#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1veh s SER 2 N 0.00 -0.00 0.11 1.61 0.15 -1.26 -5.17 113.70 109.14 1veh s SER 2 Ca 0.00 -0.13 0.10 0.00 0.70 0.00 0.00 55.95 56.62 1veh s SER 2 Cb 0.00 0.23 -0.04 0.00 -1.71 0.00 0.00 66.02 64.50 1veh s SER 2 CO 0.00 -0.33 -0.24 -0.94 1.20 0.00 0.00 173.24 172.93 1veh s SER 3 N -1.18 2.95 -0.55 5.45 1.04 -1.26 -4.93 113.70 115.22 1veh s SER 3 Ca -0.13 -0.70 0.00 0.00 0.48 0.00 0.00 55.95 55.60 1veh s SER 3 Cb -0.07 -0.19 0.14 0.00 0.10 0.00 0.00 66.02 66.00 1veh s SER 3 CO 0.01 0.13 0.32 -0.83 0.98 0.00 0.00 173.24 173.86 1veh s GLY 4 N -1.91 2.40 0.00 7.32 0.00 0.13 -4.96 107.32 110.32 1veh s GLY 4 Ca 0.10 -3.16 0.00 0.00 0.00 0.00 0.00 44.72 41.66 1veh s GLY 4 CO 0.05 1.05 0.00 1.44 0.00 0.00 0.00 173.10 175.64 1veh n SER 5 N 3.47 0.00 -4.04 1.64 7.64 -1.26 -3.99 113.62 117.08 1veh n SER 5 Ca 0.06 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.60 1veh n SER 5 Cb 0.36 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.44 1veh n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1veh s SER 6 N -4.00 4.86 1.73 6.43 0.15 -1.26 -5.03 113.70 116.59 1veh s SER 6 Ca 0.00 -2.73 0.00 0.00 0.70 0.00 0.00 55.95 53.92 1veh s SER 6 Cb 0.00 -1.75 0.00 0.00 -1.71 0.00 0.00 66.02 62.56 1veh s SER 6 CO 0.00 -0.34 0.00 0.61 1.20 0.00 0.00 173.24 174.71 1veh n GLY 7 N 3.57 3.34 3.99 9.45 0.00 -1.26 -4.66 105.19 119.62 1veh n GLY 7 Ca 0.05 -0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 1veh n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1veh s SER 8 N -4.00 4.64 -1.04 1.61 0.01 -1.26 0.22 113.70 113.87 1veh s SER 8 Ca 0.00 -0.26 -0.23 0.00 1.31 0.00 0.00 55.95 56.77 1veh s SER 8 Cb 0.00 -0.27 -0.12 0.00 0.21 0.00 0.00 66.02 65.84 1veh s SER 8 CO 0.00 -1.64 1.93 -0.62 0.41 0.00 0.00 173.24 173.31 1veh n GLU 9 N -2.69 1.51 -3.37 12.44 4.71 -1.26 -4.73 120.64 127.25 1veh n GLU 9 Ca 0.13 -2.25 -0.46 0.00 -0.01 0.00 0.00 57.16 54.57 1veh n GLU 9 Cb 0.60 -3.49 -0.02 0.00 -1.01 0.00 0.00 31.44 27.52 1veh n GLU 9 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 1veh s GLU 10 N 6.12 3.64 0.18 3.49 0.41 -1.26 -5.04 118.70 126.25 1veh s GLU 10 Ca 0.66 -2.64 -0.30 0.00 -0.41 0.00 0.00 54.97 52.28 1veh s GLU 10 Cb 0.04 -4.39 -0.08 0.00 -1.78 0.00 0.00 34.13 27.92 1veh s GLU 10 CO 0.14 -1.27 0.94 0.16 -0.49 0.00 0.00 175.26 174.74 1veh s ASP 11 N 1.83 7.58 0.24 -0.19 -4.77 -1.26 -5.06 116.67 115.03 1veh s ASP 11 Ca 0.21 1.87 0.00 0.00 -3.30 0.00 0.00 52.55 51.33 1veh s ASP 11 Cb -0.11 -2.60 0.00 0.00 -1.09 0.00 0.00 42.92 39.13 1veh s ASP 11 CO -0.08 0.07 0.00 -0.67 0.70 0.00 0.00 175.17 175.19 1veh n ASP 12 N 2.01 0.00 0.14 2.11 2.03 -1.26 -4.97 116.55 116.61 1veh n ASP 12 Ca -0.00 -0.91 0.01 0.00 0.52 0.00 0.00 54.79 54.40 1veh n ASP 12 Cb 0.48 0.00 0.14 0.00 -0.72 0.00 0.00 41.12 41.01 1veh n ASP 12 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1veh h GLU 13 N 0.00 0.00 -0.17 -0.67 5.08 -2.00 -3.14 114.58 113.68 