#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 -2.87 0.00 3.17 3.00 -1.26 -5.00 118.16 115.21 1v9j n LYS 2 Ca 0.00 2.42 0.00 0.00 -0.00 0.00 0.00 58.31 60.73 1v9j n LYS 2 Cb 0.00 -5.57 0.00 0.00 0.00 0.00 0.00 35.03 29.46 1v9j n LYS 2 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1v9j n GLY 3 N 0.12 -1.18 3.62 3.14 0.00 -1.26 -5.09 105.19 104.54 1v9j n GLY 3 Ca 0.07 0.58 -0.43 0.00 0.00 0.00 0.00 46.02 46.24 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 2.00 5.76 -1.19 1.61 0.01 -1.26 -4.90 113.70 115.73 1v9j s SER 4 Ca 0.00 2.12 -0.13 0.00 1.31 0.00 0.00 55.95 59.25 1v9j s SER 4 Cb 0.00 -2.52 0.20 0.00 0.21 0.00 0.00 66.02 63.91 1v9j s SER 4 CO 0.00 -1.69 1.36 -1.20 0.41 0.00 0.00 173.24 172.13 1v9j n SER 5 N 10.43 5.30 -0.06 2.44 7.64 -1.26 -4.62 113.62 133.49 1v9j n SER 5 Ca 0.27 -2.99 -0.07 0.00 1.01 0.00 0.00 58.87 57.08 1v9j n SER 5 Cb 0.44 -1.52 -0.08 0.00 -1.01 0.00 0.00 64.21 62.03 1v9j n SER 5 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1v9j n HIS 6 N 4.90 0.00 -3.76 1.43 8.25 -1.26 -4.96 115.22 119.83 1v9j n HIS 6 Ca 0.34 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.55 1v9j n HIS 6 Cb 0.42 -0.57 -0.17 0.00 1.12 0.00 0.00 29.99 30.78 1v9j n HIS 6 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1v9j s HIS 7 N -2.29 0.76 -0.11 4.41 0.09 -1.26 -5.13 115.29 111.77 1v9j s HIS 7 Ca -0.10 -0.37 -0.03 0.00 -0.00 0.00 0.00 55.06 54.56 1v9j s HIS 7 Cb 0.04 -0.87 -0.03 0.00 -0.00 0.00 0.00 32.58 31.72 1v9j s HIS 7 CO 0.43 -0.42 0.01 -1.01 -0.00 0.00 0.00 174.74 173.75 1v9j s HIS 8 N 1.94 3.17 -0.14 1.40 0.09 -1.26 -5.10 115.29 115.38 1v9j s HIS 8 Ca 0.03 0.13 -0.08 0.00 -0.00 0.00 0.00 55.06 55.14 1v9j s HIS 8 Cb -0.14 -1.85 0.05 0.00 -0.00 0.00 0.00 32.58 30.65 1v9j s HIS 8 CO -0.06 0.38 0.35 -1.01 -0.00 0.00 0.00 174.74 174.40 1v9j s HIS 9 N -0.59 -0.49 0.00 1.40 3.76 -1.26 -5.03 115.29 113.08 1v9j s HIS 9 Ca 0.10 1.09 0.00 0.00 -0.15 0.00 0.00 55.06 56.10 1v9j s HIS 9 Cb -0.12 0.18 0.00 0.00 1.11 0.00 0.00 32.58 33.75 1v9j s HIS 9 CO 0.02 -0.29 0.00 1.58 -0.85 0.00 0.00 174.74 175.20 1v9j n HIS 10 N 4.08 -0.45 -3.77 1.40 -0.00 -1.26 -5.15 115.22 110.07 1v9j n HIS 10 Ca -0.23 0.00 -0.10 0.00 0.46 0.00 0.00 57.72 57.86 1v9j n HIS 10 Cb 0.55 0.39 -0.06 0.00 -0.12 0.00 0.00 29.99 30.75 1v9j n HIS 10 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 1v9j s HIS 11 N -1.77 0.02 -0.09 1.57 2.46 -1.26 -5.16 115.29 111.07 1v9j s HIS 11 Ca 0.00 -0.39 -0.01 0.00 0.47 0.00 0.00 55.06 55.13 1v9j s HIS 11 Cb 0.00 0.11 0.03 0.00 -0.13 0.00 0.00 32.58 32.58 1v9j s HIS 11 CO 0.00 -0.67 -0.02 0.45 -2.47 0.00 0.00 174.74 172.03 1v9j s SER 12 N -2.86 1.80 0.00 9.88 0.15 -1.26 -4.97 113.70 116.44 1v9j s SER 12 Ca 0.06 -0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.55 1v9j s SER 12 Cb 0.03 -0.56 0.00 0.00 -1.71 0.00 0.00 66.02 63.77 1v9j s SER 12 CO -0.09 -0.17 0.00 -1.54 1.20 0.00 0.00 173.24 172.64 1v9j n SER 13 N 5.08 0.05 -4.05 5.45 3.41 -1.26 -5.12 113.62 117.18 1v9j n SER 13 Ca -0.09 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.39 1v9j n SER 13 Cb 0.50 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.33 1v9j n SER 13 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1v9j s GLY 14 N -4.51 0.48 0.31 5.00 0.00 -1.26 -5.05 107.32 102.29 1v9j s GLY 14 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 44.00 1v9j s GLY 14 CO 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 173.10 172.34 1v9j n ALA 15 N 1.59 2.09 -3.39 3.20 0.00 -1.26 -5.11 120.51 117.62 1v9j n ALA 15 Ca -0.22 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.20 1v9j n ALA 15 Cb 0.55 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.95 1v9j n ALA 15 