#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9b s SER 2 N 0.00 4.27 -0.07 1.61 0.15 -1.26 -5.09 113.70 113.32 2d9b s SER 2 Ca 0.00 -1.77 -0.03 0.00 0.70 0.00 0.00 55.95 54.85 2d9b s SER 2 Cb 0.00 -1.18 0.04 0.00 -1.71 0.00 0.00 66.02 63.17 2d9b s SER 2 CO 0.00 -0.38 0.15 -0.44 1.20 0.00 0.00 173.24 173.77 2d9b s SER 3 N 1.33 0.05 0.00 5.45 0.01 -1.26 -5.12 113.70 114.17 2d9b s SER 3 Ca 0.08 0.31 0.00 0.00 1.31 0.00 0.00 55.95 57.66 2d9b s SER 3 Cb -0.18 0.21 0.00 0.00 0.21 0.00 0.00 66.02 66.26 2d9b s SER 3 CO -0.17 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 173.93 2d9b n GLY 4 N 4.43 -0.55 3.24 3.44 0.00 -1.26 -5.05 105.19 109.44 2d9b n GLY 4 Ca -0.22 -2.19 -0.24 0.00 0.00 0.00 0.00 46.02 43.36 2d9b n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d9b s SER 5 N -4.00 2.33 -0.37 1.61 0.01 -1.26 -5.11 113.70 106.91 2d9b s SER 5 Ca 0.00 -0.55 0.02 0.00 1.31 0.00 0.00 55.95 56.74 2d9b s SER 5 Cb 0.00 -0.17 0.11 0.00 0.21 0.00 0.00 66.02 66.17 2d9b s SER 5 CO 0.00 0.11 0.12 -0.55 0.41 0.00 0.00 173.24 173.33 2d9b s SER 6 N -1.33 4.34 0.13 2.44 0.15 -1.26 -5.07 113.70 113.10 2d9b s SER 6 Ca 0.06 -2.19 0.00 0.00 0.70 0.00 0.00 55.95 54.52 2d9b s SER 6 Cb -0.09 -1.33 0.00 0.00 -1.71 0.00 0.00 66.02 62.89 2d9b s SER 6 CO 0.02 -0.35 0.00 0.61 1.20 0.00 0.00 173.24 174.72 2d9b n GLY 7 N 4.17 -2.12 3.80 9.45 0.00 -1.26 -4.86 105.19 114.37 2d9b n GLY 7 Ca 0.03 -1.40 -0.34 0.00 0.00 0.00 0.00 46.02 44.31 2d9b n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2d9b s MET 8 N -1.34 4.01 0.32 1.61 0.00 -1.26 -5.03 119.30 117.60 2d9b s MET 8 Ca 0.00 1.34 -0.06 0.00 0.00 0.00 0.00 55.69 56.97 2d9b s MET 8 Cb 0.00 -2.24 0.00 0.00 0.00 0.00 0.00 34.83 32.59 2d9b s MET 8 CO 0.00 -0.25 0.48 -1.12 0.00 0.00 0.00 175.02 174.13 2d9b s SER 9 N -1.92 0.56 0.04 -1.18 0.01 -1.26 -5.02 113.70 104.93 2d9b s SER 9 Ca 0.63 -1.32 -0.17 0.00 1.31 0.00 0.00 55.95 56.40 2d9b s SER 9 Cb -0.16 0.64 -0.20 0.00 0.21 0.00 0.00 66.02 66.52 2d9b s SER 9 CO 0.20 -1.27 1.20 1.62 0.41 0.00 0.00 173.24 175.40 2d9b h VAL 10 N 2.16 1.36 0.00 3.43 3.04 -2.02 -3.17 116.25 121.05 2d9b h VAL 10 Ca -0.28 -1.95 0.00 0.00 -1.01 0.00 0.00 66.70 63.45 2d9b h VAL 10 Cb 1.24 2.30 0.00 0.00 -2.01 0.00 0.00 31.29 32.83 2d9b h VAL 10 CO 0.39 0.59 -0.09 0.47 -1.01 0.00 0.00 177.57 177.91 2d9b n ASP 11 N -4.16 0.21 0.03 3.17 8.00 -1.26 -3.86 116.55 118.69 2d9b n ASP 11 Ca -0.09 0.39 -0.11 0.00 0.71 0.00 0.00 54.79 55.69 2d9b n ASP 11 Cb 0.66 -0.41 -0.06 0.00 -0.02 0.00 0.00 41.12 41.30 2d9b n ASP 11 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2d9b h ALA 12 N 2.91 -0.01 -0.12 2.24 0.00 -1.95 -1.21 119.26 121.13 2d9b h ALA 12 Ca 0.00 0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.96 2d9b h ALA 12 Cb 0.54 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 2d9b h ALA 12 CO 0.00 -0.52 0.39 -0.24 0.00 0.00 0.00 179.25 178.88 2d9b h VAL 13 N -0.05 0.11 0.11 0.00 3.04 -1.70 -1.99 116.25 115.77 2d9b h VAL 13 Ca 0.03 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.71 2d9b h VAL 13 Cb 0.09 0.64 0.00 0.00 -2.01 0.00 0.00 31.29 30.01 2d9b h VAL 13 CO -0.07 0.00 -0.05 -0.08 -1.01 0.00 0.00 177.57 176.36 2d9b h GLU 14 N 0.00 -0.15 -1.03 4.17 4.81 -1.44 -1.88 114.58 119.06 2d9b h GLU 14 Ca 0.06 0.01 0.29 0.00 -0.13 0.00 0.00 59.36 59.59 2d9b h GLU 14 Cb 0.84 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.20 2d9b h GLU 14 CO -0.00 -0.10 0.73 0.97 -0.73 0.00 0.00 179.01 179.88 2d9b h ILE 15 N -0.54 0.50 0.04 2.32 2.10 -1.29 0.27 117.51 120.92 2d9b h ILE 15 Ca -0.02 -0.02 -0.28 0.00 1.08 0.00 0.00 64.86 65.63 2d9b h ILE 15 Cb 0.12 0.42 0.02 0.00 -1.09 0.00 0.00 36.82 36.30 2d9b h ILE 15 CO 0.03 0.01 -1.11 -0.33 -1.08 0.00 0.00 178.15 175.67 2d9b h GLU 16 N 0.07 0.67 -0.26 2.19 4.39 -1.46 -3.15 114.58 117.03 2d9b h GLU 16 Ca 0.50 -0.78 -0.09 0.00 0.34 0.00 0.00 59.36 59.33 2d9b h GLU 16 Cb 1.88 0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 30.76 2d9b h GLU 16 CO -0.05 1.35 -0.22 1.15 -1.16 0.00 0.00 179.01 180.08 2d9b h THR 17 N 0.34 1.25 -0.68 1.13 2.02 0.31 -2.79 112.91 114.50 2d9b h THR 17 Ca -0.15 -1.19 -0.04 0.00 0.77 0.00 0.00 66.41 65.79 2d9b h THR 17 Cb 1.77 1.30 -0.03 0.00 -1.74 0.00 0.00 68.15 69.45 2d9b h THR 17 CO 0.22 0.38 0.25 -0.07 0.37 0.00 0.00 175.52 176.66 2d9b h LEU 18 N 0.42 0.95 -0.80 2.58 3.38 -1.10 -0.71 115.31 120.04 2d9b h LEU 18 Ca 0.07 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 2d9b h LEU 18 Cb 0.62 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2d9b h LEU 18 CO 0.04 0.88 0.15 0.03 0.09 0.00 0.00 178.44 179.64 2d9b h ARG 19 N 0.97 1.05 -0.36 1.13 3.08 -1.47 -2.09 114.38 116.69 2d9b h ARG 19 Ca 0.22 -0.25 -0.13 0.00 0.07 0.00 0.00 59.98 59.90 2d9b h ARG 19 Cb 0.24 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 2d9b h ARG 19 CO -0.01 0.94 -0.27 0.87 -1.07 0.00 0.00 179.97 180.43 2d9b h LYS 20 N 1.00 0.82 -0.11 0.04 6.56 -1.23 -1.65 116.57 122.00 2d9b h LYS 20 Ca 0.21 -0.40 0.00 0.00 -1.06 0.00 0.00 60.65 59.41 2d9b h LYS 20 Cb 0.36 -0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.01 2d9b h LYS 20 CO 0.00 1.03 0.06 1.15 -2.06 0.00 0.00 179.45 179.64 2d9b h THR 21 N 0.61 1.01 -0.49 -0.16 2.02 -0.94 -2.63 112.91 112.34 2d9b h THR 21 Ca 0.07 -0.05 -0.08 0.00 0.77 0.00 0.00 66.41 67.13 2d9b h THR 21 Cb 0.84 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 68.10 2d9b h THR 21 CO 0.07 0.02 -0.00 0.58 0.37 0.00 0.00 175.52 176.56 2d9b h VAL 22 N 0.13 1.25 -0.97 3.16 2.07 -1.39 -2.75 116.25 117.76 2d9b h VAL 22 Ca 0.04 -1.03 0.12 0.00 0.82 0.00 0.00 66.70 66.65 2d9b h VAL 22 Cb -0.01 0.87 -0.08 0.00 -1.52 0.00 0.00 31.29 30.56 2d9b h VAL 22 CO -0.02 0.36 0.61 -0.33 0.02 0.00 0.00 177.57 178.22 2d9b h GLU 23 N 0.77 0.90 0.12 1.57 5.08 -0.95 -2.39 114.58 119.68 2d9b h GLU 23 Ca 0.15 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2d9b h GLU 23 Cb 0.47 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2d9b h GLU 23 CO 0.02 0.60 -0.06 0.22 -1.00 0.00 0.00 179.01 178.79 2d9b h ASP 24 N 0.93 -0.14 -0.61 1.42 3.58 -1.19 -3.23 116.42 117.19 2d9b h ASP 24 Ca 0.47 -0.35 0.06 0.00 0.42 0.00 0.00 57.03 57.64 2d9b h ASP 24 Cb 0.51 0.04 -0.08 0.00 1.72 0.00 0.00 39.33 41.51 2d9b h ASP 24 CO -0.24 0.30 -0.46 0.22 -2.88 0.00 0.00 179.24 176.18 2d9b h TYR 25 N -0.61 -1.45 -0.99 0.28 3.20 -1.24 0.43 116.97 116.59 2d9b h TYR 25 Ca -0.02 0.09 0.33 0.00 3.14 0.00 0.00 58.73 62.27 2d9b h TYR 25 Cb 0.48 0.71 -0.16 0.00 1.54 0.00 0.00 36.73 39.30 2d9b h TYR 25 CO 0.06 -0.33 0.51 0.74 -1.64 0.00 0.00 178.16 177.50 2d9b h PHE 26 N -0.13 0.81 -0.38 -3.82 0.04 -1.57 0.90 116.94 112.80 2d9b h PHE 26 Ca 0.10 0.04 -0.13 0.00 2.80 0.00 0.00 57.97 60.78 2d9b h PHE 26 Cb 0.39 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.33 2d9b h PHE 26 CO -0.89 -0.25 -0.27 0.00 -0.60 0.00 0.00 178.31 176.31 2d9b h PHE 28 N 0.68 0.36 -0.68 0.00 3.57 0.26 0.07 116.94 121.19 2d9b h PHE 28 Ca 0.08 -0.06 -0.06 0.00 3.53 0.00 0.00 57.97 61.46 2d9b h PHE 28 Cb 0.80 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.42 2d9b h PHE 28 CO 0.04 0.54 0.21 0.00 -2.23 0.00 0.00 178.31 176.87 