#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qim s VAL 2 N 0.00 1.20 -0.00 1.61 0.11 -1.26 -0.64 120.40 121.41 2qim s VAL 2 Ca 0.00 -0.57 0.02 0.00 -2.93 0.00 0.00 61.98 58.50 2qim s VAL 2 Cb 0.00 -1.06 -0.01 0.00 -1.53 0.00 0.00 36.38 33.79 2qim s VAL 2 CO 0.00 0.36 -0.06 -0.36 -3.33 0.00 0.00 175.10 171.71 2qim s PHE 3 N 0.27 0.54 0.15 1.54 0.08 0.08 -5.00 117.98 115.64 2qim s PHE 3 Ca -0.07 -0.13 0.09 0.00 0.12 0.00 0.00 56.93 56.94 2qim s PHE 3 Cb -0.12 -0.35 -0.04 0.00 -0.57 0.00 0.00 43.02 41.94 2qim s PHE 3 CO 0.02 -0.01 -0.20 0.95 -0.10 0.00 0.00 175.22 175.88 2qim s THR 4 N -0.23 1.87 0.03 0.64 -4.23 -1.26 -0.36 115.64 112.11 2qim s THR 4 Ca 0.01 -1.83 -0.01 0.00 -1.18 0.00 0.00 61.69 58.68 2qim s THR 4 Cb -0.03 -1.81 -0.02 0.00 1.34 0.00 0.00 72.50 71.98 2qim s THR 4 CO -0.00 -0.21 -0.01 -0.36 -0.54 0.00 0.00 174.62 173.50 2qim s PHE 5 N -1.75 0.31 -0.08 3.99 0.08 0.05 -4.99 117.98 115.59 2qim s PHE 5 Ca 0.14 -0.64 0.02 0.00 0.12 0.00 0.00 56.93 56.57 2qim s PHE 5 Cb -0.07 -0.23 0.01 0.00 -0.57 0.00 0.00 43.02 42.16 2qim s PHE 5 CO 0.06 -0.26 -0.13 -0.65 -0.10 0.00 0.00 175.22 174.14 2qim s GLN 6 N -2.19 1.87 0.15 0.44 -1.52 -1.26 -0.53 119.66 116.62 2qim s GLN 6 Ca -0.09 -0.46 0.11 0.00 -1.95 0.00 0.00 55.36 52.97 2qim s GLN 6 Cb -0.04 -1.55 -0.04 0.00 -0.22 0.00 0.00 33.01 31.15 2qim s GLN 6 CO -0.03 0.01 -0.23 -0.51 -0.25 0.00 0.00 175.29 174.27 2qim s ASP 7 N 0.75 3.51 -0.03 5.90 1.01 -0.30 -5.01 116.67 122.50 2qim s ASP 7 Ca -0.13 -0.74 0.02 0.00 0.71 0.00 0.00 52.55 52.41 2qim s ASP 7 Cb -0.16 -0.32 0.01 0.00 1.01 0.00 0.00 42.92 43.46 2qim s ASP 7 CO 0.03 0.16 -0.07 -1.61 0.21 0.00 0.00 175.17 173.88 2qim s GLU 8 N -2.32 0.84 -0.11 8.23 2.02 -1.26 -1.30 118.70 124.80 2qim s GLU 8 Ca 0.17 -0.23 0.02 0.00 0.02 0.00 0.00 54.97 54.95 2qim s GLU 8 Cb -0.09 -0.81 0.01 0.00 0.10 0.00 0.00 34.13 33.34 2qim s GLU 8 CO 0.08 0.06 -0.16 0.71 0.02 0.00 0.00 175.26 175.97 2qim s TYR 9 N 0.34 2.08 0.09 1.61 2.02 -0.05 -4.96 117.35 118.49 2qim s TYR 9 Ca -0.05 -1.00 -0.10 0.00 -0.37 0.00 0.00 57.07 55.56 2qim s TYR 9 Cb -0.09 -1.49 -0.06 0.00 -0.40 0.00 0.00 41.96 39.92 2qim s TYR 9 CO 0.00 -0.50 0.42 0.95 -1.57 0.00 0.00 175.55 174.85 2qim s THR 10 N 0.97 5.07 0.01 -0.71 -4.23 -1.26 -0.13 115.64 115.36 2qim s THR 10 Ca -0.07 0.46 -0.02 0.00 -1.18 0.00 0.00 61.69 60.89 2qim s THR 10 Cb -0.15 -3.65 -0.01 0.00 1.34 0.00 0.00 72.50 70.03 2qim s THR 10 CO -0.02 0.26 0.01 -0.55 -0.54 0.00 0.00 174.62 173.79 2qim s SER 11 N -1.81 0.17 0.02 3.99 0.15 -0.73 -4.93 113.70 110.57 2qim s SER 11 Ca 0.34 -0.39 0.27 0.00 0.70 0.00 0.00 55.95 56.87 2qim s SER 11 Cb -0.14 0.12 1.12 0.00 -1.71 0.00 0.00 66.02 65.41 2qim s SER 11 CO 0.19 -0.29 1.85 0.35 1.20 0.00 0.00 173.24 176.53 2qim n THR 12 N 1.68 0.20 -2.93 6.45 -2.24 -1.26 -1.03 114.28 115.15 2qim n THR 12 Ca -0.23 0.01 -0.40 0.00 -2.27 0.00 0.00 64.05 61.16 2qim n THR 12 Cb 0.55 -0.58 -0.06 0.00 -2.10 0.00 0.00 70.33 68.15 2qim n THR 12 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2qim s ILE 13 N -3.02 4.36 0.53 2.28 -1.09 -1.26 -4.07 121.20 118.94 2qim s ILE 13 Ca 0.13 1.79 -0.21 0.00 -2.23 0.00 0.00 60.65 60.12 2qim s ILE 13 Cb 0.17 -4.18 -0.05 0.00 -1.58 0.00 0.00 42.46 36.82 2qim s ILE 13 CO 0.50 0.49 1.26 0.00 -1.23 0.00 0.00 174.94 175.96 2qim s ALA 14 N -0.98 2.78 0.19 9.38 0.00 -1.24 -2.21 121.76 129.68 2qim s ALA 14 Ca 0.38 1.13 -0.12 0.00 0.00 0.00 0.00 51.96 53.34 2qim s ALA 14 Cb -0.23 -3.48 0.12 0.00 0.00 0.00 0.00 23.12 19.52 2qim s ALA 14 CO 0.27 -1.11 1.84 -1.35 0.00 0.00 0.00 175.76 175.41 2qim h PRO 15 N 1.46 0.73 -0.33 0.00 0.11 -1.82 -0.41 132.00 131.75 2qim h PRO 15 Ca -0.50 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.46 2qim h PRO 15 Cb 1.28 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2qim h PRO 15 CO 0.57 0.48 -0.23 0.00 -0.21 0.00 0.00 178.00 178.62 2qim h ALA 16 N 1.24 1.00 -0.34 -0.75 0.00 -1.94 0.59 119.26 119.05 2qim h ALA 16 Ca 0.23 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 2qim h ALA 16 Cb -0.03 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2qim h ALA 16 CO -0.08 0.59 -0.10 -0.22 0.00 0.00 0.00 179.25 179.45 2qim h LYS 17 N 0.55 0.66 -0.66 0.00 3.64 -1.87 -1.47 116.57 117.43 2qim h LYS 17 Ca 0.08 -0.26 -0.08 0.00 -1.27 0.00 0.00 60.65 59.12 2qim h LYS 17 Cb 0.69 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.45 2qim h LYS 17 CO 0.05 0.84 0.11 1.25 -2.27 0.00 0.00 179.45 179.43 2qim h LEU 18 N 0.44 1.05 -0.64 5.20 5.85 -0.86 -1.92 115.31 124.43 2qim h LEU 18 Ca 0.08 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 2qim h LEU 18 Cb 0.61 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 2qim h LEU 18 CO 0.04 1.04 0.35 0.22 -0.34 0.00 0.00 178.44 179.75 2qim h TYR 19 N 1.01 0.88 -0.75 1.25 3.20 -0.80 -0.60 116.97 121.17 2qim h TYR 19 Ca 0.20 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.12 2qim h TYR 19 Cb 0.44 -0.28 -0.06 0.00 1.54 0.00 0.00 36.73 38.37 2qim h TYR 19 CO 0.03 0.63 0.43 -0.22 -1.64 0.00 0.00 178.16 177.39 2qim h LYS 20 N 0.87 0.75 -0.49 1.82 3.64 -0.93 0.74 116.57 122.97 2qim h LYS 20 Ca 0.23 -0.04 -0.12 0.00 -1.27 0.00 0.00 60.65 59.44 2qim h LYS 20 Cb 0.04 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 2qim h LYS 20 CO -0.04 0.49 -0.16 