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1v9j s SER 16 N -3.95 -0.74 -0.03 0.00 0.01 -1.26 -5.16 113.70 102.57 1v9j s SER 16 Ca 0.00 0.88 0.06 0.00 1.31 0.00 0.00 55.95 58.20 1v9j s SER 16 Cb 0.00 1.80 -0.01 0.00 0.21 0.00 0.00 66.02 68.02 1v9j s SER 16 CO 0.00 -0.26 -0.21 -0.22 0.41 0.00 0.00 173.24 172.96 1v9j s LEU 17 N 2.75 2.01 -0.47 2.44 2.96 -1.26 -5.10 118.68 122.01 1v9j s LEU 17 Ca 0.09 -0.40 0.03 0.00 -0.22 0.00 0.00 54.13 53.63 1v9j s LEU 17 Cb -0.14 -1.12 0.14 0.00 0.50 0.00 0.00 46.19 45.57 1v9j s LEU 17 CO -0.18 0.23 0.27 -0.69 -1.32 0.00 0.00 176.35 174.66 1v9j s VAL 18 N -0.30 1.67 1.12 1.68 1.01 -1.26 -5.12 120.40 119.20 1v9j s VAL 18 Ca 0.03 -2.83 -0.19 0.00 0.00 0.00 0.00 61.98 58.98 1v9j s VAL 18 Cb -0.10 -2.16 0.09 0.00 0.00 0.00 0.00 36.38 34.21 1v9j s VAL 18 CO 0.01 -0.91 -0.10 -2.65 0.00 0.00 0.00 175.10 171.45 1v9j n PRO 19 N 3.30 -1.56 0.08 2.72 -0.02 -1.26 -4.97 135.00 133.29 1v9j n PRO 19 Ca 0.10 -0.44 -0.04 0.00 -2.02 0.00 0.00 63.50 61.10 1v9j n PRO 19 Cb 0.35 -1.65 -0.02 0.00 -0.02 0.00 0.00 33.50 32.16 1v9j n PRO 19 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1v9j h ARG 20 N -2.03 -0.26 -7.32 -0.52 2.43 -2.09 -3.46 114.38 101.13 1v9j h ARG 20 Ca -0.53 0.02 -0.48 0.00 -0.81 0.00 0.00 59.98 58.18 1v9j h ARG 20 Cb 1.36 0.06 0.15 0.00 -0.42 0.00 0.00 29.97 31.12 1v9j h ARG 20 CO 0.37 -0.17 0.24 0.20 -1.51 0.00 0.00 179.97 179.10 1v9j s GLY 21 N -2.63 1.62 0.06 2.80 0.00 -1.26 -5.07 107.32 102.83 1v9j s GLY 21 Ca -0.04 -0.03 -0.12 0.00 0.00 0.00 0.00 44.72 44.53 1v9j s GLY 21 CO 0.12 0.46 0.28 -0.45 0.00 0.00 0.00 173.10 173.51 1v9j s SER 22 N -3.35 -0.07 -0.42 1.64 0.15 -1.26 -5.12 113.70 105.26 1v9j s SER 22 Ca 0.64 -0.32 0.05 0.00 0.70 0.00 0.00 55.95 57.01 1v9j s SER 22 Cb -0.18 0.36 0.17 0.00 -1.71 0.00 0.00 66.02 64.66 1v9j s SER 22 CO 0.57 -0.66 0.48 -1.61 1.20 0.00 0.00 173.24 173.22 1v9j s GLU 23 N -2.97 0.84 -0.02 5.44 2.02 -1.26 -4.95 118.70 117.79 1v9j s GLU 23 Ca -0.02 -1.23 0.01 0.00 0.02 0.00 0.00 54.97 53.75 1v9j s GLU 23 Cb 0.01 -0.68 0.03 0.00 0.10 0.00 0.00 34.13 33.58 1v9j s GLU 23 CO -0.06 -1.29 0.72 0.41 0.02 0.00 0.00 175.26 175.06 1v9j n GLY 24 N 3.51 0.25 3.65 -1.39 0.00 -1.26 -5.13 105.19 104.82 1v9j n GLY 24 Ca 0.18 -0.01 -0.02 0.00 0.00 0.00 0.00 46.02 46.17 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 0.01 -2.34 0.00 4.61 0.00 -1.26 -5.06 121.76 117.72 1v9j s ALA 25 Ca 0.01 1.90 0.20 0.00 0.00 0.00 0.00 51.96 54.07 1v9j s ALA 25 Cb 0.03 -1.79 0.33 0.00 0.00 0.00 0.00 23.12 21.69 1v9j s ALA 25 CO -0.01 -0.24 1.12 0.00 0.00 0.00 0.00 175.76 176.64 1v9j n ALA 26 N 2.56 2.37 0.18 0.00 0.00 -1.26 -4.79 120.51 119.56 1v9j n ALA 26 Ca -0.14 -2.00 0.11 0.00 0.00 0.00 0.00 53.44 51.41 1v9j n ALA 26 Cb 0.57 -0.67 0.64 0.00 0.00 0.00 0.00 19.45 19.99 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 6.86 0.93 0.00 0.00 1.35 -2.00 -2.92 112.91 117.14 1v9j h THR 27 Ca -0.21 -0.01 -0.12 0.00 -0.55 0.00 0.00 66.41 65.52 1v9j h THR 27 Cb 1.78 0.90 -0.02 0.00 -1.73 0.00 0.00 68.15 69.07 1v9j h THR 27 CO 0.06 0.01 -1.62 0.23 -0.25 0.00 0.00 175.52 173.95 1v9j n MET 28 N -4.50 1.74 -2.30 4.72 2.81 -1.26 -4.90 117.12 113.43 1v9j n MET 28 Ca 0.01 -0.03 -0.40 0.00 -1.81 0.00 0.00 57.70 55.47 1v9j n MET 28 Cb 0.23 -1.25 -0.03 0.00 -0.71 0.00 0.00 33.22 31.45 1v9j n MET 28 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1v9j s GLU 29 N -2.40 2.91 0.54 0.03 2.56 -1.10 -4.96 118.70 116.28 1v9j s GLU 29 Ca -0.05 0.17 -0.18 0.00 0.00 0.00 0.00 54.97 54.92 1v9j s GLU 29 Cb 0.04 -4.29 -0.12 0.00 2.00 0.00 0.00 34.13 31.76 1v9j s GLU 29 CO 0.42 -2.44 0.15 1.28 -0.56 0.00 0.00 175.26 174.10 1v9j n LEU 30 N 11.06 -1.78 -3.85 2.70 7.99 -1.26 -4.81 117.00 127.05 1v9j