#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nd3 n ASP 11 N 0.00 0.00 -1.11 -3.46 5.75 -1.26 -3.35 116.55 113.12 1nd3 n ASP 11 Ca 0.00 -0.34 0.08 0.00 -0.01 0.00 0.00 54.79 54.52 1nd3 n ASP 11 Cb 0.00 -0.20 0.29 0.00 -1.03 0.00 0.00 41.12 40.18 1nd3 n ASP 11 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1nd3 n ARG 12 N -1.20 3.36 -4.39 0.11 1.85 -1.26 -4.50 116.66 110.63 1nd3 n ARG 12 Ca 0.15 -2.84 -0.28 0.00 -1.00 0.00 0.00 57.85 53.88 1nd3 n ARG 12 Cb 0.18 -1.88 -0.13 0.00 -1.05 0.00 0.00 32.46 29.58 1nd3 n ARG 12 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 1nd3 s ILE 13 N -2.61 2.24 -0.12 8.89 1.01 -1.21 -1.97 121.20 127.43 1nd3 s ILE 13 Ca 0.44 -1.84 -0.20 0.00 0.00 0.00 0.00 60.65 59.05 1nd3 s ILE 13 Cb 0.34 -2.01 0.05 0.00 0.01 0.00 0.00 42.46 40.85 1nd3 s ILE 13 CO 0.12 0.00 0.50 -0.51 0.00 0.00 0.00 174.94 175.05 1nd3 s ILE 14 N -1.29 0.01 -0.06 2.92 2.07 -0.39 -4.93 121.20 119.54 1nd3 s ILE 14 Ca 0.16 -0.11 0.01 0.00 -1.41 0.00 0.00 60.65 59.29 1nd3 s ILE 14 Cb -0.09 -0.74 0.02 0.00 0.13 0.00 0.00 42.46 41.77 1nd3 s ILE 14 CO 0.07 -0.06 -0.06 -1.58 -1.91 0.00 0.00 174.94 171.40 1nd3 s GLN 15 N -0.38 1.07 -0.16 3.50 0.74 -1.26 -2.16 119.66 121.01 1nd3 s GLN 15 Ca -0.05 -0.15 0.01 0.00 0.05 0.00 0.00 55.36 55.21 1nd3 s GLN 15 Cb -0.03 -1.09 0.02 0.00 1.10 0.00 0.00 33.01 33.01 1nd3 s GLN 15 CO 0.03 -0.12 -0.18 0.42 -0.55 0.00 0.00 175.29 174.89 1nd3 s ILE 16 N 1.16 1.89 -0.16 -2.34 1.01 0.15 -4.96 121.20 117.94 1nd3 s ILE 16 Ca -0.07 -0.84 -0.02 0.00 0.00 0.00 0.00 60.65 59.73 1nd3 s ILE 16 Cb -0.14 -1.72 -0.01 0.00 0.01 0.00 0.00 42.46 40.59 1nd3 s ILE 16 CO -0.01 0.51 -0.10 -0.89 0.00 0.00 0.00 174.94 174.45 1nd3 s THR 17 N 1.30 3.22 -0.09 2.92 2.01 -1.26 -0.57 115.64 123.16 1nd3 s THR 17 Ca 0.04 -0.58 -0.02 0.00 0.31 0.00 0.00 61.69 61.43 1nd3 s THR 17 Cb -0.13 -2.39 0.04 0.00 0.01 0.00 0.00 72.50 70.02 1nd3 s THR 17 CO -0.11 0.49 0.04 -0.13 -0.69 0.00 0.00 174.62 174.22 1nd3 s ARG 18 N 0.70 0.30 7.33 4.92 1.81 0.42 -5.01 118.95 129.42 1nd3 s ARG 18 Ca -0.05 0.09 0.00 0.00 -1.72 0.00 0.00 55.73 54.05 1nd3 s ARG 18 Cb -0.15 -1.13 0.00 0.00 -0.45 0.00 0.00 34.95 33.22 1nd3 s ARG 18 CO 0.02 -0.42 0.00 0.41 -0.68 0.00 0.00 175.30 174.63 1nd3 n GLY 19 N 5.21 3.90 1.29 -3.53 0.00 -1.18 -0.65 105.19 110.23 1nd3 n GLY 19 Ca -0.06 0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.09 1nd3 n GLY 19 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nd3 n ASP 20 N 6.63 3.79 -4.41 1.61 8.00 -1.26 -4.93 116.55 125.98 1nd3 n ASP 20 Ca 0.00 -2.28 -0.30 0.00 0.71 0.00 0.00 54.79 52.91 1nd3 n ASP 20 Cb 0.00 -0.49 -0.13 0.00 -0.02 0.00 0.00 41.12 40.47 1nd3 n ASP 20 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1nd3 s SER 21 N -0.86 3.55 -0.03 -2.24 1.04 0.18 -5.08 113.70 110.27 1nd3 s SER 21 Ca 0.41 -0.50 0.01 0.00 0.48 0.00 0.00 55.95 56.36 1nd3 s SER 21 Cb 0.25 -0.48 0.02 0.00 0.10 0.00 0.00 66.02 65.91 1nd3 s SER 21 CO 0.22 0.25 -0.02 -0.89 0.98 0.00 0.00 173.24 173.78 1nd3 s THR 22 N -0.88 0.33 0.01 2.02 2.01 -1.26 -0.44 115.64 117.43 1nd3 s THR 22 Ca 0.13 -0.05 0.08 0.00 0.31 0.00 0.00 61.69 62.17 1nd3 s THR 22 Cb -0.10 -0.37 -0.02 0.00 0.01 0.00 0.00 72.50 72.02 1nd3 s THR 22 CO 0.04 0.16 -0.25 -0.63 -0.69 0.00 0.00 174.62 173.24 1nd3 s ILE 23 N 0.71 2.03 0.16 1.82 1.01 0.26 -4.95 121.20 122.24 1nd3 s ILE 23 Ca -0.08 -1.21 0.05 0.00 0.00 0.00 0.00 60.65 59.41 1nd3 s ILE 23 Cb -0.11 -1.71 -0.05 0.00 0.01 0.00 0.00 42.46 40.60 1nd3 s ILE 23 CO -0.01 0.47 -0.10 0.42 0.00 0.00 0.00 174.94 175.72 1nd3 s THR 24 N -0.69 1.28 -0.24 2.92 -4.23 -1.26 -0.68 115.64 112.74 1nd3 s THR 24 Ca 0.10 -2.09 -0.18 0.00 -1.18 0.00 0.00 61.69 58.34 1nd3 s THR 24 Cb -0.10 -1.92 0.07 0.00 1.34 0.00 0.00 72.50 71.89 1nd3 s THR 24 CO 0.00 -0.69 0.61 -0.55 -0.54 0.00 0.00 174.62 173.46 1nd3 s SER 25 N -3.21 -0.72 -0.09 3.99 0.15 -0.92 -5.00 113.70 107.90 1nd3 s SER 25 Ca 0.19 1.28 0.16 0.00 0.70 0.00 0.00 55.95 58.28 1nd3 s SER 25 Cb 0.02 1.24 0.54 0.00 -1.71 0.00 0.00 66.02 66.11 1nd3 s SER 25 CO 0.02 -0.22 1.46 0.00 1.20 0.00 0.00 173.24 175.70 1nd3 n GLN 26 N 3.42 3.25 -2.96 5.44 6.02 -1.26 -1.26 117.38 130.03 1nd3 n GLN 26 Ca -0.17 -2.61 -0.14 0.00 -0.01 0.00 0.00 57.00 54.07 1nd3 n GLN 26 Cb 0.57 -1.68 -0.01 0.00 1.02 0.00 0.00 30.24 30.14 1nd3 n GLN 26 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1nd3 n ASP 27 N 0.56 -1.89 -4.89 1.08 8.00 -0.84 -4.61 116.55 113.96 1nd3 n ASP 27 Ca 0.20 -2.94 -0.20 0.00 0.71 0.00 0.00 54.79 52.56 1nd3 n ASP 27 Cb 0.74 0.85 -0.03 0.00 -0.02 0.00 0.00 41.12 42.66 1nd3 n ASP 27 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1nd3 s VAL 28 N 0.16 3.02 -0.52 2.53 -7.23 -0.83 -1.27 120.40 116.26 1nd3 s VAL 28 Ca 0.32 -1.30 0.06 0.00 -1.81 0.00 0.00 61.98 59.25 1nd3 s VAL 28 Cb 0.14 -3.07 0.37 0.00 0.56 0.00 0.00 36.38 34.38 1nd3 s VAL 28 CO -0.16 -0.06 1.00 0.00 -0.31 0.00 0.00 175.10 175.56 1nd3 n ALA 29 N -1.53 4.69 -0.62 1.32 0.00 -1.26 -4.70 120.51 118.40 1nd3 n ALA 29 Ca 0.02 -4.50 0.00 0.00 0.00 0.00 0.00 53.44 48.97 1nd3 n ALA 29 Cb 0.61 -0.68 0.00 0.00 0.00 0.00 0.00 19.45 19.38 1nd3 n ALA 29 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1nd3 n ASN 30 N -0.31 -2.38 -4.08 0.00 4.05 -1.26 -4.92 115.26 106.36 1nd3 n ASN 30 Ca 0.33 0.00 -0.07 0.00 0.45 0.00 0.00 54.58 55.29 1nd3 n ASN 30 Cb 0.50 0.00 -0.10 0.00 1.23 0.00 0.00 39.78 41.41 1nd3 n ASN 30 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1nd3 s ALA 31 N -1.62 0.48 -0.07 5.20 0.00 -1.26 -4.57 121.76 119.92 1nd3 s ALA 31 Ca 0.00 -1.16 0.05 0.00 0.00 0.00 0.00 51.96 50.85 1nd3 s ALA 31 Cb 0.00 0.26 -0.01 0.00 0.00 0.00 0.00 23.12 23.37 1nd3 s ALA 31 CO 0.00 -0.35 -0.24 0.08 0.00 0.00 0.00 175.76 175.25 1nd3 s VAL 32 N -3.72 2.12 -0.40 0.00 1.01 -0.51 -5.04 120.40 113.86 1nd3 s VAL 32 Ca 0.05 -1.03 -0.05 0.00 0.00 0.00 0.00 61.98 60.95 1nd3 s VAL 32 Cb 0.07 -1.78 0.09 0.00 0.00 0.00 0.00 36.38 34.76 1nd3 s VAL 32 CO -0.09 0.57 0.21 -0.69 0.00 0.00 0.00 175.10 175.09 1nd3 s VAL 33 N -0.06 3.65 -0.40 2.92 1.01 -1.26 0.07 120.40 126.34 1nd3 s VAL 33 Ca -0.07 -1.71 -0.44 0.00 0.00 0.00 0.00 61.98 59.76 1nd3 s VAL 33 Cb -0.15 -3.34 -0.19 0.00 0.00 0.00 0.00 36.38 32.71 1nd3 s VAL 33 CO 0.05 -0.55 1.62 0.61 0.00 0.00 0.00 175.10 176.82 1nd3 n GLY 34 N 4.74 0.38 2.34 4.51 0.00 0.72 -0.26 105.19 117.62 1nd3 n GLY 34 Ca -0.07 0.97 -0.17 0.00 0.00 0.00 0.00 46.02 46.74 1nd3 n GLY 34 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1nd3 n TYR 35 N 4.29 -0.40 -1.57 1.61 4.01 -1.26 -2.10 117.16 121.74 1nd3 n TYR 35 Ca 0.29 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.83 1nd3 n TYR 35 Cb 0.01 -3.14 -0.08 0.00 -0.31 0.00 0.00 39.34 35.82 1nd3 n TYR 35 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1nd3 n GLY 36 N -0.45 1.88 3.20 2.72 0.00 0.64 -4.97 105.19 108.21 1nd3 n GLY 36 Ca -0.18 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.47 1nd3 n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nd3 s VAL 37 N -2.69 2.45 0.21 1.61 1.01 -0.89 -5.09 120.40 117.01 1nd3 s VAL 37 Ca 0.00 -0.83 -0.28 0.00 0.00 0.00 0.00 61.98 60.87 1nd3 s VAL 37 Cb 0.00 -2.04 -0.09 0.00 0.00 0.00 0.00 36.38 34.26 1nd3 s VAL 37 CO 0.00 0.52 0.88 0.86 0.00 0.00 0.00 175.10 177.35 1nd3 s TRP 38 N 1.09 3.96 0.37 5.22 -0.11 -1.26 -3.97 118.94 124.25 1nd3 s TRP 38 Ca -0.00 1.81 -0.28 0.00 1.22 0.00 0.00 56.10 58.85 1nd3 s TRP 38 Cb -0.14 -2.90 -0.11 0.00 -1.50 0.00 0.00 33.47 28.82 1nd3 s TRP 38 CO -0.06 0.48 1.46 -0.35 -4.62 0.00 0.00 176.95 173.87 1nd3 n PRO 39 N 1.53 2.60 -3.79 5.86 -0.04 -1.26 -4.90 135.00 135.00 1nd3 n PRO 39 Ca -0.03 0.91 -0.10 0.00 -0.04 0.00 0.00 63.50 64.24 1nd3 n PRO 39 Cb 0.48 -2.62 -0.07 0.00 -0.04 0.00 0.00 33.50 31.25 1nd3 n PRO 39 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1nd3 s HIS 40 N -1.08 0.03 0.71 0.54 -3.43 -1.26 -4.93 115.29 105.87 1nd3 s HIS 40 Ca 0.54 -0.38 -0.13 0.00 -0.80 0.00 0.00 55.06 54.29 1nd3 s HIS 40 Cb -0.49 0.03 0.03 0.00 -1.43 0.00 0.00 32.58 30.72 1nd3 s HIS 40 CO 0.63 -0.56 1.11 0.71 -2.00 0.00 0.00 174.74 174.63 1nd3 s TYR 41 N -3.57 2.56 0.18 0.38 1.51 -1.26 -4.94 117.35 112.20 1nd3 s TYR 41 Ca 0.02 1.56 -0.31 0.00 -1.01 0.00 0.00 57.07 57.34 1nd3 s TYR 41 Cb 0.03 -3.14 -0.09 0.00 -0.11 0.00 0.00 41.96 38.65 1nd3 s TYR 41 CO -0.10 -1.79 1.42 -1.17 -1.11 0.00 0.00 175.55 172.79 1nd3 s LEU 42 N -5.30 4.39 0.37 -1.29 2.96 -1.26 -5.02 118.68 113.52 1nd3 s LEU 42 Ca 0.65 2.48 -0.04 0.00 -0.22 0.00 0.00 54.13 57.00 1nd3 s