#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bcc s VAL 14 N 0.00 0.88 -0.33 4.08 1.01 -1.26 -5.11 120.40 119.67 1bcc s VAL 14 Ca 0.00 -0.26 -0.29 0.00 0.00 0.00 0.00 61.98 61.43 1bcc s VAL 14 Cb 0.00 -0.88 -0.00 0.00 0.00 0.00 0.00 36.38 35.50 1bcc s VAL 14 CO 0.00 0.32 1.45 -0.62 0.00 0.00 0.00 175.10 176.25 1bcc s ASP 15 N 1.25 6.42 0.52 3.32 -1.08 -1.26 -4.87 116.67 120.97 1bcc s ASP 15 Ca -0.04 1.16 0.36 0.00 -0.52 0.00 0.00 52.55 53.50 1bcc s ASP 15 Cb -0.14 -2.54 1.52 0.00 -1.46 0.00 0.00 42.92 40.30 1bcc s ASP 15 CO -0.02 -1.30 1.75 1.55 0.52 0.00 0.00 175.17 177.66 1bcc h PRO 16 N 10.41 0.06 0.00 4.34 0.13 -1.97 -1.73 132.00 143.24 1bcc h PRO 16 Ca -0.29 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1bcc h PRO 16 Cb 1.12 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 1bcc h PRO 16 CO 1.05 0.04 -0.04 1.25 -0.23 0.00 0.00 178.00 180.07 1bcc h LEU 17 N 0.06 -0.12 -1.96 1.56 5.85 -1.93 0.31 115.31 119.08 1bcc h LEU 17 Ca 0.65 0.01 0.32 0.00 0.84 0.00 0.00 57.88 59.71 1bcc h LEU 17 Cb 2.45 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 43.47 1bcc h LEU 17 CO -0.08 -0.04 0.80 0.71 -0.34 0.00 0.00 178.44 179.49 1bcc h THR 18 N -0.05 0.45 0.01 1.05 1.35 -1.72 -0.25 112.91 113.74 1bcc h THR 18 Ca 0.00 -0.01 -0.00 0.00 -0.55 0.00 0.00 66.41 65.85 1bcc h THR 18 Cb 0.05 0.42 0.00 0.00 -1.73 0.00 0.00 68.15 66.89 1bcc h THR 18 CO -0.03 0.00 -0.01 0.74 -0.25 0.00 0.00 175.52 175.98 1bcc h THR 19 N 0.02 1.46 0.00 6.82 2.02 -1.31 -2.49 112.91 119.44 1bcc h THR 19 Ca 0.53 -1.49 0.00 0.00 0.77 0.00 0.00 66.41 66.22 1bcc h THR 19 Cb 2.10 2.46 0.00 0.00 -1.74 0.00 0.00 68.15 70.97 1bcc h THR 19 CO -0.02 0.38 0.00 0.52 0.37 0.00 0.00 175.52 176.77 1bcc n VAL 20 N -4.79 1.09 0.03 3.16 0.31 0.01 -1.96 118.33 116.18 1bcc n VAL 20 Ca -0.09 0.30 -0.22 0.00 -0.01 0.00 0.00 64.34 64.33 1bcc n VAL 20 Cb 0.32 -1.14 -0.14 0.00 -0.91 0.00 0.00 33.84 31.96 1bcc n VAL 20 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1bcc h ARG 21 N 0.00 0.31 -0.48 5.55 3.08 -1.17 -2.93 114.38 118.75 1bcc h ARG 21 Ca 0.00 -0.54 0.05 0.00 0.07 0.00 0.00 59.98 59.57 1bcc h ARG 21 Cb 0.23 0.20 -0.05 0.00 0.08 0.00 0.00 29.97 30.44 1bcc h ARG 21 CO 0.00 1.24 0.21 0.93 -1.07 0.00 0.00 179.97 181.28 1bcc h GLU 22 N 0.09 0.40 0.93 0.04 5.08 -0.91 0.40 114.58 120.60 1bcc h GLU 22 Ca -0.38 