#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pm3 s MET 1 N 0.00 0.30 -0.66 -0.41 -2.45 -1.26 -5.11 119.30 109.72 1pm3 s MET 1 Ca 0.00 -0.42 -0.26 0.00 -1.25 0.00 0.00 55.69 53.76 1pm3 s MET 1 Cb 0.00 -0.10 0.04 0.00 1.25 0.00 0.00 34.83 36.02 1pm3 s MET 1 CO 0.00 0.01 1.15 1.03 1.05 0.00 0.00 175.02 178.26 1pm3 s ARG 2 N -0.89 3.28 0.11 4.11 1.81 -1.26 -4.94 118.95 121.16 1pm3 s ARG 2 Ca -0.08 -0.24 -0.35 0.00 -1.72 0.00 0.00 55.73 53.35 1pm3 s ARG 2 Cb -0.06 -4.13 -0.14 0.00 -0.45 0.00 0.00 34.95 30.17 1pm3 s ARG 2 CO -0.00 -1.87 1.56 0.82 -0.68 0.00 0.00 175.30 175.12 1pm3 h ILE 3 N 6.05 0.01 0.28 1.52 5.03 -1.94 0.39 117.51 128.85 1pm3 h ILE 3 Ca -0.27 0.00 -0.01 0.00 -0.12 0.00 0.00 64.86 64.46 1pm3 h ILE 3 Cb 1.06 0.01 0.00 0.00 -3.03 0.00 0.00 36.82 34.86 1pm3 h ILE 3 CO 1.21 0.00 -0.15 0.58 -0.68 0.00 0.00 178.15 179.11 1pm3 h VAL 4 N -0.74 0.00 0.00 1.67 2.07 -1.92 -2.34 116.25 114.98 1pm3 h VAL 4 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1pm3 h VAL 4 Cb 0.76 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1pm3 h VAL 4 CO -0.30 0.00 -0.03 -0.33 0.02 0.00 0.00 177.57 176.93 1pm3 h GLU 5 N -0.39 0.00 0.00 1.57 5.08 -1.91 -3.37 114.58 115.56 1pm3 h GLU 5 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1pm3 h GLU 5 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1pm3 h GLU 5 CO 0.06 0.03 0.00 0.39 -1.00 0.00 0.00 179.01 178.49 1pm3 n GLU 6 N -3.32 0.00 0.00 2.33 1.02 0.13 -4.85 120.64 115.95 1pm3 n GLU 6 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1pm3 n GLU 6 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.58 1pm3 n GLU 6 CO 0.00 0.00 0.00 -0.12 1.18 0.00 0.00 177.13 178.19 1pm3 n MET 7 N -0.92 0.35 -4.12 3.49 1.56 -0.73 -4.54 117.12 112.20 1pm3 n MET 7 Ca 0.00 0.00 -0.16 0.00 -0.27 0.00 0.00 57.70 57.27 1pm3 n MET 7 Cb 0.00 -1.31 -0.15 0.00 2.15 0.00 0.00 33.22 33.92 1pm3 n MET 7 CO 0.00 0.00 0.00 0.08 -0.73 0.00 0.00 175.97 175.32 1pm3 s VAL 8 N 0.43 0.37 0.00 1.12 1.01 -0.90 -4.65 120.40 117.79 1pm3 s VAL 8 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 61.80 1pm3 s VAL 8 Cb 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 36.38 36.05 1pm3 s VAL 8 CO 0.00 0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.82 1pm3 n GLY 9 N 3.08 0.70 3.77 4.51 0.00 -0.32 -4.91 105.19 112.02 1pm3 n GLY 9 Ca -0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 1pm3 n GLY 9 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1pm3 s LYS 10 N -0.11 4.45 0.29 1.61 2.20 -1.26 -4.65 119.74 122.26 1pm3 s LYS 10 Ca 0.00 