1veh h GLU 13 Ca 0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 1veh h GLU 13 Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 1veh h GLU 13 CO 0.00 0.60 -0.61 -0.24 -1.00 0.00 0.00 179.01 177.76 1veh h VAL 14 N 0.00 1.31 0.20 3.13 3.04 -1.98 -2.67 116.25 119.27 1veh h VAL 14 Ca -0.01 -1.84 0.01 0.00 -1.01 0.00 0.00 66.70 63.85 1veh h VAL 14 Cb 1.23 1.96 -0.04 0.00 -2.01 0.00 0.00 31.29 32.43 1veh h VAL 14 CO 0.08 0.58 -0.51 0.58 -1.01 0.00 0.00 177.57 177.28 1veh h VAL 15 N 0.41 0.00 -0.50 1.51 2.07 -1.92 0.32 116.25 118.14 1veh h VAL 15 Ca -0.03 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.64 1veh h VAL 15 Cb 1.23 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1veh h VAL 15 CO 0.13 0.00 0.40 0.00 0.02 0.00 0.00 177.57 178.12 1veh h ALA 16 N -0.65 2.38 0.57 1.67 0.00 -1.61 0.42 119.26 122.03 1veh h ALA 16 Ca -0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1veh h ALA 16 Cb 0.76 0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.60 1veh h ALA 16 CO -0.23 -0.66 -0.27 1.98 0.00 0.00 0.00 179.25 180.06 1veh h MET 17 N 0.00 -0.74 -0.92 0.00 4.05 -0.21 -1.83 114.93 115.29 1veh h MET 17 Ca 0.24 0.05 0.09 0.00 -0.28 0.00 0.00 59.70 59.80 1veh h MET 17 Cb 1.04 0.17 -0.07 0.00 -0.80 0.00 0.00 31.60 31.93 1veh h MET 17 CO -0.00 -0.45 0.56 0.82 0.23 0.00 0.00 176.91 178.07 1veh h ILE 18 N -1.13 0.98 -0.23 1.77 2.04 0.35 -0.67 117.51 120.62 1veh h ILE 18 Ca -0.08 -0.33 0.05 0.00 1.00 0.00 0.00 64.86 65.51 1veh h ILE 18 Cb 0.63 -0.07 -0.05 0.00 -0.74 0.00 0.00 36.82 36.59 1veh h ILE 18 CO 0.13 0.18 -0.12 0.11 0.00 0.00 0.00 178.15 178.45 1veh h LYS 19 N 0.96 -0.09 0.73 2.37 1.57 -0.93 0.33 116.57 121.51 1veh h LYS 19 Ca 0.43 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 59.18 1veh h LYS 19 Cb 0.32 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 1veh h LYS 19 CO -0.22 -0.06 -0.46 0.93 -0.57 0.00 0.00 179.45 179.07 1veh h GLU 20 N -0.09 -1.08 -0.07 3.15 3.07 -0.34 0.19 114.58 119.41 1veh h GLU 20 Ca 0.12 0.07 0.02 0.00 -0.50 0.00 0.00 59.36 59.08 1veh h GLU 20 Cb 0.28 0.24 -0.00 0.00 -0.84 0.00 0.00 28.75 28.43 1veh h GLU 20 CO -0.29 -0.72 0.41 -0.07 -1.40 0.00 0.00 179.01 176.94 1veh h LEU 21 N -1.12 0.00 0.00 1.33 3.38 -0.90 2.59 115.31 120.58 1veh h LEU 21 Ca -0.10 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.64 1veh h LEU 21 Cb 0.90 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.61 1veh h LEU 21 CO 0.09 0.00 -1.23 -0.07 0.09 0.00 0.00 178.44 177.32 1veh h LEU 22 N 0.00 0.00 0.06 1.67 -0.00 0.12 -3.34 115.31 113.82 1veh h LEU 22 Ca 0.03 0.00 -0.33 0.00 -0.00 0.00 0.00 57.88 57.58 1veh h LEU 22 Cb 0.85 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 41.47 1veh h LEU 22 CO -0.00 0.96 -1.90 0.47 -0.00 0.00 0.00 178.44 177.97 1veh n ASP 23 N -3.23 1.44 0.00 -0.43 9.92 0.55 0.18 116.55 124.98 1veh n ASP 23 Ca -0.06 0.28 0.00 0.00 -0.53 0.00 0.00 54.79 54.48 1veh n ASP 23 Cb 0.97 -0.39 0.00 0.00 -0.64 0.00 0.00 