#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v9j n LYS 2 N 0.00 -2.35 0.00 0.03 4.01 -1.26 -4.83 118.16 113.77 1v9j n LYS 2 Ca 0.00 0.99 0.00 0.00 -0.51 0.00 0.00 58.31 58.79 1v9j n LYS 2 Cb 0.00 -5.70 0.00 0.00 -0.51 0.00 0.00 35.03 28.82 1v9j n LYS 2 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1v9j n GLY 3 N -1.12 0.00 3.55 0.72 0.00 -1.26 -5.08 105.19 102.01 1v9j n GLY 3 Ca -0.22 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.52 1v9j n GLY 3 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v9j s SER 4 N -3.86 1.49 0.49 1.61 0.01 -1.26 -5.04 113.70 107.15 1v9j s SER 4 Ca 0.00 1.41 0.00 0.00 1.31 0.00 0.00 55.95 58.67 1v9j s SER 4 Cb 0.00 -2.15 0.01 0.00 0.21 0.00 0.00 66.02 64.08 1v9j s SER 4 CO 0.00 -3.87 0.72 -0.55 0.41 0.00 0.00 173.24 169.95 1v9j s SER 5 N -2.83 5.65 0.08 2.44 0.15 -1.26 -4.96 113.70 112.97 1v9j s SER 5 Ca 0.67 0.23 0.00 0.00 0.70 0.00 0.00 55.95 57.56 1v9j s SER 5 Cb -0.23 -1.35 0.00 0.00 -1.71 0.00 0.00 66.02 62.73 1v9j s SER 5 CO 0.62 -0.86 0.00 1.57 1.20 0.00 0.00 173.24 175.77 1v9j n HIS 6 N -2.20 -2.44 -3.12 3.44 -0.00 -1.26 -5.13 115.22 104.50 1v9j n HIS 6 Ca 0.04 0.29 -0.39 0.00 -0.00 0.00 0.00 57.72 57.65 1v9j n HIS 6 Cb 0.58 1.04 -0.06 0.00 -0.00 0.00 0.00 29.99 31.55 1v9j n HIS 6 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 1v9j s HIS 7 N -2.00 3.85 -0.51 1.57 -3.43 -1.26 -5.04 115.29 108.47 1v9j s HIS 7 Ca 0.00 1.45 0.03 0.00 -0.80 0.00 0.00 55.06 55.75 1v9j s HIS 7 Cb 0.00 -2.64 0.14 0.00 -1.43 0.00 0.00 32.58 28.65 1v9j s HIS 7 CO 0.00 0.54 0.29 -1.58 -2.00 0.00 0.00 174.74 171.99 1v9j s HIS 8 N -1.09 2.64 -0.76 0.38 2.46 -1.26 -5.02 115.29 112.64 1v9j s HIS 8 Ca 0.32 -2.85 0.01 0.00 0.47 0.00 0.00 55.06 53.02 1v9j s HIS 8 Cb -0.21 -2.32 0.19 0.00 -0.13 0.00 0.00 32.58 30.11 1v9j s HIS 8 CO 0.23 -0.73 0.59 -1.01 -2.47 0.00 0.00 174.74 171.34 1v9j s HIS 9 N -0.19 3.65 -0.54 3.88 3.76 -1.26 -4.90 115.29 119.68 1v9j s HIS 9 Ca 0.19 -3.10 0.01 0.00 -0.15 0.00 0.00 55.06 52.01 1v9j s HIS 9 Cb -0.20 -3.02 0.53 0.00 1.11 0.00 0.00 32.58 30.99 1v9j s HIS 9 CO -0.04 -0.69 1.97 0.72 -0.85 0.00 0.00 174.74 175.85 1v9j n HIS 10 N 2.46 3.03 0.41 1.40 8.25 -1.26 -4.64 115.22 124.86 1v9j n HIS 10 Ca 0.17 -2.42 -0.19 0.00 -0.26 0.00 0.00 57.72 55.03 1v9j n HIS 10 Cb 0.36 -1.19 -0.09 0.00 1.12 0.00 0.00 29.99 30.19 1v9j n HIS 10 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1v9j h HIS 11 N 1.50 -0.94 -0.47 4.41 6.17 -1.90 -3.14 115.15 120.77 1v9j h HIS 11 Ca 0.60 -0.02 -0.29 0.00 0.71 0.00 0.00 60.37 61.36 1v9j h HIS 11 Cb 1.73 0.31 -0.18 0.00 2.52 0.00 0.00 27.41 31.79 1v9j h HIS 11 CO 1.45 -0.58 -0.15 -1.13 0.71 0.00 0.00 177.93 178.23 1v9j n SER 12 N -5.52 3.36 -1.50 3.26 3.41 -1.26 -4.52 113.62 110.84 1v9j n SER 12 Ca -0.14 -3.80 0.00 0.00 -0.26 0.00 0.00 58.87 54.67 1v9j n SER 12 Cb 0.41 -0.61 -0.00 0.00 -0.26 0.00 0.00 64.21 63.75 1v9j n SER 12 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1v9j n SER 13 N -1.03 0.32 -2.74 4.04 7.64 -1.22 -5.03 113.62 115.60 1v9j n SER 13 Ca 0.38 -2.01 0.02 0.00 1.01 0.00 0.00 58.87 58.27 1v9j n SER 13 Cb 0.98 -0.09 0.01 0.00 -1.01 0.00 0.00 64.21 64.10 1v9j n SER 13 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1v9j s GLY 14 N -1.80 -1.50 -0.26 0.23 0.00 -1.19 -4.88 107.32 97.92 1v9j s GLY 14 Ca 0.22 1.61 -0.14 0.00 0.00 0.00 0.00 44.72 46.41 1v9j s GLY 14 CO -0.11 4.41 -0.20 0.00 0.00 0.00 0.00 173.10 177.21 1v9j n ALA 15 N 3.74 1.11 -2.35 3.20 0.00 -1.26 -4.70 120.51 120.24 1v9j n ALA 15 Ca 0.05 -0.95 -0.38 0.00 0.00 0.00 0.00 53.44 52.16 1v9j n ALA 15 Cb 0.64 -0.07 -0.02 0.00 0.00 0.00 0.00 19.45 20.00 1v9j n ALA 15 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1v9j n SER 16 N -4.19 4.23 -1.22 0.00 3.41 -1.26 -4.35 