1.00 -0.28 0.00 -0.36 0.00 0.00 55.97 56.32 1pm3 s LYS 10 Cb 0.00 -3.30 -0.09 0.00 -1.51 0.00 0.00 37.83 32.92 1pm3 s LYS 10 CO 0.00 0.46 1.01 -1.21 -0.36 0.00 0.00 175.35 175.25 1pm3 s GLU 11 N -0.65 4.65 -0.17 4.03 2.02 -1.26 -0.77 118.70 126.55 1pm3 s GLU 11 Ca 0.35 1.59 -0.03 0.00 0.02 0.00 0.00 54.97 56.90 1pm3 s GLU 11 Cb -0.21 -3.09 -0.02 0.00 0.10 0.00 0.00 34.13 30.92 1pm3 s GLU 11 CO 0.23 0.29 -0.06 0.08 0.02 0.00 0.00 175.26 175.82 1pm3 s VAL 12 N -1.29 3.53 -0.06 2.63 1.01 0.36 -1.10 120.40 125.48 1pm3 s VAL 12 Ca 0.46 -0.47 0.01 0.00 0.00 0.00 0.00 61.98 61.98 1pm3 s VAL 12 Cb -0.27 -2.56 -0.03 0.00 0.00 0.00 0.00 36.38 33.53 1pm3 s VAL 12 CO 0.34 0.47 -0.09 -0.76 0.00 0.00 0.00 175.10 175.06 1pm3 s LEU 13 N 0.77 3.06 0.00 3.92 1.43 0.67 -0.83 118.68 127.71 1pm3 s LEU 13 Ca -0.02 -0.07 -0.11 0.00 -1.03 0.00 0.00 54.13 52.90 1pm3 s LEU 13 Cb -0.15 -1.66 0.15 0.00 0.03 0.00 0.00 46.19 44.57 1pm3 s LEU 13 CO 0.02 0.36 0.86 -0.90 0.23 0.00 0.00 176.35 176.91 1pm3 n ASP 14 N 2.26 -0.06 0.06 2.29 5.68 -0.44 -0.54 116.55 125.81 1pm3 n ASP 14 Ca -0.18 -1.29 0.08 0.00 -0.50 0.00 0.00 54.79 52.91 1pm3 n ASP 14 Cb 0.53 -0.66 0.36 0.00 -1.14 0.00 0.00 41.12 40.20 1pm3 n ASP 14 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1pm3 n SER 15 N -3.61 0.27 -1.32 -1.12 3.41 -1.25 -2.37 113.62 107.63 1pm3 n SER 15 Ca 0.11 0.57 0.07 0.00 -0.26 0.00 0.00 58.87 59.36 1pm3 n SER 15 Cb 0.38 -0.63 0.28 0.00 -0.26 0.00 0.00 64.21 63.98 1pm3 n SER 15 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1pm3 n SER 16 N -1.80 3.86 -1.00 4.04 7.64 -1.26 -4.89 113.62 120.21 1pm3 n SER 16 Ca 0.02 -2.40 -0.13 0.00 1.01 0.00 0.00 58.87 57.38 1pm3 n SER 16 Cb 0.17 -0.52 -0.06 0.00 -1.01 0.00 0.00 64.21 62.79 1pm3 n SER 16 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1pm3 n ALA 17 N 0.74 -0.20 -2.47 -0.43 0.00 -1.00 -4.99 120.51 112.17 1pm3 n ALA 17 Ca 0.20 0.21 -0.29 0.00 0.00 0.00 0.00 53.44 53.56 1pm3 n ALA 17 Cb 0.75 -1.61 -0.03 0.00 0.00 0.00 0.00 19.45 18.56 1pm3 n ALA 17 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1pm3 s LYS 18 N -3.01 3.66 -0.31 0.00 2.20 -1.26 -4.89 119.74 116.13 1pm3 s LYS 18 Ca 0.00 0.08 -0.11 0.00 -0.36 0.00 0.00 55.97 55.57 1pm3 s LYS 18 Cb 0.00 -2.61 -0.03 0.00 -1.51 0.00 0.00 37.83 33.68 1pm3 s LYS 18 CO 0.00 0.18 0.20 0.08 -0.36 0.00 0.00 175.35 175.45 1pm3 s VAL 19 N -2.12 5.15 0.11 4.02 1.01 -1.26 -1.32 120.40 125.99 1pm3 s VAL 19 Ca 0.45 -0.09 0.10 0.00 0.00 0.00 0.00 61.98 62.44 1pm3 s VAL 19 Cb -0.11 -3.55 -0.09 0.00 0.00 0.00 0.00 36.38 