41.12 41.06 1veh n ASP 23 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 1veh n THR 24 N -3.24 0.00 -2.77 -3.53 -2.24 0.74 -4.24 114.28 99.01 1veh n THR 24 Ca -0.25 0.79 -0.02 0.00 -2.27 0.00 0.00 64.05 62.29 1veh n THR 24 Cb 1.05 -1.20 0.07 0.00 -2.10 0.00 0.00 70.33 68.16 1veh n THR 24 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1veh n ARG 25 N -0.84 1.52 0.02 -0.78 1.85 -1.26 -4.85 116.66 112.33 1veh n ARG 25 Ca 0.00 -2.88 -0.01 0.00 -1.00 0.00 0.00 57.85 53.97 1veh n ARG 25 Cb 0.00 -1.02 -0.00 0.00 -1.05 0.00 0.00 32.46 30.39 1veh n ARG 25 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 1veh n ILE 26 N -0.71 0.84 0.04 8.89 5.41 -1.21 -4.27 119.36 128.36 1veh n ILE 26 Ca 0.01 0.27 -0.12 0.00 1.00 0.00 0.00 62.75 63.91 1veh n ILE 26 Cb 0.82 -1.48 -0.07 0.00 -0.71 0.00 0.00 39.64 38.20 1veh n ILE 26 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 1veh h ARG 27 N -0.09 -0.02 0.00 0.38 2.43 0.17 0.80 114.38 118.05 1veh h ARG 27 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1veh h ARG 27 Cb 0.09 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1veh h ARG 27 CO 0.00 0.02 0.00 -0.35 -1.51 0.00 0.00 179.97 178.13 1veh n PRO 28 N -5.08 0.20 -0.08 0.20 -0.04 -1.26 -0.60 135.00 128.34 1veh n PRO 28 Ca -0.07 0.09 -0.12 0.00 -0.04 0.00 0.00 63.50 63.36 1veh n PRO 28 Cb 0.05 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 31.87 1veh n PRO 28 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1veh n THR 29 N -1.37 1.48 0.02 0.52 -1.04 -0.64 -3.94 114.28 109.32 1veh n THR 29 Ca 0.09 -0.79 -0.21 0.00 -2.04 0.00 0.00 64.05 61.10 1veh n THR 29 Cb 0.21 -0.83 -0.14 0.00 -1.82 0.00 0.00 70.33 67.75 1veh n THR 29 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1veh h VAL 30 N 0.00 1.10 -0.01 12.58 2.07 0.77 -3.26 116.25 129.50 1veh h VAL 30 Ca -0.49 -2.43 0.00 0.00 0.82 0.00 0.00 66.70 64.60 1veh h VAL 30 Cb 2.13 2.80 -0.00 0.00 -1.52 0.00 0.00 31.29 34.69 1veh h VAL 30 CO 0.03 0.72 0.09 0.06 0.02 0.00 0.00 177.57 178.48 1veh h GLN 31 N -0.28 0.00 0.00 1.57 3.07 -0.73 0.72 115.11 119.46 1veh h GLN 31 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.46 1veh h GLN 31 Cb 1.77 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.33 1veh h GLN 31 CO 0.08 0.00 -0.46 0.39 0.09 0.00 0.00 178.83 178.93 1veh n GLU 32 N -3.15 0.07 -0.01 0.06 1.02 -1.24 -4.32 120.64 113.07 1veh n GLU 32 Ca -0.02 0.02 -0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1veh n GLU 32 Cb 0.16 -1.55 -0.00 0.00 -0.02 0.00 0.00 31.44 30.03 1veh n GLU 32 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 1veh h ASP 33 N 0.00 0.00 0.00 1.62 1.82 0.40 -3.50 116.42 116.76 1veh h ASP 33 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1veh h ASP 33 Cb 0.56 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.57 1veh h ASP 33 CO 0.00 0.06 0.00 0.61 -1.61 0.00 0.00 179.24 178.30 1veh n GLY 34 N 1.82 -1.80 0.00 -0.78 0.00 -0.95 -5.12 105.19 98.36 1veh n GLY 34 Ca -0.00 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.43 1veh n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1veh n GLY 35 N -1.47 0.29 3.16 -0.02 0.00 -1.24 -4.84 105.19 101.07 1veh n GLY 35 Ca 0.00 -1.86 -0.15 0.00 0.00 0.00 0.00 46.02 44.01 1veh n GLY 35 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1veh s ASP 36 N -1.00 1.41 -0.30 1.61 1.01 -1.13 -2.94 116.67 115.33 1veh s ASP 36 Ca 0.00 -0.77 0.03 0.00 0.71 0.00 0.00 52.55 52.52 1veh s ASP 36 Cb 0.00 0.01 0.08 0.00 1.01 0.00 0.00 42.92 44.02 1veh s ASP 36 CO 0.00 -0.24 -0.02 -0.69 0.21 0.00 0.00 175.17 174.43 1veh s VAL 37 N -2.23 2.13 -0.29 -1.27 1.01 -1.26 -3.39 120.40 115.10 1veh s VAL 37 Ca 0.03 -1.96 -0.03 0.00 0.00 0.00 0.00 61.98 60.02 1veh s VAL 37 Cb -0.04 -2.43 0.04 0.00 0.00 0.00 0.00 36.38 33.94 1veh s VAL 37 CO 0.00 -0.35 0.01 -0.63 0.00 0.00 0.00 175.10 174.14 1veh s ILE 38 N 1.04 3.22 -0.59 2.22 1.09 -1.26 -4.73 121.20 122.20 1veh s ILE 38 Ca 0.02 -1.17 -0.28 0.00 -1.10 0.00 0.00 60.65 58.12 1veh s ILE 38 Cb -0.19 -2.77 0.01 0.00 -1.06 0.00 0.00 42.46 38.44 1veh s ILE 38 CO -0.07 -0.03 1.46 -0.47 -0.10 0.00 0.00 174.94 175.73 1veh s TYR 39 N 1.33 2.20 -0.43 3.97 5.04 -1.26 -0.73 117.35 127.47 1veh s TYR 39 Ca -0.02 0.44 0.02 0.00 -2.44 0.00 0.00 57.07 55.07 1veh s TYR 39 Cb -0.19 -4.38 0.13 0.00 0.35 0.00 0.00 41.96 37.87 1veh s TYR 39 CO -0.01 -2.05 0.21 1.03 -1.34 0.00 0.00 175.55 173.39 1veh s ARG 40 N 5.73 1.33 0.00 4.97 1.81 0.52 -4.96 118.95 128.34 1veh s ARG 40 Ca 0.52 -1.97 0.00 0.00 -1.72 0.00 0.00 55.73 52.56 1veh s ARG 40 Cb -0.11 -2.51 0.00 0.00 -0.45 0.00 0.00 34.95 31.89 1veh s ARG 40 CO 0.23 -1.11 0.00 0.41 -0.68 0.00 0.00 175.30 174.15 1veh n GLY 41 N 3.70 3.12 2.68 -3.53 0.00 -1.26 -4.56 105.19 105.34 1veh n GLY 41 Ca 0.06 -1.44 -0.22 0.00 0.00 0.00 0.00 46.02 44.43 1veh n GLY 41 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1veh s PHE 42 N -0.48 -0.06 0.03 1.61 5.36 -1.26 -0.31 117.98 122.87 1veh s PHE 42 Ca 0.00 -0.12 0.02 0.00 -0.96 0.00 0.00 56.93 55.87 1veh s PHE 42 Cb 0.00 -0.54 -0.02 0.00 -0.34 0.00 0.00 43.02 42.12 1veh s PHE 42 CO 0.00 -0.62 -0.07 -2.00 -1.46 0.00 0.00 175.22 171.07 1veh s GLU 43 N 2.24 0.49 -0.04 10.12 2.12 -1.15 -4.78 118.70 127.70 1veh s GLU 43 Ca 0.06 -0.63 0.00 0.00 0.36 0.00 0.00 54.97 54.76 1veh s GLU 43 Cb -0.16 -0.30 0.00 0.00 0.26 0.00 0.00 34.13 33.93 1veh s GLU 43 CO -0.15 0.06 0.00 -3.47 -0.54 0.00 0.00 175.26 171.16 1veh n ASP 44 N 1.80 -1.07 0.00 -1.70 -0.08 -1.26 0.12 116.55 114.36 1veh n ASP 44 Ca -0.21 0.47 0.00 0.00 -1.51 0.00 0.00 54.79 53.55 1veh n ASP 44 Cb 0.55 -1.06 0.00 0.00 2.34 0.00 0.00 41.12 42.95 1veh n ASP 44 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1veh n GLY 45 N -0.49 1.64 3.48 0.27 0.00 -1.26 -4.57 105.19 104.26 1veh n GLY 45 Ca -0.01 -0.24 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 1veh n GLY 45 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1veh n ILE 46 N 0.00 -0.01 -2.43 -0.61 2.08 0.32 -4.03 119.36 114.68 1veh n ILE 46 Ca 0.00 -0.13 -0.42 0.00 0.56 0.00 0.00 62.75 62.76 1veh n ILE 46 Cb 0.00 -0.89 -0.03 0.00 -0.75 0.00 0.00 39.64 37.97 1veh n ILE 46 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1veh s VAL 47 N 9.13 4.17 -0.45 1.39 1.01 -0.73 -2.93 120.40 131.98 1veh s VAL 47 Ca 1.28 1.52 -0.22 0.00 0.00 0.00 0.00 61.98 64.55 1veh s VAL 47 Cb -1.10 -3.98 0.03 0.00 0.00 0.00 0.00 36.38 31.33 1veh s VAL 47 CO 0.47 0.02 0.75 -0.13 0.00 0.00 0.00 175.10 176.21 1veh s ARG 48 N 2.04 3.36 0.18 2.72 0.52 0.58 -2.22 118.95 126.13 1veh s ARG 48 Ca 0.57 -0.19 0.09 0.00 -0.52 0.00 0.00 55.73 55.68 1veh s ARG 48 Cb -0.26 -3.95 -0.04 0.00 0.52 0.00 0.00 34.95 31.22 1veh s ARG 48 CO 0.24 -1.11 -0.11 -0.51 0.02 0.00 0.00 175.30 173.82 1veh s LEU 49 N 3.19 2.91 -0.92 2.53 2.01 0.49 0.19 118.68 129.07 1veh s LEU 49 Ca 0.28 -0.60 -0.01 0.00 0.01 0.00 0.00 54.13 53.81 1veh s LEU 49 Cb -0.13 -1.61 0.29 0.00 0.01 0.00 0.00 46.19 44.75 1veh s LEU 49 CO 0.21 0.11 1.22 1.17 1.01 0.00 0.00 176.35 180.08 1veh n LYS 50 N 0.10 3.80 -2.51 1.70 4.81 0.09 0.19 118.16 126.33 1veh n LYS 50 Ca -0.11 -4.60 -0.42 0.00 -0.87 0.00 0.00 58.31 52.31 1veh n LYS 50 Cb 0.55 -2.42 -0.03 0.00 0.02 0.00 0.00 35.03 33.15 1veh n LYS 50 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1veh s LEU 51 N -2.69 4.36 -0.29 3.14 1.43 -1.23 -4.08 118.68 119.32 1veh s LEU 51 Ca 0.34 1.89 -0.09 0.00 -1.03 0.00 0.00 54.13 55.24 1veh s LEU 51 Cb 0.08 -3.57 0.13 0.00 0.03 0.00 0.00 46.19 42.86 1veh s LEU 51 CO 0.07 -0.43 0.63 -1.58 0.23 0.00 0.00 176.35 175.27 1veh s GLN 52 N 1.20 0.56 0.00 1.70 0.74 -1.22 -4.90 119.66 117.74 1veh s GLN 52 Ca 0.56 1.37 0.00 0.00 0.05 0.00 0.00 55.36 57.35 1veh s GLN 52 Cb -0.26 0.80 0.00 0.00 1.10 0.00 0.00 33.01 34.64 1veh s GLN 52 CO 0.28 -0.26 0.00 0.41 -0.55 0.00 0.00 175.29 175.17 1veh n GLY 53 N 5.44 5.87 0.13 2.59 0.00 -1.26 -2.84 105.19 115.11 1veh n GLY 53 Ca -0.10 -1.62 -0.18 0.00 0.00 0.00 0.00 46.02 44.11 1veh n GLY 53 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1veh n SER 54 N 0.00 1.76 -3.54 1.61 7.64 -1.26 -4.92 113.62 114.90 1veh n SER 54 Ca 0.00 0.17 -0.09 0.00 1.01 0.00 0.00 58.87 59.96 1veh n SER 54 Cb 0.00 -0.53 -0.03 0.00 -1.01 0.00 0.00 64.21 62.64 1veh n SER 54 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1veh h THR 56 N 2.20 0.87 0.00 0.00 1.03 -2.05 -3.47 112.91 111.49 1veh h THR 56 Ca -0.19 -2.24 0.00 0.00 -0.01 0.00 0.00 66.41 63.97 1veh h THR 56 Cb 1.20 2.42 0.00 0.00 -1.07 0.00 0.00 68.15 70.71 1veh h THR 56 CO 0.30 0.50 0.00 -0.24 -0.01 0.00 0.00 175.52 176.06 1veh n SER 57 N -3.22 0.00 -3.53 0.00 2.88 -1.26 -4.61 113.62 103.88 1veh n SER 57 Ca 0.02 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.43 1veh n SER 57 Cb 0.74 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.16 1veh n SER 57 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1veh h PRO 59 N 2.53 0.00 0.63 0.00 0.13 -1.99 -3.11 132.00 