#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nd2 n ASP 11 N 0.00 0.88 0.06 -3.46 5.75 -1.26 -3.31 116.55 115.21 1nd2 n ASP 11 Ca 0.00 -1.38 0.12 0.00 -0.01 0.00 0.00 54.79 53.52 1nd2 n ASP 11 Cb 0.00 -0.02 0.05 0.00 -1.03 0.00 0.00 41.12 40.13 1nd2 n ASP 11 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1nd2 n ARG 12 N -0.28 0.40 -3.90 0.11 5.12 -1.26 -4.55 116.66 112.30 1nd2 n ARG 12 Ca 0.19 0.06 -0.28 0.00 -1.93 0.00 0.00 57.85 55.89 1nd2 n ARG 12 Cb 0.24 -1.69 -0.03 0.00 -1.16 0.00 0.00 32.46 29.81 1nd2 n ARG 12 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1nd2 s ILE 13 N -3.25 5.33 -0.12 0.55 1.01 -1.21 -0.66 121.20 122.85 1nd2 s ILE 13 Ca 0.03 -0.53 -0.18 0.00 0.00 0.00 0.00 60.65 59.97 1nd2 s ILE 13 Cb 0.13 -3.70 0.04 0.00 0.01 0.00 0.00 42.46 38.94 1nd2 s ILE 13 CO 0.78 -0.01 0.46 -0.51 0.00 0.00 0.00 174.94 175.65 1nd2 s ILE 14 N -1.67 0.02 -0.06 2.92 2.07 -0.49 -4.93 121.20 119.06 1nd2 s ILE 14 Ca 0.35 -0.13 0.00 0.00 -1.41 0.00 0.00 60.65 59.46 1nd2 s ILE 14 Cb -0.12 -0.70 0.02 0.00 0.13 0.00 0.00 42.46 41.80 1nd2 s ILE 14 CO 0.28 -0.07 -0.03 -1.58 -1.91 0.00 0.00 174.94 171.64 1nd2 s GLN 15 N -0.38 0.76 -0.19 3.50 0.74 -1.26 -2.25 119.66 120.59 1nd2 s GLN 15 Ca -0.05 -0.02 0.01 0.00 0.05 0.00 0.00 55.36 55.35 1nd2 s GLN 15 Cb -0.03 -0.92 0.03 0.00 1.10 0.00 0.00 33.01 33.18 1nd2 s GLN 15 CO 0.03 -0.18 -0.18 0.42 -0.55 0.00 0.00 175.29 174.83 1nd2 s ILE 16 N 1.38 2.02 -0.18 -2.34 1.01 0.06 -4.96 121.20 118.19 1nd2 s ILE 16 Ca -0.04 -0.99 -0.03 0.00 0.00 0.00 0.00 60.65 59.59 1nd2 s ILE 16 Cb -0.13 -1.87 -0.02 0.00 0.01 0.00 0.00 42.46 40.45 1nd2 s ILE 16 CO -0.03 0.46 -0.06 -0.89 0.00 0.00 0.00 174.94 174.42 1nd2 s THR 17 N 1.29 3.45 -0.11 2.92 2.01 -1.26 -0.50 115.64 123.44 1nd2 s THR 17 Ca 0.03 -0.50 -0.03 0.00 0.31 0.00 0.00 61.69 61.51 1nd2 s THR 17 Cb -0.14 -2.52 0.04 0.00 0.01 0.00 0.00 72.50 69.89 1nd2 s THR 17 CO -0.12 0.47 0.05 -0.13 -0.69 0.00 0.00 174.62 174.20 1nd2 s ARG 18 N 0.85 0.24 7.65 4.92 1.81 0.62 -5.01 118.95 130.04 1nd2 s ARG 18 Ca -0.02 0.06 0.00 0.00 -1.72 0.00 0.00 55.73 54.05 1nd2 s ARG 18 Cb -0.15 -1.24 0.00 0.00 -0.45 0.00 0.00 34.95 33.11 1nd2 s ARG 18 CO 0.01 -0.47 0.00 0.41 -0.68 0.00 0.00 175.30 174.57 1nd2 n GLY 19 N 5.22 4.15 1.71 -3.53 0.00 -1.16 -0.86 105.19 110.71 1nd2 n GLY 19 Ca -0.06 0.11 0.07 0.00 0.00 0.00 0.00 46.02 46.14 1nd2 n GLY 19 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nd2 n ASP 20 N 7.81 5.12 -4.30 1.61 8.00 -1.26 -4.93 116.55 128.59 1nd2 n ASP 20 Ca 0.00 -2.70 -0.29 0.00 0.71 0.00 0.00 54.79 52.51 1nd2 n ASP 20 Cb 0.00 -0.63 -0.15 0.00 -0.02 0.00 0.00 41.12 40.32 1nd2 n ASP 20 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1nd2 s SER 21 N -0.78 2.91 -0.05 -2.24 1.04 -0.04 -5.06 113.70 109.47 1nd2 s SER 21 Ca 0.50 -0.52 0.00 0.00 0.48 0.00 0.00 55.95 56.41 1nd2 s SER 21 Cb 0.36 -0.28 0.03 0.00 0.10 0.00 0.00 66.02 66.23 1nd2 s SER 21 CO 0.18 0.25 -0.01 -0.89 0.98 0.00 0.00 173.24 173.75 1nd2 s THR 22 N -0.72 0.37 -0.02 2.02 2.01 -1.26 -0.27 115.64 117.76 1nd2 s THR 22 Ca 0.10 0.03 0.06 0.00 0.31 0.00 0.00 61.69 62.19 1nd2 s THR 22 Cb -0.09 -0.46 -0.02 0.00 0.01 0.00 0.00 72.50 71.93 1nd2 s THR 22 CO 0.01 0.21 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.32 1nd2 s ILE 23 N 1.31 2.55 0.19 1.82 1.01 0.35 -4.95 121.20 123.48 1nd2 s ILE 23 Ca -0.05 -0.97 0.07 0.00 0.00 0.00 0.00 60.65 59.69 1nd2 s ILE 23 Cb -0.13 -1.96 -0.05 0.00 0.01 0.00 0.00 42.46 40.33 1nd2 s ILE 23 CO -0.02 0.55 -0.13 0.42 0.00 0.00 0.00 174.94 175.76 1nd2 s THR 24 N -0.70 1.58 -0.24 2.92 -4.23 -1.26 -0.76 115.64 112.95 1nd2 s THR 24 Ca 0.11 -2.17 -0.16 0.00 -1.18 0.00 0.00 61.69 58.29 1nd2 s THR 24 Cb -0.10 -2.02 0.07 0.00 1.34 0.00 0.00 72.50 71.78 1nd2 s THR 24 CO 0.00 -0.61 0.61 -0.55 -0.54 0.00 0.00 174.62 173.53 1nd2 s SER 25 N -3.29 -0.76 0.00 3.99 0.15 -0.95 -5.01 113.70 107.83 1nd2 s SER 25 Ca 0.22 1.30 0.21 0.00 0.70 0.00 0.00 55.95 58.37 1nd2 s SER 25 Cb 0.00 1.22 0.57 0.00 -1.71 0.00 0.00 66.02 66.10 1nd2 s SER 25 CO 0.06 -0.22 1.48 0.00 1.20 0.00 0.00 173.24 175.75 1nd2 n GLN 26 N 3.81 2.72 -3.04 5.44 6.02 -1.26 -1.40 117.38 129.66 1nd2 n GLN 26 Ca -0.19 -2.53 -0.15 0.00 -0.01 0.00 0.00 57.00 54.12 1nd2 n GLN 26 Cb 0.57 -1.51 -0.03 0.00 1.02 0.00 0.00 30.24 30.28 1nd2 n GLN 26 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1nd2 n ASP 27 N 1.45 -1.84 -4.90 1.08 8.00 -0.86 -4.41 116.55 115.07 1nd2 n ASP 27 Ca 0.22 -2.74 -0.21 0.00 0.71 0.00 0.00 54.79 52.77 1nd2 n ASP 27 Cb 0.59 0.62 -0.02 0.00 -0.02 0.00 0.00 41.12 42.29 1nd2 n ASP 27 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1nd2 s VAL 28 N 0.28 2.62 -0.53 2.53 -7.23 0.16 -1.19 120.40 117.04 1nd2 s VAL 28 Ca 0.32 -1.30 0.06 0.00 -1.81 0.00 0.00 61.98 59.25 1nd2 s VAL 28 Cb 0.07 -2.92 0.35 0.00 0.56 0.00 0.00 36.38 34.44 1nd2 s VAL 28 CO -0.14 0.00 0.94 0.00 -0.31 0.00 0.00 175.10 175.59 1nd2 n ALA 29 N -1.62 4.38 -0.81 1.32 0.00 -1.26 -4.76 120.51 117.76 1nd2 n ALA 29 Ca 0.04 -4.48 0.00 0.00 0.00 0.00 0.00 53.44 49.00 1nd2 n ALA 29 Cb 0.62 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 19.33 1nd2 n ALA 29 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1nd2 n ASN 30 N -0.21 -1.37 -3.82 0.00 4.05 -1.26 -4.89 115.26 107.76 1nd2 n ASN 30 Ca 0.31 0.00 -0.10 0.00 0.45 0.00 0.00 54.58 55.24 1nd2 n ASN 30 Cb 0.46 0.00 -0.07 0.00 1.23 0.00 0.00 39.78 41.40 1nd2 n ASN 30 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1nd2 s ALA 31 N -1.81 -0.40 -0.08 5.20 0.00 -1.26 -4.58 121.76 118.83 1nd2 s ALA 31 Ca 0.00 -0.36 0.03 0.00 0.00 0.00 0.00 51.96 51.63 1nd2 s ALA 31 Cb 0.00 0.41 -0.02 0.00 0.00 0.00 0.00 23.12 23.51 1nd2 s ALA 31 CO 0.00 -0.46 -0.16 0.08 0.00 0.00 0.00 175.76 175.22 1nd2 s VAL 32 N -3.22 2.87 -0.37 0.00 1.01 -0.43 -5.03 120.40 115.23 1nd2 s VAL 32 Ca -0.00 -0.77 -0.04 0.00 0.00 0.00 0.00 61.98 61.17 1nd2 s VAL 32 Cb 0.02 -2.14 0.08 0.00 0.00 0.00 0.00 36.38 34.34 1nd2 s VAL 32 CO -0.07 0.57 0.14 -0.69 0.00 0.00 0.00 175.10 175.04 1nd2 s VAL 33 N -0.28 3.39 -0.43 2.92 1.01 -1.26 0.01 120.40 125.77 1nd2 s VAL 33 Ca 0.01 -1.64 -0.45 0.00 0.00 0.00 0.00 61.98 59.90 1nd2 s VAL 33 Cb -0.13 -3.13 -0.19 0.00 0.00 0.00 0.00 36.38 32.94 1nd2 s VAL 33 CO 0.03 -0.42 1.67 0.61 0.00 0.00 0.00 175.10 176.98 1nd2 n GLY 34 N 4.68 0.40 2.23 4.51 0.00 0.13 -0.21 105.19 116.93 1nd2 n GLY 34 Ca -0.08 0.99 -0.16 0.00 0.00 0.00 0.00 46.02 46.77 1nd2 n GLY 34 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1nd2 n TYR 35 N 4.58 -0.39 -1.42 1.61 4.01 -1.26 -1.85 117.16 122.45 1nd2 n TYR 35 Ca 0.30 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.90 1nd2 n TYR 35 Cb 0.00 -2.92 -0.06 0.00 -0.31 0.00 0.00 39.34 36.05 1nd2 n TYR 35 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1nd2 n GLY 36 N -0.37 1.45 3.20 2.72 0.00 0.70 -4.98 105.19 107.91 1nd2 n GLY 36 Ca -0.16 -0.17 -0.34 0.00 0.00 0.00 0.00 46.02 45.35 1nd2 n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nd2 s VAL 37 N -2.41 2.58 0.25 1.61 1.01 -0.77 -5.08 120.40 117.58 1nd2 s VAL 37 Ca 0.00 -0.77 -0.30 0.00 0.00 0.00 0.00 61.98 60.92 1nd2 s VAL 37 Cb 0.00 -2.12 -0.09 0.00 0.00 0.00 0.00 36.38 34.17 1nd2 s VAL 37 CO 0.00 0.50 0.97 0.86 0.00 0.00 0.00 175.10 177.42 1nd2 s TRP 38 N 1.33 3.91 0.50 5.22 -0.11 -1.26 -3.84 118.94 124.69 1nd2 s TRP 38 Ca 0.05 1.88 -0.23 0.00 1.22 0.00 0.00 56.10 59.01 1nd2 s TRP 38 Cb -0.14 -3.04 -0.07 0.00 -1.50 0.00 0.00 33.47 28.73 1nd2 s TRP 38 CO -0.09 0.27 1.33 -0.35 -4.62 0.00 0.00 176.95 173.50 1nd2 n PRO 39 N 1.43 1.82 -3.67 5.86 -0.04 -1.26 -4.89 135.00 134.25 1nd2 n PRO 39 Ca -0.02 0.66 -0.11 0.00 -0.04 0.00 0.00 63.50 63.99 1nd2 n PRO 39 Cb 0.47 -2.52 -0.06 0.00 -0.04 0.00 0.00 33.50 31.35 1nd2 n PRO 39 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1nd2 s HIS 40 N -1.26 -0.20 0.74 0.54 -3.43 -1.26 -4.95 115.29 105.46 1nd2 s HIS 40 Ca 0.67 0.01 -0.13 0.00 -0.80 0.00 0.00 55.06 54.82 1nd2 s HIS 40 Cb -0.44 0.21 0.04 0.00 -1.43 0.00 0.00 32.58 30.96 1nd2 s HIS 40 CO 0.53 -0.62 1.13 0.71 -2.00 0.00 0.00 174.74 174.49 1nd2 s TYR 41 N -3.12 2.39 0.16 0.38 2.02 -1.26 -4.93 117.35 112.99 1nd2 s TYR 41 Ca -0.01 1.59 -0.31 0.00 -0.37 0.00 0.00 57.07 57.97 1nd2 s TYR 41 Cb 0.01 -3.20 -0.09 0.00 -0.40 0.00 0.00 41.96 38.28 1nd2 s TYR 41 CO -0.07 -2.01 1.38 -1.17 -1.57 0.00 0.00 175.55 172.11 1nd2 s LEU 42 N -5.44 4.39 0.42 -1.29 2.96 -1.26 -5.02 118.68 113.44 1nd2 s LEU 42 Ca 0.66 2.41 -0.05 0.00 -0.22 0.00 0.00 54.13 