#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 3.30 -0.41 1.61 0.01 -1.26 -5.11 113.70 111.84 2d9b s SER 2 Ca 0.00 -0.85 -0.20 0.00 1.31 0.00 0.00 55.95 56.21 2d9b s SER 2 Cb 0.00 -0.24 0.02 0.00 0.21 0.00 0.00 66.02 66.01 2d9b s SER 2 CO 0.00 0.10 0.59 -0.44 0.41 0.00 0.00 173.24 173.90 2d9b s SER 3 N -2.61 6.31 -0.74 2.44 0.01 -1.26 -5.01 113.70 112.84 2d9b s SER 3 Ca 0.19 -0.31 -0.26 0.00 1.31 0.00 0.00 55.95 56.89 2d9b s SER 3 Cb -0.08 -2.30 0.00 0.00 0.21 0.00 0.00 66.02 63.86 2d9b s SER 3 CO 0.09 -0.68 1.61 -0.83 0.41 0.00 0.00 173.24 173.84 2d9b s GLY 4 N 1.91 0.57 -0.36 3.44 0.00 -1.26 -4.88 107.32 106.74 2d9b s GLY 4 Ca 0.20 -1.21 -0.15 0.00 0.00 0.00 0.00 44.72 43.56 2d9b s GLY 4 CO 0.17 3.07 0.34 -0.56 0.00 0.00 0.00 173.10 176.12 2d9b s SER 5 N 6.15 6.15 0.65 1.64 0.01 -1.26 -5.06 113.70 121.98 2d9b s SER 5 Ca 0.53 -0.38 -0.17 0.00 1.31 0.00 0.00 55.95 57.25 2d9b s SER 5 Cb -0.09 -2.19 -0.00 0.00 0.21 0.00 0.00 66.02 63.95 2d9b s SER 5 CO 0.12 -0.36 1.17 -0.94 0.41 0.00 0.00 173.24 173.65 2d9b s SER 6 N 1.74 4.89 0.00 2.44 1.04 -1.26 -3.71 113.70 118.83 2d9b s SER 6 Ca 0.10 2.25 0.00 0.00 0.48 0.00 0.00 55.95 58.78 2d9b s SER 6 Cb -0.17 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.37 2d9b s SER 6 CO 0.12 -1.79 0.00 0.61 0.98 0.00 0.00 173.24 173.15 2d9b n GLY 7 N 0.16 0.85 2.94 7.32 0.00 -1.26 -4.45 105.19 110.76 2d9b n GLY 7 Ca 0.12 -0.75 -0.19 0.00 0.00 0.00 0.00 46.02 45.20 2d9b n GLY 7 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2d9b n MET 8 N -0.13 -1.23 -0.60 1.61 3.85 -1.26 -4.80 117.12 114.56 2d9b n MET 8 Ca 0.00 0.06 -0.31 0.00 -1.00 0.00 0.00 57.70 56.45 2d9b n MET 8 Cb 0.05 -2.93 0.20 0.00 -1.05 0.00 0.00 33.22 29.49 2d9b n MET 8 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 2d9b n SER 9 N -1.17 -2.12 -0.31 3.17 2.88 -1.24 -4.79 113.62 110.04 2d9b n SER 9 Ca 0.05 -0.12 -0.05 0.00 -1.33 0.00 0.00 58.87 57.42 2d9b n SER 9 Cb 0.29 -1.08 0.08 0.00 -0.75 0.00 0.00 64.21 62.75 2d9b n SER 9 CO 0.00 0.00 0.00 1.62 -1.23 0.00 0.00 175.04 175.43 2d9b h VAL 10 N -2.29 1.26 -0.01 2.46 3.04 -1.88 -1.55 116.25 117.28 2d9b h VAL 10 Ca -0.56 -0.76 0.00 0.00 -1.01 0.00 0.00 66.70 64.37 2d9b h VAL 10 Cb 1.35 0.21 0.00 0.00 -2.01 0.00 0.00 31.29 30.83 2d9b h VAL 10 CO 0.42 0.32 -0.02 0.47 -1.01 0.00 0.00 177.57 177.75 2d9b n ASP 11 N -4.30 0.68 -0.02 3.17 8.00 -1.26 -3.93 116.55 118.89 2d9b n ASP 11 Ca 0.08 -1.10 -0.12 0.00 0.71 0.00 0.00 54.79 54.35 2d9b n ASP 11 Cb 0.15 -0.01 -0.08 0.00 -0.02 0.00 0.00 41.12 41.16 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 4.06 0.09 -0.63 2.24 0.00 -1.53 -2.84 119.26 120.64 2d9b h ALA 12 Ca 0.00 -0.19 0.18 0.00 0.00 0.00 0.00 54.91 54.91 2d9b h ALA 12 Cb 0.27 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2d9b h ALA 12 CO 0.00 -0.22 0.53 -0.24 0.00 0.00 0.00 179.25 179.32 2d9b h VAL 13 N -0.18 0.50 0.86 0.00 3.04 -1.68 -2.10 116.25 116.68 2d9b h VAL 13 Ca 0.02 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.67 2d9b h VAL 13 Cb 0.37 0.61 0.01 0.00 -2.01 0.00 0.00 31.29 30.26 2d9b h VAL 13 CO 0.00 0.00 -0.41 -0.08 -1.01 0.00 0.00 177.57 176.07 2d9b h GLU 14 N 0.00 -1.11 -1.02 4.17 4.81 -1.73 0.16 114.58 119.86 2d9b h GLU 14 Ca 0.30 0.08 0.25 0.00 -0.13 0.00 0.00 59.36 59.85 2d9b h GLU 14 Cb 1.36 0.25 -0.10 0.00 0.63 0.00 0.00 28.75 30.89 2d9b h GLU 14 CO -0.00 -0.74 0.64 0.97 -0.73 0.00 0.00 179.01 179.15 2d9b h ILE 15 N -1.23 0.57 -0.18 2.32 2.10 -1.44 0.17 117.51 119.82 2d9b h ILE 15 Ca -0.12 -0.16 -0.17 0.00 1.08 0.00 0.00 64.86 65.49 2d9b h ILE 15 Cb 0.88 0.06 0.00 0.00 -1.09 0.00 0.00 36.82 36.67 2d9b h ILE 15 CO 0.19 0.09 -0.55 -0.33 -1.08 0.00 0.00 178.15 176.47 2d9b h GLU 16 N 0.47 0.70 -0.60 2.19 5.08 -1.32 -3.08 114.58 118.01 2d9b h GLU 16 Ca 0.59 -0.50 -0.07 0.00 -1.00 0.00 0.00 59.36 58.38 2d9b h GLU 16 Cb 1.35 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.66 2d9b h GLU 16 CO -0.32 1.12 0.11 1.15 -1.00 0.00 0.00 179.01 180.07 2d9b h THR 17 N 0.39 1.25 -0.52 1.13 2.02 0.18 -2.36 112.91 115.01 2d9b h THR 17 Ca -0.02 -0.95 -0.01 0.00 0.77 0.00 0.00 66.41 66.20 2d9b h THR 17 Cb 1.17 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 68.23 2d9b h THR 17 CO 0.12 0.35 0.29 -0.07 0.37 0.00 0.00 175.52 176.59 2d9b h LEU 18 N 0.91 0.63 -0.22 2.58 3.38 -0.81 -2.32 115.31 119.47 2d9b h LEU 18 Ca 0.19 -0.04 -0.17 0.00 0.09 0.00 0.00 57.88 57.95 2d9b h LEU 18 Cb 0.38 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2d9b h LEU 18 CO 0.01 0.51 -0.53 0.03 0.09 0.00 0.00 178.44 178.54 2d9b h ARG 19 N 0.72 0.75 -0.98 1.13 3.08 -1.37 -3.01 114.38 114.70 2d9b h ARG 19 Ca 0.19 -0.51 0.05 0.00 0.07 0.00 0.00 59.98 59.77 2d9b h ARG 19 Cb 0.01 0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.07 2d9b h ARG 19 CO -0.03 1.14 0.64 0.87 -1.07 0.00 0.00 179.97 181.51 2d9b h LYS 20 N 0.48 1.16 -0.46 0.04 1.57 -0.98 0.12 116.57 118.51 2d9b h LYS 20 Ca -0.00 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 2d9b h LYS 20 Cb 1.15 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 33.17 2d9b h LYS 20 CO 0.12 0.77 0.15 1.15 -0.57 0.00 0.00 179.45 181.07 2d9b h THR 21 N 1.20 1.22 -0.10 -0.16 2.02 -1.41 -2.42 112.91 113.26 2d9b h THR 21 Ca 0.40 -0.72 -0.13 0.00 0.77 0.00 0.00 66.41 66.73 2d9b h THR 21 Cb 0.07 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 2d9b h THR 21 CO -0.14 0.26 -0.51 0.58 0.37 0.00 0.00 175.52 176.08 2d9b h VAL 22 N 0.61 1.35 -0.84 3.16 2.07 -1.28 -2.79 116.25 118.53 2d9b h VAL 22 Ca 0.15 -1.77 -0.03 0.00 0.82 0.00 0.00 66.70 65.87 2d9b h VAL 22 Cb 0.25 1.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.82 2d9b h VAL 22 CO -0.01 0.53 0.40 -0.33 0.02 0.00 0.00 177.57 178.18 2d9b h GLU 23 N 0.21 1.22 -0.14 1.57 5.08 -0.52 -2.77 114.58 119.22 2d9b h GLU 23 Ca 0.01 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.14 2d9b h GLU 23 Cb 0.98 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 30.01 2d9b h GLU 23 CO 0.08 0.94 -0.09 0.22 -1.00 0.00 0.00 179.01 179.16 2d9b h ASP 24 N 1.20 0.32 -0.14 1.42 3.58 -1.35 -3.23 116.42 118.23 2d9b h ASP 24 Ca 0.29 -0.43 0.02 0.00 0.42 0.00 0.00 57.03 57.33 2d9b h ASP 24 Cb 0.12 -0.09 -0.05 0.00 1.72 0.00 0.00 39.33 41.03 2d9b h ASP 24 CO -0.04 0.68 -0.39 0.22 -2.88 0.00 0.00 179.24 176.83 2d9b h TYR 25 N -0.04 -1.18 -1.18 0.28 3.20 -1.33 0.65 116.97 117.37 2d9b h TYR 25 Ca 0.03 0.05 0.41 0.00 3.14 0.00 0.00 58.73 62.36 2d9b h TYR 25 Cb 0.57 0.53 -0.14 0.00 1.54 0.00 0.00 36.73 39.23 2d9b h TYR 25 CO 0.07 -0.38 0.72 0.74 -1.64 0.00 0.00 178.16 177.67 2d9b h PHE 26 N -0.39 0.68 -0.30 -3.82 0.04 -1.58 0.85 116.94 112.42 2d9b h PHE 26 Ca 0.03 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.74 2d9b h PHE 26 Cb 0.48 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 38.45 2d9b h PHE 26 CO -0.58 -0.27 -0.17 0.00 -0.60 0.00 0.00 178.31 176.70 2d9b h PHE 28 N 0.40 -0.32 -0.70 0.00 3.57 0.19 0.12 116.94 120.20 2d9b h PHE 28 Ca 0.06 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.60 2d9b h PHE 28 Cb 0.70 