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 57.91 1bcc h GLU 22 Cb 2.06 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 31.23 1bcc h GLU 22 CO 0.13 0.27 -0.45 0.37 -1.00 0.00 0.00 179.01 178.32 1bcc h GLN 23 N 0.41 -1.21 -0.77 2.33 4.15 -1.62 -3.05 115.11 115.36 1bcc h GLN 23 Ca 0.22 0.08 0.18 0.00 0.77 0.00 0.00 58.65 59.90 1bcc h GLN 23 Cb 0.18 0.27 -0.13 0.00 0.21 0.00 0.00 27.48 28.01 1bcc h GLN 23 CO -0.19 -0.81 0.04 0.00 -1.93 0.00 0.00 178.83 175.95 1bcc n GLU 25 N -5.32 0.00 -0.00 0.00 0.00 0.14 -0.40 120.64 115.05 1bcc n GLU 25 Ca 0.14 0.22 0.09 0.00 0.00 0.00 0.00 57.16 57.61 1bcc n GLU 25 Cb 0.50 -1.53 -0.12 0.00 0.00 0.00 0.00 31.44 30.29 1bcc n GLU 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1bcc n GLN 26 N -1.19 0.95 -1.23 3.44 -0.00 0.11 -3.92 117.38 115.54 1bcc n GLN 26 Ca 0.00 -0.06 -0.33 0.00 -0.00 0.00 0.00 57.00 56.60 1bcc n GLN 26 Cb 0.03 -1.37 0.11 0.00 -0.00 0.00 0.00 30.24 29.01 1bcc n GLN 26 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1bcc s LEU 27 N -3.39 3.18 0.01 2.61 1.43 0.47 -4.66 118.68 118.32 1bcc s LEU 27 Ca 0.01 2.28 -0.03 0.00 -1.03 0.00 0.00 54.13 55.37 1bcc s LEU 27 Cb 0.13 -4.58 -0.01 0.00 0.03 0.00 0.00 46.19 41.75 1bcc s LEU 27 CO 0.73 -2.47 1.05 -0.33 0.23 0.00 0.00 176.35 175.56 1bcc h GLU 28 N -0.76 -0.05 -0.95 1.70 5.08 -1.94 -0.79 114.58 116.88 1bcc h GLU 28 Ca -0.46 0.00 0.26 0.00 -1.00 0.00 0.00 59.36 58.16 1bcc h GLU 28 Cb 1.29 0.01 -0.17 0.00 0.50 0.00 0.00 28.75 30.37 1bcc h GLU 28 CO 0.48 -0.03 0.07 0.87 -1.00 0.00 0.00 179.01 179.40 1bcc h LYS 29 N -0.05 0.05 0.34 2.33 1.57 -1.95 1.20 116.57 120.07 1bcc h LYS 29 Ca 0.00 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1bcc h LYS 29 Cb 0.06 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1bcc h LYS 29 CO -0.04 0.03 -0.16 0.00 -0.57 0.00 0.00 179.45 178.70 1bcc h VAL 31 N -0.49 0.46 -0.05 0.00 2.07 0.36 2.11 116.25 120.72 1bcc h VAL 31 Ca -0.05 -0.11 -0.08 0.00 0.82 0.00 0.00 66.70 67.28 1bcc h VAL 31 Cb 0.35 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1bcc h VAL 31 CO 0.08 0.06 -0.33 0.11 0.02 0.00 0.00 177.57 177.51 1bcc h LYS 32 N 0.33 0.09 0.07 1.57 6.56 0.15 -2.55 116.57 122.79 1bcc h LYS 32 Ca 0.52 -0.03 -0.30 0.00 -1.06 0.00 0.00 60.65 59.77 1bcc h LYS 32 Cb 0.96 -0.01 -0.03 0.00 -0.57 0.00 0.00 32.23 32.59 1bcc h LYS 32 CO -0.55 0.41 -1.61 0.00 -2.06 0.00 0.00 179.45 175.65 1bcc h ALA 33 N 1.59 0.48 -0.93 3.86 0.00 0.60 -3.13 119.26 121.74 1bcc h ALA 33 Ca 0.01 -1.26 -0.01 0.00 0.00 0.00 0.00 54.91 53.65 1bcc h ALA 33 Cb 0.63 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 18.75 1bcc h ALA 33 CO 0.05 1.34 0.54 -0.09 0.00 0.00 0.00 179.25 181.08 1bcc h ARG 34 N 0.04 1.28 0.75 0.00 9.65 0.30 -2.19 114.38 124.21 1bcc h ARG 34 Ca -0.26 -0.13 -0.04 0.00 -1.10 0.00 0.00 59.98 58.45 1bcc h ARG 34 Cb 1.99 -0.26 0.01 0.00 -1.39 0.00 0.00 29.97 30.32 1bcc h ARG 34 CO 0.12 0.92 -0.36 0.93 2.80 0.00 0.00 179.97 184.37 1bcc h GLU 35 N 1.29 -0.97 0.00 0.20 4.39 -1.56 0.78 114.58 118.71 1bcc h GLU 35 Ca 0.33 0.07 0.00 0.00 0.34 0.00 0.00 59.36 60.10 1bcc h GLU 35 Cb -0.02 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 28.86 1bcc h GLU 35 CO -0.06 -0.65 0.50 0.07 -1.16 0.00 0.00 179.01 177.72 1bcc h ARG 36 N -1.23 0.00 0.00 2.33 -0.00 -1.47 -1.25 114.38 112.76 1bcc h ARG 36 Ca -0.10 0.00 -0.06 0.00 -0.00 0.00 0.00 59.98 59.82 1bcc h ARG 36 Cb 0.77 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.73 1bcc h ARG 36 CO 0.17 0.00 -0.54 1.25 -0.00 0.00 0.00 179.97 180.85 1bcc h LEU 37 N 0.00 0.00 -1.64 0.08 7.12 -0.90 -3.31 115.31 116.67 1bcc h LEU 37 Ca 0.00 -0.26 0.22 0.00 0.13 0.00 0.00 57.88 57.98 1bcc h LEU 37 Cb 1.00 0.00 -0.06 0.00 -0.53 0.00 0.00 40.66 41.07 1bcc h LEU 37 CO 0.00 0.93 0.61 -0.33 -0.13 0.00 0.00 178.44 179.53 1bcc h GLU 38 N -1.00 0.28 0.63 1.25 4.39 0.30 0.43 114.58 120.86 1bcc h GLU 38 Ca -0.09 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.56 1bcc h GLU 38 Cb 0.68 -0.06 0.01 0.00 -0.10 0.00 0.00 28.75 29.27 1bcc h GLU 38 CO -0.06 0.18 -0.30 -0.07 -1.16 0.00 0.00 179.01 177.60 1bcc h LEU 39 N 0.29 -0.72 -1.25 1.33 4.07 -1.55 -0.92 115.31 116.55 1bcc h LEU 39 Ca 0.47 -0.01 0.07 0.00 0.08 0.00 0.00 57.88 58.48 1bcc h LEU 39 Cb 1.35 0.19 -0.05 0.00 1.08 0.00 0.00 40.66 43.23 1bcc h LEU 39 CO -0.14 -0.43 0.54 0.00 -1.08 0.00 0.00 178.44 177.33 1bcc h ASP 41 N 0.90 -0.02 1.12 0.00 3.58 -0.80 -0.48 116.42 120.73 1bcc h ASP 41 Ca 0.36 -0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.68 1bcc h ASP 41 Cb 0.