#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 0.67 -3.85 0.03 4.01 -1.26 -5.00 118.16 112.77 1v9j n LYS 2 Ca 0.00 0.16 -0.21 0.00 -0.51 0.00 0.00 58.31 57.75 1v9j n LYS 2 Cb 0.00 -1.55 -0.03 0.00 -0.51 0.00 0.00 35.03 32.93 1v9j n LYS 2 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 1v9j s GLY 3 N -6.33 1.65 0.00 0.72 0.00 -1.26 -5.04 107.32 97.07 1v9j s GLY 3 Ca -0.32 -1.56 0.00 0.00 0.00 0.00 0.00 44.72 42.84 1v9j s GLY 3 CO 0.64 -1.52 0.00 -1.26 0.00 0.00 0.00 173.10 170.96 1v9j n SER 4 N -1.36 0.00 -4.33 1.64 2.88 -1.26 -4.97 113.62 106.22 1v9j n SER 4 Ca -0.03 0.01 -0.45 0.00 -1.33 0.00 0.00 58.87 57.06 1v9j n SER 4 Cb 0.59 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 64.05 1v9j n SER 4 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1v9j s SER 5 N -5.00 7.16 0.10 -3.46 0.01 -1.26 -4.99 113.70 106.26 1v9j s SER 5 Ca 0.00 -3.43 -0.09 0.00 1.31 0.00 0.00 55.95 53.75 1v9j s SER 5 Cb 0.00 -2.20 -0.00 0.00 0.21 0.00 0.00 66.02 64.03 1v9j s SER 5 CO 0.00 -0.34 0.21 -1.38 0.41 0.00 0.00 173.24 172.14 1v9j s HIS 6 N -0.99 0.18 -0.30 2.43 -0.00 -1.26 -5.16 115.29 110.19 1v9j s HIS 6 Ca 0.28 -0.59 -0.10 0.00 -0.00 0.00 0.00 55.06 54.64 1v9j s HIS 6 Cb -0.10 -0.05 0.14 0.00 -0.00 0.00 0.00 32.58 32.57 1v9j s HIS 6 CO -0.08 -0.57 0.73 -1.01 -0.00 0.00 0.00 174.74 173.80 1v9j s HIS 7 N -3.87 -1.21 0.61 0.38 3.76 -1.26 -5.17 115.29 108.52 1v9j s HIS 7 Ca 0.07 2.02 0.07 0.00 -0.15 0.00 0.00 55.06 57.06 1v9j s HIS 7 Cb 0.05 0.70 0.10 0.00 1.11 0.00 0.00 32.58 34.53 1v9j s HIS 7 CO -0.10 -0.61 0.84 -1.01 -0.85 0.00 0.00 174.74 173.02 1v9j s HIS 8 N 2.80 1.50 -0.24 1.40 3.76 -1.26 -4.89 115.29 118.36 1v9j s HIS 8 Ca -0.03 -0.59 -0.07 0.00 -0.15 0.00 0.00 55.06 54.22 1v9j s HIS 8 Cb -0.11 -2.44 0.03 0.00 1.11 0.00 0.00 32.58 31.17 1v9j s HIS 8 CO -0.19 -1.29 0.13 0.72 -0.85 0.00 0.00 174.74 173.27 1v9j n HIS 9 N -2.40 -4.26 -1.21 1.40 8.25 -1.26 -4.89 115.22 110.86 1v9j n HIS 9 Ca 0.15 2.21 -0.29 0.00 -0.26 0.00 0.00 57.72 59.54 1v9j n HIS 9 Cb 0.61 -3.97 0.12 0.00 1.12 0.00 0.00 29.99 27.87 1v9j n HIS 9 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1v9j n HIS 10 N 1.22 2.99 -2.10 4.41 8.25 -1.26 -4.33 115.22 124.40 1v9j n HIS 10 Ca -0.23 -2.44 -0.06 0.00 -0.26 0.00 0.00 57.72 54.73 1v9j n HIS 10 Cb 0.35 -1.20 0.09 0.00 1.12 0.00 0.00 29.99 30.35 1v9j n HIS 10 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1v9j n HIS 11 N -0.90 1.19 -0.06 4.41 1.44 -1.26 -4.74 115.22 115.30 1v9j n HIS 11 Ca 0.58 -1.71 -0.11 0.00 -2.01 0.00 0.00 57.72 54.47 1v9j n HIS 11 Cb 1.05 -0.26 -0.15 0.00 0.12 0.00 0.00 29.99 30.76 1v9j n HIS 11 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1v9j n SER 12 N -0.63 0.77 -4.68 4.39 2.88 -1.26 -4.96 113.62 110.12 1v9j n SER 12 Ca 0.24 0.16 -0.30 0.00 -1.33 0.00 0.00 58.87 57.64 1v9j n SER 12 Cb 0.88 0.25 0.15 0.00 -0.75 0.00 0.00 64.21 64.74 1v9j n SER 12 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1v9j s SER 13 N -5.99 3.16 0.00 -3.46 0.15 -1.26 -4.60 113.70 101.69 1v9j s SER 13 Ca -0.12 1.88 0.00 0.00 0.70 0.00 0.00 55.95 58.41 1v9j s SER 13 Cb 0.07 -2.45 0.00 0.00 -1.71 0.00 0.00 66.02 61.93 1v9j s SER 13 CO 0.80 -2.90 0.00 0.61 1.20 0.00 0.00 173.24 172.95 1v9j n GLY 14 N -0.32 1.04 2.24 9.45 0.00 -1.26 -4.93 105.19 111.40 1v9j n GLY 14 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.03 -2.05 -2.20 4.61 0.00 -1.26 -4.97 120.51 114.62 1v9j n ALA 15 Ca 0.00 0.48 -0.07 0.00 0.00 0.00 0.00 53.44 53.84 1v9j n ALA 15 Cb 0.00 -1.44 0.07 0.00 0.00 0.00 0.00 19.45 18.08 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 1.81 2.80 -2.94 0.00 3.41 -1.26 -4.95 113.62 112.50 1v9j n SER 16 Ca 0.00 -3.10 -0.22 0.00 -0.26 0.00 0.00 58.87 55.29 1v9j n SER 16 Cb 0.00 -0.41 0.04 0.00 -0.26 0.00 0.00 64.21 63.58 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 -0.60 -2.69 -3.65 1.04 7.94 -1.26 -4.96 117.00 112.82 1v9j n LEU 17 Ca 0.24 -0.29 -0.02 0.00 -1.11 0.00 0.00 56.01 54.83 1v9j n LEU 17 Cb 0.89 -2.90 -0.07 0.00 0.53 0.00 0.00 43.42 41.87 1v9j n LEU 17 CO 0.16 0.24 1.02 0.54 -1.11 0.00 0.00 177.39 178.24 1v9j s VAL 18 N -3.17 0.00 0.40 1.96 0.11 -1.26 -5.16 120.40 113.28 1v9j s VAL 18 Ca 0.31 0.00 -0.25 0.00 -2.93 0.00 0.00 61.98 59.10 1v9j s VAL 18 Cb -0.13 -1.00 -0.08 0.00 -1.53 0.00 0.00 36.38 33.63 1v9j s VAL 18 CO 0.38 0.00 1.17 -2.16 -3.33 0.00 0.00 175.10 171.16 1v9j s PRO 19 N 0.45 4.06 0.08 1.54 0.04 -1.26 -4.95 135.00 134.95 1v9j s PRO 19 Ca 0.01 1.85 0.00 0.00 0.04 0.00 0.00 61.00 62.90 1v9j s PRO 19 Cb -0.04 -2.68 0.00 0.00 0.04 0.00 0.00 34.50 31.82 1v9j s PRO 19 CO -0.13 -0.32 0.00 -2.13 0.04 0.00 0.00 177.00 174.46 1v9j n ARG 20 N 0.09 0.00 -0.63 4.56 3.00 -1.26 -4.94 116.66 117.48 1v9j n ARG 20 Ca 0.04 0.00 0.02 0.00 -0.00 0.00 0.00 57.85 57.91 1v9j n ARG 20 Cb 0.46 -0.02 0.20 0.00 0.00 0.00 0.00 32.46 33.10 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 1.82 4.94 1.45 5.14 0.00 -1.26 -5.09 105.19 112.19 1v9j n GLY 21 Ca 0.00 -1.24 0.04 0.00 0.00 0.00 0.00 46.02 44.82 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 -1.11 -7.83 -0.05 1.61 7.64 -1.26 -4.91 113.62 107.70 1v9j n SER 22 Ca 0.25 1.69 -0.06 0.00 1.01 0.00 0.00 58.87 61.76 1v9j n SER 22 Cb 0.85 -4.71 -0.08 0.00 -1.01 0.00 0.00 64.21 59.26 1v9j n SER 22 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1v9j n GLU 23 N -2.91 2.06 0.00 1.43 0.00 -1.26 -5.02 120.64 114.93 1v9j n GLU 23 Ca -0.02 0.01 0.00 0.00 0.00 0.00 0.00 57.16 57.15 1v9j n GLU 23 Cb 0.50 -1.26 0.00 0.00 0.00 0.00 0.00 31.44 30.68 1v9j n GLU 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1v9j n GLY 24 N 2.45 -1.01 3.27 8.31 0.00 -1.26 -5.16 105.19 111.79 1v9j n GLY 24 Ca -0.17 0.48 -0.29 0.00 0.00 0.00 0.00 46.02 46.03 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 0.00 1.97 -1.81 4.61 0.00 -1.26 -4.67 121.76 120.59 1v9j s ALA 25 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 50.93 1v9j s ALA 25 Cb 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 23.12 22.63 1v9j s ALA 25 CO 0.00 0.48 0.00 0.00 0.00 0.00 0.00 175.76 176.24 1v9j n ALA 26 N 2.45 -0.57 0.15 0.00 0.00 -1.26 -4.84 120.51 116.44 1v9j n ALA 26 Ca -0.16 0.20 0.10 0.00 0.00 0.00 0.00 53.44 53.58 1v9j n ALA 26 Cb 0.52 -2.11 0.61 0.00 0.00 0.00 0.00 19.45 18.46 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 0.00 0.96 0.00 0.00 2.02 -2.02 -2.95 112.91 110.92 1v9j h THR 27 Ca -0.47 -0.04 -0.11 0.00 0.77 0.00 0.00 66.41 66.56 1v9j h THR 27 Cb 1.35 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 68.57 1v9j h THR 27 CO 0.57 0.02 -1.61 0.23 0.37 0.00 0.00 175.52 175.11 1v9j n MET 28 N -4.50 1.63 -3.08 6.66 2.81 -1.26 -4.79 117.12 114.59 1v9j n MET 28 Ca 0.01 -0.04 -0.44 0.00 -1.81 0.00 0.00 57.70 55.42 1v9j n MET 28 Cb 0.20 -1.25 0.00 0.00 -0.71 0.00 0.00 33.22 31.46 1v9j n MET 28 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1v9j n GLU 29 N -2.18 3.57 -1.62 0.03 4.71 -1.11 -5.01 120.64 119.02 1v9j n GLU 29 Ca -0.11 -4.16 -0.59 0.00 -0.01 0.00 0.00 57.16 52.29 1v9j n GLU 29 Cb 0.62 -2.77 -0.08 0.00 -1.01 0.00 0.00 31.44 28.21 1v9j n GLU 29 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 1v9j n LEU 30 N 3.80 1.12 -4.24 -4.62 4.32 -1.25 -4.70 117.00 111.42 1v9j n LEU 30 Ca 0.30 1.14 -0.16 0.00 -0.02 0.00 0.00 56.01 57.27 1v9j n LEU 30 Cb 0.40 -1.02 -0.11 0.00 -1.62 0.00 0.00 43.42 41.07 1v9j n LEU 30 CO 0.58 -1.18 -0.43 -0.44 -1.22 