#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 0.00 0.00 2.12 5.02 -1.26 -4.94 118.16 119.10 1v9j n LYS 2 Ca 0.00 0.30 0.00 0.00 -2.02 0.00 0.00 58.31 56.59 1v9j n LYS 2 Cb 0.00 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 33.72 1v9j n LYS 2 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1v9j n GLY 3 N -0.75 -1.05 1.46 0.72 0.00 -1.26 -5.07 105.19 99.25 1v9j n GLY 3 Ca 0.00 0.91 0.00 0.00 0.00 0.00 0.00 46.02 46.93 1v9j n GLY 3 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1v9j n SER 4 N 0.00 0.00 -4.80 1.61 3.41 -1.26 -5.12 113.62 107.46 1v9j n SER 4 Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.26 1v9j n SER 4 Cb 0.00 0.21 -0.07 0.00 -0.26 0.00 0.00 64.21 64.09 1v9j n SER 4 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1v9j s SER 5 N -2.91 7.13 0.28 4.04 0.01 -1.26 -5.07 113.70 115.91 1v9j s SER 5 Ca 0.00 1.75 0.02 0.00 1.31 0.00 0.00 55.95 59.03 1v9j s SER 5 Cb 0.00 -2.56 -0.05 0.00 0.21 0.00 0.00 66.02 63.63 1v9j s SER 5 CO 0.00 -0.22 0.12 -1.00 0.41 0.00 0.00 173.24 172.55 1v9j s HIS 6 N -1.91 1.59 -1.07 2.43 3.76 -1.26 -5.07 115.29 113.76 1v9j s HIS 6 Ca 0.56 -1.23 -0.22 0.00 -0.15 0.00 0.00 55.06 54.01 1v9j s HIS 6 Cb -0.14 -0.92 -0.00 0.00 1.11 0.00 0.00 32.58 32.64 1v9j s HIS 6 CO 0.18 -0.38 1.76 -1.58 -0.85 0.00 0.00 174.74 173.87 1v9j s HIS 7 N -3.67 2.24 -0.13 1.40 2.46 -1.26 -4.63 115.29 111.70 1v9j s HIS 7 Ca 0.36 -0.27 0.18 0.00 0.47 0.00 0.00 55.06 55.80 1v9j s HIS 7 Cb 0.07 -4.37 0.43 0.00 -0.13 0.00 0.00 32.58 28.58 1v9j s HIS 7 CO 0.15 -1.71 1.19 0.72 -2.47 0.00 0.00 174.74 172.62 1v9j n HIS 8 N 11.48 0.25 -3.65 3.88 8.25 -1.26 -5.05 115.22 129.13 1v9j n HIS 8 Ca 0.41 -1.16 -0.04 0.00 -0.26 0.00 0.00 57.72 56.67 1v9j n HIS 8 Cb 0.48 -0.21 -0.07 0.00 1.12 0.00 0.00 29.99 31.31 1v9j n HIS 8 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1v9j s HIS 9 N -1.91 -0.13 -0.12 4.41 5.04 -1.26 -5.15 115.29 116.16 1v9j s HIS 9 Ca 0.36 0.31 -0.02 0.00 -1.54 0.00 0.00 55.06 54.18 1v9j s HIS 9 Cb 0.38 0.46 0.04 0.00 0.04 0.00 0.00 32.58 33.50 1v9j s HIS 9 CO -0.10 -0.06 -0.00 -3.38 -2.34 0.00 0.00 174.74 168.85 1v9j s HIS 10 N 0.04 0.98 -0.46 3.88 -3.43 -1.26 -5.01 115.29 110.03 1v9j s HIS 10 Ca 0.07 -0.53 0.03 0.00 -0.80 0.00 0.00 55.06 53.83 1v9j s HIS 10 Cb -0.05 -0.97 0.61 0.00 -1.43 0.00 0.00 32.58 30.74 1v9j s HIS 10 CO -0.14 -0.46 1.90 0.72 -2.00 0.00 0.00 174.74 174.76 1v9j n HIS 11 N 5.07 2.95 -0.01 0.38 8.25 -1.26 -4.49 115.22 126.11 1v9j n HIS 11 Ca -0.09 -1.95 -0.02 0.00 -0.26 0.00 0.00 57.72 55.40 1v9j n HIS 11 Cb 0.49 -0.99 -0.01 0.00 1.12 0.00 0.00 29.99 30.61 1v9j n HIS 11 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1v9j n SER 12 N -1.03 0.60 0.00 0.41 2.88 -1.26 -5.08 113.62 110.15 1v9j n SER 12 Ca 0.57 0.09 0.00 0.00 -1.33 0.00 0.00 58.87 58.21 1v9j n SER 12 Cb 1.48 -0.37 0.00 0.00 -0.75 0.00 0.00 64.21 64.57 1v9j n SER 12 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1v9j n SER 13 N -3.09 0.00 0.00 -3.46 7.64 -1.26 -5.15 113.62 108.30 1v9j n SER 13 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.85 1v9j n SER 13 Cb 0.11 0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.34 1v9j n SER 13 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v9j n GLY 14 N -0.82 0.99 0.12 0.23 0.00 -1.26 -4.36 105.19 100.09 1v9j n GLY 14 Ca 0.00 -1.39 -0.18 0.00 0.00 0.00 0.00 46.02 44.44 1v9j n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v9j h ALA 15 N 0.00 0.40 -3.54 4.61 0.00 -2.02 -3.51 119.26 115.21 1v9j h ALA 15 Ca 0.00 -1.29 0.36 0.00 0.00 0.00 0.00 54.91 53.98 1v9j h ALA 15 Cb 0.00 0.52 -0.19 0.00 0.00 0.00 0.00 17.79 18.12 1v9j h ALA 15 CO 0.00 1.27 -1.24 0.45 0.00 0.00 0.00 179.25 179.72 1v9j n SER 16 N -3.42 -8.06 -4.75 0.00 2.88 -1.26 -4.65 113.62 94.36 1v9j n SER 16 Ca -0.24 1.42 -0.40 0.00 -1.33 0.00 0.00 58.87 58.32 1v9j n SER 16 Cb 1.05 -4.99 -0.05 0.00 -0.75 0.00 0.00 64.21 59.47 1v9j n SER 16 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1v9j s LEU 17 N -7.30 4.47 -0.43 2.46 1.43 -1.26 -4.47 118.68 113.59 1v9j s LEU 17 Ca 0.00 1.47 -0.16 0.00 -1.03 0.00 0.00 54.13 54.41 1v9j s LEU 17 Cb 0.00 -3.22 0.02 0.00 0.03 0.00 0.00 46.19 43.02 1v9j s LEU 17 CO 0.00 0.05 0.58 0.52 0.23 0.00 0.00 176.35 177.73 1v9j n VAL 18 N 2.59-11.08 -0.05 -1.59 0.31 -1.26 -4.95 118.33 102.29 1v9j n VAL 18 Ca -0.03 0.93 -0.13 0.00 -0.01 0.00 0.00 64.34 65.09 1v9j n VAL 18 Cb 0.50 -7.25 -0.07 0.00 -0.91 0.00 0.00 33.84 26.11 1v9j n VAL 18 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1v9j h PRO 19 N 2.05 0.39 -3.31 5.55 0.13 -1.82 -3.49 132.00 131.49 1v9j h PRO 19 Ca -0.01 -0.22 0.39 0.00 -0.87 0.00 0.00 66.00 65.29 1v9j h PRO 19 Cb 0.97 0.02 -0.12 0.00 0.13 0.00 0.00 31.00 31.99 1v9j h PRO 19 CO 0.20 0.80 -0.68 0.54 -0.23 0.00 0.00 178.00 178.63 1v9j n ARG 20 N -4.50 -3.03 0.00 0.86 5.12 -1.26 -5.07 116.66 108.78 1v9j n ARG 20 Ca -0.06 2.11 0.00 0.00 -1.93 0.00 0.00 57.85 57.96 1v9j n ARG 20 Cb 0.40 -3.66 0.00 0.00 -1.16 0.00 0.00 32.46 28.03 1v9j n ARG 20 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1v9j n GLY 21 N -4.30 -0.32 1.91 -0.13 0.00 -1.26 -5.14 105.19 95.95 1v9j n GLY 21 Ca -0.01 -0.70 -0.18 0.00 0.00 0.00 0.00 46.02 45.13 1v9j n GLY 21 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v9j n SER 22 N 0.00 -3.27 -0.02 1.61 7.64 -1.26 -5.01 113.62 113.30 1v9j n SER 22 Ca 0.00 -0.54 -0.01 0.00 1.01 0.00 0.00 58.87 59.33 1v9j n SER 22 Cb 0.00 -0.60 -0.00 0.00 -1.01 0.00 0.00 64.21 62.60 1v9j n SER 22 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1v9j h GLU 23 N 0.00 0.00 0.00 1.43 4.57 -1.99 -3.49 114.58 115.10 1v9j h GLU 23 Ca -0.24 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.94 1v9j h GLU 23 Cb 0.80 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.39 1v9j h GLU 23 CO 0.14 0.00 0.00 0.41 -1.18 0.00 0.00 179.01 178.38 1v9j n GLY 24 N 1.84 -1.06 3.56 1.92 0.00 -1.26 -5.03 105.19 105.15 1v9j n GLY 24 Ca -0.01 0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1v9j n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v9j s ALA 25 N -2.00 2.71 0.00 4.61 0.00 -1.26 -4.53 121.76 121.29 1v9j s ALA 25 Ca 0.00 -2.12 0.05 0.00 0.00 0.00 0.00 51.96 49.89 1v9j s ALA 25 Cb 0.00 -4.49 0.08 0.00 0.00 0.00 0.00 23.12 18.71 1v9j s ALA 25 CO 0.00 -3.57 0.95 0.00 0.00 0.00 0.00 175.76 173.14 1v9j n ALA 26 N 8.98 3.16 0.17 0.00 0.00 -1.26 -4.84 120.51 126.72 1v9j n ALA 26 Ca 0.28 -0.90 0.08 0.00 0.00 0.00 0.00 53.44 52.90 1v9j n ALA 26 Cb 0.51 -0.36 0.58 0.00 0.00 0.00 0.00 19.45 20.18 1v9j n ALA 26 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1v9j h THR 27 N 5.45 1.01 0.00 0.00 2.02 -2.05 -2.94 112.91 116.40 1v9j h THR 27 Ca -0.39 -0.05 -0.08 0.00 0.77 0.00 0.00 66.41 66.66 1v9j h THR 27 Cb 1.43 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 68.68 1v9j h THR 27 CO -0.16 0.03 -1.58 0.23 0.37 0.00 0.00 175.52 174.41 1v9j n MET 28 N -4.51 1.15 -1.50 6.66 2.81 -1.26 -5.12 117.12 115.35 1v9j n MET 28 Ca -0.01 -0.06 0.00 0.00 -1.81 0.00 0.00 57.70 55.82 1v9j n MET 28 Cb 0.11 -1.26 0.00 0.00 -0.71 0.00 0.00 33.22 31.36 1v9j n MET 28 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1v9j n GLU 29 N -2.08 -4.22 -1.14 0.03 2.13 -1.11 -4.88 120.64 109.37 1v9j n GLU 29 Ca -0.08 3.07 -0.37 0.00 0.66 0.00 0.00 57.16 60.44 1v9j n GLU 29 Cb 0.51 -3.40 0.04 0.00 0.27 0.00 0.00 31.44 28.86 1v9j n GLU 29 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1v9j n LEU 30 N -0.01 -3.04 -4.23 4.31 7.99 -1.26 -5.00 117.00 115.75 1v9j n LEU 30 Ca 