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.31 1bcc h ASP 41 CO -0.13 0.12 0.00 -0.33 -2.88 0.00 0.00 179.24 176.02 1bcc h GLU 42 N -0.16 0.00 0.05 0.28 3.07 -0.68 -2.86 114.58 114.28 1bcc h GLU 42 Ca -0.00 0.00 -0.30 0.00 -0.50 0.00 0.00 59.36 58.56 1bcc h GLU 42 Cb 0.15 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.03 1bcc h GLU 42 CO 0.00 0.00 -1.63 0.07 -1.40 0.00 0.00 179.01 176.05 1bcc h ARG 43 N 0.00 0.10 0.00 2.33 -0.00 -0.64 -3.17 114.38 113.00 1bcc h ARG 43 Ca 0.00 -0.17 -0.12 0.00 -0.00 0.00 0.00 59.98 59.69 1bcc h ARG 43 Cb 0.56 0.06 -0.02 0.00 -0.00 0.00 0.00 29.97 30.58 1bcc h ARG 43 CO 0.00 0.82 -0.58 0.28 -0.00 0.00 0.00 179.97 180.49 1bcc h VAL 44 N 0.03 0.99 -0.00 0.08 2.07 -1.06 -3.09 116.25 115.27 1bcc h VAL 44 Ca -0.26 -2.39 0.00 0.00 0.82 0.00 0.00 66.70 64.86 1bcc h VAL 44 Cb 1.99 2.49 0.00 0.00 -1.52 0.00 0.00 31.29 34.24 1bcc h VAL 44 CO 0.11 0.56 -0.31 -1.54 0.02 0.00 0.00 177.57 176.41 1bcc n SER 45 N -3.24 0.47 0.11 0.57 3.41 -1.09 -3.88 113.62 109.97 1bcc n SER 45 Ca 0.02 -0.23 0.03 0.00 -0.26 0.00 0.00 58.87 58.42 1bcc n SER 45 Cb 0.77 0.04 -0.01 0.00 -0.26 0.00 0.00 64.21 64.75 1bcc n SER 45 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1bcc h SER 46 N 0.24 0.00 -1.98 4.04 4.64 -1.51 -3.47 113.55 115.52 1bcc h SER 46 Ca 0.00 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.85 1bcc h SER 46 Cb 0.48 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 1bcc h SER 46 CO 0.00 0.47 -0.41 -0.60 -0.87 0.00 0.00 176.83 175.42 1bcc s ARG 47 N -2.98 3.11 -0.15 4.77 6.06 -1.25 -5.04 118.95 123.46 1bcc s ARG 47 Ca 0.02 -1.00 0.08 0.00 -2.50 0.00 0.00 55.73 52.33 1bcc s ARG 47 Cb 0.08 -2.74 -0.23 0.00 0.06 0.00 0.00 34.95 32.12 1bcc s ARG 47 CO 0.77 0.22 0.23 0.43 -2.50 0.00 0.00 175.30 174.45 1bcc n SER 48 N -1.46 1.08 -3.67 -2.12 7.64 -1.26 -4.77 113.62 109.06 1bcc n SER 48 Ca -0.04 0.13 -0.27 0.00 1.01 0.00 0.00 58.87 59.69 1bcc n SER 48 Cb 0.58 0.04 -0.11 0.00 -1.01 0.00 0.00 64.21 63.72 1bcc n SER 48 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1bcc n GLN 49 N -3.08 1.55 -4.37 1.43 7.27 -1.26 -5.08 117.38 113.83 1bcc n GLN 49 Ca -0.31 -4.17 -0.22 0.00 0.07 0.00 0.00 57.00 52.37 1bcc n GLN 49 Cb 1.07 -2.09 -0.13 0.00 2.41 0.00 0.00 30.24 31.50 1bcc n GLN 49 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 1bcc s THR 50 N -1.32 1.33 -0.39 1.69 2.01 -1.26 -5.04 115.64 112.66 1bcc s THR 50 Ca 0.30 -1.18 0.23 0.00 0.31 0.00 0.00 61.69 61.35 1bcc s THR 50 Cb 0.02 -1.20 -0.01 0.00 0.01 0.00 0.00 72.50 71.31 