LEU 42 Cb -0.20 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.85 1nd3 s LEU 42 CO 0.47 -0.67 0.64 0.42 -1.32 0.00 0.00 176.35 175.89 1nd3 s THR 43 N 0.60 5.00 0.46 3.68 -4.23 -1.26 -4.95 115.64 114.94 1nd3 s THR 43 Ca 0.62 -0.01 0.40 0.00 -1.18 0.00 0.00 61.69 61.52 1nd3 s THR 43 Cb -0.39 -3.81 0.42 0.00 1.34 0.00 0.00 72.50 70.06 1nd3 s THR 43 CO 0.35 -0.56 2.23 1.55 -0.54 0.00 0.00 174.62 177.65 1nd3 h PRO 44 N 0.95 0.00 0.00 3.99 0.13 -1.95 -1.52 132.00 133.60 1nd3 h PRO 44 Ca -0.48 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.55 1nd3 h PRO 44 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1nd3 h PRO 44 CO 0.63 0.01 -0.46 -0.56 -0.23 0.00 0.00 178.00 177.39 1nd3 h GLN 45 N 0.00 0.00 0.00 0.86 -0.00 -2.03 -3.30 115.11 110.64 1nd3 h GLN 45 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1nd3 h GLN 45 Cb 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.67 1nd3 h GLN 45 CO 0.00 0.46 -1.80 -0.25 -0.00 0.00 0.00 178.83 177.24 1nd3 n ASP 46 N -3.25 0.39 -4.74 0.06 10.43 -0.99 -5.00 116.55 113.45 1nd3 n ASP 46 Ca 0.02 -0.13 -0.34 0.00 2.57 0.00 0.00 54.79 56.91 1nd3 n ASP 46 Cb 0.69 1.81 0.07 0.00 1.84 0.00 0.00 41.12 45.54 1nd3 n ASP 46 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1nd3 s ALA 47 N -3.35 2.26 0.00 2.24 0.00 -0.61 -4.67 121.76 117.63 1nd3 s ALA 47 Ca -0.05 0.76 0.00 0.00 0.00 0.00 0.00 51.96 52.66 1nd3 s ALA 47 Cb 0.13 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.84 1nd3 s ALA 47 CO 0.85 -1.63 0.00 -2.37 0.00 0.00 0.00 175.76 172.61 1nd3 n THR 48 N -2.57 0.00 -2.18 0.00 5.66 -1.26 -5.01 114.28 108.91 1nd3 n THR 48 Ca 0.12 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.70 1nd3 n THR 48 Cb 0.51 -0.42 -0.03 0.00 -1.55 0.00 0.00 70.33 68.84 1nd3 n THR 48 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nd3 s ALA 49 N -1.59 3.57 -1.37 1.79 0.00 -1.26 -4.94 121.76 117.97 1nd3 s ALA 49 Ca 0.00 1.11 0.27 0.00 0.00 0.00 0.00 51.96 53.34 1nd3 s ALA 49 Cb 0.00 -3.53 0.86 0.00 0.00 0.00 0.00 23.12 20.46 1nd3 s ALA 49 CO 0.00 -0.60 1.64 0.44 0.00 0.00 0.00 175.76 177.25 1nd3 n ILE 50 N 3.78 0.00 -2.89 0.00 -5.35 -1.26 -4.91 119.36 108.73 1nd3 n ILE 50 Ca 0.11 -0.05 -0.32 0.00 -0.27 0.00 0.00 62.75 62.22 1nd3 n ILE 50 Cb 0.42 0.09 -0.05 0.00 -1.74 0.00 0.00 39.64 38.37 1nd3 n ILE 50 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 1nd3 s ASP 51 N -2.73 6.68 0.10 7.28 3.84 -1.26 -5.00 116.67 125.59 1nd3 s ASP 51 Ca 0.20 1.32 -0.31 0.00 -0.00 0.00 0.00 52.55 53.76 1nd3 s ASP 51 Cb 0.19 -2.40 -0.09 0.00 -1.38 0.00 0.00 42.92 39.24 1nd3 s ASP 51 CO 0.57 -0.35 1.66 -0.54 -0.00 0.00 0.00 175.17 176.51 1nd3 s LYS 52 N -3.47 4.19 0.70 2.11 1.02 -1.26 -4.95 119.74 118.07 1nd3 s LYS 52 Ca 0.55 2.39 -0.13 0.00 0.02 0.00 0.00 55.97 58.80 1nd3 s LYS 52 Cb -0.10 -3.49 0.02 0.00 -0.52 0.00 0.00 37.83 33.73 1nd3 s LYS 52 CO 0.24 -0.72 1.09 -2.14 -0.92 0.00 0.00 175.35 172.89 1nd3 s PRO 53 N 2.31 2.71 -0.14 -1.68 0.02 -1.26 -4.90 135.00 132.06 1nd3 s PRO 53 Ca 0.74 1.20 -0.05 0.00 0.02 0.00 0.00 61.00 62.91 1nd3 s PRO 53 Cb -0.42 -1.95 -0.04 0.00 0.02 0.00 0.00 34.50 32.11 1nd3 s PRO 53 CO 0.33 -1.29 0.04 -0.08 -0.33 0.00 0.00 177.00 175.66 1nd3 s THR 54 N -2.69 4.63 -0.47 0.99 -1.32 -0.02 -4.92 115.64 111.84 1nd3 s THR 54 Ca 0.63 -0.11 0.03 0.00 -1.21 0.00 0.00 61.69 61.03 1nd3 s THR 54 Cb -0.17 -3.03 0.13 0.00 -1.51 0.00 0.00 72.50 67.92 1nd3 s THR 54 CO 0.48 0.53 0.24 -1.10 -2.21 0.00 0.00 174.62 172.57 1nd3 s GLN 55 N -0.22 1.55 0.50 7.08 -0.21 -1.26 -1.46 119.66 125.64 1nd3 s GLN 55 Ca 0.07 -2.23 0.24 0.00 0.02 0.00 0.00 55.36 53.46 1nd3 s GLN 55 Cb -0.12 -2.73 1.31 0.00 1.00 0.00 0.00 33.01 32.46 1nd3 s GLN 55 CO 0.02 -1.13 1.70 -1.35 -2.12 0.00 0.00 175.29 172.40 1nd3 h PRO 56 N 6.68 0.00 0.00 2.91 0.11 -1.98 -3.47 132.00 136.25 1nd3 h PRO 56 Ca -0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1nd3 h PRO 56 Cb 0.92 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1nd3 h PRO 56 CO 0.56 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 174.88 1nd3 n ASP 57 N -2.52 0.00 0.22 -2.05 4.64 -1.26 -2.44 116.55 113.13 1nd3 n ASP 57 Ca -0.02 0.00 0.15 0.00 -1.38 0.00 0.00 54.79 53.54 1nd3 n ASP 57 Cb 0.29 0.00 0.78 0.00 -1.04 0.00 0.00 41.12 41.15 1nd3 n ASP 57 CO 0.00 0.00 0.00 0.71 -0.82 0.00 0.00 177.20 177.09 1nd3 h THR 58 N 0.00 0.00 0.00 5.18 1.35 -1.90 0.13 112.91 117.67 1nd3 h THR 58 Ca 0.00 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.81 1nd3 h THR 58 Cb 0.00 0.73 0.00 0.00 -1.73 0.00 0.00 68.15 67.15 1nd3 h THR 58 CO 0.00 0.00 -0.13 -1.20 -0.25 0.00 0.00 175.52 173.94 1nd3 n SER 59 N -2.55 0.19 0.00 5.36 7.64 -1.02 -4.13 113.62 119.10 1nd3 n SER 59 Ca -0.02 0.34 0.00 0.00 1.01 0.00 0.00 58.87 60.20 1nd3 n SER 59 Cb 0.08 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 62.93 1nd3 n SER 59 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1nd3 n SER 60 N -1.58 3.68 -3.85 6.43 3.41 -0.79 -4.33 113.62 116.60 1nd3 n SER 60 Ca 0.06 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.25 1nd3 n SER 60 Cb 0.35 0.32 0.00 0.00 -0.26 0.00 0.00 64.21 64.62 1nd3 n SER 60 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1nd3 n ASN 61 N -1.74 4.78 -3.99 4.04 3.02 0.40 -4.23 115.26 117.54 1nd3 n ASN 61 Ca 0.00 -3.04 -0.08 0.00 -0.03 0.00 0.00 54.58 51.43 1nd3 n ASN 61 Cb 0.38 -1.53 -0.08 0.00 -0.61 0.00 0.00 39.78 37.94 1nd3 n ASN 61 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nd3 s ARG 62 N 1.15 0.84 0.08 3.52 1.70 -1.26 -3.10 118.95 121.88 1nd3 s ARG 62 Ca 0.42 -1.15 -0.31 0.00 -0.47 0.00 0.00 55.73 54.22 1nd3 s ARG 62 Cb 0.10 0.29 -0.06 0.00 -0.57 0.00 0.00 34.95 34.71 1nd3 s ARG 62 CO -0.02 -0.24 1.24 -0.06 -1.08 0.00 0.00 175.30 175.14 1nd3 s PHE 63 N -3.93 3.39 -0.14 5.89 0.40 -1.26 -3.94 117.98 118.40 1nd3 s PHE 63 Ca 0.11 1.23 0.02 0.00 -0.60 0.00 0.00 56.93 57.68 1nd3 s PHE 63 Cb 0.06 -3.48 0.00 0.00 0.51 0.00 0.00 43.02 40.11 1nd3 s PHE 63 CO -0.07 -1.53 -0.20 0.71 0.70 0.00 0.00 175.22 174.83 1nd3 s TYR 64 N 1.02 2.69 -0.25 0.36 1.51 0.59 -4.91 117.35 118.34 1nd3 s TYR 64 Ca 0.60 -1.17 -0.13 0.00 -1.01 0.00 0.00 57.07 55.35 1nd3 s TYR 64 Cb -0.31 -1.82 -0.04 0.00 -0.11 0.00 0.00 41.96 39.67 1nd3 s TYR 64 CO 0.30 -0.52 0.30 0.99 -1.11 0.00 0.00 175.55 175.50 1nd3 s THR 65 N 0.71 5.24 1.07 -0.71 2.01 -1.26 -1.03 115.64 121.67 1nd3 s THR 65 Ca -0.09 0.43 -0.18 0.00 0.31 0.00 0.00 61.69 62.17 1nd3 s THR 65 Cb -0.16 -3.63 0.24 0.00 0.01 0.00 0.00 72.50 68.96 1nd3 s THR 65 CO 0.01 0.23 1.24 -0.76 -0.69 0.00 0.00 174.62 174.65 1nd3 s LEU 66 N 1.68 1.87 0.39 4.42 1.02 -0.36 -5.00 118.68 122.70 1nd3 s LEU 66 Ca 0.12 0.39 -0.26 0.00 0.02 0.00 0.00 54.13 54.40 1nd3 s LEU 66 Cb -0.15 -2.28 -0.09 0.00 0.02 0.00 0.00 46.19 43.69 1nd3 s LEU 66 CO 0.09 -3.36 1.21 -1.81 0.02 0.00 0.00 176.35 172.50 1nd3 s ASP 67 N -4.50 6.53 0.55 2.29 1.01 -1.25 -4.68 116.67 116.62 1nd3 s ASP 67 Ca 0.73 2.44 -0.15 0.00 0.71 0.00 0.00 52.55 56.28 1nd3 s ASP 67 Cb -0.06 -2.62 -0.06 0.00 1.01 0.00 0.00 42.92 41.19 1nd3 s ASP 67 CO 0.54 -0.68 1.01 -0.44 0.21 0.00 0.00 175.17 175.81 1nd3 s SER 68 N -0.97 6.40 0.17 0.27 0.01 -1.26 -4.70 113.70 113.60 1nd3 s SER 68 Ca 0.56 1.57 0.11 0.00 1.31 0.00 0.00 55.95 59.49 1nd3 s SER 68 Cb -0.33 -2.50 -0.04 0.00 0.21 0.00 0.00 66.02 63.35 1nd3 s SER 68 CO 0.42 -0.75 -0.24 -0.54 0.41 0.00 0.00 173.24 172.55 1nd3 s LYS 69 N -4.33 1.43 -0.20 12.44 -0.14 -0.23 -4.95 119.74 123.76 1nd3 s LYS 69 Ca 0.59 -1.44 -0.09 0.00 -1.36 0.00 0.00 55.97 53.67 1nd3 s LYS 69 Cb -0.11 -1.75 -0.05 0.00 -1.68 0.00 0.00 37.83 34.24 1nd3 s LYS 69 CO 0.37 0.39 0.11 -1.64 -0.76 0.00 0.00 175.35 173.82 1nd3 s MET 70 N -2.48 4.09 -0.26 1.68 -1.94 -1.26 0.11 119.30 119.24 1nd3 s MET 70 Ca 0.17 -0.27 -0.10 0.00 -1.71 0.00 0.00 55.69 53.78 1nd3 s MET 70 Cb -0.08 -3.37 -0.04 0.00 2.01 0.00 0.00 34.83 33.35 1nd3 s MET 70 CO 0.08 0.24 0.15 -0.46 -0.01 0.00 0.00 175.02 175.02 1nd3 s TRP 71 N 0.50 3.21 0.35 -0.03 -0.00 -0.65 -4.95 118.94 117.37 1nd3 s TRP 71 Ca 0.06 0.02 0.04 0.00 -0.00 0.00 0.00 56.10 56.22 1nd3 s TRP 71 Cb -0.12 -2.30 -0.04 0.00 -0.00 0.00 0.00 33.47 31.01 1nd3 s TRP 71 CO -0.00 -0.13 0.13 0.54 -0.00 0.00 0.00 176.95 177.48 1nd3 s ASN 72 N 1.47 2.24 0.29 5.86 2.20 -1.26 -4.38 114.94 121.36 1nd3 s ASN 72 Ca 0.07 -1.57 0.15 0.00 -0.94 0.00 0.00 52.86 50.57 1nd3 s ASN 72 Cb -0.15 0.34 0.84 0.00 -2.00 0.00 0.00 41.25 40.28 1nd3 s ASN 72 CO 0.07 -0.85 1.41 -1.54 -2.94 0.00 0.00 177.10 173.25 1nd3 n SER 73 N -1.04 0.40 -0.36 