32.63 1pm3 s VAL 19 CO 0.30 0.12 1.42 0.40 0.00 0.00 0.00 175.10 177.34 1pm3 h ILE 20 N 5.47 1.44 0.00 2.22 2.04 -1.35 -3.49 117.51 123.84 1pm3 h ILE 20 Ca -0.33 -2.77 0.00 0.00 1.00 0.00 0.00 64.86 62.76 1pm3 h ILE 20 Cb 1.17 2.54 0.00 0.00 -0.74 0.00 0.00 36.82 39.79 1pm3 h ILE 20 CO 0.60 0.76 0.00 0.61 0.00 0.00 0.00 178.15 180.12 1pm3 n GLY 21 N 0.99 -0.51 3.71 5.37 0.00 -1.24 -4.84 105.19 108.66 1pm3 n GLY 21 Ca 0.00 -1.38 -0.23 0.00 0.00 0.00 0.00 46.02 44.41 1pm3 n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pm3 s LYS 22 N -2.00 2.30 -0.25 1.61 1.02 -1.14 -0.48 119.74 120.80 1pm3 s LYS 22 Ca 0.00 -1.61 -0.29 0.00 0.02 0.00 0.00 55.97 54.09 1pm3 s LYS 22 Cb 0.00 -2.11 0.01 0.00 -0.52 0.00 0.00 37.83 35.20 1pm3 s LYS 22 CO 0.00 0.10 1.10 0.08 -0.92 0.00 0.00 175.35 175.71 1pm3 s VAL 23 N -2.46 4.54 -0.17 3.17 1.01 0.05 -0.27 120.40 126.27 1pm3 s VAL 23 Ca 0.37 1.83 -0.15 0.00 0.00 0.00 0.00 61.98 64.04 1pm3 s VAL 23 Cb -0.02 -4.28 -0.11 0.00 0.00 0.00 0.00 36.38 31.98 1pm3 s VAL 23 CO 0.22 -0.27 0.02 0.50 0.00 0.00 0.00 175.10 175.57 1pm3 h LYS 24 N 7.85 0.00 0.00 2.72 3.64 -0.43 -0.84 116.57 129.50 1pm3 h LYS 24 Ca -0.21 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1pm3 h LYS 24 Cb 1.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1pm3 h LYS 24 CO 1.00 0.50 0.00 -3.47 -2.27 0.00 0.00 179.45 175.20 1pm3 n ASP 25 N -4.53 0.00 -3.45 4.20 4.64 -0.99 -4.89 116.55 111.53 1pm3 n ASP 25 Ca -0.19 -0.57 -0.18 0.00 -1.38 0.00 0.00 54.79 52.47 1pm3 n ASP 25 Cb 0.47 0.00 -0.11 0.00 -1.04 0.00 0.00 41.12 40.43 1pm3 n ASP 25 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 1pm3 s VAL 26 N -2.40 -0.37 0.25 5.18 1.01 -1.26 -2.30 120.40 120.50 1pm3 s VAL 26 Ca 0.00 -0.27 -0.30 0.00 0.00 0.00 0.00 61.98 61.41 1pm3 s VAL 26 Cb 0.00 -0.81 -0.10 0.00 0.00 0.00 0.00 36.38 35.47 1pm3 s VAL 26 CO 0.00 -0.31 1.39 -1.61 0.00 0.00 0.00 175.10 174.56 1pm3 s GLU 27 N 2.35 4.31 -0.01 2.72 2.02 0.20 -4.96 118.70 125.33 1pm3 s GLU 27 Ca 0.08 2.23 0.07 0.00 0.02 0.00 0.00 54.97 57.37 1pm3 s GLU 27 Cb -0.15 -3.12 -0.02 0.00 0.10 0.00 0.00 34.13 30.94 1pm3 s GLU 27 CO -0.21 -0.35 -0.22 0.08 0.02 0.00 0.00 175.26 174.58 1pm3 s VAL 28 N -0.15 1.76 -0.06 2.63 1.01 -1.26 -2.29 120.40 122.04 1pm3 s VAL 28 Ca 0.57 -0.96 -0.30 0.00 0.00 0.00 0.00 61.98 61.29 1pm3 s VAL 28 Cb -0.40 -1.46 -0.02 0.00 0.00 0.00 0.00 36.38 34.49 1pm3 s VAL 28 CO 0.44 0.49 1.04 -0.62 0.00 0.00 0.00 175.10 176.44 1pm3 s ASP 29 N -0.55 7.24 0.25 3.32 2.15 0.21 -4.91 116.67 124.38 1pm3 s ASP 29 Ca 0.09 