#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 0.34 -1.41 0.03 4.81 -1.26 -5.12 118.16 115.55 1v9j n LYS 2 Ca 0.00 -1.01 0.00 0.00 -0.87 0.00 0.00 58.31 56.43 1v9j n LYS 2 Cb 0.00 0.48 0.00 0.00 0.02 0.00 0.00 35.03 35.53 1v9j n LYS 2 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1v9j n GLY 3 N -0.39 -4.66 4.01 3.14 0.00 -1.26 -5.05 105.19 100.99 1v9j n GLY 3 Ca -0.24 -0.51 -0.20 0.00 0.00 0.00 0.00 46.02 45.06 1v9j n GLY 3 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1v9j s SER 4 N -1.11 5.10 -1.05 1.61 1.04 -1.26 -5.06 113.70 112.98 1v9j s SER 4 Ca 0.00 -0.85 -0.07 0.00 0.48 0.00 0.00 55.95 55.51 1v9j s SER 4 Cb 0.00 0.20 0.26 0.00 0.10 0.00 0.00 66.02 66.58 1v9j s SER 4 CO 0.00 -1.24 1.03 -1.20 0.98 0.00 0.00 173.24 172.81 1v9j n SER 5 N -2.13 5.15 -2.20 7.02 7.64 -1.26 -4.84 113.62 123.01 1v9j n SER 5 Ca 0.13 -3.07 -0.25 0.00 1.01 0.00 0.00 58.87 56.69 1v9j n SER 5 Cb 0.62 -1.28 0.16 0.00 -1.01 0.00 0.00 64.21 62.69 1v9j n SER 5 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1v9j n HIS 6 N 2.54 2.98 -4.02 1.43 -0.00 -1.26 -4.92 115.22 111.96 1v9j n HIS 6 Ca 0.23 -1.97 -0.11 0.00 0.46 0.00 0.00 57.72 56.33 1v9j n HIS 6 Cb 0.38 -1.00 -0.11 0.00 -0.12 0.00 0.00 29.99 29.14 1v9j n HIS 6 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 1v9j s HIS 7 N -3.24 0.44 0.11 1.57 5.04 -1.26 -5.17 115.29 112.79 1v9j s HIS 7 Ca 0.56 -0.49 0.06 0.00 -1.54 0.00 0.00 55.06 53.65 1v9j s HIS 7 Cb 0.46 -0.28 -0.04 0.00 0.04 0.00 0.00 32.58 32.76 1v9j s HIS 7 CO 0.09 -0.13 -0.15 -1.58 -2.34 0.00 0.00 174.74 170.63 1v9j s HIS 8 N -1.34 1.44 -0.28 3.88 2.46 -1.26 -4.97 115.29 115.22 1v9j s HIS 8 Ca -0.12 -0.52 -0.03 0.00 0.47 0.00 0.00 55.06 54.86 1v9j s HIS 8 Cb -0.09 -0.76 0.01 0.00 -0.13 0.00 0.00 32.58 31.60 1v9j s HIS 8 CO -0.00 0.15 0.06 1.58 -2.47 0.00 0.00 174.74 174.05 1v9j n HIS 9 N 0.70 -4.09 -0.02 3.88 -0.00 -1.26 -5.03 115.22 109.40 1v9j n HIS 9 Ca -0.17 1.95 -0.02 0.00 -0.00 0.00 0.00 57.72 59.48 1v9j n HIS 9 Cb 0.56 -3.98 -0.01 0.00 -0.00 0.00 0.00 29.99 26.56 1v9j n HIS 9 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1v9j n HIS 10 N 0.92 0.00 -2.98 1.57 -0.00 -1.26 -4.98 115.22 108.49 1v9j n HIS 10 Ca -0.09 0.00 -0.12 0.00 -0.00 0.00 0.00 57.72 57.50 1v9j n HIS 10 Cb 0.15 -0.12 -0.03 0.00 -0.00 0.00 0.00 29.99 29.99 1v9j n HIS 10 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1v9j n HIS 11 N -2.97 -2.81 -0.07 4.41 8.25 -1.26 -4.97 115.22 115.80 1v9j n HIS 11 Ca -0.03 -2.06 -0.08 0.00 -0.26 0.00 0.00 57.72 55.29 1v9j n HIS 11 Cb 0.12 1.05 -0.10 0.00 1.12 0.00 0.00 29.99 32.18 1v9j n HIS 11 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1v9j n SER 12 N 2.87 1.81 -4.61 0.41 7.64 -1.26 -4.97 113.62 115.51 1v9j n SER 12 Ca 0.22 -0.02 -0.34 0.00 1.01 0.00 0.00 58.87 59.73 1v9j n SER 12 Cb 0.53 0.57 -0.10 0.00 -1.01 0.00 0.00 64.21 64.19 1v9j n SER 12 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1v9j s SER 13 N -4.97 5.06 0.00 6.43 1.04 -1.26 -5.11 113.70 114.89 1v9j s SER 13 Ca -0.11 0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.35 1v9j s SER 13 Cb 0.05 -1.56 0.00 0.00 0.10 0.00 0.00 66.02 64.60 1v9j s SER 13 CO 0.53 0.30 0.00 0.61 0.98 0.00 0.00 173.24 175.66 1v9j n GLY 14 N 2.68 -1.71 2.20 7.32 0.00 -1.26 -4.78 105.19 109.63 1v9j n GLY 14 Ca -0.18 -0.51 -0.28 0.00 0.00 0.00 0.00 46.02 45.05 1v9j n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v9j n ALA 15 N -3.00 5.85 0.22 4.61 0.00 -1.26 -4.62 120.51 122.31 1v9j n ALA 15 Ca 0.00 -2.95 -0.15 0.00 0.00 0.00 0.00 53.44 50.34 1v9j n ALA 15 Cb 0.00 -1.61 -0.08 0.00 0.00 0.00 0.00 19.45 17.76 1v9j n ALA 15 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1v9j h SER 16 N 1.59 -0.43 -4.60 0.00 0.02 -2.03 -3.46 113.55 104.63 