130.19 1veh h PRO 59 Ca -0.23 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.87 1veh h PRO 59 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1veh h PRO 59 CO 0.34 0.72 -0.47 0.66 -0.23 0.00 0.00 178.00 179.01 1veh h SER 60 N 0.00 -1.25 -0.87 1.44 4.64 -1.96 1.14 113.55 116.70 1veh h SER 60 Ca -0.01 0.08 0.14 0.00 -0.47 0.00 0.00 61.79 61.54 1veh h SER 60 Cb 1.30 0.39 -0.09 0.00 -0.31 0.00 0.00 62.40 63.69 1veh h SER 60 CO 0.09 -0.68 0.46 -1.28 -0.87 0.00 0.00 176.83 174.56 1veh h SER 61 N -1.06 0.58 0.32 4.97 0.87 -1.93 0.61 113.55 117.91 1veh h SER 61 Ca -0.08 0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.55 1veh h SER 61 Cb 0.88 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 1veh h SER 61 CO 0.03 0.25 -0.15 0.40 -0.53 0.00 0.00 176.83 176.83 1veh h ILE 62 N 0.67 0.71 0.00 2.23 2.04 -1.36 1.52 117.51 123.32 1veh h ILE 62 Ca 0.47 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 66.02 1veh h ILE 62 Cb 0.64 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 1veh h ILE 62 CO -0.35 0.06 0.00 -0.38 0.00 0.00 0.00 178.15 177.48 1veh n ILE 63 N -5.20 1.32 -0.09 -0.67 5.41 0.39 0.20 119.36 120.72 1veh n ILE 63 Ca -0.10 0.50 -0.22 0.00 1.00 0.00 0.00 62.75 63.93 1veh n ILE 63 Cb 0.23 -1.45 -0.12 0.00 -0.71 0.00 0.00 39.64 37.60 1veh n ILE 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1veh n THR 64 N -1.88 1.60 -0.04 1.39 -1.04 0.20 -4.09 114.28 110.41 1veh n THR 64 Ca 0.00 -0.48 -0.03 0.00 -2.04 0.00 0.00 64.05 61.50 1veh n THR 64 Cb 0.08 -1.70 -0.01 0.00 -1.82 0.00 0.00 70.33 66.87 1veh n THR 64 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1veh n LEU 65 N -3.71 1.05 -0.08 -4.42 7.99 0.51 -3.37 117.00 114.97 1veh n LEU 65 Ca -0.41 0.37 -0.06 0.00 -0.01 0.00 0.00 56.01 55.90 1veh n LEU 65 Cb 0.94 -0.69 -0.04 0.00 -0.11 0.00 0.00 43.42 43.52 1veh n LEU 65 CO 0.26 -0.45 0.50 0.50 -1.51 0.00 0.00 177.39 176.69 1veh h LYS 66 N -0.56 -0.15 -0.46 3.23 1.63 0.21 0.80 116.57 121.26 1veh h LYS 66 Ca 0.00 0.01 0.09 0.00 -0.85 0.00 0.00 60.65 59.90 1veh h LYS 66 Cb 0.38 0.03 -0.10 0.00 -0.60 0.00 0.00 32.23 31.95 1veh h LYS 66 CO 0.00 -0.10 -0.28 1.03 -3.45 0.00 0.00 179.45 176.65 1veh h SER 67 N -0.15 -0.95 -1.14 4.20 0.87 -1.33 0.46 113.55 115.51 1veh h SER 67 Ca 0.04 0.19 0.35 0.00 -1.23 0.00 0.00 61.79 61.13 1veh h SER 67 Cb 0.25 0.48 -0.12 0.00 -0.44 0.00 0.00 62.40 62.57 1veh h SER 67 CO -0.28 -0.29 0.72 1.23 -0.53 0.00 0.00 176.83 177.68 1veh h GLY 68 N -0.18 1.44 0.64 5.77 0.00 -1.20 0.62 103.07 110.15 1veh h GLY 68 Ca 0.20 -0.18 -0.17 0.00 0.00 0.00 0.00 47.33 47.19 1veh h GLY 68 CO -0.56 -0.32 -0.75 -2.22 0.00 0.00 0.00 176.54 172.68 1veh h ILE 69 N 0.25 1.54 -0.61 2.60 1.08 0.20 -3.12 117.51 119.44 1veh h ILE 69 Ca 0.72 -2.52 0.10 0.00 -0.39 0.00 0.00 64.86 62.76 1veh h ILE 69 Cb 1.97 3.22 -0.08 0.00 -3.07 0.00 0.00 36.82 38.86 1veh h ILE 69 CO -0.41 0.71 0.21 1.56 -0.69 0.00 0.00 178.15 179.53 1veh h GLN 70 N -0.42 0.37 0.57 2.37 