3.54 3.41 -1.26 -1.67 113.62 116.64 1nd3 n SER 73 Ca -0.03 0.63 0.05 0.00 -0.26 0.00 0.00 58.87 59.26 1nd3 n SER 73 Cb 0.65 -0.63 0.03 0.00 -0.26 0.00 0.00 64.21 64.01 1nd3 n SER 73 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1nd3 n THR 74 N -2.08 0.00 -1.67 6.66 -2.24 -1.26 -4.78 114.28 108.91 1nd3 n THR 74 Ca -0.01 -0.49 -0.44 0.00 -2.27 0.00 0.00 64.05 60.84 1nd3 n THR 74 Cb 0.18 1.19 -0.02 0.00 -2.10 0.00 0.00 70.33 69.58 1nd3 n THR 74 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1nd3 n SER 75 N 0.43 2.55 -0.00 3.42 7.64 -0.67 -4.91 113.62 122.08 1nd3 n SER 75 Ca 0.05 1.18 0.06 0.00 1.01 0.00 0.00 58.87 61.18 1nd3 n SER 75 Cb 0.23 -1.43 -0.08 0.00 -1.01 0.00 0.00 64.21 61.92 1nd3 n SER 75 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1nd3 n LYS 76 N 1.19 2.19 0.00 1.43 5.02 -1.26 -4.77 118.16 121.95 1nd3 n LYS 76 Ca 0.08 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 1nd3 n LYS 76 Cb 0.33 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 34.17 1nd3 n LYS 76 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nd3 n GLY 77 N 1.38 1.49 3.28 0.72 0.00 -1.26 -4.55 105.19 106.25 1nd3 n GLY 77 Ca 0.02 -2.01 -0.14 0.00 0.00 0.00 0.00 46.02 43.89 1nd3 n GLY 77 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1nd3 s TRP 78 N -1.25 -0.23 0.01 1.61 0.51 -0.22 -1.74 118.94 117.62 1nd3 s TRP 78 Ca 0.00 0.32 -0.10 0.00 -2.12 0.00 0.00 56.10 54.20 1nd3 s TRP 78 Cb 0.00 0.14 0.01 0.00 -0.81 0.00 0.00 33.47 32.81 1nd3 s TRP 78 CO 0.00 -0.45 0.20 1.67 -0.51 0.00 0.00 176.95 177.87 1nd3 s TRP 79 N -1.58 -0.02 0.07 -1.98 1.48 -0.87 -0.79 118.94 115.25 1nd3 s TRP 79 Ca -0.11 -0.05 0.02 0.00 -1.06 0.00 0.00 56.10 54.90 1nd3 s TRP 79 Cb -0.04 -0.00 -0.03 0.00 -1.16 0.00 0.00 33.47 32.24 1nd3 s TRP 79 CO 0.03 -0.35 -0.07 -1.58 -4.06 0.00 0.00 176.95 170.93 1nd3 s TRP 80 N -1.63 0.77 0.03 1.66 0.51 -0.18 -1.12 118.94 118.99 1nd3 s TRP 80 Ca -0.12 -0.77 0.08 0.00 -2.12 0.00 0.00 56.10 53.17 1nd3 s TRP 80 Cb -0.05 -0.46 -0.03 0.00 -0.81 0.00 0.00 33.47 32.12 1nd3 s TRP 80 CO 0.01 -0.14 -0.24 0.15 -0.51 0.00 0.00 176.95 176.22 1nd3 s LYS 81 N -2.97 1.72 0.02 4.98 1.02 -1.26 -0.08 119.74 123.18 1nd3 s LYS 81 Ca 0.03 -1.02 0.06 0.00 0.02 0.00 0.00 55.97 55.06 1nd3 s LYS 81 Cb -0.00 -1.84 -0.03 0.00 -0.52 0.00 0.00 37.83 35.44 1nd3 s LYS 81 CO -0.03 0.48 -0.16 -0.51 -0.92 0.00 0.00 175.35 174.21 1nd3 s LEU 82 N -1.09 2.68 0.00 3.17 1.43 0.37 -0.20 118.68 125.05 1nd3 s LEU 82 Ca 0.10 -0.36 0.28 0.00 -1.03 0.00 0.00 54.13 53.12 1nd3 s LEU 82 Cb -0.10 -1.56 1.65 0.00 0.03 0.00 0.00 46.19 46.22 1nd3 s LEU 82 CO 0.01 0.27 2.05 -0.81 0.23 0.00 0.00 176.35 178.11 1nd3 n PRO 83 N 1.66 0.98 -0.27 1.29 -0.04 -1.26 -1.36 135.00 135.99 1nd3 n PRO 83 Ca -0.16 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.37 1nd3 n PRO 83 Cb 0.52 -1.44 0.18 0.00 -0.04 0.00 0.00 33.50 32.72 1nd3 n PRO 83 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1nd3 h ASP 84 N 0.00 -0.38 -0.09 3.54 3.58 -1.78 0.72 116.42 122.02 1nd3 h ASP 84 Ca 0.00 0.21 0.03 0.00 0.42 0.00 0.00 57.03 57.69 1nd3 h ASP 84 Cb 0.00 0.37 -0.00 0.00 1.72 0.00 0.00 39.33 41.42 1nd3 h ASP 84 CO 0.00 -0.21 0.24 0.00 -2.88 0.00 0.00 179.24 176.39 1nd3 h ALA 85 N 1.76 1.46 -0.55 -0.78 0.00 -0.81 -0.91 119.26 119.43 1nd3 h ALA 85 Ca 0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1nd3 h ALA 85 Cb 0.81 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1nd3 h ALA 85 CO -0.72 -0.29 0.00 1.28 0.00 0.00 0.00 179.25 179.53 1nd3 n LEU 86 N -3.24 3.49 0.33 0.00 4.77 0.24 -3.38 117.00 119.21 1nd3 n LEU 86 Ca -0.00 -2.01 0.18 0.00 -0.03 0.00 0.00 56.01 54.14 1nd3 n LEU 86 Cb 0.33 -0.37 0.94 0.00 -2.33 0.00 0.00 43.42 41.98 1nd3 n LEU 86 CO 0.20 0.87 1.15 0.07 -1.33 0.00 0.00 177.39 178.34 1nd3 h LYS 87 N 3.23 0.00 0.00 3.23 2.10 -1.12 -0.87 116.57 123.14 1nd3 h LYS 87 Ca 0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1nd3 h LYS 87 Cb 0.88 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.20 1nd3 h LYS 87 CO 0.00 0.00 -0.44 -3.47 -2.00 0.00 0.00 179.45 173.54 1nd3 n ASP 88 N -3.00 1.77 -4.24 7.07 4.64 -1.26 -4.59 116.55 116.94 1nd3 n ASP 88 Ca -0.02 -3.73 -0.42 0.00 -1.38 0.00 0.00 54.79 49.24 1nd3 n ASP 88 Cb 0.29 -0.51 -0.07 0.00 -1.04 0.00 0.00 41.12 39.79 1nd3 n ASP 88 CO 0.00 0.00 0.00 -0.04 -0.82 0.00 0.00 177.20 176.34 1nd3 s MET 89 N -3.08 2.73 0.31 -0.67 -1.94 -0.33 -4.95 119.30 111.37 1nd3 s MET 89 Ca 0.37 -1.92 0.00 0.00 -1.71 0.00 0.00 55.69 52.43 1nd3 s MET 89 Cb 0.36 -4.05 0.00 0.00 2.01 0.00 0.00 34.83 33.15 1nd3 s MET 89 CO -0.06 -1.23 0.00 0.41 -0.01 0.00 0.00 175.02 174.13 1nd3 n GLY 90 N 4.72 1.15 0.33 -0.03 0.00 -1.26 -1.44 105.19 108.65 1nd3 n GLY 90 Ca -0.05 -0.40 0.05 0.00 0.00 0.00 0.00 46.02 45.62 1nd3 n GLY 90 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1nd3 h ILE 91 N 0.00 1.07 -0.26 -0.61 1.08 -1.97 -2.22 117.51 114.60 1nd3 h ILE 91 Ca 0.00 -0.21 0.00 0.00 -0.39 0.00 0.00 64.86 64.26 1nd3 h ILE 91 Cb 0.00 0.39 -0.01 0.00 -3.07 0.00 0.00 36.82 34.13 1nd3 h ILE 91 CO 0.00 0.11 0.16 0.15 -0.69 0.00 0.00 178.15 177.89 1nd3 h PHE 92 N 0.62 0.33 -0.34 1.37 3.57 -1.73 -0.96 116.94 119.81 1nd3 h PHE 92 Ca 0.21 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.72 1nd3 h PHE 92 Cb 0.08 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 1nd3 h PHE 92 CO -0.00 0.22 0.22 0.78 -2.23 0.00 0.00 178.31 177.30 1nd3 h GLY 93 N 0.34 0.49 0.69 2.40 0.00 -0.67 -2.40 103.07 103.92 1nd3 h GLY 93 Ca 0.09 -0.19 0.04 0.00 0.00 0.00 0.00 47.33 47.27 1nd3 h GLY 93 CO -0.02 0.19 0.06 0.83 0.00 0.00 0.00 176.54 177.60 1nd3 h GLU 94 N 0.46 0.17 -0.60 4.80 4.39 -1.16 -2.65 114.58 119.98 1nd3 h GLU 94 Ca 0.12 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.85 1nd3 h GLU 94 Cb -0.03 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 1nd3 h GLU 94 CO -0.03 0.11 0.40 -0.91 -1.16 0.00 0.00 179.01 177.42 1nd3 h ASN 95 N 0.17 0.60 0.94 1.42 2.35 -0.92 -1.95 115.58 118.19 1nd3 h ASN 95 Ca 0.13 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1nd3 h ASN 95 Cb 0.13 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.36 1nd3 h ASN 95 CO -0.16 0.41 0.00 0.00 -1.65 0.00 0.00 177.43 176.03 1nd3 h MET 96 N 0.70 0.00 0.00 0.81 -0.00 -1.06 -2.88 114.93 112.49 1nd3 h MET 96 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.94 1nd3 h MET 96 Cb 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.69 1nd3 h MET 96 CO -0.07 0.00 -1.94 1.19 -0.00 0.00 0.00 176.91 176.10 1nd3 n PHE 97 N -2.40 0.00 0.59 -0.10 3.01 -0.78 -4.27 117.46 113.52 1nd3 n PHE 97 Ca 0.03 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.61 1nd3 n PHE 97 Cb 0.28 -0.47 0.22 0.00 -0.01 0.00 0.00 39.48 39.50 1nd3 n PHE 97 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1nd3 n TYR 98 N -2.21 0.62 -4.31 1.38 4.02 -0.94 -0.95 117.16 114.76 1nd3 n TYR 98 Ca -0.04 0.18 -0.29 0.00 -0.01 0.00 0.00 57.90 57.74 1nd3 n TYR 98 Cb 0.53 -0.70 -0.11 0.00 -0.02 0.00 0.00 39.34 39.04 1nd3 n TYR 98 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 1nd3 s HIS 99 N -3.15 2.52 -0.01 -0.72 3.76 -1.09 -0.90 115.29 115.70 1nd3 s HIS 99 Ca 0.07 -0.27 -0.23 0.00 -0.15 0.00 0.00 55.06 54.48 1nd3 s HIS 99 Cb 0.13 -1.32 -0.20 0.00 1.11 0.00 0.00 32.58 32.30 1nd3 s HIS 99 CO 0.70 0.41 1.17 0.35 -0.85 0.00 0.00 174.74 176.51 1nd3 h PHE 100 N 3.62 0.30 -3.42 1.40 -0.00 -1.02 -3.46 116.94 114.36 1nd3 h PHE 100 Ca -0.49 -0.13 -0.66 0.00 -0.00 0.00 0.00 57.97 56.69 1nd3 h PHE 100 Cb 1.17 -0.05 -0.14 0.00 -0.00 0.00 0.00 35.95 36.94 1nd3 h PHE 100 CO 0.61 0.82 -0.67 -0.51 -0.00 0.00 0.00 178.31 178.56 1nd3 s LEU 101 N -8.80 3.38 0.09 0.59 1.43 -0.37 -4.04 118.68 110.96 1nd3 s LEU 101 Ca -0.15 -0.16 -0.07 0.00 -1.03 0.00 0.00 54.13 52.72 1nd3 s LEU 101 Cb 0.03 -2.06 -0.01 0.00 0.03 0.00 0.00 46.19 44.18 1nd3 s LEU 101 CO 0.74 0.22 0.16 -0.83 0.23 0.00 0.00 176.35 176.87 1nd3 s GLY 102 N -1.99 0.21 -0.21 -3.19 0.00 0.14 -1.14 107.32 101.14 1nd3 s GLY 102 Ca 0.23 -0.75 -0.18 0.00 0.00 0.00 0.00 44.72 44.01 1nd3 s GLY 102 CO 0.14 -0.90 0.56 -1.60 0.00 0.00 0.00 173.10 171.30 1nd3 s ARG 103 N -3.88 0.63 -0.15 2.90 3.52 -0.29 -2.18 118.95 119.49 1nd3 s ARG 103 Ca 0.07 0.83 -0.31 0.00 -0.13 0.00 0.00 55.73 56.19 1nd3 s ARG 103 Cb 0.05 0.26 0.13 0.00 -1.56 0.00 0.00 34.95 33.84 1nd3 s ARG 103 CO -0.10 -0.09 1.07 0.45 -0.81 0.00 0.00 175.30 175.82 1nd3 s SER 104 N 0.55 -0.27 0.54 -2.12 0.15 -1.26 -1.41 113.70 109.89 1nd3 s SER 104 Ca -0.02 0.18 0.05 0.00 0.70 0.00 0.00 55.95 56.86 1nd3 