0.00 0.46 -0.22 0.00 -0.01 0.00 0.00 56.01 56.24 1v9j n LEU 30 Cb 0.00 -0.94 -0.12 0.00 -0.11 0.00 0.00 43.42 42.24 1v9j n LEU 30 CO 0.00 -4.69 -0.49 -0.44 -1.51 0.00 0.00 177.39 170.26 1v9j s SER 31 N -1.20 2.14 0.25 -1.43 0.01 -1.26 -5.04 113.70 107.18 1v9j s SER 31 Ca 0.53 -0.63 0.00 0.00 1.31 0.00 0.00 55.95 57.17 1v9j s SER 31 Cb -0.33 -0.11 0.32 0.00 0.21 0.00 0.00 66.02 66.11 1v9j s SER 31 CO 0.70 0.01 1.67 0.00 0.41 0.00 0.00 173.24 176.03 1v9j h ALA 32 N 4.27 0.99 -0.01 1.44 0.00 -1.95 -2.90 119.26 121.11 1v9j h ALA 32 Ca -0.43 -0.38 -0.17 0.00 0.00 0.00 0.00 54.91 53.93 1v9j h ALA 32 Cb 1.18 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1v9j h ALA 32 CO 0.40 0.60 -0.77 0.22 0.00 0.00 0.00 179.25 179.70 1v9j h ASP 33 N 0.48 0.12 0.07 0.00 3.58 -1.96 -2.50 116.42 116.21 1v9j h ASP 33 Ca 0.06 -0.09 -0.00 0.00 0.42 0.00 0.00 57.03 57.42 1v9j h ASP 33 Cb 0.75 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.76 1v9j h ASP 33 CO 0.06 0.85 -0.03 0.22 -2.88 0.00 0.00 179.24 177.45 1v9j h TYR 34 N 0.06 -0.09 -0.03 0.28 3.20 -1.93 0.28 116.97 118.74 1v9j h TYR 34 Ca -0.02 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.72 1v9j h TYR 34 Cb 1.36 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 39.64 1v9j h TYR 34 CO 0.01 -0.05 -0.57 -0.07 -1.64 0.00 0.00 178.16 175.84 1v9j h LEU 35 N -0.10 0.09 0.14 2.82 3.38 -1.59 -1.36 115.31 118.70 1v9j h LEU 35 Ca -0.01 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1v9j h LEU 35 Cb 0.08 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1v9j h LEU 35 CO 0.02 0.64 -0.07 -0.09 0.09 0.00 0.00 178.44 179.03 1v9j h ARG 36 N 0.06 -0.18 -0.07 1.13 2.43 -1.13 -1.48 114.38 115.14 1v9j h ARG 36 Ca -0.00 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.10 1v9j h ARG 36 Cb 1.02 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.60 1v9j h ARG 36 CO 0.08 0.23 -0.30 0.93 -1.51 0.00 0.00 179.97 179.40 1v9j h GLU 37 N -0.67 0.13 0.59 0.20 4.39 -0.50 -0.03 114.58 118.71 1v9j h GLU 37 Ca -0.02 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.61 1v9j h GLU 37 Cb 0.50 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.14 1v9j h GLU 37 CO 0.03 0.42 -0.28 -0.22 -1.16 0.00 0.00 179.01 177.80 1v9j h LYS 38 N 0.12 -0.77 -0.52 2.33 3.64 -1.24 -1.24 116.57 118.89 1v9j h LYS 38 Ca 0.02 0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1v9j h LYS 38 Cb 0.59 0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.56 1v9j h LYS 38 CO 0.04 -0.51 0.30 -0.07 -2.27 0.00 0.00 179.45 176.94 1v9j h LEU 39 N -1.21 0.64 -0.46 5.20 3.38 -1.28 0.65 115.31 122.22 1v9j h LEU 39 Ca -0.08 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 57.84 1v9j h LEU 39 Cb 0.61 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 1v9j h LEU 39 CO 0.13 0.53 0.25 -0.09 0.09 0.00 0.00 178.44 179.35 1v9j h ARG 40 N 0.69 0.48 -0.04 1.13 2.43 -1.08 0.68 114.38 118.68 1v9j h ARG 40 Ca 0.18 -0.03 -0.25 0.00 -0.81 0.00 0.00 59.98 59.08 1v9j h ARG 40 Cb 0.02 -0.11 0.02 0.00 -0.42 0.00 0.00 29.97 29.48 1v9j h ARG 40 CO -0.03 0.31 -0.94 1.96 -1.51 0.00 0.00 179.97 179.76 1v9j h GLN 41 N 0.49 0.70 0.72 0.20 1.08 -0.98 0.24 115.11 117.57 1v9j h GLN 41 Ca 0.19 -0.71 -0.04 0.00 -1.45 0.00 0.00 58.65 56.65 1v9j h GLN 41 Cb 0.07 0.19 0.01 0.00 -0.05 0.00 0.00 27.48 27.69 1v9j h GLN 41 CO -0.12 1.29 -0.35 0.22 -0.95 0.00 0.00 178.83 178.93 1v9j h ASP 42 N 0.38 -0.82 1.06 1.46 3.58 0.57 -3.19 116.42 119.46 1v9j h ASP 42 Ca -0.11 0.03 -0.04 0.00 0.42 0.00 0.00 57.03 57.33 1v9j h ASP 42 Cb 1.59 0.21 -0.01 0.00 1.72 0.00 0.00 39.33 42.85 1v9j h ASP 42 CO 0.19 -0.44 -0.18 -0.07 -2.88 0.00 0.00 179.24 175.86 1v9j h LEU 43 N -1.26 0.00 -2.45 2.28 3.38 0.24 -3.48 115.31 114.02 1v9j h LEU 43 Ca -0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1v9j