n LEU 30 Ca 0.12 0.68 -0.12 0.00 -0.01 0.00 0.00 56.01 56.68 1v9j n LEU 30 Cb 0.51 -0.99 -0.11 0.00 -0.11 0.00 0.00 43.42 42.72 1v9j n LEU 30 CO 0.71 -4.06 -0.18 -0.44 -1.51 0.00 0.00 177.39 171.92 1v9j s SER 31 N -1.08 -0.06 0.08 -1.43 0.01 -1.26 -5.06 113.70 104.90 1v9j s SER 31 Ca 0.62 0.04 -0.19 0.00 1.31 0.00 0.00 55.95 57.72 1v9j s SER 31 Cb -0.47 0.26 -0.08 0.00 0.21 0.00 0.00 66.02 65.94 1v9j s SER 31 CO 0.61 -0.23 1.53 0.00 0.41 0.00 0.00 173.24 175.57 1v9j h ALA 32 N 5.01 0.32 -0.12 1.44 0.00 -1.95 -2.84 119.26 121.12 1v9j h ALA 32 Ca -0.28 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 1v9j h ALA 32 Cb 1.20 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1v9j h ALA 32 CO 0.40 0.03 -0.07 -0.44 0.00 0.00 0.00 179.25 179.18 1v9j h ASP 33 N 0.20 0.16 -0.38 0.00 5.19 -1.97 -1.69 116.42 117.94 1v9j h ASP 33 Ca 0.07 -0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.45 1v9j h ASP 33 Cb 0.38 -0.04 -0.02 0.00 0.18 0.00 0.00 39.33 39.83 1v9j h ASP 33 CO 0.01 0.26 0.22 0.22 -3.12 0.00 0.00 179.24 176.83 1v9j h TYR 34 N 0.18 0.50 -0.02 4.55 3.20 -1.92 -0.06 116.97 123.39 1v9j h TYR 34 Ca 0.04 -0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.76 1v9j h TYR 34 Cb 0.24 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.33 1v9j h TYR 34 CO 0.00 0.36 -0.67 -0.07 -1.64 0.00 0.00 178.16 176.15 1v9j h LEU 35 N 0.49 0.11 0.65 2.82 3.38 -1.34 -2.11 115.31 119.31 1v9j h LEU 35 Ca 0.13 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1v9j h LEU 35 Cb 0.01 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 40.73 1v9j h LEU 35 CO -0.02 0.74 -0.31 -0.09 0.09 0.00 0.00 178.44 178.85 1v9j h ARG 36 N 0.06 -0.84 -0.29 1.13 2.43 -0.93 -1.35 114.38 114.59 1v9j h ARG 36 Ca -0.01 0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1v9j h ARG 36 Cb 1.19 0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.91 1v9j h ARG 36 CO 0.09 -0.56 0.17 0.93 -1.51 0.00 0.00 179.97 179.09 1v9j h GLU 37 N -1.23 0.38 0.76 0.20 5.08 -1.11 -0.53 114.58 118.12 1v9j h GLU 37 Ca -0.09 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.20 1v9j h GLU 37 Cb 0.67 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.85 1v9j h GLU 37 CO 0.15 0.28 -0.36 -0.22 -1.00 0.00 0.00 179.01 177.85 1v9j h LYS 38 N 0.39 -0.98 -0.19 2.33 3.64 -1.37 -2.52 116.57 117.87 1v9j h LYS 38 Ca 0.10 0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.57 1v9j h LYS 38 Cb -0.01 0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 1v9j h LYS 38 CO -0.02 -0.65 0.13 -0.07 -2.27 0.00 0.00 179.45 176.57 1v9j h LEU 39 N -1.27 0.15 0.89 5.20 3.38 -1.11 0.51 115.31 123.06 1v9j h LEU 39 Ca -0.10 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1v9j h LEU 39 Cb 0.78 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.50 1v9j h LEU 39 CO 0.17 0.11 -0.45 -0.09 0.09 0.00 0.00 178.44 178.27 1v9j h ARG 40 N 0.18 -1.19 -0.04 1.13 2.43 -1.02 0.18 114.38 116.05 1v9j h ARG 40 Ca 0.08 0.08 -0.25 0.00 -0.81 0.00 0.00 59.98 59.08 1v9j h ARG 40 Cb 0.09 0.27 0.02 0.00 -0.42 0.00 0.00 29.97 29.92 1v9j h ARG 40 CO -0.01 -0.79 -0.96 -0.56 -1.51 0.00 0.00 179.97 176.14 1v9j h GLN 41 N -1.23 0.68 0.92 0.20 3.07 -1.23 0.44 115.11 117.96 1v9j h GLN 41 Ca -0.12 -0.68 -0.04 0.00 0.09 0.00 0.00 58.65 57.90 1v9j h GLN 41 Cb 0.95 0.18 0.00 0.00 0.08 0.00 0.00 27.48 28.70 1v9j h GLN 41 CO 0.18 1.27 -0.49 0.22 0.09 0.00 0.00 178.83 180.10 1v9j h ASP 42 N 0.41 -1.20 1.82 0.06 1.82 -0.00 -3.01 116.42 116.31 1v9j h ASP 42 Ca -0.10 0.05 0.00 0.00 -0.39 0.00 0.00 57.03 56.59 1v9j h ASP 42 Cb 1.60 0.33 0.00 0.00 0.68 0.00 0.00 39.33 41.94 1v9j h ASP 42 CO 0.19 -0.80 0.00 -0.07 -1.61 0.00 0.00 179.24 176.95 1v9j h LEU 43 N -1.30 0.00 -2.43 2.28 3.38 -0.76 -3.49 115.31 112.98 