0.00 -2.27 0.00 0.00 179.45 177.48 2qim h ALA 21 N 1.39 0.78 0.00 5.00 0.00 -0.87 0.32 119.26 125.89 2qim h ALA 21 Ca 0.34 -0.37 -0.21 0.00 0.00 0.00 0.00 54.91 54.67 2qim h ALA 21 Cb 0.23 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2qim h ALA 21 CO -0.20 0.66 -1.10 -0.07 0.00 0.00 0.00 179.25 178.55 2qim h LEU 22 N 0.84 0.00 0.00 0.00 3.38 -0.63 -3.08 115.31 115.82 2qim h LEU 22 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2qim h LEU 22 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 2qim h LEU 22 CO 0.05 0.94 0.00 0.52 0.09 0.00 0.00 178.44 180.05 2qim n VAL 23 N -3.27 0.00 -0.29 1.22 0.31 0.21 -4.32 118.33 112.19 2qim n VAL 23 Ca -0.03 0.04 0.01 0.00 -0.01 0.00 0.00 64.34 64.36 2qim n VAL 23 Cb 0.94 -0.84 0.15 0.00 -0.91 0.00 0.00 33.84 33.18 2qim n VAL 23 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 2qim h THR 24 N 0.00 0.96 -0.32 2.52 2.02 -1.53 -2.23 112.91 114.34 2qim h THR 24 Ca 0.00 -0.29 -0.03 0.00 0.77 0.00 0.00 66.41 66.86 2qim h THR 24 Cb 0.00 0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 66.44 2qim h THR 24 CO 0.00 0.15 0.01 0.47 0.37 0.00 0.00 175.52 176.52 2qim n ASP 25 N -4.71 3.93 -0.27 4.18 8.00 0.11 -4.73 116.55 123.07 2qim n ASP 25 Ca 0.12 -3.10 0.07 0.00 0.71 0.00 0.00 54.79 52.59 2qim n ASP 25 Cb 0.23 -0.58 0.21 0.00 -0.02 0.00 0.00 41.12 40.96 2qim n ASP 25 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qim h ALA 26 N 1.91 1.11 0.00 2.24 0.00 -1.30 0.15 119.26 123.37 2qim h ALA 26 Ca 0.04 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2qim h ALA 26 Cb 1.56 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.50 2qim h ALA 26 CO 0.29 -0.29 -0.08 -0.44 0.00 0.00 0.00 179.25 178.73 2qim h ASP 27 N 0.37 0.00 0.00 0.00 3.32 -1.83 -1.67 116.42 116.61 2qim h ASP 27 Ca 0.45 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 57.27 2qim h ASP 27 Cb 0.76 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.27 2qim h ASP 27 CO -0.48 0.08 -1.60 -0.38 -1.72 0.00 0.00 179.24 175.15 2qim n ILE 28 N -3.30 1.51 -0.03 0.35 2.08 -0.59 -4.48 119.36 114.91 2qim n ILE 28 Ca -0.01 -0.09 -0.16 0.00 0.56 0.00 0.00 62.75 63.05 2qim n ILE 28 Cb 0.28 -2.12 -0.08 0.00 -0.75 0.00 0.00 39.64 36.96 2qim n ILE 28 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 2qim h ILE 29 N -1.00 1.36 -0.16 1.39 1.08 -0.99 -3.24 117.51 115.95 2qim h ILE 29 Ca -0.34 -1.85 0.00 0.00 -0.39 0.00 0.00 64.86 62.28 2qim h ILE 29 Cb 1.23 2.18 -0.01 0.00 -3.07 0.00 0.00 36.82 37.15 2qim h ILE 29 CO -0.20 0.56 0.10 0.40 -0.69 0.00 0.00 178.15 178.32 2qim h ILE 30 N 0.16 1.05 -0.53 -0.67 2.04 -1.49 0.34 117.51 118.41 2qim h ILE 30 Ca -0.04 -0.11 -0.03 0.00 1.00 0.00 0.00 64.86 65.68 2qim h ILE 30 Cb 1.18 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 38.07 2qim h ILE 30 CO 0.11 0.05 0.19 -0.65 0.00 0.00 0.00 178.15 177.85 2qim h PRO 31 N 0.21 0.78 -0.61 2.37 0.11 -1.75 0.10 132.00 133.21 2qim h PRO 31 Ca 0.06 -0.13 -0.06 0.00 0.11 0.00 0.00 66.00 65.99 2qim h PRO 31 Cb -0.01 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 30.94 2qim h PRO 31 CO -0.01 0.66 0.16 0.87 -0.21 0.00 0.00 178.00 179.47 2qim h LYS 32 N 0.77 0.97 0.16 1.05 1.57 -1.46 -3.31 116.57 116.30 2qim h LYS 32 Ca 0.18 -0.23 -0.21 0.00 -1.87 0.00 0.00 60.65 58.52 2qim h LYS 32 Cb 0.19 -0.13 0.02 0.00 0.08 0.00 0.00 32.23 32.39 2qim h LYS 32 CO -0.01 0.88 -0.93 0.00 -0.57 0.00 0.00 179.45 178.81 2qim h ALA 33 N 1.05 -0.09 -2.74 3.86 0.00 -0.58 -3.45 119.26 117.30 2qim h ALA 33 Ca 0.19 -0.74 -0.65 0.00 0.00 0.00 0.00 54.91 53.72 2qim h ALA 33 Cb 0.33 0.13 -0.17 0.00 0.00 0.00 0.00 17.79 18.08 2qim h ALA 33 CO -0.00 0.44 -0.39 0.08 0.00 0.00 0.00 179.25 179.38 2qim s VAL 34 N -2.45 5.24 -0.48 0.00 1.01 0.32 -4.60 120.40 119.45 2qim s VAL 34 Ca -0.13 0.14 0.26 0.00 0.00 0.00 0.00 61.98 62.24 2qim s VAL 34 Cb 0.01 -3.68 0.28 0.00 0.00 0.00 0.00 36.38 33.00 2qim s VAL 34 CO 0.84 0.08 1.76 -0.33 0.00 0.00 0.00 175.10 177.46 2qim h GLU 35 N 8.38 0.00 -0.01 2.72 4.39 -1.87 -2.38 114.58 125.81 2qim h GLU 35 Ca -0.32 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.38 2qim h GLU 35 Cb 1.16 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 2qim h GLU 35 CO 0.63 0.00 -0.40 0.25 -1.16 0.00 0.00 179.01 178.33 2qim n THR 36 N -2.41 0.00 -3.96 1.13 -2.24 -1.26 -4.89 114.28 100.64 2qim n THR 36 Ca 0.03 -0.21 -0.35 0.00 -2.27 0.00 0.00 64.05 61.25 2qim n THR 36 Cb 0.32 0.94 -0.13 0.00 -2.10 0.00 0.00 70.33 69.36 2qim n THR 36 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2qim s ILE 37 N -2.49 3.96 -0.09 2.28 1.01 -0.90 -1.14 121.20 123.84 2qim s ILE 37 Ca 0.21 -0.30 0.14 0.00 0.00 0.00 0.00 60.65 60.70 2qim s ILE 37 Cb 0.19 -2.81 -0.23 0.00 0.01 0.00 0.00 42.46 39.61 2qim s ILE 37 CO 0.55 0.40 0.51 0.00 0.00 0.00 0.00 174.94 176.41 2qim n GLN 38 N 4.51 0.65 -3.51 2.79 3.00 0.58 -4.48 117.38 120.90 2qim n GLN 38 Ca -0.17 0.21 -0.14 0.00 -0.01 0.00 0.00 57.00 56.88 2qim n GLN 38 Cb 0.52 -1.72 -0.05 0.00 0.00 0.00 0.00 30.24 28.99 2qim n GLN 38 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 2qim s SER 39 N -5.89 -0.55 -0.15 1.08 1.04 -1.18 -4.85 113.70 103.20 2qim s SER 39 Ca -0.06 0.45 -0.02 0.00 0.48 0.00 0.00 55.95 56.80 2qim s SER 39 Cb 0.08 0.48 0.05 0.00 0.10 0.00 0.00 66.02 66.72 2qim s