h LEU 43 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1v9j h LEU 43 CO 0.16 0.18 -0.11 -0.62 0.09 0.00 0.00 178.44 178.14 1v9j n GLU 44 N -3.29 -1.33 -3.28 1.13 1.02 0.81 -4.94 120.64 110.75 1v9j n GLU 44 Ca 0.01 1.47 -0.19 0.00 -0.02 0.00 0.00 57.16 58.43 1v9j n GLU 44 Cb 0.43 -5.07 -0.01 0.00 -0.02 0.00 0.00 31.44 26.77 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 -2.84 4.31 -0.09 0.62 0.00 -0.92 -4.80 121.76 118.05 1v9j s ALA 45 Ca 0.05 -1.75 -0.04 0.00 0.00 0.00 0.00 51.96 50.23 1v9j s ALA 45 Cb -0.01 -1.37 -0.02 0.00 0.00 0.00 0.00 23.12 21.72 1v9j s ALA 45 CO 0.63 -0.24 0.15 1.49 0.00 0.00 0.00 175.76 177.79 1v9j h GLU 46 N 0.83 -0.12 -3.97 0.00 4.81 -1.86 -3.47 114.58 110.80 1v9j h GLU 46 Ca -0.41 0.01 -0.39 0.00 -0.13 0.00 0.00 59.36 58.44 1v9j h GLU 46 Cb 1.27 0.03 -0.34 0.00 0.63 0.00 0.00 28.75 30.34 1v9j h GLU 46 CO 0.51 -0.08 -0.77 -1.01 -0.73 0.00 0.00 179.01 176.93 1v9j s HIS 47 N -1.96 0.65 0.07 0.92 3.76 -1.18 -5.05 115.29 112.51 1v9j s HIS 47 Ca -0.02 -0.16 0.07 0.00 -0.15 0.00 0.00 55.06 54.81 1v9j s HIS 47 Cb 0.00 -0.60 -0.03 0.00 1.11 0.00 0.00 32.58 33.06 1v9j s HIS 47 CO 0.06 -0.17 -0.20 0.14 -0.85 0.00 0.00 174.74 173.72 1v9j s VAL 48 N 0.90 1.59 -0.06 -0.90 -7.23 -1.26 -2.21 120.40 111.22 1v9j s VAL 48 Ca -0.11 -1.36 -0.02 0.00 -1.81 0.00 0.00 61.98 58.68 1v9j s VAL 48 Cb -0.14 -1.43 0.03 0.00 0.56 0.00 0.00 36.38 35.40 1v9j s VAL 48 CO -0.00 0.02 0.02 -1.61 -0.31 0.00 0.00 175.10 173.22 1v9j s GLU 49 N -1.58 0.37 0.19 4.82 2.02 -0.77 -4.98 118.70 118.77 1v9j s GLU 49 Ca 0.06 0.20 0.06 0.00 0.02 0.00 0.00 54.97 55.31 1v9j s GLU 49 Cb -0.09 -0.81 -0.04 0.00 0.10 0.00 0.00 34.13 33.28 1v9j s GLU 49 CO 0.03 -0.31 0.09 0.54 0.02 0.00 0.00 175.26 175.62 1v9j s VAL 50 N 2.04 4.15 0.14 2.63 0.11 -1.26 -0.77 120.40 127.44 1v9j s VAL 50 Ca 0.05 -1.30 0.02 0.00 -2.93 0.00 0.00 61.98 57.82 1v9j s VAL 50 Cb -0.12 -3.13 -0.04 0.00 -1.53 0.00 0.00 36.38 31.55 1v9j s VAL 50 CO -0.04 -0.16 -0.02 -0.70 -3.33 0.00 0.00 175.10 170.85 1v9j s GLU 51 N -3.19 0.99 -0.14 1.54 2.56 0.72 -4.96 118.70 116.23 1v9j s GLU 51 Ca 0.30 -1.45 -0.11 0.00 0.00 0.00 0.00 54.97 53.71 1v9j s GLU 51 Cb -0.09 -0.21 0.04 0.00 2.00 0.00 0.00 34.13 35.87 1v9j s GLU 51 CO 0.22 -0.10 0.36 0.34 -0.56 0.00 0.00 175.26 175.52 1v9j s ASP 52 N -3.12 -0.40 -0.67 -1.70 2.15 -1.26 -2.66 116.67 109.02 1v9j s ASP 52 Ca 0.19 0.74 0.05 0.00 0.43 0.00 0.00 52.55 53.96 1v9j s ASP 52 Cb 0.06 0.71 0.16 0.00 -0.30 0.00 0.00 42.92 43.55 1v9j s ASP 52 CO 0.01 -0.14 0.46 0.42 -0.17 0.00 0.00 175.17 175.74 1v9j s THR 53 N 0.56 2.70 -1.08 1.71 -4.23 -0.95 -5.00 115.64 109.35 1v9j s THR 53 Ca -0.03 -4.07 -0.23 0.00 -1.18 0.00 0.00 61.69 56.18 1v9j s THR 53 Cb -0.05 -2.79 -0.06 0.00 1.34 0.00 0.00 72.50 70.94 1v9j s THR 53 CO -0.03 -1.00 1.92 0.28 -0.54 0.00 0.00 174.62 175.25 1v9j s THR 54 N -1.23 3.53 -1.67 3.99 -1.32 -1.26 -3.56 115.64 114.12 1v9j s THR 54 Ca 0.24 -0.74 -0.01 0.00 -1.21 0.00 0.00 61.69 59.97 1v9j s THR 54 Cb -0.07 -4.39 0.00 0.00 -1.51 0.00 0.00 72.50 66.54 1v9j s THR 54 CO -0.15 -1.03 0.15 0.18 -2.21 0.00 0.00 174.62 171.57 1v9j n LEU 55 N 13.93 -2.11 -0.08 9.08 4.77 -1.26 -4.89 117.00 136.44 1v9j n LEU 55 Ca 0.43 -0.09 -0.22 0.00 -0.03 0.00 0.00 56.01 56.10 1v9j n LEU 55 Cb 0.47 -2.87 -0.12 0.00 -2.33 0.00 0.00 43.42 38.57 1v9j n LEU 55 CO 0.65 -0.10 -0.97 -3.20 -1.33 0.00 0.00 177.39 172.44 1v9j n ASN 56 N -1.99 2.00 -3.64 -1.43 5.15 -1.23 -4.97 115.26 109.15 1v9j n ASN 56 Ca -0.21 0.21 -0.08 0.00 -0.60 0.00 0.00 54.58 53.90 1v9j n ASN 56 Cb 0.67 -0.78 -0.07 0.00 -0.53 0.00 0.00 39.78 39.07 1v9j n ASN 56 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1v9j s ARG 57 N -2.49 0.54 -1.50 1.20 0.52 -1.26 -4.95 