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 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1v9j h LEU 43 CO 0.18 0.00 -0.29 -0.62 0.09 0.00 0.00 178.44 177.80 1v9j n GLU 44 N -2.82 -1.69 -4.13 1.13 1.02 0.15 -4.97 120.64 109.33 1v9j n GLU 44 Ca 0.05 1.68 -0.26 0.00 -0.02 0.00 0.00 57.16 58.60 1v9j n GLU 44 Cb 0.50 -4.94 -0.05 0.00 -0.02 0.00 0.00 31.44 26.93 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 -2.52 4.00 -0.20 0.62 0.00 -0.61 -4.79 121.76 118.27 1v9j s ALA 45 Ca 0.14 -1.49 -0.20 0.00 0.00 0.00 0.00 51.96 50.42 1v9j s ALA 45 Cb -0.04 -0.46 -0.16 0.00 0.00 0.00 0.00 23.12 22.45 1v9j s ALA 45 CO 0.62 -0.24 0.15 0.93 0.00 0.00 0.00 175.76 177.22 1v9j h GLU 46 N 1.15 0.00 -3.74 0.00 4.39 -1.81 -3.47 114.58 111.10 1v9j h GLU 46 Ca -0.41 0.00 -0.44 0.00 0.34 0.00 0.00 59.36 58.85 1v9j h GLU 46 Cb 1.28 0.00 -0.38 0.00 -0.10 0.00 0.00 28.75 29.55 1v9j h GLU 46 CO 0.66 0.84 -0.77 -1.01 -1.16 0.00 0.00 179.01 177.56 1v9j s HIS 47 N -2.34 0.72 0.16 4.33 3.76 -1.14 -5.04 115.29 115.76 1v9j s HIS 47 Ca -0.26 -0.21 0.09 0.00 -0.15 0.00 0.00 55.06 54.53 1v9j s HIS 47 Cb 0.05 -0.83 -0.04 0.00 1.11 0.00 0.00 32.58 32.87 1v9j s HIS 47 CO 0.53 -0.34 -0.16 0.14 -0.85 0.00 0.00 174.74 174.06 1v9j s VAL 48 N 1.94 2.88 -0.03 -0.90 -7.23 -1.26 -1.51 120.40 114.29 1v9j s VAL 48 Ca 0.05 -1.70 -0.05 0.00 -1.81 0.00 0.00 61.98 58.47 1v9j s VAL 48 Cb -0.12 -2.38 0.01 0.00 0.56 0.00 0.00 36.38 34.44 1v9j s VAL 48 CO -0.05 -0.04 0.12 -1.61 -0.31 0.00 0.00 175.10 173.20 1v9j s GLU 49 N -2.57 0.28 0.19 4.82 2.02 0.28 -4.98 118.70 118.73 1v9j s GLU 49 Ca 0.22 -0.08 0.08 0.00 0.02 0.00 0.00 54.97 55.20 1v9j s GLU 49 Cb -0.09 0.12 -0.04 0.00 0.10 0.00 0.00 34.13 34.22 1v9j s GLU 49 CO 0.12 -0.05 -0.15 0.54 0.02 0.00 0.00 175.26 175.74 1v9j s VAL 50 N -0.56 1.71 0.16 2.63 0.11 -1.26 0.73 120.40 123.91 1v9j s VAL 50 Ca -0.06 -2.09 -0.03 0.00 -2.93 0.00 0.00 61.98 56.87 1v9j s VAL 50 Cb -0.04 -1.94 -0.03 0.00 -1.53 0.00 0.00 36.38 32.84 1v9j s VAL 50 CO 0.01 -0.51 0.13 -0.70 -3.33 0.00 0.00 175.10 170.69 1v9j s GLU 51 N -3.34 1.07 -0.14 1.54 2.56 0.16 -4.91 118.70 115.64 1v9j s GLU 51 Ca 0.19 -1.45 -0.12 0.00 0.00 0.00 0.00 54.97 53.60 1v9j s GLU 51 Cb -0.02 0.28 0.04 0.00 2.00 0.00 0.00 34.13 36.43 1v9j s GLU 51 CO 0.06 -0.34 0.36 0.34 -0.56 0.00 0.00 175.26 175.13 1v9j s ASP 52 N -3.07 -0.39 -0.43 -1.70 2.15 -1.26 -1.46 116.67 110.52 1v9j s ASP 52 Ca 0.27 0.74 0.04 0.00 0.43 0.00 0.00 52.55 54.04 1v9j s ASP 52 Cb 0.06 0.72 0.17 0.00 -0.30 0.00 0.00 42.92 43.58 1v9j s ASP 52 CO 0.05 -0.14 0.44 0.42 -0.17 0.00 0.00 175.17 175.77 1v9j s THR 53 N 0.42 -0.15 0.11 1.71 -4.23 -0.83 -4.97 115.64 107.71 1v9j s THR 53 Ca -0.02 -1.84 -0.24 0.00 -1.18 0.00 0.00 61.69 58.41 1v9j s THR 53 Cb -0.04 -0.81 -0.07 0.00 1.34 0.00 0.00 72.50 72.92 1v9j s THR 53 CO -0.02 -0.78 0.74 -0.89 -0.54 0.00 0.00 174.62 173.13 1v9j s THR 54 N 0.60 4.54 -0.11 3.99 2.01 -1.26 -3.77 115.64 121.64 1v9j s THR 54 Ca 0.28 1.60 0.19 0.00 0.31 0.00 0.00 61.69 64.08 1v9j s THR 54 Cb -0.02 -4.09 0.43 0.00 0.01 0.00 0.00 72.50 68.83 1v9j s THR 54 CO -0.11 0.48 1.18 0.18 -0.69 0.00 0.00 174.62 175.66 1v9j n LEU 55 N 2.01 1.87 0.00 4.42 4.77 -1.26 -5.03 117.00 123.78 1v9j n LEU 55 Ca -0.05 -2.91 0.03 0.00 -0.03 0.00 0.00 56.01 53.04 1v9j n LEU 55 Cb 0.49 -0.17 0.01 0.00 -2.33 0.00 0.00 43.42 41.42 1v9j n LEU 55 CO 0.46 0.95 1.06 -3.20 -1.33 0.00 0.00 177.39 175.33 1v9j n ASN 56 N -0.23 -1.16 -1.95 -1.43 2.85 -1.26 -5.02 115.26 107.05 1v9j n ASN 56 Ca 0.13 -1.24 -0.20 0.00 -0.11 0.00 0.00 54.58 53.15 1v9j n ASN 56 Cb 0.95 1.80 0.16 0.00 1.24 0.00 0.00 39.78 43.93 1v9j n ASN 56 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 1v9j n ARG 57 N -0.89 