s SER 104 Cb -0.05 0.24 0.04 0.00 -1.71 0.00 0.00 66.02 64.55 1nd3 s SER 104 CO -0.03 -0.33 0.38 -0.83 1.20 0.00 0.00 173.24 173.63 1nd3 s GLY 105 N -1.62 2.42 0.09 9.45 0.00 -0.28 -4.11 107.32 113.26 1nd3 s GLY 105 Ca 0.04 -1.19 -0.10 0.00 0.00 0.00 0.00 44.72 43.47 1nd3 s GLY 105 CO -0.03 -1.96 0.22 -0.19 0.00 0.00 0.00 173.10 171.14 1nd3 s TYR 106 N -2.78 0.10 -0.26 1.90 1.51 -0.18 -0.62 117.35 117.03 1nd3 s TYR 106 Ca 0.32 -0.50 0.03 0.00 -1.01 0.00 0.00 57.07 55.91 1nd3 s TYR 106 Cb -0.02 -0.02 0.06 0.00 -0.11 0.00 0.00 41.96 41.88 1nd3 s TYR 106 CO 0.20 -0.56 -0.09 0.99 -1.11 0.00 0.00 175.55 174.99 1nd3 s THR 107 N -3.76 2.02 -0.24 -0.71 2.01 -0.25 -0.78 115.64 113.93 1nd3 s THR 107 Ca 0.04 -1.58 -0.10 0.00 0.31 0.00 0.00 61.69 60.37 1nd3 s THR 107 Cb 0.04 -2.18 -0.05 0.00 0.01 0.00 0.00 72.50 70.32 1nd3 s THR 107 CO -0.11 -0.08 0.14 -0.69 -0.69 0.00 0.00 174.62 173.19 1nd3 s VAL 108 N 1.16 5.12 -0.27 3.82 1.01 0.14 -1.21 120.40 130.17 1nd3 s VAL 108 Ca -0.07 0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.02 1nd3 s VAL 108 Cb -0.20 -3.39 0.07 0.00 0.00 0.00 0.00 36.38 32.87 1nd3 s VAL 108 CO -0.06 0.34 -0.03 -2.28 0.00 0.00 0.00 175.10 173.07 1nd3 s HIS 109 N 1.20 2.76 -0.16 5.22 2.46 -0.00 -0.85 115.29 125.90 1nd3 s HIS 109 Ca 0.07 -2.10 -0.16 0.00 0.47 0.00 0.00 55.06 53.34 1nd3 s HIS 109 Cb -0.14 -1.91 -0.04 0.00 -0.13 0.00 0.00 32.58 30.35 1nd3 s HIS 109 CO 0.05 -0.84 0.38 0.08 -2.47 0.00 0.00 174.74 171.94 1nd3 s VAL 110 N 1.27 5.24 -0.08 0.89 1.01 -0.34 -1.49 120.40 126.91 1nd3 s VAL 110 Ca -0.02 0.70 0.03 0.00 0.00 0.00 0.00 61.98 62.70 1nd3 s VAL 110 Cb -0.19 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.46 1nd3 s VAL 110 CO -0.08 0.32 -0.17 -1.10 0.00 0.00 0.00 175.10 174.07 1nd3 s GLN 111 N 0.81 2.78 -0.30 2.72 -0.21 0.15 -1.06 119.66 124.55 1nd3 s GLN 111 Ca 0.20 -0.76 -0.05 0.00 0.02 0.00 0.00 55.36 54.77 1nd3 s GLN 111 Cb -0.14 -2.39 0.19 0.00 1.00 0.00 0.00 33.01 31.67 1nd3 s GLN 111 CO 0.07 0.43 0.79 0.00 -2.12 0.00 0.00 175.29 174.46 1nd3 s ASN 113 N 2.90 4.14 0.00 0.00 4.22 -1.26 -4.43 114.94 120.51 1nd3 s ASN 113 Ca 0.12 -0.58 0.00 0.00 -2.14 0.00 0.00 52.86 50.26 1nd3 s ASN 113 Cb -0.12 -0.67 0.00 0.00 1.28 0.00 0.00 41.25 41.75 1nd3 s ASN 113 CO -0.18 0.12 0.00 0.00 -2.04 0.00 0.00 177.10 175.00 1nd3 n ALA 114 N 0.22 0.00 -3.61 3.54 0.00 -1.26 -4.80 120.51 114.60 1nd3 n ALA 114 Ca -0.12 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.24 1nd3 n ALA 114 Cb 0.55 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.97 1nd3 n ALA 114 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nd3 s SER 115 N 1.00 -0.21 0.00 0.00 1.04 -1.26 -5.00 113.70 109.27 1nd3 s SER 115 Ca 0.00 -0.70 0.09 0.00 0.48 0.00 0.00 55.95 55.82 1nd3 s SER 115 Cb 0.00 0.67 0.56 0.00 0.10 0.00 0.00 66.02 67.35 1nd3 s SER 115 CO 0.00 -1.26 1.10 0.29 0.98 0.00 0.00 173.24 174.35 1nd3 n LYS 116 N -0.43 0.67 -0.03 4.02 5.02 -1.26 -1.84 118.16 124.32 1nd3 n LYS 116 Ca -0.04 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.29 1nd3 n LYS 116 Cb 0.60 -1.22 0.05 0.00 -0.02 0.00 0.00 35.03 34.45 1nd3 n LYS 116 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1nd3 n PHE 117 N -0.72 0.00 -4.25 2.13 3.01 -1.26 -5.01 117.46 111.37 1nd3 n PHE 117 Ca 0.07 -0.68 -0.25 0.00 1.01 0.00 0.00 57.45 57.60 1nd3 n PHE 117 Cb 0.03 -0.09 -0.07 0.00 -0.01 0.00 0.00 39.48 39.34 1nd3 n PHE 117 CO 0.00 0.00 0.00 -1.01 1.01 0.00 0.00 176.76 176.76 1nd3 s HIS 118 N -1.70 2.78 0.02 1.38 3.76 -0.77 -4.49 115.29 116.27 1nd3 s HIS 118 Ca 0.12 -0.18 -0.04 0.00 -0.15 0.00 0.00 55.06 54.81 1nd3 s HIS 118 Cb 0.10 -1.29 -0.01 0.00 1.11 0.00 0.00 32.58 32.49 1nd3 s HIS 118 CO 0.01 0.56 0.07 1.14 -0.85 0.00 0.00 174.74 175.67 1nd3 s GLN 119 N -3.29 0.45 0.00 1.40 -2.07 -0.54 -4.58 119.66 111.03 1nd3 s GLN 119 Ca 0.29 -0.57 0.00 0.00 -1.82 0.00 0.00 55.36 53.26 1nd3 s GLN 119 Cb -0.08 0.18 0.00 0.00 -1.09 0.00 0.00 33.01 32.02 1nd3 s GLN 119 CO 0.19 -0.10 0.00 0.41 -1.32 0.00 0.00 175.29 174.47 1nd3 n GLY 120 N 1.31 3.11 2.88 2.60 0.00 -1.26 -1.06 105.19 112.77 1nd3 n GLY 120 Ca -0.22 -0.78 -0.14 0.00 0.00 0.00 0.00 46.02 44.88 1nd3 n GLY 120 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nd3 s THR 121 N -2.00 -0.06 -0.09 2.61 2.01 -0.63 -1.65 115.64 115.84 1nd3 s THR 121 Ca 0.00 0.20 0.01 0.00 0.31 0.00 0.00 61.69 62.20 1nd3 s THR 121 Cb 0.00 -0.20 -0.02 0.00 0.01 0.00 0.00 72.50 72.29 1nd3 s THR 121 CO 0.00 0.08 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.14 1nd3 s LEU 122 N 1.18 2.88 -0.29 4.42 1.43 -0.17 -1.29 118.68 126.85 1nd3 s LEU 122 Ca -0.09 -0.20 -0.12 0.00 -1.03 0.00 0.00 54.13 52.70 1nd3 s LEU 122 Cb -0.12 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.43 1nd3 s LEU 122 CO -0.05 0.26 0.23 -0.22 0.23 0.00 0.00 176.35 176.80 1nd3 s LEU 123 N -0.24 4.10 -0.28 1.79 2.96 0.13 -0.46 118.68 126.67 1nd3 s LEU 123 Ca 0.02 -0.03 -0.07 0.00 -0.22 0.00 0.00 54.13 53.83 1nd3 s LEU 123 Cb -0.13 -2.17 0.00 0.00 0.50 0.00 0.00 46.19 44.39 1nd3 s LEU 123 CO 0.03 -0.10 0.07 -0.69 -1.32 0.00 0.00 176.35 174.34 1nd3 s VAL 124 N 1.81 3.96 0.03 1.68 1.01 0.17 -1.71 120.40 127.35 1nd3 s VAL 124 Ca 0.08 -0.62 0.05 0.00 0.00 0.00 0.00 61.98 61.50 1nd3 s VAL 124 Cb -0.16 -3.00 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 1nd3 s VAL 124 CO 0.11 0.13 -0.16 -0.69 0.00 0.00 0.00 175.10 174.49 1nd3 s VAL 125 N 1.51 1.27 -0.30 2.92 1.01 -0.06 -1.48 120.40 125.27 1nd3 s VAL 125 Ca 0.03 -0.98 -0.04 0.00 0.00 0.00 0.00 61.98 60.99 1nd3 s VAL 125 Cb -0.17 -1.12 0.04 0.00 0.00 0.00 0.00 36.38 35.13 1nd3 s VAL 125 CO 0.02 0.13 0.04 -0.04 0.00 0.00 0.00 175.10 175.24 1nd3 s MET 126 N -0.99 2.66 -0.19 2.72 -1.94 -0.66 -0.70 119.30 120.20 1nd3 s MET 126 Ca 0.04 -1.13 -0.05 0.00 -1.71 0.00 0.00 55.69 52.84 1nd3 s MET 126 Cb -0.08 -3.27 -0.03 0.00 2.01 0.00 0.00 34.83 33.46 1nd3 s MET 126 CO 0.01 -0.57 0.00 0.42 -0.01 0.00 0.00 175.02 174.87 1nd3 s ILE 127 N 1.35 4.06 0.20 2.53 1.01 -0.16 -3.92 121.20 126.27 1nd3 s ILE 127 Ca -0.02 -0.28 -0.25 0.00 0.00 0.00 0.00 60.65 60.10 1nd3 s ILE 127 Cb -0.19 -2.83 -0.08 0.00 0.01 0.00 0.00 42.46 39.37 1nd3 s ILE 127 CO 0.00 0.44 0.80 -2.16 0.00 0.00 0.00 174.94 174.02 1nd3 s PRO 128 N 0.80 4.54 -1.18 2.79 0.04 -1.26 -1.16 135.00 139.58 1nd3 s PRO 128 Ca 0.01 1.15 -0.26 0.00 0.04 0.00 0.00 61.00 61.94 1nd3 s PRO 128 Cb -0.14 -3.14 0.01 0.00 0.04 0.00 0.00 34.50 31.27 1nd3 s PRO 128 CO 0.02 0.51 0.74 0.39 0.04 0.00 0.00 177.00 178.70 1nd3 n GLU 129 N 1.32 -0.87 -2.69 4.56 -0.58 -0.53 -4.83 120.64 117.01 1nd3 n GLU 129 Ca -0.04 0.30 -0.43 0.00 -0.42 0.00 0.00 57.16 56.57 1nd3 n GLU 129 Cb 0.49 -3.50 -0.01 0.00 -0.57 0.00 0.00 31.44 27.85 1nd3 n GLU 129 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1nd3 s HIS 130 N -3.51 2.93 -0.55 -0.32 2.46 -1.26 -4.95 115.29 110.11 1nd3 s HIS 130 Ca 0.47 -1.58 -0.28 0.00 0.47 0.00 0.00 55.06 54.14 1nd3 s HIS 130 Cb -0.21 -4.60 0.02 0.00 -0.13 0.00 0.00 32.58 27.66 1nd3 s HIS 130 CO 0.91 -1.71 1.31 -1.14 -2.47 0.00 0.00 174.74 171.64 1nd3 s GLN 131 N 3.62 3.45 0.75 2.88 0.74 -1.26 -5.00 119.66 124.84 1nd3 s GLN 131 Ca 0.48 0.44 -0.12 0.00 0.05 0.00 0.00 55.36 56.21 1nd3 s GLN 131 Cb 0.01 -4.06 0.05 0.00 1.10 0.00 0.00 33.01 30.11 1nd3 s GLN 131 CO 0.01 -1.76 1.10 -0.51 -0.55 0.00 0.00 175.29 173.59 1nd3 s LEU 132 N 5.45 3.12 0.32 3.68 1.43 -1.26 -4.78 118.68 126.64 1nd3 s LEU 132 Ca 0.49 1.91 0.09 0.00 -1.03 0.00 0.00 54.13 55.60 1nd3 s LEU 132 Cb -0.10 -4.53 -0.05 0.00 0.03 0.00 0.00 46.19 41.54 1nd3 s LEU 132 CO 0.27 -2.02 -0.01 0.00 0.23 0.00 0.00 176.35 174.82 1nd3 s ALA 133 N -2.71 3.16 0.20 4.21 0.00 -0.61 -4.72 121.76 121.29 1nd3 s ALA 133 Ca 0.63 -1.89 0.10 0.00 0.00 0.00 0.00 51.96 50.80 1nd3 s ALA 133 Cb -0.19 -0.45 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 1nd3 s ALA 133 CO 0.52 0.13 -0.11 0.95 0.00 0.00 0.00 175.76 177.24 1nd3 s THR 134 N -2.48 3.05 -0.11 0.00 -4.23 -1.26 0.68 115.64 111.28 1nd3 s THR 134 Ca 0.34 -1.80 0.01 0.00 -1.18 0.00 0.00 61.69 59.05 1nd3 s THR 134 Cb -0.02 -2.53 -0.02 0.00 1.34 0.00 0.00 72.50 71.28 1nd3 s THR 134 CO 0.19 -0.17 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.28 1nd3 s VAL 135 N -1.84 3.05 -1.51 2.29 1.01 -1.26 -4.70 120.40 117.45 1nd3 s VAL 135 Ca 0.25 -0.68 -0.09 0.00 0.00 0.00 0.00 61.98 61.46 1nd3 s VAL 135 Cb -0.08 -2.26 0.07 0.00 0.00 0.00 0.00 36.38 34.11 1nd3 s VAL 135 CO 0.15 0.54 0.75 0.59 0.00 0.00 0.00 175.10 177.13 1nd3 n ASN 136 N 3.17 -2.70 -0.96 