2d9b h TYR 30 N 1.00 -0.57 0.00 0.00 3.20 -1.20 -1.85 116.97 117.54 2d9b h TYR 30 Ca 0.22 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.05 2d9b h TYR 30 Cb 0.31 0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.76 2d9b h TYR 30 CO 0.02 -0.25 -0.11 0.78 -1.64 0.00 0.00 178.16 176.97 2d9b h GLY 31 N -0.95 0.00 0.99 1.82 0.00 -0.99 -2.00 103.07 101.95 2d9b h GLY 31 Ca -0.06 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.15 2d9b h GLY 31 CO 0.10 0.00 -0.27 1.70 0.00 0.00 0.00 176.54 178.08 2d9b h LYS 32 N 0.00 0.75 0.00 4.80 3.11 -0.69 -2.98 116.57 121.56 2d9b h LYS 32 Ca -0.00 -0.38 -0.07 0.00 -2.81 0.00 0.00 60.65 57.39 2d9b h LYS 32 Cb 0.20 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.42 2d9b h LYS 32 CO 0.01 1.00 -0.33 0.00 -2.81 0.00 0.00 179.45 177.32 2d9b h ALA 33 N 0.74 1.11 -0.05 5.00 0.00 -0.89 -2.82 119.26 122.34 2d9b h ALA 33 Ca 0.06 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 2d9b h ALA 33 Cb 0.83 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2d9b h ALA 33 CO 0.07 0.41 -0.36 -0.07 0.00 0.00 0.00 179.25 179.30 2d9b h LEU 34 N 0.00 0.09 0.00 0.00 3.38 -1.23 -3.47 115.31 114.09 2d9b h LEU 34 Ca -0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2d9b h LEU 34 Cb 0.76 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2d9b h LEU 34 CO 0.04 0.45 0.00 0.61 0.09 0.00 0.00 178.44 179.63 2d9b n GLY 35 N -0.42 1.23 4.02 0.83 0.00 -1.07 -5.10 105.19 104.68 2d9b n GLY 35 Ca -0.02 -0.08 -0.22 0.00 0.00 0.00 0.00 46.02 45.70 2d9b n GLY 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d9b s LYS 36 N -0.50 1.91 0.00 1.61 1.02 -1.16 -5.03 119.74 117.60 2d9b s LYS 36 Ca 0.00 -1.40 0.14 0.00 0.02 0.00 0.00 55.97 54.73 2d9b s LYS 36 Cb 0.00 -2.47 0.29 0.00 -0.52 0.00 0.00 37.83 35.13 2d9b s LYS 36 CO 0.00 -1.22 1.19 0.45 -0.92 0.00 0.00 175.35 174.85 2d9b n SER 37 N -2.59 2.84 -4.16 2.83 2.88 -1.26 -4.82 113.62 109.34 2d9b n SER 37 Ca 0.16 -1.85 -0.10 0.00 -1.33 0.00 0.00 58.87 55.75 2d9b n SER 37 Cb 0.61 -0.19 -0.10 0.00 -0.75 0.00 0.00 64.21 63.78 2d9b n SER 37 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2d9b s THR 38 N -1.09 0.54 0.16 2.46 -4.23 -1.26 -5.14 115.64 107.08 2d9b s THR 38 Ca 0.25 -1.91 -0.30 0.00 -1.18 0.00 0.00 61.69 58.55 2d9b s THR 38 Cb 0.15 -1.73 -0.07 0.00 1.34 0.00 0.00 72.50 72.19 2d9b s THR 38 CO 0.20 -0.82 0.97 0.68 -0.54 0.00 0.00 174.62 175.11 2d9b s VAL 39 N -3.73 4.26 -0.07 2.29 -7.23 -1.26 -4.66 120.40 110.00 2d9b s VAL 39 Ca 0.13 2.01 0.02 0.00 -1.81 0.00 0.00 61.98 62.33 2d9b s VAL 39 Cb 0.06 -4.28 -0.03 0.00 0.56 0.00 0.00 36.38 32.69 2d9b s VAL 39 CO -0.04 0.37 -0.11 -0.69 -0.31 0.00 0.00 175.10 174.32 2d9b s VAL 40 N -0.44 3.30 0.02 1.32 1.01 -1.11 -4.97 120.40 119.53 2d9b s VAL 40 Ca 0.45 -0.62 -0.30 0.00 0.00 0.00 0.00 61.98 61.51 2d9b s VAL 40 Cb -0.25 -2.33 -0.06 0.00 0.00 0.00 0.00 36.38 33.74 2d9b s VAL 40 CO 0.31 0.58 1.43 -2.16 0.00 0.00 0.00 175.10 175.26 2d9b s PRO 41 N -0.52 4.28 -0.32 2.72 0.04 -1.26 -4.12 135.00 135.82 2d9b s PRO 41 Ca 0.07 2.03 -0.29 0.00 0.04 0.00 0.00 61.00 62.85 2d9b s PRO 41 Cb -0.12 -3.54 -0.01 0.00 0.04 0.00 0.00 34.50 30.87 2d9b s PRO 41 CO 0.02 -0.58 1.59 0.08 0.04 0.00 0.00 177.00 178.15 2d9b s VAL 42 N 2.27 3.72 -1.18 -0.36 1.01 -1.26 -4.91 120.40 119.69 2d9b s VAL 42 Ca 0.65 0.77 -0.23 0.00 0.00 0.00 0.00 61.98 63.17 2d9b s VAL 42 Cb -0.33 -3.86 -0.09 0.00 0.00 0.00 0.00 36.38 32.10 2d9b s VAL 42 CO 0.28 -0.48 1.93 -2.16 0.00 0.00 0.00 175.10 174.67 2d9b s PRO 43 N 5.02 2.50 0.14 2.72 0.04 -1.26 -4.79 135.00 139.36 2d9b