2.26 0.10 1.20 0.63 -1.26 -4.56 116.66 114.13 1v9j n ARG 57 Ca 0.04 -3.15 0.00 0.00 -0.92 0.00 0.00 57.85 53.82 1v9j n ARG 57 Cb 0.56 -2.10 0.00 0.00 0.45 0.00 0.00 32.46 31.37 1v9j n ARG 57 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1v9j s ALA 59 N -2.00 2.70 -0.29 0.00 0.00 -1.26 -5.01 121.76 115.90 1v9j s ALA 59 Ca 0.00 -0.16 0.02 0.00 0.00 0.00 0.00 51.96 51.82 1v9j s ALA 59 Cb 0.00 -3.09 0.18 0.00 0.00 0.00 0.00 23.12 20.21 1v9j s ALA 59 CO 0.00 -1.24 0.53 0.95 0.00 0.00 0.00 175.76 176.00 1v9j s THR 60 N -3.20 -0.87 0.34 0.00 -4.23 -1.26 -4.60 115.64 101.82 1v9j s THR 60 Ca 0.58 -0.07 -0.11 0.00 -1.18 0.00 0.00 61.69 60.91 1v9j s THR 60 Cb -0.13 -0.97 -0.07 0.00 1.34 0.00 0.00 72.50 72.67 1v9j s THR 60 CO 0.54 -0.07 0.70 -0.44 -0.54 0.00 0.00 174.62 174.81 1v9j s SER 61 N 2.74 6.62 -0.08 3.99 0.01 -1.25 -2.76 113.70 122.98 1v9j s SER 61 Ca 0.14 1.11 -0.14 0.00 1.31 0.00 0.00 55.95 58.37 1v9j s SER 61 Cb -0.13 -2.31 0.03 0.00 0.21 0.00 0.00 66.02 63.82 1v9j s SER 61 CO -0.24 -0.26 0.34 -0.36 0.41 0.00 0.00 173.24 173.14 1v9j s PHE 62 N -2.12 -0.30 -0.20 2.43 0.08 -0.13 -1.96 117.98 115.78 1v9j s PHE 62 Ca 0.51 0.64 -0.01 0.00 0.12 0.00 0.00 56.93 58.19 1v9j s PHE 62 Cb -0.10 0.12 0.01 0.00 -0.57 0.00 0.00 43.02 42.48 1v9j s PHE 62 CO 0.25 -0.30 -0.13 0.50 -0.10 0.00 0.00 175.22 175.45 1v9j s ARG 63 N -0.56 3.18 -0.15 0.44 6.06 -0.53 -2.89 118.95 124.50 1v9j s ARG 63 Ca -0.07 -0.73 -0.07 0.00 -2.50 0.00 0.00 55.73 52.36 1v9j s ARG 63 Cb -0.04 -2.78 -0.04 0.00 0.06 0.00 0.00 34.95 32.15 1v9j s ARG 63 CO 0.02 -0.20 0.11 0.14 -2.50 0.00 0.00 175.30 172.87 1v9j s VAL 64 N 1.37 5.20 -0.01 7.11 -7.23 -0.85 0.40 120.40 126.38 1v9j s VAL 64 Ca 0.05 0.10 0.03 0.00 -1.81 0.00 0.00 61.98 60.35 1v9j s VAL 64 Cb -0.14 -3.30 -0.00 0.00 0.56 0.00 0.00 36.38 33.50 1v9j s VAL 64 CO -0.08 0.54 -0.09 -0.22 -0.31 0.00 0.00 175.10 174.94 1v9j s LEU 65 N -0.36 1.97 -0.05 1.32 1.98 0.22 -2.72 118.68 121.05 1v9j s LEU 65 Ca 0.11 -0.16 -0.05 0.00 -2.89 0.00 0.00 54.13 51.13 1v9j s LEU 65 Cb -0.12 -0.46 0.01 0.00 0.66 0.00 0.00 46.19 46.28 1v9j s LEU 65 CO 0.01 0.10 0.15 -0.69 -1.89 0.00 0.00 176.35 174.03 1v9j s VAL 66 N -0.13 0.01 -0.08 1.68 1.01 -1.10 -0.55 120.40 121.23 1v9j s VAL 66 Ca 0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 61.98 61.88 1v9j s VAL 66 Cb -0.04 -0.25 0.03 0.00 0.00 0.00 0.00 36.38 36.11 1v9j s VAL 66 CO -0.00 -0.06 -0.02 -0.69 0.00 0.00 0.00 175.10 174.32 1v9j s VAL 67 N -0.16 0.58 -0.02 2.92 1.01 -0.57 -2.79 120.40 121.37 1v9j s VAL 67 Ca -0.02 -0.01 -0.29 0.00 0.00 0.00 0.00 61.98 61.66 1v9j s VAL 67 Cb -0.02 -0.69 0.11 0.00 0.00 0.00 0.00 36.38 35.77 1v9j s VAL 67 CO 0.00 0.29 1.29 -0.55 0.00 0.00 0.00 175.10 176.14 1v9j s SER 68 N 1.89 -0.02 0.14 3.32 0.15 -1.15 -2.26 113.70 115.78 1v9j s SER 68 Ca 0.05 -0.18 0.20 0.00 0.70 0.00 0.00 55.95 56.73 1v9j s SER 68 Cb -0.12 0.15 -0.07 0.00 -1.71 0.00 0.00 66.02 64.27 1v9j s SER 68 CO -0.06 -0.29 0.93 0.00 1.20 0.00 0.00 173.24 175.02 1v9j n ALA 69 N -0.72 2.31 -0.16 5.45 0.00 -1.26 -4.06 120.51 122.06 1v9j n ALA 69 Ca -0.02 -0.37 0.19 0.00 0.00 0.00 0.00 53.44 53.24 1v9j n ALA 69 Cb 0.60 -1.03 0.57 0.00 0.00 0.00 0.00 19.45 19.59 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 0.28 -0.00 0.00 3.11 -1.93 0.22 116.57 118.25 1v9j h LYS 70 Ca -0.06 -0.02 -0.16 0.00 -2.81 0.00 0.00 60.65 57.60 1v9j h LYS 70 Cb 1.22 -0.06 -0.02 0.00 -1.00 0.00 0.00 32.23 32.37 1v9j h LYS 70 CO 0.02 0.19 -0.75 0.74 -2.81 0.00 0.00 179.45 176.83 1v9j h PHE 71 N 0.29 0.01 -0.61 1.91 0.04 -1.92 -3.18 116.94 113.48 1v9j h PHE 71 Ca 0.38 -0.00 -0.04 0.00 2.80 0.00 0.00 57.97 61.11 1v9j h PHE 71 Cb 1.07 -0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.19 