3.32 3.02 -1.26 -4.88 115.26 114.97 1nd3 n ASN 136 Ca -0.18 -0.90 0.04 0.00 -0.03 0.00 0.00 54.58 53.51 1nd3 n ASN 136 Cb 0.53 -3.43 0.06 0.00 -0.61 0.00 0.00 39.78 36.32 1nd3 n ASN 136 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1nd3 n LYS 137 N -4.47 0.37 0.00 3.52 5.02 -1.26 -5.12 118.16 116.22 1nd3 n LYS 137 Ca -0.10 -2.01 0.00 0.00 -2.02 0.00 0.00 58.31 54.19 1nd3 n LYS 137 Cb 0.58 -0.53 0.00 0.00 -0.02 0.00 0.00 35.03 35.06 1nd3 n LYS 137 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nd3 n GLY 138 N -0.07 1.94 0.83 0.72 0.00 -1.26 -2.75 105.19 104.60 1nd3 n GLY 138 Ca 0.07 -0.52 0.03 0.00 0.00 0.00 0.00 46.02 45.60 1nd3 n GLY 138 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1nd3 n ASN 139 N -0.30 2.27 -4.69 1.61 0.23 -1.26 -4.86 115.26 108.26 1nd3 n ASN 139 Ca 0.00 -2.23 -0.42 0.00 -0.53 0.00 0.00 54.58 51.40 1nd3 n ASN 139 Cb 0.00 -0.44 -0.03 0.00 -2.08 0.00 0.00 39.78 37.23 1nd3 n ASN 139 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1nd3 s VAL 140 N -1.63 4.66 0.35 3.53 1.01 -1.11 -5.03 120.40 122.18 1nd3 s VAL 140 Ca 0.19 1.94 0.07 0.00 0.00 0.00 0.00 61.98 64.17 1nd3 s VAL 140 Cb 0.13 -4.24 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 1nd3 s VAL 140 CO 0.08 0.03 0.47 0.20 0.00 0.00 0.00 175.10 175.88 1nd3 s ASN 141 N 1.15 5.87 0.19 3.32 0.01 -1.26 -4.67 114.94 119.55 1nd3 s ASN 141 Ca 0.51 -0.25 -0.33 0.00 -0.71 0.00 0.00 52.86 52.08 1nd3 s ASN 141 Cb -0.20 -1.13 -0.14 0.00 0.41 0.00 0.00 41.25 40.19 1nd3 s ASN 141 CO 0.21 -0.47 1.53 0.00 -1.51 0.00 0.00 177.10 176.86 1nd3 n ALA 142 N -1.65 1.35 -1.81 0.60 0.00 -1.26 -4.76 120.51 112.99 1nd3 n ALA 142 Ca 0.01 0.43 -0.33 0.00 0.00 0.00 0.00 53.44 53.55 1nd3 n ALA 142 Cb 0.58 -2.34 -0.05 0.00 0.00 0.00 0.00 19.45 17.65 1nd3 n ALA 142 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1nd3 s GLY 143 N 0.73 2.39 0.21 0.00 0.00 -0.51 -4.95 107.32 105.19 1nd3 s GLY 143 Ca 0.75 0.45 -0.16 0.00 0.00 0.00 0.00 44.72 45.77 1nd3 s GLY 143 CO 0.41 0.75 1.60 -1.82 0.00 0.00 0.00 173.10 174.05 1nd3 h TYR 144 N 1.61 -0.58 0.00 1.90 3.20 -1.92 -1.15 116.97 120.03 1nd3 h TYR 144 Ca -0.49 0.07 -0.01 0.00 3.14 0.00 0.00 58.73 61.44 1nd3 h TYR 144 Cb 1.20 0.35 -0.00 0.00 1.54 0.00 0.00 36.73 39.82 1nd3 h TYR 144 CO 0.60 -0.33 -0.04 1.57 -1.64 0.00 0.00 178.16 178.33 1nd3 h LYS 145 N -0.06 0.00 0.00 1.82 2.10 -1.93 -2.43 116.57 116.06 1nd3 h LYS 145 Ca 0.29 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.78 1nd3 h LYS 145 Cb 0.52 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.83 1nd3 h LYS 145 CO -0.70 0.04 -0.78 1.88 -2.00 0.00 0.00 179.45 177.89 1nd3 h TYR 146 N 0.00 0.00 -0.67 0.07 -1.99 -1.56 -3.21 116.97 109.62 1nd3 h TYR 146 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1nd3 h TYR 146 Cb 0.30 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.03 1nd3 h TYR 146 CO 0.00 0.78 0.00 0.25 -0.00 0.00 0.00 178.16 179.19 1nd3 n THR 147 N -3.32 1.35 -3.11 -2.88 -2.24 -0.94 -4.37 114.28 98.77 1nd3 n THR 147 Ca 0.01 -1.03 -0.20 0.00 -2.27 0.00 0.00 64.05 60.56 1nd3 n THR 147 Cb 0.84 0.28 -0.03 0.00 -2.10 0.00 0.00 70.33 69.33 1nd3 n THR 147 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1nd3 n HIS 148 N 1.32 1.14 0.34 4.78 8.25 -1.04 -4.85 115.22 125.15 1nd3 n HIS 148 Ca 0.24 -3.82 0.15 0.00 -0.26 0.00 0.00 57.72 54.03 1nd3 n HIS 148 Cb 0.73 -0.43 0.59 0.00 1.12 0.00 0.00 29.99 31.99 1nd3 n HIS 148 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1nd3 h PRO 149 N 2.99 0.00 0.00 -0.41 0.11 -1.76 -3.47 132.00 129.46 1nd3 h PRO 149 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1nd3 h PRO 149 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1nd3 h PRO 149 CO 0.58 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.78 1nd3 n GLY 150 N 0.09 -1.44 0.31 -0.55 0.00 -1.26 -3.86 105.19 98.47 1nd3 n GLY 150 Ca 0.01 -1.30 0.21 0.00 0.00 0.00 0.00 46.02 44.94 1nd3 n GLY 150 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1nd3 h GLU 151 N 0.00 0.00 0.00 1.61 4.11 -1.80 -1.31 114.58 117.19 1nd3 h GLU 151 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1nd3 h GLU 151 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1nd3 h GLU 151 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 179.01 179.08 1nd3 h ALA 152 N 1.97 1.00 -0.99 1.06 0.00 -1.91 -3.32 119.26 117.07 1nd3 h ALA 152 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1nd3 h ALA 152 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1nd3 h ALA 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1nd3 n GLY 153 N 0.51 0.95 2.97 0.00 0.00 -0.50 -4.75 105.19 104.39 1nd3 n GLY 153 Ca 0.02 -0.81 -0.24 0.00 0.00 0.00 0.00 46.02 44.99 1nd3 n GLY 153 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1nd3 s ARG 154 N 0.00 1.46 -0.40 1.61 6.06 -0.28 -4.81 118.95 122.59 1nd3 s ARG 154 Ca 0.00 -0.31 -0.17 0.00 -2.50 0.00 0.00 55.73 52.75 1nd3 s ARG 154 Cb 0.00 -1.29 0.01 0.00 0.06 0.00 0.00 34.95 33.73 1nd3 s ARG 154 CO 0.00 -0.04 0.43 -1.21 -2.50 0.00 0.00 175.30 171.97 1nd3 s GLU 155 N 0.88 3.22 0.29 5.12 2.02 -1.26 -2.06 118.70 126.91 1nd3 s GLU 155 Ca -0.11 -0.65 -0.30 0.00 0.02 0.00 0.00 54.97 53.93 1nd3 s GLU 155 Cb -0.15 -3.92 -0.12 0.00 0.10 0.00 0.00 34.13 30.04 1nd3 s GLU 155 CO 0.01 -0.77 1.58 0.28 0.02 0.00 0.00 175.26 176.37 1nd3 n VAL 156 N 5.40 1.06 -1.87 2.63 0.31 -0.71 -3.51 118.33 121.63 1nd3 n VAL 156 Ca -0.07 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 63.99 1nd3 n VAL 156 Cb 0.48 -1.93 0.00 0.00 -0.91 0.00 0.00 33.84 31.48 1nd3 n VAL 156 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1nd3 n GLY 157 N 2.09 0.82 1.80 2.92 0.00 -1.26 -4.41 105.19 107.15 1nd3 n GLY 157 Ca 0.08 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1nd3 n GLY 157 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1nd3 n THR 158 N -2.72 0.00 -0.99 2.61 -2.24 -1.23 -5.09 114.28 104.64 1nd3 n THR 158 Ca 0.00 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.45 1nd3 n THR 158 Cb 0.41 -0.70 0.02 0.00 -2.10 0.00 0.00 70.33 67.97 1nd3 n THR 158 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nd3 n GLN 159 N -2.62 0.00 -3.25 -0.78 0.00 -1.26 -4.93 117.38 104.54 1nd3 n GLN 159 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 57.00 56.56 1nd3 n GLN 159 Cb 0.10 -0.89 -0.07 0.00 0.00 0.00 0.00 30.24 29.37 1nd3 n GLN 159 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1nd3 s VAL 160 N -1.79 5.01 -0.98 -0.39 1.01 -1.26 -4.99 120.40 117.00 1nd3 s VAL 160 Ca 0.42 -0.60 -0.11 0.00 0.00 0.00 0.00 61.98 61.69 1nd3 s VAL 160 Cb -0.28 -4.20 -0.32 0.00 0.00 0.00 0.00 36.38 31.57 1nd3 s VAL 160 CO 0.68 -0.67 2.18 -0.62 0.00 0.00 0.00 175.10 176.67 1nd3 n GLU 161 N 5.81 0.04 -2.94 2.72 -0.58 -1.26 -4.96 120.64 119.47 1nd3 n GLU 161 Ca -0.08 -0.06 -0.18 0.00 -0.42 0.00 0.00 57.16 56.42 1nd3 n GLU 161 Cb 0.45 -1.21 0.02 0.00 -0.57 0.00 0.00 31.44 30.13 1nd3 n GLU 161 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 1nd3 s ASN 162 N 0.98 5.57 0.11 1.62 0.01 -1.26 -5.04 114.94 116.92 1nd3 s ASN 162 Ca 1.29 -0.35 -0.16 0.00 -0.71 0.00 0.00 52.86 52.92 1nd3 s ASN 162 Cb -0.80 -0.68 -0.05 0.00 0.41 0.00 0.00 41.25 40.13 1nd3 s ASN 162 CO 0.53 -0.85 1.55 -0.08 -1.51 0.00 0.00 177.10 176.74 1nd3 h GLU 163 N 0.52 0.59 -0.55 -0.60 4.81 -2.02 -3.01 114.58 114.31 1nd3 h GLU 163 Ca -0.40 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 58.64 1nd3 h GLU 163 Cb 1.28 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1nd3 h GLU 163 CO 0.46 0.71 0.00 1.63 -0.73 0.00 0.00 179.01 181.08 1nd3 n LYS 164 N -4.53 0.98 -2.34 1.92 4.76 -1.26 -4.85 118.16 112.85 1nd3 n LYS 164 Ca -0.02 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.00 1nd3 n LYS 164 Cb 0.27 -1.28 -0.03 0.00 -1.84 0.00 0.00 35.03 32.15 1nd3 n LYS 164 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 1nd3 s GLN 165 N -1.44 4.38 0.86 1.97 2.00 -1.14 -1.42 119.66 124.87 1nd3 s GLN 165 Ca 0.00 1.87 -0.12 0.00 -2.00 0.00 0.00 55.36 55.11 1nd3 s GLN 165 Cb 0.00 -3.35 0.11 0.00 0.80 0.00 0.00 33.01 30.57 1nd3 s GLN 165 CO 0.00 -0.34 1.13 -1.25 -0.50 0.00 0.00 175.29 174.32 1nd3 s PRO 166 N 1.24 1.58 0.48 1.67 0.04 -1.26 -4.72 135.00 134.04 1nd3 s PRO 166 Ca 0.61 0.39 -0.23 0.00 0.04 0.00 0.00 61.00 61.81 1nd3 s PRO 166 Cb -0.31 -1.88 -0.08 0.00 0.04 0.00 0.00 34.50 32.27 1nd3 s PRO 166 CO 0.29 -1.91 1.20 0.45 0.04 0.00 0.00 177.00 177.07 1nd3 n SER 167 N -3.59 2.11 -0.29 6.66 2.88 0.21 -4.91 113.62 116.70 1nd3 n SER 167 Ca 0.07 1.02 0.08 0.00 -1.33 0.00 0.00 