1.63 -0.05 0.00 0.43 0.00 0.00 52.55 54.65 1pm3 s ASP 29 Cb -0.09 -2.56 0.31 0.00 -0.30 0.00 0.00 42.92 40.29 1pm3 s ASP 29 CO -0.01 -0.42 1.90 0.16 -0.17 0.00 0.00 175.17 176.64 1pm3 h ILE 30 N 4.97 1.17 0.00 4.11 -0.00 -1.96 -2.12 117.51 123.69 1pm3 h ILE 30 Ca -0.35 -0.43 0.00 0.00 -0.00 0.00 0.00 64.86 64.09 1pm3 h ILE 30 Cb 1.17 -0.18 0.00 0.00 -0.00 0.00 0.00 36.82 37.81 1pm3 h ILE 30 CO 0.83 0.23 0.00 -0.62 -0.00 0.00 0.00 178.15 178.59 1pm3 n GLU 31 N -4.46 0.00 0.00 0.16 -0.58 -1.26 -3.44 120.64 111.06 1pm3 n GLU 31 Ca 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 1pm3 n GLU 31 Cb 0.09 -0.51 0.00 0.00 -0.57 0.00 0.00 31.44 30.45 1pm3 n GLU 31 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1pm3 n SER 32 N -0.01 0.00 -2.07 1.62 3.41 -1.26 -4.72 113.62 110.60 1pm3 n SER 32 Ca 0.00 0.16 -0.15 0.00 -0.26 0.00 0.00 58.87 58.62 1pm3 n SER 32 Cb 0.00 -0.16 -0.03 0.00 -0.26 0.00 0.00 64.21 63.76 1pm3 n SER 32 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1pm3 n GLN 33 N -1.07 -1.80 -4.18 4.33 0.00 -0.80 -4.92 117.38 108.93 1pm3 n GLN 33 Ca 0.00 0.78 -0.24 0.00 -0.00 0.00 0.00 57.00 57.54 1pm3 n GLN 33 Cb 0.09 -5.27 -0.06 0.00 0.00 0.00 0.00 30.24 25.00 1pm3 n GLN 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1pm3 s ALA 34 N -2.57 3.39 0.38 1.69 0.00 -1.17 -4.90 121.76 118.58 1pm3 s ALA 34 Ca 0.00 -1.44 -0.25 0.00 0.00 0.00 0.00 51.96 50.27 1pm3 s ALA 34 Cb 0.00 -1.10 -0.09 0.00 0.00 0.00 0.00 23.12 21.93 1pm3 s ALA 34 CO 0.00 0.34 1.06 0.42 0.00 0.00 0.00 175.76 177.58 1pm3 s ILE 35 N -2.05 3.66 0.00 0.00 1.01 -1.26 0.66 121.20 123.22 1pm3 s ILE 35 Ca 0.31 1.34 0.00 0.00 0.00 0.00 0.00 60.65 62.30 1pm3 s ILE 35 Cb -0.08 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.66 1pm3 s ILE 35 CO 0.22 0.07 0.00 1.21 0.00 0.00 0.00 174.94 176.44 1pm3 n GLU 36 N 0.15 3.59 -3.58 2.79 2.13 -0.97 -4.79 120.64 119.96 1pm3 n GLU 36 Ca 0.04 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.79 1pm3 n GLU 36 Cb 0.49 -0.68 -0.04 0.00 0.27 0.00 0.00 31.44 31.48 1pm3 n GLU 36 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 1pm3 s SER 37 N -0.82 -0.24 -0.11 4.31 1.04 -1.16 -1.77 113.70 114.95 1pm3 s SER 37 Ca 0.00 0.16 -0.05 0.00 0.48 0.00 0.00 55.95 56.54 1pm3 s SER 37 Cb 0.00 0.22 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 1pm3 s SER 37 CO 0.00 -0.29 0.09 -0.76 0.98 0.00 0.00 173.24 173.26 1pm3 s LEU 38 N -1.57 4.08 -0.32 2.42 1.02 0.59 -0.63 118.68 124.28 1pm3 s LEU 38 Ca 0.04 0.35 -0.08 0.00 0.02 0.00 0.00 54.13 54.46 1pm3 s LEU 38 Cb -0.01 -1.98 0.01 0.00 0.02 0.00 0.00 46.19 44.24 1pm3 s LEU 38 CO -0.04 0.40 0.13 0.68 0.02 0.00 0.00 176.35 177.54 1pm3 s VAL 39 N -0.98 4.22 0.37 -1.59 -7.23 -0.97 -0.68 120.40 113.53 1pm3 s VAL 39 Ca 0.14 -0.73 0.03 0.00 -1.81 0.00 0.00 61.98 59.61 1pm3 s VAL 39 Cb -0.12 -3.24 -0.01 0.00 0.56 0.00 0.00 36.38 33.57 1pm3 s VAL 39 CO 0.03 -0.03 0.54 -0.76 -0.31 0.00 0.00 175.10 174.58 1pm3 s LEU 40 N 1.52 3.91 0.03 1.32 1.43 0.28 0.31 118.68 127.49 1pm3 s LEU 40 Ca 0.02 0.15 0.07 0.00 -1.03 0.00 0.00 54.13 53.34 1pm3 s LEU 40 Cb -0.18 -3.03 -0.03 0.00 0.03 0.00 0.00 46.19 42.98 1pm3 s LEU 40 CO 0.04 -0.45 -0.17 -0.83 0.23 0.00 0.00 176.35 175.17 1pm3 s GLY 41 N -4.13 1.58 -0.07 -3.19 0.00 0.63 -1.63 107.32 100.50 1pm3 s GLY 41 Ca 0.44 -1.17 -0.03 0.00 0.00 0.00 0.00 44.72 43.96 1pm3 s GLY 41 CO 0.34 -1.05 -0.05 1.70 0.00 0.00 0.00 173.10 174.04 1pm3 h LYS 42 N 4.58 0.00 0.00 2.90 3.11 -1.63 -3.02 116.57 122.52 1pm3 h LYS 42 Ca -0.48 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.36 1pm3 h LYS 42 Cb 1.16 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.39 1pm3 h LYS 42 CO 0.48 0.00 0.00 0.41 -2.81 0.00 0.00 179.45 177.53 1pm3 n GLY 43 N 1.77 1.31 0.00 5.01 0.00 -1.26 -4.94 105.19 107.08 1pm3 n GLY 43 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1pm3 n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pm3 n GLY 44 N 0.00 -0.37 0.00 -0.02 0.00 -1.26 -5.26 105.19 98.28 1pm3 n GLY 44 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1pm3 n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pm3 n GLY 54 N -0.05 0.00 3.68 -0.02 0.00 -1.26 -5.28 105.19 102.26 1pm3 n GLY 54 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1pm3 n GLY 54 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1pm3 s GLU 55 N 0.00 3.10 -0.13 1.61 2.12 -1.26 -1.62 118.70 122.52 1pm3 s GLU 55 Ca 0.00 -0.39 0.02 0.00 0.36 0.00 0.00 54.97 54.96 1pm3 s GLU 55 Cb 0.00 -2.84 0.01 0.00 0.26 0.00 0.00 34.13 31.56 1pm3 s GLU 55 CO 0.00 0.66 -0.21 0.99 -0.54 0.00 0.00 175.26 176.16 1pm3 s THR 56 N -0.76 1.97 -0.43 -1.70 2.01 -0.64 -4.94 115.64 111.15 1pm3 s THR 56 Ca 0.12 -0.93 -0.14 0.00 0.31 0.00 0.00 61.69 61.05 1pm3 s THR 56 Cb -0.12 -1.74 0.05 0.00 0.01 0.00 0.00 72.50 70.70 1pm3 s THR 56 CO 0.02 0.53 0.32 -0.63 -0.69 0.00 0.00 174.62 174.17 1pm3 s ILE 57 N 0.81 5.00 -0.23 1.82 1.01 -1.26 1.00 121.20 129.35 1pm3 s ILE 57 Ca -0.08 -0.95 -0.06 0.00 0.00 0.00 0.00 60.65 59.56 1pm3 s ILE 57 Cb -0.16 -3.90 -0.03 0.00 0.01 0.00 0.00 42.46 38.39 1pm3 s ILE 57 CO -0.01 -0.43 0.04 -0.69 0.00 