1v9j h SER 16 Ca 0.55 -0.02 -0.40 0.00 -0.84 0.00 0.00 61.79 61.08 1v9j h SER 16 Cb 1.39 0.11 0.07 0.00 0.14 0.00 0.00 62.40 64.12 1v9j h SER 16 CO 1.29 -0.27 -0.61 0.18 -1.14 0.00 0.00 176.83 176.29 1v9j n LEU 17 N -5.29 -2.79 -3.71 5.07 4.77 -1.26 -4.97 117.00 108.83 1v9j n LEU 17 Ca -0.11 -0.32 -0.29 0.00 -0.03 0.00 0.00 56.01 55.26 1v9j n LEU 17 Cb 0.24 -2.97 -0.13 0.00 -2.33 0.00 0.00 43.42 38.23 1v9j n LEU 17 CO 0.35 0.29 -0.23 -0.69 -1.33 0.00 0.00 177.39 175.78 1v9j s VAL 18 N -3.20 1.45 0.46 4.08 1.01 -1.26 -5.12 120.40 117.83 1v9j s VAL 18 Ca 0.34 -2.71 -0.23 0.00 0.00 0.00 0.00 61.98 59.38 1v9j s VAL 18 Cb -0.15 -2.01 -0.10 0.00 0.00 0.00 0.00 36.38 34.12 1v9j s VAL 18 CO 0.42 -0.93 0.91 -2.65 0.00 0.00 0.00 175.10 172.85 1v9j n PRO 19 N 3.36 1.11 0.12 2.72 -0.02 -1.26 -4.93 135.00 136.10 1v9j n PRO 19 Ca 0.11 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 1v9j n PRO 19 Cb 0.36 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 1v9j n PRO 19 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1v9j n ARG 20 N 0.01 0.00 -2.32 -0.52 0.00 -1.26 -5.17 116.66 107.40 1v9j n ARG 20 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.95 1v9j n ARG 20 Cb 0.41 -0.09 0.00 0.00 0.00 0.00 0.00 32.46 32.78 1v9j n ARG 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1v9j n GLY 21 N 1.86 0.01 2.05 5.14 0.00 -1.26 -5.06 105.19 107.92 1v9j n GLY 21 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.56 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 0.71 -0.88 -4.25 1.61 7.64 -1.26 -5.06 113.62 112.14 1v9j n SER 22 Ca 0.00 0.26 -0.41 0.00 1.01 0.00 0.00 58.87 59.72 1v9j n SER 22 Cb 0.00 1.03 -0.08 0.00 -1.01 0.00 0.00 64.21 64.15 1v9j n SER 22 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1v9j s GLU 23 N -2.00 2.60 -0.89 1.43 2.12 -1.26 -5.02 118.70 115.68 1v9j s GLU 23 Ca 0.00 -1.65 -0.25 0.00 0.36 0.00 0.00 54.97 53.43 1v9j s GLU 23 Cb 0.00 -3.94 -0.01 0.00 0.26 0.00 0.00 34.13 30.44 1v9j s GLU 23 CO 0.00 -1.14 1.75 0.20 -0.54 0.00 0.00 175.26 175.54 1v9j s GLY 24 N 2.63 0.53 0.31 -1.50 0.00 -1.26 -4.87 107.32 103.15 1v9j s GLY 24 Ca 0.05 -1.60 -0.19 0.00 0.00 0.00 0.00 44.72 42.97 1v9j s GLY 24 CO 0.01 3.20 0.78 0.00 0.00 0.00 0.00 173.10 177.09 1v9j s ALA 25 N 8.24 -1.08 1.00 3.20 0.00 -1.26 -5.13 121.76 126.73 1v9j s ALA 25 Ca 0.61 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.11 1v9j s ALA 25 Cb -0.06 0.76 0.00 0.00 0.00 0.00 0.00 23.12 23.82 1v9j s ALA 25 CO 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 175.76 174.74 1v9j n ALA 26 N -0.50 0.00 -1.54 0.00 0.00 -1.26 -2.99 120.51 114.21 1v9j n ALA 26 Ca -0.06 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.19 1v9j n ALA 26 Cb 0.60 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.97 1v9j n ALA 26 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1v9j n THR 27 N -1.53 0.00 0.00 0.00 -1.04 -1.26 -4.03 114.28 106.42 1v9j n THR 27 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1v9j n THR 27 Cb 0.00 -1.86 0.00 0.00 -1.82 0.00 0.00 70.33 66.65 1v9j n THR 27 CO 0.00 0.00 0.00 0.80 -0.64 0.00 0.00 175.07 175.23 1v9j n MET 28 N -2.27 0.00 -1.57 -2.82 0.00 -1.26 -5.10 117.12 104.10 1v9j n MET 28 Ca -0.19 0.00 -0.39 0.00 0.00 0.00 0.00 57.70 57.12 1v9j n MET 28 Cb 0.64 0.00 -0.03 0.00 0.00 0.00 0.00 33.22 33.83 1v9j n MET 28 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 1v9j n GLU 29 N 0.00 1.46 -1.45 2.12 0.00 -1.16 -4.88 120.64 116.73 1v9j n GLU 29 Ca 0.00 0.24 -0.45 0.00 0.00 0.00 0.00 57.16 56.94 1v9j n GLU 29 Cb 0.00 -3.36 -0.02 0.00 0.00 0.00 0.00 31.44 28.06 1v9j n GLU 29 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1v9j n LEU 30 N 14.08 -0.37 -3.64 4.31 7.99 -1.26 -4.93 117.00 133.17 1v9j n LEU 30 Ca 0.34 