58.87 58.71 1nd3 n SER 167 Cb 0.58 -1.48 0.14 0.00 -0.75 0.00 0.00 64.21 62.71 1nd3 n SER 167 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1nd3 n ASP 168 N -0.19 1.95 -4.43 -3.46 2.03 -1.26 -4.82 116.55 106.38 1nd3 n ASP 168 Ca 0.09 -3.19 -0.44 0.00 0.52 0.00 0.00 54.79 51.77 1nd3 n ASP 168 Cb 0.42 -0.43 -0.04 0.00 -0.72 0.00 0.00 41.12 40.34 1nd3 n ASP 168 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1nd3 s ASP 169 N -2.80 6.18 0.37 1.67 1.01 -1.26 -4.65 116.67 117.19 1nd3 s ASP 169 Ca 0.31 -1.14 0.08 0.00 0.71 0.00 0.00 52.55 52.51 1nd3 s ASP 169 Cb 0.29 -2.38 0.72 0.00 1.01 0.00 0.00 42.92 42.56 1nd3 s ASP 169 CO -0.01 -1.33 1.89 -0.55 0.21 0.00 0.00 175.17 175.38 1nd3 h ASN 170 N 9.44 0.28 0.69 0.27 7.08 -1.93 -2.14 115.58 129.26 1nd3 h ASN 170 Ca -0.29 -0.06 0.00 0.00 -3.08 0.00 0.00 56.30 52.87 1nd3 h ASN 170 Cb 1.08 -0.07 0.00 0.00 -2.08 0.00 0.00 38.32 37.24 1nd3 h ASN 170 CO 1.15 0.44 0.00 -2.67 -2.08 0.00 0.00 177.43 174.27 1nd3 n TRP 171 N -4.25 0.61 -1.18 4.14 4.27 -1.26 -2.05 117.44 117.72 1nd3 n TRP 171 Ca -0.00 0.24 0.05 0.00 -3.89 0.00 0.00 57.50 53.89 1nd3 n TRP 171 Cb 0.28 -0.88 0.21 0.00 -1.36 0.00 0.00 31.31 29.56 1nd3 n TRP 171 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1nd3 n LEU 172 N -2.05 3.54 -1.62 5.67 4.77 -0.90 -1.81 117.00 124.60 1nd3 n LEU 172 Ca 0.03 -3.30 -0.12 0.00 -0.03 0.00 0.00 56.01 52.58 1nd3 n LEU 172 Cb 0.22 -0.54 -0.04 0.00 -2.33 0.00 0.00 43.42 40.72 1nd3 n LEU 172 CO 0.18 0.89 -0.13 0.59 -1.33 0.00 0.00 177.39 177.60 1nd3 n ASN 173 N -0.93 -3.42 -0.59 -1.43 5.03 -0.87 -1.07 115.26 111.97 1nd3 n ASN 173 Ca 0.23 0.28 -0.08 0.00 0.87 0.00 0.00 54.58 55.89 1nd3 n ASN 173 Cb 0.87 -3.14 -0.03 0.00 -1.02 0.00 0.00 39.78 36.45 1nd3 n ASN 173 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1nd3 n PHE 174 N -2.20 -0.02 -1.27 3.10 3.72 -0.86 -4.69 117.46 115.24 1nd3 n PHE 174 Ca -0.13 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.27 1nd3 n PHE 174 Cb 0.46 -2.48 0.00 0.00 -0.94 0.00 0.00 39.48 36.52 1nd3 n PHE 174 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1nd3 n ASP 175 N -1.00 0.00 0.00 4.37 5.68 -0.32 -1.58 116.55 123.70 1nd3 n ASP 175 Ca -0.08 -1.03 0.00 0.00 -0.50 0.00 0.00 54.79 53.19 1nd3 n ASP 175 Cb 0.55 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.52 1nd3 n ASP 175 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nd3 n GLY 176 N 0.00 0.70 3.28 6.12 0.00 -0.24 -4.85 105.19 110.20 1nd3 n GLY 176 Ca 0.00 -0.40 -0.18 0.00 0.00 0.00 0.00 46.02 45.43 1nd3 n GLY 176 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nd3 s THR 177 N -2.00 1.47 0.02 2.61 -4.23 -1.01 -5.04 115.64 107.46 1nd3 s THR 177 Ca 0.00 -1.87 -0.30 0.00 -1.18 0.00 0.00 61.69 58.34 1nd3 s THR 177 Cb 0.00 -1.70 -0.04 0.00 1.34 0.00 0.00 72.50 72.10 1nd3 s THR 177 CO 0.00 -0.46 1.07 -0.76 -0.54 0.00 0.00 174.62 173.93 1nd3 s LEU 178 N -2.71 4.36 0.29 4.79 1.43 -1.26 -2.76 118.68 122.82 1nd3 s LEU 178 Ca 0.13 1.80 0.01 0.00 -1.03 0.00 0.00 54.13 55.05 1nd3 s LEU 178 Cb -0.04 -3.57 0.69 0.00 0.03 0.00 0.00 46.19 43.30 1nd3 s LEU 178 CO 0.04 -0.36 1.64 0.25 0.23 0.00 0.00 176.35 178.15 1nd3 h LEU 179 N 6.88 -0.05 -2.02 1.79 5.85 -1.61 -0.88 115.31 125.27 1nd3 h LEU 179 Ca -0.41 0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.51 1nd3 h LEU 179 Cb 1.21 0.28 0.00 0.00 0.37 0.00 0.00 40.66 42.53 1nd3 h LEU 179 CO 0.78 -0.17 0.13 1.23 -0.34 0.00 0.00 178.44 180.07 1nd3 h GLY 180 N 0.19 0.00 -2.06 3.75 0.00 -1.93 -1.07 103.07 101.95 1nd3 h GLY 180 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1nd3 h GLY 180 CO -0.67 0.00 0.00 0.70 0.00 0.00 0.00 176.54 176.57 1nd3 n ASN 181 N -2.66 3.15 0.26 0.19 3.02 -0.34 -4.24 115.26 114.65 1nd3 n ASN 181 Ca -0.02 -1.95 0.18 0.00 -0.03 0.00 0.00 54.58 52.76 1nd3 n ASN 181 Cb 0.17 -0.25 0.83 0.00 -0.61 0.00 0.00 39.78 39.93 1nd3 n ASN 181 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1nd3 h LEU 182 N 4.00 0.00 0.00 3.41 3.38 -1.32 -2.65 115.31 122.14 1nd3 h LEU 182 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1nd3 h LEU 182 Cb 0.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1nd3 h LEU 182 CO 0.00 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.71 1nd3 n LEU 183 N -2.86 0.00 0.02 1.67 4.32 -1.26 -1.06 117.00 117.82 1nd3 n LEU 183 Ca -0.01 0.31 0.12 0.00 -0.02 0.00 0.00 56.01 56.42 1nd3 n LEU 183 Cb 0.18 -0.31 0.53 0.00 -1.62 0.00 0.00 43.42 42.20 1nd3 n LEU 183 CO 0.22 -0.25 0.90 0.00 -1.22 0.00 0.00 177.39 177.04 1nd3 n ILE 184 N -1.31 0.30 -3.93 -0.08 0.13 -1.00 -4.76 119.36 108.71 1nd3 n ILE 184 Ca 0.03 0.02 -0.21 0.00 -1.10 0.00 0.00 62.75 61.49 1nd3 n ILE 184 Cb 0.05 -0.63 -0.03 0.00 -0.84 0.00 0.00 39.64 38.19 1nd3 n ILE 184 CO 0.00 0.00 0.00 -0.36 2.80 0.00 0.00 176.55 178.99 1nd3 s PHE 185 N -3.02 3.24 0.06 9.51 2.99 -0.23 -5.03 117.98 125.50 1nd3 s PHE 185 Ca 0.12 -0.11 -0.34 0.00 0.00 0.00 0.00 56.93 56.60 1nd3 s PHE 185 Cb 0.16 -1.60 -0.13 0.00 0.00 0.00 0.00 43.02 41.45 1nd3 s PHE 185 CO 0.48 0.38 1.71 -2.30 -0.00 0.00 0.00 175.22 175.49 1nd3 n PRO 186 N -1.36 2.19 -3.88 0.24 -0.02 -1.25 -4.86 135.00 126.05 1nd3 n PRO 186 Ca -0.07 0.80 -0.08 0.00 -2.02 0.00 0.00 63.50 62.13 1nd3 n PRO 186 Cb 0.58 -2.60 -0.02 0.00 -0.02 0.00 0.00 33.50 31.44 1nd3 n PRO 186 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1nd3 s HIS 187 N 2.24 0.05 0.23 6.00 -3.43 -1.26 -1.65 115.29 117.48 1nd3 s HIS 187 Ca 0.84 -0.54 -0.17 0.00 -0.80 0.00 0.00 55.06 54.40 1nd3 s HIS 187 Cb -0.67 0.62 0.02 0.00 -1.43 0.00 0.00 32.58 31.11 1nd3 s HIS 187 CO 0.43 -1.28 0.56 -0.65 -2.00 0.00 0.00 174.74 171.81 1nd3 s GLN 188 N -3.47 1.55 0.11 -0.38 -0.21 -0.55 -4.93 119.66 111.77 1nd3 s GLN 188 Ca 0.15 -1.02 0.10 0.00 0.02 0.00 0.00 55.36 54.61 1nd3 s GLN 188 Cb -0.05 0.53 -0.04 0.00 1.00 0.00 0.00 33.01 34.46 1nd3 s GLN 188 CO 0.09 -0.67 -0.25 -0.06 -2.12 0.00 0.00 175.29 172.28 1nd3 s PHE 189 N -3.93 2.17 -0.39 0.91 0.08 -1.26 -0.66 117.98 114.90 1nd3 s PHE 189 Ca 0.14 -0.39 0.00 0.00 0.12 0.00 0.00 56.93 56.80 1nd3 s PHE 189 Cb -0.02 -1.20 0.11 0.00 -0.57 0.00 0.00 43.02 41.33 1nd3 s PHE 189 CO 0.04 0.27 0.15 0.42 -0.10 0.00 0.00 175.22 175.99 1nd3 s ILE 190 N -1.03 2.86 -0.46 0.64 1.01 0.39 -4.86 121.20 119.75 1nd3 s ILE 190 Ca 0.12 -2.23 -0.14 0.00 0.00 0.00 0.00 60.65 58.39 1nd3 s ILE 190 Cb -0.10 -3.02 0.07 0.00 0.01 0.00 0.00 42.46 39.42 1nd3 s ILE 190 CO 0.05 -0.66 0.36 0.21 0.00 0.00 0.00 174.94 174.90 1nd3 s ASN 191 N 1.36 6.06 0.51 3.58 2.47 -1.26 -1.00 114.94 126.66 1nd3 s ASN 191 Ca 0.10 -1.30 0.41 0.00 0.42 0.00 0.00 52.86 52.49 1nd3 s ASN 191 Cb -0.21 -2.15 1.60 0.00 -1.45 0.00 0.00 41.25 39.03 1nd3 s ASN 191 CO -0.06 -0.60 1.62 -0.07 -3.72 0.00 0.00 177.10 174.27 1nd3 h LEU 192 N 8.68 0.10 -0.08 3.21 3.38 -1.46 0.60 115.31 129.74 1nd3 h LEU 192 Ca -0.27 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1nd3 h LEU 192 Cb 1.11 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1nd3 h LEU 192 CO 0.84 -0.08 0.00 -2.11 0.09 0.00 0.00 178.44 177.18 1nd3 n ARG 193 N -4.28 0.11 -0.03 1.13 1.85 -1.26 -4.36 116.66 109.82 1nd3 n ARG 193 Ca 0.40 0.16 -0.06 0.00 -1.00 0.00 0.00 57.85 57.34 1nd3 n ARG 193 Cb 1.70 -1.64 -0.02 0.00 -1.05 0.00 0.00 32.46 31.45 1nd3 n ARG 193 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1nd3 n SER 194 N -1.83 0.60 -4.19 2.89 7.64 0.20 -5.10 113.62 113.83 1nd3 n SER 194 Ca 0.05 0.10 -0.12 0.00 1.01 0.00 0.00 58.87 59.92 1nd3 n SER 194 Cb 0.33 -0.23 -0.10 0.00 -1.01 0.00 0.00 64.21 63.20 1nd3 n SER 194 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1nd3 s ASN 195 N -5.66 1.16 -0.09 6.43 4.22 -0.75 -4.78 114.94 115.49 1nd3 s ASN 195 Ca -0.09 -1.06 0.13 0.00 -2.14 0.00 0.00 52.86 49.69 1nd3 s ASN 195 Cb 0.03 0.10 0.19 0.00 1.28 0.00 0.00 41.25 42.86 1nd3 s ASN 195 CO 0.11 -0.50 1.10 -0.46 -2.04 0.00 0.00 177.10 175.31 1nd3 n ASN 196 N -0.11 2.22 -3.50 3.54 0.23 -0.40 -4.09 115.26 113.15 1nd3 n ASN 196 Ca -0.10 -2.72 -0.09 0.00 -0.53 0.00 0.00 54.58 51.13 1nd3 n ASN 196 Cb 0.62 -0.29 -0.02 0.00 -2.08 0.00 0.00 39.78 38.01 1nd3 n ASN 196 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1nd3 s SER 197 N -2.25 -0.41 0.02 0.53 1.04 -1.25 -1.02 113.70 110.36 1nd3 s SER 197 Ca 0.21 -0.05 0.03 0.00 0.48 0.00 0.00 55.95 56.63 1nd3 s SER 197 Cb 0.19 0.47 -0.02 0.00 0.10 0.00 0.00 66.02 66.76 1nd3 s SER 197 CO 0.02 -0.77 -0.10 0.00 0.98 0.00 0.00 173.24 173.36 1nd3 s ALA 198 N -3.36 0.85 -0.09 5.32 0.00 -0.22 -4.40 121.76 119.87 1nd3 s ALA 198 