118.95 111.01 1v9j s ARG 57 Ca -0.30 0.75 -0.06 0.00 -0.52 0.00 0.00 55.73 55.60 1v9j s ARG 57 Cb 0.08 0.21 0.01 0.00 0.52 0.00 0.00 34.95 35.77 1v9j s ARG 57 CO 0.64 -0.08 0.80 0.00 0.02 0.00 0.00 175.30 176.68 1v9j n ALA 59 N -4.03 -0.01 -2.12 0.00 0.00 -1.26 -4.47 120.51 108.62 1v9j n ALA 59 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.94 1v9j n ALA 59 Cb 0.60 -0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.02 1v9j n ALA 59 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1v9j s THR 60 N -0.00 3.60 0.21 0.00 -4.23 -1.25 -4.44 115.64 109.52 1v9j s THR 60 Ca 0.00 0.59 0.05 0.00 -1.18 0.00 0.00 61.69 61.15 1v9j s THR 60 Cb 0.00 -3.86 -0.05 0.00 1.34 0.00 0.00 72.50 69.93 1v9j s THR 60 CO 0.00 -0.59 -0.06 -0.94 -0.54 0.00 0.00 174.62 172.50 1v9j s SER 61 N 5.58 2.02 -0.03 3.99 1.04 -1.24 -3.38 113.70 121.67 1v9j s SER 61 Ca 0.72 -1.13 -0.01 0.00 0.48 0.00 0.00 55.95 56.02 1v9j s SER 61 Cb -0.19 -0.03 0.03 0.00 0.10 0.00 0.00 66.02 65.93 1v9j s SER 61 CO 0.32 -0.40 0.03 -0.36 0.98 0.00 0.00 173.24 173.81 1v9j s PHE 62 N -3.29 0.20 -0.23 5.02 0.08 -0.29 -2.25 117.98 117.23 1v9j s PHE 62 Ca 0.24 0.09 -0.05 0.00 0.12 0.00 0.00 56.93 57.33 1v9j s PHE 62 Cb 0.04 -0.43 -0.02 0.00 -0.57 0.00 0.00 43.02 42.04 1v9j s PHE 62 CO 0.06 -0.16 0.00 1.03 -0.10 0.00 0.00 175.22 176.06 1v9j s ARG 63 N 1.48 3.48 -0.15 0.44 1.81 -1.09 -1.76 118.95 123.17 1v9j s ARG 63 Ca -0.04 -0.57 -0.03 0.00 -1.72 0.00 0.00 55.73 53.38 1v9j s ARG 63 Cb -0.13 -3.13 -0.02 0.00 -0.45 0.00 0.00 34.95 31.22 1v9j s ARG 63 CO -0.03 -0.19 -0.06 0.14 -0.68 0.00 0.00 175.30 174.47 1v9j s VAL 64 N 1.53 3.66 -0.03 3.52 -7.23 -0.12 -0.20 120.40 121.52 1v9j s VAL 64 Ca 0.06 -0.44 0.07 0.00 -1.81 0.00 0.00 61.98 59.86 1v9j s VAL 64 Cb -0.15 -2.59 -0.02 0.00 0.56 0.00 0.00 36.38 34.19 1v9j s VAL 64 CO -0.01 0.50 -0.25 -0.22 -0.31 0.00 0.00 175.10 174.81 1v9j s LEU 65 N 0.35 2.05 -0.03 1.32 1.98 0.05 -2.67 118.68 121.73 1v9j s LEU 65 Ca -0.06 -0.47 -0.01 0.00 -2.89 0.00 0.00 54.13 50.70 1v9j s LEU 65 Cb -0.15 -1.33 0.03 0.00 0.66 0.00 0.00 46.19 45.41 1v9j s LEU 65 CO 0.04 0.30 0.06 -0.69 -1.89 0.00 0.00 176.35 174.16 1v9j s VAL 66 N -0.49 -0.07 -0.12 1.68 1.01 -1.12 -1.84 120.40 119.45 1v9j s VAL 66 Ca 0.06 0.24 -0.00 0.00 0.00 0.00 0.00 61.98 62.28 1v9j s VAL 66 Cb -0.11 -0.13 0.02 0.00 0.00 0.00 0.00 36.38 36.17 1v9j s VAL 66 CO 0.00 0.10 -0.09 -0.69 0.00 0.00 0.00 175.10 174.42 1v9j s VAL 67 N 1.25 1.18 0.02 2.92 1.01 -0.94 -2.93 120.40 122.91 1v9j s VAL 67 Ca -0.07 -0.38 -0.18 0.00 0.00 0.00 0.00 61.98 61.34 1v9j s VAL 67 Cb -0.13 -1.17 0.06 0.00 0.00 0.00 0.00 36.38 35.15 1v9j s VAL 67 CO -0.04 0.39 0.84 -0.24 0.00 0.00 0.00 175.10 176.06 1v9j n SER 68 N 4.90 -0.93 -0.01 3.32 2.88 -1.16 -2.55 113.62 120.06 1v9j n SER 68 Ca -0.14 -1.30 0.11 0.00 -1.33 0.00 0.00 58.87 56.21 1v9j n SER 68 Cb 0.50 1.47 -0.17 0.00 -0.75 0.00 0.00 64.21 65.26 1v9j n SER 68 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1v9j n ALA 69 N -1.54 2.78 -0.04 -1.46 0.00 -1.26 -4.05 120.51 114.94 1v9j n ALA 69 Ca -0.08 -0.54 0.19 0.00 0.00 0.00 0.00 53.44 53.01 1v9j n ALA 69 Cb 0.40 -0.74 0.65 0.00 0.00 0.00 0.00 19.45 19.76 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 0.09 -0.00 0.00 3.11 -1.92 0.14 116.57 117.99 1v9j h LYS 70 Ca -0.01 -0.01 -0.17 0.00 -2.81 0.00 0.00 60.65 57.66 1v9j h LYS 70 Cb 1.02 -0.02 -0.02 0.00 -1.00 0.00 0.00 32.23 32.21 1v9j h LYS 70 CO 0.00 0.06 -0.77 0.74 -2.81 0.00 0.00 179.45 176.67 1v9j h PHE 71 N 0.09 0.08 -0.38 1.91 0.04 -1.92 -3.16 116.94 113.61 1v9j h PHE 71 Ca 0.28 -0.04 -0.02 0.00 2.80 0.00 0.00 57.97 60.99 1v9j h PHE 71 Cb 0.97 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 39.09 1v9j h PHE 71 CO -0.00 0.80 0.17 0.93 -0.60 0.00 0.00 