1.08 -0.13 0.00 -0.01 0.00 0.00 56.01 57.29 1v9j n LEU 30 Cb 0.50 -1.06 -0.06 0.00 -0.11 0.00 0.00 43.42 42.69 1v9j n LEU 30 CO 0.69 -2.65 0.19 -0.44 -1.51 0.00 0.00 177.39 173.66 1v9j s SER 31 N -0.87 -0.32 -0.01 -1.43 0.01 -1.26 -4.84 113.70 104.98 1v9j s SER 31 Ca 0.62 0.01 -0.23 0.00 1.31 0.00 0.00 55.95 57.66 1v9j s SER 31 Cb -0.79 0.45 -0.15 0.00 0.21 0.00 0.00 66.02 65.74 1v9j s SER 31 CO 0.58 -0.70 1.04 0.00 0.41 0.00 0.00 173.24 174.57 1v9j h ALA 32 N 2.88 -0.54 -0.15 1.44 0.00 -1.94 -2.81 119.26 118.15 1v9j h ALA 32 Ca -0.31 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1v9j h ALA 32 Cb 1.21 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 1v9j h ALA 32 CO 0.43 -0.59 0.10 0.22 0.00 0.00 0.00 179.25 179.41 1v9j h ASP 33 N -0.96 0.16 0.81 0.00 3.58 -1.95 -1.85 116.42 116.20 1v9j h ASP 33 Ca -0.05 -0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.35 1v9j h ASP 33 Cb 0.55 -0.04 0.01 0.00 1.72 0.00 0.00 39.33 41.56 1v9j h ASP 33 CO 0.09 0.12 -0.39 0.22 -2.88 0.00 0.00 179.24 176.40 1v9j h TYR 34 N 0.19 -1.00 -0.10 0.28 3.20 -1.96 0.34 116.97 117.92 1v9j h TYR 34 Ca 0.06 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 1v9j h TYR 34 Cb -0.01 0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 1v9j h TYR 34 CO -0.00 -0.62 -0.03 -0.07 -1.64 0.00 0.00 178.16 175.80 1v9j h LEU 35 N -1.09 0.12 0.41 2.82 3.38 -1.26 0.30 115.31 119.99 1v9j h LEU 35 Ca -0.11 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 1v9j h LEU 35 Cb 0.83 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.56 1v9j h LEU 35 CO 0.18 0.18 -0.20 -0.09 0.09 0.00 0.00 178.44 178.61 1v9j h ARG 36 N 0.14 -0.53 -0.11 1.13 2.43 -1.05 -1.61 114.38 114.78 1v9j h ARG 36 Ca 0.03 0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.25 1v9j h ARG 36 Cb 0.15 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 1v9j h ARG 36 CO 0.01 -0.30 0.07 0.93 -1.51 0.00 0.00 179.97 179.16 1v9j h GLU 37 N -1.11 0.11 0.51 0.20 5.08 -0.24 0.21 114.58 119.34 1v9j h GLU 37 Ca -0.06 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 1v9j h GLU 37 Cb 0.47 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.70 1v9j h GLU 37 CO 0.09 0.07 -0.25 -0.22 -1.00 0.00 0.00 179.01 177.71 1v9j h LYS 38 N 0.11 -0.66 -0.78 2.33 3.64 -0.97 -2.38 116.57 117.85 1v9j h LYS 38 Ca 0.04 0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.46 1v9j h LYS 38 Cb 0.04 0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 31.97 1v9j h LYS 38 CO -0.01 -0.44 0.45 -0.07 -2.27 0.00 0.00 179.45 177.11 1v9j h LEU 39 N -1.18 0.95 0.04 5.20 3.38 -1.14 0.49 115.31 123.05 1v9j h LEU 39 Ca -0.07 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 57.85 1v9j h LEU 39 Cb 0.53 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1v9j h LEU 39 CO 0.12 0.75 -0.09 -0.09 0.09 0.00 0.00 178.44 179.21 1v9j h ARG 40 N 1.08 -0.17 -0.03 1.13 2.43 -0.65 0.34 114.38 118.51 1v9j h ARG 40 Ca 0.28 0.01 -0.24 0.00 -0.81 0.00 0.00 59.98 59.22 1v9j h ARG 40 Cb -0.01 0.04 0.02 0.00 -0.42 0.00 0.00 29.97 29.59 1v9j h ARG 40 CO -0.05 -0.11 -0.93 1.96 -1.51 0.00 0.00 179.97 179.33 1v9j h GLN 41 N -0.18 0.69 1.00 0.20 4.20 -1.19 0.38 115.11 120.21 1v9j h GLN 41 Ca 0.02 -0.69 -0.05 0.00 0.06 0.00 0.00 58.65 57.99 1v9j h GLN 41 Cb 0.20 0.19 0.01 0.00 0.30 0.00 0.00 27.48 28.18 1v9j h GLN 41 CO -0.07 1.28 -0.48 0.22 -0.67 0.00 0.00 178.83 179.12 1v9j h ASP 42 N 0.36 -1.14 1.61 1.46 1.82 0.11 -3.04 116.42 117.59 1v9j h ASP 42 Ca -0.11 0.04 -0.02 0.00 -0.39 0.00 0.00 57.03 56.56 1v9j h ASP 42 Cb 1.58 0.29 -0.00 0.00 0.68 0.00 0.00 39.33 41.88 1v9j h ASP 42 CO 0.18 -0.81 -0.08 -0.07 -1.61 0.00 0.00 179.24 176.86 1v9j h LEU 43 N -1.36 0.00 -2.43 2.28 3.38 -0.44 -3.49 115.31 113.26 1v9j h LEU 43 Ca -0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.83 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 0.23 0.08 -0.40 -0.62 0.09 0.00 0.00 178.44 177.81 1v9j n GLU 44 N -3.14 -1.91 -3.91 1.13 1.02 0.12 -4.98 120.64 108.98 1v9j n GLU 44 Ca 0.03 1.80 -0.23 0.00 -0.02 0.00 0.00 57.16 58.74 1v9j n GLU 44 Cb 0.49 -4.84 -0.05 0.00 -0.02 0.00 0.00 31.44 27.02 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 -2.28 3.74 -0.11 0.62 0.00 -0.75 -4.85 121.76 118.13 1v9j s ALA 45 Ca 0.20 -1.95 -0.11 0.00 0.00 0.00 0.00 51.96 50.10 1v9j s ALA 45 Cb -0.06 -0.72 -0.10 0.00 0.00 0.00 0.00 23.12 22.25 1v9j s ALA 45 CO 0.61 -0.13 0.30 0.93 0.00 0.00 0.00 175.76 177.47 1v9j h GLU 46 N 1.31 -0.01 -4.37 0.00 5.08 -1.83 -3.47 114.58 111.29 1v9j h GLU 46 Ca -0.43 0.00 -0.44 0.00 -1.00 0.00 0.00 59.36 57.50 1v9j h GLU 46 Cb 1.26 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 30.19 1v9j h GLU 46 CO 0.64 0.34 -0.79 -1.01 -1.00 0.00 0.00 179.01 177.19 1v9j s HIS 47 N -1.86 0.99 0.05 4.33 3.76 -1.22 -5.05 115.29 116.28 1v9j s HIS 47 Ca -0.07 -0.29 0.06 0.00 -0.15 0.00 0.00 55.06 54.61 1v9j s HIS 47 Cb -0.01 -0.76 -0.02 0.00 1.11 0.00 0.00 32.58 32.90 1v9j s HIS 47 CO 0.25 -0.17 -0.18 0.14 -0.85 0.00 0.00 174.74 173.93 1v9j s VAL 48 N 0.56 1.47 -0.04 -0.90 -7.23 -1.26 -2.64 120.40 110.35 1v9j s VAL 48 Ca -0.09 -1.16 -0.02 0.00 -1.81 0.00 0.00 61.98 58.90 1v9j s VAL 48 Cb -0.12 -1.30 0.03 0.00 0.56 0.00 0.00 36.38 35.55 1v9j s VAL 48 CO 0.01 0.10 0.05 -0.70 -0.31 0.00 0.00 175.10 174.26 1v9j s GLU 49 N -1.24 0.02 0.10 4.82 2.12 -1.10 -5.00 118.70 118.42 1v9j s GLU 49 Ca 0.05 0.34 0.04 0.00 0.36 0.00 0.00 54.97 55.77 1v9j s GLU 49 Cb -0.09 -0.58 -0.04 0.00 0.26 0.00 0.00 34.13 33.69 1v9j s GLU 49 CO 0.02 -0.33 0.04 0.54 -0.54 0.00 0.00 175.26 174.99 1v9j s VAL 50 N 2.14 4.20 0.17 3.70 0.11 -1.26 -1.46 120.40 128.00 1v9j s VAL 50 Ca 0.05 -0.96 0.03 0.00 -2.93 0.00 0.00 61.98 58.17 1v9j s VAL 50 Cb -0.12 -3.03 -0.05 0.00 -1.53 0.00 0.00 36.38 31.65 1v9j s VAL 50 CO -0.03 0.08 -0.04 -0.70 -3.33 0.00 0.00 175.10 171.08 1v9j s GLU 51 N -2.46 1.13 -0.13 1.54 2.56 0.07 -4.97 118.70 116.44 1v9j s GLU 51 Ca 0.27 -1.53 -0.13 0.00 0.00 0.00 0.00 54.97 53.59 1v9j s GLU 51 Cb -0.11 -0.47 0.03 0.00 2.00 0.00 0.00 34.13 35.58 1v9j s GLU 51 CO 0.20 -0.05 0.36 0.34 -0.56 0.00 0.00 175.26 175.55 1v9j s ASP 52 N -3.20 -0.37 -0.62 -1.70 2.15 -1.26 -2.16 116.67 109.51 1v9j s ASP 52 Ca 0.22 0.70 0.04 0.00 0.43 0.00 0.00 52.55 53.94 1v9j s ASP 52 Cb 0.05 0.72 0.16 0.00 -0.30 0.00 0.00 42.92 43.54 1v9j s ASP 52 CO 0.03 -0.14 0.40 0.42 -0.17 0.00 0.00 175.17 175.71 1v9j s THR 53 N 0.12 2.58 -0.28 1.71 -4.23 -1.25 -5.04 115.64 109.24 1v9j s THR 53 Ca -0.01 -3.81 -0.26 0.00 -1.18 0.00 0.00 61.69 56.43 1v9j s THR 53 Cb -0.03 -2.73 0.18 0.00 1.34 0.00 0.00 72.50 71.27 1v9j s THR 53 CO 0.01 -0.95 1.34 0.28 -0.54 0.00 0.00 174.62 174.76 1v9j s THR 54 N -0.93 0.00 0.00 3.99 -1.32 -1.26 -4.50 115.64 111.63 1v9j s THR 54 Ca 0.23 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.74 1v9j s THR 54 Cb -0.12 -1.00 -0.25 0.00 -1.51 0.00 0.00 72.50 69.63 1v9j s THR 54 CO -0.11 0.00 0.85 -0.07 -2.21 0.00 0.00 174.62 173.08 1v9j h LEU 55 N 2.97 0.18 0.00 9.08 3.38 -2.01 -3.48 115.31 125.44 1v9j h LEU 55 Ca -0.22 -0.28 -0.41 0.00 0.09 0.00 0.00 57.88 57.06 1v9j h LEU 55 Cb 1.19 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 1v9j h LEU 55 CO 0.19 1.24 -0.16 0.59 0.09 0.00 0.00 178.44 180.38 1v9j n ASN 56 N -3.30 2.12 -4.29 -0.43 4.13 -1.26 -5.06 115.26 107.17 1v9j n ASN 56 Ca -0.14 -2.34 -0.45 0.00 1.68 0.00 0.00 54.58 53.34 1v9j n ASN 56 Cb 1.02 -0.10 0.00 0.00 -1.54 0.00 0.00 39.78 39.17 1v9j n ASN 56 CO 0.00 0.00 0.00 -1.14 0.28 0.00 0.00 177.26 176.40 1v9j n ARG 57 N -1.57 3.67 -2.45 3.52 0.63 -1.26 -4.76 116.66 114.44 1v9j n ARG 57 Ca 0.02 -4.42 -0.14 0.00 -0.92 0.00 0.00 57.85 52.39 1v9j n ARG 57 Cb 0.46 -2.59 0.03 0.00 0.45 0.00 0.00 32.46 30.81 1v9j n ARG 57 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1v9j n ALA 59 N -0.57 0.00 -1.00 0.00 0.00 -1.26 -4.92 120.51 112.77 1v9j n ALA 59 Ca 0.26 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.71 1v9j n ALA 59 Cb 0.85 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.30 1v9j n ALA 59 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1v9j n THR 60 N 0.00 0.00 -1.51 0.00 -1.04 -1.26 -4.80 114.28 105.67 1v9j n THR 60 Ca 0.00 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.71 1v9j n THR 60 Cb 0.00 -0.04 0.09 0.00 -1.82 0.00 0.00 70.33 68.56 1v9j n THR 60 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1v9j s SER 61 N -4.27 4.53 -0.00 8.00 0.01 -1.26 -3.97 113.70 116.74 1v9j s SER 61 Ca 0.00 1.40 -0.15 0.00 1.31 0.00 0.00 55.95 58.51 1v9j s SER 61 Cb 0.00 -2.15 0.02 0.00 0.21 0.00 0.00 66.02 64.10 1v9j s SER 61 CO 0.00 -1.96 0.32 -0.36 0.41 0.00 0.00 173.24 171.65 1v9j s PHE 62 N -3.10 -0.18 -0.09 2.43 0.08 -0.30 -3.79 117.98 113.02 1v9j s PHE 62 Ca 0.61 0.23 0.03 0.00 0.12 0.00 0.00 56.93 57.91 1v9j s PHE 62 Cb -0.15 0.11 0.01 0.00 -0.57 0.00 0.00 43.02 42.42 1v9j s PHE 62 CO 0.55 -0.42 -0.18 0.50 -0.10 0.00 0.00 175.22 175.56 1v9j s ARG 63 N -1.60 2.44 -0.10 0.44 3.52 -0.92 -2.52 118.95 120.21 1v9j s ARG 63 Ca -0.12 -0.66 0.04 0.00 -0.13 0.00 0.00 55.73 54.86 1v9j s ARG 63 Cb -0.04 -1.93 0.00 0.00 -1.56 0.00 0.00 34.95 31.42 1v9j s ARG 63 CO 0.03 0.08 -0.23 0.14 -0.81 0.00 0.00 175.30 174.50 1v9j s VAL 64 N 0.58 2.02 -0.02 7.11 -7.23 -0.29 -0.75 120.40 121.81 1v9j s VAL 64 Ca -0.15 -0.99 0.07 0.00 -1.81 0.00 0.00 61.98 59.09 1v9j s VAL 64 Cb -0.17 -1.74 -0.02 0.00 0.56 0.00 0.00 36.38 35.01 1v9j s VAL 64 CO 0.05 0.55 -0.22 -0.22 -0.31 0.00 0.00 175.10 174.95 1v9j s LEU 65 N 0.35 2.04 -0.06 1.32 1.98 -0.54 -2.55 118.68 121.22 1v9j s LEU 65 Ca -0.19 -0.41 -0.03 0.00 -2.89 0.00 0.00 54.13 50.62 1v9j s LEU 65 Cb -0.18 -1.15 0.03 0.00 0.66 0.00 0.00 46.19 45.55 1v9j s LEU 65 CO 0.09 0.26 0.13 -0.69 -1.89 0.00 0.00 176.35 174.25 1v9j s VAL 66 N -0.47 -0.04 -0.09 1.68 1.01 -1.06 -2.70 120.40 118.74 1v9j s VAL 66 Ca 0.07 0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.18 1v9j s VAL 66 Cb -0.09 -0.21 0.03 0.00 0.00 0.00 0.00 36.38 36.11 1v9j s VAL 66 CO -0.00 0.06 -0.04 -0.69 0.00 0.00 0.00 175.10 174.42 1v9j s VAL 67 N 0.87 0.73 -0.02 2.92 1.01 -1.08 -2.90 120.40 121.92 1v9j s VAL 67 Ca -0.07 -0.10 -0.30 0.00 0.00 0.00 0.00 61.98 61.52 1v9j s VAL 67 Cb -0.09 -0.81 0.11 0.00 0.00 0.00 0.00 36.38 35.60 1v9j s VAL 67 CO -0.04 0.32 1.29 -0.94 0.00 0.00 0.00 175.10 175.73 1v9j s SER 68 N 1.83 -0.04 0.22 3.32 1.04 -1.13 -2.34 113.70 116.61 1v9j s SER 68 Ca 0.05 -0.16 0.23 0.00 0.48 0.00 0.00 55.95 56.55 1v9j s SER 68 Cb -0.12 0.16 0.06 0.00 0.10 0.00 0.00 66.02 66.21 1v9j s SER 68 CO -0.07 -0.30 1.12 0.00 0.98 0.00 0.00 173.24 174.98 1v9j h ALA 69 N 2.00 0.56 -0.59 5.32 0.00 -1.93 -3.35 119.26 121.27 1v9j h ALA 69 Ca -0.29 0.00 0.15 0.00 0.00 0.00 0.00 54.91 54.78 1v9j h ALA 69 Cb 1.20 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1v9j h ALA 69 CO 0.29 0.00 0.41 -0.22 0.00 0.00 0.00 179.25 179.74 1v9j h LYS 70 N 0.00 0.10 -0.01 0.00 3.64 -1.94 0.13 116.57 118.50 1v9j h LYS 70 Ca 0.00 -0.01 -0.17 0.00 -1.27 0.00 0.00 60.65 59.21 1v9j h LYS 70 Cb 0.98 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.76 1v9j h LYS 70 CO 0.00 0.07 -0.77 0.74 -2.27 0.00 0.00 179.45 177.21 1v9j h PHE 71 N 0.10 0.13 -0.86 1.91 0.04 -1.91 -3.22 116.94 113.13 1v9j h PHE 71 Ca 0.28 -0.06 0.00 0.00 2.80 0.00 0.00 57.97 60.99 1v9j h PHE 71 Cb 0.97 -0.02 -0.04 0.00 2.20 0.00 