0.00 0.00 177.39 174.70 1v9j s SER 31 N 1.45 1.91 0.17 -1.43 0.01 -1.26 -5.04 113.70 109.52 1v9j s SER 31 Ca 0.94 -0.88 -0.13 0.00 1.31 0.00 0.00 55.95 57.18 1v9j s SER 31 Cb -1.21 -0.05 0.07 0.00 0.21 0.00 0.00 66.02 65.04 1v9j s SER 31 CO 0.62 -0.21 1.79 0.00 0.41 0.00 0.00 173.24 175.85 1v9j h ALA 32 N 3.24 0.71 -0.08 1.44 0.00 -1.93 -2.24 119.26 120.39 1v9j h ALA 32 Ca -0.38 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 1v9j h ALA 32 Cb 1.20 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1v9j h ALA 32 CO 0.55 0.21 -0.26 -0.44 0.00 0.00 0.00 179.25 179.31 1v9j h ASP 33 N 0.74 0.14 0.10 0.00 3.32 -1.96 -1.71 116.42 117.05 1v9j h ASP 33 Ca 0.20 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1v9j h ASP 33 Cb 0.02 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1v9j h ASP 33 CO -0.03 0.40 -0.05 0.22 -1.72 0.00 0.00 179.24 178.06 1v9j h TYR 34 N 0.13 -0.13 -0.06 4.55 3.20 -1.82 0.59 116.97 123.43 1v9j h TYR 34 Ca 0.02 -0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.79 1v9j h TYR 34 Cb 0.53 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.83 1v9j h TYR 34 CO 0.01 0.01 -0.41 -0.07 -1.64 0.00 0.00 178.16 176.05 1v9j h LEU 35 N -0.25 0.13 0.03 2.82 3.38 -1.36 -1.60 115.31 118.47 1v9j h LEU 35 Ca -0.01 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1v9j h LEU 35 Cb 0.20 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1v9j h LEU 35 CO 0.02 0.54 -0.02 -0.09 0.09 0.00 0.00 178.44 178.99 1v9j h ARG 36 N 0.11 -0.04 -0.89 1.13 2.43 -1.07 -2.67 114.38 113.38 1v9j h ARG 36 Ca 0.01 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1v9j h ARG 36 Cb 0.78 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.30 1v9j h ARG 36 CO 0.06 0.59 0.58 0.93 -1.51 0.00 0.00 179.97 180.63 1v9j h GLU 37 N -0.74 1.18 0.32 0.20 4.39 0.18 0.80 114.58 120.92 1v9j h GLU 37 Ca -0.00 -0.08 -0.02 0.00 0.34 0.00 0.00 59.36 59.60 1v9j h GLU 37 Cb 0.66 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 29.05 1v9j h GLU 37 CO 0.01 0.79 -0.15 -0.22 -1.16 0.00 0.00 179.01 178.27 1v9j h LYS 38 N 1.21 -0.42 -0.63 2.33 3.64 -1.37 0.44 116.57 121.78 1v9j h LYS 38 Ca 0.33 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.71 1v9j h LYS 38 Cb -0.13 0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 1v9j h LYS 38 CO -0.07 -0.27 0.30 -0.07 -2.27 0.00 0.00 179.45 177.07 1v9j h LEU 39 N -0.45 0.82 -0.36 5.20 3.38 -1.27 0.70 115.31 123.33 1v9j h LEU 39 Ca -0.04 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 57.80 1v9j h LEU 39 Cb 0.34 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1v9j h LEU 39 CO 0.07 0.72 0.24 -0.09 0.09 0.00 0.00 178.44 179.47 1v9j h ARG 40 N 0.86 0.47 -0.01 1.13 2.43 -0.68 0.47 114.38 119.05 1v9j h ARG 40 Ca 0.22 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.27 1v9j h ARG 40 Cb 0.12 -0.11 0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1v9j h ARG 40 CO -0.03 0.31 -0.32 1.96 -1.51 0.00 0.00 179.97 180.38 1v9j h GLN 41 N 0.48 0.24 -0.14 0.20 1.08 -0.71 0.84 115.11 117.11 1v9j h GLN 41 Ca 0.13 -0.24 0.01 0.00 -1.45 0.00 0.00 58.65 57.10 1v9j h GLN 41 Cb -0.05 0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.43 1v9j h GLN 41 CO -0.03 0.94 0.07 0.22 -0.95 0.00 0.00 178.83 179.08 1v9j h ASP 42 N -0.37 0.11 1.25 1.46 1.82 0.49 -2.85 116.42 118.33 1v9j h ASP 42 Ca -0.04 0.00 -0.11 0.00 -0.39 0.00 0.00 57.03 56.50 1v9j h ASP 42 Cb 1.05 -0.02 -0.02 0.00 0.68 0.00 0.00 39.33 41.02 1v9j h ASP 42 CO 0.06 0.08 -0.78 -0.07 -1.61 0.00 0.00 179.24 176.93 1v9j h LEU 43 N 0.15 0.00 -1.50 2.28 3.38 -0.16 -3.48 115.31 115.98 1v9j h LEU 43 Ca 0.06 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.76 1v9j h LEU 43 Cb 0.01 0.00 0.12 0.00 