113.62 110.25 1v9j n SER 16 Ca -0.48 -2.84 -0.01 0.00 -0.26 0.00 0.00 58.87 55.28 1v9j n SER 16 Cb 0.85 -1.73 -0.02 0.00 -0.26 0.00 0.00 64.21 63.05 1v9j n SER 16 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1v9j n LEU 17 N 10.33 0.05 -0.02 1.04 7.94 -1.26 -4.93 117.00 130.15 1v9j n LEU 17 Ca 0.48 -1.94 -0.20 0.00 -1.11 0.00 0.00 56.01 53.24 1v9j n LEU 17 Cb 0.46 0.00 -0.13 0.00 0.53 0.00 0.00 43.42 44.27 1v9j n LEU 17 CO 0.75 0.95 -0.22 0.58 -1.11 0.00 0.00 177.39 178.34 1v9j h VAL 18 N 6.05 1.23 0.14 1.96 2.07 -1.98 -3.39 116.25 122.33 1v9j h VAL 18 Ca -0.37 -2.38 0.01 0.00 0.82 0.00 0.00 66.70 64.79 1v9j h VAL 18 Cb 1.64 2.83 -0.04 0.00 -1.52 0.00 0.00 31.29 34.20 1v9j h VAL 18 CO -0.08 0.62 -0.46 -0.65 0.02 0.00 0.00 177.57 177.02 1v9j h PRO 19 N -0.56 -0.65 -6.21 1.57 0.11 -1.97 -3.39 132.00 120.90 1v9j h PRO 19 Ca -0.23 0.04 -0.56 0.00 0.11 0.00 0.00 66.00 65.36 1v9j h PRO 19 Cb 1.53 0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.76 1v9j h PRO 19 CO 0.02 -0.44 0.85 -0.98 -0.21 0.00 0.00 178.00 177.24 1v9j s ARG 20 N -5.39 4.27 0.00 1.05 3.03 -1.26 -4.81 118.95 115.83 1v9j s ARG 20 Ca -0.14 1.70 0.00 0.00 2.03 0.00 0.00 55.73 59.31 1v9j s ARG 20 Cb 0.05 -3.71 0.00 0.00 -1.03 0.00 0.00 34.95 30.26 1v9j s ARG 20 CO 0.52 -0.63 0.00 0.41 -1.13 0.00 0.00 175.30 174.47 1v9j n GLY 21 N 3.56 0.24 3.86 3.88 0.00 -1.26 -4.95 105.19 110.52 1v9j n GLY 21 Ca 0.13 0.26 -0.37 0.00 0.00 0.00 0.00 46.02 46.04 1v9j n GLY 21 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1v9j s SER 22 N 0.00 6.62 0.54 1.61 0.15 -1.26 -5.10 113.70 116.27 1v9j s SER 22 Ca 0.00 0.74 -0.05 0.00 0.70 0.00 0.00 55.95 57.34 1v9j s SER 22 Cb 0.00 -2.17 -0.01 0.00 -1.71 0.00 0.00 66.02 62.14 1v9j s SER 22 CO 0.00 0.31 0.83 -0.70 1.20 0.00 0.00 173.24 174.88 1v9j s GLU 23 N -1.32 3.12 0.00 5.44 -6.30 -1.26 -4.99 118.70 113.40 1v9j s GLU 23 Ca 0.24 -0.01 0.00 0.00 -2.50 0.00 0.00 54.97 52.69 1v9j s GLU 23 Cb -0.14 -2.34 0.00 0.00 0.00 0.00 0.00 34.13 31.64 1v9j s GLU 23 CO 0.12 -0.49 0.00 0.41 0.02 0.00 0.00 175.26 175.32 1v9j n GLY 24 N -2.42 -1.48 0.65 -1.50 0.00 -1.26 -4.75 105.19 94.42 1v9j n GLY 24 Ca 0.03 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 43.87 1v9j n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v9j n ALA 25 N -0.15 2.58 -1.84 4.61 0.00 -1.26 -4.84 120.51 119.60 1v9j n ALA 25 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1v9j n ALA 25 Cb 0.00 0.44 0.14 0.00 0.00 0.00 0.00 19.45 20.04 1v9j n ALA 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v9j n ALA 26 N -2.71 3.16 0.19 0.00 0.00 -1.26 -4.73 120.51 115.15 1v9j n ALA 26 Ca 0.00 -2.92 0.09 0.00 0.00 0.00 0.00 53.44 50.61 1v9j n ALA 26 Cb 0.44 -0.47 0.61 0.00 0.00 0.00 0.00 19.45 20.03 1v9j n ALA 26 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1v9j h THR 27 N 2.87 0.98 0.00 0.00 1.35 -1.88 -2.97 112.91 113.26 1v9j h THR 27 Ca -0.07 -0.03 -0.12 0.00 -0.55 0.00 0.00 66.41 65.64 1v9j h THR 27 Cb 1.28 0.89 -0.02 0.00 -1.73 0.00 0.00 68.15 68.56 1v9j h THR 27 CO 0.03 0.02 -1.62 0.80 -0.25 0.00 0.00 175.52 174.50 1v9j n MET 28 N -4.51 1.70 -1.59 4.72 1.56 -1.26 -4.92 117.12 112.82 1v9j n MET 28 Ca -0.00 -0.04 -0.38 0.00 -0.27 0.00 0.00 57.70 57.01 1v9j n MET 28 Cb 0.15 -1.25 -0.03 0.00 2.15 0.00 0.00 33.22 34.24 1v9j n MET 28 CO 0.00 0.00 0.00 -2.00 -0.73 0.00 0.00 175.97 173.24 1v9j s GLU 29 N -2.41 2.39 0.01 2.12 2.56 -1.12 -4.17 118.70 118.09 1v9j s GLU 29 Ca -0.05 1.54 -0.01 0.00 0.00 0.00 0.00 54.97 56.46 1v9j s GLU 29 Cb 0.04 -4.52 0.00 0.00 2.00 0.00 0.00 34.13 31.66 1v9j s GLU 29 CO 0.42 -2.94 0.01 1.28 -0.56 0.00 0.00 175.26 173.46 1v9j n LEU 30 N 14.66 -6.68 -4.31 2.70 4.32 -1.26 -4.91 117.00 121.52 1v9j n LEU 30 Ca 0.34 2.87 -0.16 0.00 -0.02 0.00 0.00 