0.00 35.95 39.06 1v9j h PHE 71 CO -0.00 0.82 0.55 0.93 -0.60 0.00 0.00 178.31 180.01 1v9j h GLU 72 N 0.05 1.15 -0.10 1.51 4.39 -0.94 -1.98 114.58 118.66 1v9j h GLU 72 Ca -0.02 -0.08 0.03 0.00 0.34 0.00 0.00 59.36 59.63 1v9j h GLU 72 Cb 1.36 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 29.75 1v9j h GLU 72 CO 0.11 0.78 0.07 0.78 -1.16 0.00 0.00 179.01 179.59 1v9j h GLY 73 N 1.17 0.01 -3.79 -3.84 0.00 -1.53 -3.42 103.07 91.68 1v9j h GLY 73 Ca 0.31 -0.00 -0.56 0.00 0.00 0.00 0.00 47.33 47.08 1v9j h GLY 73 CO -0.06 0.00 -0.53 0.54 0.00 0.00 0.00 176.54 176.49 1v9j s LYS 74 N -5.07 3.06 0.40 4.80 1.02 -0.75 -5.12 119.74 118.09 1v9j s LYS 74 Ca -0.05 -0.81 -0.07 0.00 0.02 0.00 0.00 55.97 55.07 1v9j s LYS 74 Cb 0.17 -2.73 0.10 0.00 -0.52 0.00 0.00 37.83 34.85 1v9j s LYS 74 CO 0.68 0.49 0.31 -0.35 -0.92 0.00 0.00 175.35 175.56 1v9j n PRO 75 N -0.48 -2.08 0.08 -1.68 -0.04 -1.26 -4.78 135.00 124.74 1v9j n PRO 75 Ca -0.08 -0.50 -0.10 0.00 -0.04 0.00 0.00 63.50 62.78 1v9j n PRO 75 Cb 0.55 -0.53 -0.10 0.00 -0.04 0.00 0.00 33.50 33.38 1v9j n PRO 75 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1v9j h LEU 76 N 0.00 0.15 -0.43 1.53 6.46 -1.97 -2.90 115.31 118.16 1v9j h LEU 76 Ca -0.12 -0.16 -0.17 0.00 -0.12 0.00 0.00 57.88 57.31 1v9j h LEU 76 Cb 0.39 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.25 1v9j h LEU 76 CO 0.08 1.09 -0.78 0.17 -0.62 0.00 0.00 178.44 178.38 1v9j h LEU 77 N 0.03 0.15 -0.02 2.25 -0.00 -1.99 -2.76 115.31 112.96 1v9j h LEU 77 Ca -0.05 -0.11 -0.02 0.00 -0.00 0.00 0.00 57.88 57.70 1v9j h LEU 77 Cb 1.78 -0.04 0.00 0.00 -0.00 0.00 0.00 40.66 42.39 1v9j h LEU 77 CO 0.15 0.87 -0.08 1.56 -0.00 0.00 0.00 178.44 180.94 1v9j h GLN 78 N 0.07 0.10 -0.88 0.17 1.08 -1.92 -1.47 115.11 112.25 1v9j h GLN 78 Ca -0.02 -0.07 0.02 0.00 -1.45 0.00 0.00 58.65 57.12 1v9j h GLN 78 Cb 1.37 0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 28.77 1v9j h GLN 78 CO 0.11 0.71 0.58 0.07 -0.95 0.00 0.00 178.83 179.35 1v9j h ARG 79 N -0.49 1.14 0.00 1.46 0.11 -1.59 0.34 114.38 115.35 1v9j h ARG 79 Ca -0.00 -0.07 -0.00 0.00 0.10 0.00 0.00 59.98 60.01 1v9j h ARG 79 Cb 0.72 -0.26 0.00 0.00 1.11 0.00 0.00 29.97 31.54 1v9j h ARG 79 CO 0.02 0.75 -0.00 0.45 0.10 0.00 0.00 179.97 181.29 1v9j h HIS 80 N 1.17 -0.00 -0.08 4.08 3.86 -1.52 -2.97 115.15 119.68 1v9j h HIS 80 Ca 0.33 -0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.49 1v9j h HIS 80 Cb -0.09 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.37 1v9j h HIS 80 CO -0.00 0.49 -0.19 -0.09 0.86 0.00 0.00 177.93 179.01 1v9j h ARG 81 N -0.50 0.13 0.10 2.45 2.43 -1.03 -2.71 114.38 115.25 1v9j h ARG 81 Ca -0.00 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1v9j h ARG 81 Cb 0.50 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1v9j h ARG 81 CO 0.00 0.32 -0.05 -0.07 -1.51 0.00 0.00 179.97 178.66 1v9j h LEU 82 N 0.12 -0.12 -1.20 3.80 3.38 -0.29 0.21 115.31 121.22 1v9j h LEU 82 Ca 0.02 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1v9j h LEU 82 Cb 0.40 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1v9j h LEU 82 CO 0.03 -0.08 0.21 0.58 0.09 0.00 0.00 178.44 179.27 1v9j h VAL 83 N -0.15 1.20 -0.35 1.22 2.07 -1.36 -2.45 116.25 116.42 1v9j h VAL 83 Ca -0.01 -0.62 -0.17 0.00 0.82 0.00 0.00 66.70 66.72 1v9j h VAL 83 Cb 0.12 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1v9j h VAL 83 CO 0.02 0.24 -0.44 0.78 0.02 0.00 0.00 177.57 178.19 1v9j h ASN 84 N 0.76 1.00 -0.81 0.57 4.21 -1.16 -3.08 115.58 117.08 1v9j h ASN 84 Ca 0.18 -0.49 0.00 0.00 1.21 0.00 0.00 56.30 57.21 1v9j h ASN 84 Cb 0.16 -0.28 -0.04 0.00 -1.12 0.00 0.00 38.32 37.03 1v9j h ASN 84 CO -0.02 1.29 0.52 -0.33 -1.29 0.00 0.00 177.43 177.61 1v9j h GLU 85 N 0.74 1.08 0.85 0.81 5.08 -0.20 -0.93 114.58 122.01 