69 -1.08 0.00 0.00 178.44 177.04 1s64 s VAL 270 N -3.75 -0.10 0.53 1.22 1.01 -0.78 -5.02 120.40 113.50 1s64 s VAL 270 Ca -0.07 -1.84 0.23 0.00 0.00 0.00 0.00 61.98 60.29 1s64 s VAL 270 Cb 0.10 -0.86 0.37 0.00 0.00 0.00 0.00 36.38 35.99 1s64 s VAL 270 CO 0.86 -0.82 2.03 1.55 0.00 0.00 0.00 175.10 178.72 1s64 h PRO 271 N 5.99 0.00 -3.75 2.72 0.13 -0.79 -3.29 132.00 133.02 1s64 h PRO 271 Ca 0.16 -0.00 -0.78 0.00 -0.87 0.00 0.00 66.00 64.51 1s64 h PRO 271 Cb 0.99 -0.00 -0.24 0.00 0.13 0.00 0.00 31.00 31.88 1s64 h PRO 271 CO 0.25 0.00 0.96 1.58 -0.23 0.00 0.00 178.00 180.56 1s64 n HIS 272 N -4.42 4.32 -3.45 1.56 -0.00 -1.26 -4.86 115.22 107.11 1s64 n HIS 272 Ca 0.07 -3.36 -0.21 0.00 0.46 0.00 0.00 57.72 54.68 1s64 n HIS 272 Cb 0.48 -1.78 -0.11 0.00 -0.12 0.00 0.00 29.99 28.46 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 1.04 2.24 0.27 0.26 3.84 -1.24 -5.03 114.94 116.33 1s64 s ASN 273 Ca 0.35 -0.90 -0.00 0.00 0.21 0.00 0.00 52.86 52.52 1s64 s ASN 273 Cb -0.03 0.24 0.51 0.00 -0.55 0.00 0.00 41.25 41.42 1s64 s ASN 273 CO -0.01 -0.40 1.83 -0.08 -2.79 0.00 0.00 177.10 175.65 1s64 h GLU 274 N 8.31 0.94 -0.34 0.43 4.81 -1.94 -2.74 114.58 124.05 1s64 h GLU 274 Ca -0.15 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.06 1s64 h GLU 274 Cb 1.06 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 30.19 1s64 h GLU 274 CO 0.37 0.62 0.10 0.77 -0.73 0.00 0.00 179.01 180.14 1s64 h SER 275 N 0.97 0.08 -0.30 1.04 0.02 -1.93 0.18 113.55 113.61 1s64 h SER 275 Ca 0.47 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.46 1s64 h SER 275 Cb 0.44 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 1s64 h SER 275 CO -0.26 0.08 0.15 0.00 -1.14 0.00 0.00 176.83 175.66 1s64 h ALA 276 N 1.23 0.39 -0.44 3.77 0.00 -1.79 -1.76 119.26 120.66 1s64 h ALA 276 Ca 0.16 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1s64 h ALA 276 Cb 0.15 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1s64 h ALA 276 CO -0.18 -0.05 0.05 -1.49 0.00 0.00 0.00 179.25 177.58 1s64 h TRP 277 N 0.36 0.72 -0.28 0.00 4.06 -1.28 -1.80 115.95 117.72 1s64 h TRP 277 Ca 0.10 -0.07 -0.10 0.00 2.06 0.00 0.00 58.89 60.88 1s64 h TRP 277 Cb 0.12 -0.21 -0.01 0.00 -1.00 0.00 0.00 29.16 28.06 1s64 h TRP 277 CO -0.02 0.65 -0.25 -0.91 -3.56 0.00 0.00 178.44 174.36 1s64 h ASN 278 N 0.66 0.55 0.06 -3.49 2.35 -0.37 -1.39 115.58 113.96 1s64 h ASN 278 Ca 0.14 -0.19 -0.00 0.00 -0.55 0.00 0.00 56.30 55.70 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 0.01 0.79 -0.03 0.22 -1.65 0.00 0.00 177.43 176.76 1s64 h TYR 279 N 0.48 -0.08 -0.24 1.19 3.20 -0.93 0.21 116.97 120.80 1s64 h TYR 279 Ca 0.07 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.99 1s64 h TYR 279 Cb 0.68 0.03 -0.06 0.00 1.54 0.00 0.00 36.73 38.92 1s64 h TYR 279 CO 0.03 0.24 -0.12 1.25 -1.64 0.00 0.00 178.16 177.92 1s64 h LEU 280 N -0.40 -0.39 -0.92 2.82 5.85 -1.20 -0.78 115.31 120.28 1s64 h LEU 280 Ca -0.01 0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.71 1s64 h LEU 280 Cb 0.36 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1s64 h LEU 280 CO 0.01 -0.15 -0.30 0.50 -0.34 0.00 0.00 178.44 178.16 1s64 h LYS 281 N -0.09 0.43 -0.65 1.25 3.64 -1.24 -3.13 116.57 116.78 1s64 h LYS 281 Ca 0.13 -0.18 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 1s64 h LYS 281 Cb 0.28 