56.01 59.04 1v9j n LEU 30 Cb 0.52 -3.28 -0.10 0.00 -1.62 0.00 0.00 43.42 38.93 1v9j n LEU 30 CO 0.70 -3.02 -0.32 -0.55 -1.22 0.00 0.00 177.39 172.97 1v9j s SER 31 N -0.61 1.63 0.18 -1.43 0.15 -1.26 -5.00 113.70 107.37 1v9j s SER 31 Ca -0.01 -1.22 -0.13 0.00 0.70 0.00 0.00 55.95 55.29 1v9j s SER 31 Cb 0.00 0.05 0.09 0.00 -1.71 0.00 0.00 66.02 64.44 1v9j s SER 31 CO 0.03 -0.54 1.84 0.00 1.20 0.00 0.00 173.24 175.77 1v9j h ALA 32 N 2.52 0.70 -0.13 5.45 0.00 -1.98 -2.04 119.26 123.79 1v9j h ALA 32 Ca -0.38 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.43 1v9j h ALA 32 Cb 1.22 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1v9j h ALA 32 CO 0.64 0.12 -0.25 0.22 0.00 0.00 0.00 179.25 179.98 1v9j h ASP 33 N 0.73 0.22 0.34 0.00 3.58 -1.96 -0.79 116.42 118.54 1v9j h ASP 33 Ca 0.21 -0.06 -0.02 0.00 0.42 0.00 0.00 57.03 57.58 1v9j h ASP 33 Cb -0.06 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 40.93 1v9j h ASP 33 CO -0.06 0.48 -0.16 0.22 -2.88 0.00 0.00 179.24 176.83 1v9j h TYR 34 N 0.20 -0.43 -0.02 0.28 3.20 -1.78 0.14 116.97 118.57 1v9j h TYR 34 Ca 0.03 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.77 1v9j h TYR 34 Cb 0.56 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.95 1v9j h TYR 34 CO 0.01 -0.25 -0.56 -0.07 -1.64 0.00 0.00 178.16 175.66 1v9j h LEU 35 N -0.49 0.06 0.64 2.82 3.38 -1.39 -1.87 115.31 118.45 1v9j h LEU 35 Ca -0.05 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1v9j h LEU 35 Cb 0.37 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.11 1v9j h LEU 35 CO 0.08 0.60 -0.31 -0.09 0.09 0.00 0.00 178.44 178.81 1v9j h ARG 36 N 0.04 -0.83 -0.19 1.13 2.43 -0.92 -0.86 114.38 115.18 1v9j h ARG 36 Ca -0.00 0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1v9j h ARG 36 Cb 0.99 0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 1v9j h ARG 36 CO 0.08 -0.55 0.08 0.93 -1.51 0.00 0.00 179.97 178.99 1v9j h GLU 37 N -1.23 0.26 0.37 0.20 5.08 -0.79 0.14 114.58 118.61 1v9j h GLU 37 Ca -0.09 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 1v9j h GLU 37 Cb 0.66 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1v9j h GLU 37 CO 0.14 0.22 -0.18 -0.22 -1.00 0.00 0.00 179.01 177.97 1v9j h LYS 38 N 0.26 -0.48 -0.46 2.33 3.64 -1.33 -0.88 116.57 119.65 1v9j h LYS 38 Ca 0.07 0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 1v9j h LYS 38 Cb 0.05 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 1v9j h LYS 38 CO -0.01 -0.16 0.14 -0.07 -2.27 0.00 0.00 179.45 177.08 1v9j h LEU 39 N -0.87 0.67 -0.20 5.20 3.38 -0.96 0.81 115.31 123.34 1v9j h LEU 39 Ca -0.05 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.72 1v9j h LEU 39 Cb 0.54 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1v9j h LEU 39 CO 0.08 0.71 0.08 -0.09 0.09 0.00 0.00 178.44 179.31 1v9j h ARG 40 N 0.61 0.18 -0.02 1.13 2.43 -0.77 0.46 114.38 118.40 1v9j h ARG 40 Ca 0.15 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.20 1v9j h ARG 40 Cb 0.28 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1v9j h ARG 40 CO -0.00 0.12 -0.40 1.96 -1.51 0.00 0.00 179.97 180.13 1v9j h GLN 41 N 0.19 0.30 0.97 0.20 1.08 -1.06 0.28 115.11 117.07 1v9j h GLN 41 Ca 0.08 -0.30 -0.05 0.00 -1.45 0.00 0.00 58.65 56.93 1v9j h GLN 41 Cb 0.04 0.08 0.01 0.00 -0.05 0.00 0.00 27.48 27.55 1v9j h GLN 41 CO -0.07 0.99 -0.49 0.22 -0.95 0.00 0.00 178.83 178.53 1v9j h ASP 42 N -0.26 -1.18 0.99 1.46 3.58 0.73 -2.95 116.42 118.77 1v9j h ASP 42 Ca -0.05 0.05 -0.06 0.00 0.42 0.00 0.00 57.03 57.40 1v9j h ASP 42 Cb 1.12 0.32 -0.01 0.00 1.72 0.00 0.00 39.33 42.48 1v9j h ASP 42 CO 0.08 -0.81 -0.26 -0.07 -2.88 0.00 0.00 179.24 175.29 1v9j h LEU 43 N -1.34 0.00 -2.46 2.28 3.38 -0.21 -3.48 115.31 113.48 1v9j h LEU 43 Ca -0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1v9j h LEU 43 Cb 1.