0.09 0.00 0.00 40.66 40.88 1v9j h LEU 43 CO -0.04 0.47 -0.57 -0.62 0.09 0.00 0.00 178.44 177.78 1v9j n GLU 44 N -3.09 -5.31 -1.04 1.13 1.02 0.29 -4.98 120.64 108.66 1v9j n GLU 44 Ca -0.01 0.64 -0.17 0.00 -0.02 0.00 0.00 57.16 57.59 1v9j n GLU 44 Cb 0.75 -5.06 0.13 0.00 -0.02 0.00 0.00 31.44 27.23 1v9j n GLU 44 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1v9j n ALA 45 N -3.66 -1.11 -0.11 0.62 0.00 -0.89 -4.93 120.51 110.43 1v9j n ALA 45 Ca -0.16 -1.02 -0.20 0.00 0.00 0.00 0.00 53.44 52.06 1v9j n ALA 45 Cb 0.61 -0.05 -0.08 0.00 0.00 0.00 0.00 19.45 19.92 1v9j n ALA 45 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1v9j n GLU 46 N -2.81 0.55 -4.12 0.00 -0.58 -0.84 -4.98 120.64 107.85 1v9j n GLU 46 Ca 0.10 0.36 -0.18 0.00 -0.42 0.00 0.00 57.16 57.02 1v9j n GLU 46 Cb 0.34 -1.56 -0.16 0.00 -0.57 0.00 0.00 31.44 29.49 1v9j n GLU 46 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 1v9j s HIS 47 N -2.53 0.58 0.10 -0.32 3.76 -1.05 -5.04 115.29 110.79 1v9j s HIS 47 Ca -0.31 -0.13 0.06 0.00 -0.15 0.00 0.00 55.06 54.53 1v9j s HIS 47 Cb 0.09 -0.51 -0.03 0.00 1.11 0.00 0.00 32.58 33.23 1v9j s HIS 47 CO 0.47 -0.12 -0.15 0.14 -0.85 0.00 0.00 174.74 174.22 1v9j s VAL 48 N 0.64 1.29 -0.04 -0.90 -7.23 -1.26 -1.39 120.40 111.52 1v9j s VAL 48 Ca -0.08 -1.54 -0.01 0.00 -1.81 0.00 0.00 61.98 58.54 1v9j s VAL 48 Cb -0.11 -1.36 0.03 0.00 0.56 0.00 0.00 36.38 35.50 1v9j s VAL 48 CO -0.00 -0.30 0.06 -1.61 -0.31 0.00 0.00 175.10 172.93 1v9j s GLU 49 N -2.23 -0.04 0.23 4.82 2.02 -0.64 -4.99 118.70 117.86 1v9j s GLU 49 Ca 0.04 0.30 0.09 0.00 0.02 0.00 0.00 54.97 55.43 1v9j s GLU 49 Cb -0.07 -0.35 -0.04 0.00 0.10 0.00 0.00 34.13 33.76 1v9j s GLU 49 CO 0.03 -0.24 -0.06 0.54 0.02 0.00 0.00 175.26 175.55 1v9j s VAL 50 N 1.59 3.28 0.14 2.63 0.11 -1.26 -0.94 120.40 125.95 1v9j s VAL 50 Ca -0.03 -1.82 -0.00 0.00 -2.93 0.00 0.00 61.98 57.20 1v9j s VAL 50 Cb -0.12 -2.69 -0.04 0.00 -1.53 0.00 0.00 36.38 31.99 1v9j s VAL 50 CO -0.03 -0.25 0.03 -0.70 -3.33 0.00 0.00 175.10 170.82 1v9j s GLU 51 N -3.27 0.97 -0.15 1.54 2.56 0.27 -4.96 118.70 115.66 1v9j s GLU 51 Ca 0.28 -1.46 -0.09 0.00 0.00 0.00 0.00 54.97 53.70 1v9j s GLU 51 Cb -0.07 0.07 0.05 0.00 2.00 0.00 0.00 34.13 36.18 1v9j s GLU 51 CO 0.17 -0.21 0.36 0.34 -0.56 0.00 0.00 175.26 175.36 1v9j s ASP 52 N -3.09 -0.43 0.00 -1.70 2.15 -1.26 -2.55 116.67 109.80 1v9j s ASP 52 Ca 0.23 0.77 0.00 0.00 0.43 0.00 0.00 52.55 53.98 1v9j s ASP 52 Cb 0.07 0.67 0.00 0.00 -0.30 0.00 0.00 42.92 43.36 1v9j s ASP 52 CO 0.02 -0.17 0.00 0.35 -0.17 0.00 0.00 175.17 175.20 1v9j n THR 53 N 4.01 0.00 -2.10 1.71 -2.24 -1.24 -5.06 114.28 109.36 1v9j n THR 53 Ca -0.22 0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 1v9j n THR 53 Cb 0.55 -1.31 0.00 0.00 -2.10 0.00 0.00 70.33 67.47 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 -2.11-12.90 -0.04 4.28 -1.04 -1.26 -4.86 114.28 96.36 1v9j n THR 54 Ca 0.00 3.14 -0.10 0.00 -2.04 0.00 0.00 64.05 65.05 1v9j n THR 54 Cb 0.00 -5.62 -0.04 0.00 -1.82 0.00 0.00 70.33 62.86 1v9j n THR 54 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1v9j h LEU 55 N 4.04 0.19 0.00 -4.42 3.38 -1.92 -3.45 115.31 113.14 1v9j h LEU 55 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1v9j h LEU 55 Cb 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1v9j h LEU 55 CO 0.00 0.14 0.00 0.59 0.09 0.00 0.00 178.44 179.26 1v9j n ASN 56 N -4.97 0.00 0.05 -0.43 3.02 -1.26 -5.07 115.26 106.60 1v9j n ASN 56 Ca -0.04 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.51 1v9j n ASN 56 Cb 0.03 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.20 1v9j n ASN 56 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1v9j n ARG 57 N -1.77 0.00 -1.77 3.52 3.00 -1.26 -5.04 116.66 113.33 1v9j n ARG 57 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 57.85 57.43 1v9j n ARG 57 Cb 0.00 -0.48 -0.01 0.00 0.00 0.00 0.00 32.46 31.97 1v9j n ARG 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1v9j s ALA 59 N -0.07 1.33 0.18 0.00 0.00 -1.26 -4.20 121.76 117.73 1v9j s ALA 59 Ca 0.63 0.42 0.00 0.00 0.00 0.00 0.00 51.96 53.00 1v9j s ALA 59 Cb -0.48 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.26 1v9j s ALA 59 CO 0.49 -2.75 0.00 0.25 0.00 0.00 0.00 175.76 173.75 1v9j n THR 60 N -4.21 0.00 -4.43 0.00 -2.24 -1.26 -4.92 114.28 97.22 1v9j n THR 60 Ca 0.10 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.66 1v9j n THR 60 Cb 0.53 -0.23 -0.10 0.00 -2.10 0.00 0.00 70.33 68.43 1v9j n THR 60 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1v9j s SER 61 N -4.10 3.22 -0.15 3.42 1.04 -1.26 -2.34 113.70 113.54 1v9j s SER 61 Ca 0.00 -1.04 -0.09 0.00 0.48 0.00 0.00 55.95 55.30 1v9j s SER 61 Cb 0.00 -0.24 0.05 0.00 0.10 0.00 0.00 66.02 65.93 1v9j s SER 61 CO 0.00 -0.05 0.36 -0.36 0.98 0.00 0.00 173.24 174.16 1v9j s PHE 62 N -2.69 -0.50 -0.14 5.02 0.08 -0.66 -3.64 117.98 115.46 1v9j s PHE 62 Ca 0.27 1.11 -0.06 0.00 0.12 0.00 0.00 56.93 58.38 1v9j s PHE 62 Cb -0.03 0.19 -0.04 0.00 -0.57 0.00 0.00 43.02 42.57 1v9j s PHE 62 CO 0.12 -0.29 0.07 1.03 -0.10 0.00 0.00 175.22 176.05 1v9j s ARG 63 N 1.20 3.55 -0.04 0.44 0.52 -1.06 -2.89 118.95 120.67 1v9j s ARG 63 Ca -0.08 -0.29 0.02 0.00 -0.52 0.00 0.00 55.73 54.87 1v9j s ARG 63 Cb -0.08 -3.10 0.01 0.00 0.52 0.00 0.00 34.95 32.30 1v9j s ARG 63 CO -0.10 0.55 -0.10 0.14 0.02 0.00 0.00 175.30 175.82 1v9j s VAL 64 N -0.42 0.87 -0.02 3.52 -7.23 -0.57 -0.57 120.40 115.98 1v9j s VAL 64 Ca 0.10 -0.37 0.03 0.00 -1.81 0.00 0.00 61.98 59.93 1v9j s VAL 64 Cb -0.12 -0.79 -0.00 0.00 0.56 0.00 0.00 36.38 36.02 1v9j s VAL 64 CO 0.02 0.28 -0.11 -0.22 -0.31 0.00 0.00 175.10 174.76 1v9j s LEU 65 N 0.44 1.91 -0.03 1.32 1.98 -0.12 -2.65 118.68 121.53 1v9j s LEU 65 Ca -0.08 -0.21 0.03 0.00 -2.89 0.00 0.00 54.13 50.98 1v9j s LEU 65 Cb -0.12 -0.61 0.00 0.00 0.66 0.00 0.00 46.19 46.13 1v9j s LEU 65 CO 0.01 0.11 -0.10 -0.69 -1.89 0.00 0.00 176.35 173.80 1v9j s VAL 66 N -0.04 0.84 -0.09 1.68 1.01 -1.10 -1.62 120.40 121.08 1v9j s VAL 66 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.60 1v9j s VAL 66 Cb -0.07 -0.75 0.02 0.00 0.00 0.00 0.00 36.38 35.58 1v9j s VAL 66 CO 0.00 0.26 -0.07 -0.69 0.00 0.00 0.00 175.10 174.61 1v9j s VAL 67 N 0.25 0.92 0.02 2.92 1.01 -0.49 -2.87 120.40 122.16 1v9j s VAL 67 Ca -0.04 -0.25 -0.26 0.00 0.00 0.00 0.00 61.98 61.42 1v9j s VAL 67 Cb -0.10 -0.94 0.09 0.00 0.00 0.00 0.00 36.38 35.44 1v9j s VAL 67 CO 0.01 0.34 1.21 -0.24 0.00 0.00 0.00 175.10 176.41 1v9j n SER 68 N 4.71 -1.29 0.00 3.32 2.88 -1.14 -1.99 113.62 120.10 1v9j n SER 68 Ca -0.14 -1.38 0.11 0.00 -1.33 0.00 0.00 58.87 56.12 1v9j n SER 68 Cb 0.50 2.03 -0.15 0.00 -0.75 0.00 0.00 64.21 65.84 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 -0.94 3.02 0.03 -1.46 0.00 -1.26 -4.06 120.51 115.84 1v9j n ALA 69 Ca -0.11 -0.51 0.19 0.00 0.00 0.00 0.00 53.44 53.01 1v9j n ALA 69 Cb 0.57 -0.78 0.69 0.00 0.00 0.00 0.00 19.45 19.92 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 0.00 -0.00 0.00 3.64 -1.93 0.10 116.57 118.37 1v9j h LYS 70 Ca 0.00 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.21 1v9j h LYS 70 Cb 0.94 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.74 1v9j h LYS 70 CO 0.00 0.00 -0.77 0.74 -2.27 0.00 0.00 179.45 177.15 1v9j h PHE 71 N 0.00 0.09 -0.18 1.91 0.04 -1.91 -3.14 116.94 113.75 1v9j h PHE 71 Ca 0.23 -0.05 0.02 0.00 2.80 0.00 0.00 57.97 60.97 1v9j h PHE 71 Cb 0.91 