1v9j h PHE 71 CO -0.00 0.76 0.21 0.93 -0.60 0.00 0.00 178.31 179.60 1v9j h GLU 72 N 0.00 0.91 0.41 1.51 4.39 -0.76 -3.11 114.58 117.93 1v9j h GLU 72 Ca -0.01 -0.16 -0.01 0.00 0.34 0.00 0.00 59.36 59.51 1v9j h GLU 72 Cb 1.33 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 29.83 1v9j h GLU 72 CO 0.10 0.77 -0.24 0.78 -1.16 0.00 0.00 179.01 179.26 1v9j h GLY 73 N 1.00 -0.64 -1.55 -3.84 0.00 -1.47 -3.43 103.07 93.14 1v9j h GLY 73 Ca 0.20 0.27 -0.50 0.00 0.00 0.00 0.00 47.33 47.30 1v9j h GLY 73 CO -0.01 -0.24 0.39 0.54 0.00 0.00 0.00 176.54 177.21 1v9j s LYS 74 N -6.09 3.52 0.16 4.80 1.02 -1.18 -5.06 119.74 116.91 1v9j s LYS 74 Ca -0.16 0.95 -0.03 0.00 0.02 0.00 0.00 55.97 56.75 1v9j s LYS 74 Cb 0.05 -2.07 0.04 0.00 -0.52 0.00 0.00 37.83 35.33 1v9j s LYS 74 CO 0.64 -0.63 0.12 -0.35 -0.92 0.00 0.00 175.35 174.20 1v9j n PRO 75 N -2.32 -1.68 0.08 -1.68 -0.04 -1.26 -4.76 135.00 123.33 1v9j n PRO 75 Ca 0.07 -0.20 -0.08 0.00 -0.04 0.00 0.00 63.50 63.25 1v9j n PRO 75 Cb 0.54 -0.21 -0.07 0.00 -0.04 0.00 0.00 33.50 33.72 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 0.11 -0.45 1.53 6.46 -1.97 -2.85 115.31 118.14 1v9j h LEU 76 Ca -0.05 -0.10 -0.17 0.00 -0.12 0.00 0.00 57.88 57.44 1v9j h LEU 76 Cb 0.15 -0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.03 1v9j h LEU 76 CO 0.03 1.01 -0.77 0.17 -0.62 0.00 0.00 178.44 178.26 1v9j h LEU 77 N 0.03 0.11 -0.07 2.25 -0.00 -1.99 -2.96 115.31 112.68 1v9j h LEU 77 Ca -0.03 -0.08 -0.12 0.00 -0.00 0.00 0.00 57.88 57.65 1v9j h LEU 77 Cb 1.67 -0.03 0.01 0.00 -0.00 0.00 0.00 40.66 42.31 1v9j h LEU 77 CO 0.14 0.84 -0.43 1.56 -0.00 0.00 0.00 178.44 180.54 1v9j h GLN 78 N 0.05 0.41 -0.97 0.17 7.50 -1.91 -1.71 115.11 118.66 1v9j h GLN 78 Ca -0.02 -0.35 0.03 0.00 0.50 0.00 0.00 58.65 58.81 1v9j h GLN 78 Cb 1.36 0.08 -0.05 0.00 0.05 0.00 0.00 27.48 28.91 1v9j h GLN 78 CO 0.11 0.99 0.63 0.07 -1.50 0.00 0.00 178.83 179.13 1v9j h ARG 79 N -0.06 1.21 -0.01 1.46 0.11 -1.56 0.29 114.38 115.81 1v9j h ARG 79 Ca -0.03 -0.07 -0.17 0.00 0.10 0.00 0.00 59.98 59.81 1v9j h ARG 79 Cb 1.09 -0.27 -0.02 0.00 1.11 0.00 0.00 29.97 31.88 1v9j h ARG 79 CO 0.09 0.80 -0.76 0.45 0.10 0.00 0.00 179.97 180.65 1v9j h HIS 80 N 1.24 0.16 -0.12 4.08 3.86 -1.56 -2.85 115.15 119.96 1v9j h HIS 80 Ca 0.38 -0.08 -0.23 0.00 -1.16 0.00 0.00 60.37 59.28 1v9j h HIS 80 Cb -0.04 -0.02 0.01 0.00 1.06 0.00 0.00 27.41 28.42 1v9j h HIS 80 CO -0.01 0.82 -0.82 0.00 0.86 0.00 0.00 177.93 178.79 1v9j h ARG 81 N 0.07 0.77 -0.47 2.45 3.08 -0.51 -1.96 114.38 117.81 1v9j h ARG 81 Ca -0.02 -0.66 -0.03 0.00 0.07 0.00 0.00 59.98 59.34 1v9j h ARG 81 Cb 1.33 0.15 -0.02 0.00 0.08 0.00 0.00 29.97 31.51 1v9j h ARG 81 CO 0.11 1.26 0.20 -0.07 -1.07 0.00 0.00 179.97 180.40 1v9j h LEU 82 N 0.49 0.64 -0.29 3.04 3.38 -0.48 0.30 115.31 122.40 1v9j h LEU 82 Ca -0.07 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.67 1v9j h LEU 82 Cb 1.45 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 1v9j h LEU 82 CO 0.17 0.63 -0.09 0.58 0.09 0.00 0.00 178.44 179.81 1v9j h VAL 83 N 0.62 1.29 -0.16 1.22 2.07 -1.55 -1.85 116.25 117.87 1v9j h VAL 83 Ca 0.16 -1.14 -0.02 0.00 0.82 0.00 0.00 66.70 66.51 1v9j h VAL 83 Cb 0.18 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 1v9j h VAL 83 CO -0.01 0.36 0.01 0.78 0.02 0.00 0.00 177.57 178.73 1v9j h ASN 84 N 0.32 0.27 -0.08 0.57 2.35 -1.23 -2.81 115.58 114.97 1v9j h ASN 84 Ca 0.07 -0.28 -0.00 0.00 -0.55 0.00 0.00 56.30 55.53 1v9j h ASN 84 Cb 0.58 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 1v9j h ASN 84 CO 0.03 0.49 0.05 -0.33 -1.65 0.00 0.00 177.43 176.02 1v9j h GLU 85 N 0.04 0.13 0.83 0.81 5.08 -0.41 -0.31 114.58 120.76 1v9j h GLU 85 Ca 0.05 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1v9j