SER 39 CO 0.83 -0.61 0.02 -0.69 0.98 0.00 0.00 173.24 173.76 2qim s VAL 40 N -1.82 0.49 0.03 5.02 1.01 -1.26 -1.31 120.40 122.56 2qim s VAL 40 Ca -0.05 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 61.65 2qim s VAL 40 Cb -0.00 -0.85 -0.02 0.00 0.00 0.00 0.00 36.38 35.50 2qim s VAL 40 CO 0.02 -0.02 -0.09 -1.61 0.00 0.00 0.00 175.10 173.40 2qim s GLU 41 N 1.89 0.60 -0.18 2.72 2.02 -0.33 -4.50 118.70 120.94 2qim s GLU 41 Ca 0.01 -0.60 -0.26 0.00 0.02 0.00 0.00 54.97 54.15 2qim s GLU 41 Cb -0.15 -0.50 -0.01 0.00 0.10 0.00 0.00 34.13 33.57 2qim s GLU 41 CO -0.07 0.12 0.85 0.42 0.02 0.00 0.00 175.26 176.60 2qim s ILE 42 N -0.89 4.86 -0.12 -1.63 1.01 -1.26 0.03 121.20 123.20 2qim s ILE 42 Ca -0.04 1.67 -0.21 0.00 0.00 0.00 0.00 60.65 62.07 2qim s ILE 42 Cb -0.07 -4.15 -0.26 0.00 0.01 0.00 0.00 42.46 37.98 2qim s ILE 42 CO 0.00 0.01 0.62 0.58 0.00 0.00 0.00 174.94 176.15 2qim h VAL 43 N 5.22 1.30 -2.58 2.92 2.07 -1.13 -3.47 116.25 120.58 2qim h VAL 43 Ca -0.28 -2.37 -0.09 0.00 0.82 0.00 0.00 66.70 64.77 2qim h VAL 43 Cb 1.12 2.90 -0.19 0.00 -1.52 0.00 0.00 31.29 33.60 2qim h VAL 43 CO 0.85 0.61 -0.06 -0.70 0.02 0.00 0.00 177.57 178.29 2qim s GLU 44 N -2.38 0.86 0.00 1.57 2.12 -1.14 -4.99 118.70 114.73 2qim s GLU 44 Ca -0.20 -0.00 0.00 0.00 0.36 0.00 0.00 54.97 55.12 2qim s GLU 44 Cb 0.02 0.39 0.00 0.00 0.26 0.00 0.00 34.13 34.81 2qim s GLU 44 CO 0.73 -0.26 0.00 0.41 -0.54 0.00 0.00 175.26 175.60 2qim n GLY 45 N 1.06 1.65 1.05 -1.50 0.00 -1.26 -0.92 105.19 105.27 2qim n GLY 45 Ca -0.20 -2.00 0.12 0.00 0.00 0.00 0.00 46.02 43.93 2qim n GLY 45 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2qim n ASN 46 N 0.00 3.14 0.00 1.61 0.23 -1.26 -4.93 115.26 114.05 2qim n ASN 46 Ca 0.00 -1.95 0.00 0.00 -0.53 0.00 0.00 54.58 52.10 2qim n ASN 46 Cb 0.00 -0.23 0.00 0.00 -2.08 0.00 0.00 39.78 37.47 2qim n ASN 46 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2qim n GLY 47 N 1.44 2.24 1.63 4.83 0.00 -1.26 -5.08 105.19 108.98 2qim n GLY 47 Ca 0.19 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.10 2qim n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qim n GLY 48 N -1.56 -0.37 3.59 -0.02 0.00 -1.26 -4.87 105.19 100.69 2qim n GLY 48 Ca 0.00 -1.82 -0.47 0.00 0.00 0.00 0.00 46.02 43.72 2qim n GLY 48 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qim n PRO 49 N -2.00 1.27 0.00 1.61 -0.02 -1.26 -1.51 135.00 133.10 2qim n PRO 49 Ca 0.07 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 2qim n PRO 49 Cb 0.25 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 2qim n PRO 49 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qim n GLY 50 N 1.79 2.20 3.76 -1.23 0.00 0.82 -4.97 105.19 107.56 2qim n GLY 50 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2qim n GLY 50 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2qim n THR 51 N -2.00 1.80 -4.43 2.61 -1.04 -0.57 -4.70 114.28 105.95 2qim n THR 51 Ca 0.00 -0.45 -0.34 0.00 -2.04 0.00 0.00 64.05 61.22 2qim n THR 51 Cb 0.00 -1.91 -0.13 0.00 -1.82 0.00 0.00 70.33 66.47 2qim n THR 51 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2qim s ILE 52 N -0.89 3.56 -0.00 12.58 -1.09 -0.09 -0.80 121.20 134.47 2qim s ILE 52 Ca 0.56 -0.47 0.05 0.00 -2.23 0.00 0.00 60.65 58.56 2qim s ILE 52 Cb -0.50 -2.55 -0.03 0.00 -1.58 0.00 0.00 42.46 37.80 2qim s ILE 52 CO 0.61 0.49 -0.15 -0.54 -1.23 0.00 0.00 174.94 174.11 2qim s LYS 53 N 0.56 2.31 -0.24 2.79 1.02 0.37 -0.49 119.74 126.06 2qim s LYS 53 Ca -0.04 -0.83 -0.05 0.00 0.02 0.00 0.00 55.97 55.06 2qim s LYS 53 Cb -0.15 -2.30 -0.01 0.00 -0.52 0.00 0.00 37.83 34.85 2qim s LYS 53 CO 0.03 0.58 0.01 0.21 -0.92 0.00 0.00 175.35 175.26 2qim s LYS 54 N -1.13 3.40 -0.29 1.68 2.20 0.10 -0.73 119.74 124.99 2qim s LYS 54 Ca 0.14 -0.62 -0.07 0.00 -0.36 0.00 0.00 55.97 55.05 2qim s LYS 54 Cb -0.11 -3.16 0.00 0.00 -1.51 0.00 0.00 37.83 33.06 2qim s LYS 54 CO 0.03 -0.24 0.08 -0.51 -0.36 0.00 0.00 175.35 174.35 2qim s LEU 55 N 1.52 3.77 -0.16 5.43 1.02 -0.09 -1.18 118.68 128.98 2qim s LEU 55 Ca 0.05 -0.64 -0.08 0.00 0.02 0.00 0.00 54.13 53.48 2qim s LEU 55 Cb -0.15 -1.88 -0.04 0.00 0.02 0.00 0.00 46.19 44.13 2qim s LEU 55 CO -0.00 -0.17 0.13 -0.89 0.02 0.00 0.00 176.35 175.43 2qim s THR 56 N 1.51 5.37 0.17 5.49 2.01 -0.42 -1.12 115.64 128.66 2qim s THR 56 Ca 0.03 0.17 -0.04 0.00 0.31 0.00 0.00 61.69 62.16 2qim s THR 56 Cb -0.17 -3.40 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 2qim s THR 56 CO 0.02 0.52 0.18 0.72 -0.69 0.00 0.00 174.62 175.38 2qim s PHE 57 N -0.25 0.77 -0.09 4.92 -0.12 -0.22 -0.31 117.98 122.69 2qim s PHE 57 Ca 0.11 -1.10 0.01 0.00 -0.05 0.00 0.00 56.93 55.90 2qim s PHE 57 Cb -0.12 -0.32 -0.02 0.00 -0.63 0.00 0.00 43.02 41.93 2qim s PHE 57 CO 0.01 -0.66 -0.10 -1.50 -0.05 0.00 0.00 175.22 172.92 2qim s ILE 58 N -4.06 3.35 -0.16 -4.49 1.10 -0.29 -1.07 121.20 115.59 2qim s ILE 58 Ca 0.26 -0.59 -0.07 0.00 -0.51 0.00 0.00 60.65 59.75 2qim s ILE 58 Cb 0.05 -2.38 0.07 0.00 0.15 0.00 0.00 42.46 40.35 2qim s ILE 58 CO 0.05 0.56 0.35 -0.70 -2.11 0.00 0.00 174.94 173.09 2qim s GLU 59 N -0.31 0.28 -1.55 3.50 2.12 -0.22 -4.84 118.70 117.67 2qim s GLU 59 Ca 0.04 0.82 -0.04 0.00 0.36 0.00 0.00 54.97 56.15 2qim s GLU 59 Cb -0.13 0.08 0.01 0.00 0.26 0.00 0.00 34.13 34.35 2qim s GLU 59 CO 0.02 -0.22 0.43 0.41 -0.54 0.00 0.00 175.26 175.36 2qim n GLY 60 N 4.91 -0.51 2.64 -1.50 0.00 -1.26 -1.72 105.19 107.75 2qim n GLY 60 Ca -0.14 0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2qim n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qim n GLY 61 N -1.33 2.40 3.73 -0.02 0.00 -1.26 -5.01 105.19 103.69 2qim n GLY 61 Ca -0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 2qim n GLY 61 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qim s GLU 62 N -0.12 3.07 -0.09 1.61 2.02 -0.70 -5.08 118.70 119.42 2qim s GLU 62 Ca 0.00 -0.36 -0.30 0.00 0.02 0.00 0.00 54.97 54.33 2qim s GLU 62 Cb 0.00 -2.87 -0.02 0.00 0.10 0.00 0.00 34.13 31.33 2qim s GLU 62 CO 0.00 0.71 1.11 0.45 0.02 0.00 0.00 175.26 177.56 2qim s SER 63 N -0.98 7.14 0.25 -0.19 0.15 -1.26 -1.06 113.70 117.74 2qim s SER 63 Ca 0.14 1.67 0.02 0.00 0.70 0.00 0.00 55.95 58.48 2qim s SER 63 Cb -0.11 -2.56 -0.04 0.00 -1.71 0.00 0.00 66.02 61.60 2qim s SER 63 CO 0.04 -0.53 0.17 -0.54 1.20 0.00 0.00 173.24 173.57 2qim s LYS 64 N 2.18 1.40 0.12 5.44 1.02 -0.23 -5.00 119.74 124.66 2qim s LYS 64 Ca 0.52 -1.77 -0.05 0.00 0.02 0.00 0.00 55.97 54.70 2qim s LYS 64 Cb -0.21 0.20 -0.02 0.00 -0.52 0.00 0.00 37.83 37.27 2qim s LYS 64 CO 0.19 -0.45 0.13 1.52 -0.92 0.00 0.00 175.35 175.82 2qim s TYR 65 N -3.90 0.55 0.05 3.18 -0.85 -1.26 -1.05 117.35 114.08 2qim s TYR 65 Ca 0.39 -0.96 0.04 0.00 -0.52 0.00 0.00 57.07 56.02 2qim s TYR 65 Cb 0.06 -0.27 -0.02 0.00 0.38 0.00 0.00 41.96 42.10 2qim s TYR 65 CO 0.17 -0.56 -0.12 0.14 -1.52 0.00 0.00 175.55 173.66 2qim s VAL 66 N -3.97 0.95 -0.14 -3.49 -7.23 -0.27 -3.56 120.40 102.69 2qim s VAL 66 Ca 0.16 -1.11 -0.05 0.00 -1.81 0.00 0.00 61.98 59.17 2qim s VAL 66 Cb 0.06 -0.92 -0.04 0.00 0.56 0.00 0.00 36.38 36.05 2qim s VAL 66 CO -0.03 -0.17 0.03 -0.76 -0.31 0.00 0.00 175.10 173.86 2qim s LEU 67 N -1.44 3.68 -0.10 1.32 1.43 -0.15 -0.91 118.68 122.51 2qim s LEU 67 Ca -0.02 0.10 0.01 0.00 -1.03 0.00 0.00 54.13 53.18 2qim s LEU 67 Cb -0.09 -1.89 -0.02 0.00 0.03 0.00 0.00 46.19 44.22 2qim s LEU 67 CO 0.01 0.27 -0.11 -1.00 0.23 0.00 0.00 176.35 175.75 2qim s HIS 68 N -0.20 2.82 -0.23 0.29 3.76 0.09 -0.70 115.29 121.12 2qim s HIS 68 Ca 0.06 -0.33 -0.08 0.00 -0.15 0.00 0.00 55.06 54.56 2qim s HIS 68 Cb -0.12 -1.76 -0.04 0.00 1.11 0.00 0.00 32.58 31.77 2qim s HIS 68 CO 0.02 0.03 0.08 0.21 -0.85 0.00 0.00 174.74 174.23 2qim s LYS 69 N -0.20 3.81 0.00 1.40 2.20 0.22 -0.48 119.74 126.69 2qim s LYS 69 Ca 0.01 -0.41 -0.30 0.00 -0.36 0.00 0.00 55.97 54.91 2qim s LYS 69 Cb -0.13 -3.31 -0.05 0.00 -1.51 0.00 0.00 37.83 32.82 2qim s LYS 69 CO 0.03 -0.01 1.37 0.42 -0.36 0.00 0.00 175.35 176.80 2qim s ILE 70 N 1.14 3.77 -0.22 5.43 1.01 0.02 -1.20 121.20 131.16 2qim s ILE 70 Ca 0.05 1.16 0.03 0.00 0.00 0.00 0.00 60.65 61.89 2qim s ILE 70 Cb -0.14 -3.75 -0.20 0.00 0.01 0.00 0.00 42.46 38.38 2qim s ILE 70 CO 0.04 0.01 -0.07 -0.62 0.00 0.00 0.00 174.94 174.29 2qim n GLU 71 N 5.23 0.67 -3.70 2.79 1.02 0.47 -0.13 120.64 127.00 2qim n GLU 71 Ca 0.13 0.15 -0.14 0.00 -0.02 0.00 0.00 57.16 57.27 2qim n GLU 71 Cb 0.44 -1.56 -0.08 0.00 -0.02 0.00 0.00 31.44 30.22 2qim n GLU 71 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qim s ALA 72 N -2.52 -1.11 -0.18 0.62 0.00 -0.94 -4.77 121.76 112.85 2qim s ALA 72 Ca -0.29 0.89 -0.04 0.00 0.00 0.00 0.00 51.96 52.53 2qim s ALA 72 Cb 0.08 -0.26 0.09 0.00 0.00 0.00 0.00 23.12 23.03 2qim s ALA 72 CO 0.67 -0.26 0.26 -1.50 0.00 0.00 0.00 175.76 174.92 2qim s ILE 73 N -0.69 -0.40 -0.43 0.00 2.07 -1.26 -0.69 121.20 119.80 2qim s ILE 73 Ca -0.08 0.04 0.02 0.00 -1.41 0.00 0.00 60.65 59.23 2qim s ILE 73 Cb -0.03 -0.61 0.15 0.00 0.13 0.00 0.00 42.46 42.10 2qim s ILE 73 CO 0.04 -0.07 0.27 -0.62 -1.91 0.00 0.00 174.94 172.65 2qim s ASP 74 N 2.39 3.18 0.29 4.50 2.15 -0.31 -4.98 116.67 123.89 2qim s ASP 74 Ca 0.06 -2.68 0.00 0.00 0.43 0.00 0.00 52.55 50.36 2qim s ASP 74 Cb -0.14 -0.81 0.45 0.00 -0.30 0.00 0.00 42.92 42.11 2qim s ASP 74 CO -0.11 -0.25 1.82 -0.33 -0.17 0.00 0.00 175.17 176.13 2qim h GLU 75 N 6.51 0.71 -0.95 4.34 3.07 -1.96 0.02 114.58 126.32 2qim h GLU 75 Ca 0.07 -0.16 0.17 0.00 -0.50 0.00 0.00 59.36 58.93 2qim h GLU 75 Cb 0.92 -0.10 -0.08 0.00 -0.84 0.00 0.00 28.75 28.65 2qim h GLU 75 CO 0.42 0.70 0.60 0.00 -1.40 0.00 0.00 179.01 179.33 2qim h ALA 76 N 1.37 1.80 -0.25 3.43 0.00 -1.94 -1.67 119.26 121.98 2qim h ALA 76 Ca 0.14 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2qim h ALA 76 Cb 0.36 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2qim h ALA 76 CO 0.01 -0.09 0.00 0.09 0.00 0.00 0.00 179.25 179.26 2qim n ASN 77 N -4.63 3.46 -4.03 0.00 3.02 -0.94 -4.97 115.26 107.17 2qim n ASN 77 Ca 0.20 -2.73 -0.29 0.00 -0.03 0.00 0.00 54.58 51.73 2qim n ASN 77 Cb 0.52 -0.44 -0.02 0.00 -0.61 0.00 0.00 39.78 39.24 2qim n ASN 77 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2qim n LEU 78 N -0.32 -2.11 -4.55 3.41 4.77 -0.55 -4.69 117.00 112.96 2qim n LEU 78 Ca 0.18 -0.99 -0.32 0.00 -0.03 0.00 0.00 56.01 54.86 2qim n LEU 78 Cb 0.73 -2.22 -0.11 0.00 -2.33 0.00 0.00 43.42 39.49 2qim n LEU 78 CO 0.12 0.39 -0.42 -0.83 -1.33 0.00 0.00 177.39 175.32 2qim s GLY 79 N -3.95 1.69 -0.21 -0.72 0.00 -0.12 -1.89 107.32 102.12 2qim s GLY 79 Ca 0.29 -1.09 -0.08 0.00 0.00 0.00 0.00 44.72 43.84 2qim s GLY 79 CO 0.89 -0.96 