0.11 -0.05 0.00 2.79 0.00 0.00 35.95 39.50 2d9b h PHE 28 CO 0.06 -0.19 0.42 0.00 -2.23 0.00 0.00 178.31 176.37 2d9b h TYR 30 N 0.81 -0.90 0.00 0.00 3.20 -1.13 -1.04 116.97 117.90 2d9b h TYR 30 Ca 0.30 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 2d9b h TYR 30 Cb 0.09 0.30 -0.00 0.00 1.54 0.00 0.00 36.73 38.66 2d9b h TYR 30 CO -0.05 -0.56 -0.04 0.78 -1.64 0.00 0.00 178.16 176.64 2d9b h GLY 31 N -1.15 0.00 0.97 1.82 0.00 -0.68 -2.12 103.07 101.91 2d9b h GLY 31 Ca -0.10 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.09 2d9b h GLY 31 CO 0.16 0.00 -0.40 1.70 0.00 0.00 0.00 176.54 178.01 2d9b h LYS 32 N 0.00 0.67 0.00 4.80 3.11 0.28 -3.04 116.57 122.39 2d9b h LYS 32 Ca -0.00 -0.42 -0.04 0.00 -2.81 0.00 0.00 60.65 57.38 2d9b h LYS 32 Cb 0.09 0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.37 2d9b h LYS 32 CO 0.01 1.03 -0.21 0.00 -2.81 0.00 0.00 179.45 177.47 2d9b h ALA 33 N 0.63 1.08 0.00 5.00 0.00 -0.63 -2.72 119.26 122.61 2d9b h ALA 33 Ca 0.01 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 2d9b h ALA 33 Cb 0.99 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2d9b h ALA 33 CO 0.09 0.26 -0.49 -0.07 0.00 0.00 0.00 179.25 179.04 2d9b h LEU 34 N 0.00 0.00 0.00 0.00 3.38 -1.29 -3.47 115.31 113.93 2d9b h LEU 34 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2d9b h LEU 34 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 2d9b h LEU 34 CO 0.03 0.49 0.00 0.61 0.09 0.00 0.00 178.44 179.66 2d9b n GLY 35 N 0.11 1.01 3.99 0.83 0.00 -1.03 -5.09 105.19 105.01 2d9b n GLY 35 Ca -0.01 -0.36 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 2d9b n GLY 35 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2d9b n LYS 36 N -1.88 -0.18 -0.48 1.61 5.02 -1.17 -5.02 118.16 116.06 2d9b n LYS 36 Ca 0.00 -2.77 0.08 0.00 -2.02 0.00 0.00 58.31 53.60 2d9b n LYS 36 Cb 0.06 -0.71 0.27 0.00 -0.02 0.00 0.00 35.03 34.63 2d9b n LYS 36 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2d9b n SER 37 N -2.94 4.06 -3.81 4.39 7.64 -1.26 -4.86 113.62 116.83 2d9b n SER 37 Ca 0.17 -2.92 -0.10 0.00 1.01 0.00 0.00 58.87 57.02 2d9b n SER 37 Cb 0.61 -0.54 -0.05 0.00 -1.01 0.00 0.00 64.21 63.22 2d9b n SER 37 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2d9b s THR 38 N -2.67 0.00 0.08 0.44 -4.23 -1.26 -5.16 115.64 102.84 2d9b s THR 38 Ca 0.43 -1.47 -0.20 0.00 -1.18 0.00 0.00 61.69 59.26 2d9b s THR 38 Cb 0.33 -2.35 -0.07 0.00 1.34 0.00 0.00 72.50 71.76 2d9b s THR 38 CO 0.11 0.00 0.60 0.68 -0.54 0.00 0.00 174.62 175.46 2d9b s VAL 39 N -3.75 4.71 -0.09 2.29 -7.23 -1.26 -4.58 120.40 110.49 2d9b s VAL 39 Ca 0.25 1.28 0.04 0.00 -1.81 0.00 0.00 61.98 61.74 2d9b s VAL 39 Cb -0.00 -3.93 -0.01 0.00 0.56 0.00 0.00 36.38 32.99 2d9b s VAL 39 CO 0.12 0.54 -0.21 -0.69 -0.31 0.00 0.00 175.10 174.55 2d9b s VAL 40 N -1.03 2.41 0.00 1.32 1.01 -1.18 -4.96 120.40 117.97 2d9b s VAL 40 Ca 0.30 -0.92 -0.30 0.00 0.00 0.00 0.00 61.98 61.06 2d9b s VAL 40 Cb -0.20 -1.93 -0.06 0.00 0.00 0.00 0.00 36.38 34.19 2d9b s VAL 40 CO 0.20 0.56 1.45 -2.16 0.00 0.00 0.00 175.10 175.14 2d9b s PRO 41 N 0.04 4.26 -0.33 2.72 0.04 -1.26 -4.15 135.00 136.31 2d9b s PRO 41 Ca -0.08 2.02 -0.29 0.00 0.04 0.00 0.00 61.00 62.69 2d9b s PRO 41 Cb -0.15 -3.61 -0.01 0.00 0.04 0.00 0.00 34.50 30.78 2d9b s PRO 41 CO 0.05 -0.62 1.52 0.08 0.04 0.00 0.00 177.00 178.07 2d9b s VAL 42 N 2.56 3.81 -1.19 -0.36 1.01 -1.26 -4.91 120.40 120.06 2d9b s VAL 42 Ca 0.65 0.86 -0.23 0.00 0.00 0.00 0.00 61.98 63.27 2d9b s VAL 42 Cb -0.32 -3.97 -0.09 0.00 0.00 0.00 