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.05 1s64 h LYS 281 CO -0.30 0.69 0.31 0.78 -2.27 0.00 0.00 179.45 178.66 1s64 h GLY 282 N 1.06 1.01 1.32 5.01 0.00 0.53 0.15 103.07 112.13 1s64 h GLY 282 Ca 0.05 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1s64 h GLY 282 CO 0.06 0.48 -0.04 0.29 0.00 0.00 0.00 176.54 177.33 1s64 n ILE 283 N -4.47 0.00 -0.01 2.60 -5.35 -0.41 -4.02 119.36 107.70 1s64 n ILE 283 Ca 0.05 -0.02 -0.00 0.00 -0.27 0.00 0.00 62.75 62.50 1s64 n ILE 283 Cb 0.13 -0.36 -0.02 0.00 -1.74 0.00 0.00 39.64 37.65 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 -0.26 7.28 4.77 -1.06 -4.78 117.00 121.79 1s64 n LEU 284 Ca 0.15 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.28 1s64 n LEU 284 Cb 0.24 0.04 0.43 0.00 -2.33 0.00 0.00 43.42 41.81 1s64 n LEU 284 CO 0.23 0.04 1.22 0.06 -1.33 0.00 0.00 177.39 177.61 1s64 h GLN 285 N 0.00 0.55 0.00 3.23 3.07 -0.85 -1.47 115.11 119.64 1s64 h GLN 285 Ca -0.04 -0.03 -0.04 0.00 0.09 0.00 0.00 58.65 58.62 1s64 h GLN 285 Cb 0.81 -0.12 -0.01 0.00 0.08 0.00 0.00 27.48 28.24 1s64 h GLN 285 CO 0.00 0.37 -0.32 -0.44 0.09 0.00 0.00 178.83 178.53 1s64 h ASP 286 N 0.57 0.00 1.08 0.06 3.45 -1.84 -3.12 116.42 116.63 1s64 h ASP 286 Ca 0.47 0.00 -0.16 0.00 0.43 0.00 0.00 57.03 57.77 1s64 h ASP 286 Cb 0.93 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.68 1s64 h ASP 286 CO -0.21 0.19 -0.74 0.03 -1.57 0.00 0.00 179.24 176.94 1s64 h ARG 287 N 0.00 0.00 0.00 3.56 2.47 -1.60 -3.49 114.38 115.32 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 1.16 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.48 1s64 h ARG 287 CO 0.02 0.74 0.00 0.41 0.56 0.00 0.00 179.97 181.71 1s64 n GLY 288 N 1.06 1.72 0.34 0.04 0.00 -0.72 -4.85 105.19 102.78 1s64 n GLY 288 Ca 0.00 -0.85 0.12 0.00 0.00 0.00 0.00 46.02 45.30 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 0.23 -0.34 0.99 3.38 -1.76 -1.20 115.31 116.61 1s64 h LEU 289 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1s64 h LEU 289 Cb 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1s64 h LEU 289 CO 0.00 0.14 0.00 -1.54 0.09 0.00 0.00 178.44 177.13 1s64 n SER 290 N -4.46 0.52 -0.14 -0.43 3.41 -1.26 -2.90 113.62 108.35 1s64 n SER 290 Ca 0.07 0.60 0.01 0.00 -0.26 0.00 0.00 58.87 59.29 1s64 n SER 290 Cb 0.35 -0.72 0.03 0.00 -0.26 0.00 0.00 64.21 63.61 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 -2.04 1.15 -3.45 4.33 1.74 -0.45 -4.30 116.66 113.65 1s64 n ARG 291 Ca 0.04 -0.22 -0.26 0.00 -0.77 0.00 0.00 57.85 56.63 1s64 n ARG 291 Cb 0.28 -1.08 -0.09 0.00 -1.02 0.00 0.00 32.46 30.55 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 -0.30 1.85 -0.33 -1.55 4.01 -1.14 -4.98 117.16 114.71 1s64 n TYR 292 Ca 0.02 -3.91 0.18 0.00 -0.16 0.00 0.00 57.90 54.03 1s64 n TYR 292 Cb 0.07 -0.40 0.41 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 4.56 0.55 0.00 -0.72 0.13 -1.86 -1.15 132.00 133.51 1s64 h PRO 293 Ca 0.16 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 65.19 1s64 h PRO 293 Cb 0.77 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 31.77 1s64 h PRO 293 CO 0.65 0.36 -0.32 -0.91 -0.23 0.00 0.00 178.00 177.55 1s64 h ASN 294 N 0.57 0.00 0.12 1.44 2.35 -1.97 -3.16 115.58 114.92 1s64 h ASN 294 Ca 0.59 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.34 1s64 h ASN 294 Cb 1.