#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bqt s PRO 2 N 0.00 3.65 0.00 1.61 0.04 -1.26 -4.43 135.00 134.61 1bqt s PRO 2 Ca 0.00 1.26 0.05 0.00 0.04 0.00 0.00 61.00 62.35 1bqt s PRO 2 Cb 0.00 -2.08 -0.01 0.00 0.04 0.00 0.00 34.50 32.46 1bqt s PRO 2 CO 0.00 -0.54 0.43 -1.91 0.04 0.00 0.00 177.00 175.02 1bqt n GLU 3 N -1.41 2.67 0.00 4.56 2.13 -1.26 -4.68 120.64 122.64 1bqt n GLU 3 Ca 0.09 -0.40 0.00 0.00 0.66 0.00 0.00 57.16 57.51 1bqt n GLU 3 Cb 0.53 -0.91 0.00 0.00 0.27 0.00 0.00 31.44 31.33 1bqt n GLU 3 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1bqt n THR 4 N -0.43 0.00 -3.32 6.31 -2.24 -1.18 -4.83 114.28 108.60 1bqt n THR 4 Ca 0.02 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.82 1bqt n THR 4 Cb 0.11 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.30 1bqt n THR 4 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1bqt s LEU 5 N 0.00 -0.39 0.00 3.22 2.34 -0.58 -4.47 118.68 118.79 1bqt s LEU 5 Ca 0.00 0.54 0.00 0.00 0.06 0.00 0.00 54.13 54.73 1bqt s LEU 5 Cb 0.00 1.45 0.00 0.00 -0.56 0.00 0.00 46.19 47.08 1bqt s LEU 5 CO 0.00 -0.08 0.00 0.00 -1.06 0.00 0.00 176.35 175.21 1bqt n GLY 7 N 0.00 0.48 0.20 0.00 0.00 -1.18 -4.54 105.19 100.14 1bqt n GLY 7 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 1bqt n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bqt h ALA 8 N 0.00 1.00 -0.44 4.61 0.00 -1.90 -2.09 119.26 120.44 1bqt h ALA 8 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.61 1bqt h ALA 8 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 17.66 1bqt h ALA 8 CO 0.00 0.00 0.39 0.39 0.00 0.00 0.00 179.25 180.03 1bqt n GLU 9 N -2.43 1.74 0.00 0.00 1.02 -1.26 -3.67 120.64 116.04 1bqt n GLU 9 Ca -0.01 -1.46 0.00 0.00 -0.02 0.00 0.00 57.16 55.67 1bqt n GLU 9 Cb 0.07 -1.57 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 1bqt n GLU 9 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 1bqt n LEU 10 N 0.40 2.19 0.28 -4.62 -0.00 -0.78 -4.41 117.00 110.06 1bqt n LEU 10 Ca 0.28 0.00 -0.12 0.00 -0.00 0.00 0.00 56.01 56.17 1bqt n LEU 10 Cb 0.59 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.95 1bqt n LEU 10 CO 0.35 0.36 0.31 0.58 -0.00 0.00 0.00 177.39 178.99 1bqt h VAL 11 N 0.00 0.00 0.00 1.47 2.07 -1.76 -2.53 116.25 115.49 1bqt h VAL 11 Ca 0.00 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.10 1bqt h VAL 11 Cb 0.78 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1bqt h VAL 11 CO 0.00 0.00 0.00 0.47 0.02 0.00 0.00 177.57 178.06 1bqt n ASP 12 N -5.25 0.00 -0.06 0.57 9.92 -1.26 -2.62 116.55 117.85 1bqt n ASP 12 Ca -0.10 -0.30 -0.14 0.00 -0.53 0.00 0.00 54.79 53.72 1bqt n ASP 12 Cb 0.31 -0.12 -0.13 0.00 -0.64 0.00 0.00 41.12 40.53 1bqt n ASP 12 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1bqt h ALA 13 N 3.00 -0.00 -0.31 2.24 0.00 -1.71 -3.19 119.26 119.28 1bqt h ALA 13 Ca 0.00 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 1bqt h ALA 13 Cb 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1bqt h ALA 13 CO 0.00 -0.01 0.18 -0.07 0.00 0.00 0.00 179.25 179.35 1bqt h LEU 14 N -0.96 0.37 -3.40 0.00 3.38 -1.21 -0.44 115.31 113.06 1bqt h LEU 14 Ca -0.00 -0.02 -0.36 0.00 0.09 0.00 0.00 57.88 57.59 1bqt h LEU 14 Cb 0.97 -0.09 -0.19 0.00 0.09 0.00 0.00 40.66 41.44 1bqt h LEU 14 CO 0.00 0.29 0.47 0.00 0.09 0.00 0.00 178.44 179.29 1bqt n GLN 15 N -4.46 1.89 0.09 1.13 0.00 -1.20 -3.17 117.38 111.66 1bqt n GLN 15 Ca 0.02 -1.94 0.00 0.00 0.00 0.00 0.00 57.00 55.07 1bqt n GLN 15 Cb 0.09 -1.76 0.00 0.00 0.00 0.00 0.00 30.24 28.57 1bqt n GLN 15 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1bqt n PHE 16 N -0.31 -1.44 0.13 2.61 7.35 -0.22 -4.14 117.46 121.45 1bqt n PHE 16 Ca 0.38 0.25 0.03 0.00 -0.76 0.00 0.00 57.45 57.35 1bqt n PHE 16 Cb 0.97 0.45 0.40 0.00 0.35 0.00 0.00 39.48 41.66 1bqt n PHE 16 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1bqt h VAL 17 N 0.00 1.17 0.00 -2.13 2.07 -1.61 -2.94 116.25 112.81 1bqt h VAL 17 Ca 0.00 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 66.75 1bqt h VAL 17 Cb 0.00 1.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1bqt h VAL 17 CO 0.00 0.24 -0.17 0.00 0.02 0.00 0.00 177.57 177.65 1bqt n GLY 19 N -0.58 -0.06 1.57 0.00 0.00 -1.11 0.78 105.19 105.79 1bqt n GLY 19 Ca 0.06 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.54 1bqt n GLY 19 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1bqt n ASP 20 N 1.32 -2.35 0.00 1.61 -0.08 -1.26 -4.76 116.55 111.02 1bqt n ASP 20 Ca 0.13 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.41 1bqt n ASP 20 Cb 0.02 -0.39 0.00 0.00 2.34 0.00 0.00 41.12 43.08 1bqt n ASP 20 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 1bqt n ARG 21 N -2.78 0.00 -3.25 -0.67 1.85 0.23 -5.11 116.66 106.93 1bqt n ARG 21 Ca 0.00 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.70 1bqt n ARG 21 Cb 0.00 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 31.35 1bqt n ARG 21 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1bqt s GLY 22 N 0.00 -0.14 0.00 2.89 0.00 -0.69 -3.89 107.32 105.49 1bqt s GLY 22 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 44.72 43.67 1bqt s GLY 22 CO 0.00 2.88 0.00 0.69 0.00 0.00 0.00 173.10 176.67 1bqt n PHE 23 N 3.76 0.00 0.00 1.90 3.72 -1.24 -3.58 117.46 122.02 1bqt n PHE 23 Ca 0.16 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.56 1bqt n PHE 23 Cb 0.49 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.03 1bqt n PHE 23 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1bqt n TYR 24 N 0.00 0.00 -2.22 1.38 4.02 -1.26 -4.05 117.16 115.03 1bqt n TYR 24 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.87 