56.94 1nd2 s LEU 42 Cb -0.21 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.84 1nd2 s LEU 42 CO 0.48 -0.63 0.71 0.42 -1.32 0.00 0.00 176.35 176.01 1nd2 s THR 43 N 0.68 4.95 -0.34 3.68 -4.23 -1.26 -4.94 115.64 114.18 1nd2 s THR 43 Ca 0.62 0.09 0.25 0.00 -1.18 0.00 0.00 61.69 61.46 1nd2 s THR 43 Cb -0.38 -3.84 0.26 0.00 1.34 0.00 0.00 72.50 69.88 1nd2 s THR 43 CO 0.34 -0.69 1.74 1.55 -0.54 0.00 0.00 174.62 177.02 1nd2 h PRO 44 N 0.61 0.00 0.02 3.99 0.13 -1.95 -1.23 132.00 133.57 1nd2 h PRO 44 Ca -0.48 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.45 1nd2 h PRO 44 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 1nd2 h PRO 44 CO 0.62 0.00 -0.96 -0.56 -0.23 0.00 0.00 178.00 176.87 1nd2 h GLN 45 N 0.00 0.11 0.00 0.86 -0.00 -2.03 -3.31 115.11 110.74 1nd2 h GLN 45 Ca 0.00 -0.14 0.00 0.00 -0.00 0.00 0.00 58.65 58.51 1nd2 h GLN 45 Cb 0.29 0.05 0.00 0.00 -0.00 0.00 0.00 27.48 27.82 1nd2 h GLN 45 CO 0.00 0.98 -1.15 -0.25 -0.00 0.00 0.00 178.83 178.41 1nd2 n ASP 46 N -3.52 0.85 -4.77 0.06 8.00 -0.99 -4.99 116.55 111.18 1nd2 n ASP 46 Ca -0.03 -0.84 -0.32 0.00 0.71 0.00 0.00 54.79 54.31 1nd2 n ASP 46 Cb 0.88 1.15 0.06 0.00 -0.02 0.00 0.00 41.12 43.19 1nd2 n ASP 46 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1nd2 s ALA 47 N -3.08 2.40 0.00 2.24 0.00 -0.50 -4.63 121.76 118.20 1nd2 s ALA 47 Ca 0.06 0.45 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1nd2 s ALA 47 Cb 0.16 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.97 1nd2 s ALA 47 CO 0.88 -1.43 0.00 -2.37 0.00 0.00 0.00 175.76 172.84 1nd2 n THR 48 N -2.77 0.00 -1.91 0.00 5.66 -1.26 -5.01 114.28 108.98 1nd2 n THR 48 Ca 0.10 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.68 1nd2 n THR 48 Cb 0.52 -0.78 -0.03 0.00 -1.55 0.00 0.00 70.33 68.50 1nd2 n THR 48 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nd2 s ALA 49 N -1.88 3.74 -1.61 1.79 0.00 -1.26 -4.93 121.76 117.61 1nd2 s ALA 49 Ca 0.00 1.41 0.25 0.00 0.00 0.00 0.00 51.96 53.62 1nd2 s ALA 49 Cb 0.00 -3.61 0.43 0.00 0.00 0.00 0.00 23.12 19.94 1nd2 s ALA 49 CO 0.00 -0.82 1.36 0.44 0.00 0.00 0.00 175.76 176.74 1nd2 n ILE 50 N 3.16 0.00 -2.21 0.00 -5.35 -1.26 -4.94 119.36 108.76 1nd2 n ILE 50 Ca 0.11 -0.12 -0.32 0.00 -0.27 0.00 0.00 62.75 62.15 1nd2 n ILE 50 Cb 0.39 0.63 -0.02 0.00 -1.74 0.00 0.00 39.64 38.90 1nd2 n ILE 50 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 1nd2 s ASP 51 N -2.64 6.46 0.03 7.28 -4.77 -1.26 -4.99 116.67 116.79 1nd2 s ASP 51 Ca 0.19 1.49 -0.30 0.00 -3.30 0.00 0.00 52.55 50.62 1nd2 s ASP 51 Cb 0.18 -2.48 -0.06 0.00 -1.09 0.00 0.00 42.92 39.47 1nd2 s ASP 51 CO 0.60 -0.69 1.38 -0.75 0.70 0.00 0.00 175.17 176.41 1nd2 s LYS 52 N -4.50 4.30 0.64 2.11 2.20 -1.26 -4.97 119.74 118.26 1nd2 s LYS 52 Ca 0.57 1.97 -0.15 0.00 -0.36 0.00 0.00 55.97 58.00 1nd2 s LYS 52 Cb -0.10 -3.49 -0.01 0.00 -1.51 0.00 0.00 37.83 32.71 1nd2 s LYS 52 CO 0.40 -0.52 1.08 -2.14 -0.36 0.00 0.00 175.35 173.81 1nd2 s PRO 53 N 2.03 3.01 -0.12 4.03 0.02 -1.26 -4.89 135.00 137.82 1nd2 s PRO 53 Ca 0.64 1.28 -0.05 0.00 0.02 0.00 0.00 61.00 62.89 1nd2 s PRO 53 Cb -0.32 -1.99 -0.04 0.00 0.02 0.00 0.00 34.50 32.17 1nd2 s PRO 53 CO 0.27 -1.06 0.07 -0.08 -0.33 0.00 0.00 177.00 175.87 1nd2 s THR 54 N -2.44 4.88 -0.43 0.99 -1.32 0.24 -4.91 115.64 112.64 1nd2 s THR 54 Ca 0.65 -0.03 0.02 0.00 -1.21 0.00 0.00 61.69 61.12 1nd2 s THR 54 Cb -0.18 -3.11 0.13 0.00 -1.51 0.00 0.00 72.50 67.83 1nd2 s THR 54 CO 0.41 0.59 0.22 -1.10 -2.21 0.00 0.00 174.62 172.52 1nd2 s GLN 55 N -0.72 1.29 0.63 7.08 -0.21 -1.26 -1.30 119.66 125.17 1nd2 s GLN 55 Ca 0.12 -1.96 0.31 0.00 0.02 0.00 0.00 55.36 53.86 1nd2 s GLN 55 Cb -0.12 -2.41 1.70 0.00 1.00 0.00 0.00 33.01 33.18 1nd2 s GLN 55 CO 0.03 -1.13 1.95 -1.35 -2.12 0.00 0.00 175.29 172.66 1nd2 h PRO 56 N 6.88 0.00 0.00 2.91 0.11 -1.98 -3.47 132.00 136.45 1nd2 h PRO 56 Ca -0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1nd2 h PRO 56 Cb 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1nd2 h PRO 56 CO 0.50 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 174.82 1nd2 n ASP 57 N -2.83 0.00 0.32 -2.05 2.03 -1.26 -2.61 116.55 110.15 1nd2 n ASP 57 Ca -0.02 0.00 0.21 0.00 0.52 0.00 0.00 54.79 55.50 1nd2 n ASP 57 Cb 0.30 0.00 1.10 0.00 -0.72 0.00 0.00 41.12 41.80 1nd2 n ASP 57 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1nd2 h THR 58 N 0.00 0.02 -0.00 5.18 1.35 -1.90 0.21 112.91 117.77 1nd2 h THR 58 Ca 0.00 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 1nd2 h THR 58 Cb 0.00 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 67.54 1nd2 h THR 58 CO 0.00 0.00 -0.01 -1.20 -0.25 0.00 0.00 175.52 174.06 1nd2 n SER 59 N -3.11 0.01 0.00 5.36 7.64 -1.07 -3.99 113.62 118.46 1nd2 n SER 59 Ca -0.02 0.43 0.00 0.00 1.01 0.00 0.00 58.87 60.29 1nd2 n SER 59 Cb 0.12 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.86 1nd2 n SER 59 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1nd2 n SER 60 N -1.48 3.99 -3.79 6.43 3.41 -0.79 -4.27 113.62 117.13 1nd2 n SER 60 Ca 0.08 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.27 1nd2 n SER 60 Cb 0.33 0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.62 1nd2 n SER 60 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1nd2 n ASN 61 N -1.87 5.62 -4.14 4.04 3.02 0.67 -4.20 115.26 118.41 1nd2 n ASN 61 Ca 0.00 -3.11 -0.09 0.00 -0.03 0.00 0.00 54.58 51.35 1nd2 n ASN 61 Cb 0.42 -1.46 -0.10 0.00 -0.61 0.00 0.00 39.78 38.03 1nd2 n ASN 61 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nd2 s ARG 62 N 0.16 0.86 0.04 3.52 1.70 -1.26 -2.99 118.95 120.97 1nd2 s ARG 62 Ca 0.42 -1.40 -0.30 0.00 -0.47 0.00 0.00 55.73 53.98 1nd2 s ARG 62 Cb 0.11 0.23 -0.05 0.00 -0.57 0.00 0.00 34.95 34.68 1nd2 s ARG 62 CO -0.01 -0.23 1.15 -0.06 -1.08 0.00 0.00 175.30 175.07 1nd2 s PHE 63 N -4.02 3.47 -0.20 5.89 0.08 -1.26 -3.82 117.98 118.11 1nd2 s PHE 63 Ca 0.21 1.38 -0.01 0.00 0.12 0.00 0.00 56.93 58.63 1nd2 s PHE 63 Cb 0.08 -3.36 0.01 0.00 -0.57 0.00 0.00 43.02 39.18 1nd2 s PHE 63 CO -0.01 -1.01 -0.14 0.71 -0.10 0.00 0.00 175.22 174.67 1nd2 s TYR 64 N 1.14 2.85 -0.20 0.36 2.02 0.25 -4.91 117.35 118.86 1nd2 s TYR 64 Ca 0.57 -1.42 -0.17 0.00 -0.37 0.00 0.00 57.07 55.68 1nd2 s TYR 64 Cb -0.27 -1.99 -0.04 0.00 -0.40 0.00 0.00 41.96 39.27 1nd2 s TYR 64 CO 0.28 -0.72 0.47 0.99 -1.57 0.00 0.00 175.55 175.00 1nd2 s THR 65 N 1.35 5.15 0.97 -0.71 2.01 -1.26 -1.22 115.64 121.92 1nd2 s THR 65 Ca 0.05 0.85 -0.16 0.00 0.31 0.00 0.00 61.69 62.74 1nd2 s THR 65 Cb -0.14 -3.80 0.20 0.00 0.01 0.00 0.00 72.50 68.78 1nd2 s THR 65 CO -0.09 0.21 1.30 -0.76 -0.69 0.00 0.00 174.62 174.59 1nd2 s LEU 66 N 1.48 2.57 0.26 4.42 1.02 -0.06 -5.01 118.68 123.37 1nd2 s LEU 66 Ca 0.22 0.33 -0.29 0.00 0.02 0.00 0.00 54.13 54.40 1nd2 s LEU 66 Cb -0.15 -2.38 -0.10 0.00 0.02 0.00 0.00 46.19 43.58 1nd2 s LEU 66 CO 0.09 -2.77 1.30 -1.81 0.02 0.00 0.00 176.35 173.18 1nd2 s ASP 67 N -4.80 6.86 0.64 2.29 1.01 -1.26 -4.67 116.67 116.74 1nd2 s ASP 67 Ca 0.73 2.53 -0.13 0.00 0.71 0.00 0.00 52.55 56.39 1nd2 s ASP 67 Cb -0.05 -2.63 -0.01 0.00 1.01 0.00 0.00 42.92 41.24 1nd2 s ASP 67 CO 0.53 -0.51 1.06 -0.44 0.21 0.00 0.00 175.17 176.02 1nd2 s SER 68 N -0.10 5.59 0.23 0.27 0.01 -1.26 -4.74 113.70 113.69 1nd2 s SER 68 Ca 0.53 1.71 0.11 0.00 1.31 0.00 0.00 55.95 59.61 1nd2 s SER 68 Cb -0.38 -2.51 -0.05 0.00 0.21 0.00 0.00 66.02 63.29 1nd2 s SER 68 CO 0.45 -1.30 -0.21 -0.54 0.41 0.00 0.00 173.24 172.05 1nd2 s LYS 69 N -4.57 1.55 -0.19 12.44 -0.14 -0.31 -4.95 119.74 123.57 1nd2 s LYS 69 Ca 0.61 -1.63 -0.07 0.00 -1.36 0.00 0.00 55.97 53.52 1nd2 s LYS 69 Cb -0.15 -1.68 -0.04 0.00 -1.68 0.00 0.00 37.83 34.29 1nd2 s LYS 69 CO 0.46 0.33 0.04 -1.64 -0.76 0.00 0.00 175.35 173.78 1nd2 s MET 70 N -3.17 3.87 -0.25 1.68 -1.94 -1.26 -0.19 119.30 118.03 1nd2 s MET 70 Ca 0.25 -0.40 -0.11 0.00 -1.71 0.00 0.00 55.69 53.71 1nd2 s MET 70 Cb -0.06 -3.17 -0.05 0.00 2.01 0.00 0.00 34.83 33.57 1nd2 s MET 70 CO 0.12 0.20 0.20 -0.46 -0.01 0.00 0.00 175.02 175.07 1nd2 s TRP 71 N 0.54 3.29 0.28 -0.03 -0.00 -0.49 -4.95 118.94 117.59 1nd2 s TRP 71 Ca 0.02 0.24 0.02 0.00 -0.00 0.00 0.00 56.10 56.38 1nd2 s TRP 71 Cb -0.13 -2.34 -0.05 0.00 -0.00 0.00 0.00 33.47 30.94 1nd2 s TRP 71 CO 0.01 -0.03 0.09 0.54 -0.00 0.00 0.00 176.95 177.57 1nd2 s ASN 72 N 1.30 1.52 0.49 5.86 2.20 -1.26 -4.35 114.94 120.69 1nd2 s ASN 72 Ca 0.09 -1.41 0.20 0.00 -0.94 0.00 0.00 52.86 50.80 1nd2 s ASN 72 Cb -0.14 0.14 1.07 0.00 -2.00 0.00 0.00 41.25 40.31 1nd2 s ASN 72 CO 0.07 -0.73 1.55 0.77 -2.94 0.00 