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1v9j h LEU 43 CO 0.20 0.26 -0.27 -0.62 0.09 0.00 0.00 178.44 178.11 1v9j n GLU 44 N -3.39 -1.60 -3.79 1.13 1.02 0.91 -4.94 120.64 109.98 1v9j n GLU 44 Ca 0.00 1.62 -0.24 0.00 -0.02 0.00 0.00 57.16 58.52 1v9j n GLU 44 Cb 0.47 -4.79 -0.02 0.00 -0.02 0.00 0.00 31.44 27.08 1v9j n GLU 44 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1v9j s ALA 45 N -2.49 4.22 -0.15 0.62 0.00 -0.80 -4.75 121.76 118.42 1v9j s ALA 45 Ca 0.13 -1.59 -0.11 0.00 0.00 0.00 0.00 51.96 50.39 1v9j s ALA 45 Cb -0.04 -0.79 -0.06 0.00 0.00 0.00 0.00 23.12 22.23 1v9j s ALA 45 CO 0.60 -0.36 -0.06 1.49 0.00 0.00 0.00 175.76 177.42 1v9j h GLU 46 N 0.90 0.00 -4.38 0.00 4.81 -1.73 -3.48 114.58 110.70 1v9j h GLU 46 Ca -0.39 0.00 -0.46 0.00 -0.13 0.00 0.00 59.36 58.38 1v9j h GLU 46 Cb 1.28 0.00 -0.33 0.00 0.63 0.00 0.00 28.75 30.33 1v9j h GLU 46 CO 0.58 0.21 -0.80 -1.58 -0.73 0.00 0.00 179.01 176.70 1v9j s HIS 47 N -2.19 1.12 0.16 0.92 2.46 -1.15 -5.04 115.29 111.58 1v9j s HIS 47 Ca -0.16 -0.37 0.03 0.00 0.47 0.00 0.00 55.06 55.03 1v9j s HIS 47 Cb 0.02 -0.86 -0.05 0.00 -0.13 0.00 0.00 32.58 31.57 1v9j s HIS 47 CO 0.28 -0.21 -0.04 0.14 -2.47 0.00 0.00 174.74 172.43 1v9j s VAL 48 N 0.65 0.87 -0.16 0.89 -7.23 -1.26 -2.10 120.40 112.07 1v9j s VAL 48 Ca -0.12 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.00 1v9j s VAL 48 Cb -0.14 -1.98 0.08 0.00 0.56 0.00 0.00 36.38 34.90 1v9j s VAL 48 CO 0.02 -0.62 0.33 -0.70 -0.31 0.00 0.00 175.10 173.82 1v9j s GLU 49 N -3.84 0.22 0.19 4.82 2.56 -0.72 -4.94 118.70 116.98 1v9j s GLU 49 Ca 0.20 0.87 0.06 0.00 0.00 0.00 0.00 54.97 56.10 1v9j s GLU 49 Cb 0.05 0.12 -0.04 0.00 2.00 0.00 0.00 34.13 36.26 1v9j s GLU 49 CO 0.02 -0.27 0.11 0.54 -0.56 0.00 0.00 175.26 175.09 1v9j s VAL 50 N 2.50 4.26 0.07 3.70 0.11 -1.26 -0.05 120.40 129.72 1v9j s VAL 50 Ca 0.00 -1.26 -0.05 0.00 -2.93 0.00 0.00 61.98 57.75 1v9j s VAL 50 Cb -0.12 -3.19 -0.02 0.00 -1.53 0.00 0.00 36.38 31.51 1v9j s VAL 50 CO -0.10 -0.17 0.07 -0.70 -3.33 0.00 0.00 175.10 170.88 1v9j s GLU 51 N -3.23 0.72 -0.14 1.54 2.56 0.14 -4.98 118.70 115.32 1v9j s GLU 51 Ca 0.31 -1.09 -0.12 0.00 0.00 0.00 0.00 54.97 54.06 1v9j s GLU 51 Cb -0.09 0.27 0.04 0.00 2.00 0.00 0.00 34.13 36.35 1v9j s GLU 51 CO 0.22 -0.18 0.36 0.34 -0.56 0.00 0.00 175.26 175.44 1v9j s ASP 52 N -2.89 -0.39 -0.97 -1.70 2.15 -1.26 -2.40 116.67 109.21 1v9j s ASP 52 Ca 0.06 0.74 -0.03 0.00 0.43 0.00 0.00 52.55 53.75 1v9j s ASP 52 Cb 0.06 0.73 0.27 0.00 -0.30 0.00 0.00 42.92 43.68 1v9j s ASP 52 CO -0.10 -0.13 1.08 0.35 -0.17 0.00 0.00 175.17 176.19 1v9j n THR 53 N 3.08 4.04 -1.48 1.71 -2.24 -1.08 -5.01 114.28 113.29 1v9j n THR 53 Ca -0.15 -5.46 0.16 0.00 -2.27 0.00 0.00 64.05 56.33 1v9j n THR 53 Cb 0.57 -2.29 -0.09 0.00 -2.10 0.00 0.00 70.33 66.42 1v9j n THR 53 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1v9j n THR 54 N 1.86 -1.17 -3.21 4.28 -1.04 -1.26 -4.55 114.28 109.20 1v9j n THR 54 Ca 0.25 1.03 -0.25 0.00 -2.04 0.00 0.00 64.05 63.04 1v9j n THR 54 Cb 0.37 -1.57 -0.06 0.00 -1.82 0.00 0.00 70.33 67.25 1v9j n THR 54 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1v9j n LEU 55 N -4.23 3.06 0.00 -4.42 4.77 -1.26 -4.74 117.00 110.18 1v9j n LEU 55 Ca -0.09 -5.35 -0.09 0.00 -0.03 0.00 0.00 56.01 50.45 1v9j n LEU 55 Cb 0.68 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 1v9j n LEU 55 CO 0.04 2.18 0.04 -3.20 -1.33 0.00 0.00 177.39 175.11 1v9j n ASN 56 N 0.53 1.51 -2.28 -1.43 5.15 -1.26 -4.99 115.26 112.49 1v9j n ASN 56 Ca 0.28 -1.66 -0.31 0.00 -0.60 0.00 0.00 54.58 52.30 1v9j n ASN 56 Cb 0.45 -0.03 0.12 0.00 -0.53 0.00 0.00 39.78 39.79 1v9j n ASN 56 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1v9j n ARG 57 N -1.02 2.53 0.00 1.20 5.12 -1.26 -4.35 116.66 118.88 1v9j n ARG 57 Ca 0.00 -3.19 0.00 0.00 -1.93 0.00 0.00 57.85 52.73 1v9j n ARG 57 Cb 0.22 -2.25 0.00 0.00 -1.16 0.00 0.00 32.46 29.27 1v9j n ARG 57 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1v9j s ALA 59 N -1.97 -0.47 -0.26 0.00 0.00 -1.26 -5.14 121.76 112.66 1v9j s ALA 59 Ca 0.00 0.28 -0.01 0.00 0.00 0.00 0.00 51.96 52.23 1v9j s ALA 59 Cb 0.00 -0.12 0.13 0.00 0.00 0.00 0.00 23.12 23.13 1v9j s ALA 59 CO 0.00 -0.16 0.32 -0.08 0.00 0.00 0.00 175.76 175.84 1v9j s THR 60 N -0.61 -0.47 -0.09 0.00 -1.32 -1.26 -4.22 115.64 107.66 1v9j s THR 60 Ca -0.07 -0.28 0.02 0.00 -1.21 0.00 0.00 61.69 60.15 1v9j s THR 60 Cb -0.04 -0.88 0.01 0.00 -1.51 0.00 0.00 72.50 70.08 1v9j s THR 60 CO 0.01 -0.30 -0.13 -0.94 -2.21 0.00 0.00 174.62 171.05 1v9j s SER 61 N 2.43 2.17 0.02 8.08 1.04 -1.26 -2.52 113.70 123.66 1v9j s SER 61 Ca 0.10 -0.37 0.06 0.00 0.48 0.00 0.00 55.95 56.22 1v9j s SER 61 Cb -0.14 -0.97 -0.03 0.00 0.10 0.00 0.00 66.02 64.98 1v9j s SER 61 CO -0.24 0.01 -0.14 -0.36 0.98 0.00 0.00 173.24 173.49 1v9j s PHE 62 N 0.94 2.66 -0.08 5.02 0.08 -0.01 -2.65 117.98 123.94 1v9j s PHE 62 Ca -0.09 -0.19 -0.01 0.00 0.12 0.00 0.00 56.93 56.77 1v9j s PHE 62 Cb -0.15 -1.52 0.03 0.00 -0.57 0.00 0.00 43.02 40.81 1v9j s PHE 62 CO -0.00 0.28 -0.03 0.50 -0.10 0.00 0.00 175.22 175.87 1v9j s ARG 63 N -1.38 0.96 -0.03 0.44 3.52 -1.01 -1.94 118.95 119.52 1v9j s ARG 63 Ca 0.15 -0.05 0.07 0.00 -0.13 0.00 0.00 55.73 55.78 1v9j s ARG 63 Cb -0.11 -1.16 -0.02 0.00 -1.56 0.00 0.00 34.95 32.10 1v9j s ARG 63 CO 0.06 -0.25 -0.25 0.14 -0.81 0.00 0.00 175.30 174.19 1v9j s VAL 64 N 1.71 2.17 -0.05 7.11 -7.23 -0.81 0.27 120.40 123.56 1v9j s VAL 64 Ca 0.02 -1.06 0.06 0.00 -1.81 0.00 0.00 61.98 59.19 1v9j s VAL 64 Cb -0.13 -1.76 -0.01 0.00 0.56 0.00 0.00 36.38 35.04 1v9j s VAL 64 CO -0.05 0.58 -0.24 -0.22 -0.31 0.00 0.00 175.10 174.85 1v9j s LEU 65 N -0.59 2.05 -0.02 1.32 1.98 0.92 -2.85 118.68 121.49 1v9j s LEU 65 Ca 0.09 -0.49 0.02 0.00 -2.89 0.00 0.00 54.13 50.86 1v9j s LEU 65 Cb -0.10 -1.33 0.00 0.00 0.66 0.00 0.00 46.19 45.42 1v9j s LEU 65 CO -0.01 0.25 -0.07 -0.69 -1.89 0.00 0.00 176.35 173.94 1v9j s VAL 66 N -0.21 0.61 -0.07 1.68 1.01 -0.89 -1.76 120.40 120.77 1v9j s VAL 66 Ca -0.02 -0.29 -0.03 0.00 0.00 0.00 0.00 61.98 61.65 1v9j s VAL 66 Cb -0.13 -0.54 0.04 0.00 0.00 0.00 0.00 36.38 35.75 1v9j s VAL 66 CO 0.03 0.19 0.12 -0.69 0.00 0.00 0.00 175.10 174.75 1v9j s VAL 67 N 0.10 -0.20 -0.03 2.92 1.01 -0.89 -2.83 120.40 120.48 1v9j s VAL 67 Ca -0.01 0.38 -0.29 0.00 0.00 0.00 0.00 61.98 62.06 1v9j s VAL 67 Cb -0.06 -0.23 0.10 0.00 0.00 0.00 0.00 36.38 36.19 1v9j s VAL 67 CO -0.00 0.16 1.31 -0.55 0.00 0.00 0.00 175.10 176.02 1v9j s SER 68 N 2.24 -0.00 0.13 3.32 0.15 -1.15 -1.86 113.70 116.53 1v9j s SER 68 Ca 0.04 -0.15 0.23 0.00 0.70 0.00 0.00 55.95 56.77 1v9j s SER 68 Cb -0.12 0.12 0.02 0.00 -1.71 0.00 0.00 66.02 64.33 1v9j s SER 68 CO -0.05 -0.23 1.01 0.00 1.20 0.00 0.00 173.24 175.18 1v9j n ALA 69 N -0.83 2.80 -0.09 5.45 0.00 -1.26 -4.09 120.51 122.48 1v9j n ALA 69 Ca 0.02 -0.30 0.17 0.00 0.00 0.00 0.00 53.44 53.33 1v9j n ALA 69 Cb 0.59 -1.05 0.58 0.00 0.00 0.00 0.00 19.45 19.58 1v9j n ALA 69 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1v9j h LYS 70 N 0.00 0.23 -0.00 0.00 3.11 -1.92 0.12 116.57 118.11 1v9j h LYS 70 Ca 0.00 -0.01 -0.17 0.00 -2.81 0.00 0.00 60.65 57.66 1v9j h LYS 70 Cb 0.91 -0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 32.07 1v9j h LYS 70 CO 0.00 0.15 -0.77 0.74 -2.81 0.00 0.00 179.45 176.76 1v9j h PHE 71 N 0.24 0.09 -0.20 1.91 0.04 -1.92 -3.14 116.94 113.95 1v9j h PHE 71 Ca 0.32 -0.05 0.00 0.00 2.80 0.00 0.00 57.97 61.04 1v9j h PHE 71 Cb 0.92 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 39.05 1v9j h PHE 71 CO -0.00 