1bqt n TYR 24 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.32 1bqt n TYR 24 CO 0.00 0.00 0.00 1.97 -1.01 0.00 0.00 176.86 177.82 1bqt n PHE 25 N 0.00 -1.59 -1.57 -0.72 -1.74 -1.26 -4.55 117.46 106.02 1bqt n PHE 25 Ca 0.00 0.03 0.02 0.00 -0.56 0.00 0.00 57.45 56.94 1bqt n PHE 25 Cb 0.00 -0.85 0.03 0.00 1.52 0.00 0.00 39.48 40.18 1bqt n PHE 25 CO 0.00 0.00 0.00 -1.71 -0.56 0.00 0.00 176.76 174.49 1bqt n ASN 26 N -1.25 0.55 -4.02 5.98 4.05 -1.26 -4.29 115.26 115.01 1bqt n ASN 26 Ca 0.00 -2.06 -0.33 0.00 0.45 0.00 0.00 54.58 52.65 1bqt n ASN 26 Cb 0.41 -0.20 -0.12 0.00 1.23 0.00 0.00 39.78 41.09 1bqt n ASN 26 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 1bqt s LYS 27 N -0.60 2.30 -0.44 1.20 1.02 -1.26 -4.94 119.74 117.02 1bqt s LYS 27 Ca 0.06 -2.61 -0.29 0.00 0.02 0.00 0.00 55.97 53.15 1bqt s LYS 27 Cb 0.05 -3.53 0.01 0.00 -0.52 0.00 0.00 37.83 33.84 1bqt s LYS 27 CO 0.01 -1.15 1.43 -1.25 -0.92 0.00 0.00 175.35 173.46 1bqt s PRO 28 N -0.24 3.50 -0.28 -1.68 0.04 -1.08 -4.79 135.00 130.47 1bqt s PRO 28 Ca 0.17 0.85 -0.13 0.00 0.04 0.00 0.00 61.00 61.93 1bqt s PRO 28 Cb -0.23 -4.05 0.10 0.00 0.04 0.00 0.00 34.50 30.36 1bqt s PRO 28 CO -0.02 -1.66 0.66 0.95 0.04 0.00 0.00 177.00 176.97 1bqt s THR 29 N 5.63 -0.37 0.00 1.26 -4.23 -1.26 -4.96 115.64 111.71 1bqt s THR 29 Ca 0.60 0.01 0.00 0.00 -1.18 0.00 0.00 61.69 61.12 1bqt s THR 29 Cb -0.13 -0.97 0.00 0.00 1.34 0.00 0.00 72.50 72.73 1bqt s THR 29 CO 0.31 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.01 1bqt n GLY 30 N 4.75 1.77 2.74 3.99 0.00 -1.26 -4.96 105.19 112.21 1bqt n GLY 30 Ca -0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 1bqt n GLY 30 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1bqt n TYR 31 N -0.13 -2.92 0.00 1.61 4.02 -1.26 -5.05 117.16 113.43 1bqt n TYR 31 Ca 0.00 -1.35 0.00 0.00 -0.01 0.00 0.00 57.90 56.54 1bqt n TYR 31 Cb 0.00 1.43 0.00 0.00 -0.02 0.00 0.00 39.34 40.75 1bqt n TYR 31 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1bqt n GLY 32 N 2.26 -2.51 3.46 2.72 0.00 -1.26 -4.57 105.19 105.29 1bqt n GLY 32 Ca 0.12 -0.42 -0.45 0.00 0.00 0.00 0.00 46.02 45.27 1bqt n GLY 32 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1bqt n SER 33 N 0.00 1.31 -3.57 1.61 2.88 -1.26 -4.80 113.62 109.79 1bqt n SER 33 Ca 0.00 0.15 0.03 0.00 -1.33 0.00 0.00 58.87 57.71 1bqt n SER 33 Cb 0.00 -1.16 -0.06 0.00 -0.75 0.00 0.00 64.21 62.24 1bqt n SER 33 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1bqt s SER 34 N 8.92 -0.03 -0.28 -3.46 1.04 -1.26 -5.13 113.70 113.49 1bqt s SER 34 Ca 1.18 0.05 -0.28 0.00 0.48 0.00 0.00 55.95 57.38 1bqt s SER 34 Cb -0.93 1.02 0.01 0.00 0.10 0.00 0.00 66.02 66.22 1bqt s SER 34 CO 0.46 -0.01 1.03 -0.44 0.98 0.00 0.00 173.24 175.26 1bqt s SER 35 N 1.18 6.97 -0.07 7.02 0.01 -1.26 -4.46 113.70 123.08 1bqt s SER 35 Ca -0.07 1.14 -0.02 0.00 1.31 0.00 0.00 55.95 58.31 1bqt s SER 35 Cb -0.02 -2.53 0.01 0.00 0.21 0.00 0.00 66.02 63.69 1bqt s SER 35 CO -0.10 -0.77 0.04 0.54 0.41 0.00 0.00 173.24 173.36 1bqt n ARG 36 N 6.59 -1.84 0.00 12.44 1.74 -1.26 -4.99 116.66 129.33 1bqt n ARG 36 Ca 0.11 1.69 0.00 0.00 -0.77 0.00 0.00 57.85 58.88 1bqt n ARG 36 Cb 0.47 -2.20 0.00 0.00 -1.02 0.00 0.00 32.46 29.71 1bqt n ARG 36 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1bqt n ARG 37 N 1.77 0.00 -3.49 5.56 3.00 -1.26 -5.17 116.66 117.08 1bqt n ARG 37 Ca -0.07 0.00 -0.09 0.00 -0.00 0.00 0.00 57.85 57.68 1bqt n ARG 37 Cb 0.27 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 32.71 1bqt n ARG 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1bqt s ALA 38 N 0.00 -1.75 -0.29 5.13 0.00 -1.26 -4.73 121.76 118.86 1bqt s ALA 38 Ca 0.00 0.83 -0.29 0.00 0.00 0.00 0.00 51.96 52.50 1bqt s ALA 38 Cb 0.00 0.57 -0.00 0.00 0.00 0.00 0.00 23.12 23.68 1bqt s ALA 38 CO 0.00 -0.72 1.34 -1.25 0.00 0.00 0.00 175.76 175.13 1bqt s PRO 39 N -3.32 3.89 0.00 0.00 0.04 -1.26 -4.66 135.00 129.69 1bqt s PRO 39 Ca 0.04 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.37 1bqt s PRO 39 Cb -0.01 -3.90 0.00 0.00 0.04 0.00 0.00 34.50 30.63 1bqt s PRO 39 CO -0.10 -1.15 0.00 0.00 0.04 0.00 0.00 177.00 175.79 1bqt n GLN 40 N 7.37 0.00 -1.01 4.56 10.64 -1.26 -2.64 117.38 135.04 1bqt n GLN 40 Ca 0.15 0.00 -0.00 0.00 -1.83 0.00 0.00 57.00 55.32 1bqt n GLN 40 Cb 0.46 0.00 -0.00 0.00 -0.86 0.00 0.00 30.24 29.84 1bqt n GLN 40 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 1bqt n THR 41 N 0.00 0.00 1.00 -0.39 -1.04 -1.26 -4.79 114.28 107.79 1bqt n THR 41 Ca 0.00 0.00 0.09 0.00 -2.04 0.00 0.00 64.05 62.10 1bqt n THR 41 Cb 0.00 -0.78 0.29 0.00 -1.82 0.00 0.00 70.33 68.02 1bqt n THR 41 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1bqt n GLY 42 N 0.00 0.58 0.20 3.41 0.00 -1.26 -3.69 105.19 104.43 1bqt n GLY 42 Ca -0.00 -0.44 0.13 0.00 0.00 0.00 0.00 46.02 45.70 1bqt n GLY 42 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1bqt n ILE 43 N 0.52 0.03 -0.08 -0.61 2.08 -1.26 -3.25 119.36 116.78 1bqt n ILE 43 Ca 0.15 -0.12 -0.10 0.00 0.56 0.00 0.00 62.75 63.24 1bqt n ILE 43 Cb 0.35 -0.07 -0.10 0.00 -0.75 0.00 0.00 39.64 39.06 1bqt n ILE 43 CO 0.00 0.00 0.00 1.33 0.56 0.00 0.00 176.55 178.44 1bqt n VAL 44 N -0.46 1.05 -0.21 1.39 0.24 -1.24 -3.41 118.33 115.69 1bqt n VAL 44 Ca 0.19 -0.52 -0.04 0.00 -2.04 0.00 0.00 64.34 61.94 1bqt n VAL 44 Cb 0.19 -0.90 0.19 0.00 -1.47 0.00 0.00 33.84 31.85 1bqt n VAL 44 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1bqt n ASP 45 N -2.81 3.67 0.00 -1.34 5.75 -1.21 -3.11 116.55 117.51 1bqt n ASP 45 Ca -0.29 -2.72 0.00 0.00 -0.01 0.00 0.00 54.79 51.77 1bqt n ASP 45 Cb 0.92 -0.65 