7.50 0.39 -2.21 115.11 123.68 1veh h GLN 70 Ca -0.13 -0.02 -0.02 0.00 0.50 0.00 0.00 58.65 58.98 1veh h GLN 70 Cb 1.59 -0.08 -0.02 0.00 0.05 0.00 0.00 27.48 29.02 1veh h GLN 70 CO 0.14 0.24 -0.50 -0.97 -1.50 0.00 0.00 178.83 176.25 1veh h ASN 71 N 0.38 -1.34 -0.98 1.46 -1.24 -0.11 -1.78 115.58 111.97 1veh h ASN 71 Ca 0.31 0.10 0.38 0.00 0.71 0.00 0.00 56.30 57.81 1veh h ASN 71 Cb 0.40 0.43 -0.18 0.00 0.73 0.00 0.00 38.32 39.71 1veh h ASN 71 CO -0.33 -0.69 0.43 0.80 -1.29 0.00 0.00 177.43 176.36 1veh n MET 72 N -5.58 -0.06 0.42 6.67 1.56 -0.88 0.12 117.12 119.37 1veh n MET 72 Ca -0.13 1.37 -0.20 0.00 -0.27 0.00 0.00 57.70 58.48 1veh n MET 72 Cb 0.47 -2.41 -0.10 0.00 2.15 0.00 0.00 33.22 33.33 1veh n MET 72 CO 0.00 0.00 0.00 1.25 -0.73 0.00 0.00 175.97 176.49 1veh h LEU 73 N 0.00 -1.23 -0.02 -0.89 5.85 -0.81 -0.75 115.31 117.46 1veh h LEU 73 Ca 0.79 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 59.58 1veh h LEU 73 Cb 2.01 0.36 -0.00 0.00 0.37 0.00 0.00 40.66 43.40 1veh h LEU 73 CO -0.79 -0.74 0.01 1.56 -0.34 0.00 0.00 178.44 178.14 1veh h GLN 74 N -1.18 0.03 -0.77 1.25 7.50 0.27 0.36 115.11 122.56 1veh h GLN 74 Ca -0.10 -0.00 0.10 0.00 0.50 0.00 0.00 58.65 59.15 1veh h GLN 74 Cb 0.95 -0.01 -0.12 0.00 0.05 0.00 0.00 27.48 28.35 1veh h GLN 74 CO 0.10 0.11 -0.46 0.35 -1.50 0.00 0.00 178.83 177.43 1veh h PHE 75 N -0.05 -1.37 0.20 2.96 3.04 0.10 -2.23 116.94 119.59 1veh h PHE 75 Ca 0.01 0.10 -0.01 0.00 3.98 0.00 0.00 57.97 62.05 1veh h PHE 75 Cb 0.08 0.71 0.00 0.00 2.56 0.00 0.00 35.95 39.30 1veh h PHE 75 CO -0.05 -0.41 -0.10 1.88 -2.02 0.00 0.00 178.31 177.62 1veh h TYR 76 N -0.12 -0.25 -3.48 0.41 0.05 -1.03 -3.41 116.97 109.14 1veh h TYR 76 Ca 0.22 -0.01 -0.72 0.00 0.05 0.00 0.00 58.73 58.27 1veh h TYR 76 Cb 0.54 0.08 -0.21 0.00 1.01 0.00 0.00 36.73 38.15 1veh h TYR 76 CO -0.82 0.15 -0.39 0.42 -1.05 0.00 0.00 178.16 176.47 1veh s ILE 77 N -3.91 5.24 -1.61 -2.88 -1.09 0.12 -4.91 121.20 112.16 1veh s ILE 77 Ca -0.13 -0.67 0.23 0.00 -2.23 0.00 0.00 60.65 57.85 1veh s ILE 77 Cb 0.01 -3.96 0.49 0.00 -1.58 0.00 0.00 42.46 37.42 1veh s ILE 77 CO 0.51 -0.35 1.76 -0.81 -1.23 0.00 0.00 174.94 174.82 1veh n PRO 78 N 5.22 0.46 0.00 2.79 -0.04 -1.14 -3.83 135.00 138.45 1veh n PRO 78 Ca -0.11 0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1veh n PRO 78 Cb 0.47 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 1veh n PRO 78 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1veh n GLU 79 N -1.19 0.00 -0.84 0.54 1.02 -1.26 -4.85 120.64 114.06 1veh n GLU 79 Ca 0.13 0.37 -0.34 0.00 -0.02 0.00 0.00 57.16 57.30 1veh n GLU 79 Cb 0.15 -1.09 0.10 0.00 -0.02 0.00 0.00 31.44 30.58 1veh n GLU 79 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 1veh n VAL 80 N -1.62 0.00 0.09 2.62 3.14 -1.25 -4.67 118.33 116.64 1veh n VAL 80 Ca 0.00 -0.27 0.00 0.00 -2.96 0.00 0.00 64.34 61.11 1veh n VAL 80 Cb 0.00 -0.42 0.00 0.00 -1.06 0.00 0.00 33.84 32.36 1veh n VAL 80 