1bcc s THR 50 CO -0.14 -0.00 1.10 -0.62 -0.69 0.00 0.00 174.62 174.26 1bcc n GLU 51 N 1.65 0.48 -1.78 4.92 -0.58 -1.26 -4.96 120.64 119.11 1bcc n GLU 51 Ca -0.19 0.09 -0.40 0.00 -0.42 0.00 0.00 57.16 56.24 1bcc n GLU 51 Cb 0.54 -1.75 0.02 0.00 -0.57 0.00 0.00 31.44 29.68 1bcc n GLU 51 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 1bcc s GLU 52 N -3.29 3.63 0.23 3.49 2.12 -1.26 -5.04 118.70 118.58 1bcc s GLU 52 Ca 0.02 2.42 0.10 0.00 0.36 0.00 0.00 54.97 57.87 1bcc s GLU 52 Cb 0.11 -2.62 -0.05 0.00 0.26 0.00 0.00 34.13 31.83 1bcc s GLU 52 CO 0.78 -0.86 -0.18 -0.51 -0.54 0.00 0.00 175.26 173.94 1bcc s ASP 53 N -0.53 3.13 -0.28 -1.70 1.01 -1.26 -5.00 116.67 112.05 1bcc s ASP 53 Ca 0.62 -0.99 0.11 0.00 0.71 0.00 0.00 52.55 53.00 1bcc s ASP 53 Cb -0.44 -0.22 0.64 0.00 1.01 0.00 0.00 42.92 43.91 1bcc s ASP 53 CO 0.56 -0.03 1.64 0.00 0.21 0.00 0.00 175.17 177.55 1bcc h THR 55 N 2.04 0.00 -0.08 0.00 1.35 -1.99 -0.43 112.91 113.80 1bcc h THR 55 Ca 0.19 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 66.06 1bcc h THR 55 Cb 1.97 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 68.38 1bcc h THR 55 CO 0.54 0.00 -0.05 -0.08 -0.25 0.00 0.00 175.52 175.68 1bcc h GLU 56 N -0.50 -0.00 -1.08 4.72 4.81 -2.00 0.42 114.58 120.94 1bcc h GLU 56 Ca -0.02 0.00 0.32 0.00 -0.13 0.00 0.00 59.36 59.53 1bcc h GLU 56 Cb 0.48 0.00 -0.12 0.00 0.63 0.00 0.00 28.75 29.74 1bcc h GLU 56 CO -0.13 -0.00 0.67 0.93 -0.73 0.00 0.00 179.01 179.75 1bcc h GLU 57 N -0.00 0.32 -0.14 1.92 3.07 -1.89 0.76 114.58 118.63 1bcc h GLU 57 Ca 0.01 -0.02 -0.02 0.00 -0.50 0.00 0.00 59.36 58.83 1bcc h GLU 57 Cb 0.03 -0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 27.87 1bcc h GLU 57 CO -0.08 0.21 0.00 1.25 -1.40 0.00 0.00 179.01 179.00 1bcc h LEU 58 N 0.33 0.23 0.41 1.33 5.85 0.15 -3.08 115.31 120.54 1bcc h LEU 58 Ca 0.69 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 59.10 1bcc h LEU 58 Cb 1.75 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.70 1bcc h LEU 58 CO -0.44 0.48 -0.33 -0.26 -0.34 0.00 0.00 178.44 177.54 1bcc h PHE 59 N -0.02 -0.89 -1.09 1.25 0.04 0.12 -1.21 116.94 115.14 1bcc h PHE 59 Ca 0.04 0.00 0.42 0.00 2.80 0.00 0.00 57.97 61.23 1bcc h PHE 59 Cb 0.36 0.34 -0.17 0.00 2.20 0.00 0.00 35.95 38.68 1bcc h PHE 59 CO 0.03 -0.49 0.62 -0.44 -0.60 0.00 0.00 178.31 177.44 1bcc h ASP 60 N -0.74 0.31 -0.26 2.17 3.32 -1.41 1.82 116.42 121.63 1bcc h ASP 60 Ca -0.04 0.23 -0.09 0.00 0.02 0.00 0.00 57.03 57.15 1bcc h ASP 60 Cb 0.65 0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.42 1bcc h ASP 60 CO -0.02 -0.36 -0.20 0.15 -1.72 0.00 0.00 179.24 177.09 1bcc h PHE 61 N 0.04 0.71 -0.30 4.55 3.57 -1.16 -2.43 116.94 121.92 1bcc h PHE 61 Ca 0.84 -0.20 -0.18 0.00 3.53 0.00 0.00 57.97 61.96 1bcc h PHE 61 Cb 2.32 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 40.90 1bcc h PHE 61 CO -0.01 0.89 -0.53 -0.07 -2.23 0.00 0.00 178.31 176.36 1bcc h LEU 62 N 0.32 0.96 -2.27 0.59 3.38 0.31 0.41 115.31 119.01 1bcc h LEU 62 Ca 0.05 -0.51 -0.00 0.00 0.09 0.00 0.00 57.88 57.51 1bcc h LEU 62 Cb 0.74 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 1bcc h LEU 62 CO 0.05 1.30 -0.01 -0.74 0.09 0.00 0.00 178.44 179.14 1bcc h HIS 63 N 0.67 0.00 0.01 1.13 2.76 0.16 -1.96 115.15 117.91 1bcc h HIS 63 Ca 0.02 0.00 -0.37 0.00 -2.20 0.00 0.00 60.37 57.82 1bcc h HIS 63 Cb 1.13 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 30.04 1bcc h HIS 63 CO 0.07 0.01 -2.02 0.00 -1.30 0.00 0.00 177.93 174.68 1bcc n ALA 64 N -2.10 1.04 -0.11 5.26 0.00 -0.92 -3.74 120.51 119.95 1bcc n ALA 64 Ca -0.01 -0.84 0.00 0.00 0.00 0.00 0.00 53.44 52.58 1bcc n ALA 64 Cb 0.18 -0.19 0.00 0.00 0.00 0.00 0.00 19.45 19.44 1bcc n ALA 64 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1bcc n ARG 65 N -4.22 0.00 -0.30 0.00 0.63 0.14 -2.94 116.66 109.98 1bcc n ARG 65 Ca -0.44 0.62 0.12 0.00 -0.92 0.00 0.00 57.85 57.23 1bcc n ARG 65 Cb 0.82 -1.45 0.27 0.00 0.45 0.00 0.00 32.46 32.56 1bcc n ARG 65 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1bcc h ASP 66 N 0.00 -0.09 -1.04 6.15 5.19 -1.59 -1.32 116.42 123.73 1bcc h ASP 66 Ca 0.00 0.20 0.31 0.00 -0.62 0.00 0.00 57.03 56.92 1bcc h ASP 66 Cb 0.00 0.30 -0.13 0.00 0.18 0.00 0.00 39.33 39.67 1bcc h ASP 66 CO 0.00 -0.18 0.62 -0.74 -3.12 0.00 0.00 179.24 175.82 1bcc h HIS 67 N 0.17 0.88 0.00 4.55 2.76 -1.62 0.48 115.15 122.38 1bcc h HIS 67 Ca 0.54 0.03 -0.10 0.00 -2.20 0.00 0.00 60.37 58.64 1bcc h HIS 67 Cb 1.08 -0.24 -0.02 0.00 1.55 0.00 0.00 27.41 29.78 1bcc h HIS 67 CO -0.30 -0.08 -1.25 0.00 -1.30 0.00 0.00 177.93 174.99 1bcc h VAL 69 N 0.00 0.94 -0.12 0.00 2.07 0.15 -1.05 116.25 118.23 1bcc h VAL 69 Ca -0.10 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 1bcc h VAL 