s PRO 43 Ca 0.70 -1.15 -0.23 0.00 0.04 0.00 0.00 61.00 60.35 2d9b s PRO 43 Cb -0.20 -5.24 -0.01 0.00 0.04 0.00 0.00 34.50 29.09 2d9b s PRO 43 CO 0.31 -3.97 1.64 1.88 0.04 0.00 0.00 177.00 176.90 2d9b h TYR 44 N 9.75 -0.60 -0.55 0.56 0.05 -1.98 0.31 116.97 124.51 2d9b h TYR 44 Ca 0.21 0.03 0.11 0.00 0.05 0.00 0.00 58.73 59.13 2d9b h TYR 44 Cb 0.94 0.29 -0.11 0.00 1.01 0.00 0.00 36.73 38.86 2d9b h TYR 44 CO 1.21 -0.31 -0.24 1.49 -1.05 0.00 0.00 178.16 179.26 2d9b h GLU 45 N -0.29 -0.10 0.59 4.88 4.81 -2.00 0.31 114.58 122.79 2d9b h GLU 45 Ca 0.10 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.31 2d9b h GLU 45 Cb 0.44 0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.85 2d9b h GLU 45 CO -0.30 -0.07 -0.29 0.87 -0.73 0.00 0.00 179.01 178.50 2d9b h LYS 46 N -0.10 -0.77 -1.13 1.92 1.57 -1.82 -3.10 116.57 113.14 2d9b h LYS 46 Ca 0.25 0.05 0.37 0.00 -1.87 0.00 0.00 60.65 59.46 2d9b h LYS 46 Cb 0.50 0.17 -0.14 0.00 0.08 0.00 0.00 32.23 32.84 2d9b h LYS 46 CO -0.62 -0.51 0.69 0.52 -0.57 0.00 0.00 179.45 178.96 2d9b h MET 47 N -1.04 0.19 -0.99 3.15 2.86 -0.12 0.84 114.93 119.82 2d9b h MET 47 Ca -0.08 -0.01 0.10 0.00 -2.06 0.00 0.00 59.70 57.65 2d9b h MET 47 Cb 0.61 -0.04 -0.08 0.00 0.06 0.00 0.00 31.60 32.15 2d9b h MET 47 CO 0.13 0.12 0.62 -0.07 1.06 0.00 0.00 176.91 178.78 2d9b h LEU 48 N 0.19 0.93 0.22 1.22 3.38 -0.31 0.66 115.31 121.61 2d9b h LEU 48 Ca 0.77 0.04 -0.34 0.00 0.09 0.00 0.00 57.88 58.44 2d9b h LEU 48 Cb 2.09 -0.15 0.02 0.00 0.09 0.00 0.00 40.66 42.72 2d9b h LEU 48 CO -0.52 0.52 -1.58 0.03 0.09 0.00 0.00 178.44 176.99 2d9b h ARG 49 N 1.02 0.46 -2.86 1.13 3.08 0.61 -3.40 114.38 114.42 2d9b h ARG 49 Ca 0.47 -0.79 -0.61 0.00 0.07 0.00 0.00 59.98 59.12 2d9b h ARG 49 Cb 0.40 0.30 -0.41 0.00 0.08 0.00 0.00 29.97 30.34 2d9b h ARG 49 CO -0.24 1.37 -0.70 0.34 -1.07 0.00 0.00 179.97 179.68 2d9b s ASP 50 N -7.43 3.79 0.56 7.04 -1.08 -0.19 -4.91 116.67 114.44 2d9b s ASP 50 Ca -0.11 -3.61 0.34 0.00 -0.52 0.00 0.00 52.55 48.65 2d9b s ASP 50 Cb 0.05 -1.27 1.53 0.00 -1.46 0.00 0.00 42.92 41.77 2d9b s ASP 50 CO 0.91 -0.11 2.05 1.56 0.52 0.00 0.00 175.17 180.09 2d9b h GLN 51 N 5.48 0.00 0.65 4.34 4.20 -1.12 -3.17 115.11 125.49 2d9b h GLN 51 Ca 0.18 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.86 2d9b h GLN 51 Cb 0.80 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.59 2d9b h GLN 51 CO 0.61 0.03 -0.31 1.03 -0.67 0.00 0.00 178.83 179.52 2d9b h SER 52 N 0.00 -0.74 -0.79 1.46 0.87 -1.91 -2.85 113.55 109.60 2d9b h SER 52 Ca -0.00 -0.01 0.28 0.00 -1.23 0.00 0.00 61.79 60.83 2d9b h SER 52 Cb 0.43 0.19 -0.09 0.00 -0.44 0.00 0.00 62.40 62.49 2d9b h SER 52 CO 0.00 -0.45 0.50 0.00 -0.53 0.00 0.00 176.83 176.35 2d9b n ALA 53 N -2.54 0.79 -3.66 6.23 0.00 -1.20 -3.83 120.51 116.31 2d9b n ALA 53 Ca -0.13 0.53 -0.09 0.00 0.00 0.00 0.00 53.44 53.75 2d9b n ALA 53 Cb 0.37 -0.63 -0.10 0.00 0.00 0.00 0.00 19.45 19.09 2d9b n ALA 53 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2d9b s VAL 54 N -4.62 -0.56 0.20 0.00 1.01 -1.07 -0.84 120.40 114.51 2d9b s VAL 54 Ca -0.04 0.17 0.04 0.00 0.00 0.00 0.00 61.98 62.15 2d9b s VAL 54 Cb 0.19 -0.64 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 2d9b s VAL 54 CO 0.48 0.07 0.33 -0.69 0.00 0.00 0.00 175.10 175.29 2d9b s VAL 55 N 2.46 5.29 -0.12 2.92 1.01 -0.29 -4.77 120.40 126.90 2d9b s VAL 55 Ca -0.02 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.11 2d9b s VAL 55 Cb -0.12 -3.81 0.02 0.00 0.00 0.00 0.00 36.38 32.47 2d9b s VAL 55 CO -0.12 -0.23 -0.14 -0.69 0.00 0.00 0.00 175.10 173.92 2d9b s VAL 56 N -1.88 1.47 0.17 2.92 1.01 -1.26 -1.85 120.40 120.98 2d9b s VAL 56 Ca 0.34 -0.61 0.10 0.00 0.00 0.00 0.00 61.98 61.82 2d9b s VAL 56 Cb -0.10 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 2d9b s VAL 56 CO 0.29 0.44 -0.18 -1.10 0.00 0.00 0.00 175.10 174.54 2d9b s GLN 57 N 1.14 1.75 0.00 2.72 -0.21 -0.47 -4.71 119.66 119.89 2d9b s GLN 57 Ca -0.03 -1.36 0.00 0.00 0.02 0.00 0.00 55.36 53.98 2d9b s GLN 57 Cb -0.14 -2.01 0.00 0.00 1.00 0.00 0.00 33.01 31.86 2d9b s GLN 57 CO -0.04 0.43 0.00 0.41 -2.12 0.00 0.00 175.29 173.97 2d9b n GLY 58 N 0.33 1.00 3.87 3.09 0.00 -1.26 -0.75 105.19 111.47 2d9b n GLY 58 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 2d9b n GLY 58 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2d9b s LEU 59 N 0.00 3.73 1.23 0.99 1.43 -1.26 -4.58 118.68 120.21 2d9b s LEU 59 Ca 0.00 1.20 -0.20 0.00 -1.03 0.00 0.00 54.13 54.10 2d9b s LEU 59 Cb 0.00 -4.11 0.30 0.00 0.03 0.00 0.00 46.19 42.41 2d9b s LEU 59 CO 0.00 -0.49 1.11 -2.16 0.23 0.00 0.00 176.35 175.05 2d9b s PRO 60 N -4.09 -1.42 0.48 1.29 0.04 -1.26 -5.02 135.00 125.02 2d9b s PRO 60 Ca 0.52 -0.15 -0.14 0.00 0.04 0.00 0.00 61.00 61.27 2d9b s PRO 60 Cb -0.10 -1.58 -0.07 0.00 0.04 0.00 0.00 34.50 32.78 2d9b s PRO 60 CO 0.35 -3.83 0.91 -2.00 0.04 0.00 0.00 177.00 172.47 2d9b s GLU 61 N -5.47 3.89 -1.89 4.56 2.56 -1.26 -3.76 118.70 117.32 2d9b s GLU 61 Ca 0.72 0.78 0.00 0.00 0.00 0.00 0.00 54.97 56.47 2d9b s GLU 61 Cb -0.08 -2.22 0.00 0.00 2.00 0.00 0.00 34.13 33.82 2d9b s GLU 61 CO 0.56 -0.19 0.00 0.41 -0.56 0.00 0.00 175.26 175.48 2d9b n GLY 62 N -1.49 1.07 3.62 -1.50 0.00 -1.26 -4.96 105.19 100.67 2d9b n GLY 62 Ca 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 2d9b n GLY 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d9b s VAL 63 N -2.72 2.58 -0.12 1.61 0.11 -1.25 -5.14 120.40 115.47 2d9b s VAL 63 Ca 0.00 -2.01 -0.04 0.00 -2.93 0.00 0.00 61.98 57.00 2d9b s VAL 63 Cb 0.00 -2.77 0.06 0.00 -1.53 0.00 0.00 36.38 32.14 2d9b s VAL 63 CO 0.00 -0.20 0.20 0.00 -3.33 0.00 0.00 175.10 171.76 2d9b s ALA 64 N -2.53 -0.27 -0.35 1.54 0.00 -1.26 -4.98 121.76 113.91 2d9b s ALA 64 Ca 0.34 0.58 -0.34 0.00 0.00 0.00 0.00 51.96 52.55 2d9b s ALA 64 Cb 0.00 -0.97 -0.15 0.00 0.00 0.00 0.00 23.12 22.01 2d9b s ALA 64 CO 0.19 -0.72 1.15 0.34 0.00 0.00 0.00 175.76 176.72 2d9b n PHE 65 N 5.33 1.24 -3.77 0.00 7.35 -1.26 -4.88 117.46 121.47 2d9b n PHE 65 Ca -0.05 0.84 -0.03 0.00 -0.76 0.00 0.00 57.45 57.44 2d9b n PHE 65 Cb 0.50 -1.63 -0.01 0.00 0.35 0.00 0.00 39.48 38.69 2d9b n PHE 65 CO 0.00 0.00 0.00 -1.59 -0.76 0.00 0.00 176.76 174.41 2d9b s LYS 66 N 2.07 1.20 0.28 -4.13 -2.85 -1.26 -5.06 119.74 110.00 2d9b s LYS 66 Ca 0.76 -0.69 -0.26 0.00 -1.00 0.00 0.00 55.97 54.79 2d9b s LYS 66 Cb -1.09 0.39 -0.16 0.00 -2.06 0.00 0.00 37.83 34.92 2d9b s LYS 66 CO 0.59 -0.55 0.56 1.58 0.10 0.00 0.00 175.35 177.62 2d9b n HIS 67 N -0.51 -0.38 0.74 1.78 -0.00 -1.26 -4.79 115.22 110.79 2d9b n HIS 67 Ca -0.06 0.81 0.07 0.00 -0.00 0.00 0.00 57.72 58.55 2d9b n HIS 67 Cb 0.61 -1.99 0.39 0.00 -0.00 0.00 0.00 29.99 28.99 2d9b n HIS 67 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 2d9b n PRO 68 N 0.93 0.25 0.03 1.57 -0.04 -1.26 -1.97 135.00 134.51 2d9b n PRO 68 Ca 0.14 0.12 0.11 0.00 -0.04 0.00 0.00 63.50 63.84 2d9b n PRO 68 Cb 0.31 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.30 2d9b n PRO 68 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2d9b n GLU 69 N -1.24 0.27 0.04 0.54 0.28 -1.26 -3.91 120.64 115.35 2d9b n GLU 69 Ca 0.08 -0.00 0.13 0.00 -0.16 0.00 0.00 57.16 57.20 2d9b n GLU 