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1veh n GLU 81 N -0.46 0.00 -4.57 1.45 1.02 -1.26 -4.81 120.64 112.01 1veh n GLU 81 Ca 0.03 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.90 1veh n GLU 81 Cb 0.57 -0.19 -0.08 0.00 -0.02 0.00 0.00 31.44 31.72 1veh n GLU 81 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1veh s GLY 82 N -4.69 2.64 0.25 0.62 0.00 -1.26 -4.93 107.32 99.95 1veh s GLY 82 Ca 0.00 -1.18 0.08 0.00 0.00 0.00 0.00 44.72 43.61 1veh s GLY 82 CO 0.00 -1.93 -0.11 -1.34 0.00 0.00 0.00 173.10 169.72 1veh s VAL 83 N -3.12 1.77 -0.17 1.40 -7.23 -1.26 -1.78 120.40 110.00 1veh s VAL 83 Ca 0.21 -2.19 -0.14 0.00 -1.81 0.00 0.00 61.98 58.06 1veh s VAL 83 Cb 0.03 -2.28 0.05 0.00 0.56 0.00 0.00 36.38 34.74 1veh s VAL 83 CO 0.12 -0.42 0.45 -0.70 -0.31 0.00 0.00 175.10 174.24 1veh s GLU 84 N -3.67 0.50 -1.11 4.82 -6.30 -0.94 -4.91 118.70 107.09 1veh s GLU 84 Ca 0.27 0.69 -0.16 0.00 -2.50 0.00 0.00 54.97 53.27 1veh s GLU 84 Cb 0.01 0.19 0.15 0.00 0.00 0.00 0.00 34.13 34.48 1veh s GLU 84 CO 0.10 -0.09 1.33 -1.14 0.02 0.00 0.00 175.26 175.48 1veh s GLN 85 N 0.55 3.91 -0.34 4.30 -0.44 -1.24 -0.38 119.66 126.02 1veh s GLN 85 Ca -0.03 -2.27 -0.36 0.00 -2.50 0.00 0.00 55.36 50.20 1veh s GLN 85 Cb -0.04 -5.02 -0.12 0.00 -1.64 0.00 0.00 33.01 26.19 1veh s GLN 85 CO -0.03 -1.78 2.15 1.33 0.50 0.00 0.00 175.29 177.46 1veh n VAL 86 N 4.96 0.20 -2.47 1.34 0.24 0.51 -4.78 118.33 118.33 1veh n VAL 86 Ca 0.32 -0.23 -0.35 0.00 -2.04 0.00 0.00 64.34 62.04 1veh n VAL 86 Cb 0.45 -1.57 -0.03 0.00 -1.47 0.00 0.00 33.84 31.22 1veh n VAL 86 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1veh s SER 87 N 6.92 6.31 0.00 -1.34 1.04 -1.26 -4.53 113.70 120.84 1veh s SER 87 Ca 1.09 2.03 0.00 0.00 0.48 0.00 0.00 55.95 59.55 1veh s SER 87 Cb -0.89 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 62.65 1veh s SER 87 CO 0.51 -0.81 0.00 0.61 0.98 0.00 0.00 173.24 174.53 1veh n GLY 88 N 0.00 0.60 3.55 7.32 0.00 -1.26 -5.08 105.19 110.33 1veh n GLY 88 Ca 0.09 -0.14 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 1veh n GLY 88 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1veh s PRO 89 N 0.00 2.93 0.11 1.61 0.04 -1.26 -4.94 135.00 133.49 1veh s PRO 89 Ca 0.00 0.08 -0.01 0.00 0.04 0.00 0.00 61.00 61.12 1veh s PRO 89 Cb 0.00 -4.38 -0.04 0.00 0.04 0.00 0.00 34.50 30.12 1veh s PRO 89 CO 0.00 -2.48 0.04 0.45 0.04 0.00 0.00 177.00 175.05 1veh s SER 90 N 5.95 0.36 0.42 6.66 0.15 -1.26 -5.09 113.70 120.89 1veh s SER 90 Ca 0.52 -1.16 0.00 0.00 0.70 0.00 0.00 55.95 56.00 1veh s SER 90 Cb -0.10 0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.49 1veh s SER 90 CO 0.15 -0.70 0.00 -0.24 1.20 0.00 0.00 173.24 173.65 1veh n SER 91 N -0.05 -7.94 0.00 5.45 2.88 -1.26 -5.26 113.62 107.43 1veh n SER 91 Ca -0.07 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.58 1veh n SER 91 Cb 0.63 -4.14 0.00 0.00 -0.75 0.00 0.00 64.21 59.95 1veh n SER 91 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42