0.46 -0.47 0.00 0.00 0.00 173.10 173.02 2qim s TYR 80 N -0.98 -0.86 -0.03 1.90 5.04 -0.52 -1.16 117.35 120.74 2qim s TYR 80 Ca 0.16 1.63 0.07 0.00 -2.44 0.00 0.00 57.07 56.50 2qim s TYR 80 Cb -0.11 0.38 -0.02 0.00 0.35 0.00 0.00 41.96 42.57 2qim s TYR 80 CO 0.07 -0.49 -0.24 -0.80 -1.34 0.00 0.00 175.55 172.74 2qim s ASN 81 N 2.47 2.89 0.18 4.32 0.01 0.13 -1.09 114.94 123.84 2qim s ASN 81 Ca -0.04 -0.45 -0.15 0.00 -0.71 0.00 0.00 52.86 51.51 2qim s ASN 81 Cb -0.11 -0.43 0.02 0.00 0.41 0.00 0.00 41.25 41.13 2qim s ASN 81 CO -0.14 0.29 0.44 -0.72 -1.51 0.00 0.00 177.10 175.45 2qim s TYR 82 N -0.47 0.03 0.16 2.20 -0.85 -0.58 -0.39 117.35 117.45 2qim s TYR 82 Ca 0.06 -0.37 0.08 0.00 -0.52 0.00 0.00 57.07 56.32 2qim s TYR 82 Cb -0.10 0.24 -0.04 0.00 0.38 0.00 0.00 41.96 42.44 2qim s TYR 82 CO 0.00 -0.83 -0.17 -1.54 -1.52 0.00 0.00 175.55 171.49 2qim s SER 83 N -2.89 2.52 -0.17 -0.18 1.04 -0.34 -0.32 113.70 113.36 2qim s SER 83 Ca 0.11 -0.88 -0.20 0.00 0.48 0.00 0.00 55.95 55.46 2qim s SER 83 Cb 0.01 -0.14 -0.03 0.00 0.10 0.00 0.00 66.02 65.96 2qim s SER 83 CO -0.03 -0.08 0.57 -0.63 0.98 0.00 0.00 173.24 174.05 2qim s ILE 84 N -2.25 5.08 -0.02 -1.02 1.01 -0.56 -0.61 121.20 122.83 2qim s ILE 84 Ca 0.16 1.08 0.03 0.00 0.00 0.00 0.00 60.65 61.92 2qim s ILE 84 Cb -0.05 -3.89 0.04 0.00 0.01 0.00 0.00 42.46 38.57 2qim s ILE 84 CO 0.06 0.18 0.91 1.33 0.00 0.00 0.00 174.94 177.43 2qim n VAL 85 N 4.39 0.86 0.00 2.92 0.24 0.13 -4.62 118.33 122.25 2qim n VAL 85 Ca -0.04 -0.92 0.00 0.00 -2.04 0.00 0.00 64.34 61.35 2qim n VAL 85 Cb 0.50 0.50 0.00 0.00 -1.47 0.00 0.00 33.84 33.37 2qim n VAL 85 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qim n GLY 86 N -0.50 0.69 0.00 7.63 0.00 -1.22 -4.87 105.19 106.91 2qim n GLY 86 Ca 0.02 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.35 2qim n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qim n GLY 87 N -0.05 1.15 3.31 -0.02 0.00 -1.26 -0.97 105.19 107.35 2qim n GLY 87 Ca 0.00 -0.82 -0.32 0.00 0.00 0.00 0.00 46.02 44.88 2qim n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qim s VAL 88 N -2.38 2.45 0.00 1.61 1.01 -1.23 -5.00 120.40 116.85 2qim s VAL 88 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.07 2qim s VAL 88 Cb 0.00 -1.95 0.00 0.00 0.00 0.00 0.00 36.38 34.43 2qim s VAL 88 CO 0.00 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.27 2qim n GLY 89 N 3.10 1.58 3.79 4.51 0.00 -1.26 -5.03 105.19 111.88 2qim n GLY 89 Ca -0.18 -2.13 -0.33 0.00 0.00 0.00 0.00 46.02 43.38 2qim n GLY 89 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qim s LEU 90 N 0.00 3.46 0.59 0.99 2.01 -1.26 -5.02 118.68 119.45 2qim s LEU 90 Ca 0.00 1.90 -0.18 0.00 0.01 0.00 0.00 54.13 55.86 2qim s LEU 90 Cb 0.00 -4.54 -0.06 0.00 0.01 0.00 0.00 46.19 41.60 2qim s LEU 90 CO 0.00 -1.36 0.76 -2.65 1.01 0.00 0.00 176.35 174.11 2qim n PRO 91 N -2.18 0.70 0.00 1.29 -0.02 -1.26 -5.04 135.00 128.49 2qim n PRO 91 Ca 0.09 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 2qim n PRO 91 Cb 0.52 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 2qim n PRO 91 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2qim n ASP 92 N -0.23 0.00 0.05 2.55 3.85 -1.26 -5.04 116.55 116.48 2qim n ASP 92 Ca 0.13 0.00 0.13 0.00 -0.71 0.00 0.00 54.79 54.33 2qim n ASP 92 Cb 0.47 0.00 0.30 0.00 -1.35 0.00 0.00 41.12 40.55 2qim n ASP 92 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 2qim n THR 93 N 0.00 0.32 -2.47 2.12 -2.24 -1.26 -4.77 114.28 105.97 2qim n THR 93 Ca 0.00 -0.20 -0.43 0.00 -2.27 0.00 0.00 64.05 61.15 2qim n THR 93 Cb 0.00 -0.23 -0.02 0.00 -2.10 0.00 0.00 70.33 67.98 2qim n THR 93 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2qim s ILE 94 N -3.10 4.33 0.02 2.28 1.01 -1.26 -4.23 121.20 120.24 2qim s ILE 94 Ca 0.09 1.58 -0.18 0.00 0.00 0.00 0.00 60.65 62.15 2qim s ILE 94 Cb 0.14 -4.10 -0.29 0.00 0.01 0.00 0.00 42.46 38.23 2qim s ILE 94 CO 0.66 -0.23 1.05 -0.33 0.00 0.00 0.00 174.94 176.09 2qim h GLU 95 N 8.30 0.50 -2.38 2.79 5.08 -1.27 -3.48 114.58 124.11 2qim h GLU 95 Ca -0.25 -0.68 -0.08 0.00 -1.00 0.00 0.00 59.36 57.36 2qim h GLU 95 Cb 1.09 0.22 -0.23 0.00 0.50 0.00 0.00 28.75 30.34 2qim h GLU 95 CO 0.99 1.29 -0.07 0.21 -1.00 0.00 0.00 179.01 180.42 2qim s LYS 96 N -2.89 0.64 -0.06 2.33 2.20 -0.87 -4.99 119.74 116.09 2qim s LYS 96 Ca -0.11 0.81 0.02 0.00 -0.36 0.00 0.00 55.97 56.32 2qim s LYS 96 Cb 0.04 0.28 0.01 0.00 -1.51 0.00 0.00 37.83 36.65 2qim s LYS 96 CO 0.88 -0.09 -0.11 -1.50 -0.36 0.00 0.00 175.35 174.17 2qim s ILE 97 N 0.47 1.06 0.13 5.43 2.07 -1.26 -0.67 121.20 128.43 2qim s ILE 97 Ca -0.01 -0.43 -0.01 0.00 -1.41 0.00 0.00 60.65 58.79 2qim s ILE 97 Cb -0.04 -0.97 -0.04 0.00 0.13 0.00 0.00 42.46 41.53 2qim s ILE 97 CO -0.02 0.34 0.04 -0.94 -1.91 0.00 0.00 174.94 172.46 2qim s SER 98 N 0.69 0.44 -0.00 4.50 1.04 -0.48 -1.49 113.70 118.38 2qim s SER 98 Ca -0.14 -1.19 0.01 0.00 0.48 0.00 0.00 55.95 55.10 2qim s SER 98 Cb -0.16 0.27 -0.00 0.00 0.10 0.00 0.00 66.02 66.23 2qim s SER 98 CO 0.03 -0.70 -0.03 -0.36 0.98 0.00 0.00 173.24 173.16 2qim s PHE 99 N -3.99 0.27 -0.16 5.02 0.08 0.56 -0.69 117.98 119.08 2qim s PHE 99 Ca 0.23 -0.05 0.01 0.00 0.12 0.00 0.00 56.93 57.25 2qim s PHE 99 Cb 0.07 -0.19 0.02 0.00 -0.57 0.00 0.00 43.02 42.35 2qim s PHE 99 CO 0.01 -0.01 -0.19 -1.21 -0.10 0.00 0.00 175.22 173.72 2qim s GLU 100 N 0.01 2.82 0.06 0.44 2.02 -0.11 -1.52 118.70 122.42 2qim s GLU 100 Ca 0.00 -0.77 0.08 0.00 0.02 0.00 0.00 54.97 54.30 2qim s GLU 100 Cb -0.02 -2.39 -0.03 0.00 0.10 0.00 0.00 34.13 31.79 2qim s GLU 100 CO -0.00 -0.14 -0.22 0.95 0.02 0.00 0.00 175.26 175.87 2qim s THR 101 N 1.14 1.79 -0.09 3.63 -4.23 -0.25 -0.70 115.64 116.92 2qim s THR 101 Ca -0.00 -1.30 -0.09 0.00 -1.18 0.00 0.00 61.69 59.12 2qim s THR 101 Cb -0.14 -1.56 0.02 0.00 1.34 0.00 0.00 72.50 72.16 2qim s THR 101 CO -0.08 0.20 0.25 -0.75 -0.54 0.00 0.00 174.62 173.69 2qim s LYS 102 N -1.32 0.29 -0.12 3.99 2.20 -0.74 -1.44 119.74 122.60 2qim s LYS 102 Ca 0.08 0.33 -0.03 0.00 -0.36 0.00 0.00 55.97 56.00 2qim s LYS 102 Cb -0.09 0.14 -0.03 0.00 -1.51 0.00 0.00 37.83 36.34 2qim s LYS 102 CO 0.02 -0.04 -0.02 -0.51 -0.36 0.00 0.00 175.35 174.45 2qim s LEU 103 N 0.11 3.39 0.17 5.43 1.43 -0.79 -0.76 118.68 127.65 2qim s LEU 103 Ca -0.00 -0.01 0.03 0.00 -1.03 0.00 0.00 54.13 53.12 2qim s LEU 103 Cb -0.02 -1.79 -0.05 0.00 0.03 0.00 0.00 46.19 44.36 2qim s LEU 103 CO 0.00 0.26 -0.05 0.68 0.23 0.00 0.00 176.35 177.48 2qim s VAL 104 N -0.19 0.95 0.36 -1.59 -7.23 -0.19 -4.79 120.40 107.73 2qim s VAL 104 Ca 0.04 -2.02 -0.28 0.00 -1.81 0.00 0.00 61.98 57.91 2qim s VAL 104 Cb -0.13 -2.01 -0.11 0.00 0.56 0.00 0.00 36.38 34.69 2qim s VAL 104 CO 0.02 -0.60 1.45 -1.61 -0.31 0.00 0.00 175.10 174.06 2qim s GLU 105 N -3.83 4.16 0.00 4.82 2.02 -1.26 -0.45 118.70 124.17 2qim s GLU 105 Ca 0.21 2.49 0.00 0.00 0.02 0.00 0.00 54.97 57.69 2qim s GLU 105 Cb 0.05 -2.99 0.00 0.00 0.10 0.00 0.00 34.13 31.28 2qim s GLU 105 CO 0.03 -0.46 0.00 0.41 0.02 0.00 0.00 175.26 175.26 2qim n GLY 106 N 0.57 3.28 3.87 -1.39 0.00 0.77 -4.40 105.19 107.88 2qim n GLY 106 Ca 0.01 -0.71 -0.37 0.00 0.00 0.00 0.00 46.02 44.95 2qim n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qim s ALA 107 N -2.07 3.84 -1.48 4.61 0.00 -1.26 -4.41 121.76 120.98 2qim s ALA 107 Ca 0.00 -0.56 -0.12 0.00 0.00 0.00 0.00 51.96 51.28 2qim s ALA 107 Cb 0.00 -2.06 0.07 0.00 0.00 0.00 0.00 23.12 21.14 2qim s ALA 107 CO 0.00 0.57 0.85 0.09 0.00 0.00 0.00 175.76 177.28 2qim n ASN 108 N 2.02 -4.88 0.00 0.00 3.02 -1.26 -0.41 115.26 113.75 2qim n ASN 108 Ca -0.19 -0.63 0.00 0.00 -0.03 0.00 0.00 54.58 53.73 2qim n ASN 108 Cb 0.54 -3.91 0.00 0.00 -0.61 0.00 0.00 39.78 35.80 2qim n ASN 108 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qim n GLY 109 N -1.59 0.79 0.00 7.41 0.00 -1.26 -5.02 105.19 105.51 2qim n GLY 109 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2qim n GLY 109 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qim n GLY 110 N -2.34 0.08 3.23 -0.02 0.00 0.45 -3.59 105.19 103.00 2qim n GLY 110 Ca 0.00 -1.65 -0.14 0.00 0.00 0.00 0.00 46.02 44.23 2qim n GLY 110 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qim s SER 111 N -1.00 1.71 -0.14 1.61 0.01 -0.19 -0.17 113.70 115.53 2qim s SER 111 Ca 0.00 -0.98 0.01 0.00 1.31 0.00 0.00 55.95 56.28 2qim s SER 111 Cb 0.00 -0.00 0.02 0.00 0.21 0.00 0.00 66.02 66.25 2qim s SER 111 CO 0.00 -0.33 -0.15 -0.63 0.41 0.00 0.00 173.24 172.54 2qim s ILE 112 N -3.22 1.57 -0.47 1.44 1.01 0.41 -1.77 121.20 120.16 2qim s ILE 112 Ca 0.15 -0.64 -0.24 0.00 0.00 0.00 0.00 60.65 59.92 2qim s ILE 112 Cb 0.02 -1.46 0.03 0.00 0.01 0.00 0.00 42.46 41.06 2qim s ILE 112 CO 0.00 0.46 0.85 -0.83 0.00 0.00 0.00 174.94 175.42 2qim s GLY 113 N 1.37 1.53 -0.06 6.18 0.00 0.81 -1.02 107.32 116.14 2qim s GLY 113 Ca 0.02 -1.00 -0.14 0.00 0.00 0.00 0.00 44.72 43.60 2qim s GLY 113 CO -0.09 1.90 0.36 0.54 0.00 0.00 0.00 173.10 175.81 2qim s LYS 114 N 3.53 3.95 -0.05 2.90 1.02 0.06 -0.87 119.74 130.28 2qim s LYS 114 Ca 0.32 0.29 -0.00 0.00 0.02 0.00 0.00 55.97 56.59 2qim s LYS 114 Cb -0.12 -3.27 0.03 0.00 -0.52 0.00 0.00 37.83 33.95 2qim s LYS 114 CO 0.23 0.57 0.00 0.08 -0.92 0.00 0.00 175.35 175.31 2qim s VAL 115 N -0.63 0.25 -0.21 3.17 1.01 -0.42 -1.79 120.40 121.79 2qim s VAL 115 Ca 0.21 0.12 -0.06 0.00 0.00 0.00 0.00 61.98 62.25 2qim s VAL 115 Cb -0.15 -0.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.81 2qim s VAL 115 CO 0.10 0.20 0.04 -0.89 0.00 0.00 0.00 175.10 174.55 2qim s THR 116 N 1.50 4.36 -0.20 3.92 2.01 0.12 -1.15 115.64 126.19 2qim s THR 116 Ca -0.03 -0.17 -0.07 0.00 0.31 0.00 0.00 61.69 61.73 2qim s THR 116 Cb -0.13 -2.98 -0.03 0.00 0.01 0.00 0.00 72.50 69.36 2qim s THR 116 CO -0.03 0.41 0.05 -0.63 -0.69 0.00 0.00 174.62 173.73 2qim s ILE 117 N 0.93 4.41 -0.21 1.82 1.09 0.31 -0.93 121.20 128.62 2qim s ILE 117 Ca 0.03 -0.16 -0.02 0.00 -1.10 0.00 0.00 60.65 59.40 2qim s ILE 117 Cb -0.14 -3.01 0.01 0.00 -1.06 0.00 0.00 42.46 38.26 2qim s ILE 117 CO 0.02 0.42 -0.11 -0.75 -0.10 0.00 0.00 174.94 174.42 2qim s LYS 118 N 0.89 3.13 -0.14 2.79 2.20 0.13 -0.77 119.74 127.96 2qim s LYS 118 Ca 0.03 -0.77 -0.00 0.00 -0.36 0.00 0.00 55.97 54.87 2qim s LYS 118 Cb -0.14 -2.84 -0.01 0.00 -1.51 0.00 0.00 37.83 33.33 2qim s LYS 118 CO 0.02 -0.24 -0.13 0.42 -0.36 0.00 0.00 175.35 175.06 2qim s ILE 119 N 1.38 2.93 -0.16 5.43 1.01 0.51 -1.38 121.20 130.92 2qim s ILE 119 Ca 0.04 -0.69 -0.04 0.00 0.00 0.00 0.00 60.65 59.96 2qim s ILE 119 Cb -0.14 -2.24 -0.03 0.00 0.01 0.00 0.00 42.46 40.06 2qim s ILE 119 CO -0.07 0.51 -0.03 -1.61 0.00 0.00 