Ca 0.04 -0.63 -0.01 0.00 0.00 0.00 0.00 51.96 51.36 1nd3 s ALA 198 Cb -0.01 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 23.01 1nd3 s ALA 198 CO -0.09 0.15 -0.02 0.99 0.00 0.00 0.00 175.76 176.79 1nd3 s THR 199 N -0.71 0.59 -0.08 0.00 2.01 -1.26 -1.20 115.64 114.98 1nd3 s THR 199 Ca -0.00 -0.04 0.03 0.00 0.31 0.00 0.00 61.69 61.98 1nd3 s THR 199 Cb -0.06 -0.72 0.01 0.00 0.01 0.00 0.00 72.50 71.73 1nd3 s THR 199 CO 0.00 0.27 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.26 1nd3 s LEU 200 N 1.88 1.85 -0.26 4.42 1.02 -0.03 -1.42 118.68 126.15 1nd3 s LEU 200 Ca 0.05 -0.43 -0.02 0.00 0.02 0.00 0.00 54.13 53.75 1nd3 s LEU 200 Cb -0.13 -1.11 0.03 0.00 0.02 0.00 0.00 46.19 45.00 1nd3 s LEU 200 CO -0.06 0.09 -0.05 -0.63 0.02 0.00 0.00 176.35 175.72 1nd3 s ILE 201 N 0.54 2.89 0.00 -0.59 1.01 0.11 0.24 121.20 125.40 1nd3 s ILE 201 Ca -0.16 -1.10 0.07 0.00 0.00 0.00 0.00 60.65 59.46 1nd3 s ILE 201 Cb -0.17 -2.51 -0.03 0.00 0.01 0.00 0.00 42.46 39.77 1nd3 s ILE 201 CO 0.06 0.14 -0.21 0.68 0.00 0.00 0.00 174.94 175.60 1nd3 s VAL 202 N 1.31 2.51 0.81 2.92 -7.23 0.04 -0.20 120.40 120.55 1nd3 s VAL 202 Ca -0.01 -1.09 -0.08 0.00 -1.81 0.00 0.00 61.98 58.99 1nd3 s VAL 202 Cb -0.17 -1.97 0.14 0.00 0.56 0.00 0.00 36.38 34.94 1nd3 s VAL 202 CO -0.04 0.48 1.12 -2.16 -0.31 0.00 0.00 175.10 174.19 1nd3 s PRO 203 N -0.98 1.38 0.03 4.82 0.04 -1.25 -1.00 135.00 138.02 1nd3 s PRO 203 Ca 0.12 -0.70 -0.30 0.00 0.04 0.00 0.00 61.00 60.16 1nd3 s PRO 203 Cb -0.10 -2.12 -0.05 0.00 0.04 0.00 0.00 34.50 32.27 1nd3 s PRO 203 CO 0.02 -1.78 1.21 -0.47 0.04 0.00 0.00 177.00 176.02 1nd3 s TYR 204 N -3.44 3.33 -0.13 0.56 5.04 -1.26 -4.78 117.35 116.67 1nd3 s TYR 204 Ca 0.68 1.25 -0.00 0.00 -2.44 0.00 0.00 57.07 56.56 1nd3 s TYR 204 Cb -0.06 -3.44 0.03 0.00 0.35 0.00 0.00 41.96 38.84 1nd3 s TYR 204 CO 0.48 -1.36 -0.10 0.08 -1.34 0.00 0.00 175.55 173.31 1nd3 s VAL 205 N 1.45 1.24 -0.07 3.14 1.01 -1.26 -5.07 120.40 120.84 1nd3 s VAL 205 Ca 0.58 -0.46 -0.31 0.00 0.00 0.00 0.00 61.98 61.79 1nd3 s VAL 205 Cb -0.28 -1.24 0.12 0.00 0.00 0.00 0.00 36.38 34.98 1nd3 s VAL 205 CO 0.27 0.37 1.08 0.21 0.00 0.00 0.00 175.10 177.03 1nd3 s ASN 206 N 1.62 -0.21 0.00 3.32 3.84 -1.26 -4.95 114.94 117.29 1nd3 s ASN 206 Ca 0.04 -0.05 0.29 0.00 0.21 0.00 0.00 52.86 53.36 1nd3 s ASN 206 Cb -0.13 0.26 1.38 0.00 -0.55 0.00 0.00 41.25 42.21 1nd3 s ASN 206 CO -0.09 -0.44 1.93 0.00 -2.79 0.00 0.00 177.10 175.71 1nd3 n ALA 207 N -0.22 2.67 -2.73 1.71 0.00 -1.26 -4.79 120.51 115.88 1nd3 n ALA 207 Ca -0.04 -0.32 -0.18 0.00 0.00 0.00 0.00 53.44 52.90 1nd3 n ALA 207 Cb 0.60 -1.32 -0.12 0.00 0.00 0.00 0.00 19.45 18.61 1nd3 n ALA 207 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1nd3 s VAL 208 N -2.10 0.98 0.50 0.00 -7.23 -1.26 -5.07 120.40 106.22 1nd3 s VAL 208 Ca 0.39 -1.18 0.19 0.00 -1.81 0.00 0.00 61.98 59.57 1nd3 s VAL 208 Cb 0.21 -0.95 0.26 0.00 0.56 0.00 0.00 36.38 36.46 1nd3 s VAL 208 CO 0.38 -0.21 2.11 1.55 -0.31 0.00 0.00 175.10 178.62 1nd3 h PRO 209 N 4.49 0.00 -3.75 4.82 0.13 -1.87 -3.44 132.00 132.38 1nd3 h PRO 209 Ca -0.39 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.66 1nd3 h PRO 209 Cb 1.19 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.19 1nd3 h PRO 209 CO 0.41 0.07 -0.31 -1.64 -0.23 0.00 0.00 178.00 176.31 1nd3 s MET 210 N -4.77 0.94 0.31 0.86 -1.94 -1.26 -4.89 119.30 108.55 1nd3 s MET 210 Ca -0.04 -0.96 -0.11 0.00 -1.71 0.00 0.00 55.69 52.86 1nd3 s MET 210 Cb 0.16 0.37 0.01 0.00 2.01 0.00 0.00 34.83 37.38 1nd3 s MET 210 CO 0.65 -0.32 0.58 0.34 -0.01 0.00 0.00 175.02 176.26 1nd3 s ASP 211 N -2.87 0.20 -0.08 3.03 -1.08 -0.93 -4.92 116.67 110.02 1nd3 s ASP 211 Ca 0.07 -1.10 -0.30 0.00 -0.52 0.00 0.00 52.55 50.70 1nd3 s ASP 211 Cb 0.04 0.69 -0.04 0.00 -1.46 0.00 0.00 42.92 42.15 1nd3 s ASP 211 CO -0.09 -1.34 1.37 -0.55 0.52 0.00 0.00 175.17 175.07 1nd3 s SER 212 N -3.08 6.88 0.43 -0.34 0.15 -1.26 -0.68 113.70 115.80 1nd3 s SER 212 Ca 0.22 1.93 0.29 0.00 0.70 0.00 0.00 55.95 59.08 1nd3 s SER 212 Cb -0.02 -2.55 1.02 0.00 -1.71 0.00 0.00 66.02 62.77 1nd3 s SER 212 CO 0.13 -0.76 1.83 -0.03 1.20 0.00 0.00 173.24 175.61 1nd3 h MET 213 N 8.27 0.00 0.04 5.44 4.05 -1.83 -2.89 114.93 128.02 1nd3 h MET 213 Ca -0.33 0.00 -0.34 0.00 -0.28 0.00 0.00 59.70 58.75 1nd3 h MET 213 Cb 1.15 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.90 1nd3 h MET 213 CO 0.94 0.00 -2.03 0.28 0.23 0.00 0.00 176.91 176.33 1nd3 n VAL 214 N -2.81 1.62 0.99 -5.77 0.31 -1.26 -4.48 118.33 106.92 1nd3 n VAL 214 Ca 0.02 -0.72 0.10 0.00 -0.01 0.00 0.00 64.34 63.73 1nd3 n VAL 214 Cb 0.34 -1.25 -0.08 0.00 -0.91 0.00 0.00 33.84 31.95 1nd3 n VAL 214 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1nd3 n ARG 215 N -3.19 0.51 -4.02 5.55 5.12 -1.24 -4.93 116.66 114.47 1nd3 n ARG 215 Ca -0.29 -0.37 -0.23 0.00 -1.93 0.00 0.00 57.85 55.04 1nd3 n ARG 215 Cb 1.06 -1.48 -0.17 0.00 -1.16 0.00 0.00 32.46 30.71 1nd3 n ARG 215 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1nd3 s HIS 216 N -2.78 0.92 -0.32 -1.55 2.46 -1.09 -5.07 115.29 107.85 1nd3 s HIS 216 Ca 0.12 -0.32 -0.10 0.00 0.47 0.00 0.00 55.06 55.22 1nd3 s HIS 216 Cb 0.17 -0.85 -0.01 0.00 -0.13 0.00 0.00 32.58 31.76 1nd3 s HIS 216 CO 0.75 -0.30 0.17 -0.80 -2.47 0.00 0.00 174.74 172.09 1nd3 s ASN 217 N 1.40 5.65 -0.02 9.88 0.01 -1.26 -4.61 114.94 125.99 1nd3 s ASN 217 Ca -0.03 -0.55 -0.24 0.00 -0.71 0.00 0.00 52.86 51.33 1nd3 s ASN 217 Cb -0.13 -2.03 -0.19 0.00 0.41 0.00 0.00 41.25 39.31 1nd3 s ASN 217 CO -0.03 -0.22 1.22 0.78 -1.51 0.00 0.00 177.10 177.35 1nd3 h ASN 218 N 8.38 0.15 -2.35 -1.22 2.35 -1.59 -3.41 115.58 117.89 1nd3 h ASN 218 Ca -0.31 -0.56 -0.61 0.00 -0.55 0.00 0.00 56.30 54.27 1nd3 h ASN 218 Cb 1.14 -0.04 -0.14 0.00 0.05 0.00 0.00 38.32 39.33 1nd3 h ASN 218 CO 0.62 0.68 -0.75 0.26 -1.65 0.00 0.00 177.43 176.59 1nd3 s TRP 219 N -3.97 2.36 -0.05 1.19 0.52 -1.17 -1.46 118.94 116.36 1nd3 s TRP 219 Ca -0.16 -0.31 0.01 0.00 0.02 0.00 0.00 56.10 55.66 1nd3 s TRP 219 Cb 0.02 -1.05 0.02 0.00 -1.15 0.00 0.00 33.47 31.32 1nd3 s TRP 219 CO 0.71 0.67 -0.05 -1.12 0.02 0.00 0.00 176.95 177.18 1nd3 s SER 220 N -3.41 1.09 -0.29 2.95 0.01 -0.31 -0.48 113.70 113.27 1nd3 s SER 220 Ca 0.29 -0.15 -0.15 0.00 1.31 0.00 0.00 55.95 57.25 1nd3 s SER 220 Cb -0.06 -0.50 -0.03 0.00 0.21 0.00 0.00 66.02 65.64 1nd3 s SER 220 CO 0.15 -0.05 0.36 -0.22 0.41 0.00 0.00 173.24 173.89 1nd3 s LEU 221 N 0.95 4.14 -0.12 2.44 2.96 0.88 -0.98 118.68 128.94 1nd3 s LEU 221 Ca -0.10 0.13 0.03 0.00 -0.22 0.00 0.00 54.13 53.96 1nd3 s LEU 221 Cb -0.14 -2.39 0.00 0.00 0.50 0.00 0.00 46.19 44.16 1nd3 s LEU 221 CO 0.00 -0.22 -0.21 -0.69 -1.32 0.00 0.00 176.35 173.91 1nd3 s VAL 222 N 2.05 2.25 -0.23 1.68 1.01 0.12 -1.01 120.40 126.28 1nd3 s VAL 222 Ca 0.14 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.20 1nd3 s VAL 222 Cb -0.16 -1.89 0.05 0.00 0.00 0.00 0.00 36.38 34.38 1nd3 s VAL 222 CO 0.11 0.55 -0.10 -0.63 0.00 0.00 0.00 175.10 175.03 1nd3 s ILE 223 N 0.52 1.85 -0.13 2.22 1.01 0.03 -0.88 121.20 125.81 1nd3 s ILE 223 Ca -0.13 -1.32 0.03 0.00 0.00 0.00 0.00 60.65 59.22 1nd3 s ILE 223 Cb -0.17 -1.97 0.01 0.00 0.01 0.00 0.00 42.46 40.33 1nd3 s ILE 223 CO 0.05 0.03 -0.22 -0.63 0.00 0.00 0.00 174.94 174.17 1nd3 s ILE 224 N 1.27 2.11 -0.65 2.92 -1.09 -0.69 -1.05 121.20 124.02 1nd3 s ILE 224 Ca -0.05 -0.97 -0.27 0.00 -2.23 0.00 0.00 60.65 57.12 1nd3 s ILE 224 Cb -0.18 -1.84 0.03 0.00 -1.58 0.00 0.00 42.46 38.89 1nd3 s ILE 224 CO -0.07 0.55 1.21 -2.16 -1.23 0.00 0.00 174.94 173.24 1nd3 s PRO 225 N 0.69 3.35 0.40 2.79 0.04 -1.26 -0.69 135.00 140.32 1nd3 s PRO 225 Ca -0.10 -0.02 0.21 0.00 0.04 0.00 0.00 61.00 61.13 1nd3 s PRO 225 Cb -0.16 -4.09 0.30 0.00 0.04 0.00 0.00 34.50 30.59 1nd3 s PRO 225 CO 0.01 -1.88 1.58 -0.39 0.04 0.00 0.00 177.00 176.36 1nd3 h VAL 226 N 6.09 0.25 -3.31 -0.36 -1.51 -1.55 -3.42 116.25 112.43 1nd3 h VAL 226 Ca -0.26 -1.32 -0.55 0.00 -1.23 0.00 0.00 66.70 63.33 1nd3 h VAL 226 Cb 1.05 2.10 -0.38 0.00 -2.13 0.00 0.00 31.29 31.94 1nd3 h VAL 226 CO 1.22 0.14 -0.79 0.00 -1.23 0.00 0.00 177.57 176.91 1nd3 n GLN 228 N 4.88 1.23 -2.32 0.00 7.27 -1.26 -1.60 117.38 125.59 1nd3 n GLN 228 Ca -0.12 0.43 -0.43 0.00 0.07 0.00 0.00 57.00 56.96 1nd3 n GLN 228 Cb 0.48 -1.84 -0.02 0.00 2.41 0.00 0.00 30.24 31.27 1nd3 n GLN 228 CO 0.00 0.00 0.00 -1.17 0.07 0.00 0.00 177.06 175.96 1nd3 s LEU 229 N 0.66 4.22 0.04 1.69 2.96 -1.26 -4.22 118.68 122.77 1nd3 s LEU 229 Ca 0.64 1.84 0.03 0.00 -0.22 0.00 0.00 54.13 56.42 1nd3 s LEU 229 Cb -0.77 