0.00 36.38 31.99 2d9b s VAL 42 CO 0.27 -0.54 1.93 -0.81 0.00 0.00 0.00 175.10 175.95 2d9b n PRO 43 N 7.93 1.61 -0.08 2.72 -0.04 -1.26 -4.78 135.00 141.10 2d9b n PRO 43 Ca 0.18 -2.47 -0.07 0.00 -0.04 0.00 0.00 63.50 61.10 2d9b n PRO 43 Cb 0.47 -3.73 -0.00 0.00 -0.04 0.00 0.00 33.50 30.20 2d9b n PRO 43 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2d9b h TYR 44 N 9.66 -0.35 -0.65 0.54 -1.99 -1.98 0.27 116.97 122.48 2d9b h TYR 44 Ca 0.22 0.03 0.13 0.00 2.00 0.00 0.00 58.73 61.11 2d9b h TYR 44 Cb 0.93 0.20 -0.13 0.00 2.00 0.00 0.00 36.73 39.74 2d9b h TYR 44 CO 1.21 -0.22 -0.23 1.49 -0.00 0.00 0.00 178.16 180.41 2d9b h GLU 45 N -0.10 -0.06 0.50 4.88 4.81 -2.00 0.32 114.58 122.94 2d9b h GLU 45 Ca 0.16 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.37 2d9b h GLU 45 Cb 0.34 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.73 2d9b h GLU 45 CO -0.37 -0.04 -0.24 0.87 -0.73 0.00 0.00 179.01 178.50 2d9b h LYS 46 N -0.06 -0.65 -1.05 1.92 1.57 -1.77 -3.21 116.57 113.32 2d9b h LYS 46 Ca 0.30 0.04 0.38 0.00 -1.87 0.00 0.00 60.65 59.50 2d9b h LYS 46 Cb 0.52 0.15 -0.16 0.00 0.08 0.00 0.00 32.23 32.82 2d9b h LYS 46 CO -0.70 -0.43 0.60 0.52 -0.57 0.00 0.00 179.45 178.87 2d9b h MET 47 N -1.13 0.14 -0.58 3.15 2.86 -0.16 0.65 114.93 119.86 2d9b h MET 47 Ca -0.07 -0.01 0.09 0.00 -2.06 0.00 0.00 59.70 57.65 2d9b h MET 47 Cb 0.52 -0.03 -0.07 0.00 0.06 0.00 0.00 31.60 32.07 2d9b h MET 47 CO 0.11 0.09 0.19 -0.07 1.06 0.00 0.00 176.91 178.30 2d9b h LEU 48 N 0.14 0.16 -0.01 1.22 3.38 -0.36 0.04 115.31 119.89 2d9b h LEU 48 Ca 0.80 0.08 -0.23 0.00 0.09 0.00 0.00 57.88 58.62 2d9b h LEU 48 Cb 2.08 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 42.89 2d9b h LEU 48 CO -0.65 0.10 -1.06 0.03 0.09 0.00 0.00 178.44 176.96 2d9b h ARG 49 N 0.36 0.11 -2.78 1.13 3.08 0.14 -3.40 114.38 113.01 2d9b h ARG 49 Ca 0.29 -0.18 -0.60 0.00 0.07 0.00 0.00 59.98 59.57 2d9b h ARG 49 Cb 0.37 0.06 -0.40 0.00 0.08 0.00 0.00 29.97 30.08 2d9b h ARG 49 CO -0.31 1.06 -0.80 0.34 -1.07 0.00 0.00 179.97 179.19 2d9b s ASP 50 N -6.88 3.24 0.06 7.04 2.15 0.19 -4.96 116.67 117.51 2d9b s ASP 50 Ca -0.01 -2.51 -0.12 0.00 0.43 0.00 0.00 52.55 50.34 2d9b s ASP 50 Cb 0.09 -0.75 -0.28 0.00 -0.30 0.00 0.00 42.92 41.69 2d9b s ASP 50 CO 0.84 -0.27 1.12 1.56 -0.17 0.00 0.00 175.17 178.25 2d9b h GLN 51 N 6.73 0.51 -0.98 4.34 4.20 -1.26 -3.34 115.11 125.32 2d9b h GLN 51 Ca 0.04 -0.73 0.14 0.00 0.06 0.00 0.00 58.65 58.16 2d9b h GLN 51 Cb 0.94 0.25 -0.15 0.00 0.30 0.00 0.00 27.48 28.82 2d9b h GLN 51 CO 0.39 1.33 -0.43 -1.13 -0.67 0.00 0.00 178.83 178.32 2d9b n SER 52 N -3.72 -0.73 -0.23 1.46 3.41 -1.26 0.57 113.62 113.11 2d9b n SER 52 Ca -0.12 1.71 0.22 0.00 -0.26 0.00 0.00 58.87 60.41 2d9b n SER 52 Cb 1.00 -0.35 0.40 0.00 -0.26 0.00 0.00 64.21 65.00 2d9b n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2d9b n ALA 53 N -3.43 0.70 -3.68 7.33 0.00 -1.25 -4.15 120.51 116.03 2d9b n ALA 53 Ca 0.08 0.73 -0.09 0.00 0.00 0.00 0.00 53.44 54.16 2d9b n ALA 53 Cb 0.36 -0.71 -0.10 0.00 0.00 0.00 0.00 19.45 18.99 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 -5.13 -0.11 0.34 0.00 1.01 0.19 -0.71 120.40 115.99 2d9b s VAL 54 Ca -0.07 0.09 0.07 0.00 0.00 0.00 0.00 61.98 62.07 2d9b s VAL 54 Cb 0.24 -0.68 -0.01 0.00 0.00 0.00 0.00 36.38 35.92 2d9b s VAL 54 CO 0.56 0.04 0.41 -0.69 0.00 0.00 0.00 175.10 175.41 2d9b s VAL 55 N 1.61 3.83 -0.06 2.92 1.01 -0.30 -4.75 120.40 124.64 2d9b s VAL 55 Ca -0.09 -1.13 -0.00 0.00 0.00 0.00 0.00 61.98 60.76 2d9b s VAL 