178.31 179.61 1v9j h GLU 72 N 0.03 0.52 -0.00 1.51 4.39 -0.94 -1.93 114.58 118.17 1v9j h GLU 72 Ca -0.01 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.58 1v9j h GLU 72 Cb 1.35 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.89 1v9j h GLU 72 CO 0.10 0.42 -0.20 0.78 -1.16 0.00 0.00 179.01 178.95 1v9j h GLY 73 N 0.66 0.00 -3.96 -3.84 0.00 -1.49 -3.43 103.07 91.01 1v9j h GLY 73 Ca 0.13 -0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.92 1v9j h GLY 73 CO -0.02 0.00 -0.47 0.54 0.00 0.00 0.00 176.54 176.59 1v9j s LYS 74 N -4.59 3.40 0.93 4.80 1.02 -0.72 -5.10 119.74 119.47 1v9j s LYS 74 Ca -0.04 -0.64 -0.11 0.00 0.02 0.00 0.00 55.97 55.20 1v9j s LYS 74 Cb 0.16 -2.93 0.15 0.00 -0.52 0.00 0.00 37.83 34.68 1v9j s LYS 74 CO 0.70 0.51 1.09 -1.25 -0.92 0.00 0.00 175.35 175.48 1v9j s PRO 75 N -3.29 1.00 0.50 -1.68 0.04 -1.26 -4.77 135.00 125.54 1v9j s PRO 75 Ca 0.34 1.03 0.18 0.00 0.04 0.00 0.00 61.00 62.59 1v9j s PRO 75 Cb -0.11 -1.76 1.24 0.00 0.04 0.00 0.00 34.50 33.91 1v9j s PRO 75 CO 0.28 -2.48 2.08 1.25 0.04 0.00 0.00 177.00 178.17 1v9j h LEU 76 N -1.73 0.09 -0.44 -3.56 6.46 -1.96 -0.40 115.31 113.77 1v9j h LEU 76 Ca -0.49 -0.00 -0.17 0.00 -0.12 0.00 0.00 57.88 57.10 1v9j h LEU 76 Cb 1.28 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 41.17 1v9j h LEU 76 CO 0.51 0.06 -0.78 0.17 -0.62 0.00 0.00 178.44 177.78 1v9j h LEU 77 N 0.10 0.14 -0.45 2.25 -0.00 -2.00 -3.17 115.31 112.18 1v9j h LEU 77 Ca 0.12 -0.10 -0.17 0.00 -0.00 0.00 0.00 57.88 57.73 1v9j h LEU 77 Cb 0.35 -0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 40.95 1v9j h LEU 77 CO -0.01 0.86 -0.77 1.56 -0.00 0.00 0.00 178.44 180.07 1v9j h GLN 78 N 0.07 0.08 0.81 0.17 1.08 -1.45 -2.67 115.11 113.19 1v9j h GLN 78 Ca -0.02 -0.07 -0.04 0.00 -1.45 0.00 0.00 58.65 57.07 1v9j h GLN 78 Cb 1.36 0.02 0.01 0.00 -0.05 0.00 0.00 27.48 28.82 1v9j h GLN 78 CO 0.11 0.81 -0.40 0.00 -0.95 0.00 0.00 178.83 178.40 1v9j h ARG 79 N 0.05 -1.06 -0.35 1.46 3.08 -1.27 0.31 114.38 116.60 1v9j h ARG 79 Ca -0.02 0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 1v9j h ARG 79 Cb 1.36 0.24 -0.02 0.00 0.08 0.00 0.00 29.97 31.63 1v9j h ARG 79 CO 0.11 -0.71 0.18 0.45 -1.07 0.00 0.00 179.97 178.93 1v9j h HIS 80 N -1.10 0.50 -0.34 3.04 3.86 -1.65 -2.46 115.15 117.00 1v9j h HIS 80 Ca -0.11 -0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.08 1v9j h HIS 80 Cb 0.85 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 29.14 1v9j h HIS 80 CO -0.02 0.42 0.20 -0.09 0.86 0.00 0.00 177.93 179.29 1v9j h ARG 81 N 0.43 0.46 -0.77 2.45 2.43 -1.42 -1.51 114.38 116.45 1v9j h ARG 81 Ca 0.12 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1v9j h ARG 81 Cb 0.10 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.51 1v9j h ARG 81 CO -0.02 0.33 0.47 -0.07 -1.51 0.00 0.00 179.97 179.18 1v9j h LEU 82 N 0.47 0.91 -0.36 3.80 3.38 0.10 0.20 115.31 123.82 1v9j h LEU 82 Ca 0.12 -0.06 -0.19 0.00 0.09 0.00 0.00 57.88 57.85 1v9j h LEU 82 Cb -0.01 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1v9j h LEU 82 CO -0.02 0.70 -0.82 0.58 0.09 0.00 0.00 178.44 178.97 1v9j h VAL 83 N 1.05 1.46 -0.24 1.22 2.07 -1.23 -3.04 116.25 117.53 1v9j h VAL 83 Ca 0.28 -2.44 -0.18 0.00 0.82 0.00 0.00 66.70 65.17 1v9j h VAL 83 Cb -0.05 2.34 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1v9j h VAL 83 CO -0.05 0.72 -0.56 0.78 0.02 0.00 0.00 177.57 178.47 1v9j h ASN 84 N 0.14 0.83 -0.55 0.57 2.35 -0.87 -2.86 115.58 115.19 1v9j h ASN 84 Ca -0.04 -0.45 -0.02 0.00 -0.55 0.00 0.00 56.30 55.24 1v9j h ASN 84 Cb 1.42 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 39.52 1v9j h ASN 84 CO 0.13 1.22 0.27 -0.33 -1.65 0.00 0.00 177.43 177.06 1v9j h GLU 85 N 0.57 0.79 0.94 0.81 5.08 -0.64 0.48 114.58 122.60 1v9j h GLU 