0.81 0.14 0.93 -0.60 0.00 0.00 178.31 179.58 1v9j h GLU 72 N 0.04 0.27 -0.54 1.51 4.39 -0.96 -2.44 114.58 116.84 1v9j h GLU 72 Ca -0.02 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.68 1v9j h GLU 72 Cb 1.36 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.92 1v9j h GLU 72 CO 0.11 0.18 0.35 0.78 -1.16 0.00 0.00 179.01 179.27 1v9j h GLY 73 N 0.28 0.76 -2.40 -3.84 0.00 -1.48 -3.43 103.07 92.96 1v9j h GLY 73 Ca 0.07 -0.28 -0.48 0.00 0.00 0.00 0.00 47.33 46.65 1v9j h GLY 73 CO -0.02 0.26 -0.07 0.54 0.00 0.00 0.00 176.54 177.26 1v9j s LYS 74 N -6.15 3.49 1.02 4.80 1.02 -0.92 -5.09 119.74 117.92 1v9j s LYS 74 Ca -0.13 -0.12 -0.12 0.00 0.02 0.00 0.00 55.97 55.62 1v9j s LYS 74 Cb 0.13 -2.54 0.20 0.00 -0.52 0.00 0.00 37.83 35.10 1v9j s LYS 74 CO 0.75 -0.01 1.08 -1.25 -0.92 0.00 0.00 175.35 174.99 1v9j s PRO 75 N -4.50 0.21 0.16 -1.68 0.04 -1.26 -4.80 135.00 123.18 1v9j s PRO 75 Ca 0.43 0.75 -0.15 0.00 0.04 0.00 0.00 61.00 62.07 1v9j s PRO 75 Cb -0.10 -1.69 0.05 0.00 0.04 0.00 0.00 34.50 32.80 1v9j s PRO 75 CO 0.40 -2.94 1.81 1.25 0.04 0.00 0.00 177.00 177.56 1v9j h LEU 76 N -2.05 0.44 -1.90 -3.56 5.85 -1.95 -1.59 115.31 110.54 1v9j h LEU 76 Ca -0.55 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.17 1v9j h LEU 76 Cb 1.32 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.25 1v9j h LEU 76 CO 0.54 0.31 0.06 0.17 -0.34 0.00 0.00 178.44 179.18 1v9j h LEU 77 N 0.54 0.11 -0.48 2.25 8.10 -2.01 -1.25 115.31 122.58 1v9j h LEU 77 Ca 0.17 -0.00 -0.16 0.00 0.11 0.00 0.00 57.88 58.00 1v9j h LEU 77 Cb -0.01 -0.03 -0.02 0.00 -0.44 0.00 0.00 40.66 40.16 1v9j h LEU 77 CO -0.07 0.08 -0.76 1.56 -4.11 0.00 0.00 178.44 175.14 1v9j h GLN 78 N 0.13 0.03 0.71 0.17 1.08 -1.67 -2.82 115.11 112.74 1v9j h GLN 78 Ca 0.04 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.18 1v9j h GLN 78 Cb -0.01 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1v9j h GLN 78 CO -0.01 0.77 -0.39 0.00 -0.95 0.00 0.00 178.83 178.26 1v9j h ARG 79 N 0.02 -0.98 -0.60 1.46 3.08 -0.39 0.44 114.38 117.40 1v9j h ARG 79 Ca -0.01 0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 1v9j h ARG 79 Cb 1.34 0.22 -0.03 0.00 0.08 0.00 0.00 29.97 31.59 1v9j h ARG 79 CO 0.10 -0.65 0.24 0.45 -1.07 0.00 0.00 179.97 179.03 1v9j h HIS 80 N -1.02 0.89 -0.06 3.04 3.86 -1.63 -2.16 115.15 118.08 1v9j h HIS 80 Ca -0.09 -0.05 -0.10 0.00 -1.16 0.00 0.00 60.37 58.97 1v9j h HIS 80 Cb 0.80 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.99 1v9j h HIS 80 CO -0.06 0.69 -0.42 -0.09 0.86 0.00 0.00 177.93 178.91 1v9j h ARG 81 N 0.87 0.13 -0.08 2.45 2.43 -1.29 -2.93 114.38 115.97 1v9j h ARG 81 Ca 0.21 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.31 1v9j h ARG 81 Cb 0.18 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1v9j h ARG 81 CO -0.02 0.53 0.04 -0.07 -1.51 0.00 0.00 179.97 178.94 1v9j h LEU 82 N 0.11 0.10 -1.58 3.80 3.38 0.54 -0.58 115.31 121.08 1v9j h LEU 82 Ca 0.01 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 1v9j h LEU 82 Cb 0.79 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1v9j h LEU 82 CO 0.06 0.18 0.03 0.58 0.09 0.00 0.00 178.44 179.38 1v9j h VAL 83 N 0.01 1.12 -0.24 1.22 2.07 -1.46 -1.65 116.25 117.32 1v9j h VAL 83 Ca 0.03 -0.43 -0.18 0.00 0.82 0.00 0.00 66.70 66.94 1v9j h VAL 83 Cb 0.11 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1v9j h VAL 83 CO -0.00 0.15 -0.55 0.78 0.02 0.00 0.00 177.57 177.96 1v9j h ASN 84 N 0.30 0.89 0.03 0.57 4.21 -1.28 -3.09 115.58 117.22 1v9j h ASN 84 Ca 0.07 -0.56 -0.08 0.00 1.21 0.00 0.00 56.30 56.94 1v9j h ASN 84 Cb 0.15 -0.26 -0.01 0.00 -1.12 0.00 0.00 38.32 37.08 1v9j h ASN 84 CO -0.00 1.29 -0.24 -0.33 -1.29 0.00 0.00 177.43 176.86 1v9j h GLU 85 N 0.54 0.36 1.01 0.81 5.08 -0.64 0.51 114.58 122.24 1v9j h GLU 85 Ca -0.00 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.18 1v9j h GLU 85 Cb 1.17 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.40 1v9j h GLU 85 CO 0.12 0.58 -0.48 0.00 -1.00 0.00 0.00 179.01 178.23 1v9j n LEU 87 N -5.67 6.47 0.15 0.00 4.77 -1.17 -4.71 117.00 116.84 1v9j n LEU 87 Ca -0.17 -4.77 0.04 0.00 -0.03 0.00 0.00 56.01 51.08 1v9j n LEU 87 Cb 0.53 -0.78 0.44 0.00 -2.33 0.00 0.00 43.42 41.28 1v9j n LEU 87 CO 0.41 1.86 0.92 0.00 -1.33 0.00 0.00 177.39 179.24 1v9j h ALA 88 N 2.50 1.60 -0.00 -1.18 0.00 -0.91 0.83 119.26 122.10 1v9j h ALA 88 Ca 0.48 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1v9j h ALA 88 Cb 0.70 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1v9j h ALA 88 CO 1.22 0.29 -0.09 0.93 0.00 0.00 0.00 179.25 181.60 1v9j h GLU 89 N 0.16 0.07 0.00 0.00 5.08 -1.84 -3.32 114.58 114.73 1v9j h GLU 89 Ca 0.03 -0.07 -0.16 0.00 -1.00 0.00 0.00 59.36 58.17 1v9j h GLU 89 Cb 0.32 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1v9j h GLU 89 CO 0.02 0.81 -0.74 0.93 -1.00 0.00 0.00 179.01 179.03 1v9j h GLU 90 N -0.65 0.00 -0.51 2.33 5.08 -1.90 -3.35 114.58 115.59 1v9j h GLU 90 Ca -0.01 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.40 1v9j h GLU 90 Cb 0.84 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.01 1v9j h GLU 90 CO 0.02 0.74 -0.55 -0.07 -1.00 0.00 0.00 179.01 178.15 1v9j h LEU 91 N 0.00 -1.89 -1.99 1.33 3.38 0.60 0.13 115.31 116.87 1v9j h LEU 91 Ca -0.01 0.26 0.27 0.00 0.09 0.00 0.00 57.88 58.48 1v9j h LEU 91 Cb 1.34 0.79 -0.04 0.00 0.09 0.00 0.00 40.66 42.84 1v9j h LEU 91 CO 0.10 -0.37 0.67 1.55 0.09 0.00 0.00 178.44 180.48 1v9j h PRO 92 N -0.32 0.00 0.00 1.13 0.13 -1.70 0.46 132.00 131.69 1v9j h PRO 92 Ca 0.09 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.07 1v9j h PRO 92 Cb 0.55 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.66 1v9j h PRO 92 CO -0.65 0.00 -0.70 0.45 -0.23 0.00 0.00 178.00 176.87 1v9j h HIS 93 N 0.00 0.00 -2.80 1.56 3.86 -0.95 -3.43 115.15 113.39 1v9j h HIS 93 Ca 0.44 0.00 -0.56 0.00 -1.16 0.00 0.00 60.37 59.09 1v9j h HIS 93 Cb 1.77 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 30.21 1v9j h HIS 93 CO 0.00 0.70 1.03 0.42 0.86 0.00 0.00 177.93 180.94 1v9j s ILE 94 N -3.40 3.89 0.39 2.45 -1.09 0.16 -4.89 121.20 118.71 1v9j s ILE 94 Ca -0.01 1.05 0.11 0.00 -2.23 0.00 0.00 60.65 59.57 1v9j s ILE 94 Cb 0.12 -3.77 0.14 0.00 -1.58 0.00 0.00 42.46 37.37 1v9j s ILE 94 CO 0.78 -0.19 1.90 -0.74 -1.23 0.00 0.00 174.94 175.45 1v9j h HIS 95 N 9.43 0.16 -2.05 3.97 2.76 -1.83 -3.42 115.15 124.17 1v9j h HIS 95 Ca -0.32 -0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 57.79 1v9j h HIS 95 Cb 1.14 -0.04 -0.25 0.00 1.55 0.00 0.00 27.41 29.80 1v9j h HIS 95 CO 0.87 0.35 -0.32 0.00 -1.30 0.00 0.00 177.93 177.53 1v9j s ALA 96 N -4.58 -1.53 0.06 5.26 0.00 -1.05 -5.02 121.76 114.91 1v9j s ALA 96 Ca -0.05 1.66 0.07 0.00 0.00 0.00 0.00 51.96 53.64 1v9j s ALA 96 Cb 0.15 -1.62 -0.03 0.00 0.00 0.00 0.00 23.12 21.62 1v9j s ALA 96 CO 0.73 -0.98 -0.19 0.12 0.00 0.00 0.00 175.76 175.44 1v9j s PHE 97 N 2.71 1.66 -0.04 0.00 2.19 -1.26 -0.83 117.98 122.41 1v9j s PHE 97 Ca 0.03 -0.38 -0.02 0.00 0.33 0.00 0.00 56.93 56.89 1v9j s PHE 97 Cb -0.13 -0.97 0.03 0.00 -1.31 0.00 0.00 43.02 40.64 1v9j s PHE 97 CO -0.16 0.10 0.06 -2.00 1.83 0.00 0.00 175.22 175.05 1v9j s GLU 98 N -1.34 -0.06 -0.07 10.12 2.56 -0.82 -4.98 118.70 124.11 1v9j s GLU 98 Ca 0.06 0.37 0.04 0.00 0.00 0.00 0.00 54.97 55.44 1v9j s GLU 98 Cb -0.09 -0.52 -0.02 0.00 2.00 0.00 0.00 34.13 35.50 1v9j s GLU 98 CO 0.02 -0.33 -0.18 1.14 -0.56 0.00 0.00 175.26 175.35 1v9j s GLN 99 N 2.16 2.68 -0.11 4.30 -2.07 -1.26 -1.93 119.66 123.43 1v9j s GLN 99 Ca 0.05 -0.77 -0.01 0.00 -1.82 0.00 0.00 55.36 52.81 1v9j s GLN 99 Cb -0.12 -2.34 0.03 