1v9j h GLU 85 Ca 0.04 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1v9j h GLU 85 Cb 1.05 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 30.07 1v9j h GLU 85 CO 0.11 0.73 -0.41 0.00 -1.00 0.00 0.00 179.01 178.44 1v9j n LEU 87 N -5.58 6.92 -0.06 0.00 4.77 -1.14 -4.73 117.00 117.18 1v9j n LEU 87 Ca -0.15 -5.14 -0.13 0.00 -0.03 0.00 0.00 56.01 50.56 1v9j n LEU 87 Cb 0.46 -1.00 -0.06 0.00 -2.33 0.00 0.00 43.42 40.49 1v9j n LEU 87 CO 0.40 1.96 0.61 0.00 -1.33 0.00 0.00 177.39 179.03 1v9j h ALA 88 N 3.37 0.26 -0.02 -1.18 0.00 -1.17 0.38 119.26 120.90 1v9j h ALA 88 Ca 0.49 -0.33 -0.19 0.00 0.00 0.00 0.00 54.91 54.89 1v9j h ALA 88 Cb 0.26 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1v9j h ALA 88 CO 1.23 0.15 -0.82 0.93 0.00 0.00 0.00 179.25 180.74 1v9j h GLU 89 N 0.08 0.25 0.00 0.00 5.08 -1.86 -3.20 114.58 114.92 1v9j h GLU 89 Ca 0.03 -0.25 -0.16 0.00 -1.00 0.00 0.00 59.36 57.99 1v9j h GLU 89 Cb 0.68 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 1v9j h GLU 89 CO 0.04 0.94 -0.75 0.93 -1.00 0.00 0.00 179.01 179.17 1v9j h GLU 90 N 0.15 0.00 -0.04 2.33 3.07 -1.90 -3.33 114.58 114.86 1v9j h GLU 90 Ca -0.04 0.00 0.03 0.00 -0.50 0.00 0.00 59.36 58.85 1v9j h GLU 90 Cb 1.42 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 29.27 1v9j h GLU 90 CO 0.13 0.75 -0.48 -0.07 -1.40 0.00 0.00 179.01 177.95 1v9j h LEU 91 N 0.00 -1.47 -1.79 1.33 3.38 -0.91 -1.01 115.31 114.84 1v9j h LEU 91 Ca -0.01 0.18 0.41 0.00 0.09 0.00 0.00 57.88 58.55 1v9j h LEU 91 Cb 1.34 0.57 -0.08 0.00 0.09 0.00 0.00 40.66 42.58 1v9j h LEU 91 CO 0.10 -0.48 0.97 -0.65 0.09 0.00 0.00 178.44 178.47 1v9j h PRO 92 N -0.60 0.07 -0.01 1.13 0.11 -1.70 0.95 132.00 131.95 1v9j h PRO 92 Ca 0.04 -0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.97 1v9j h PRO 92 Cb 0.68 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.76 1v9j h PRO 92 CO -0.36 0.05 -0.78 0.45 -0.21 0.00 0.00 178.00 177.14 1v9j h HIS 93 N 0.07 0.19 -3.10 0.65 3.86 -1.37 -3.43 115.15 112.02 1v9j h HIS 93 Ca 0.72 -0.09 -0.57 0.00 -1.16 0.00 0.00 60.37 59.26 1v9j h HIS 93 Cb 2.61 -0.02 -0.05 0.00 1.06 0.00 0.00 27.41 31.01 1v9j h HIS 93 CO -0.00 0.86 1.07 0.42 0.86 0.00 0.00 177.93 181.14 1v9j s ILE 94 N -3.33 3.90 0.34 2.45 -1.09 0.33 -4.81 121.20 119.00 1v9j s ILE 94 Ca -0.02 0.97 0.02 0.00 -2.23 0.00 0.00 60.65 59.39 1v9j s ILE 94 Cb 0.11 -4.06 0.26 0.00 -1.58 0.00 0.00 42.46 37.19 1v9j s ILE 94 CO 0.81 -0.57 2.00 -0.74 -1.23 0.00 0.00 174.94 175.21 1v9j h HIS 95 N 10.47 0.81 -2.42 3.97 2.76 -1.81 -3.41 115.15 125.53 1v9j h HIS 95 Ca -0.29 0.01 -0.15 0.00 -2.20 0.00 0.00 60.37 57.75 1v9j h HIS 95 Cb 1.12 -0.27 -0.30 0.00 1.55 0.00 0.00 27.41 29.51 1v9j h HIS 95 CO 0.93 0.52 -0.45 0.00 -1.30 0.00 0.00 177.93 177.64 1v9j s ALA 96 N -5.71 -0.96 0.03 5.26 0.00 -1.26 -4.98 121.76 114.14 1v9j s ALA 96 Ca -0.10 1.15 0.06 0.00 0.00 0.00 0.00 51.96 53.07 1v9j s ALA 96 Cb 0.18 -1.36 -0.03 0.00 0.00 0.00 0.00 23.12 21.91 1v9j s ALA 96 CO 0.77 -0.90 -0.17 0.12 0.00 0.00 0.00 175.76 175.58 1v9j s PHE 97 N 2.54 2.59 -0.11 0.00 2.19 -1.26 -1.15 117.98 122.77 1v9j s PHE 97 Ca 0.03 -0.24 -0.04 0.00 0.33 0.00 0.00 56.93 57.02 1v9j s PHE 97 Cb -0.13 -1.49 0.06 0.00 -1.31 0.00 0.00 43.02 40.14 1v9j s PHE 97 CO -0.13 0.25 0.21 -2.00 1.83 0.00 0.00 175.22 175.38 1v9j s GLU 98 N -1.35 0.09 0.20 10.12 2.56 -1.05 -4.99 118.70 124.28 1v9j s GLU 98 Ca 0.14 0.66 0.11 0.00 0.00 0.00 0.00 54.97 55.89 1v9j s GLU 98 Cb -0.11 -0.15 -0.04 0.00 2.00 0.00 0.00 34.13 35.83 1v9j s GLU 98 CO 0.05 -0.30 -0.24 1.14 -0.56 0.00 0.00 175.26 175.36 1v9j s GLN 99 N 2.36 1.53 -0.14 4.30 0.00 -1.26 -1.14 119.66 125.30 1v9j s GLN 99 Ca 0.02 -1.55 -0.06 0.00 -0.00 0.00 0.00 55.36 53.77 1v9j s GLN 99 Cb -0.12 -1.83 0.06 0.00 0.00 0.00 0.00 