55 Cb -0.08 -3.31 0.02 0.00 0.00 0.00 0.00 36.38 33.01 2d9b s VAL 55 CO -0.14 -0.15 -0.03 -0.69 0.00 0.00 0.00 175.10 174.09 2d9b s VAL 56 N -2.23 0.50 0.32 2.92 1.01 -1.26 -2.44 120.40 119.22 2d9b s VAL 56 Ca 0.44 -0.02 0.09 0.00 0.00 0.00 0.00 61.98 62.49 2d9b s VAL 56 Cb -0.08 -0.59 -0.05 0.00 0.00 0.00 0.00 36.38 35.66 2d9b s VAL 56 CO 0.30 0.25 -0.02 -1.10 0.00 0.00 0.00 175.10 174.53 2d9b s GLN 57 N 1.48 2.07 0.00 2.72 -0.21 -0.06 -4.72 119.66 120.95 2d9b s GLN 57 Ca -0.02 -1.70 0.00 0.00 0.02 0.00 0.00 55.36 53.66 2d9b s GLN 57 Cb -0.13 -1.95 0.00 0.00 1.00 0.00 0.00 33.01 31.93 2d9b s GLN 57 CO -0.03 0.20 0.00 0.41 -2.12 0.00 0.00 175.29 173.74 2d9b n GLY 58 N -0.90 0.82 3.87 3.09 0.00 -1.26 -2.07 105.19 108.73 2d9b n GLY 58 Ca -0.05 -0.08 -0.31 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 3.87 1.08 0.99 1.43 -1.26 -4.64 118.68 120.15 2d9b s LEU 59 Ca 0.00 1.14 -0.15 0.00 -1.03 0.00 0.00 54.13 54.09 2d9b s LEU 59 Cb 0.00 -4.01 0.23 0.00 0.03 0.00 0.00 46.19 42.44 2d9b s LEU 59 CO 0.00 -0.37 1.10 -2.16 0.23 0.00 0.00 176.35 175.15 2d9b s PRO 60 N -3.71 -0.26 0.40 1.29 0.04 -1.26 -5.01 135.00 126.49 2d9b s PRO 60 Ca 0.51 0.29 -0.23 0.00 0.04 0.00 0.00 61.00 61.61 2d9b s PRO 60 Cb -0.10 -1.68 -0.10 0.00 0.04 0.00 0.00 34.50 32.66 2d9b s PRO 60 CO 0.29 -3.14 0.97 -2.00 0.04 0.00 0.00 177.00 173.16 2d9b s GLU 61 N -5.12 4.29 -1.13 4.56 2.56 -1.26 -3.50 118.70 119.10 2d9b s GLU 61 Ca 0.67 1.28 0.00 0.00 0.00 0.00 0.00 54.97 56.92 2d9b s GLU 61 Cb -0.16 -2.43 0.00 0.00 2.00 0.00 0.00 34.13 33.54 2d9b s GLU 61 CO 0.57 0.01 0.00 0.41 -0.56 0.00 0.00 175.26 175.69 2d9b n GLY 62 N -0.05 1.18 3.69 -1.50 0.00 -1.26 -5.00 105.19 102.26 2d9b n GLY 62 Ca 0.05 -0.41 -0.25 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.33 2.36 -0.15 1.61 0.11 -1.23 -5.14 120.40 115.63 2d9b s VAL 63 Ca 0.00 -1.81 -0.04 0.00 -2.93 0.00 0.00 61.98 57.19 2d9b s VAL 63 Cb 0.00 -2.95 0.07 0.00 -1.53 0.00 0.00 36.38 31.97 2d9b s VAL 63 CO 0.00 -0.05 0.26 0.00 -3.33 0.00 0.00 175.10 171.97 2d9b s ALA 64 N -2.59 -0.52 -0.29 1.54 0.00 -1.26 -4.98 121.76 113.66 2d9b s ALA 64 Ca 0.38 0.80 -0.36 0.00 0.00 0.00 0.00 51.96 52.79 2d9b s ALA 64 Cb 0.04 -1.09 -0.16 0.00 0.00 0.00 0.00 23.12 21.91 2d9b s ALA 64 CO 0.21 -0.76 1.16 0.34 0.00 0.00 0.00 175.76 176.70 2d9b n PHE 65 N 5.35 1.15 -3.69 0.00 7.35 -1.26 -4.89 117.46 121.47 2d9b n PHE 65 Ca -0.06 0.90 -0.01 0.00 -0.76 0.00 0.00 57.45 57.52 2d9b n PHE 65 Cb 0.50 -1.75 -0.01 0.00 0.35 0.00 0.00 39.48 38.57 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 1.72 0.82 0.24 -4.13 -2.85 -1.26 -5.03 119.74 109.26 2d9b s LYS 66 Ca 0.81 -0.46 -0.27 0.00 -1.00 0.00 0.00 55.97 55.05 2d9b s LYS 66 Cb -1.14 0.28 -0.16 0.00 -2.06 0.00 0.00 37.83 34.75 2d9b s LYS 66 CO 0.60 -0.38 0.58 1.58 0.10 0.00 0.00 175.35 177.83 2d9b n HIS 67 N -0.48 -0.29 0.98 1.78 -0.00 -1.26 -4.77 115.22 111.19 2d9b n HIS 67 Ca -0.07 0.87 0.05 0.00 -0.00 0.00 0.00 57.72 58.57 2d9b n HIS 67 Cb 0.62 -2.00 0.31 0.00 -0.00 0.00 0.00 29.99 28.92 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 0.95 0.49 0.03 1.57 -0.04 -1.26 -2.11 135.00 134.63 2d9b n PRO 68 Ca 0.16 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.69 2d9b n PRO 68 Cb 0.28 -1.33 -0.10 0.00 -0.04 0.00 0.00 33.50 32.31 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 -0.83 0.64 0.00 0.54 -0.00 -1.26 -4.00 120.64 115.72 2d9b n GLU 69 Ca 0.08 -0.02 0.14 0.00 -0.00 0.00 0.00 57.16 57.36 2d9b n GLU 69 Cb 0.04 -1.66 0.59 0.00 -0.00 