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.58 1s64 h ASN 294 CO -0.37 0.32 -0.06 0.25 -1.65 0.00 0.00 177.43 175.93 1s64 h LEU 295 N 0.00 -0.13 -0.57 1.61 5.85 -1.60 -0.39 115.31 120.08 1s64 h LEU 295 Ca -0.00 -0.19 0.12 0.00 0.84 0.00 0.00 57.88 58.64 1s64 h LEU 295 Cb 0.83 0.03 -0.10 0.00 0.37 0.00 0.00 40.66 41.79 1s64 h LEU 295 CO 0.04 0.12 -0.07 0.25 -0.34 0.00 0.00 178.44 178.44 1s64 h LEU 296 N -0.38 -0.38 -0.43 2.25 5.85 -1.51 -0.21 115.31 120.50 1s64 h LEU 296 Ca -0.02 0.15 -0.17 0.00 0.84 0.00 0.00 57.88 58.69 1s64 h LEU 296 Cb 0.31 0.30 -0.00 0.00 0.37 0.00 0.00 40.66 41.64 1s64 h LEU 296 CO 0.03 -0.14 -0.53 0.78 -0.34 0.00 0.00 178.44 178.23 1s64 h ASN 297 N 0.06 0.79 -0.13 1.25 2.35 -1.54 -1.76 115.58 116.59 1s64 h ASN 297 Ca 0.29 -0.41 -0.04 0.00 -0.55 0.00 0.00 56.30 55.58 1s64 h ASN 297 Cb 0.45 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 1s64 h ASN 297 CO -0.53 1.17 -0.03 1.56 -1.65 0.00 0.00 177.43 177.94 1s64 h GLN 298 N 0.55 0.38 -0.04 0.81 4.20 -0.32 -1.77 115.11 118.91 1s64 h GLN 298 Ca 0.02 -0.07 -0.13 0.00 0.06 0.00 0.00 58.65 58.53 1s64 h GLN 298 Cb 1.10 -0.06 0.01 0.00 0.30 0.00 0.00 27.48 28.83 1s64 h GLN 298 CO 0.11 0.43 -0.47 -0.07 -0.67 0.00 0.00 178.83 178.16 1s64 h LEU 299 N 0.37 0.49 -2.44 1.46 3.38 -0.94 -3.07 115.31 114.54 1s64 h LEU 299 Ca 0.08 -0.70 0.02 0.00 0.09 0.00 0.00 57.88 57.37 1s64 h LEU 299 Cb 0.29 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 1s64 h LEU 299 CO 0.01 1.12 0.10 -0.07 0.09 0.00 0.00 178.44 179.69 1s64 h LEU 300 N -0.10 0.00 0.00 1.67 3.38 -0.99 0.23 115.31 119.49 1s64 h LEU 300 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1s64 h LEU 300 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1s64 h LEU 300 CO 0.09 0.00 -0.20 0.47 0.09 0.00 0.00 178.44 178.90 1s64 n ASP 301 N -3.61 0.58 -0.01 -0.43 8.00 -0.70 -3.47 116.55 116.91 1s64 n ASP 301 Ca -0.01 0.37 -0.11 0.00 0.71 0.00 0.00 54.79 55.75 1s64 n ASP 301 Cb 0.19 -0.40 -0.14 0.00 -0.02 0.00 0.00 41.12 40.75 1s64 n ASP 301 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1s64 h LEU 302 N 0.00 0.07 -0.98 0.64 3.38 -0.52 -3.39 115.31 114.51 1s64 h LEU 302 Ca 0.00 -0.16 0.34 0.00 0.09 0.00 0.00 57.88 58.15 1s64 h LEU 302 Cb 0.66 -0.02 -0.17 0.00 0.09 0.00 0.00 40.66 41.22 1s64 h LEU 302 CO 0.00 1.14 0.35 -0.61 0.09 0.00 0.00 178.44 179.41 1s64 h GLN 303 N 0.01 0.07 0.06 1.13 4.15 -1.48 -0.86 115.11 118.18 1s64 h GLN 303 Ca -0.30 -0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.13 1s64 h GLN 303 Cb 2.01 -0.02 -0.05 0.00 0.21 0.00 0.00 27.48 29.64 1s64 h GLN 303 CO 0.08 0.04 -0.53 -1.35 -1.93 0.00 0.00 178.83 175.15 1s64 h PRO 304 N 0.07 -0.69 0.00 -2.39 0.11 -1.78 -3.30 132.00 124.03 1s64 h PRO 304 Ca 0.72 0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.88 1s64 h PRO 304 Cb 1.73 0.16 0.00 0.00 0.11 0.00 0.00 31.00 33.00 1s64 h PRO 304 CO -0.78 -0.46 -0.61 -1.13 -0.21 0.00 0.00 178.00 174.81 1s64 n SER 305 N -5.48 1.25 -1.49 -2.05 3.41 -0.81 -4.65 113.62 103.80 1s64 n SER 305 Ca -0.08 0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 1s64 n SER 305 Cb 0.41 -0.62 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 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 -3.76 0.00 -1.49 7.33 8.25 -0.39 -4.90 115.22 120.26 1s64 n HIS 306 Ca -0.08 -0.52 -0.31 0.00 -0.26 0.00 0.00 57.72 