0.00 0.00 -1.03 0.00 0.00 41.12 40.36 1bqt n ASP 45 CO 0.00 0.00 0.00 -1.84 -0.11 0.00 0.00 177.20 175.25 1bqt n GLU 46 N 0.01 0.00 -0.00 0.11 -0.00 -1.20 -4.68 120.64 114.88 1bqt n GLU 46 Ca 0.25 0.00 -0.07 0.00 -0.00 0.00 0.00 57.16 57.34 1bqt n GLU 46 Cb 0.98 -0.44 0.11 0.00 -0.00 0.00 0.00 31.44 32.09 1bqt n GLU 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1bqt n PHE 49 N 0.37 2.37 -1.17 0.00 3.01 -0.65 -1.53 117.46 119.86 1bqt n PHE 49 Ca 0.16 -2.57 -0.06 0.00 1.01 0.00 0.00 57.45 55.98 1bqt n PHE 49 Cb 0.77 -0.25 -0.03 0.00 -0.01 0.00 0.00 39.48 39.96 1bqt n PHE 49 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 1bqt n ARG 50 N -0.50 -0.92 -0.35 -1.08 0.63 -1.25 -4.08 116.66 109.10 1bqt n ARG 50 Ca 0.29 0.60 0.07 0.00 -0.92 0.00 0.00 57.85 57.88 1bqt n ARG 50 Cb 0.82 -4.49 0.11 0.00 0.45 0.00 0.00 32.46 29.35 1bqt n ARG 50 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1bqt n SER 51 N -0.15 1.62 0.01 6.15 2.88 -0.65 -4.69 113.62 118.78 1bqt n SER 51 Ca -0.06 -2.90 0.05 0.00 -1.33 0.00 0.00 58.87 54.63 1bqt n SER 51 Cb 0.32 -0.38 0.22 0.00 -0.75 0.00 0.00 64.21 63.61 1bqt n SER 51 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1bqt n ASP 53 N -1.58 -3.34 -2.23 0.00 -0.08 -1.26 -4.82 116.55 103.24 1bqt n ASP 53 Ca 0.02 0.03 -0.26 0.00 -1.51 0.00 0.00 54.79 53.07 1bqt n ASP 53 Cb 0.10 -0.70 0.16 0.00 2.34 0.00 0.00 41.12 43.02 1bqt n ASP 53 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1bqt n LEU 54 N 1.94 6.86 -0.13 -2.67 4.32 -1.26 -4.23 117.00 121.84 1bqt n LEU 54 Ca -0.01 -3.69 -0.20 0.00 -0.02 0.00 0.00 56.01 52.09 1bqt n LEU 54 Cb 0.68 -0.86 -0.12 0.00 -1.62 0.00 0.00 43.42 41.50 1bqt n LEU 54 CO 0.47 1.12 -1.35 -1.14 -1.22 0.00 0.00 177.39 175.28 1bqt n ARG 55 N -1.07 0.64 0.00 3.23 3.00 -1.26 -4.23 116.66 116.98 1bqt n ARG 55 Ca 0.59 0.17 0.10 0.00 -0.00 0.00 0.00 57.85 58.72 1bqt n ARG 55 Cb 1.47 -1.52 0.53 0.00 0.00 0.00 0.00 32.46 32.93 1bqt n ARG 55 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 1bqt n ARG 56 N -3.41 0.30 0.07 -0.14 0.63 -1.26 -2.10 116.66 110.75 1bqt n ARG 56 Ca -0.47 0.09 -0.01 0.00 -0.92 0.00 0.00 57.85 56.54 1bqt n ARG 56 Cb 0.98 -1.50 -0.06 0.00 0.45 0.00 0.00 32.46 32.33 1bqt n ARG 56 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 1bqt h LEU 57 N 0.00 0.00 -0.94 6.15 -0.00 -1.81 -3.23 115.31 115.48 1bqt h LEU 57 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1bqt h LEU 57 Cb 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.85 1bqt h LEU 57 CO 0.00 0.67 0.00 -1.84 -0.00 0.00 0.00 178.44 177.27 1bqt n GLU 58 N -3.10 0.10 0.03 1.13 -0.00 -0.89 -1.42 120.64 116.48 1bqt n GLU 58 Ca -0.05 0.58 -0.19 0.00 -0.00 0.00 0.00 57.16 57.51 1bqt n GLU 58 Cb 0.85 -1.80 -0.13 0.00 -0.00 0.00 0.00 31.44 30.35 1bqt n GLU 58 