0.00 0.00 31.44 30.40 2d9b n GLU 69 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2d9b n ASN 70 N -2.53 0.27 -4.76 -1.84 3.02 -0.90 -4.81 115.26 103.71 2d9b n ASN 70 Ca -0.06 -0.17 -0.38 0.00 -0.03 0.00 0.00 54.58 53.94 2d9b n ASN 70 Cb 0.65 -0.17 -0.06 0.00 -0.61 0.00 0.00 39.78 39.59 2d9b n ASN 70 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2d9b s TYR 71 N -2.71 3.59 0.72 3.10 2.02 -1.26 -5.06 117.35 117.76 2d9b s TYR 71 Ca 0.22 0.91 -0.15 0.00 -0.37 0.00 0.00 57.07 57.68 2d9b s TYR 71 Cb 0.19 -2.44 0.03 0.00 -0.40 0.00 0.00 41.96 39.35 2d9b s TYR 71 CO 0.52 0.36 1.17 -0.51 -1.57 0.00 0.00 175.55 175.51 2d9b s ASP 72 N -0.05 4.43 0.26 2.29 1.11 -1.26 -4.62 116.67 118.84 2d9b s ASP 72 Ca 0.24 2.22 -0.05 0.00 0.18 0.00 0.00 52.55 55.14 2d9b s ASP 72 Cb -0.16 -2.57 0.51 0.00 1.07 0.00 0.00 42.92 41.77 2d9b s ASP 72 CO 0.11 -2.10 1.62 0.25 1.18 0.00 0.00 175.17 176.23 2d9b h LEU 73 N -0.30 -0.41 0.29 1.23 5.85 -1.97 0.18 115.31 120.18 2d9b h LEU 73 Ca -0.47 0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.47 2d9b h LEU 73 Cb 1.28 0.39 -0.02 0.00 0.37 0.00 0.00 40.66 42.69 2d9b h LEU 73 CO 0.51 -0.23 -0.25 0.00 -0.34 0.00 0.00 178.44 178.13 2d9b h ALA 74 N 1.79 -0.54 -0.43 1.25 0.00 -2.00 -2.74 119.26 116.58 2d9b h ALA 74 Ca 0.46 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.34 2d9b h ALA 74 Cb 0.84 0.34 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 2d9b h ALA 74 CO -0.75 -0.83 0.15 1.15 0.00 0.00 0.00 179.25 178.97 2d9b h THR 75 N -0.56 0.86 -0.47 0.00 2.02 -1.39 -2.84 112.91 110.53 2d9b h THR 75 Ca -0.02 -0.11 0.06 0.00 0.77 0.00 0.00 66.41 67.11 2d9b h THR 75 Cb 0.50 0.51 -0.09 0.00 -1.74 0.00 0.00 68.15 67.34 2d9b h THR 75 CO -0.03 0.06 -0.55 -0.07 0.37 0.00 0.00 175.52 175.30 2d9b h LEU 76 N 0.32 -1.87 -0.81 2.58 3.38 -0.52 0.35 115.31 118.75 2d9b h LEU 76 Ca 0.20 0.25 0.20 0.00 0.09 0.00 0.00 57.88 58.62 2d9b h LEU 76 Cb 0.20 0.78 -0.14 0.00 0.09 0.00 0.00 40.66 41.59 2d9b h LEU 76 CO -0.21 -0.38 0.10 0.11 0.09 0.00 0.00 178.44 178.15 2d9b h LYS 77 N -0.35 0.15 0.08 1.13 1.57 -1.25 -1.75 116.57 116.15 2d9b h LYS 77 Ca 0.09 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.87 2d9b h LYS 77 Cb 0.58 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.82 2d9b h LYS 77 CO -0.63 0.10 -0.39 2.35 -0.57 0.00 0.00 179.45 180.31 2d9b h TRP 78 N 0.15 -1.12 -0.99 -1.35 7.01 -0.82 0.23 115.95 119.06 2d9b h TRP 78 Ca 0.47 0.03 0.18 0.00 2.11 0.00 0.00 58.89 61.68 2d9b h TRP 78 Cb 0.87 0.48 -0.18 0.00 -2.10 0.00 0.00 29.16 28.24 2d9b h TRP 78 CO -0.36 -0.44 -0.30 0.82 -2.79 0.00 0.00 178.44 175.38 2d9b h ILE 79 N -0.55 0.01 -0.53 2.65 2.04 -0.82 1.20 117.51 121.50 2d9b h ILE 79 Ca -0.00 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 2d9b h ILE 79 Cb 0.55 0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 2d9b h ILE 79 CO -0.21 0.00 0.23 -0.07 0.00 0.00 0.00 178.15 178.09 2d9b h LEU 80 N -0.00 0.69 0.32 1.44 3.38 -1.15 0.17 115.31 120.16 2d9b h LEU 80 Ca 0.43 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.31 2d9b h LEU 80 Cb 0.68 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.26 2d9b h LEU 80 CO -1.01 0.61 -0.15 -0.33 0.09 0.00 0.00 178.44 177.65 2d9b h GLU 81 N 0.75 -0.41 -1.01 1.13 4.39 0.34 -3.13 114.58 116.64 2d9b h GLU 81 Ca 0.18 0.03 -0.62 0.00 0.34 0.00 0.00 59.36 59.30 2d9b h GLU 81 Cb 0.13 0.09 -0.29 0.00 -0.10 0.00 0.00 28.75 28.58 2d9b h GLU 81 CO -0.02 -0.14 0.79 0.09 -1.16 0.00 0.00 179.01 178.57 2d9b n ASN 82 N -5.18 6.40 -0.00 1.42 5.03 0.18 -4.51 115.26 118.60 2d9b n ASN 82 Ca -0.10 -3.71 -0.17 0.00 0.87 0.00 0.00 54.58 51.47 2d9b n ASN 82 Cb 0.25 -0.93 -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 1.66 0.30 -1.45 3.52 2.10 -0.59 -3.18 116.57 118.92 2d9b h LYS 83 Ca 0.61 -0.36 0.45 0.00 -2.00 0.00 0.00 60.65 59.35 2d9b h LYS 83 Cb 1.47 0.11 -0.11 0.00 -0.90 0.00 0.00 32.23 32.80 2d9b h LYS 83 CO 1.42 1.07 0.98 0.00 -2.00 0.00 0.00 179.45 180.92 2d9b h ALA 84 N 0.25 3.03 0.03 0.07 0.00 -1.81 1.07 119.26 121.89 2d9b h ALA 84 Ca -0.07 0.05 -0.25 0.00 0.00 0.00 0.00 54.91 54.64 2d9b h ALA 84 Cb 1.27 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 2d9b h ALA 84 CO 0.10 -1.60 -1.28 0.78 0.00 0.00 0.00 179.25 177.24 2d9b h GLY 85 N 0.07 0.08 -6.31 0.00 0.00 -1.91 -3.45 103.07 91.54 2d9b h GLY 85 Ca 0.81 -0.20 -0.70 0.00 0.00 0.00 0.00 47.33 47.25 2d9b h GLY 85 CO -0.28 0.17 1.05 1.39 0.00 0.00 0.00 176.54 178.88 2d9b n ILE 86 N -3.31 0.36 -4.41 2.60 5.41 0.37 -4.68 119.36 115.69 2d9b n ILE 86 Ca -0.08 -0.10 -0.24 0.00 1.00 0.00 0.00 62.75 63.33 2d9b n ILE 86 Cb 0.99 -1.46 -0.11 0.00 -0.71 0.00 0.00 39.64 38.35 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 4.38 3.26 -0.12 4.38 0.01 -0.88 -4.97 113.70 119.77 2d9b s SER 87 Ca 0.99 -0.93 0.03 0.00 1.31 0.00 0.00 55.95 57.35 2d9b s SER 87 Cb -0.94 -0.24 0.01 0.00 0.21 0.00 0.00 66.02 65.06 2d9b s SER 87 CO 0.59 0.04 -0.20 -0.36 0.41 0.00 0.00 173.24 173.72 2d9b s PHE 88 N -2.11 2.42 -0.35 2.43 0.40 -1.26 -0.88 117.98 118.63 2d9b s PHE 88 Ca 0.23 -1.14 -0.07 0.00 -0.60 0.00 0.00 56.93 55.35 2d9b s PHE 88 Cb -0.06 -1.66 0.04 0.00 0.51 0.00 0.00 43.02 41.85 2d9b s PHE 88 CO 0.11 -0.52 0.13 0.42 0.70 0.00 0.00 175.22 176.06 2d9b s ILE 89 N 0.73 3.92 -0.39 0.64 1.09 -1.02 -4.84 121.20 121.33 2d9b s ILE 89 Ca -0.10 -1.12 -0.27 0.00 -1.10 0.00 0.00 60.65 58.05 2d9b s ILE 89 Cb -0.16 -3.23 0.02 0.00 -1.06 0.00 0.00 42.46 38.03 2d9b s ILE 89 CO 0.01 -0.21 1.00 -0.63 -0.10 0.00 0.00 174.94 175.00 2d9b s ILE 90 N 1.42 4.48 -0.12 2.92 1.09 -1.26 -1.16 121.20 128.58 2d9b s ILE 90 Ca -0.01 1.27 0.17 0.00 -1.10 0.00 0.00 60.65 60.98 2d9b s ILE 90 Cb -0.20 -4.41 -0.20 0.00 -1.06 0.00 0.00 42.46 36.59 2d9b s ILE 90 CO 0.03 -0.65 0.56 0.29 -0.10 0.00 0.00 174.94 175.08 2d9b n LYS 91 N 7.04 0.64 -3.65 2.79 4.76 0.11 -4.99 118.16 124.87 2d9b n LYS 91 Ca 0.09 0.13 -0.02 0.00 -2.87 0.00 0.00 58.31 55.64 2d9b n LYS 91 Cb 0.48 -1.70 -0.07 0.00 -1.84 0.00 0.00 35.03 31.90 2d9b n LYS 91 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2d9b s ARG 92 N -2.83 0.05 0.58 1.97 3.00 -0.24 -4.96 118.95 116.52 2d9b s ARG 92 Ca -0.06 0.06 -0.18 0.00 -1.00 0.00 0.00 55.73 54.56 2d9b s ARG 92 Cb 0.08 0.02 -0.04 0.00 0.00 0.00 0.00 34.95 35.02 2d9b s ARG 92 CO 0.83 -0.01 1.12 -1.25 0.00 0.00 0.00 175.30 175.99 2d9b s PRO 93 N 0.23 3.18 0.50 5.12 0.04 -1.26 -4.43 135.00 138.38 2d9b s PRO 93 Ca 0.04 1.53 -0.21 0.00 0.04 0.00 0.00 61.00 62.41 2d9b s PRO 93 Cb -0.04 -1.99 -0.07 0.00 0.04 0.00 0.00 34.50 32.43 2d9b s PRO 93 CO -0.15 -0.97 1.09 -0.06 0.04 0.00 0.00 177.00 176.95 2d9b s PHE 94 N -1.96 2.88 -0.19 0.56 0.40 -1.26 -4.97 117.98 113.43 2d9b s PHE 94 Ca 0.71 1.56 0.13 0.00 -0.60 0.00 0.00 56.93 58.73 2d9b s PHE 94 Cb -0.23 -3.19 0.39 0.00 0.51 0.00 0.00 43.02 40.50 2d9b s PHE 94 CO 0.32 -1.18 1.20 1.47 0.70 0.00 0.00 175.22 177.73 2d9b n LEU 95 N -0.97 2.59 -4.63 -0.37 -0.00 -1.26 -5.02 117.00 107.34 2d9b n LEU 95 Ca 0.10 -3.67 -0.42 0.00 -0.00 0.00 0.00 56.01 52.01 2d9b n LEU 