69 Cb 1.36 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1bcc h VAL 69 CO 0.03 0.13 -0.05 0.00 0.02 0.00 0.00 177.57 177.69 1bcc h ALA 70 N 1.61 0.17 0.00 1.67 0.00 -1.12 0.72 119.26 122.30 1bcc h ALA 70 Ca 0.36 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1bcc h ALA 70 Cb 0.47 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1bcc h ALA 70 CO -0.14 -0.05 0.23 -2.39 0.00 0.00 0.00 179.25 176.90 1bcc n HIS 71 N -4.70 0.51 0.00 0.00 -0.00 -0.42 -3.63 115.22 106.99 1bcc n HIS 71 Ca -0.06 0.27 0.00 0.00 -0.00 0.00 0.00 57.72 57.92 1bcc n HIS 71 Cb 0.28 -0.77 0.00 0.00 -0.00 0.00 0.00 29.99 29.50 1bcc n HIS 71 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 1bcc n LYS 72 N -2.09 0.50 -0.25 -1.40 5.02 -1.10 -4.92 118.16 113.91 1bcc n LYS 72 Ca -0.01 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.21 1bcc n LYS 72 Cb 0.25 -0.67 -0.06 0.00 -0.02 0.00 0.00 35.03 34.53 1bcc n LYS 72 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1bcc n LEU 73 N -1.54 -0.63 0.03 -0.35 0.00 0.25 0.49 117.00 115.24 1bcc n LEU 73 Ca 0.00 1.23 0.02 0.00 0.00 0.00 0.00 56.01 57.25 1bcc n LEU 73 Cb 0.17 -0.22 0.08 0.00 0.00 0.00 0.00 43.42 43.45 1bcc n LEU 73 CO 0.00 -0.95 0.55 0.49 0.00 0.00 0.00 177.39 177.49 1bcc n PHE 74 N -4.48 0.10 0.17 1.96 3.01 -1.26 -1.77 117.46 115.19 1bcc n PHE 74 Ca 0.01 0.05 0.02 0.00 1.01 0.00 0.00 57.45 58.55 1bcc n PHE 74 Cb 0.16 -0.49 0.37 0.00 -0.01 0.00 0.00 39.48 39.50 1bcc n PHE 74 CO 0.00 0.00 0.00 -0.91 1.01 0.00 0.00 176.76 176.86 1bcc h ASN 75 N 0.00 0.07 0.61 4.37 2.35 -0.32 -3.16 115.58 119.51 1bcc h ASN 75 Ca 0.00 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.69 1bcc h ASN 75 Cb 0.20 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 1bcc h ASN 75 CO 0.00 0.38 -1.42 -1.20 -1.65 0.00 0.00 177.43 173.54 1bcc n SER 76 N -4.15 0.57 -4.79 5.81 7.64 -0.73 -4.94 113.62 113.03 1bcc n SER 76 Ca -0.02 0.23 -0.36 0.00 1.01 0.00 0.00 58.87 59.73 1bcc n SER 76 Cb 0.37 0.87 -0.06 0.00 -1.01 0.00 0.00 64.21 64.39 1bcc n SER 76 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1bcc s LEU 77 N -5.19 4.18 0.00 -3.43 1.43 -1.20 -5.04 118.68 109.43 1bcc s LEU 77 Ca -0.04 1.89 0.31 0.00 -1.03 0.00 0.00 54.13 55.27 1bcc s LEU 77 Cb 0.11 -4.18 1.71 0.00 0.03 0.00 0.00 46.19 43.85 1bcc s LEU 77 CO 0.83 -0.30 2.12 1.17 0.23 0.00 0.00 176.35 180.40