85 Ca 0.01 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 1v9j h GLU 85 Cb 1.14 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 30.26 1v9j h GLU 85 CO 0.12 0.64 -0.45 0.00 -1.00 0.00 0.00 179.01 178.32 1v9j n LEU 87 N -5.63 7.27 0.00 0.00 4.77 -1.08 -4.61 117.00 117.73 1v9j n LEU 87 Ca -0.16 -3.96 -0.12 0.00 -0.03 0.00 0.00 56.01 51.74 1v9j n LEU 87 Cb 0.50 -0.96 -0.07 0.00 -2.33 0.00 0.00 43.42 40.56 1v9j n LEU 87 CO 0.40 1.35 0.84 0.00 -1.33 0.00 0.00 177.39 178.65 1v9j h ALA 88 N 1.76 0.08 -0.02 -1.18 0.00 0.08 0.83 119.26 120.81 1v9j h ALA 88 Ca 0.55 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 55.20 1v9j h ALA 88 Cb 1.14 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1v9j h ALA 88 CO 1.35 -0.37 -0.84 0.93 0.00 0.00 0.00 179.25 180.32 1v9j h GLU 89 N -0.01 0.31 0.00 0.00 5.08 -1.83 -3.21 114.58 114.92 1v9j h GLU 89 Ca 0.02 -0.30 -0.16 0.00 -1.00 0.00 0.00 59.36 57.92 1v9j h GLU 89 Cb 0.11 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1v9j h GLU 89 CO -0.00 0.99 -0.76 0.93 -1.00 0.00 0.00 179.01 179.17 1v9j h GLU 90 N 0.19 0.00 -0.12 2.33 3.07 -1.85 -3.33 114.58 114.87 1v9j h GLU 90 Ca -0.05 0.00 0.04 0.00 -0.50 0.00 0.00 59.36 58.85 1v9j h GLU 90 Cb 1.45 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 29.30 1v9j h GLU 90 CO 0.14 0.76 -0.46 -0.07 -1.40 0.00 0.00 179.01 177.97 1v9j h LEU 91 N 0.00 -1.45 -1.84 1.33 3.38 0.69 -0.79 115.31 116.62 1v9j h LEU 91 Ca -0.01 0.18 0.42 0.00 0.09 0.00 0.00 57.88 58.56 1v9j h LEU 91 Cb 1.35 0.58 -0.07 0.00 0.09 0.00 0.00 40.66 42.60 1v9j h LEU 91 CO 0.10 -0.45 1.00 -0.65 0.09 0.00 0.00 178.44 178.53 1v9j h PRO 92 N -0.54 0.05 -0.01 1.13 0.11 -1.70 0.97 132.00 132.01 1v9j h PRO 92 Ca 0.06 -0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.99 1v9j h PRO 92 Cb 0.65 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.74 1v9j h PRO 92 CO -0.40 0.03 -0.78 0.45 -0.21 0.00 0.00 178.00 177.09 1v9j h HIS 93 N 0.05 0.17 -3.02 0.65 3.86 -1.34 -3.43 115.15 112.10 1v9j h HIS 93 Ca 0.72 -0.09 -0.57 0.00 -1.16 0.00 0.00 60.37 59.27 1v9j h HIS 93 Cb 2.68 -0.02 -0.04 0.00 1.06 0.00 0.00 27.41 31.09 1v9j h HIS 93 CO -0.00 0.85 0.98 0.42 0.86 0.00 0.00 177.93 181.04 1v9j s ILE 94 N -3.33 4.11 0.40 2.45 -1.09 0.33 -4.89 121.20 119.18 1v9j s ILE 94 Ca -0.02 1.28 0.06 0.00 -2.23 0.00 0.00 60.65 59.74 1v9j s ILE 94 Cb 0.11 -4.04 0.26 0.00 -1.58 0.00 0.00 42.46 37.21 1v9j s ILE 94 CO 0.80 -0.35 2.05 -0.74 -1.23 0.00 0.00 174.94 175.47 1v9j h HIS 95 N 9.20 0.55 -2.28 3.97 2.76 -1.81 -3.41 115.15 124.13 1v9j h HIS 95 Ca -0.27 0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 57.80 1v9j h HIS 95 Cb 1.11 -0.19 -0.28 0.00 1.55 0.00 0.00 27.41 29.60 1v9j h HIS 95 CO 0.86 0.36 -0.39 0.00 -1.30 0.00 0.00 177.93 177.46 1v9j s ALA 96 N -5.50 -1.19 0.02 5.26 0.00 -1.22 -5.03 121.76 114.10 1v9j s ALA 96 Ca -0.08 1.36 0.09 0.00 0.00 0.00 0.00 51.96 53.32 1v9j s ALA 96 Cb 0.17 -1.46 -0.03 0.00 0.00 0.00 0.00 23.12 21.81 1v9j s ALA 96 CO 0.74 -0.92 -0.25 0.12 0.00 0.00 0.00 175.76 175.45 1v9j s PHE 97 N 2.61 2.22 -0.05 0.00 5.36 -1.26 -1.13 117.98 125.73 1v9j s PHE 97 Ca 0.03 -0.41 -0.02 0.00 -0.96 0.00 0.00 56.93 55.57 1v9j s PHE 97 Cb -0.13 -1.36 0.03 0.00 -0.34 0.00 0.00 43.02 41.22 1v9j s PHE 97 CO -0.14 0.07 0.08 -2.00 -1.46 0.00 0.00 175.22 171.77 1v9j s GLU 98 N -1.03 -0.06 0.04 10.12 2.56 -0.72 -4.97 118.70 124.64 1v9j s GLU 98 Ca 0.10 0.41 0.08 0.00 0.00 0.00 0.00 54.97 55.56 1v9j s GLU 98 Cb -0.10 -0.48 -0.03 0.00 2.00 0.00 0.00 34.13 35.52 1v9j s GLU 98 CO 0.01 -0.33 -0.23 1.14 -0.56 0.00 0.00 175.26 175.29 1v9j s GLN 99 N 2.19 1.91 -0.11 4.30 -2.07 -1.26 -0.95 119.66 123.67 1v9j s GLN 99 Ca 0.05 -1.06 -0.04 0.00 -1.82 0.00 0.00 55.36 52.49 1v9j s GLN 99 Cb -0.12 -2.07 