0.00 177.10 175.82 1nd2 h SER 73 N 2.29 0.00 -0.02 3.54 4.64 -1.98 -1.41 113.55 120.62 1nd2 h SER 73 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1nd2 h SER 73 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1nd2 h SER 73 CO 0.62 0.00 -0.02 0.35 -0.87 0.00 0.00 176.83 176.91 1nd2 n THR 74 N -2.43 0.00 -1.68 2.95 -2.24 -1.26 -4.75 114.28 104.87 1nd2 n THR 74 Ca -0.01 -0.49 -0.45 0.00 -2.27 0.00 0.00 64.05 60.83 1nd2 n THR 74 Cb 0.38 1.25 -0.03 0.00 -2.10 0.00 0.00 70.33 69.83 1nd2 n THR 74 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1nd2 n SER 75 N 0.63 2.92 -0.00 3.42 7.64 -0.53 -4.91 113.62 122.79 1nd2 n SER 75 Ca 0.07 1.13 0.09 0.00 1.01 0.00 0.00 58.87 61.18 1nd2 n SER 75 Cb 0.31 -1.45 -0.12 0.00 -1.01 0.00 0.00 64.21 61.94 1nd2 n SER 75 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1nd2 n LYS 76 N 2.22 0.77 0.00 1.43 5.02 -1.26 -4.74 118.16 121.60 1nd2 n LYS 76 Ca 0.12 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 1nd2 n LYS 76 Cb 0.32 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 1nd2 n LYS 76 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nd2 n GLY 77 N 1.43 1.40 3.28 0.72 0.00 -1.26 -4.51 105.19 106.25 1nd2 n GLY 77 Ca 0.01 -2.00 -0.12 0.00 0.00 0.00 0.00 46.02 43.91 1nd2 n GLY 77 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1nd2 s TRP 78 N -1.20 -0.17 -0.02 1.61 0.51 -0.14 -1.15 118.94 118.38 1nd2 s TRP 78 Ca 0.00 0.10 -0.17 0.00 -2.12 0.00 0.00 56.10 53.91 1nd2 s TRP 78 Cb 0.00 0.14 0.03 0.00 -0.81 0.00 0.00 33.47 32.83 1nd2 s TRP 78 CO 0.00 -0.51 0.35 1.67 -0.51 0.00 0.00 176.95 177.95 1nd2 s TRP 79 N -2.37 -0.24 0.11 -1.98 1.48 -0.97 -0.68 118.94 114.29 1nd2 s TRP 79 Ca -0.06 0.37 0.03 0.00 -1.06 0.00 0.00 56.10 55.38 1nd2 s TRP 79 Cb -0.01 0.13 -0.04 0.00 -1.16 0.00 0.00 33.47 32.39 1nd2 s TRP 79 CO -0.02 -0.41 -0.08 -1.58 -4.06 0.00 0.00 176.95 170.80 1nd2 s TRP 80 N -1.30 1.01 0.02 1.66 0.51 -0.16 -1.15 118.94 119.54 1nd2 s TRP 80 Ca -0.13 -0.84 0.07 0.00 -2.12 0.00 0.00 56.10 53.08 1nd2 s TRP 80 Cb -0.05 -0.56 -0.02 0.00 -0.81 0.00 0.00 33.47 32.04 1nd2 s TRP 80 CO 0.05 -0.07 -0.21 0.15 -0.51 0.00 0.00 176.95 176.36 1nd2 s LYS 81 N -3.67 1.52 0.01 4.98 1.02 -1.26 -0.59 119.74 121.76 1nd2 s LYS 81 Ca 0.12 -0.87 0.05 0.00 0.02 0.00 0.00 55.97 55.30 1nd2 s LYS 81 Cb 0.03 -1.57 -0.03 0.00 -0.52 0.00 0.00 37.83 35.74 1nd2 s LYS 81 CO -0.03 0.41 -0.13 -0.51 -0.92 0.00 0.00 175.35 174.17 1nd2 s LEU 82 N -0.90 2.82 0.00 3.17 1.43 0.59 -0.01 118.68 125.77 1nd2 s LEU 82 Ca 0.08 -0.28 0.31 0.00 -1.03 0.00 0.00 54.13 53.21 1nd2 s LEU 82 Cb -0.09 -1.63 1.83 0.00 0.03 0.00 0.00 46.19 46.34 1nd2 s LEU 82 CO 0.01 0.28 2.17 -0.81 0.23 0.00 0.00 176.35 178.23 1nd2 n PRO 83 N 1.71 0.94 -0.31 1.29 -0.04 -1.26 -1.49 135.00 135.84 1nd2 n PRO 83 Ca -0.16 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.40 1nd2 n PRO 83 Cb 0.52 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.70 1nd2 n PRO 83 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1nd2 h ASP 84 N 0.00 -0.49 -0.16 3.54 3.58 -1.75 0.10 116.42 121.25 1nd2 h ASP 84 Ca 0.00 0.25 0.05 0.00 0.42 0.00 0.00 57.03 57.75 1nd2 h ASP 84 Cb 0.02 0.45 -0.01 0.00 1.72 0.00 0.00 39.33 41.51 1nd2 h ASP 84 CO 0.00 -0.28 0.20 0.00 -2.88 0.00 0.00 179.24 176.28 1nd2 h ALA 85 N 1.88 1.70 -0.55 -0.78 0.00 -0.65 -1.38 119.26 119.49 1nd2 h ALA 85 Ca 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1nd2 h ALA 85 Cb 0.97 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1nd2 h ALA 85 CO -0.84 -0.28 0.00 1.28 0.00 0.00 0.00 179.25 179.41 1nd2 n LEU 86 N -3.66 3.58 0.23 0.00 4.77 0.34 -3.35 117.00 118.90 1nd2 n LEU 86 Ca 0.01 -2.07 0.18 0.00 -0.03 0.00 0.00 56.01 54.10 1nd2 n LEU 86 Cb 0.31 -0.39 0.87 0.00 -2.33 0.00 0.00 43.42 41.88 1nd2 n LEU 86 CO 0.26 0.86 1.15 0.07 -1.33 0.00 0.00 177.39 178.40 1nd2 h LYS 87 N 3.22 0.00 -0.12 3.23 2.10 -1.14 -1.04 116.57 122.82 1nd2 h LYS 87 Ca 0.00 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.61 1nd2 h LYS 87 Cb 0.93 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.23 1nd2 h LYS 87 CO 0.02 0.00 -0.19 -3.47 -2.00 0.00 0.00 179.45 173.82 1nd2 n ASP 88 N -3.49 2.37 -4.28 7.07 2.03 -1.26 -4.51 116.55 114.48 1nd2 n ASP 88 Ca 0.01 -3.52 -0.43 0.00 0.52 0.00 0.00 54.79 51.37 1nd2 n ASP 88 Cb 0.35 -0.53 -0.07 0.00 -0.72 0.00 0.00 41.12 40.15 1nd2 n ASP 88 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1nd2 s MET 89 N -3.08 2.75 0.00 -0.67 -1.94 -0.39 -4.95 119.30 111.02 1nd2 s MET 89 Ca 0.38 -1.65 0.00 0.00 -1.71 0.00 0.00 55.69 52.71 1nd2 s MET 89 Cb 0.35 -4.08 0.00 0.00 2.01 0.00 0.00 34.83 33.11 1nd2 s MET 89 CO -0.00 -1.20 0.00 0.41 -0.01 0.00 0.00 175.02 174.22 1nd2 n GLY 90 N 5.08 1.12 0.29 -0.03 0.00 -1.26 -1.18 105.19 109.21 1nd2 n GLY 90 Ca -0.11 -0.35 0.04 0.00 0.00 0.00 0.00 46.02 45.60 1nd2 n GLY 90 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1nd2 h ILE 91 N 0.00 1.10 -0.18 -0.61 1.08 -1.97 -2.39 117.51 114.54 1nd2 h ILE 91 Ca 0.00 -0.27 -0.00 0.00 -0.39 0.00 0.00 64.86 64.20 1nd2 h ILE 91 Cb 0.00 0.67 -0.01 0.00 -3.07 0.00 0.00 36.82 34.42 1nd2 h ILE 91 CO 0.00 0.11 0.10 0.15 -0.69 0.00 0.00 178.15 177.82 1nd2 h PHE 92 N 0.44 0.26 -0.48 1.37 3.57 -1.72 -1.69 116.94 118.69 1nd2 h PHE 92 Ca 0.12 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.61 1nd2 h PHE 92 Cb 0.02 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.65 1nd2 h PHE 92 CO 0.00 0.25 0.32 0.78 -2.23 0.00 0.00 178.31 177.43 1nd2 h GLY 93 N 0.19 0.68 0.68 2.40 0.00 -0.68 -2.33 103.07 104.01 1nd2 h GLY 93 Ca 0.06 -0.25 0.02 0.00 0.00 0.00 0.00 47.33 47.17 1nd2 h GLY 93 CO -0.01 0.24 -0.10 0.83 0.00 0.00 0.00 176.54 177.50 1nd2 h GLU 94 N 0.65 -0.15 -0.76 4.80 4.39 -1.26 -2.65 114.58 119.59 1nd2 h GLU 94 Ca 0.18 0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.97 1nd2 h GLU 94 Cb -0.07 0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.56 1nd2 h GLU 94 CO -0.04 -0.10 0.50 -0.91 -1.16 0.00 0.00 179.01 177.30 1nd2 h ASN 95 N -0.16 0.67 0.73 1.42 2.35 -1.08 -1.56 115.58 117.96 1nd2 h ASN 95 Ca 0.05 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1nd2 h ASN 95 Cb 0.23 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.47 1nd2 h ASN 95 CO -0.14 0.42 0.00 1.15 -1.65 0.00 0.00 177.43 177.21 1nd2 n MET 96 N -4.49 0.12 -0.03 0.81 0.00 -0.90 -2.62 117.12 110.01 1nd2 n MET 96 Ca 0.12 0.32 0.04 0.00 0.00 0.00 0.00 57.70 58.18 1nd2 n MET 96 Cb 0.27 -1.71 -0.13 0.00 0.00 0.00 0.00 33.22 31.64 1nd2 n MET 96 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 1nd2 n PHE 97 N -1.93 0.00 0.52 3.17 3.72 -0.64 -4.37 117.46 117.92 1nd2 n PHE 97 Ca 0.03 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.56 1nd2 n PHE 97 Cb 0.23 -0.50 0.26 0.00 -0.94 0.00 0.00 39.48 38.53 1nd2 n PHE 97 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 176.76 178.59 1nd2 h TYR 98 N 0.00 0.00 -3.88 1.38 0.05 -1.33 0.47 116.97 113.65 1nd2 h TYR 98 Ca -0.12 0.00 -0.68 0.00 0.05 0.00 0.00 58.73 57.98 1nd2 h TYR 98 Cb 1.12 0.00 -0.21 0.00 1.01 0.00 0.00 36.73 38.65 1nd2 h TYR 98 CO 0.00 0.00 -0.83 -1.01 -1.05 0.00 0.00 178.16 175.27 1nd2 s HIS 99 N -3.16 2.47 0.05 4.88 3.76 -1.08 -1.26 115.29 120.96 1nd2 s HIS 99 Ca 0.08 -0.30 -0.18 0.00 -0.15 0.00 0.00 55.06 54.50 1nd2 s HIS 99 Cb 0.12 -1.35 -0.15 0.00 1.11 0.00 0.00 32.58 32.31 1nd2 s HIS 99 CO 0.67 0.32 1.30 0.35 -0.85 0.00 0.00 174.74 176.53 1nd2 h PHE 100 N 4.05 0.66 -3.46 1.40 3.57 -1.05 -3.46 116.94 118.66 1nd2 h PHE 100 Ca -0.49 -0.24 -0.66 0.00 3.53 0.00 0.00 57.97 60.10 1nd2 h PHE 100 Cb 1.16 -0.12 -0.14 0.00 2.79 0.00 0.00 35.95 39.64 1nd2 h PHE 100 CO 0.57 0.98 -0.69 -0.51 -2.23 0.00 0.00 178.31 176.43 1nd2 s LEU 101 N -8.81 3.29 0.08 0.59 1.43 -0.15 -3.96 118.68 111.14 1nd2 s LEU 101 Ca -0.13 -0.22 -0.10 0.00 -1.03 0.00 0.00 54.13 52.65 1nd2 s LEU 101 Cb 0.06 -2.01 0.00 0.00 0.03 0.00 0.00 46.19 44.27 1nd2 s LEU 101 CO 0.81 0.20 0.22 -0.83 0.23 0.00 0.00 176.35 176.98 1nd2 s GLY 102 N -2.07 0.03 -0.19 -3.19 0.00 0.08 -1.28 107.32 100.69 1nd2 s GLY 102 Ca 0.23 -0.47 -0.15 0.00 0.00 0.00 0.00 44.72 44.32 1nd2 s GLY 102 CO 0.15 -0.66 0.50 -1.60 0.00 0.00 0.00 173.10 171.48 1nd2 s ARG 103 N -3.59 0.55 -0.07 2.90 3.52 -0.31 -2.19 118.95 119.76 1nd2 s ARG 103 Ca 0.03 0.78 -0.29 0.00 -0.13 0.00 0.00 55.73 56.11 1nd2 s ARG 103 Cb 0.03 0.19 0.11 0.00 -1.56 0.00 0.00 34.95 33.72 1nd2 s ARG 103 CO -0.10 -0.10 0.91 0.45 -0.81 0.00 0.00 175.30 175.65 1nd2 s SER 104 N 0.71 -0.40 0.55 -2.12 0.15 -1.26 -1.26 113.70 