56.55 1s64 n HIS 306 Cb 0.31 -0.34 0.07 0.00 1.12 0.00 0.00 29.99 31.15 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 1.71 4.97 -0.20 0.41 0.15 -1.23 -4.71 113.70 114.80 1s64 s SER 307 Ca 0.00 1.60 -0.36 0.00 0.70 0.00 0.00 55.95 57.89 1s64 s SER 307 Cb 0.00 -2.41 0.15 0.00 -1.71 0.00 0.00 66.02 62.05 1s64 s SER 307 CO 0.00 -1.70 1.31 -0.94 1.20 0.00 0.00 173.24 173.11 1s64 s SER 308 N -3.72 -0.07 0.48 5.45 1.04 -1.26 -4.84 113.70 110.78 1s64 s SER 308 Ca 0.59 -0.02 0.17 0.00 0.48 0.00 0.00 55.95 57.18 1s64 s SER 308 Cb -0.15 0.08 1.16 0.00 0.10 0.00 0.00 66.02 67.21 1s64 s SER 308 CO 0.55 -0.13 2.05 1.55 0.98 0.00 0.00 173.24 178.24 1s64 h PRO 309 N 2.00 0.00 -0.70 4.02 0.13 -1.95 -2.36 132.00 133.15 1s64 h PRO 309 Ca -0.11 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.96 1s64 h PRO 309 Cb 1.16 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.26 1s64 h PRO 309 CO 0.22 0.12 0.19 1.88 -0.23 0.00 0.00 178.00 180.19 1s64 h TYR 310 N 0.00 1.15 -0.17 1.56 0.99 -1.95 0.20 116.97 118.75 1s64 h TYR 310 Ca -0.00 -0.13 -0.04 0.00 2.00 0.00 0.00 58.73 60.56 1s64 h TYR 310 Cb 0.23 -0.33 -0.01 0.00 1.00 0.00 0.00 36.73 37.62 1s64 h TYR 310 CO 0.00 0.93 -0.05 1.25 -0.00 0.00 0.00 178.16 180.29 1s64 h LEU 311 N 1.04 0.34 -0.58 3.88 6.46 -1.79 -1.09 115.31 123.56 1s64 h LEU 311 Ca 0.22 -0.38 0.03 0.00 -0.12 0.00 0.00 57.88 57.64 1s64 h LEU 311 Cb 0.34 -0.09 -0.04 0.00 -0.73 0.00 0.00 40.66 40.14 1s64 h LEU 311 CO -0.00 0.64 0.34 0.40 -0.62 0.00 0.00 178.44 179.19 1s64 h ILE 312 N 0.04 1.03 -0.85 4.05 1.08 -1.26 -0.89 117.51 120.71 1s64 h ILE 312 Ca 0.04 -0.23 -0.01 0.00 -0.39 0.00 0.00 64.86 64.28 1s64 h ILE 312 Cb 0.49 0.31 -0.04 0.00 -3.07 0.00 0.00 36.82 34.52 1s64 h ILE 312 CO 0.02 0.12 0.51 0.00 -0.69 0.00 0.00 178.15 178.11 1s64 h ALA 313 N 1.27 1.08 -0.36 1.87 0.00 -0.86 -1.30 119.26 120.97 1s64 h ALA 313 Ca 0.24 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1s64 h ALA 313 Cb 0.07 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1s64 h ALA 313 CO -0.12 0.55 0.22 0.35 0.00 0.00 0.00 179.25 180.25 1s64 h PHE 314 N 1.17 0.46 -0.52 0.00 -0.00 -0.26 -1.02 116.94 116.77 1s64 h PHE 314 Ca 0.30 0.00 0.03 0.00 -0.00 0.00 0.00 57.97 58.31 1s64 h PHE 314 Cb -0.04 -0.15 -0.04 0.00 -0.00 0.00 0.00 35.95 35.72 1s64 h PHE 314 CO -0.00 0.32 0.30 -0.07 -0.00 0.00 0.00 178.31 178.86 1s64 h LEU 315 N 0.47 0.48 -1.08 0.59 3.38 -0.67 0.13 115.31 118.61 1s64 h LEU 315 Ca 0.13 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.15 1s64 h LEU 315 Cb -0.02 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 40.58 1s64 h LEU 315 CO -0.03 0.33 0.62 0.58 0.09 0.00 0.00 178.44 180.04 1s64 h VAL 316 N 0.59 1.13 -0.24 1.22 2.07 -0.81 0.40 116.25 120.62 1s64 h VAL 316 Ca 0.21 -0.40 -0.12 0.00 0.82 0.00 0.00 66.70 67.21 1s64 h VAL 316 Cb 0.04 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 29.67 1s64 h VAL 316 CO -0.11 0.21 -0.37 0.44 0.02 0.00 0.00 177.57 177.77 1s64 h ASP 317 N 1.17 0.57 -0.01 0.57 3.45 -0.17 -0.33 116.42 121.66 1s64 h ASP 317 Ca 0.39 -0.24 -0.00 0.00 0.43 0.00 0.00 57.03 57.61 1s64 h ASP 317 Cb 0.07 -0.16 -0.00 0.00 -0.56 0.00 0.00 39.33 38.68 1s64 h ASP 317 CO -0.13 0.88 0.00 0.40 -1.57 0.00 0.00 179.24 178.82 1s64 h ILE 318 N 0.45 1.22 -0.61 0.35 2.04 -0.09 -1.41 117.51 119.47 1s64 h ILE 318 