69 Cb 0.11 -1.59 0.35 0.00 1.43 0.00 0.00 31.44 31.73 2d9b n GLU 69 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 2d9b n ASN 70 N -1.93 0.50 -4.70 -1.84 2.85 -0.83 -4.81 115.26 104.49 2d9b n ASN 70 Ca 0.02 0.20 -0.39 0.00 -0.11 0.00 0.00 54.58 54.30 2d9b n ASN 70 Cb 0.43 -0.16 -0.06 0.00 1.24 0.00 0.00 39.78 41.24 2d9b n ASN 70 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 2d9b s TYR 71 N -3.07 3.50 0.51 1.20 2.02 -1.25 -5.04 117.35 115.22 2d9b s TYR 71 Ca 0.10 1.01 -0.22 0.00 -0.37 0.00 0.00 57.07 57.59 2d9b s TYR 71 Cb 0.16 -2.69 -0.07 0.00 -0.40 0.00 0.00 41.96 38.95 2d9b s TYR 71 CO 0.65 0.06 1.18 -0.25 -1.57 0.00 0.00 175.55 175.61 2d9b n ASP 72 N 4.04 1.91 -0.29 2.29 8.00 -1.26 -4.41 116.55 126.83 2d9b n ASP 72 Ca -0.04 0.97 0.08 0.00 0.71 0.00 0.00 54.79 56.51 2d9b n ASP 72 Cb 0.51 -1.47 0.16 0.00 -0.02 0.00 0.00 41.12 40.30 2d9b n ASP 72 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2d9b n LEU 73 N -0.39 -0.22 0.06 0.64 7.94 -1.26 0.85 117.00 124.62 2d9b n LEU 73 Ca 0.10 1.39 -0.11 0.00 -1.11 0.00 0.00 56.01 56.28 2d9b n LEU 73 Cb 0.43 -0.45 -0.05 0.00 0.53 0.00 0.00 43.42 43.88 2d9b n LEU 73 CO 0.54 -1.36 0.74 0.00 -1.11 0.00 0.00 177.39 176.21 2d9b h ALA 74 N 1.62 -0.23 -0.40 1.96 0.00 -2.01 -2.47 119.26 117.73 2d9b h ALA 74 Ca 0.43 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.36 2d9b h ALA 74 Cb 0.75 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 2d9b h ALA 74 CO -0.81 -0.67 0.23 1.15 0.00 0.00 0.00 179.25 179.15 2d9b h THR 75 N -0.30 1.03 -0.70 0.00 2.02 0.14 -2.62 112.91 112.49 2d9b h THR 75 Ca 0.05 -0.16 0.15 0.00 0.77 0.00 0.00 66.41 67.22 2d9b h THR 75 Cb 0.36 0.52 -0.12 0.00 -1.74 0.00 0.00 68.15 67.18 2d9b h THR 75 CO -0.16 0.09 -0.01 -0.07 0.37 0.00 0.00 175.52 175.74 2d9b h LEU 76 N 0.47 -0.33 -0.35 2.58 3.38 -0.57 -0.05 115.31 120.43 2d9b h LEU 76 Ca 0.16 0.18 0.06 0.00 0.09 0.00 0.00 57.88 58.37 2d9b h LEU 76 Cb 0.02 0.32 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 2d9b h LEU 76 CO -0.08 -0.15 0.04 0.11 0.09 0.00 0.00 178.44 178.45 2d9b h LYS 77 N 0.10 0.14 -0.07 1.13 1.57 -1.07 -2.84 116.57 115.54 2d9b h LYS 77 Ca 0.37 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.17 2d9b h LYS 77 Cb 0.63 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.85 2d9b h LYS 77 CO -0.61 0.09 -0.51 2.35 -0.57 0.00 0.00 179.45 180.20 2d9b h TRP 78 N 0.15 -1.52 -0.95 -1.35 7.01 -0.89 -0.58 115.95 117.82 2d9b h TRP 78 Ca 0.17 0.05 0.15 0.00 2.11 0.00 0.00 58.89 61.38 2d9b h TRP 78 Cb 0.21 0.67 -0.16 0.00 -2.10 0.00 0.00 29.16 27.79 2d9b h TRP 78 CO -0.21 -0.53 -0.37 0.82 -2.79 0.00 0.00 178.44 175.35 2d9b h ILE 79 N -0.60 0.02 -0.90 2.65 2.04 -1.23 0.84 117.51 120.34 2d9b h ILE 79 Ca 0.02 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.92 2d9b h ILE 79 Cb 0.67 0.02 -0.05 0.00 -0.74 0.00 0.00 36.82 36.72 2d9b h ILE 79 CO -0.38 0.00 0.59 -0.07 0.00 0.00 0.00 178.15 178.29 2d9b h LEU 80 N -0.02 0.97 0.47 1.44 3.38 -1.22 0.31 115.31 120.65 2d9b h LEU 80 Ca 0.34 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.28 2d9b h LEU 80 Cb 0.60 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2d9b h LEU 80 CO -0.96 0.67 -0.23 -0.33 0.09 0.00 0.00 178.44 177.68 2d9b h GLU 81 N 1.13 -0.61 -1.02 1.13 5.08 0.21 -3.11 114.58 117.39 2d9b h GLU 81 Ca 0.36 0.04 -0.65 0.00 -1.00 0.00 0.00 59.36 58.11 2d9b h GLU 81 Cb 0.02 0.14 -0.28 0.00 0.50 0.00 0.00 28.75 29.13 2d9b h GLU 81 CO -0.11 -0.34 0.84 0.09 -1.00 0.00 0.00 179.01 178.49 2d9b n ASN 82 N -5.30 7.26 0.01 1.42 5.03 0.24 -4.52 115.26 119.39 