0.06 0.00 -1.09 0.00 0.00 33.01 29.79 1v9j s GLN 99 CO -0.03 0.52 0.22 0.21 -1.32 0.00 0.00 175.29 174.89 1v9j s LYS 100 N -1.34 0.10 -0.08 9.60 2.47 -1.09 -5.01 119.74 124.39 1v9j s LYS 100 Ca 0.13 0.66 0.02 0.00 -1.56 0.00 0.00 55.97 55.22 1v9j s LYS 100 Cb -0.10 -0.15 -0.02 0.00 -1.46 0.00 0.00 37.83 36.10 1v9j s LYS 100 CO 0.03 -0.30 -0.12 0.95 0.16 0.00 0.00 175.35 176.08 1v9j s THR 101 N 2.36 3.27 0.28 3.43 -4.23 -1.26 -2.80 115.64 116.69 1v9j s THR 101 Ca 0.02 -0.63 -0.08 0.00 -1.18 0.00 0.00 61.69 59.82 1v9j s THR 101 Cb -0.12 -2.32 -0.00 0.00 1.34 0.00 0.00 72.50 71.39 1v9j s THR 101 CO -0.07 0.57 0.46 -0.76 -0.54 0.00 0.00 174.62 174.28 1v9j s LEU 102 N -0.44 0.61 0.27 4.79 1.43 -1.15 -5.05 118.68 119.14 1v9j s LEU 102 Ca 0.06 -1.17 -0.04 0.00 -1.03 0.00 0.00 54.13 51.94 1v9j s LEU 102 Cb -0.12 1.60 -0.05 0.00 0.03 0.00 0.00 46.19 47.65 1v9j s LEU 102 CO 0.02 -1.20 0.52 0.42 0.23 0.00 0.00 176.35 176.35 1v9j s THR 103 N -3.61 5.05 0.41 5.49 -4.23 -1.26 -3.00 115.64 114.49 1v9j s THR 103 Ca 0.26 0.00 0.14 0.00 -1.18 0.00 0.00 61.69 60.91 1v9j s THR 103 Cb -0.00 -3.73 0.14 0.00 1.34 0.00 0.00 72.50 70.25 1v9j s THR 103 CO 0.13 -0.28 1.91 1.55 -0.54 0.00 0.00 174.62 177.39 1v9j h PRO 104 N 1.79 0.00 -0.22 3.99 0.13 -1.89 -1.69 132.00 134.12 1v9j h PRO 104 Ca -0.48 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.50 1v9j h PRO 104 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1v9j h PRO 104 CO 0.67 0.28 -0.48 0.93 -0.23 0.00 0.00 178.00 179.16 1v9j h GLU 105 N 0.00 0.57 -0.02 0.86 4.39 -1.94 -1.49 114.58 116.96 1v9j h GLU 105 Ca -0.00 -0.33 -0.10 0.00 0.34 0.00 0.00 59.36 59.26 1v9j h GLU 105 Cb 0.49 0.02 0.01 0.00 -0.10 0.00 0.00 28.75 29.17 1v9j h GLU 105 CO 0.04 0.93 -0.39 1.96 -1.16 0.00 0.00 179.01 180.39 1v9j h GLN 106 N 0.46 0.30 0.23 2.33 4.20 -1.89 -2.58 115.11 118.16 1v9j h GLN 106 Ca 0.02 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.43 1v9j h GLN 106 Cb 1.01 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.87 1v9j h GLN 106 CO 0.09 0.98 -0.11 2.35 -0.67 0.00 0.00 178.83 181.47 1v9j h TRP 107 N -0.27 -0.29 0.00 2.96 2.91 -1.35 0.84 115.95 120.75 1v9j h TRP 107 Ca -0.04 -0.01 -0.00 0.00 1.13 0.00 0.00 58.89 59.97 1v9j h TRP 107 Cb 1.10 0.10 -0.00 0.00 -0.51 0.00 0.00 29.16 29.85 1v9j h TRP 107 CO 0.15 -0.14 -0.00 1.15 -1.03 0.00 0.00 178.44 178.58 1v9j h THR 108 N -0.37 0.93 0.00 2.65 2.02 -1.38 -1.42 112.91 115.34 1v9j h THR 108 Ca -0.03 -0.01 -0.15 0.00 0.77 0.00 0.00 66.41 66.99 1v9j h THR 108 Cb 0.28 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 1v9j h THR 108 CO 0.05 0.00 -1.15 0.03 0.37 0.00 0.00 175.52 174.82 1v9j h ARG 109 N 0.00 0.00 0.00 6.66 3.08 -1.01 -3.31 114.38 119.80 1v9j h ARG 109 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1v9j h ARG 109 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1v9j h ARG 109 CO 0.00 0.35 0.00 0.94 -1.07 0.00 0.00 179.97 180.19 1v9j n GLN 110 N -2.98 0.17 -1.18 0.04 7.27 0.29 -2.08 117.38 118.91 1v9j n GLN 110 Ca -0.06 0.49 -0.16 0.00 0.07 0.00 0.00 57.00 57.34 1v9j n GLN 110 Cb 0.81 -1.88 0.14 0.00 2.41 0.00 0.00 30.24 31.72 1v9j n GLN 110 CO 0.00 0.00 0.00 2.89 0.07 0.00 0.00 177.06 180.02 1v9j n ARG 111 N -2.20 2.35 -3.67 3.69 1.85 -1.17 -4.97 116.66 112.54 1v9j n ARG 111 Ca 0.01 -3.37 -0.37 0.00 -1.00 0.00 0.00 57.85 53.11 1v9j n ARG 111 Cb 0.16 -2.03 -0.12 0.00 -1.05 0.00 0.00 32.46 29.43 1v9j n ARG 111 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 1v9j s ARG 112 N -3.42 3.75 0.00 2.89 3.52 -0.88 -5.09 118.95 119.71 1v9j s ARG 112 Ca 0.51 -0.44 0.00 0.00 -0.13 0.00 0.00 55.73 55.67 1v9j s ARG 112 Cb 0.43 -3.50 0.00 0.00 -1.56 0.00 0.00 34.95 30.32 1v9j s ARG 112 CO 0.02 -0.21 0.00 -0.85 -0.81 0.00 0.00 175.30 173.44