Ca 0.05 -0.65 0.02 0.00 1.00 0.00 0.00 64.86 65.28 1s64 h ILE 318 Cb 0.85 1.65 -0.03 0.00 -0.74 0.00 0.00 36.82 38.54 1s64 h ILE 318 CO 0.07 0.17 0.40 1.88 0.00 0.00 0.00 178.15 180.67 1s64 h TYR 319 N -0.26 0.72 -0.16 1.37 0.99 -0.84 -1.59 116.97 117.20 1s64 h TYR 319 Ca 0.00 0.02 -0.13 0.00 2.00 0.00 0.00 58.73 60.62 1s64 h TYR 319 Cb 0.28 -0.24 -0.01 0.00 1.00 0.00 0.00 36.73 37.75 1s64 h TYR 319 CO 0.02 0.44 -0.45 1.49 -0.00 0.00 0.00 178.16 179.66 1s64 h GLU 320 N 0.76 0.40 -0.54 4.88 4.81 -0.80 -2.01 114.58 122.09 1s64 h GLU 320 Ca 0.23 -0.21 -0.09 0.00 -0.13 0.00 0.00 59.36 59.16 1s64 h GLU 320 Cb 0.00 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1s64 h GLU 320 CO -0.06 0.77 -0.02 0.22 -0.73 0.00 0.00 179.01 179.19 1s64 h ASP 321 N 0.32 0.91 0.13 1.04 -0.00 -0.34 -1.49 116.42 116.99 1s64 h ASP 321 Ca 0.02 -0.25 -0.01 0.00 -0.00 0.00 0.00 57.03 56.79 1s64 h ASP 321 Cb 0.92 -0.24 0.00 0.00 -0.00 0.00 0.00 39.33 40.01 1s64 h ASP 321 CO 0.08 0.98 -0.06 0.24 -0.00 0.00 0.00 179.24 180.48 1s64 h MET 322 N 0.86 -0.17 -0.44 0.28 2.86 -1.02 -1.98 114.93 115.31 1s64 h MET 322 Ca 0.16 0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.85 1s64 h MET 322 Cb 0.53 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.21 1s64 h MET 322 CO 0.03 -0.07 0.30 -0.07 1.06 0.00 0.00 176.91 178.15 1s64 h LEU 323 N -0.22 0.36 -1.37 1.22 3.38 -1.21 -0.37 115.31 117.11 1s64 h LEU 323 Ca -0.02 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 1s64 h LEU 323 Cb 0.17 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1s64 h LEU 323 CO 0.03 0.25 -0.27 -0.33 0.09 0.00 0.00 178.44 178.21 1s64 h GLU 324 N 0.42 0.00 -1.83 1.13 5.08 -0.66 -3.17 114.58 115.56 1s64 h GLU 324 Ca 0.19 0.00 -0.69 0.00 -1.00 0.00 0.00 59.36 57.86 1s64 h GLU 324 Cb 0.21 0.00 -0.34 0.00 0.50 0.00 0.00 28.75 29.12 1s64 h GLU 324 CO -0.05 0.27 0.20 0.09 -1.00 0.00 0.00 179.01 178.52 1s64 n ASN 325 N -3.69 6.15 -2.92 1.42 3.02 -0.16 -4.96 115.26 114.11 1s64 n ASN 325 Ca -0.01 -3.77 -0.04 0.00 -0.03 0.00 0.00 54.58 50.73 1s64 n ASN 325 Cb 0.38 -0.79 0.00 0.00 -0.61 0.00 0.00 39.78 38.77 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 -0.47 -0.38 -1.99 3.52 10.64 -1.20 -4.89 117.38 122.62 1s64 n GLN 326 Ca 0.46 -0.03 -0.29 0.00 -1.83 0.00 0.00 57.00 55.31 1s64 n GLN 326 Cb 0.42 -0.12 0.16 0.00 -0.86 0.00 0.00 30.24 29.84 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 -4.80 7.35 -0.43 0.00 1.11 -1.26 -3.87 116.67 114.78 1s64 s ASP 328 Ca 0.70 1.60 -0.02 0.00 0.18 0.00 0.00 52.55 55.01 1s64 s ASP 328 Cb -0.06 -2.49 0.00 0.00 1.07 0.00 0.00 42.92 41.45 1s64 s ASP 328 CO 0.51 0.18 0.37 0.59 1.18 0.00 0.00 175.17 178.00 1s64 n ASN 329 N 1.79 -3.14 -0.19 0.27 5.03 -1.26 -4.84 115.26 112.92 1s64 n ASN 329 Ca -0.05 -0.18 -0.02 0.00 0.87 0.00 0.00 54.58 55.20 1s64 n ASN 329 Cb 0.49 -1.96 0.05 0.00 -1.02 0.00 0.00 39.78 37.34 1s64 n ASN 329 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 1s64 h LYS 330 N -0.82 -0.01 0.00 3.52 3.64 -1.98 0.19 116.57 121.11 1s64 h LYS 330 Ca -0.18 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.15 1s64 h LYS 330 Cb 1.12 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.93 1s64 h LYS 330 CO 0.18 -0.00 -0.20 0.93 -2.27 0.00 0.00 179.45 178.08 1s64 h GLU 331 N -0.01 0.00 0.24 1.90 5.08 -1.92 -1.30 114.58 118.57 