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.13 177.65 1bqt h MET 59 N 0.00 0.33 -1.28 3.44 2.86 -1.73 -3.32 114.93 115.23 1bqt h MET 59 Ca 0.00 -0.46 -0.68 0.00 -2.06 0.00 0.00 59.70 56.50 1bqt h MET 59 Cb 0.02 0.16 -0.32 0.00 0.06 0.00 0.00 31.60 31.52 1bqt h MET 59 CO 0.00 1.17 0.52 0.66 1.06 0.00 0.00 176.91 180.33 1bqt n TYR 60 N -4.18 3.11 -1.87 -0.22 4.01 -0.51 -4.80 117.16 112.70 1bqt n TYR 60 Ca -0.12 -2.72 -0.40 0.00 -0.16 0.00 0.00 57.90 54.50 1bqt n TYR 60 Cb 0.75 -1.09 -0.01 0.00 -0.31 0.00 0.00 39.34 38.68 1bqt n TYR 60 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1bqt n ALA 62 N 2.21 -0.63 0.58 0.00 0.00 -1.25 -3.47 120.51 117.95 1bqt n ALA 62 Ca 0.65 0.04 0.12 0.00 0.00 0.00 0.00 53.44 54.24 1bqt n ALA 62 Cb 0.25 -0.19 0.46 0.00 0.00 0.00 0.00 19.45 19.97 1bqt n ALA 62 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1bqt n PRO 63 N -0.96 0.16 -1.14 0.00 -0.04 -1.26 -4.87 135.00 126.88 1bqt n PRO 63 Ca 0.00 0.26 -0.38 0.00 -0.04 0.00 0.00 63.50 63.35 1bqt n PRO 63 Cb 0.06 -1.74 0.03 0.00 -0.04 0.00 0.00 33.50 31.80 1bqt n PRO 63 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1bqt n LEU 64 N -2.03 -4.47 -3.80 1.53 0.00 -1.23 -4.94 117.00 102.07 1bqt n LEU 64 Ca 0.04 0.46 -0.30 0.00 0.00 0.00 0.00 56.01 56.21 1bqt n LEU 64 Cb 0.31 -0.83 -0.14 0.00 0.00 0.00 0.00 43.42 42.76 1bqt n LEU 64 CO 0.24 -5.25 -0.24 -1.59 0.00 0.00 0.00 177.39 170.55 1bqt s LYS 65 N -1.50 1.45 -0.86 1.96 -2.85 -1.26 -4.99 119.74 111.69 1bqt s LYS 65 Ca 0.50 -2.10 -0.25 0.00 -1.00 0.00 0.00 55.97 53.12 1bqt s LYS 65 Cb -0.36 -2.64 0.00 0.00 -2.06 0.00 0.00 37.83 32.78 1bqt s LYS 65 CO 0.73 -1.12 1.65 -1.25 0.10 0.00 0.00 175.35 175.46 1bqt s PRO 66 N 0.30 3.02 -0.12 1.78 0.04 -1.26 -4.91 135.00 133.85 1bqt s PRO 66 Ca 0.16 -0.39 -0.03 0.00 0.04 0.00 0.00 61.00 60.79 1bqt s PRO 66 Cb -0.24 -4.88 0.04 0.00 0.04 0.00 0.00 34.50 29.47 1bqt s PRO 66 CO -0.02 -2.66 0.04 0.00 0.04 0.00 0.00 177.00 174.40 1bqt s ALA 67 N 7.46 0.62 0.18 8.56 0.00 -1.26 -5.13 121.76 132.20 1bqt s ALA 67 Ca 0.55 -0.25 -0.23 0.00 0.00 0.00 0.00 51.96 52.03 1bqt s ALA 67 Cb -0.06 -0.90 0.06 0.00 0.00 0.00 0.00 23.12 22.22 1bqt s ALA 67 CO 0.03 -0.81 0.68 -1.59 0.00 0.00 0.00 175.76 174.07 1bqt s LYS 68 N 2.02 1.39 0.18 0.00 -2.85 -1.26 -5.04 119.74 114.18 1bqt s LYS 68 Ca 0.03 -0.62 -0.13 0.00 -1.00 0.00 0.00 55.97 54.25 1bqt s LYS 68 Cb -0.14 0.57 0.09 0.00 -2.06 0.00 0.00 37.83 36.29 1bqt s LYS 68 CO -0.06 -0.62 1.83 0.66 0.10 0.00 0.00 175.35 177.25 1bqt h SER 69 N 2.00 0.72 0.00 0.03 4.64 -2.05 -3.57 113.55 115.32 1bqt h SER 69 Ca -0.28 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1bqt h SER 69 Cb 1.28 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1bqt h SER 69 CO 0.32 0.56 0.00 0.00 -0.87 0.00 0.00 176.83 176.84