0.00 -1.09 0.00 0.00 33.01 29.48 1v9j s GLN 99 CO -0.03 0.46 -0.07 0.15 -1.32 0.00 0.00 175.29 174.48 1v9j s LYS 100 N -0.32 1.45 -0.09 9.60 1.02 -1.13 -5.04 119.74 125.23 1v9j s LYS 100 Ca 0.02 -0.22 0.02 0.00 0.02 0.00 0.00 55.97 55.81 1v9j s LYS 100 Cb -0.13 -1.54 -0.02 0.00 -0.52 0.00 0.00 37.83 35.63 1v9j s LYS 100 CO 0.02 -0.27 -0.16 0.95 -0.92 0.00 0.00 175.35 174.98 1v9j s THR 101 N 1.73 2.88 0.20 2.17 -4.23 -1.26 -2.10 115.64 115.04 1v9j s THR 101 Ca 0.05 -0.75 -0.11 0.00 -1.18 0.00 0.00 61.69 59.69 1v9j s THR 101 Cb -0.13 -2.16 -0.00 0.00 1.34 0.00 0.00 72.50 71.56 1v9j s THR 101 CO -0.08 0.56 0.39 -0.76 -0.54 0.00 0.00 174.62 174.18 1v9j s LEU 102 N -0.11 0.58 0.39 4.79 1.43 -1.13 -5.05 118.68 119.58 1v9j s LEU 102 Ca -0.02 -0.87 -0.10 0.00 -1.03 0.00 0.00 54.13 52.11 1v9j s LEU 102 Cb -0.14 1.51 -0.06 0.00 0.03 0.00 0.00 46.19 47.53 1v9j s LEU 102 CO 0.04 -1.01 0.74 0.42 0.23 0.00 0.00 176.35 176.76 1v9j s THR 103 N -3.99 4.82 0.40 5.49 -4.23 -1.26 -2.91 115.64 113.96 1v9j s THR 103 Ca 0.20 0.53 0.12 0.00 -1.18 0.00 0.00 61.69 61.35 1v9j s THR 103 Cb 0.01 -3.73 0.14 0.00 1.34 0.00 0.00 72.50 70.26 1v9j s THR 103 CO 0.04 -0.49 1.90 1.55 -0.54 0.00 0.00 174.62 177.08 1v9j h PRO 104 N 1.31 0.09 -0.20 3.99 0.13 -1.89 -2.01 132.00 133.42 1v9j h PRO 104 Ca -0.47 -0.03 -0.13 0.00 -0.87 0.00 0.00 66.00 64.51 1v9j h PRO 104 Cb 1.19 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1v9j h PRO 104 CO 0.64 0.32 -0.41 1.49 -0.23 0.00 0.00 178.00 179.81 1v9j h GLU 105 N 0.09 0.46 -0.01 0.86 4.81 -1.95 -1.51 114.58 117.33 1v9j h GLU 105 Ca 0.01 -0.23 -0.02 0.00 -0.13 0.00 0.00 59.36 58.99 1v9j h GLU 105 Cb 0.46 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1v9j h GLU 105 CO 0.03 0.80 -0.09 1.96 -0.73 0.00 0.00 179.01 180.98 1v9j h GLN 106 N 0.38 0.07 -0.66 1.92 1.08 -1.87 -3.05 115.11 112.98 1v9j h GLN 106 Ca 0.03 -0.07 0.01 0.00 -1.45 0.00 0.00 58.65 57.18 1v9j h GLN 106 Cb 0.89 0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 28.30 1v9j h GLN 106 CO 0.07 0.80 0.43 2.35 -0.95 0.00 0.00 178.83 181.54 1v9j h TRP 107 N -0.63 0.81 -0.10 2.96 2.91 -1.40 -1.61 115.95 118.88 1v9j h TRP 107 Ca -0.01 0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.04 1v9j h TRP 107 Cb 0.83 -0.27 -0.00 0.00 -0.51 0.00 0.00 29.16 29.20 1v9j h TRP 107 CO 0.18 0.50 0.07 1.15 -1.03 0.00 0.00 178.44 179.30 1v9j h THR 108 N 0.87 1.00 -0.02 2.65 2.02 -1.36 -0.60 112.91 117.46 1v9j h THR 108 Ca 0.25 -0.03 -0.13 0.00 0.77 0.00 0.00 66.41 67.27 1v9j h THR 108 Cb -0.06 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 1v9j h THR 108 CO -0.07 0.02 -0.60 0.03 0.37 0.00 0.00 175.52 175.27 1v9j h ARG 109 N 0.09 0.08 -0.73 6.66 2.47 -1.18 -3.19 114.38 118.59 1v9j h ARG 109 Ca 0.04 -0.06 -0.51 0.00 -1.26 0.00 0.00 59.98 58.19 1v9j h ARG 109 Cb 0.05 0.01 -0.35 0.00 -1.65 0.00 0.00 29.97 28.03 1v9j h ARG 109 CO -0.01 0.66 -0.37 1.04 0.56 0.00 0.00 179.97 181.85 1v9j n GLN 110 N -3.84 3.14 -1.19 0.04 3.00 -0.37 -4.72 117.38 113.44 1v9j n GLN 110 Ca -0.02 -3.84 -0.26 0.00 -0.01 0.00 0.00 57.00 52.87 1v9j n GLN 110 Cb 0.61 -2.20 0.14 0.00 0.00 0.00 0.00 30.24 28.78 1v9j n GLN 110 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1v9j n ARG 111 N -0.82 2.31 -4.41 -1.09 5.12 -0.39 -4.92 116.66 112.47 1v9j n ARG 111 Ca 0.46 -2.90 -0.34 0.00 -1.93 0.00 0.00 57.85 53.14 1v9j n ARG 111 Cb 0.90 -2.14 -0.12 0.00 -1.16 0.00 0.00 32.46 29.94 1v9j n ARG 111 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1v9j s ARG 112 N -3.26 3.65 0.00 5.56 0.52 -1.26 -5.07 118.95 119.09 1v9j s ARG 112 Ca 0.56 -0.53 0.06 0.00 -0.52 0.00 0.00 55.73 55.30 1v9j s ARG 112 Cb 0.46 -2.90 0.36 0.00 0.52 0.00 0.00 34.95 33.38 1v9j s ARG 112 CO 0.06 0.23 0.82 0.39 0.02 0.00 0.00 175.30 176.83