1s64 h GLU 331 Ca 0.27 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.30 1s64 h GLU 331 Cb 0.42 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.70 1s64 h GLU 331 CO -0.59 0.20 -1.45 0.22 -1.00 0.00 0.00 179.01 176.40 1s64 h ASP 332 N 0.00 0.78 -0.08 1.42 3.58 -1.36 -3.13 116.42 117.63 1s64 h ASP 332 Ca -0.00 -0.84 -0.01 0.00 0.42 0.00 0.00 57.03 56.60 1s64 h ASP 332 Cb 0.51 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 41.30 1s64 h ASP 332 CO 0.03 1.66 0.01 0.40 -2.88 0.00 0.00 179.24 178.45 1s64 h ILE 333 N 0.14 1.21 -0.88 2.25 1.08 -0.51 -2.54 117.51 118.26 1s64 h ILE 333 Ca -0.24 -0.66 0.17 0.00 -0.39 0.00 0.00 64.86 63.74 1s64 h ILE 333 Cb 2.14 1.51 -0.10 0.00 -3.07 0.00 0.00 36.82 37.30 1s64 h ILE 333 CO 0.27 0.18 0.45 0.25 -0.69 0.00 0.00 178.15 178.61 1s64 h LEU 334 N -0.11 0.51 -1.19 1.44 5.85 -1.35 0.19 115.31 120.65 1s64 h LEU 334 Ca 0.02 0.11 -0.08 0.00 0.84 0.00 0.00 57.88 58.77 1s64 h LEU 334 Cb 0.28 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1s64 h LEU 334 CO 0.00 0.17 -0.37 0.78 -0.34 0.00 0.00 178.44 178.68 1s64 h ASN 335 N 0.58 0.00 0.05 1.25 2.35 -1.46 -1.06 115.58 117.29 1s64 h ASN 335 Ca 0.50 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 56.10 1s64 h ASN 335 Cb 0.79 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.15 1s64 h ASN 335 CO -0.41 0.37 -0.51 0.11 -1.65 0.00 0.00 177.43 175.35 1s64 h LYS 336 N 0.00 0.51 0.26 0.81 1.57 -0.23 -1.96 116.57 117.52 1s64 h LYS 336 Ca -0.00 -0.30 -0.01 0.00 -1.87 0.00 0.00 60.65 58.46 1s64 h LYS 336 Cb 0.74 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.08 1s64 h LYS 336 CO 0.05 0.90 -0.12 0.00 -0.57 0.00 0.00 179.45 179.71 1s64 h ALA 337 N 1.04 -0.35 -0.96 3.86 0.00 -0.88 -2.94 119.26 119.04 1s64 h ALA 337 Ca 0.02 -0.20 0.15 0.00 0.00 0.00 0.00 54.91 54.87 1s64 h ALA 337 Cb 1.03 0.13 -0.09 0.00 0.00 0.00 0.00 17.79 18.86 1s64 h ALA 337 CO 0.09 -0.45 0.57 -0.07 0.00 0.00 0.00 179.25 179.40 1s64 h LEU 338 N -0.84 0.78 -1.36 0.00 3.38 -1.24 0.17 115.31 116.19 1s64 h LEU 338 Ca -0.04 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1s64 h LEU 338 Cb 0.51 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1s64 h LEU 338 CO 0.06 0.35 0.33 -0.33 0.09 0.00 0.00 178.44 178.94 1s64 h GLU 339 N 0.82 0.76 0.03 1.13 5.08 -1.37 -1.64 114.58 119.39 1s64 h GLU 339 Ca 0.51 -0.07 -0.26 0.00 -1.00 0.00 0.00 59.36 58.55 1s64 h GLU 339 Cb 0.66 -0.16 0.02 0.00 0.50 0.00 0.00 28.75 29.77 1s64 h GLU 339 CO -0.33 0.55 -1.01 -0.07 -1.00 0.00 0.00 179.01 177.15 1s64 h LEU 340 N 0.78 0.85 -0.48 1.33 3.38 -0.58 -2.45 115.31 118.13 1s64 h LEU 340 Ca 0.20 -0.76 0.07 0.00 0.09 0.00 0.00 57.88 57.48 1s64 h LEU 340 Cb -0.01 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.42 1s64 h LEU 340 CO -0.04 1.50 0.16 0.00 0.09 0.00 0.00 178.44 180.16 1s64 h GLU 342 N 0.32 0.03 -0.19 0.00 4.57 -1.34 -0.60 114.58 117.38 1s64 h GLU 342 Ca 0.23 -0.01 -0.12 0.00 -1.18 0.00 0.00 59.36 58.28 1s64 h GLU 342 Cb 0.26 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 1s64 h GLU 342 CO -0.25 0.38 -0.41 0.82 -1.18 0.00 0.00 179.01 178.37 1s64 h ILE 343 N 0.03 1.31 -0.07 2.32 2.04 -0.66 -0.26 117.51 122.22 1s64 h ILE 343 Ca 0.00 -1.57 -0.03 0.00 1.00 0.00 0.00 64.86 64.26 1s64 h ILE 343 Cb 0.64 1.61 -0.00 0.00 -0.74 0.00 0.00 36.82 38.33 1s64 h ILE 