110.07 1nd2 s SER 104 Ca -0.04 0.22 0.05 0.00 0.70 0.00 0.00 55.95 56.88 1nd2 s SER 104 Cb -0.05 0.37 0.04 0.00 -1.71 0.00 0.00 66.02 64.67 1nd2 s SER 104 CO -0.05 -0.52 0.37 -0.83 1.20 0.00 0.00 173.24 173.41 1nd2 s GLY 105 N -1.84 2.46 0.06 9.45 0.00 -0.07 -4.07 107.32 113.32 1nd2 s GLY 105 Ca 0.01 -1.09 -0.12 0.00 0.00 0.00 0.00 44.72 43.52 1nd2 s GLY 105 CO -0.03 -1.98 0.27 -0.19 0.00 0.00 0.00 173.10 171.17 1nd2 s TYR 106 N -2.80 -0.03 -0.23 1.90 2.02 -0.34 -0.79 117.35 117.08 1nd2 s TYR 106 Ca 0.30 -0.22 0.02 0.00 -0.37 0.00 0.00 57.07 56.80 1nd2 s TYR 106 Cb -0.02 0.05 0.04 0.00 -0.40 0.00 0.00 41.96 41.64 1nd2 s TYR 106 CO 0.19 -0.52 -0.14 0.99 -1.57 0.00 0.00 175.55 174.49 1nd2 s THR 107 N -3.02 2.08 -0.23 -0.71 2.01 -0.37 -0.64 115.64 114.75 1nd2 s THR 107 Ca -0.02 -1.33 -0.07 0.00 0.31 0.00 0.00 61.69 60.58 1nd2 s THR 107 Cb 0.01 -2.08 -0.03 0.00 0.01 0.00 0.00 72.50 70.41 1nd2 s THR 107 CO -0.06 0.18 0.06 -0.69 -0.69 0.00 0.00 174.62 173.43 1nd2 s VAL 108 N 1.20 4.42 -0.27 3.82 1.01 0.13 -1.19 120.40 129.51 1nd2 s VAL 108 Ca -0.03 -0.14 0.03 0.00 0.00 0.00 0.00 61.98 61.83 1nd2 s VAL 108 Cb -0.17 -3.04 0.07 0.00 0.00 0.00 0.00 36.38 33.24 1nd2 s VAL 108 CO -0.08 0.37 -0.06 -2.28 0.00 0.00 0.00 175.10 173.05 1nd2 s HIS 109 N 1.27 3.13 -0.15 5.22 2.46 -0.06 -0.90 115.29 126.26 1nd2 s HIS 109 Ca 0.05 -2.33 -0.15 0.00 0.47 0.00 0.00 55.06 53.10 1nd2 s HIS 109 Cb -0.15 -2.06 -0.04 0.00 -0.13 0.00 0.00 32.58 30.20 1nd2 s HIS 109 CO 0.03 -0.87 0.34 0.08 -2.47 0.00 0.00 174.74 171.85 1nd2 s VAL 110 N 1.14 5.27 -0.09 0.89 1.01 -0.26 -1.64 120.40 126.72 1nd2 s VAL 110 Ca -0.03 0.65 0.02 0.00 0.00 0.00 0.00 61.98 62.62 1nd2 s VAL 110 Cb -0.19 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 1nd2 s VAL 110 CO -0.07 0.36 -0.16 -1.10 0.00 0.00 0.00 175.10 174.14 1nd2 s GLN 111 N 0.57 2.94 -0.30 2.72 -0.21 0.15 -1.23 119.66 124.29 1nd2 s GLN 111 Ca 0.19 -0.74 -0.01 0.00 0.02 0.00 0.00 55.36 54.81 1nd2 s GLN 111 Cb -0.14 -2.45 0.19 0.00 1.00 0.00 0.00 33.01 31.62 1nd2 s GLN 111 CO 0.06 0.37 0.74 0.00 -2.12 0.00 0.00 175.29 174.34 1nd2 s ASN 113 N 2.88 5.08 0.00 0.00 4.22 -1.26 -4.38 114.94 121.48 1nd2 s ASN 113 Ca 0.15 -0.28 0.00 0.00 -2.14 0.00 0.00 52.86 50.59 1nd2 s ASN 113 Cb -0.10 -1.19 0.00 0.00 1.28 0.00 0.00 41.25 41.24 1nd2 s ASN 113 CO -0.22 0.08 0.00 0.00 -2.04 0.00 0.00 177.10 174.92 1nd2 n ALA 114 N -0.18 0.00 -2.89 3.54 0.00 -1.26 -4.78 120.51 114.93 1nd2 n ALA 114 Ca -0.09 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.25 1nd2 n ALA 114 Cb 0.55 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.94 1nd2 n ALA 114 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nd2 s SER 115 N 1.00 -0.03 0.19 0.00 1.04 -1.26 -5.02 113.70 109.61 1nd2 s SER 115 Ca 0.00 -0.88 0.23 0.00 0.48 0.00 0.00 55.95 55.78 1nd2 s SER 115 Cb 0.00 0.50 0.91 0.00 0.10 0.00 0.00 66.02 67.52 1nd2 s SER 115 CO 0.00 -0.99 1.71 0.29 0.98 0.00 0.00 173.24 175.24 1nd2 n LYS 116 N -0.29 0.17 -0.54 4.02 5.02 -1.26 -1.98 118.16 123.30 1nd2 n LYS 116 Ca -0.05 0.31 0.08 0.00 -2.02 0.00 0.00 58.31 56.63 1nd2 n LYS 116 Cb 0.63 -1.77 0.32 0.00 -0.02 0.00 0.00 35.03 34.18 1nd2 n LYS 116 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1nd2 n PHE 117 N -2.09 1.30 -3.99 2.13 3.01 -1.26 -4.90 117.46 111.67 1nd2 n PHE 117 Ca 0.04 -0.52 -0.22 0.00 1.01 0.00 0.00 57.45 57.76 1nd2 n PHE 117 Cb 0.29 -0.21 -0.04 0.00 -0.01 0.00 0.00 39.48 39.50 1nd2 n PHE 117 CO 0.00 0.00 0.00 -1.01 1.01 0.00 0.00 176.76 176.76 1nd2 s HIS 118 N -1.79 2.93 -0.03 1.38 3.76 -0.84 -4.53 115.29 116.17 1nd2 s HIS 118 Ca 0.45 -0.24 -0.12 0.00 -0.15 0.00 0.00 55.06 55.00 1nd2 s HIS 118 Cb 0.29 -1.60 0.02 0.00 1.11 0.00 0.00 32.58 32.40 1nd2 s HIS 118 CO 0.22 0.35 0.26 1.14 -0.85 0.00 0.00 174.74 175.86 1nd2 s GLN 119 N -3.90 0.54 0.00 1.40 -2.07 -0.65 -4.59 119.66 110.39 1nd2 s GLN 119 Ca 0.37 -0.12 0.00 0.00 -1.82 0.00 0.00 55.36 53.79 1nd2 s GLN 119 Cb -0.06 0.24 0.00 0.00 -1.09 0.00 0.00 33.01 32.10 1nd2 s GLN 119 CO 0.25 -0.13 0.00 0.41 -1.32 0.00 0.00 175.29 174.50 1nd2 n GLY 120 N 1.70 2.76 2.76 2.60 0.00 -1.26 -1.00 105.19 112.75 1nd2 n GLY 120 Ca -0.20 -0.66 -0.16 0.00 0.00 0.00 0.00 46.02 45.00 1nd2 n GLY 120 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nd2 s THR 121 N -2.00 -0.07 -0.12 2.61 2.01 -0.35 -1.50 115.64 116.22 1nd2 s THR 121 Ca 0.00 0.25 -0.01 0.00 0.31 0.00 0.00 61.69 62.25 1nd2 s THR 121 Cb 0.00 -0.10 -0.02 0.00 0.01 0.00 0.00 72.50 72.39 1nd2 s THR 121 CO 0.00 0.10 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.18 1nd2 s LEU 122 N 1.27 2.97 -0.36 4.42 1.43 -0.16 -0.99 118.68 127.27 1nd2 s LEU 122 Ca -0.07 -0.19 -0.15 0.00 -1.03 0.00 0.00 54.13 52.69 1nd2 s LEU 122 Cb -0.13 -1.67 -0.01 0.00 0.03 0.00 0.00 46.19 44.41 1nd2 s LEU 122 CO -0.03 0.22 0.33 -0.22 0.23 0.00 0.00 176.35 176.88 1nd2 s LEU 123 N 0.01 4.56 -0.29 1.79 2.96 0.11 -0.36 118.68 127.47 1nd2 s LEU 123 Ca -0.02 -0.39 -0.09 0.00 -0.22 0.00 0.00 54.13 53.41 1nd2 s LEU 123 Cb -0.14 -2.27 -0.02 0.00 0.50 0.00 0.00 46.19 44.26 1nd2 s LEU 123 CO 0.03 -0.34 0.14 -0.69 -1.32 0.00 0.00 176.35 174.17 1nd2 s VAL 124 N 1.92 4.66 0.03 1.68 1.01 0.12 -1.69 120.40 128.12 1nd2 s VAL 124 Ca 0.10 -0.24 0.05 0.00 0.00 0.00 0.00 61.98 61.89 1nd2 s VAL 124 Cb -0.17 -3.29 -0.02 0.00 0.00 0.00 0.00 36.38 32.90 1nd2 s VAL 124 CO 0.11 0.18 -0.15 -0.69 0.00 0.00 0.00 175.10 174.55 1nd2 s VAL 125 N 1.64 1.17 -0.29 2.92 1.01 0.16 -1.30 120.40 125.71 1nd2 s VAL 125 Ca 0.06 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 1nd2 s VAL 125 Cb -0.16 -1.05 0.04 0.00 0.00 0.00 0.00 36.38 35.21 1nd2 s VAL 125 CO 0.06 0.06 -0.01 -0.04 0.00 0.00 0.00 175.10 175.17 1nd2 s MET 126 N -1.06 2.57 -0.19 2.72 -1.94 -0.59 -0.79 119.30 120.02 1nd2 s MET 126 Ca 0.03 -1.17 -0.05 0.00 -1.71 0.00 0.00 55.69 52.78 1nd2 s MET 126 Cb -0.08 -3.15 -0.03 0.00 2.01 0.00 0.00 34.83 33.58 1nd2 s MET 126 CO 0.01 -0.56 0.01 0.42 -0.01 0.00 0.00 175.02 174.90 1nd2 s ILE 127 N 1.29 4.13 0.13 2.53 1.01 0.01 -3.87 121.20 126.43 1nd2 s ILE 127 Ca -0.03 -0.26 -0.25 0.00 0.00 0.00 0.00 60.65 60.11 1nd2 s ILE 127 Cb -0.19 -2.86 -0.07 0.00 0.01 0.00 0.00 42.46 39.35 1nd2 s ILE 127 CO -0.02 0.44 0.76 -2.16 0.00 0.00 0.00 174.94 173.96 1nd2 s PRO 128 N 0.81 4.52 -1.18 2.79 0.04 -1.26 -1.06 135.00 139.66 1nd2 s PRO 128 Ca 0.01 1.10 -0.18 0.00 0.04 0.00 0.00 61.00 61.97 1nd2 s PRO 128 Cb -0.14 -3.28 -0.01 0.00 0.04 0.00 0.00 34.50 31.11 1nd2 s PRO 128 CO 0.02 0.51 0.74 0.39 0.04 0.00 0.00 177.00 178.70 1nd2 n GLU 129 N 1.89 -1.58 -2.62 4.56 -0.58 -0.60 -4.83 120.64 116.88 1nd2 n GLU 129 Ca -0.05 0.44 -0.42 0.00 -0.42 0.00 0.00 57.16 56.70 1nd2 n GLU 129 Cb 0.49 -4.15 -0.01 0.00 -0.57 0.00 0.00 31.44 27.20 1nd2 n GLU 129 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1nd2 s HIS 130 N -3.54 2.76 -0.66 -0.32 2.46 -1.26 -4.93 115.29 109.80 1nd2 s HIS 130 Ca 0.40 -1.35 -0.28 0.00 0.47 0.00 0.00 55.06 54.31 1nd2 s HIS 130 Cb -0.15 -4.68 0.03 0.00 -0.13 0.00 0.00 32.58 27.66 1nd2 s HIS 130 CO 0.87 -1.81 1.25 -1.14 -2.47 0.00 0.00 174.74 171.44 1nd2 s GLN 131 N 4.24 3.33 0.62 2.88 0.74 -1.26 -5.00 119.66 125.21 1nd2 s GLN 131 Ca 0.49 -0.00 -0.17 0.00 0.05 0.00 0.00 55.36 55.72 1nd2 s GLN 131 Cb 0.01 -4.11 -0.02 0.00 1.10 0.00 0.00 33.01 30.00 1nd2 s GLN 131 CO -0.01 -1.95 1.16 -0.51 -0.55 0.00 0.00 175.29 173.44 1nd2 s LEU 132 N 5.43 3.55 0.36 3.68 1.43 -1.26 -4.78 118.68 127.09 1nd2 s LEU 132 Ca 0.39 2.22 0.08 0.00 -1.03 0.00 0.00 54.13 55.79 1nd2 s LEU 132 Cb -0.08 -4.58 -0.03 0.00 0.03 0.00 0.00 46.19 41.53 1nd2 s LEU 132 CO 0.20 -1.63 0.25 0.00 0.23 0.00 0.00 176.35 175.40 1nd2 s ALA 133 N -1.92 3.75 0.22 4.21 0.00 -0.39 -4.67 121.76 122.96 1nd2 s ALA 133 Ca 0.73 -1.79 0.10 0.00 0.00 0.00 0.00 51.96 51.01 1nd2 s ALA 133 Cb -0.26 -0.94 -0.04 0.00 0.00 0.00 0.00 23.12 21.88 1nd2 s ALA 133 CO 0.36 -0.04 -0.14 0.95 0.00 0.00 0.00 175.76 176.89 1nd2 s THR 134 N -2.40 2.85 -0.13 0.00 -4.23 -1.26 0.80 115.64 111.28 1nd2 s THR 134 Ca 0.41 -1.97 0.00 0.00 -1.18 0.00 0.00 61.69 58.95 1nd2 s THR 134 Cb -0.04 -2.44 -0.01 0.00 1.34 0.00 0.00 72.50 71.35 1nd2 s THR 134 CO 0.25 -0.22 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.29 1nd2 s VAL 135 N -1.98 3.03 -1.51 2.29 1.01 -1.26 -4.69 120.40 117.29 1nd2 s VAL 135 Ca 0.26 -0.67 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 1nd2 s VAL 135 Cb -0.07 -2.27 0.07 0.00 0.00 0.00 0.00 36.38 34.11 1nd2 s VAL 135 CO 0.14 0.53 0.92 0.59 0.00 0.00 0.00 175.10 