33.01 31.13 1v9j s GLN 99 CO -0.07 0.39 0.31 0.21 0.00 0.00 0.00 175.29 176.13 1v9j s LYS 100 N -2.76 0.24 -0.08 9.60 2.36 -1.06 -5.00 119.74 123.04 1v9j s LYS 100 Ca 0.22 0.75 0.02 0.00 -2.55 0.00 0.00 55.97 54.41 1v9j s LYS 100 Cb -0.08 0.01 -0.02 0.00 -1.05 0.00 0.00 37.83 36.69 1v9j s LYS 100 CO 0.10 -0.22 -0.14 0.95 1.55 0.00 0.00 175.35 177.60 1v9j s THR 101 N 1.95 3.08 0.09 3.43 -4.23 -1.26 -2.56 115.64 116.15 1v9j s THR 101 Ca -0.04 -0.69 -0.08 0.00 -1.18 0.00 0.00 61.69 59.70 1v9j s THR 101 Cb -0.11 -2.24 -0.01 0.00 1.34 0.00 0.00 72.50 71.48 1v9j s THR 101 CO -0.10 0.57 0.17 -0.76 -0.54 0.00 0.00 174.62 173.95 1v9j s LEU 102 N -0.31 1.53 0.36 4.79 1.43 -1.14 -5.05 118.68 120.28 1v9j s LEU 102 Ca 0.03 -0.71 -0.20 0.00 -1.03 0.00 0.00 54.13 52.22 1v9j s LEU 102 Cb -0.13 0.94 -0.10 0.00 0.03 0.00 0.00 46.19 46.93 1v9j s LEU 102 CO 0.03 -0.72 0.86 0.42 0.23 0.00 0.00 176.35 177.16 1v9j s THR 103 N -3.88 4.47 0.25 5.49 -4.23 -1.26 -2.83 115.64 113.66 1v9j s THR 103 Ca 0.06 1.35 -0.03 0.00 -1.18 0.00 0.00 61.69 61.90 1v9j s THR 103 Cb 0.05 -3.69 0.23 0.00 1.34 0.00 0.00 72.50 70.43 1v9j s THR 103 CO -0.10 -0.16 1.76 -0.65 -0.54 0.00 0.00 174.62 174.93 1v9j h PRO 104 N 2.36 0.57 -0.47 3.99 0.11 -1.89 -1.39 132.00 135.28 1v9j h PRO 104 Ca -0.48 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.60 1v9j h PRO 104 Cb 1.18 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.14 1v9j h PRO 104 CO 0.63 0.38 0.31 0.93 -0.21 0.00 0.00 178.00 180.04 1v9j h GLU 105 N 0.59 0.61 -0.01 1.05 5.08 -1.96 -0.08 114.58 119.85 1v9j h GLU 105 Ca 0.44 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.76 1v9j h GLU 105 Cb 0.60 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 1v9j h GLU 105 CO -0.35 0.40 0.01 1.96 -1.00 0.00 0.00 179.01 180.02 1v9j h GLN 106 N 0.62 0.01 -0.00 2.33 4.20 -1.68 -2.34 115.11 118.26 1v9j h GLN 106 Ca 0.18 -0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.86 1v9j h GLN 106 Cb -0.05 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.72 1v9j h GLN 106 CO -0.05 0.02 -0.13 2.35 -0.67 0.00 0.00 178.83 180.35 1v9j h TRP 107 N -0.00 0.00 -0.32 2.96 2.91 -1.12 -2.04 115.95 118.34 1v9j h TRP 107 Ca 0.00 -0.00 0.06 0.00 1.13 0.00 0.00 58.89 60.08 1v9j h TRP 107 Cb 0.01 -0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 28.65 1v9j h TRP 107 CO -0.07 0.13 0.22 1.15 -1.03 0.00 0.00 178.44 178.84 1v9j h THR 108 N 0.00 0.94 -0.12 2.65 2.02 -0.44 -0.38 112.91 117.58 1v9j h THR 108 Ca -0.00 -0.06 -0.04 0.00 0.77 0.00 0.00 66.41 67.07 1v9j h THR 108 Cb 0.24 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 1v9j h THR 108 CO 0.02 0.03 -0.12 0.03 0.37 0.00 0.00 175.52 175.85 1v9j h ARG 109 N 0.19 0.18 -2.60 6.66 2.47 -1.31 -3.33 114.38 116.64 1v9j h ARG 109 Ca 0.14 -0.04 -0.60 0.00 -1.26 0.00 0.00 59.98 58.23 1v9j h ARG 109 Cb 0.34 -0.03 -0.39 0.00 -1.65 0.00 0.00 29.97 28.24 1v9j h ARG 109 CO -0.02 0.31 -0.84 1.04 0.56 0.00 0.00 179.97 181.02 1v9j n GLN 110 N -4.31 0.79 -1.25 0.04 6.02 -0.16 -4.96 117.38 113.55 1v9j n GLN 110 Ca -0.01 -3.64 -0.30 0.00 -0.01 0.00 0.00 57.00 53.04 1v9j n GLN 110 Cb 0.24 -1.88 0.06 0.00 1.02 0.00 0.00 30.24 29.68 1v9j n GLN 110 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1v9j n ARG 111 N 2.48 2.42 -1.71 -1.09 5.12 -1.16 -4.90 116.66 117.81 1v9j n ARG 111 Ca 0.26 -2.76 -0.42 0.00 -1.93 0.00 0.00 57.85 53.00 1v9j n ARG 111 Cb 0.44 -2.08 -0.03 0.00 -1.16 0.00 0.00 32.46 29.62 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 -3.18 3.02 0.00 5.56 1.81 -1.26 -5.14 118.95 119.76 1v9j s ARG 112 Ca 0.54 1.74 0.31 0.00 -1.72 0.00 0.00 55.73 56.60 1v9j s ARG 112 Cb 0.42 -4.36 1.68 0.00 -0.45 0.00 0.00 34.95 32.24 1v9j s ARG 112 CO -0.04 -2.23 2.10 0.39 -0.68 0.00 0.00 175.30 174.83