343 CO 0.05 0.49 -0.06 -0.07 0.00 0.00 0.00 178.15 178.55 1s64 h LEU 344 N 0.37 0.17 -0.22 1.44 3.38 -0.38 -0.67 115.31 119.40 1s64 h LEU 344 Ca 0.03 -0.48 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 1s64 h LEU 344 Cb 0.88 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1s64 h LEU 344 CO 0.07 0.61 0.08 0.00 0.09 0.00 0.00 178.44 179.30 1s64 h ALA 345 N 0.56 0.29 0.00 1.53 0.00 -1.05 0.72 119.26 121.31 1s64 h ALA 345 Ca 0.01 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.63 1s64 h ALA 345 Cb 0.57 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1s64 h ALA 345 CO 0.02 -0.11 -0.84 1.57 0.00 0.00 0.00 179.25 179.89 1s64 h LYS 346 N 0.20 0.00 0.00 0.00 -0.00 -1.14 -3.37 116.57 112.26 1s64 h LYS 346 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.72 1s64 h LYS 346 Cb 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.42 1s64 h LYS 346 CO -0.01 0.82 0.00 -0.85 -0.00 0.00 0.00 179.45 179.41 1s64 n GLU 347 N -3.30 1.52 -0.04 0.07 0.00 -0.80 -4.89 120.64 113.21 1s64 n GLU 347 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 57.16 57.04 1s64 n GLU 347 Cb 0.87 -0.39 -0.14 0.00 0.00 0.00 0.00 31.44 31.78 1s64 n GLU 347 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1s64 n LYS 348 N -0.34 0.67 -2.99 3.44 4.76 -0.33 -4.61 118.16 118.77 1s64 n LYS 348 Ca 0.00 0.23 -0.14 0.00 -2.87 0.00 0.00 58.31 55.52 1s64 n LYS 348 Cb 0.00 -1.71 -0.00 0.00 -1.84 0.00 0.00 35.03 31.48 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 -3.12 0.69 -0.24 4.39 4.64 0.25 -4.62 116.55 118.54 1s64 n ASP 349 Ca -0.26 -2.96 0.17 0.00 -1.38 0.00 0.00 54.79 50.36 1s64 n ASP 349 Cb 1.06 -0.37 0.47 0.00 -1.04 0.00 0.00 41.12 41.25 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 1.73 0.73 -0.12 5.18 1.35 -1.69 -1.30 112.91 118.79 1s64 h THR 350 Ca 0.02 -0.17 0.03 0.00 -0.55 0.00 0.00 66.41 65.74 1s64 h THR 350 Cb 1.05 0.20 -0.00 0.00 -1.73 0.00 0.00 68.15 67.66 1s64 h THR 350 CO 0.46 0.09 0.13 -0.29 -0.25 0.00 0.00 175.52 175.65 1s64 h ILE 351 N 0.49 0.53 -0.46 6.82 2.10 -1.90 0.23 117.51 125.32 1s64 h ILE 351 Ca 0.45 0.00 -0.05 0.00 1.08 0.00 0.00 64.86 66.34 1s64 h ILE 351 Cb 1.00 0.90 -0.03 0.00 -1.09 0.00 0.00 36.82 37.60 1s64 h ILE 351 CO -0.19 0.00 0.05 0.54 -1.08 0.00 0.00 178.15 177.47 1s64 n ARG 352 N -3.88 3.67 -0.37 2.19 1.74 -0.49 -4.75 116.66 114.78 1s64 n ARG 352 Ca -0.00 -3.02 -0.09 0.00 -0.77 0.00 0.00 57.85 53.97 1s64 n ARG 352 Cb 0.24 -2.06 -0.06 0.00 -1.02 0.00 0.00 32.46 29.56 1s64 n ARG 352 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1s64 h LYS 353 N 2.65 -0.05 -0.02 5.56 3.11 -0.52 0.24 116.57 127.53 1s64 h LYS 353 Ca 0.06 0.00 -0.03 0.00 -2.81 0.00 0.00 60.65 57.88 1s64 h LYS 353 Cb 1.81 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 33.05 1s64 h LYS 353 CO 0.42 -0.03 -0.14 0.93 -2.81 0.00 0.00 179.45 177.82 1s64 h GLU 354 N -0.05 0.03 0.28 1.90 5.08 -1.85 -2.36 114.58 117.62 1s64 h GLU 354 Ca 0.20 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1s64 h GLU 354 Cb 0.48 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1s64 h GLU 354 CO -0.90 0.18 -0.13 -0.92 -1.00 0.00 0.00 179.01 176.23 1s64 h TYR 355 N 0.03 -0.35 -0.95 4.33 3.20 -0.97 -1.90 116.97 120.36 1s64 h TYR 355 Ca 0.01 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.94 1s64 h TYR 355 Cb 0.27 0.12 -0.07 0.00 1.54 0.00 0.00 36.73 38.58 1s64 h TYR 355 CO 0.00 0.00 0.60 -1.49 -1.64 0.00 0.00 178.16 175.63 1s64 h TRP 356 N -0.78 1.11 -0.30 -3.82 -0.00 -0.93 0.19 115.95 111.42 1s64 h TRP 356 Ca -0.04 0.03 -0.06 0.00 -0.00 0.00 0.00 58.89 58.82 1s64 h TRP 356 Cb 0.51 -0.36 -0.02 0.00 -0.00 0.00 0.00 29.16 29.29 1s64 h TRP 356 CO 0.04 0.54 -0.09 0.00 -0.00 0.00 0.00 178.44 178.92 1s64 h ARG 357 N 1.06 0.49 -0.49 0.49 3.08 -1.44 0.10 114.38 117.67 1s64 h ARG 357 Ca 0.42 -0.13 -0.11 0.00 0.07 0.00 0.00 59.98 60.24 1s64 h ARG 357 Cb 0.24 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1s64 h ARG 357 CO -0.19 0.59 -0.12 -0.92 -1.07 0.00 0.00 179.97 178.25 1s64 h TYR 358 N 0.46 1.01 -0.29 3.04 3.20 -0.10 -1.15 116.97 123.14 1s64 h TYR 358 Ca 0.09 -0.20 -0.03 0.00 3.14 0.00 0.00 58.73 61.72 1s64 h TYR 358 Cb 0.44 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1s64 h TYR 358 CO 0.01 0.97 0.05 0.82 -1.64 0.00 0.00 178.16 178.37 1s64 h ILE 359 N 0.82 1.23 0.06 1.81 1.08 0.17 -2.10 117.51 120.58 1s64 h ILE 359 Ca 0.13 -0.79 0.03 0.00 -0.39 0.00 0.00 64.86 63.84 1s64 h ILE 359 Cb 0.65 1.19 -0.05 0.00 -3.07 0.00 0.00 36.82 35.54 1s64 h ILE 359 CO 0.05 0.26 -0.33 1.23 -0.69 0.00 0.00 178.15 178.67 1s64 h GLY 360 N 0.30 -0.59 1.10 5.37 0.00 -0.52 -0.79 103.07 107.95 1s64 h GLY 360 Ca 0.09 0.39 0.11 0.00 0.00 0.00 0.00 47.33 47.92 1s64 h GLY 360 CO 0.01 -0.24 0.35 3.21 0.00 0.00 0.00 176.54 179.86 1s64 h ARG 361 N -0.52 0.19 -0.35 4.80 3.08 -1.16 -0.53 114.38 119.89 1s64 h ARG 361 Ca 0.04 -0.01 -0.13 0.00 0.07 0.00 0.00 59.98 59.95 1s64 h ARG 361 Cb 0.57 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 1s64 h ARG 361 CO -0.23 0.12 -0.32 0.77 -1.07 0.00 0.00 179.97 179.25 1s64 h SER 362 N 0.19 0.80 -0.31 7.04 0.02 -0.48 -2.47 113.55 118.35 1s64 h SER 362 Ca 0.24 -0.33 -0.11 0.00 -0.84 0.00 0.00 61.79 60.74 1s64 h SER 362 Cb 0.68 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 1s64 h SER 362 CO -0.04 1.05 -0.25 -0.07 -1.14 0.00 0.00 176.83 176.38 1s64 h LEU 363 N 0.65 0.75 0.03 5.07 3.38 0.18 -2.98 115.31 122.39 1s64 h LEU 363 Ca 0.07 -0.45 -0.00 0.00 0.09 0.00 0.00 57.88 57.59 1s64 h LEU 363 Cb 0.85 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1s64 h LEU 363 CO 0.07 1.05 -0.01 1.56 0.09 0.00 0.00 178.44 181.20 1s64 h GLN 364 N 0.47 -0.04 0.00 1.13 4.20 -1.32 -1.32 115.11 118.24 1s64 h GLN 364 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1s64 h GLN 364 Cb 0.81 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.60 1s64 h GLN 364 CO 0.07 0.10 0.00 -1.13 -0.67 0.00 0.00 178.83 177.20 1s64 n SER 365 N -5.04 0.00 -0.02 1.46 3.41 -0.93 -2.68 113.62 109.81 1s64 n SER 365 Ca -0.08 0.11 0.04 0.00 -0.26 0.00 0.00 58.87 58.69 1s64 n SER 365 Cb 0.10 -0.29 -0.10 0.00 -0.26 0.00 0.00 64.21 63.66 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 -1.29 0.72 -3.36 4.33 4.01 -1.00 -4.81 118.16 116.76 1s64 n LYS 366 Ca 0.06 -0.09 -0.26 0.00 -0.51 0.00 0.00 58.31 57.51 1s64 n LYS 366 Cb 0.10 -1.30 -0.08 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 -2.04 0.73 -1.69 2.13 8.25 -0.53 -5.09 115.22 116.98 1s64 n HIS 367 Ca -0.06 -3.71 0.00 0.00 -0.26 0.00 0.00 57.72 53.70 1s64 n HIS 367 Cb 0.44 -0.28 0.00 0.00 1.12 0.00 0.00 29.99 31.27 1s64 n HIS 367 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41