177.28 1nd2 n ASN 136 N 3.50 -4.09 -0.92 3.32 3.02 -1.26 -4.88 115.26 113.94 1nd2 n ASN 136 Ca -0.18 -0.80 0.05 0.00 -0.03 0.00 0.00 54.58 53.61 1nd2 n ASN 136 Cb 0.53 -3.83 0.09 0.00 -0.61 0.00 0.00 39.78 35.96 1nd2 n ASN 136 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1nd2 n LYS 137 N -4.61 0.64 0.00 3.52 5.02 -1.26 -5.11 118.16 116.36 1nd2 n LYS 137 Ca -0.02 -2.34 0.00 0.00 -2.02 0.00 0.00 58.31 53.93 1nd2 n LYS 137 Cb 0.55 -0.74 0.00 0.00 -0.02 0.00 0.00 35.03 34.82 1nd2 n LYS 137 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nd2 n GLY 138 N -0.29 2.55 0.93 0.72 0.00 -1.26 -2.49 105.19 105.35 1nd2 n GLY 138 Ca 0.10 -0.44 0.04 0.00 0.00 0.00 0.00 46.02 45.72 1nd2 n GLY 138 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1nd2 n ASN 139 N 0.68 2.61 -4.68 1.61 6.94 -1.26 -4.87 115.26 116.29 1nd2 n ASN 139 Ca 0.00 -2.27 -0.43 0.00 -0.02 0.00 0.00 54.58 51.87 1nd2 n ASN 139 Cb 0.00 -0.46 -0.02 0.00 -2.36 0.00 0.00 39.78 36.94 1nd2 n ASN 139 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1nd2 s VAL 140 N -1.70 4.66 0.35 3.53 1.01 -1.04 -5.03 120.40 122.19 1nd2 s VAL 140 Ca 0.23 1.95 0.07 0.00 0.00 0.00 0.00 61.98 64.23 1nd2 s VAL 140 Cb 0.16 -4.25 -0.01 0.00 0.00 0.00 0.00 36.38 32.28 1nd2 s VAL 140 CO 0.10 -0.03 0.49 0.20 0.00 0.00 0.00 175.10 175.86 1nd2 s ASN 141 N 1.20 5.89 0.12 3.32 0.01 -1.26 -4.66 114.94 119.56 1nd2 s ASN 141 Ca 0.49 -0.24 -0.33 0.00 -0.71 0.00 0.00 52.86 52.07 1nd2 s ASN 141 Cb -0.19 -1.10 -0.13 0.00 0.41 0.00 0.00 41.25 40.25 1nd2 s ASN 141 CO 0.17 -0.50 1.71 0.00 -1.51 0.00 0.00 177.10 176.96 1nd2 n ALA 142 N -1.68 1.71 -1.78 0.60 0.00 -1.26 -4.76 120.51 113.34 1nd2 n ALA 142 Ca 0.02 0.38 -0.36 0.00 0.00 0.00 0.00 53.44 53.48 1nd2 n ALA 142 Cb 0.58 -2.46 -0.03 0.00 0.00 0.00 0.00 19.45 17.54 1nd2 n ALA 142 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1nd2 s GLY 143 N 1.84 2.70 0.23 0.00 0.00 -0.60 -4.92 107.32 106.58 1nd2 s GLY 143 Ca 0.81 0.72 -0.15 0.00 0.00 0.00 0.00 44.72 46.10 1nd2 s GLY 143 CO 0.39 1.14 1.57 -1.82 0.00 0.00 0.00 173.10 174.38 1nd2 h TYR 144 N 2.27 -0.77 -0.92 1.90 5.03 -1.92 0.30 116.97 122.86 1nd2 h TYR 144 Ca -0.49 0.09 0.14 0.00 2.58 0.00 0.00 58.73 61.05 1nd2 h TYR 144 Cb 1.22 0.46 -0.08 0.00 1.55 0.00 0.00 36.73 39.89 1nd2 h TYR 144 CO 0.57 -0.39 0.59 -0.22 -1.32 0.00 0.00 178.16 177.39 1nd2 h LYS 145 N -0.04 0.75 0.00 1.82 3.64 -1.92 -1.93 116.57 118.89 1nd2 h LYS 145 Ca 0.35 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.59 1nd2 h LYS 145 Cb 0.60 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1nd2 h LYS 145 CO -0.87 0.50 -0.45 1.88 -2.27 0.00 0.00 179.45 178.23 1nd2 h TYR 146 N 0.77 0.00 -0.70 1.91 0.05 -1.28 -2.97 116.97 114.75 1nd2 h TYR 146 Ca 0.47 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.25 1nd2 h TYR 146 Cb 0.66 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.40 1nd2 h TYR 146 CO -0.00 0.45 0.00 0.25 -1.05 0.00 0.00 178.16 177.81 1nd2 n THR 147 N -3.57 1.15 -2.84 -2.88 -2.24 -0.77 -4.34 114.28 98.79 1nd2 n THR 147 Ca -0.00 -1.00 -0.17 0.00 -2.27 0.00 0.00 64.05 60.61 1nd2 n THR 147 Cb 0.56 0.39 -0.00 0.00 -2.10 0.00 0.00 70.33 69.17 1nd2 n THR 147 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1nd2 n HIS 148 N 1.48 1.61 0.55 4.78 8.25 -0.93 -4.85 115.22 126.11 1nd2 n HIS 148 Ca 0.24 -3.34 0.09 0.00 -0.26 0.00 0.00 57.72 54.46 1nd2 n HIS 148 Cb 0.66 -0.36 0.39 0.00 1.12 0.00 0.00 29.99 31.81 1nd2 n HIS 148 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1nd2 n PRO 149 N -0.05 0.05 0.00 -0.41 -0.04 -1.25 -4.92 135.00 128.38 1nd2 n PRO 149 Ca 0.22 0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.93 1nd2 n PRO 149 Cb 0.68 -1.59 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 1nd2 n PRO 149 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nd2 n GLY 150 N 0.26 -1.24 0.23 0.55 0.00 -1.26 -3.82 105.19 99.92 1nd2 n GLY 150 Ca 0.04 -1.26 0.16 0.00 0.00 0.00 0.00 46.02 44.96 1nd2 n GLY 150 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1nd2 h GLU 151 N 0.00 0.00 0.00 1.61 4.11 -1.79 -1.16 114.58 117.35 1nd2 h GLU 151 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.35 1nd2 h GLU 151 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1nd2 h GLU 151 CO 0.00 0.00 -0.39 0.00 0.07 0.00 0.00 179.01 178.69 1nd2 h ALA 152 N 2.02 0.86 -0.98 1.06 0.00 -1.91 -3.34 119.26 116.98 1nd2 h ALA 152 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1nd2 h ALA 152 Cb 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1nd2 h ALA 152 CO 0.00 0.48 0.00 0.41 0.00 0.00 0.00 179.25 180.14 1nd2 n GLY 153 N 0.64 0.96 3.10 0.00 0.00 -0.44 -4.75 105.19 104.69 1nd2 n GLY 153 Ca 0.01 -0.79 -0.27 0.00 0.00 0.00 0.00 46.02 44.97 1nd2 n GLY 153 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1nd2 s ARG 154 N 0.00 2.01 -0.42 1.61 6.06 -0.30 -4.83 118.95 123.07 1nd2 s ARG 154 Ca 0.00 -0.57 -0.18 0.00 -2.50 0.00 0.00 55.73 52.48 1nd2 s ARG 154 Cb 0.00 -1.64 0.02 0.00 0.06 0.00 0.00 34.95 33.40 1nd2 s ARG 154 CO 0.00 0.12 0.47 -1.21 -2.50 0.00 0.00 175.30 172.18 1nd2 s GLU 155 N 0.41 3.12 0.24 5.12 2.02 -1.26 -2.30 118.70 126.04 1nd2 s GLU 155 Ca -0.12 -0.71 -0.31 0.00 0.02 0.00 0.00 54.97 53.85 1nd2 s GLU 155 Cb -0.15 -3.97 -0.11 0.00 0.10 0.00 0.00 34.13 30.01 1nd2 s GLU 155 CO 0.04 -0.88 1.55 0.08 0.02 0.00 0.00 175.26 176.08 1nd2 s VAL 156 N 2.23 2.39 0.00 2.63 1.01 -0.30 -3.12 120.40 125.24 1nd2 s VAL 156 Ca 0.13 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.42 1nd2 s VAL 156 Cb -0.17 -3.20 0.00 0.00 0.00 0.00 0.00 36.38 33.02 1nd2 s VAL 156 CO 0.14 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.89 1nd2 n GLY 157 N 2.81 0.67 1.21 4.51 0.00 -1.26 -4.22 105.19 108.91 1nd2 n GLY 157 Ca 0.10 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1nd2 n GLY 157 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1nd2 n THR 158 N -2.55 0.89 -1.19 2.61 -2.24 -1.18 -5.07 114.28 105.54 1nd2 n THR 158 Ca 0.00 0.29 -0.47 0.00 -2.27 0.00 0.00 64.05 61.61 1nd2 n THR 158 Cb 0.00 -1.39 -0.07 0.00 -2.10 0.00 0.00 70.33 66.78 1nd2 n THR 158 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nd2 n GLN 159 N -3.42 0.00 -2.53 -0.78 1.13 -1.26 -4.84 117.38 105.67 1nd2 n GLN 159 Ca 0.00 0.00 -0.43 0.00 -1.94 0.00 0.00 57.00 54.63 1nd2 n GLN 159 Cb 0.05 -1.10 -0.02 0.00 0.11 0.00 0.00 30.24 29.28 1nd2 n GLN 159 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1nd2 s VAL 160 N 1.05 4.21 0.37 5.09 1.01 -1.26 -4.96 120.40 125.91 1nd2 s VAL 160 Ca 0.72 1.31 -0.10 0.00 0.00 0.00 0.00 61.98 63.91 1nd2 s VAL 160 Cb -1.01 -4.40 -0.09 0.00 0.00 0.00 0.00 36.38 30.88 1nd2 s VAL 160 CO 0.51 -0.73 -0.18 -0.62 0.00 0.00 0.00 175.10 174.08 1nd2 n GLU 161 N 7.54 0.00 -3.44 2.72 1.02 -1.26 -5.05 120.64 122.17 1nd2 n GLU 161 Ca 0.13 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.16 1nd2 n GLU 161 Cb 0.48 -0.58 -0.02 0.00 -0.02 0.00 0.00 31.44 31.30 1nd2 n GLU 161 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1nd2 s ASN 162 N -0.58 -0.54 0.16 1.62 3.84 -1.26 -5.04 114.94 113.13 1nd2 s ASN 162 Ca 0.30 -0.02 -0.15 0.00 0.21 0.00 0.00 52.86 53.20 1nd2 s ASN 162 Cb -0.24 0.58 0.04 0.00 -0.55 0.00 0.00 41.25 41.09 1nd2 s ASN 162 CO 0.41 -0.95 1.81 -0.08 -2.79 0.00 0.00 177.10 175.50 1nd2 h GLU 163 N 2.00 0.52 -0.21 0.43 4.81 -2.01 -2.43 114.58 117.68 1nd2 h GLU 163 Ca -0.32 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 1nd2 h GLU 163 Cb 1.30 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.56 1nd2 h GLU 163 CO 0.37 0.34 0.00 1.63 -0.73 0.00 0.00 179.01 180.62 1nd2 n LYS 164 N -4.83 1.49 -2.31 1.92 4.76 -1.26 -4.89 118.16 113.04 1nd2 n LYS 164 Ca 0.01 -0.76 -0.42 0.00 -2.87 0.00 0.00 58.31 54.28 1nd2 n LYS 164 Cb 0.05 -1.17 -0.03 0.00 -1.84 0.00 0.00 35.03 32.04 1nd2 n LYS 164 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 1nd2 s GLN 165 N -1.72 4.39 0.86 1.97 2.00 -0.92 -1.55 119.66 124.69 1nd2 s GLN 165 Ca 0.15 1.91 -0.12 0.00 -2.00 0.00 0.00 55.36 55.30 1nd2 s GLN 165 Cb 0.08 -3.29 0.11 0.00 0.80 0.00 0.00 33.01 30.70 1nd2 s GLN 165 CO 0.10 -0.30 1.10 -1.25 -0.50 0.00 0.00 175.29 174.44 1nd2 s PRO 166 N 0.85 1.59 0.60 1.67 0.04 -1.26 -4.70 135.00 133.79 1nd2 s PRO 166 Ca 0.60 0.61 -0.18 0.00 0.04 0.00 0.00 61.00 62.07 1nd2 s PRO 166 Cb -0.33 -1.86 -0.05 0.00 0.04 0.00 0.00 34.50 32.30 1nd2 s PRO 166 CO 0.31 -1.96 1.00 0.45 0.04 0.00 0.00 177.00 176.84 1nd2 n SER 167 N -3.66 0.91 -0.28 6.66 2.88 0.24 -4.90 113.62 115.48 1nd2 n SER 167 Ca 0.07 