0.00 174.94 173.74 2qim s GLU 120 N 0.59 3.66 0.42 2.79 2.02 0.16 -0.74 118.70 127.60 2qim s GLU 120 Ca -0.08 -0.52 0.06 0.00 0.02 0.00 0.00 54.97 54.45 2qim s GLU 120 Cb -0.16 -2.95 -0.07 0.00 0.10 0.00 0.00 34.13 31.06 2qim s GLU 120 CO 0.03 0.20 0.04 0.95 0.02 0.00 0.00 175.26 176.50 2qim s THR 121 N 0.49 1.95 -0.26 3.63 -4.23 0.18 -0.80 115.64 116.59 2qim s THR 121 Ca -0.03 -1.95 -0.23 0.00 -1.18 0.00 0.00 61.69 58.30 2qim s THR 121 Cb -0.14 -2.90 -0.01 0.00 1.34 0.00 0.00 72.50 70.79 2qim s THR 121 CO 0.03 0.00 0.76 -0.75 -0.54 0.00 0.00 174.62 174.12 2qim s LYS 122 N -3.77 4.12 7.98 3.99 2.47 -1.26 -0.79 119.74 132.48 2qim s LYS 122 Ca 0.33 0.75 0.00 0.00 -1.56 0.00 0.00 55.97 55.49 2qim s LYS 122 Cb 0.08 -3.66 0.00 0.00 -1.46 0.00 0.00 37.83 32.79 2qim s LYS 122 CO 0.17 -0.52 0.00 0.41 0.16 0.00 0.00 175.35 175.57 2qim n GLY 123 N 3.96 3.91 1.10 5.54 0.00 -1.26 -2.03 105.19 116.42 2qim n GLY 123 Ca 0.03 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.14 2qim n GLY 123 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qim n ASP 124 N 6.82 3.19 -4.76 1.61 10.43 -1.26 0.15 116.55 132.73 2qim n ASP 124 Ca 0.00 -2.07 -0.39 0.00 2.57 0.00 0.00 54.79 54.90 2qim n ASP 124 Cb 0.00 -0.41 0.02 0.00 1.84 0.00 0.00 41.12 42.57 2qim n ASP 124 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2qim s ALA 125 N -1.36 3.07 0.15 2.24 0.00 -0.86 -5.00 121.76 120.01 2qim s ALA 125 Ca 0.38 1.33 0.05 0.00 0.00 0.00 0.00 51.96 53.73 2qim s ALA 125 Cb 0.21 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.74 2qim s ALA 125 CO 0.24 -1.15 0.09 -0.65 0.00 0.00 0.00 175.76 174.30 2qim s GLN 126 N -2.60 2.77 0.62 0.00 -1.52 -1.26 -4.60 119.66 113.06 2qim s GLN 126 Ca 0.64 -0.90 -0.19 0.00 -1.95 0.00 0.00 55.36 52.96 2qim s GLN 126 Cb -0.40 -2.59 -0.02 0.00 -0.22 0.00 0.00 33.01 29.78 2qim s GLN 126 CO 0.50 0.49 1.32 -2.14 -0.25 0.00 0.00 175.29 175.21 2qim s PRO 127 N -2.92 2.71 -0.25 2.91 0.02 -1.26 -4.91 135.00 131.30 2qim s PRO 127 Ca 0.30 2.14 -0.29 0.00 0.02 0.00 0.00 61.00 63.16 2qim s PRO 127 Cb -0.10 -1.97 0.01 0.00 0.02 0.00 0.00 34.50 32.46 2qim s PRO 127 CO 0.22 -1.49 1.05 1.21 -0.33 0.00 0.00 177.00 177.65 2qim s ASN 128 N -1.24 7.06 0.10 2.53 3.84 -1.26 -4.94 114.94 121.03 2qim s ASN 128 Ca 0.80 1.30 -0.16 0.00 0.21 0.00 0.00 52.86 55.00 2qim s ASN 128 Cb -0.39 -2.54 -0.06 0.00 -0.55 0.00 0.00 41.25 37.71 2qim s ASN 128 CO 0.43 -0.72 1.49 -0.08 -2.79 0.00 0.00 177.10 175.43 2qim h GLU 129 N 7.61 0.63 -0.72 0.43 4.81 -1.99 -1.60 114.58 123.76 2qim h GLU 129 Ca -0.19 -0.25 0.02 0.00 -0.13 0.00 0.00 59.36 58.80 2qim h GLU 129 Cb 1.06 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.37 2qim h GLU 129 CO 0.99 0.83 0.47 0.93 -0.73 0.00 0.00 179.01 181.49 2qim h GLU 130 N 0.41 0.91 -0.70 1.92 4.39 -1.99 -0.51 114.58 119.00 2qim h GLU 130 Ca 0.08 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.70 2qim h GLU 130 Cb 0.60 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 29.02 2qim h GLU 130 CO 0.04 0.60 0.34 1.49 -1.16 0.00 0.00 179.01 180.32 2qim h GLU 131 N 0.94 1.01 -0.53 2.33 4.57 -1.94 -0.89 114.58 120.06 2qim h GLU 131 Ca 0.27 -0.15 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2qim h GLU 131 Cb -0.06 -0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 28.32 2qim h GLU 131 CO -0.08 0.80 0.34 0.78 -1.18 0.00 0.00 179.01 179.67 2qim h GLY 132 N 0.98 0.75 1.00 1.92 0.00 -0.82 0.21 103.07 107.11 2qim h GLY 132 Ca 0.24 -0.29 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 2qim h GLY 132 CO -0.03 0.29 0.36 0.50 0.00 0.00 0.00 176.54 177.66 2qim h LYS 133 N 0.72 0.78 -0.60 4.80 1.57 -0.91 -0.47 116.57 122.47 2qim h LYS 133 Ca 0.19 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.82 2qim h LYS 133 Cb -0.06 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.06 2qim h LYS 133 CO -0.04 0.55 0.03 0.00 -0.57 0.00 0.00 179.45 179.42 2qim h ALA 134 N 1.19 0.92 -0.51 3.86 0.00 -0.71 -0.92 119.26 123.09 2qim h ALA 134 Ca 0.21 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 2qim h ALA 134 Cb -0.04 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2qim h ALA 134 CO -0.04 0.65 -0.03 0.00 0.00 0.00 0.00 179.25 179.83 2qim h ALA 135 N 1.08 0.69 -0.48 0.00 0.00 -0.28 0.55 119.26 120.81 2qim h ALA 135 Ca 0.17 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 2qim h ALA 135 Cb 0.51 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2qim h ALA 135 CO 0.02 0.52 0.11 -0.22 0.00 0.00 0.00 179.25 179.69 2qim h LYS 136 N 0.78 0.77 -0.93 0.00 1.63 -0.92 -1.20 116.57 116.69 2qim h LYS 136 Ca 0.14 -0.19 0.03 0.00 -0.85 0.00 0.00 60.65 59.78 2qim h LYS 136 Cb 0.56 -0.10 -0.05 0.00 -0.60 0.00 0.00 32.23 32.04 2qim h LYS 136 CO 0.03 0.76 0.61 0.00 -3.45 0.00 0.00 179.45 177.39 2qim h ALA 137 N 0.98 1.23 -0.80 5.00 0.00 -0.91 -0.68 119.26 124.07 2qim h ALA 137 Ca 0.15 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2qim h ALA 137 Cb 0.33 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 2qim h ALA 137 CO 0.00 0.49 0.40 0.00 0.00 0.00 0.00 179.25 180.14 2qim h ARG 138 N 1.18 1.14 -0.62 0.00 3.08 -0.58 -1.56 114.38 117.02 2qim h ARG 138 Ca 0.37 -0.15 0.01 0.00 0.07 0.00 0.00 59.98 60.28 2qim h ARG 138 Cb -0.01 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.79 2qim h ARG 