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 39.04 1v9j h PHE 71 CO 0.00 0.81 0.12 0.93 -0.60 0.00 0.00 178.31 179.57 1v9j h GLU 72 N 0.04 0.16 0.00 1.51 4.39 -1.02 -1.28 114.58 118.37 1v9j h GLU 72 Ca -0.02 -0.01 -0.09 0.00 0.34 0.00 0.00 59.36 59.59 1v9j h GLU 72 Cb 1.36 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.96 1v9j h GLU 72 CO 0.11 0.11 -0.41 0.78 -1.16 0.00 0.00 179.01 178.43 1v9j h GLY 73 N 0.17 0.00 -3.94 -3.84 0.00 -1.51 -3.44 103.07 90.51 1v9j h GLY 73 Ca 0.07 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.83 1v9j h GLY 73 CO -0.01 0.00 -0.55 0.54 0.00 0.00 0.00 176.54 176.52 1v9j s LYS 74 N -4.09 3.00 0.89 4.80 1.02 -0.48 -5.10 119.74 119.76 1v9j s LYS 74 Ca -0.03 -0.80 -0.10 0.00 0.02 0.00 0.00 55.97 55.06 1v9j s LYS 74 Cb 0.14 -2.71 0.13 0.00 -0.52 0.00 0.00 37.83 34.87 1v9j s LYS 74 CO 0.73 0.50 1.13 -1.25 -0.92 0.00 0.00 175.35 175.54 1v9j s PRO 75 N -3.03 1.24 0.35 -1.68 0.04 -1.26 -4.79 135.00 125.86 1v9j s PRO 75 Ca 0.31 1.42 0.05 0.00 0.04 0.00 0.00 61.00 62.82 1v9j s PRO 75 Cb -0.10 -1.76 0.70 0.00 0.04 0.00 0.00 34.50 33.37 1v9j s PRO 75 CO 0.24 -2.43 1.96 1.25 0.04 0.00 0.00 177.00 178.05 1v9j h LEU 76 N -1.72 0.71 -1.28 -3.56 6.46 -1.96 -0.91 115.31 113.04 1v9j h LEU 76 Ca -0.44 0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.27 1v9j h LEU 76 Cb 1.26 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 41.02 1v9j h LEU 76 CO 0.44 0.46 -0.05 0.17 -0.62 0.00 0.00 178.44 178.85 1v9j h LEU 77 N 0.81 0.40 -0.50 2.25 -0.00 -2.00 -2.38 115.31 113.89 1v9j h LEU 77 Ca 0.31 -0.08 -0.16 0.00 -0.00 0.00 0.00 57.88 57.96 1v9j h LEU 77 Cb 0.21 -0.10 -0.02 0.00 -0.00 0.00 0.00 40.66 40.74 1v9j h LEU 77 CO -0.10 0.50 -0.75 1.56 -0.00 0.00 0.00 178.44 179.65 1v9j h GLN 78 N 0.41 0.01 0.62 0.17 4.20 -1.53 -2.75 115.11 116.23 1v9j h GLN 78 Ca 0.09 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.76 1v9j h GLN 78 Cb 0.35 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.13 1v9j h GLN 78 CO 0.02 0.75 -0.35 0.00 -0.67 0.00 0.00 178.83 178.58 1v9j h ARG 79 N 0.00 -0.87 -0.40 1.46 3.08 -0.85 0.30 114.38 117.10 1v9j h ARG 79 Ca -0.01 0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 1v9j h ARG 79 Cb 1.33 0.20 -0.02 0.00 0.08 0.00 0.00 29.97 31.56 1v9j h ARG 79 CO 0.10 -0.58 0.13 0.45 -1.07 0.00 0.00 179.97 179.00 1v9j h HIS 80 N -0.90 0.65 -0.93 3.04 3.86 -1.63 -2.68 115.15 116.56 1v9j h HIS 80 Ca -0.08 -0.06 0.02 0.00 -1.16 0.00 0.00 60.37 59.08 1v9j h HIS 80 Cb 0.72 -0.19 -0.05 0.00 1.06 0.00 0.00 27.41 28.95 1v9j h HIS 80 CO -0.07 0.60 0.61 -0.09 0.86 0.00 0.00 177.93 179.84 1v9j h ARG 81 N 0.51 1.20 -0.33 2.45 2.43 -1.40 -2.33 114.38 116.90 1v9j h ARG 81 Ca 0.13 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1v9j h ARG 81 Cb 0.26 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1v9j h ARG 81 CO -0.00 0.79 0.21 -0.07 -1.51 0.00 0.00 179.97 179.39 1v9j h LEU 82 N 1.23 0.39 -1.00 3.80 3.38 -0.15 -1.94 115.31 121.03 1v9j h LEU 82 Ca 0.35 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.30 1v9j h LEU 82 Cb -0.11 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.49 1v9j h LEU 82 CO -0.08 0.31 0.66 0.58 0.09 0.00 0.00 178.44 179.99 1v9j h VAL 83 N 0.43 1.22 -0.08 1.22 2.07 -1.13 -1.59 116.25 118.39 1v9j h VAL 83 Ca 0.12 -0.45 -0.06 0.00 0.82 0.00 0.00 66.70 67.13 1v9j h VAL 83 Cb -0.02 -0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 29.54 1v9j h VAL 83 CO -0.02 0.24 -0.23 0.78 0.02 0.00 0.00 177.57 178.35 1v9j h ASN 84 N 1.31 0.13 -0.34 0.57 2.35 -1.05 -2.61 115.58 115.94 1v9j h ASN 84 Ca 0.38 -0.03 -0.10 0.00 -0.55 0.00 0.00 56.30 56.00 1v9j h ASN 84 Cb -0.09 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 1v9j h ASN 