0.81 0.06 0.00 -1.33 0.00 0.00 58.87 58.48 1nd2 n SER 167 Cb 0.57 -1.41 0.09 0.00 -0.75 0.00 0.00 64.21 62.71 1nd2 n SER 167 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1nd2 n ASP 168 N -0.86 1.51 -4.48 -3.46 2.03 -1.26 -4.84 116.55 105.20 1nd2 n ASP 168 Ca 0.14 -2.74 -0.43 0.00 0.52 0.00 0.00 54.79 52.28 1nd2 n ASP 168 Cb 0.47 -0.36 -0.04 0.00 -0.72 0.00 0.00 41.12 40.48 1nd2 n ASP 168 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1nd2 s ASP 169 N -2.26 6.23 0.35 1.67 1.01 -1.26 -4.64 116.67 117.77 1nd2 s ASP 169 Ca 0.22 -0.76 0.06 0.00 0.71 0.00 0.00 52.55 52.78 1nd2 s ASP 169 Cb 0.20 -2.43 0.65 0.00 1.01 0.00 0.00 42.92 42.35 1nd2 s ASP 169 CO 0.01 -1.37 1.87 -0.55 0.21 0.00 0.00 175.17 175.34 1nd2 h ASN 170 N 9.49 0.38 0.81 0.27 7.08 -1.94 -2.11 115.58 129.55 1nd2 h ASN 170 Ca -0.28 -0.08 0.00 0.00 -3.08 0.00 0.00 56.30 52.86 1nd2 h ASN 170 Cb 1.07 -0.10 0.00 0.00 -2.08 0.00 0.00 38.32 37.21 1nd2 h ASN 170 CO 1.15 0.51 0.00 -2.67 -2.08 0.00 0.00 177.43 174.34 1nd2 n TRP 171 N -4.25 0.83 -1.16 4.14 4.27 -1.26 -2.12 117.44 117.89 1nd2 n TRP 171 Ca 0.00 0.32 0.04 0.00 -3.89 0.00 0.00 57.50 53.97 1nd2 n TRP 171 Cb 0.28 -1.01 0.23 0.00 -1.36 0.00 0.00 31.31 29.44 1nd2 n TRP 171 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1nd2 n LEU 172 N -2.25 3.88 -1.65 5.67 4.77 -0.91 -1.57 117.00 124.94 1nd2 n LEU 172 Ca 0.02 -3.28 -0.10 0.00 -0.03 0.00 0.00 56.01 52.62 1nd2 n LEU 172 Cb 0.25 -0.57 -0.03 0.00 -2.33 0.00 0.00 43.42 40.74 1nd2 n LEU 172 CO 0.21 0.87 -0.11 0.59 -1.33 0.00 0.00 177.39 177.63 1nd2 n ASN 173 N -0.80 -2.86 -0.87 -1.43 5.03 -0.90 -1.11 115.26 112.32 1nd2 n ASN 173 Ca 0.25 0.25 -0.11 0.00 0.87 0.00 0.00 54.58 55.84 1nd2 n ASN 173 Cb 0.93 -2.68 -0.05 0.00 -1.02 0.00 0.00 39.78 36.96 1nd2 n ASN 173 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1nd2 n PHE 174 N -2.14 -0.03 -1.57 3.10 3.72 -0.84 -4.70 117.46 114.99 1nd2 n PHE 174 Ca -0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 1nd2 n PHE 174 Cb 0.41 -2.71 0.00 0.00 -0.94 0.00 0.00 39.48 36.23 1nd2 n PHE 174 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1nd2 n ASP 175 N -1.05 0.00 0.00 4.37 5.68 -0.27 -1.27 116.55 124.02 1nd2 n ASP 175 Ca -0.11 -1.16 0.00 0.00 -0.50 0.00 0.00 54.79 53.02 1nd2 n ASP 175 Cb 0.57 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.52 1nd2 n ASP 175 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nd2 n GLY 176 N 0.00 0.63 3.25 6.12 0.00 -0.45 -4.83 105.19 109.90 1nd2 n GLY 176 Ca 0.00 -0.63 -0.17 0.00 0.00 0.00 0.00 46.02 45.22 1nd2 n GLY 176 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nd2 s THR 177 N -2.00 1.32 0.06 2.61 -4.23 -1.05 -5.04 115.64 107.30 1nd2 s THR 177 Ca 0.00 -1.79 -0.30 0.00 -1.18 0.00 0.00 61.69 58.42 1nd2 s THR 177 Cb 0.00 -1.60 -0.05 0.00 1.34 0.00 0.00 72.50 72.20 1nd2 s THR 177 CO 0.00 -0.48 1.04 -0.76 -0.54 0.00 0.00 174.62 173.88 1nd2 s LEU 178 N -2.60 4.41 0.30 4.79 1.43 -1.26 -2.69 118.68 123.06 1nd2 s LEU 178 Ca 0.11 1.81 0.06 0.00 -1.03 0.00 0.00 54.13 55.08 1nd2 s LEU 178 Cb -0.04 -3.58 0.80 0.00 0.03 0.00 0.00 46.19 43.40 1nd2 s LEU 178 CO 0.03 -0.26 1.69 0.25 0.23 0.00 0.00 176.35 178.29 1nd2 h LEU 179 N 6.34 0.34 -2.18 1.79 5.85 -1.54 -1.23 115.31 124.69 1nd2 h LEU 179 Ca -0.42 0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.51 1nd2 h LEU 179 Cb 1.22 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.38 1nd2 h LEU 179 CO 0.75 -0.04 0.28 1.23 -0.34 0.00 0.00 178.44 180.33 1nd2 h GLY 180 N 0.38 0.00 -2.01 3.75 0.00 -1.93 -1.30 103.07 101.96 1nd2 h GLY 180 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.92 1nd2 h GLY 180 CO -0.56 0.00 0.00 0.70 0.00 0.00 0.00 176.54 176.68 1nd2 n ASN 181 N -3.39 3.04 0.30 0.19 3.02 -0.46 -4.20 115.26 113.76 1nd2 n ASN 181 Ca 0.01 -1.95 0.20 0.00 -0.03 0.00 0.00 54.58 52.81 1nd2 n ASN 181 Cb 0.39 -0.29 0.96 0.00 -0.61 0.00 0.00 39.78 40.22 1nd2 n ASN 181 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1nd2 h LEU 182 N 3.66 0.00 0.00 3.41 3.38 -1.36 -2.57 115.31 121.83 1nd2 h LEU 182 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1nd2 h LEU 182 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1nd2 h LEU 182 CO 0.00 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.71 1nd2 n LEU 183 N -3.05 0.00 0.04 1.67 4.32 -1.26 -1.04 117.00 117.68 1nd2 n LEU 183 Ca -0.01 0.49 0.12 0.00 -0.02 0.00 0.00 56.01 56.59 1nd2 n LEU 183 Cb 0.18 -0.49 0.48 0.00 -1.62 0.00 0.00 43.42 41.97 1nd2 n LEU 183 CO 0.23 -0.43 0.87 0.00 -1.22 0.00 0.00 177.39 176.84 1nd2 n ILE 184 N -1.49 0.48 -3.87 -0.08 0.13 -0.97 -4.75 119.36 108.81 1nd2 n ILE 184 Ca 0.01 0.03 -0.21 0.00 -1.10 0.00 0.00 62.75 61.49 1nd2 n ILE 184 Cb 0.04 -0.73 -0.02 0.00 -0.84 0.00 0.00 39.64 38.09 1nd2 n ILE 184 CO 0.00 0.00 0.00 -0.36 2.80 0.00 0.00 176.55 178.99 1nd2 s PHE 185 N -3.06 3.31 0.09 9.51 0.08 -0.21 -5.03 117.98 122.68 1nd2 s PHE 185 Ca 0.10 -0.09 -0.34 0.00 0.12 0.00 0.00 56.93 56.72 1nd2 s PHE 185 Cb 0.14 -1.65 -0.14 0.00 -0.57 0.00 0.00 43.02 40.80 1nd2 s PHE 185 CO 0.46 0.34 1.64 -2.30 -0.10 0.00 0.00 175.22 175.26 1nd2 n PRO 186 N -1.43 2.09 -3.86 0.24 -0.02 -1.25 -4.85 135.00 125.91 1nd2 n PRO 186 Ca -0.07 0.76 -0.07 0.00 -2.02 0.00 0.00 63.50 62.10 1nd2 n PRO 186 Cb 0.57 -2.54 -0.02 0.00 -0.02 0.00 0.00 33.50 31.50 1nd2 n PRO 186 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1nd2 s HIS 187 N 1.70 -0.17 0.25 6.00 -3.43 -1.26 -1.54 115.29 116.84 1nd2 s HIS 187 Ca 0.83 -0.30 -0.14 0.00 -0.80 0.00 0.00 55.06 54.65 1nd2 s HIS 187 Cb -0.70 0.72 -0.00 0.00 -1.43 0.00 0.00 32.58 31.16 1nd2 s HIS 187 CO 0.42 -1.26 0.51 -0.65 -2.00 0.00 0.00 174.74 171.76 1nd2 s GLN 188 N -3.82 1.58 0.07 -0.38 -0.21 -0.42 -4.92 119.66 111.57 1nd2 s GLN 188 Ca 0.11 -1.21 0.08 0.00 0.02 0.00 0.00 55.36 54.37 1nd2 s GLN 188 Cb -0.06 0.49 -0.03 0.00 1.00 0.00 0.00 33.01 34.41 1nd2 s GLN 188 CO 0.07 -0.67 -0.23 -0.06 -2.12 0.00 0.00 175.29 172.29 1nd2 s PHE 189 N -4.00 1.95 -0.42 0.91 0.08 -1.26 -0.71 117.98 114.54 1nd2 s PHE 189 Ca 0.21 -0.39 -0.02 0.00 0.12 0.00 0.00 56.93 56.85 1nd2 s PHE 189 Cb -0.01 -1.12 0.11 0.00 -0.57 0.00 0.00 43.02 41.42 1nd2 s PHE 189 CO 0.09 0.16 0.20 0.42 -0.10 0.00 0.00 175.22 175.99 1nd2 s ILE 190 N -0.94 3.15 -0.44 0.64 1.01 0.52 -4.88 121.20 120.26 1nd2 s ILE 190 Ca 0.09 -2.20 -0.14 0.00 0.00 0.00 0.00 60.65 58.40 1nd2 s ILE 190 Cb -0.09 -3.18 0.06 0.00 0.01 0.00 0.00 42.46 39.26 1nd2 s ILE 190 CO 0.03 -0.70 0.34 0.21 0.00 0.00 0.00 174.94 174.82 1nd2 s ASN 191 N 1.56 6.00 0.49 3.58 2.47 -1.26 -0.99 114.94 126.79 1nd2 s ASN 191 Ca 0.09 -1.26 0.37 0.00 0.42 0.00 0.00 52.86 52.48 1nd2 s ASN 191 Cb -0.22 -2.13 1.53 0.00 -1.45 0.00 0.00 41.25 38.99 1nd2 s ASN 191 CO -0.05 -0.57 1.64 -0.07 -3.72 0.00 0.00 177.10 174.33 1nd2 h LEU 192 N 8.64 0.14 -0.25 3.21 3.38 -1.42 0.87 115.31 129.88 1nd2 h LEU 192 Ca -0.27 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1nd2 h LEU 192 Cb 1.11 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1nd2 h LEU 192 CO 0.81 -0.09 0.00 -2.11 0.09 0.00 0.00 178.44 177.14 1nd2 n ARG 193 N -4.37 0.17 -0.04 1.13 1.85 -1.26 -4.33 116.66 109.81 1nd2 n ARG 193 Ca 0.37 0.26 -0.09 0.00 -1.00 0.00 0.00 57.85 57.40 1nd2 n ARG 193 Cb 1.57 -1.75 -0.03 0.00 -1.05 0.00 0.00 32.46 31.20 1nd2 n ARG 193 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1nd2 n SER 194 N -2.07 0.67 -4.20 2.89 7.64 0.29 -5.11 113.62 113.74 1nd2 n SER 194 Ca 0.04 0.11 -0.12 0.00 1.01 0.00 0.00 58.87 59.92 1nd2 n SER 194 Cb 0.32 -0.27 -0.10 0.00 -1.01 0.00 0.00 64.21 63.15 1nd2 n SER 194 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1nd2 s ASN 195 N -5.79 1.20 -0.05 6.43 4.22 -0.62 -4.76 114.94 115.57 1nd2 s ASN 195 Ca -0.12 -1.06 0.08 0.00 -2.14 0.00 0.00 52.86 49.63 1nd2 s ASN 195 Cb 0.04 0.10 0.15 0.00 1.28 0.00 0.00 41.25 42.82 1nd2 s ASN 195 CO 0.15 -0.49 1.09 -0.46 -2.04 0.00 0.00 177.10 175.36 1nd2 n ASN 196 N -0.11 2.30 -3.51 3.54 0.23 -0.33 -4.12 115.26 113.25 1nd2 n ASN 196 Ca -0.10 -2.43 -0.09 0.00 -0.53 0.00 0.00 54.58 51.43 1nd2 n ASN 196 Cb 0.62 -0.19 -0.02 0.00 -2.08 0.00 0.00 39.78 38.10 1nd2 n ASN 196 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1nd2 s SER 197 N -1.69 -0.42 0.01 0.53 1.04 -1.25 -0.81 113.70 111.10 1nd2 s SER 197 Ca 0.15 -0.07 0.03 0.00 0.48 0.00 0.00 55.95 56.54 1nd2 s SER 197 Cb 0.12 0.50 -0.01 0.00 0.10 0.00 0.00 66.02 66.73 1nd2 s SER 197 CO 0.03 -0.82 -0.08 0.00 0.98 0.00 0.00 173.24 173.34 1nd2 s ALA 198 N -3.42 0.69 -0.08 