2d9b n ASN 82 Ca -0.11 -3.74 -0.18 0.00 0.87 0.00 0.00 54.58 51.43 2d9b n ASN 82 Cb 0.29 -0.97 -0.12 0.00 -1.02 0.00 0.00 39.78 37.96 2d9b n ASN 82 CO 0.00 0.00 0.00 0.07 -1.83 0.00 0.00 177.26 175.50 2d9b h LYS 83 N 1.87 0.30 -1.25 3.52 2.10 -0.30 -3.18 116.57 119.63 2d9b h LYS 83 Ca 0.60 -0.38 0.39 0.00 -2.00 0.00 0.00 60.65 59.26 2d9b h LYS 83 Cb 1.02 0.12 -0.12 0.00 -0.90 0.00 0.00 32.23 32.36 2d9b h LYS 83 CO 1.51 1.10 0.81 0.00 -2.00 0.00 0.00 179.45 180.87 2d9b h ALA 84 N 0.21 2.62 0.11 0.07 0.00 -1.81 0.59 119.26 121.04 2d9b h ALA 84 Ca -0.08 0.10 -0.27 0.00 0.00 0.00 0.00 54.91 54.66 2d9b h ALA 84 Cb 1.33 0.16 0.01 0.00 0.00 0.00 0.00 17.79 19.28 2d9b h ALA 84 CO 0.11 -1.18 -1.18 0.78 0.00 0.00 0.00 179.25 177.77 2d9b h GLY 85 N 0.16 0.35 -5.90 0.00 0.00 -1.92 -3.45 103.07 92.32 2d9b h GLY 85 Ca 0.75 -0.82 -0.69 0.00 0.00 0.00 0.00 47.33 46.57 2d9b h GLY 85 CO -0.37 0.72 0.79 1.39 0.00 0.00 0.00 176.54 179.06 2d9b n ILE 86 N -3.59 0.23 -4.46 2.60 5.41 0.20 -4.72 119.36 115.04 2d9b n ILE 86 Ca -0.08 -0.04 -0.22 0.00 1.00 0.00 0.00 62.75 63.40 2d9b n ILE 86 Cb 0.98 -1.21 -0.11 0.00 -0.71 0.00 0.00 39.64 38.60 2d9b n ILE 86 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 2d9b s SER 87 N 2.52 2.72 -0.06 4.38 0.01 0.07 -4.98 113.70 118.36 2d9b s SER 87 Ca 0.92 -1.29 0.01 0.00 1.31 0.00 0.00 55.95 56.90 2d9b s SER 87 Cb -0.96 -0.16 0.02 0.00 0.21 0.00 0.00 66.02 65.13 2d9b s SER 87 CO 0.56 -0.47 -0.06 -0.36 0.41 0.00 0.00 173.24 173.32 2d9b s PHE 88 N -3.10 0.95 -0.32 2.43 0.40 -1.26 -1.37 117.98 115.71 2d9b s PHE 88 Ca 0.33 -0.31 -0.05 0.00 -0.60 0.00 0.00 56.93 56.29 2d9b s PHE 88 Cb 0.07 -0.80 0.04 0.00 0.51 0.00 0.00 43.02 42.83 2d9b s PHE 88 CO 0.14 -0.24 0.07 0.42 0.70 0.00 0.00 175.22 176.31 2d9b s ILE 89 N 0.98 3.60 -0.41 0.64 1.09 -0.77 -4.82 121.20 121.51 2d9b s ILE 89 Ca -0.10 -1.10 -0.26 0.00 -1.10 0.00 0.00 60.65 58.09 2d9b s ILE 89 Cb -0.14 -3.00 0.02 0.00 -1.06 0.00 0.00 42.46 38.27 2d9b s ILE 89 CO 0.00 -0.10 0.95 -0.63 -0.10 0.00 0.00 174.94 175.06 2d9b s ILE 90 N 1.38 4.51 -0.06 2.92 1.09 -1.26 -1.14 121.20 128.63 2d9b s ILE 90 Ca -0.02 1.06 0.06 0.00 -1.10 0.00 0.00 60.65 60.65 2d9b s ILE 90 Cb -0.19 -4.40 -0.24 0.00 -1.06 0.00 0.00 42.46 36.57 2d9b s ILE 90 CO 0.02 -0.68 0.58 0.11 -0.10 0.00 0.00 174.94 174.86 2d9b h LYS 91 N 8.75 0.09 -1.00 2.79 1.79 -1.16 -3.49 116.57 124.34 2d9b h LYS 91 Ca -0.23 -0.16 0.21 0.00 -2.18 0.00 0.00 60.65 58.29 2d9b h LYS 91 Cb 1.08 0.06 -0.33 0.00 -1.58 0.00 0.00 32.23 31.45 2d9b h LYS 91 CO 1.01 0.74 0.76 0.50 -1.08 0.00 0.00 179.45 181.38 2d9b s ARG 92 N -2.59 0.03 -0.04 3.15 3.00 -0.62 -4.98 118.95 116.90 2d9b s ARG 92 Ca -0.10 0.05 -0.30 0.00 -1.00 0.00 0.00 55.73 54.38 2d9b s ARG 92 Cb 0.08 0.01 -0.05 0.00 0.00 0.00 0.00 34.95 34.98 2d9b s ARG 92 CO 0.81 -0.01 1.49 -1.25 0.00 0.00 0.00 175.30 176.34 2d9b s PRO 93 N 1.07 4.23 0.59 5.12 0.04 -1.26 -4.37 135.00 140.42 2d9b s PRO 93 Ca -0.08 2.02 -0.15 0.00 0.04 0.00 0.00 61.00 62.83 2d9b s PRO 93 Cb -0.02 -3.76 -0.13 0.00 0.04 0.00 0.00 34.50 30.63 2d9b s PRO 93 CO -0.10 -0.71 -0.32 1.19 0.04 0.00 0.00 177.00 177.10 2d9b n PHE 94 N 6.26 -3.25 -1.98 0.56 3.01 -1.26 -4.82 117.46 115.98 2d9b n PHE 94 Ca 0.15 0.24 -0.38 0.00 1.01 0.00 0.00 57.45 58.47 2d9b n PHE 94 Cb 0.43 -1.39 0.01 0.00 -0.01 0.00 0.00 39.48 38.53 2d9b n PHE 94 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2d9b s LEU 95 N 5.29 4.01 -0.05 4.37 1.43 -1.26 -5.03 118.68 127.45 2d9b s LEU 95 Ca 0.44 2.63 -0.30 0.00 -1.03 0.00 0.00 54.13 55.88 2d9b s LEU 95 Cb -0.33 -4.14 0.07 0.00 0.03 0.00 0.00 46.19 41.82 2d9b s LEU 95 CO 0.63 -1.18 0.65 -1.83 0.23 0.00 0.00 176.35 174.85 2d9b s GLU 96 N -2.63 1.03 0.96 1.70 4.04 -1.26 -5.17 118.70 117.35 2d9b s GLU 96 Ca 0.65 0.23 -0.12 0.00 0.04 0.00 0.00 54.97 55.76 2d9b s GLU 96 Cb -0.37 0.48 0.16 0.00 0.02 0.00 0.00 34.13 34.43 2d9b s GLU 96 CO 0.45 -0.32 1.09 -1.25 -1.84 0.00 0.00 175.26 173.40 2d9b s PRO 97 N -1.19 0.77 -0.31 -4.83 0.04 -1.26 -4.98 135.00 123.24 2d9b s PRO 97 Ca -0.11 0.64 0.09 0.00 0.04 0.00 0.00 61.00 61.66 2d9b s PRO 97 Cb -0.00 -1.77 0.58 0.00 0.04 0.00 0.00 34.50 33.34 2d9b s PRO 97 CO 0.09 -2.53 1.60 0.36 0.04 0.00 0.00 177.00 176.57 2d9b n LYS 98 N -4.05 2.34 -4.26 4.56 2.85 -1.26 -4.97 118.16 113.37 2d9b n LYS 98 Ca 0.06 -3.08 -0.20 0.00 -1.05 0.00 0.00 58.31 54.04 2d9b n LYS 98 Cb 0.56 -1.95 -0.12 0.00 -0.65 0.00 0.00 35.03 32.87 2d9b n LYS 98 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2d9b s LYS 99 N -3.16 0.92 -0.09 -1.58 1.02 -1.26 -5.07 119.74 110.52 2d9b s LYS 99 Ca 0.48 -0.93 -0.11 0.00 0.02 0.00 0.00 55.97 55.43 2d9b s LYS 99 Cb 0.42 -0.98 -0.04 0.00 -0.52 0.00 0.00 37.83 36.71 2d9b s LYS 99 CO 0.05 0.23 -0.22 1.58 -0.92 0.00 0.00 175.35 176.07 2d9b n HIS 100 N 1.44 0.00 -3.87 3.18 -0.00 -1.26 -5.03 115.22 109.68 2d9b n HIS 100 Ca -0.20 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.23 2d9b n HIS 100 Cb 0.54 -0.31 -0.04 0.00 -0.00 0.00 0.00 29.99 30.19 2d9b n HIS 100 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.34 176.48 2d9b s VAL 101 N -2.43 5.32 0.09 3.57 -7.23 -1.26 -4.92 120.40 113.53 2d9b s VAL 101 Ca -0.18 -0.44 0.00 0.00 -1.81 0.00 0.00 61.98 59.55 2d9b s VAL 101 Cb 0.02 -3.68 0.00 0.00 0.56 0.00 0.00 36.38 33.28 2d9b s VAL 101 CO 0.27 0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.67 2d9b n GLY 102 N -0.15 -1.46 3.23 2.32 0.00 -1.26 -5.16 105.19 102.71 2d9b n GLY 102 Ca -0.05 0.56 -0.14 0.00 0.00 0.00 0.00 46.02 46.38 2d9b n GLY 102 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2d9b s GLY 103 N -2.00 1.01 -0.10 -0.02 0.00 -1.26 -5.07 107.32 99.88 2d9b s GLY 103 Ca 0.00 -1.41 -0.03 0.00 0.00 0.00 0.00 44.72 43.28 2d9b s GLY 103 CO 0.00 -1.50 -0.12 -1.14 0.00 0.00 0.00 173.10 170.34 2d9b n SER 104 N 0.02 1.49 0.00 1.64 3.41 -1.26 -5.15 113.62 113.76 2d9b n SER 104 Ca -0.12 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 2d9b n SER 104 Cb 0.60 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.29 2d9b n SER 104 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d9b n GLY 105 N 2.57 2.57 0.08 5.00 0.00 -1.26 -4.73 105.19 109.41 2d9b n GLY 105 Ca -0.19 -1.66 -0.13 0.00 0.00 0.00 0.00 46.02 44.05 2d9b n GLY 105 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d9b h PRO 106 N 0.00 -0.06 -0.31 1.61 0.13 -2.02 -3.31 132.00 128.04 2d9b h PRO 106 Ca 0.00 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 65.20 2d9b h PRO 106 Cb 0.00 0.01 -0.08 0.00 0.13 0.00 0.00 31.00 31.06 2d9b h PRO 106 CO 0.00 0.40 -0.37 0.66 -0.23 0.00 0.00 178.00 178.46 2d9b h SER 107 N -0.54 -1.22 -1.37 1.44 4.64 -2.08 -3.21 113.55 111.21 2d9b h SER 107 Ca -0.01 0.19 -0.66 0.00 -0.47 0.00 0.00 61.79 60.84 2d9b h SER 107 Cb 0.49 0.54 -0.12 0.00 -0.31 0.00 0.00 62.40 63.00 2d9b h SER 107 CO 0.01 -0.36 1.62 -0.55 -0.87 0.00 0.00 176.83 176.68 2d9b s SER 108 N -5.01 6.72 0.00 4.97 0.15 -1.25 -5.28 113.70 114.00 2d9b s SER 108 Ca -0.15 -2.11 0.22 0.00 0.70 0.00 0.00 55.95 54.62 2d9b s SER 108 Cb 0.12 -2.52 0.18 0.00 -1.71 0.00 0.00 66.02 62.08 2d9b s SER 108 CO 0.66 -1.22 1.21 0.61 1.20 0.00 0.00 173.24 175.70