95 Cb 0.51 -0.50 -0.04 0.00 -0.00 0.00 0.00 43.42 43.39 2d9b n LEU 95 CO 0.42 1.22 0.65 -1.61 -0.00 0.00 0.00 177.39 178.07 2d9b s GLU 96 N -3.10 4.08 -0.43 1.47 2.02 -1.26 -5.00 118.70 116.49 2d9b s GLU 96 Ca 0.36 0.80 -0.28 0.00 0.02 0.00 0.00 54.97 55.87 2d9b s GLU 96 Cb 0.35 -3.69 -0.01 0.00 0.10 0.00 0.00 34.13 30.87 2d9b s GLU 96 CO -0.05 -0.62 1.75 -1.25 0.02 0.00 0.00 175.26 175.12 2d9b s PRO 97 N 2.95 3.17 0.19 0.39 0.04 -1.26 -4.99 135.00 135.48 2d9b s PRO 97 Ca 0.35 1.11 -0.03 0.00 0.04 0.00 0.00 61.00 62.46 2d9b s PRO 97 Cb -0.14 -4.23 -0.05 0.00 0.04 0.00 0.00 34.50 30.12 2d9b s PRO 97 CO 0.10 -2.07 0.41 0.21 0.04 0.00 0.00 177.00 175.70 2d9b s LYS 98 N 5.95 3.59 0.02 4.56 2.20 -1.26 -5.11 119.74 129.69 2d9b s LYS 98 Ca 0.73 -0.15 0.06 0.00 -0.36 0.00 0.00 55.97 56.25 2d9b s LYS 98 Cb -0.18 -2.81 -0.03 0.00 -1.51 0.00 0.00 37.83 33.30 2d9b s LYS 98 CO 0.30 0.40 -0.17 0.15 -0.36 0.00 0.00 175.35 175.67 2d9b s LYS 99 N -3.03 2.18 0.15 4.03 1.02 -1.26 -5.04 119.74 117.80 2d9b s LYS 99 Ca 0.41 -0.92 -0.17 0.00 0.02 0.00 0.00 55.97 55.31 2d9b s LYS 99 Cb -0.11 -2.24 0.06 0.00 -0.52 0.00 0.00 37.83 35.02 2d9b s LYS 99 CO 0.27 0.56 1.70 1.12 -0.92 0.00 0.00 175.35 178.08 2d9b h HIS 100 N 4.69 -0.04 -3.83 3.18 2.07 -2.06 -3.41 115.15 115.75 2d9b h HIS 100 Ca -0.47 0.02 -0.50 0.00 -2.85 0.00 0.00 60.37 56.57 2d9b h HIS 100 Cb 1.15 0.07 0.02 0.00 2.57 0.00 0.00 27.41 31.23 2d9b h HIS 100 CO 0.52 -0.07 0.49 0.54 -3.07 0.00 0.00 177.93 176.34 2d9b s VAL 101 N -6.19 3.41 0.11 6.12 0.11 -1.26 -4.96 120.40 117.74 2d9b s VAL 101 Ca -0.13 1.39 0.00 0.00 -2.93 0.00 0.00 61.98 60.30 2d9b s VAL 101 Cb 0.12 -3.87 0.00 0.00 -1.53 0.00 0.00 36.38 31.11 2d9b s VAL 101 CO 0.70 0.30 0.00 0.61 -3.33 0.00 0.00 175.10 173.39 2d9b n GLY 102 N 1.07 -0.07 2.35 6.54 0.00 -1.26 -5.13 105.19 108.69 2d9b n GLY 102 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 2d9b n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d9b n GLY 103 N 3.11 -5.52 0.18 -0.02 0.00 -1.26 -4.96 105.19 96.73 2d9b n GLY 103 Ca 0.00 0.59 -0.09 0.00 0.00 0.00 0.00 46.02 46.52 2d9b n GLY 103 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2d9b h SER 104 N 3.95 -0.31 0.00 1.61 0.87 -2.05 -3.47 113.55 114.15 2d9b h SER 104 Ca -0.18 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.23 2d9b h SER 104 Cb 0.40 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 2d9b h SER 104 CO 0.00 0.19 0.00 0.61 -0.53 0.00 0.00 176.83 177.10 2d9b n GLY 105 N 0.58 -1.45 2.25 5.77 0.00 -1.26 -5.18 105.19 105.90 2d9b n GLY 105 Ca -0.07 0.83 -0.19 0.00 0.00 0.00 0.00 46.02 46.59 2d9b n GLY 105 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d9b n PRO 106 N 0.00 -2.42 -1.06 1.61 -0.04 -1.26 -4.87 135.00 126.96 2d9b n PRO 106 Ca 0.00 -1.12 -0.38 0.00 -0.04 0.00 0.00 63.50 61.96 2d9b n PRO 106 Cb 0.00 -1.06 -0.04 0.00 -0.04 0.00 0.00 33.50 32.37 2d9b n PRO 106 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2d9b n SER 107 N -4.22 -0.56 -4.70 3.54 3.41 -1.26 -4.91 113.62 104.91 2d9b n SER 107 Ca 0.10 0.84 -0.35 0.00 -0.26 0.00 0.00 58.87 59.19 2d9b n SER 107 Cb 0.38 -0.69 -0.09 0.00 -0.26 0.00 0.00 64.21 63.55 2d9b n SER 107 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2d9b s SER 108 N -0.45 5.62 0.00 4.04 0.01 -1.26 -5.27 113.70 116.39 2d9b s SER 108 Ca 0.55 0.19 0.00 0.00 1.31 0.00 0.00 55.95 57.99 2d9b s SER 108 Cb -0.78 -1.80 0.00 0.00 0.21 0.00 0.00 66.02 63.65 2d9b s SER 108 CO 0.41 0.30 0.00 0.61 0.41 0.00 0.00 173.24 174.98