0.00 0.00 174.94 173.85 1pm3 s VAL 58 N 1.61 4.14 0.15 2.92 1.01 0.14 -4.94 120.40 125.43 1pm3 s VAL 58 Ca 0.04 -0.24 -0.34 0.00 0.00 0.00 0.00 61.98 61.44 1pm3 s VAL 58 Cb -0.22 -2.90 -0.15 0.00 0.00 0.00 0.00 36.38 33.11 1pm3 s VAL 58 CO 0.07 0.38 1.38 -2.65 0.00 0.00 0.00 175.10 174.28 1pm3 n PRO 59 N 4.60 1.59 0.31 2.72 -0.02 -1.26 -0.30 135.00 142.64 1pm3 n PRO 59 Ca -0.17 0.57 0.20 0.00 -2.02 0.00 0.00 63.50 62.09 1pm3 n PRO 59 Cb 0.52 -2.22 0.97 0.00 -0.02 0.00 0.00 33.50 32.75 1pm3 n PRO 59 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1pm3 h TYR 60 N 4.61 0.00 0.00 6.00 3.20 -1.67 -1.23 116.97 127.87 1pm3 h TYR 60 Ca -0.45 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.42 1pm3 h TYR 60 Cb 1.30 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.57 1pm3 h TYR 60 CO 0.59 0.00 0.00 0.39 -1.64 0.00 0.00 178.16 177.50 1pm3 n GLU 61 N -3.06 0.55 -0.07 1.82 4.71 -1.26 -1.96 120.64 121.36 1pm3 n GLU 61 Ca -0.01 0.01 -0.14 0.00 -0.01 0.00 0.00 57.16 57.00 1pm3 n GLU 61 Cb 0.18 -1.50 -0.14 0.00 -1.01 0.00 0.00 31.44 28.96 1pm3 n GLU 61 CO 0.00 0.00 0.00 -0.12 0.09 0.00 0.00 177.13 177.10 1pm3 n MET 62 N -1.02 0.68 -1.67 3.49 1.56 -0.46 -4.92 117.12 114.77 1pm3 n MET 62 Ca 0.13 0.16 -0.48 0.00 -0.27 0.00 0.00 57.70 57.25 1pm3 n MET 62 Cb 0.07 -1.63 -0.05 0.00 2.15 0.00 0.00 33.22 33.76 1pm3 n MET 62 CO 0.00 0.00 0.00 0.28 -0.73 0.00 0.00 175.97 175.52 1pm3 n VAL 63 N -3.11 0.33 -0.11 1.12 0.31 -0.83 -0.78 118.33 115.27 1pm3 n VAL 63 Ca -0.32 -0.06 -0.23 0.00 -0.01 0.00 0.00 64.34 63.72 1pm3 n VAL 63 Cb 1.07 -1.69 -0.12 0.00 -0.91 0.00 0.00 33.84 32.19 1pm3 n VAL 63 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1pm3 n LYS 64 N 5.24 0.64 -3.90 5.55 4.81 0.40 -4.77 118.16 126.13 1pm3 n LYS 64 Ca 0.20 0.27 -0.10 0.00 -0.87 0.00 0.00 58.31 57.81 1pm3 n LYS 64 Cb 0.28 -1.58 -0.10 0.00 0.02 0.00 0.00 35.03 33.66 1pm3 n LYS 64 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1pm3 s LYS 65 N -2.50 0.47 -0.27 1.64 -0.14 -0.43 -4.97 119.74 113.53 1pm3 s LYS 65 Ca -0.33 -0.49 -0.02 0.00 -1.36 0.00 0.00 55.97 53.77 1pm3 s LYS 65 Cb 0.10 0.19 0.09 0.00 -1.68 0.00 0.00 37.83 36.53 1pm3 s LYS 65 CO 0.59 -0.11 0.08 0.42 -0.76 0.00 0.00 175.35 175.58 1pm3 s ILE 66 N -1.57 0.66 0.00 2.17 1.01 -1.26 -0.46 121.20 121.74 1pm3 s ILE 66 Ca -0.14 -1.08 0.00 0.00 0.00 0.00 0.00 60.65 59.44 1pm3 s ILE 66 Cb -0.07 -1.40 0.00 0.00 0.01 0.00 0.00 42.46 41.00 1pm3 s ILE 66 CO 0.00 -0.55 0.00 0.61 0.00 0.00 0.00 174.94 175.01 1pm3 n GLY 67 N 4.96 3.55 0.18 6.18 0.00 -1.26 -4.97 