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 42.36 1nd3 s LEU 229 CO 0.57 -0.80 -0.09 -1.10 -1.32 0.00 0.00 176.35 173.61 1nd3 s GLN 230 N 3.59 0.57 0.03 1.98 -0.21 -0.22 -4.32 119.66 121.07 1nd3 s GLN 230 Ca 0.60 -0.76 -0.28 0.00 0.02 0.00 0.00 55.36 54.93 1nd3 s GLN 230 Cb -0.25 -0.37 0.10 0.00 1.00 0.00 0.00 33.01 33.49 1nd3 s GLN 230 CO 0.19 0.07 1.22 -1.54 -2.12 0.00 0.00 175.29 173.11 1nd3 s SER 231 N -1.54 -0.04 -0.34 5.90 1.04 -1.26 -1.47 113.70 115.99 1nd3 s SER 231 Ca -0.08 -0.26 0.08 0.00 0.48 0.00 0.00 55.95 56.16 1nd3 s SER 231 Cb -0.10 0.24 0.57 0.00 0.10 0.00 0.00 66.02 66.83 1nd3 s SER 231 CO 0.01 -0.45 1.63 0.59 0.98 0.00 0.00 173.24 175.99 1nd3 n ASN 232 N -0.79 3.07 -2.90 7.02 5.03 -1.26 -4.47 115.26 120.96 1nd3 n ASN 232 Ca -0.04 -3.66 -0.12 0.00 0.87 0.00 0.00 54.58 51.63 1nd3 n ASN 232 Cb 0.61 -0.70 0.04 0.00 -1.02 0.00 0.00 39.78 38.70 1nd3 n ASN 232 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1nd3 n ASN 233 N -1.05 -0.60 0.28 6.41 5.15 -1.26 -5.00 115.26 119.19 1nd3 n ASN 233 Ca 0.42 -3.19 0.16 0.00 -0.60 0.00 0.00 54.58 51.37 1nd3 n ASN 233 Cb 1.25 0.54 0.82 0.00 -0.53 0.00 0.00 39.78 41.86 1nd3 n ASN 233 CO 0.00 0.00 0.00 0.16 1.40 0.00 0.00 177.26 178.82 1nd3 h ILE 234 N 2.09 0.32 0.00 -1.44 3.07 -2.00 -2.76 117.51 116.79 1nd3 h ILE 234 Ca -0.04 -0.43 -0.01 0.00 1.55 0.00 0.00 64.86 65.94 1nd3 h ILE 234 Cb 1.08 1.32 -0.00 0.00 -0.27 0.00 0.00 36.82 38.94 1nd3 h ILE 234 CO 0.30 0.07 -0.03 0.77 -1.05 0.00 0.00 178.15 178.21 1nd3 h SER 235 N 0.00 0.00 -3.58 2.16 4.64 -1.98 -3.39 113.55 111.39 1nd3 h SER 235 Ca -0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 1nd3 h SER 235 Cb 0.31 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.33 1nd3 h SER 235 CO 0.01 0.03 0.96 0.21 -0.87 0.00 0.00 176.83 177.16 1nd3 s ASN 236 N -5.60 6.56 0.22 4.97 3.04 -1.04 -4.98 114.94 118.10 1nd3 s ASN 236 Ca -0.03 0.44 -0.31 0.00 0.04 0.00 0.00 52.86 53.01 1nd3 s ASN 236 Cb 0.12 -2.55 -0.10 0.00 -1.54 0.00 0.00 41.25 37.18 1nd3 s ASN 236 CO 0.49 -1.32 1.50 -0.63 -3.04 0.00 0.00 177.10 174.10 1nd3 s ILE 237 N 4.67 2.62 -0.42 -5.21 1.01 -1.26 -4.99 121.20 117.62 1nd3 s ILE 237 Ca 0.49 0.49 -0.02 0.00 0.00 0.00 0.00 60.65 61.60 1nd3 s ILE 237 Cb -0.08 -3.31 0.11 0.00 0.01 0.00 0.00 42.46 39.19 1nd3 s ILE 237 CO 0.31 0.06 0.21 -0.69 0.00 0.00 0.00 174.94 174.83 1nd3 s VAL 238 N 0.47 3.22 0.75 2.92 1.01 -1.26 -5.07 120.40 122.43 1nd3 s VAL 238 Ca 0.64 -2.17 -0.11 0.00 0.00 0.00 0.00 61.98 60.34 1nd3 s VAL 238 Cb -0.43 -3.21 0.04 0.00 0.00 0.00 0.00 36.38 32.78 1nd3 s VAL 238 CO 0.39 -0.70 1.13 -2.84 0.00 0.00 0.00 175.10 173.07 1nd3 s PRO 239 N 1.01 2.45 -0.08 2.72 0.02 -1.26 -1.63 135.00 138.22 1nd3 s PRO 239 Ca 0.09 0.28 0.01 0.00 0.02 0.00 0.00 61.00 61.39 1nd3 s PRO 239 Cb -0.22 -2.00 0.02 0.00 0.02 0.00 0.00 34.50 32.32 1nd3 s PRO 239 CO -0.04 -1.28 -0.08 0.42 -0.33 0.00 0.00 177.00 175.69 1nd3 s ILE 240 N -3.44 0.95 -0.03 2.83 1.01 0.12 -4.55 121.20 118.08 1nd3 s ILE 240 Ca 0.60 -0.30 0.06 0.00 0.00 0.00 0.00 60.65 61.01 1nd3 s ILE 240 Cb -0.11 -0.94 -0.01 0.00 0.01 0.00 0.00 42.46 41.41 1nd3 s ILE 240 CO 0.50 0.34 -0.22 -0.89 0.00 0.00 0.00 174.94 174.66 1nd3 s THR 241 N 1.26 1.79 -0.12 2.92 2.01 -0.07 -1.06 115.64 122.38 1nd3 s THR 241 Ca -0.04 -0.95 0.02 0.00 0.31 0.00 0.00 61.69 61.03 1nd3 s THR 241 Cb -0.14 -1.50 -0.01 0.00 0.01 0.00 0.00 72.50 70.86 1nd3 s THR 241 CO -0.03 0.51 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.54 1nd3 s VAL 242 N -0.34 2.62 -0.12 3.82 1.01 -1.26 0.34 120.40 126.46 1nd3 s VAL 242 Ca 0.03 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.21 1nd3 s VAL 242 Cb -0.10 -2.06 0.02 0.00 0.00 0.00 0.00 36.38 34.23 1nd3 s VAL 242 CO 0.01 0.54 -0.16 -0.44 0.00 0.00 0.00 175.10 175.05 1nd3 s SER 243 N 0.34 2.59 -0.06 3.32 0.01 -0.55 -1.22 113.70 118.13 1nd3 s SER 243 Ca -0.14 -0.47 0.06 0.00 1.31 0.00 0.00 55.95 56.71 1nd3 s SER 243 Cb -0.17 -1.16 -0.01 0.00 0.21 0.00 0.00 66.02 64.90 1nd3 s SER 243 CO 0.07 0.00 -0.24 -0.63 0.41 0.00 0.00 173.24 172.86 1nd3 s ILE 244 N 1.11 1.95 -0.16 1.44 1.01 -0.20 -0.82 121.20 125.52 1nd3 s ILE 244 Ca -0.03 -1.01 0.00 0.00 0.00 0.00 0.00 60.65 59.61 1nd3 s ILE 244 Cb -0.14 -1.65 0.02 0.00 0.01 0.00 0.00 42.46 40.70 1nd3 s ILE 244 CO -0.04 0.54 -0.14 -0.55 0.00 0.00 0.00 174.94 174.75 1nd3 s SER 245 N -0.12 2.80 0.75 3.58 0.15 -0.35 -0.30 113.70 120.21 1nd3 s SER 245 Ca -0.04 -0.54 -0.13 0.00 0.70 0.00 0.00 55.95 55.94 1nd3 s SER 245 Cb -0.13 -1.21 0.05 0.00 -1.71 0.00 0.00 66.02 63.02 1nd3 s SER 245 CO 0.04 -0.06 1.14 -2.84 1.20 0.00 0.00 173.24 172.72 1nd3 s PRO 246 N 1.46 2.15 -0.02 5.44 0.02 -1.25 -1.09 135.00 141.70 1nd3 s PRO 246 Ca 0.04 1.50 0.01 0.00 0.02 0.00 0.00 61.00 62.57 1nd3 s PRO 246 Cb -0.13 -1.86 0.02 0.00 0.02 0.00 0.00 34.50 32.55 1nd3 s PRO 246 CO -0.11 -1.77 -0.01 -1.64 -0.33 0.00 0.00 177.00 173.14 1nd3 s MET 247 N -4.30 0.33 -1.49 5.54 -1.94 0.21 -4.13 119.30 113.52 1nd3 s MET 247 Ca 0.68 0.01 -0.12 0.00 -1.71 0.00 0.00 55.69 54.55 1nd3 s MET 247 Cb -0.23 -0.44 0.07 0.00 2.01 0.00 0.00 34.83 36.23 1nd3 s MET 247 CO 0.49 -0.07 0.97 0.00 -0.01 0.00 0.00 175.02 176.39 1nd3 s ALA 249 N -3.27 3.60 -0.01 0.00 0.00 -1.26 -4.55 121.76 116.27 1nd3 s ALA 249 Ca 0.62 1.14 -0.03 0.00 0.00 0.00 0.00 51.96 53.69 1nd3 s ALA 249 Cb -0.30 -3.54 -0.00 0.00 0.00 0.00 0.00 23.12 19.28 1nd3 s ALA 249 CO 0.76 -0.62 0.07 -1.83 0.00 0.00 0.00 175.76 174.14 1nd3 s GLU 250 N 0.86 0.27 0.11 0.00 -1.05 -0.50 -4.20 118.70 114.20 1nd3 s GLU 250 Ca 0.64 -0.25 0.05 0.00 -0.15 0.00 0.00 54.97 55.26 1nd3 s GLU 250 Cb -0.38 0.11 -0.04 0.00 -0.44 0.00 0.00 34.13 33.39 1nd3 s GLU 250 CO 0.32 -0.05 -0.13 -0.06 0.95 0.00 0.00 175.26 176.29 1nd3 s PHE 251 N -0.82 1.30 0.03 4.83 0.08 -0.53 -1.14 117.98 121.73 1nd3 s PHE 251 Ca -0.09 -0.58 -0.11 0.00 0.12 0.00 0.00 56.93 56.27 1nd3 s PHE 251 Cb -0.05 -0.69 0.01 0.00 -0.57 0.00 0.00 43.02 41.72 1nd3 s PHE 251 CO 0.00 0.10 0.24 0.45 -0.10 0.00 0.00 175.22 175.92 1nd3 s SER 252 N -2.42 -0.04 -0.11 1.36 0.15 -0.29 -0.84 113.70 111.51 1nd3 s SER 252 Ca 0.07 -0.26 -0.01 0.00 0.70 0.00 0.00 55.95 56.46 1nd3 s SER 252 Cb -0.05 0.31 -0.01 0.00 -1.71 0.00 0.00 66.02 64.57 1nd3 s SER 252 CO 0.02 -0.56 0.09 0.61 1.20 0.00 0.00 173.24 174.61 1nd3 n GLY 253 N 0.74 0.71 3.77 9.45 0.00 -1.26 -1.23 105.19 117.37 1nd3 n GLY 253 Ca -0.19 -0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 1nd3 n GLY 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nd3 s ALA 254 N -3.04 2.57 0.00 4.61 0.00 -1.26 -1.41 121.76 123.23 1nd3 s ALA 254 Ca 0.05 0.70 0.00 0.00 0.00 0.00 0.00 51.96 52.71 1nd3 s ALA 254 Cb -0.01 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.77 1nd3 s ALA 254 CO 0.07 -1.06 0.00 2.89 0.00 0.00 0.00 175.76 177.67 1nd3 n ARG 255 N -1.88 0.00 -1.16 0.00 1.85 -0.07 -4.94 116.66 110.46 1nd3 n ARG 255 Ca 0.11 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.66 1nd3 n ARG 255 Cb 0.51 0.00 0.14 0.00 -1.05 0.00 0.00 32.46 32.07 1nd3 n ARG 255 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1nd3 s ALA 256 N -1.00 1.47 -0.05 2.89 0.00 -1.26 -4.77 121.76 119.04 1nd3 s ALA 256 Ca 0.00 -0.04 -0.30 0.00 0.00 0.00 0.00 51.96 51.62 1nd3 s ALA 256 Cb 0.00 -3.20 -0.02 0.00 0.00 0.00 0.00 23.12 19.89 1nd3 s ALA 256 CO 0.00 -2.42 1.00 0.21 0.00 0.00 0.00 175.76 174.55 1nd3 s LYS 257 N -4.91 4.49 0.20 0.00 2.20 -1.26 -4.53 119.74 115.93 1nd3 s LYS 257 Ca 0.64 1.42 -0.30 0.00 -0.36 0.00 0.00 55.97 57.37 1nd3 s LYS 257 Cb -0.18 -3.50 -0.08 0.00 -1.51 0.00 0.00 37.83 32.56 1nd3 s LYS 257 CO 0.57 -0.19 1.21 0.99 -0.36 0.00 0.00 175.35 177.57 1nd3 s THR 258 N 1.50 3.50 -0.20 3.43 2.01 -0.13 -4.98 115.64 120.77 1nd3 s THR 258 Ca 0.51 1.28 -0.02 0.00 0.31 0.00 0.00 61.69 63.76 1nd3 s THR 258 Cb -0.20 -3.81 -0.00 0.00 0.01 0.00 0.00 72.50 68.49 1nd3 s THR 258 CO 0.23 0.21 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.60 1nd3 s VAL 259 N -0.14 3.02 0.09 3.82 1.01 -1.26 -4.94 120.40 122.00 1nd3 s VAL 259 Ca 0.53 -0.62 -0.04 0.00 0.00 0.00 0.00 61.98 61.85 1nd3 s VAL 259 Cb -0.33 -2.34 -0.05 0.00 0.00 0.00 0.00 36.38 33.65 1nd3 s VAL 259 CO 0.38 0.46 0.31 -0.69 0.00 0.00 0.00 175.10 175.55 1nd3 s VAL 260 N 1.34 5.25 0.00 2.92 1.01 -1.26 -5.28 120.40 124.38 1nd3 s VAL 260 Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.97 1nd3 s VAL 260 Cb -0.14 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.62 1nd3 s VAL 260 CO -0.05 0.14 0.00 0.00 0.00 0.00 0.00 175.10 175.19