h GLU 85 Cb 0.34 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.57 1v9j h GLU 85 CO 0.01 0.10 -0.42 0.00 -1.00 0.00 0.00 179.01 177.70 1v9j n LEU 87 N -5.59 7.27 -0.16 0.00 4.77 -1.10 -4.65 117.00 117.54 1v9j n LEU 87 Ca -0.15 -4.33 0.00 0.00 -0.03 0.00 0.00 56.01 51.50 1v9j n LEU 87 Cb 0.46 -0.88 0.26 0.00 -2.33 0.00 0.00 43.42 40.93 1v9j n LEU 87 CO 0.39 1.54 1.16 0.00 -1.33 0.00 0.00 177.39 179.15 1v9j h ALA 88 N 1.99 1.44 -0.04 -1.18 0.00 -0.97 0.82 119.26 121.31 1v9j h ALA 88 Ca 0.57 -0.09 -0.20 0.00 0.00 0.00 0.00 54.91 55.20 1v9j h ALA 88 Cb 0.98 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.53 1v9j h ALA 88 CO 1.46 0.48 -0.76 0.93 0.00 0.00 0.00 179.25 181.36 1v9j h GLU 89 N 0.89 0.58 0.00 0.00 5.08 -1.85 -3.28 114.58 115.99 1v9j h GLU 89 Ca 0.23 -0.57 -0.16 0.00 -1.00 0.00 0.00 59.36 57.86 1v9j h GLU 89 Cb -0.00 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 1v9j h GLU 89 CO -0.04 1.19 -0.76 0.93 -1.00 0.00 0.00 179.01 179.33 1v9j h GLU 90 N 0.18 0.00 -0.40 2.33 3.07 -1.84 -3.34 114.58 114.59 1v9j h GLU 90 Ca -0.08 0.00 0.06 0.00 -0.50 0.00 0.00 59.36 58.83 1v9j h GLU 90 Cb 1.43 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 29.25 1v9j h GLU 90 CO 0.15 0.76 -0.50 -0.07 -1.40 0.00 0.00 179.01 177.95 1v9j h LEU 91 N 0.00 -1.67 -1.64 1.33 3.38 0.60 0.36 115.31 117.67 1v9j h LEU 91 Ca -0.01 0.23 0.39 0.00 0.09 0.00 0.00 57.88 58.59 1v9j h LEU 91 Cb 1.35 0.70 -0.09 0.00 0.09 0.00 0.00 40.66 42.71 1v9j h LEU 91 CO 0.10 -0.39 0.90 -0.65 0.09 0.00 0.00 178.44 178.48 1v9j h PRO 92 N -0.37 0.12 -0.01 1.13 0.11 -1.70 0.96 132.00 132.24 1v9j h PRO 92 Ca 0.10 -0.01 -0.17 0.00 0.11 0.00 0.00 66.00 66.04 1v9j h PRO 92 Cb 0.60 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.66 1v9j h PRO 92 CO -0.58 0.08 -0.77 0.45 -0.21 0.00 0.00 178.00 176.96 1v9j h HIS 93 N 0.12 0.11 -2.97 0.65 3.86 -1.14 -3.43 115.15 112.35 1v9j h HIS 93 Ca 0.72 -0.05 -0.56 0.00 -1.16 0.00 0.00 60.37 59.32 1v9j h HIS 93 Cb 2.43 -0.01 -0.03 0.00 1.06 0.00 0.00 27.41 30.86 1v9j h HIS 93 CO -0.00 0.81 0.82 0.42 0.86 0.00 0.00 177.93 180.84 1v9j s ILE 94 N -3.32 4.17 0.26 2.45 -1.09 0.33 -4.70 121.20 119.31 1v9j s ILE 94 Ca -0.01 1.47 0.01 0.00 -2.23 0.00 0.00 60.65 59.89 1v9j s ILE 94 Cb 0.11 -3.95 0.04 0.00 -1.58 0.00 0.00 42.46 37.09 1v9j s ILE 94 CO 0.80 -0.06 1.67 -0.74 -1.23 0.00 0.00 174.94 175.38 1v9j h HIS 95 N 7.92 0.57 -2.53 3.97 2.76 -1.77 -3.43 115.15 122.65 1v9j h HIS 95 Ca -0.31 -0.14 -0.18 0.00 -2.20 0.00 0.00 60.37 57.54 1v9j h HIS 95 Cb 1.14 -0.13 -0.31 0.00 1.55 0.00 0.00 27.41 29.66 1v9j h HIS 95 CO 0.77 0.76 -0.48 0.00 -1.30 0.00 0.00 177.93 177.67 1v9j s ALA 96 N -4.39 -0.81 -0.09 5.26 0.00 -1.26 -4.96 121.76 115.51 1v9j s ALA 96 Ca -0.07 1.03 0.04 0.00 0.00 0.00 0.00 51.96 52.96 1v9j s ALA 96 Cb 0.13 -1.27 0.00 0.00 0.00 0.00 0.00 23.12 21.98 1v9j s ALA 96 CO 0.80 -0.86 -0.22 0.12 0.00 0.00 0.00 175.76 175.60 1v9j s PHE 97 N 2.49 2.31 -0.17 0.00 2.19 -1.26 -0.95 117.98 122.59 1v9j s PHE 97 Ca 0.03 -0.90 0.01 0.00 0.33 0.00 0.00 56.93 56.40 1v9j s PHE 97 Cb -0.13 -1.56 0.02 0.00 -1.31 0.00 0.00 43.02 40.04 1v9j s PHE 97 CO -0.12 -0.36 -0.18 -2.00 1.83 0.00 0.00 175.22 174.40 1v9j s GLU 98 N 0.33 2.72 -0.25 10.12 2.12 -1.14 -5.04 118.70 127.57 1v9j s GLU 98 Ca -0.16 -0.73 -0.11 0.00 0.36 0.00 0.00 54.97 54.34 1v9j s GLU 98 Cb -0.17 -2.39 -0.05 0.00 0.26 0.00 0.00 34.13 31.78 1v9j s GLU 98 CO 0.07 -0.22 0.16 1.14 -0.54 0.00 0.00 175.26 175.87 1v9j s GLN 99 N 1.37 4.04 -0.07 4.30 -2.07 -1.26 -2.02 119.66 123.94 1v9j s GLN 99 Ca 0.05 -0.28 0.00 0.00 -1.82 0.00 0.00 55.36 53.31 1v9j s GLN 99 Cb -0.13 -3.56 0.02 0.00 -1.09 0.00 0.00 33.01 28.26 1v9j s GLN 99 CO -0.12 0.01 -0.05 0.21 -1.32 0.00 0.00 175.29 174.02 1v9j s LYS 100 N 1.20 1.05 0.03 9.60 2.20 -1.10 -5.05 119.74 127.68 1v9j s LYS 100 Ca 0.07 -0.12 0.06 0.00 -0.36 0.00 0.00 55.97 55.63 1v9j s LYS 100 Cb -0.14 -1.15 -0.02 0.00 -1.51 0.00 0.00 37.83 35.01 1v9j s LYS 100 CO 0.06 -0.19 -0.19 0.95 -0.36 0.00 0.00 175.35 175.62 1v9j s THR 101 N 1.42 1.50 0.15 3.43 -4.23 -1.26 -2.73 115.64 113.93 1v9j s THR 101 Ca -0.02 -1.09 -0.12 0.00 -1.18 0.00 0.00 61.69 59.28 1v9j s THR 101 Cb -0.13 -1.31 0.01 0.00 1.34 0.00 0.00 72.50 72.40 1v9j s THR 101 CO -0.03 0.19 0.33 -0.76 -0.54 0.00 0.00 174.62 173.81 1v9j s LEU 102 N -1.06 0.79 0.29 4.79 1.43 -1.12 -5.03 118.68 118.77 1v9j s LEU 102 Ca 0.06 -0.67 -0.11 0.00 -1.03 0.00 0.00 54.13 52.39 1v9j s LEU 102 Cb -0.08 1.45 -0.07 0.00 0.03 0.00 0.00 46.19 47.52 1v9j s LEU 102 CO 0.01 -0.89 0.64 0.42 0.23 0.00 0.00 176.35 176.77 1v9j s THR 103 N -3.90 4.84 0.23 5.49 -4.23 -1.26 -2.93 115.64 113.88 1v9j s THR 103 Ca 0.11 0.59 -0.07 0.00 -1.18 0.00 0.00 61.69 61.14 1v9j s THR 103 Cb 0.02 -3.65 0.18 0.00 1.34 0.00 0.00 72.50 70.40 1v9j s THR 103 CO -0.05 -0.21 1.76 -0.65 -0.54 0.00 0.00 174.62 174.94 1v9j h PRO 104 N 2.14 0.52 -0.40 3.99 0.11 -1.89 -1.26 132.00 135.21 1v9j h PRO 104 Ca -0.47 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.61 1v9j h PRO 104 Cb 1.18 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1v9j h PRO 104 CO 0.67 0.34 0.26 1.49 -0.21 0.00 0.00 178.00 180.55 1v9j h GLU 105 N 0.53 0.52 -0.04 1.05 4.22 -1.95 0.13 114.58 119.04 1v9j h GLU 105 Ca 0.36 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.77 1v9j h GLU 105 Cb 0.43 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1v9j h GLU 105 CO -0.31 0.35 0.03 1.96 -2.18 0.00 0.00 179.01 178.86 1v9j h GLN 106 N 0.54 0.06 0.09 1.92 4.20 -1.76 0.16 115.11 120.31 1v9j h GLN 106 Ca 0.15 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.85 1v9j h GLN 106 Cb -0.06 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.71 1v9j h GLN 106 CO -0.04 0.04 -0.04 2.35 -0.67 0.00 0.00 178.83 180.47 1v9j h TRP 107 N 0.06 -0.11 0.36 2.96 2.91 -1.05 0.18 115.95 121.26 1v9j h TRP 107 Ca 0.02 -0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.03 1v9j h TRP 107 Cb -0.00 0.04 -0.01 0.00 -0.51 0.00 0.00 29.16 28.67 1v9j h TRP 107 CO -0.08 -0.00 -0.26 1.15 -1.03 0.00 0.00 178.44 178.22 1v9j h THR 108 N -0.19 0.45 -0.18 2.65 2.02 -0.65 0.70 112.91 117.72 1v9j h THR 108 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.17 1v9j h THR 108 Cb 0.16 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 1v9j h THR 108 CO 0.02 0.00 0.11 0.03 0.37 0.00 0.00 175.52 176.05 1v9j h ARG 109 N -0.61 0.23 -2.19 6.66 2.47 -0.66 -3.33 114.38 116.95 1v9j h ARG 109 Ca -0.03 -0.01 -0.52 0.00 -1.26 0.00 0.00 59.98 58.15 1v9j h ARG 109 Cb 0.53 -0.05 -0.35 0.00 -1.65 0.00 0.00 29.97 28.44 1v9j h ARG 109 CO 0.01 0.16 -0.90 -0.65 0.56 0.00 0.00 179.97 179.15 1v9j s GLN 110 N -5.24 0.88 -0.53 0.04 -0.21 0.62 -4.98 119.66 110.25 1v9j s GLN 110 Ca -0.06 -1.86 -0.00 0.00 0.02 0.00 0.00 55.36 53.45 1v9j s GLN 110 Cb 0.17 -1.20 0.46 0.00 1.00 0.00 0.00 33.01 33.44 1v9j s GLN 110 CO 0.70 -1.36 1.96 2.89 -2.12 0.00 0.00 175.29 177.36 1v9j n ARG 111 N 3.01 2.36 0.25 2.91 1.85 0.24 -4.35 116.66 122.92 1v9j n ARG 111 Ca 0.26 -2.82 -0.10 0.00 -1.00 0.00 0.00 57.85 54.20 1v9j n ARG 111 Cb 0.48 -2.10 -0.05 0.00 -1.05 0.00 0.00 32.46 29.74 1v9j n ARG 111 CO 0.00 0.00 0.00 -0.09 -0.01 0.00 0.00 177.63 177.53 1v9j h ARG 112 N 1.55 -0.61 0.00 2.89 9.65 -1.94 -3.51 114.38 122.41 1v9j h ARG 112 Ca 0.55 0.04 0.00 0.00 -1.10 0.00 0.00 59.98 59.47 1v9j h ARG 112 Cb 1.44 0.14 0.00 0.00 -1.39 0.00 0.00 29.97 30.16 1v9j h ARG 112 CO 1.27 -0.41 0.00 -0.85 2.80 0.00 0.00 179.97 182.78