84 CO -0.10 0.37 -0.13 -0.33 -1.65 0.00 0.00 177.43 175.59 1v9j h GLU 85 N 0.12 0.78 0.95 0.81 5.08 -0.52 0.52 114.58 122.32 1v9j h GLU 85 Ca 0.02 -0.27 -0.05 0.00 -1.00 0.00 0.00 59.36 58.06 1v9j h GLU 85 Cb 0.49 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.69 1v9j h GLU 85 CO 0.03 0.88 -0.46 0.00 -1.00 0.00 0.00 179.01 178.47 1v9j n LEU 87 N -5.59 7.24 -0.02 0.00 4.77 -1.17 -4.69 117.00 117.53 1v9j n LEU 87 Ca -0.16 -4.60 -0.12 0.00 -0.03 0.00 0.00 56.01 51.10 1v9j n LEU 87 Cb 0.50 -0.93 -0.06 0.00 -2.33 0.00 0.00 43.42 40.60 1v9j n LEU 87 CO 0.38 1.68 0.81 0.00 -1.33 0.00 0.00 177.39 178.94 1v9j h ALA 88 N 2.45 0.12 -0.02 -1.18 0.00 -0.88 0.52 119.26 120.27 1v9j h ALA 88 Ca 0.56 -0.11 -0.20 0.00 0.00 0.00 0.00 54.91 55.16 1v9j h ALA 88 Cb 0.56 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1v9j h ALA 88 CO 1.42 -0.27 -0.84 0.93 0.00 0.00 0.00 179.25 180.49 1v9j h GLU 89 N -0.02 0.32 0.00 0.00 5.08 -1.85 -3.22 114.58 114.90 1v9j h GLU 89 Ca 0.03 -0.31 -0.16 0.00 -1.00 0.00 0.00 59.36 57.92 1v9j h GLU 89 Cb 0.20 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 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 0.20 0.00 -0.07 2.33 3.07 -1.87 -3.33 114.58 114.90 1v9j h GLU 90 Ca -0.05 0.00 0.03 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 0.00 179.01 177.98 1v9j h LEU 91 N 0.00 -1.42 -1.78 1.33 3.38 0.05 -0.95 115.31 115.93 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 0.56 -0.08 0.00 0.09 0.00 0.00 40.66 42.57 1v9j h LEU 91 CO 0.10 -0.46 0.97 -0.65 0.09 0.00 0.00 178.44 178.48 1v9j h PRO 92 N -0.56 0.07 -0.01 1.13 0.11 -1.70 0.97 132.00 132.02 1v9j h PRO 92 Ca 0.05 -0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.98 1v9j h PRO 92 Cb 0.66 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.74 1v9j h PRO 92 CO -0.38 0.05 -0.79 0.45 -0.21 0.00 0.00 178.00 177.12 1v9j h HIS 93 N 0.08 0.20 -3.00 0.65 3.86 -1.37 -3.43 115.15 112.14 1v9j h HIS 93 Ca 0.72 -0.10 -0.57 0.00 -1.16 0.00 0.00 60.37 59.26 1v9j h HIS 93 Cb 2.59 -0.03 -0.04 0.00 1.06 0.00 0.00 27.41 30.99 1v9j h HIS 93 CO -0.00 0.87 0.97 0.42 0.86 0.00 0.00 177.93 181.05 1v9j s ILE 94 N -3.33 4.11 0.41 2.45 -1.09 0.34 -4.89 121.20 119.19 1v9j s ILE 94 Ca -0.02 1.29 0.07 0.00 -2.23 0.00 0.00 60.65 59.76 1v9j s ILE 94 Cb 0.11 -4.03 0.25 0.00 -1.58 0.00 0.00 42.46 37.21 1v9j s ILE 94 CO 0.81 -0.33 2.04 -0.74 -1.23 0.00 0.00 174.94 175.49 1v9j h HIS 95 N 9.14 0.48 -2.38 3.97 -0.00 -1.71 -3.41 115.15 121.25 1v9j h HIS 95 Ca -0.28 0.00 -0.14 0.00 -0.00 0.00 0.00 60.37 59.96 1v9j h HIS 95 Cb 1.11 -0.16 -0.29 0.00 -0.00 0.00 0.00 27.41 28.06 1v9j h HIS 95 CO 0.86 0.33 -0.44 0.00 -0.00 0.00 0.00 177.93 178.68 1v9j s ALA 96 N -5.39 -1.00 0.02 5.26 0.00 -0.99 -4.99 121.76 114.66 1v9j s ALA 96 Ca -0.08 1.17 0.08 0.00 0.00 0.00 0.00 51.96 53.13 1v9j s ALA 96 Cb 0.17 -1.38 -0.02 0.00 0.00 0.00 0.00 23.12 21.89 1v9j s ALA 96 CO 0.73 -0.91 -0.23 0.12 0.00 0.00 0.00 175.76 175.47 1v9j s PHE 97 N 2.55 2.07 -0.08 0.00 5.36 -1.26 -1.65 117.98 124.97 1v9j s PHE 97 Ca 0.04 -0.39 -0.03 0.00 -0.96 0.00 0.00 56.93 55.58 1v9j s PHE 97 Cb -0.13 -1.28 0.05 0.00 -0.34 0.00 0.00 43.02 41.31 1v9j s PHE 97 CO -0.13 0.04 0.16 -2.00 -1.46 0.00 0.00 175.22 171.83 1v9j s GLU 98 N -0.91 0.03 0.11 10.12 2.12 -1.14 -5.01 118.70 124.02 1v9j s GLU 98 Ca 0.09 0.56 0.09 0.00 0.36 0.00 0.00 54.97 56.07 1v9j s GLU 98 Cb -0.09 -0.29 -0.04 0.00 0.26 0.00 0.00 34.13 33.98 1v9j s GLU 98 CO 0.01 -0.31 -0.23 1.14 -0.54 0.00 0.00 175.26 175.33 1v9j s GLN 99 N 2.29 1.23 -0.01 4.30 1.03 -1.26 -1.51 119.66 125.73 1v9j s GLN 99 Ca 0.03 -1.21 -0.04 0.00 0.04 0.00 0.00 55.36 54.18 1v9j s GLN 99 Cb -0.12 -1.57 0.00 0.00 0.03 0.00 0.00 