105.19 113.83 1pm3 n GLY 67 Ca -0.05 -0.39 -0.11 0.00 0.00 0.00 0.00 46.02 45.48 1pm3 n GLY 67 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1pm3 h ASP 68 N 0.00 0.54 -1.79 1.61 3.32 -1.99 -3.44 116.42 114.67 1pm3 h ASP 68 Ca 0.00 -0.31 -0.58 0.00 0.02 0.00 0.00 57.03 56.16 1pm3 h ASP 68 Cb 0.00 -0.15 -0.10 0.00 0.22 0.00 0.00 39.33 39.30 1pm3 h ASP 68 CO 0.00 0.72 -0.57 -0.54 -1.72 0.00 0.00 179.24 177.13 1pm3 s LYS 69 N -4.98 2.13 -0.23 3.56 3.01 -1.26 -4.67 119.74 117.30 1pm3 s LYS 69 Ca -0.13 -1.80 -0.07 0.00 -1.01 0.00 0.00 55.97 52.95 1pm3 s LYS 69 Cb 0.08 -1.93 -0.03 0.00 -1.01 0.00 0.00 37.83 34.95 1pm3 s LYS 69 CO 0.77 0.04 0.06 0.42 0.51 0.00 0.00 175.35 177.14 1pm3 s ILE 70 N -2.56 4.33 -0.27 2.17 1.01 -0.26 -4.40 121.20 121.23 1pm3 s ILE 70 Ca 0.37 -0.17 -0.09 0.00 0.00 0.00 0.00 60.65 60.76 1pm3 s ILE 70 Cb 0.02 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 39.46 1pm3 s ILE 70 CO 0.20 0.37 0.12 -0.76 0.00 0.00 0.00 174.94 174.87 1pm3 s LEU 71 N 1.33 3.74 0.55 2.97 1.43 0.39 -0.24 118.68 128.86 1pm3 s LEU 71 Ca 0.05 -0.25 -0.11 0.00 -1.03 0.00 0.00 54.13 52.79 1pm3 s LEU 71 Cb -0.15 -1.99 -0.05 0.00 0.03 0.00 0.00 46.19 44.04 1pm3 s LEU 71 CO 0.03 -0.08 0.95 -0.76 0.23 0.00 0.00 176.35 176.72 1pm3 s LEU 72 N 1.64 3.44 0.53 1.79 1.43 0.30 0.15 118.68 127.97 1pm3 s LEU 72 Ca 0.06 1.31 -0.05 0.00 -1.03 0.00 0.00 54.13 54.42 1pm3 s LEU 72 Cb -0.16 -4.31 -0.01 0.00 0.03 0.00 0.00 46.19 41.75 1pm3 s LEU 72 CO 0.06 -0.72 0.83 -1.59 0.23 0.00 0.00 176.35 175.17 1pm3 s LYS 73 N -4.78 3.17 1.01 1.70 -2.85 0.04 -3.87 119.74 114.16 1pm3 s LYS 73 Ca 0.54 0.03 -0.16 0.00 -1.00 0.00 0.00 55.97 55.37 1pm3 s LYS 73 Cb -0.11 -2.34 0.21 0.00 -2.06 0.00 0.00 37.83 33.54 1pm3 s LYS 73 CO 0.46 -0.47 1.26 0.20 0.10 0.00 0.00 175.35 176.91 1pm3 s GLY 74 N -4.22 1.72 0.47 0.59 0.00 -1.26 -4.44 107.32 100.19 1pm3 s GLY 74 Ca 0.51 -1.10 0.27 0.00 0.00 0.00 0.00 44.72 44.40 1pm3 s GLY 74 CO 0.44 -0.32 1.84 -0.56 0.00 0.00 0.00 173.10 174.50 1pm3 h PRO 75 N -1.82 0.00 -0.02 2.90 0.13 -2.00 -2.53 132.00 128.65 1pm3 h PRO 75 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1pm3 h PRO 75 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1pm3 h PRO 75 CO 0.39 0.13 -0.29 -0.85 -0.23 0.00 0.00 178.00 177.15 1pm3 n GLU 76 N -3.24 1.64 0.00 0.86 0.00 -1.26 -5.29 120.64 113.35 1pm3 n GLU 76 Ca 0.01 -1.35 0.13 0.00 0.00 0.00 0.00 57.16 55.95 1pm3 n GLU 76 Cb 0.41 -1.47 0.31 0.00 0.00 0.00 0.00 31.44 30.69 1pm3 n GLU 76 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52