5.32 0.00 -0.37 -4.39 121.76 119.51 1nd2 s ALA 198 Ca 0.04 -0.44 0.00 0.00 0.00 0.00 0.00 51.96 51.57 1nd2 s ALA 198 Cb -0.01 -0.14 0.02 0.00 0.00 0.00 0.00 23.12 22.99 1nd2 s ALA 198 CO -0.09 0.14 -0.07 0.99 0.00 0.00 0.00 175.76 176.74 1nd2 s THR 199 N -0.41 0.85 -0.08 0.00 2.01 -1.26 -1.10 115.64 115.65 1nd2 s THR 199 Ca 0.01 -0.23 0.00 0.00 0.31 0.00 0.00 61.69 61.78 1nd2 s THR 199 Cb -0.04 -0.87 0.02 0.00 0.01 0.00 0.00 72.50 71.62 1nd2 s THR 199 CO -0.00 0.32 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.42 1nd2 s LEU 200 N 1.36 1.25 -0.25 4.42 1.02 -0.08 -1.32 118.68 125.08 1nd2 s LEU 200 Ca -0.03 -0.24 -0.06 0.00 0.02 0.00 0.00 54.13 53.83 1nd2 s LEU 200 Cb -0.14 -0.70 -0.01 0.00 0.02 0.00 0.00 46.19 45.36 1nd2 s LEU 200 CO -0.03 -0.08 0.04 -0.63 0.02 0.00 0.00 176.35 175.67 1nd2 s ILE 201 N 1.31 3.95 0.04 -0.59 1.09 0.10 0.20 121.20 127.30 1nd2 s ILE 201 Ca -0.03 -0.39 0.09 0.00 -1.10 0.00 0.00 60.65 59.22 1nd2 s ILE 201 Cb -0.14 -2.88 -0.03 0.00 -1.06 0.00 0.00 42.46 38.36 1nd2 s ILE 201 CO -0.03 0.30 -0.25 0.68 -0.10 0.00 0.00 174.94 175.54 1nd2 s VAL 202 N 1.55 2.22 0.75 2.92 -7.23 0.19 0.20 120.40 120.99 1nd2 s VAL 202 Ca 0.05 -1.33 -0.05 0.00 -1.81 0.00 0.00 61.98 58.84 1nd2 s VAL 202 Cb -0.15 -1.86 0.11 0.00 0.56 0.00 0.00 36.38 35.04 1nd2 s VAL 202 CO 0.01 0.39 1.04 -2.16 -0.31 0.00 0.00 175.10 174.07 1nd2 s PRO 203 N -1.19 1.69 0.11 4.82 0.04 -1.25 -1.20 135.00 138.01 1nd2 s PRO 203 Ca 0.12 -0.71 -0.31 0.00 0.04 0.00 0.00 61.00 60.15 1nd2 s PRO 203 Cb -0.10 -2.20 -0.07 0.00 0.04 0.00 0.00 34.50 32.17 1nd2 s PRO 203 CO 0.02 -1.52 1.24 -0.47 0.04 0.00 0.00 177.00 176.31 1nd2 s TYR 204 N -3.29 3.40 -0.10 0.56 5.04 -1.26 -4.80 117.35 116.91 1nd2 s TYR 204 Ca 0.65 1.27 -0.00 0.00 -2.44 0.00 0.00 57.07 56.55 1nd2 s TYR 204 Cb -0.07 -3.48 0.02 0.00 0.35 0.00 0.00 41.96 38.79 1nd2 s TYR 204 CO 0.46 -1.48 -0.06 0.08 -1.34 0.00 0.00 175.55 173.20 1nd2 s VAL 205 N 0.72 0.87 -0.09 3.14 1.01 -1.26 -5.07 120.40 119.73 1nd2 s VAL 205 Ca 0.58 -0.21 -0.32 0.00 0.00 0.00 0.00 61.98 62.03 1nd2 s VAL 205 Cb -0.32 -0.91 0.12 0.00 0.00 0.00 0.00 36.38 35.27 1nd2 s VAL 205 CO 0.32 0.34 1.15 0.21 0.00 0.00 0.00 175.10 177.11 1nd2 s ASN 206 N 1.62 -0.16 0.00 3.32 3.84 -1.26 -4.95 114.94 117.35 1nd2 s ASN 206 Ca 0.02 -0.07 0.26 0.00 0.21 0.00 0.00 52.86 53.28 1nd2 s ASN 206 Cb -0.13 0.22 1.08 0.00 -0.55 0.00 0.00 41.25 41.87 1nd2 s ASN 206 CO -0.06 -0.37 1.75 0.00 -2.79 0.00 0.00 177.10 175.63 1nd2 n ALA 207 N -0.25 2.58 -2.79 1.71 0.00 -1.26 -4.80 120.51 115.69 1nd2 n ALA 207 Ca -0.04 -0.41 -0.15 0.00 0.00 0.00 0.00 53.44 52.84 1nd2 n ALA 207 Cb 0.60 -1.20 -0.12 0.00 0.00 0.00 0.00 19.45 18.73 1nd2 n ALA 207 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1nd2 s VAL 208 N -1.94 0.67 0.50 0.00 -7.23 -1.26 -5.07 120.40 106.07 1nd2 s VAL 208 Ca 0.37 -0.96 0.15 0.00 -1.81 0.00 0.00 61.98 59.73 1nd2 s VAL 208 Cb 0.20 -0.68 0.26 0.00 0.56 0.00 0.00 36.38 36.71 1nd2 s VAL 208 CO 0.31 -0.23 2.12 1.55 -0.31 0.00 0.00 175.10 178.54 1nd2 h PRO 209 N 4.77 0.05 -3.88 4.82 0.13 -1.87 -3.44 132.00 132.58 1nd2 h PRO 209 Ca -0.35 -0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.67 1nd2 h PRO 209 Cb 1.20 -0.01 -0.13 0.00 0.13 0.00 0.00 31.00 32.18 1nd2 h PRO 209 CO 0.43 0.06 -0.35 -1.64 -0.23 0.00 0.00 178.00 176.26 1nd2 s MET 210 N -5.05 1.03 0.28 0.86 -1.94 -1.26 -4.89 119.30 108.33 1nd2 s MET 210 Ca -0.05 -1.10 -0.19 0.00 -1.71 0.00 0.00 55.69 52.63 1nd2 s MET 210 Cb 0.17 0.36 0.02 0.00 2.01 0.00 0.00 34.83 37.38 1nd2 s MET 210 CO 0.68 -0.36 0.69 0.34 -0.01 0.00 0.00 175.02 176.36 1nd2 s ASP 211 N -2.93 -0.21 -0.04 3.03 -1.08 -0.93 -4.92 116.67 109.58 1nd2 s ASP 211 Ca 0.13 -0.69 -0.30 0.00 -0.52 0.00 0.00 52.55 51.17 1nd2 s ASP 211 Cb 0.04 0.72 -0.05 0.00 -1.46 0.00 0.00 42.92 42.17 1nd2 s ASP 211 CO -0.04 -1.34 1.43 -0.55 0.52 0.00 0.00 175.17 175.19 1nd2 s SER 212 N -2.94 6.83 0.00 -0.34 0.15 -1.25 -0.74 113.70 115.39 1nd2 s SER 212 Ca 0.13 2.07 0.28 0.00 0.70 0.00 0.00 55.95 59.13 1nd2 s SER 212 Cb -0.05 -2.55 1.13 0.00 -1.71 0.00 0.00 66.02 62.83 1nd2 s SER 212 CO 0.08 -0.77 1.83 0.23 1.20 0.00 0.00 173.24 175.81 1nd2 n MET 213 N 5.95 0.17 0.01 5.44 2.81 -1.26 -2.62 117.12 127.62 1nd2 n MET 213 Ca 0.14 -0.04 -0.19 0.00 -1.81 0.00 0.00 57.70 55.80 1nd2 n MET 213 Cb 0.44 -1.50 -0.14 0.00 -0.71 0.00 0.00 33.22 31.31 1nd2 n MET 213 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1nd2 h VAL 214 N 0.10 0.71 -0.26 2.03 2.07 -1.89 -3.40 116.25 115.60 1nd2 h VAL 214 Ca 0.00 -2.43 0.00 0.00 0.82 0.00 0.00 66.70 65.09 1nd2 h VAL 214 Cb 0.45 2.53 0.00 0.00 -1.52 0.00 0.00 31.29 32.74 1nd2 h VAL 214 CO 0.00 0.83 0.00 -2.11 0.02 0.00 0.00 177.57 176.31 1nd2 n ARG 215 N -3.42 2.21 -3.70 1.57 1.85 -1.24 -4.92 116.66 109.01 1nd2 n ARG 215 Ca -0.28 -1.81 -0.24 0.00 -1.00 0.00 0.00 57.85 54.52 1nd2 n ARG 215 Cb 1.05 -1.26 -0.17 0.00 -1.05 0.00 0.00 32.46 31.03 1nd2 n ARG 215 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 1nd2 s HIS 216 N -0.98 0.50 -0.42 2.89 2.46 -1.08 -5.06 115.29 113.59 1nd2 s HIS 216 Ca 0.21 -0.28 -0.17 0.00 0.47 0.00 0.00 55.06 55.28 1nd2 s HIS 216 Cb 0.11 -0.76 0.02 0.00 -0.13 0.00 0.00 32.58 31.83 1nd2 s HIS 216 CO 0.15 -0.42 0.44 -0.80 -2.47 0.00 0.00 174.74 171.64 1nd2 s ASN 217 N 2.03 6.19 0.05 9.88 0.01 -1.26 -4.59 114.94 127.25 1nd2 s ASN 217 Ca 0.03 -0.68 -0.20 0.00 -0.71 0.00 0.00 52.86 51.30 1nd2 s ASN 217 Cb -0.14 -2.22 -0.13 0.00 0.41 0.00 0.00 41.25 39.16 1nd2 s ASN 217 CO -0.06 -0.58 1.40 0.78 -1.51 0.00 0.00 177.10 177.13 1nd2 h ASN 218 N 8.73 0.36 -3.01 -1.22 2.35 -1.63 -3.41 115.58 117.74 1nd2 h ASN 218 Ca -0.26 -0.42 -0.62 0.00 -0.55 0.00 0.00 56.30 54.44 1nd2 h ASN 218 Cb 1.11 -0.10 -0.17 0.00 0.05 0.00 0.00 38.32 39.21 1nd2 h ASN 218 CO 0.79 0.70 -0.80 0.26 -1.65 0.00 0.00 177.43 176.73 1nd2 s TRP 219 N -4.55 2.22 -0.05 1.19 0.52 -1.17 -1.56 118.94 115.54 1nd2 s TRP 219 Ca -0.14 -0.37 0.01 0.00 0.02 0.00 0.00 56.10 55.62 1nd2 s TRP 219 Cb 0.06 -1.07 0.02 0.00 -1.15 0.00 0.00 33.47 31.33 1nd2 s TRP 219 CO 0.74 0.53 -0.08 -1.12 0.02 0.00 0.00 176.95 177.04 1nd2 s SER 220 N -2.88 1.29 -0.30 2.95 0.01 -0.22 -0.30 113.70 114.24 1nd2 s SER 220 Ca 0.22 -0.20 -0.14 0.00 1.31 0.00 0.00 55.95 57.14 1nd2 s SER 220 Cb -0.07 -0.60 -0.03 0.00 0.21 0.00 0.00 66.02 65.53 1nd2 s SER 220 CO 0.11 -0.02 0.34 -0.22 0.41 0.00 0.00 173.24 173.85 1nd2 s LEU 221 N 0.83 4.20 -0.12 2.44 2.96 0.25 -0.81 118.68 128.43 1nd2 s LEU 221 Ca -0.12 0.02 0.02 0.00 -0.22 0.00 0.00 54.13 53.83 1nd2 s LEU 221 Cb -0.15 -2.34 -0.00 0.00 0.50 0.00 0.00 46.19 44.20 1nd2 s LEU 221 CO 0.01 -0.23 -0.19 -0.69 -1.32 0.00 0.00 176.35 173.93 1nd2 s VAL 222 N 2.00 2.43 -0.22 1.68 1.01 0.03 -0.99 120.40 126.35 1nd2 s VAL 222 Ca 0.12 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.23 1nd2 s VAL 222 Cb -0.16 -1.98 0.05 0.00 0.00 0.00 0.00 36.38 34.29 1nd2 s VAL 222 CO 0.11 0.54 -0.07 -0.63 0.00 0.00 0.00 175.10 175.05 1nd2 s ILE 223 N 0.45 1.56 -0.14 2.22 1.01 0.15 -0.67 121.20 125.77 1nd2 s ILE 223 Ca -0.14 -1.10 0.02 0.00 0.00 0.00 0.00 60.65 59.43 1nd2 s ILE 223 Cb -0.17 -1.74 0.01 0.00 0.01 0.00 0.00 42.46 40.57 1nd2 s ILE 223 CO 0.06 0.03 -0.21 -0.63 0.00 0.00 0.00 174.94 174.18 1nd2 s ILE 224 N 1.41 2.13 -0.63 2.92 -1.09 -0.68 -0.97 121.20 124.28 1nd2 s ILE 224 Ca -0.04 -0.96 -0.28 0.00 -2.23 0.00 0.00 60.65 57.15 1nd2 s ILE 224 Cb -0.18 -1.85 0.02 0.00 -1.58 0.00 0.00 42.46 38.87 1nd2 s ILE 224 CO -0.07 0.55 1.32 -2.16 -1.23 0.00 0.00 174.94 173.35 1nd2 s PRO 225 N 0.83 3.30 0.35 2.79 0.04 -1.26 -0.72 135.00 140.32 1nd2 s PRO 225 Ca -0.07 0.16 0.24 0.00 0.04 0.00 0.00 61.00 61.37 1nd2 s PRO 225 Cb -0.15 -4.12 0.40 0.00 0.04 0.00 0.00 34.50 30.66 1nd2 s PRO 225 CO -0.02 -1.97 1.56 -0.39 0.04 0.00 0.00 177.00 176.22 1nd2 h VAL 226 N 6.22 0.00 -3.29 -0.36 -1.51 -1.42 -3.42 116.25 112.47 1nd2 h VAL 226 Ca -0.27 -0.86 -0.52 0.00 -1.23 0.00 0.00 66.70 63.82 1nd2 h VAL 226 Cb 1.07 1.78 -0.38 0.00 -2.13 0.00 0.00 31.29 31.63 1nd2 h VAL 226 CO 1.22 0.00 -0.78 0.00 -1.23 0.00 0.00 177.57 176.77 1nd2 n GLN 228 N 4.97 1.43 -2.18 0.00 7.27 -1.26 -1.21 117.38 126.40 1nd2 n GLN 228 Ca -0.10 0.50 -0.42 0.00 0.07 0.00 0.00 57.00 57.05 1nd2 n GLN 228 Cb 0.48 -1.95 -0.03 0.00 2.41 0.00 0.00 30.24 31.16 1nd2 n GLN 228 CO 0.00 0.00 0.00 -1.17 0.07 0.00 0.00 177.06 175.96 1nd2 s LEU 229 N 0.37 4.31 0.01 1.69 2.96 -1.26 -4.23 118.68 122.53 1nd2 s LEU 229 Ca 0.63 2.14 -0.01 0.00 -0.22 0.00 0.00 54.13 56.66 1nd2 