138 CO -0.12 0.86 0.41 0.78 -1.07 0.00 0.00 179.97 180.84 2qim h GLY 139 N 1.16 0.87 1.00 0.04 0.00 -0.24 0.15 103.07 106.05 2qim h GLY 139 Ca 0.28 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.29 2qim h GLY 139 CO -0.04 0.31 0.31 -0.55 0.00 0.00 0.00 176.54 176.57 2qim h ASP 140 N 0.83 0.55 -0.42 0.19 3.32 -0.77 -1.40 116.42 118.73 2qim h ASP 140 Ca 0.23 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.17 2qim h ASP 140 Cb -0.08 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.31 2qim h ASP 140 CO -0.06 0.40 -0.08 0.00 -1.72 0.00 0.00 179.24 177.79 2qim h ALA 141 N 1.17 0.95 0.18 3.45 0.00 -0.77 -0.83 119.26 123.41 2qim h ALA 141 Ca 0.17 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2qim h ALA 141 Cb -0.07 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2qim h ALA 141 CO -0.04 0.62 -0.09 0.35 0.00 0.00 0.00 179.25 180.10 2qim h PHE 142 N 0.78 -0.22 -0.49 0.00 3.57 -0.39 -0.60 116.94 119.58 2qim h PHE 142 Ca 0.13 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.54 2qim h PHE 142 Cb 0.59 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 2qim h PHE 142 CO 0.03 -0.04 -0.06 0.74 -2.23 0.00 0.00 178.31 176.75 2qim h PHE 143 N -0.37 0.95 -0.48 0.41 0.04 -1.19 -1.10 116.94 115.20 2qim h PHE 143 Ca -0.02 -0.16 0.02 0.00 2.80 0.00 0.00 57.97 60.60 2qim h PHE 143 Cb 0.28 -0.25 -0.03 0.00 2.20 0.00 0.00 35.95 38.16 2qim h PHE 143 CO -0.03 0.89 0.29 -0.22 -0.60 0.00 0.00 178.31 178.65 2qim h LYS 144 N 0.80 0.57 -0.38 1.51 3.64 -1.06 -0.25 116.57 121.40 2qim h LYS 144 Ca 0.14 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.43 2qim h LYS 144 Cb 0.56 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 2qim h LYS 144 CO 0.03 0.38 0.03 0.00 -2.27 0.00 0.00 179.45 177.61 2qim h ALA 145 N 1.21 0.51 -0.60 5.00 0.00 -0.87 -0.77 119.26 123.74 2qim h ALA 145 Ca 0.19 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2qim h ALA 145 Cb 0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2qim h ALA 145 CO -0.08 0.26 0.21 0.82 0.00 0.00 0.00 179.25 180.46 2qim h ILE 146 N 0.49 1.24 0.00 0.00 2.04 -1.00 -1.02 117.51 119.25 2qim h ILE 146 Ca 0.11 -0.78 0.00 0.00 1.00 0.00 0.00 64.86 65.20 2qim h ILE 146 Cb 0.43 0.62 -0.00 0.00 -0.74 0.00 0.00 36.82 37.12 2qim h ILE 146 CO 0.01 0.30 -0.00 -0.08 0.00 0.00 0.00 178.15 178.38 2qim h GLU 147 N 0.84 -0.01 -0.58 2.37 4.81 -0.85 -0.27 114.58 120.90 2qim h GLU 147 Ca 0.20 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.47 2qim h GLU 147 Cb 0.25 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.59 2qim h GLU 147 CO -0.01 -0.00 0.33 1.03 -0.73 0.00 0.00 179.01 179.62 2qim h SER 148 N -0.01 0.50 -0.16 1.04 0.87 -1.07 -0.38 113.55 114.34 2qim h SER 148 Ca 0.00 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.56 2qim h SER 148 Cb 0.01 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 2qim h SER 148 CO -0.00 0.34 0.03 0.22 -0.53 0.00 0.00 176.83 176.88 2qim h TYR 149 N 0.63 0.28 0.00 2.24 3.20 -0.86 -2.01 116.97 120.45 2qim h TYR 149 Ca 0.25 -0.04 -0.08 0.00 3.14 0.00 0.00 58.73 62.00 2qim h TYR 149 Cb 0.11 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 2qim h TYR 149 CO -0.08 0.43 -0.38 -0.07 -1.64 0.00 0.00 178.16 176.43 2qim h LEU 150 N 0.05 0.00 -0.76 2.82 3.38 -0.92 -0.39 115.31 119.49 2qim h LEU 150 Ca 0.05 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 2qim h LEU 150 Cb 0.30 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2qim h LEU 150 CO 0.00 0.38 -0.08 0.28 0.09 0.00 0.00 178.44 179.11 2qim h SER 151 N 0.00 0.84 1.55 -0.43 0.02 -0.88 -2.33 113.55 112.32 2qim h SER 151 Ca -0.00 -0.25 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 2qim h SER 151 Cb 0.77 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.08 2qim h SER 151 CO 0.05 0.96 -0.40 0.00 -1.14 0.00 0.00 176.83 176.30 2qim h ALA 152 N 1.12 0.79 -2.02 3.77 0.00 -0.74 -3.39 119.26 118.80 2qim h ALA 152 Ca 0.13 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.54 2qim h ALA 152 Cb 0.58 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 17.98 2qim h ALA 152 CO 0.04 0.00 -1.14 0.72 0.00 0.00 0.00 179.25 178.87 2qim n HIS 153 N -2.85 0.36 0.32 0.00 8.25 -0.21 -4.96 115.22 116.13 2qim n HIS 153 Ca 0.03 -3.79 0.20 0.00 -0.26 0.00 0.00 57.72 53.90 2qim n HIS 153 Cb 0.53 -0.41 1.11 0.00 1.12 0.00 0.00 29.99 32.33 2qim n HIS 153 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2qim h PRO 154 N 3.21 0.00 -6.21 -0.41 0.13 -1.63 -3.40 132.00 123.68 2qim h PRO 154 Ca 0.10 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.75 2qim h PRO 154 Cb 0.92 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.03 2qim h PRO 154 CO 0.52 0.00 -0.45 0.16 -0.23 0.00 0.00 178.00 178.00 2qim s ASP 155 N -5.48 5.85 0.00 1.44 3.84 -1.26 -5.09 116.67 115.97 2qim s ASP 155 Ca -0.05 -0.16 0.00 0.00 -0.00 0.00 0.00 52.55 52.34 2qim s ASP 155 Cb 0.14 -1.48 0.00 0.00 -1.38 0.00 0.00 42.92 40.19 2qim s ASP 155 CO 0.45 -0.16 0.00 0.00 -0.00 0.00 0.00 175.17 175.47 2qim n TYR 156 N -1.37 0.00 -0.06 2.11 0.18 -1.26 -5.11 117.16 111.66 2qim n TYR 156 Ca -0.06 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.72 2qim n TYR 156 Cb 0.58 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.54 2qim n TYR 156 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87