33.01 31.35 1v9j s GLN 99 CO -0.06 0.37 0.08 0.21 -2.54 0.00 0.00 175.29 173.35 1v9j s LYS 100 N -1.92 0.27 -0.06 9.60 2.20 -1.08 -5.02 119.74 123.73 1v9j s LYS 100 Ca 0.09 -0.20 0.04 0.00 -0.36 0.00 0.00 55.97 55.54 1v9j s LYS 100 Cb -0.10 0.11 -0.00 0.00 -1.51 0.00 0.00 37.83 36.33 1v9j s LYS 100 CO 0.05 -0.05 -0.19 0.95 -0.36 0.00 0.00 175.35 175.74 1v9j s THR 101 N -0.73 1.60 0.10 3.43 -4.23 -1.26 -2.70 115.64 111.85 1v9j s THR 101 Ca -0.08 -0.79 -0.12 0.00 -1.18 0.00 0.00 61.69 59.52 1v9j s THR 101 Cb -0.05 -1.39 0.01 0.00 1.34 0.00 0.00 72.50 72.42 1v9j s THR 101 CO 0.00 0.46 0.28 -0.76 -0.54 0.00 0.00 174.62 174.06 1v9j s LEU 102 N 0.17 0.98 0.63 4.79 1.43 -1.14 -5.05 118.68 120.50 1v9j s LEU 102 Ca -0.09 -0.50 -0.11 0.00 -1.03 0.00 0.00 54.13 52.41 1v9j s LEU 102 Cb -0.14 1.38 -0.02 0.00 0.03 0.00 0.00 46.19 47.44 1v9j s LEU 102 CO 0.04 -0.78 1.03 0.42 0.23 0.00 0.00 176.35 177.29 1v9j s THR 103 N -3.80 4.39 0.13 5.49 -4.23 -1.26 -2.90 115.64 113.46 1v9j s THR 103 Ca 0.04 0.72 -0.12 0.00 -1.18 0.00 0.00 61.69 61.15 1v9j s THR 103 Cb 0.03 -3.76 -0.05 0.00 1.34 0.00 0.00 72.50 70.07 1v9j s THR 103 CO -0.11 -0.99 1.47 1.55 -0.54 0.00 0.00 174.62 176.00 1v9j h PRO 104 N -0.37 0.88 -0.48 3.99 0.13 -1.88 -2.23 132.00 132.03 1v9j h PRO 104 Ca -0.44 -0.44 0.00 0.00 -0.87 0.00 0.00 66.00 64.24 1v9j h PRO 104 Cb 1.21 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 1v9j h PRO 104 CO 0.62 1.09 0.30 1.49 -0.23 0.00 0.00 178.00 181.27 1v9j h GLU 105 N 0.69 0.64 0.03 0.86 4.22 -1.94 0.20 114.58 119.27 1v9j h GLU 105 Ca 0.07 -0.04 -0.00 0.00 0.08 0.00 0.00 59.36 59.46 1v9j h GLU 105 Cb 0.90 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1v9j h GLU 105 CO 0.08 0.43 -0.01 1.96 -2.18 0.00 0.00 179.01 179.29 1v9j h GLN 106 N 0.65 -0.04 0.07 1.92 4.20 -1.94 -2.63 115.11 117.35 1v9j h GLN 106 Ca 0.17 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.88 1v9j h GLN 106 Cb -0.05 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.74 1v9j h GLN 106 CO -0.04 0.64 -0.03 2.35 -0.67 0.00 0.00 178.83 181.08 1v9j h TRP 107 N -0.77 -0.08 -0.18 2.96 2.91 -1.21 0.27 115.95 119.85 1v9j h TRP 107 Ca -0.00 -0.00 0.04 0.00 1.13 0.00 0.00 58.89 60.06 1v9j h TRP 107 Cb 0.69 0.03 -0.01 0.00 -0.51 0.00 0.00 29.16 29.36 1v9j h TRP 107 CO 0.17 -0.03 0.12 1.15 -1.03 0.00 0.00 178.44 178.82 1v9j h THR 108 N -0.11 0.94 0.03 2.65 2.02 -0.72 0.13 112.91 117.84 1v9j h THR 108 Ca -0.01 -0.02 -0.24 0.00 0.77 0.00 0.00 66.41 66.91 1v9j h THR 108 Cb 0.09 0.89 -0.03 0.00 -1.74 0.00 0.00 68.15 67.36 1v9j h THR 108 CO 0.02 0.01 -1.22 0.03 0.37 0.00 0.00 175.52 174.72 1v9j h ARG 109 N 0.05 0.06 -1.02 6.66 3.08 -1.01 -3.33 114.38 118.87 1v9j h ARG 109 Ca 0.08 -0.10 -0.62 0.00 0.07 0.00 0.00 59.98 59.41 1v9j h ARG 109 Cb 0.27 0.04 -0.36 0.00 0.08 0.00 0.00 29.97 30.00 1v9j h ARG 109 CO -0.01 0.95 0.01 1.04 -1.07 0.00 0.00 179.97 180.89 1v9j n GLN 110 N -3.33 3.17 -2.43 0.04 3.00 0.90 -4.64 117.38 114.09 1v9j n GLN 110 Ca -0.06 -3.80 -0.41 0.00 -0.01 0.00 0.00 57.00 52.72 1v9j n GLN 110 Cb 0.98 -2.28 0.01 0.00 0.00 0.00 0.00 30.24 28.95 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 -0.76 4.56 -2.65 -1.09 5.12 -0.09 -4.64 116.66 117.12 1v9j n ARG 111 Ca 0.52 -3.99 -0.21 0.00 -1.93 0.00 0.00 57.85 52.24 1v9j n ARG 111 Cb 0.76 -2.63 0.01 0.00 -1.16 0.00 0.00 32.46 29.43 1v9j n ARG 111 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 1v9j n ARG 112 N 1.69 -2.89 -0.52 5.56 0.63 -1.26 -5.08 116.66 114.80 1v9j n ARG 112 Ca 0.46 0.93 0.00 0.00 -0.92 0.00 0.00 57.85 58.32 1v9j n ARG 112 Cb 0.29 -5.66 0.00 0.00 0.45 0.00 0.00 32.46 27.54 1v9j n ARG 112 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51