s LEU 229 Cb -0.72 -3.56 -0.01 0.00 0.50 0.00 0.00 46.19 42.40 1nd2 s LEU 229 CO 0.57 -0.77 0.00 -1.10 -1.32 0.00 0.00 176.35 173.74 1nd2 s GLN 230 N 2.73 0.21 0.07 1.98 -0.21 -0.17 -4.31 119.66 119.97 1nd2 s GLN 230 Ca 0.65 -0.34 -0.26 0.00 0.02 0.00 0.00 55.36 55.43 1nd2 s GLN 230 Cb -0.32 0.08 0.09 0.00 1.00 0.00 0.00 33.01 33.86 1nd2 s GLN 230 CO 0.27 -0.04 1.16 -1.54 -2.12 0.00 0.00 175.29 173.02 1nd2 s SER 231 N -0.88 -0.03 -0.35 5.90 1.04 -1.26 -1.63 113.70 116.49 1nd2 s SER 231 Ca -0.10 -0.37 0.07 0.00 0.48 0.00 0.00 55.95 56.03 1nd2 s SER 231 Cb -0.06 0.31 0.57 0.00 0.10 0.00 0.00 66.02 66.94 1nd2 s SER 231 CO -0.00 -0.60 1.64 0.59 0.98 0.00 0.00 173.24 175.85 1nd2 n ASN 232 N -0.92 2.98 -2.81 7.02 5.03 -1.26 -4.43 115.26 120.87 1nd2 n ASN 232 Ca -0.03 -3.71 -0.10 0.00 0.87 0.00 0.00 54.58 51.61 1nd2 n ASN 232 Cb 0.60 -0.72 0.06 0.00 -1.02 0.00 0.00 39.78 38.71 1nd2 n ASN 232 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1nd2 n ASN 233 N -1.12 -0.94 0.32 6.41 5.15 -1.26 -4.99 115.26 118.83 1nd2 n ASN 233 Ca 0.44 -3.06 0.21 0.00 -0.60 0.00 0.00 54.58 51.57 1nd2 n ASN 233 Cb 1.29 0.75 1.09 0.00 -0.53 0.00 0.00 39.78 42.38 1nd2 n ASN 233 CO 0.00 0.00 0.00 0.16 1.40 0.00 0.00 177.26 178.82 1nd2 h ILE 234 N 2.30 0.02 0.00 -1.44 3.07 -2.00 -2.64 117.51 116.83 1nd2 h ILE 234 Ca -0.11 -0.12 -0.03 0.00 1.55 0.00 0.00 64.86 66.15 1nd2 h ILE 234 Cb 1.14 1.12 -0.00 0.00 -0.27 0.00 0.00 36.82 38.81 1nd2 h ILE 234 CO 0.22 0.00 -0.12 0.77 -1.05 0.00 0.00 178.15 177.97 1nd2 h SER 235 N 0.00 0.00 -3.21 2.16 4.64 -1.98 -3.40 113.55 111.76 1nd2 h SER 235 Ca -0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 1nd2 h SER 235 Cb 0.12 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.16 1nd2 h SER 235 CO 0.00 0.12 0.99 0.21 -0.87 0.00 0.00 176.83 177.29 1nd2 s ASN 236 N -6.24 6.58 0.23 4.97 3.04 -1.00 -4.97 114.94 117.55 1nd2 s ASN 236 Ca -0.03 1.07 -0.30 0.00 0.04 0.00 0.00 52.86 53.64 1nd2 s ASN 236 Cb 0.13 -2.54 -0.09 0.00 -1.54 0.00 0.00 41.25 37.21 1nd2 s ASN 236 CO 0.59 -1.18 1.36 -0.63 -3.04 0.00 0.00 177.10 174.20 1nd2 s ILE 237 N 4.65 2.97 -0.43 -5.21 1.01 -1.26 -5.00 121.20 117.94 1nd2 s ILE 237 Ca 0.57 0.82 -0.01 0.00 0.00 0.00 0.00 60.65 62.03 1nd2 s ILE 237 Cb -0.15 -3.52 0.12 0.00 0.01 0.00 0.00 42.46 38.91 1nd2 s ILE 237 CO 0.26 0.13 0.21 -0.69 0.00 0.00 0.00 174.94 174.85 1nd2 s VAL 238 N -0.02 3.13 0.72 2.92 1.01 -1.26 -5.07 120.40 121.82 1nd2 s VAL 238 Ca 0.57 -2.28 -0.09 0.00 0.00 0.00 0.00 61.98 60.17 1nd2 s VAL 238 Cb -0.39 -3.15 0.05 0.00 0.00 0.00 0.00 36.38 32.89 1nd2 s VAL 238 CO 0.41 -0.70 1.06 -2.84 0.00 0.00 0.00 175.10 173.03 1nd2 s PRO 239 N 0.88 2.42 -0.09 2.72 0.02 -1.26 -1.39 135.00 138.30 1nd2 s PRO 239 Ca 0.10 0.08 0.01 0.00 0.02 0.00 0.00 61.00 61.21 1nd2 s PRO 239 Cb -0.22 -2.09 0.02 0.00 0.02 0.00 0.00 34.50 32.23 1nd2 s PRO 239 CO -0.05 -1.20 -0.12 0.42 -0.33 0.00 0.00 177.00 175.73 1nd2 s ILE 240 N -3.33 1.20 -0.03 2.83 1.01 0.73 -4.57 121.20 119.05 1nd2 s ILE 240 Ca 0.59 -0.47 0.07 0.00 0.00 0.00 0.00 60.65 60.84 1nd2 s ILE 240 Cb -0.11 -1.13 -0.02 0.00 0.01 0.00 0.00 42.46 41.21 1nd2 s ILE 240 CO 0.48 0.38 -0.24 -0.89 0.00 0.00 0.00 174.94 174.67 1nd2 s THR 241 N 1.05 1.90 -0.13 2.92 2.01 -0.07 -1.16 115.64 122.16 1nd2 s THR 241 Ca -0.07 -1.02 0.02 0.00 0.31 0.00 0.00 61.69 60.93 1nd2 s THR 241 Cb -0.15 -1.59 -0.00 0.00 0.01 0.00 0.00 72.50 70.77 1nd2 s THR 241 CO -0.01 0.54 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.58 1nd2 s VAL 242 N -0.46 2.50 -0.12 3.82 1.01 -1.26 0.29 120.40 126.17 1nd2 s VAL 242 Ca 0.06 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.21 1nd2 s VAL 242 Cb -0.10 -2.01 0.02 0.00 0.00 0.00 0.00 36.38 34.28 1nd2 s VAL 242 CO 0.00 0.54 -0.16 -0.44 0.00 0.00 0.00 175.10 175.04 1nd2 s SER 243 N 0.52 2.62 -0.06 3.32 0.01 -0.65 -0.88 113.70 118.57 1nd2 s SER 243 Ca -0.12 -0.47 0.04 0.00 1.31 0.00 0.00 55.95 56.71 1nd2 s SER 243 Cb -0.16 -1.18 -0.00 0.00 0.21 0.00 0.00 66.02 64.89 1nd2 s SER 243 CO 0.05 0.01 -0.20 -0.63 0.41 0.00 0.00 173.24 172.88 1nd2 s ILE 244 N 1.07 1.68 -0.20 1.44 1.01 -0.36 -0.88 121.20 124.96 1nd2 s ILE 244 Ca -0.04 -0.83 0.01 0.00 0.00 0.00 0.00 60.65 59.79 1nd2 s ILE 244 Cb -0.15 -1.45 0.03 0.00 0.01 0.00 0.00 42.46 40.91 1nd2 s ILE 244 CO -0.04 0.47 -0.18 -0.55 0.00 0.00 0.00 174.94 174.65 1nd2 s SER 245 N 0.15 3.44 0.88 3.58 0.15 -0.34 -0.58 113.70 120.98 1nd2 s SER 245 Ca -0.09 -0.80 -0.10 0.00 0.70 0.00 0.00 55.95 55.66 1nd2 s SER 245 Cb -0.14 -1.50 0.12 0.00 -1.71 0.00 0.00 66.02 62.79 1nd2 s SER 245 CO 0.04 -0.04 1.13 -2.84 1.20 0.00 0.00 173.24 172.73 1nd2 s PRO 246 N 1.25 1.31 -0.04 5.44 0.02 -1.25 -1.24 135.00 140.49 1nd2 s PRO 246 Ca 0.02 1.43 -0.01 0.00 0.02 0.00 0.00 61.00 62.46 1nd2 s PRO 246 Cb -0.15 -1.77 0.03 0.00 0.02 0.00 0.00 34.50 32.64 1nd2 s PRO 246 CO -0.11 -2.39 0.08 -1.64 -0.33 0.00 0.00 177.00 172.61 1nd2 s MET 247 N -4.72 0.02 -1.55 5.54 -1.94 0.03 -4.17 119.30 112.52 1nd2 s MET 247 Ca 0.65 0.27 -0.04 0.00 -1.71 0.00 0.00 55.69 54.86 1nd2 s MET 247 Cb -0.21 -0.22 0.01 0.00 2.01 0.00 0.00 34.83 36.42 1nd2 s MET 247 CO 0.58 -0.17 0.48 0.00 -0.01 0.00 0.00 175.02 175.89 1nd2 s ALA 249 N -3.11 3.75 -0.04 0.00 0.00 -1.26 -4.56 121.76 116.54 1nd2 s ALA 249 Ca 0.26 1.37 -0.09 0.00 0.00 0.00 0.00 51.96 53.50 1nd2 s ALA 249 Cb -0.12 -3.61 0.01 0.00 0.00 0.00 0.00 23.12 19.40 1nd2 s ALA 249 CO 0.32 -0.78 0.20 -1.83 0.00 0.00 0.00 175.76 173.67 1nd2 s GLU 250 N 0.82 0.39 0.11 0.00 -1.05 -0.39 -4.20 118.70 114.39 1nd2 s GLU 250 Ca 0.68 -0.00 0.05 0.00 -0.15 0.00 0.00 54.97 55.55 1nd2 s GLU 250 Cb -0.44 0.18 -0.04 0.00 -0.44 0.00 0.00 34.13 33.39 1nd2 s GLU 250 CO 0.34 -0.08 -0.13 -0.06 0.95 0.00 0.00 175.26 176.28 1nd2 s PHE 251 N -0.60 1.28 0.04 4.83 0.40 -0.42 -1.16 117.98 122.35 1nd2 s PHE 251 Ca -0.07 -0.57 -0.07 0.00 -0.60 0.00 0.00 56.93 55.62 1nd2 s PHE 251 Cb -0.04 -0.68 -0.00 0.00 0.51 0.00 0.00 43.02 42.80 1nd2 s PHE 251 CO 0.01 0.09 0.14 0.45 0.70 0.00 0.00 175.22 176.61 1nd2 s SER 252 N -2.37 0.11 0.00 1.36 0.15 -0.40 -0.60 113.70 111.95 1nd2 s SER 252 Ca 0.07 -0.45 0.00 0.00 0.70 0.00 0.00 55.95 56.26 1nd2 s SER 252 Cb -0.05 0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 1nd2 s SER 252 CO 0.02 -0.52 0.00 0.61 1.20 0.00 0.00 173.24 174.55 1nd2 n GLY 253 N 0.76 0.79 3.77 9.45 0.00 -1.26 -0.98 105.19 117.72 1nd2 n GLY 253 Ca -0.19 -0.34 -0.36 0.00 0.00 0.00 0.00 46.02 45.13 1nd2 n GLY 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nd2 s ALA 254 N -2.99 2.81 0.00 4.61 0.00 -1.26 -1.34 121.76 123.60 1nd2 s ALA 254 Ca 0.00 0.90 0.00 0.00 0.00 0.00 0.00 51.96 52.86 1nd2 s ALA 254 Cb 0.00 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.74 1nd2 s ALA 254 CO 0.00 -0.75 0.00 2.89 0.00 0.00 0.00 175.76 177.90 1nd2 n ARG 255 N -0.94 0.00 -1.26 0.00 1.85 -0.39 -4.95 116.66 110.97 1nd2 n ARG 255 Ca 0.10 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.66 1nd2 n ARG 255 Cb 0.49 0.00 0.17 0.00 -1.05 0.00 0.00 32.46 32.07 1nd2 n ARG 255 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1nd2 s ALA 256 N -1.00 1.16 -0.13 2.89 0.00 -1.26 -4.80 121.76 118.62 1nd2 s ALA 256 Ca 0.00 -0.40 -0.26 0.00 0.00 0.00 0.00 51.96 51.30 1nd2 s ALA 256 Cb 0.00 -3.10 -0.02 0.00 0.00 0.00 0.00 23.12 20.00 1nd2 s ALA 256 CO 0.00 -2.70 0.85 0.21 0.00 0.00 0.00 175.76 174.12 1nd2 s LYS 257 N -5.04 4.36 0.22 0.00 2.20 -1.26 -4.47 119.74 115.75 1nd2 s LYS 257 Ca 0.65 1.08 -0.30 0.00 -0.36 0.00 0.00 55.97 57.04 1nd2 s LYS 257 Cb -0.18 -3.54 -0.09 0.00 -1.51 0.00 0.00 37.83 32.52 1nd2 s LYS 257 CO 0.57 -0.23 1.29 0.99 -0.36 0.00 0.00 175.35 177.60 1nd2 s THR 258 N 1.80 3.18 -0.20 3.43 2.01 0.15 -4.96 115.64 121.05 1nd2 s THR 258 Ca 0.41 1.01 -0.01 0.00 0.31 0.00 0.00 61.69 63.40 1nd2 s THR 258 Cb -0.17 -3.64 0.00 0.00 0.01 0.00 0.00 72.50 68.70 1nd2 s THR 258 CO 0.15 0.17 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.44 1nd2 s VAL 259 N -0.15 2.74 -0.02 3.82 1.01 -1.26 -4.92 120.40 121.62 1nd2 s VAL 259 Ca 0.55 -0.71 -0.18 0.00 0.00 0.00 0.00 61.98 61.63 1nd2 s VAL 259 Cb -0.36 -2.21 -0.05 0.00 0.00 0.00 0.00 36.38 33.75 1nd2 s VAL 259 CO 0.40 0.48 0.51 -0.69 0.00 0.00 0.00 175.10 175.81 1nd2 s VAL 260 N 1.36 4.97 0.00 2.92 1.01 -1.26 -5.28 120.40 124.12 1nd2 s VAL 260 Ca 0.05 1.07 0.00 0.00 0.00 0.00 0.00 61.98 63.09 1nd2 s VAL 260 Cb -0.14 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.40 1nd2 s VAL 260 CO -0.08 0.46 0.00 0.00 0.00 0.00 0.00 175.10 175.49