#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v9j s LYS 2 N 0.00 -2.64 0.00 2.12 -2.85 -1.26 -4.20 119.74 110.91 1v9j s LYS 2 Ca 0.00 0.35 0.00 0.00 -1.00 0.00 0.00 55.97 55.32 1v9j s LYS 2 Cb 0.00 -1.39 0.00 0.00 -2.06 0.00 0.00 37.83 34.38 1v9j s LYS 2 CO 0.00 -4.74 0.00 0.41 0.10 0.00 0.00 175.35 171.12 1v9j n GLY 3 N 1.51 0.75 2.34 0.59 0.00 -1.26 -4.70 105.19 104.42 1v9j n GLY 3 Ca 0.10 -0.75 -0.00 0.00 0.00 0.00 0.00 46.02 45.37 1v9j n GLY 3 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v9j n SER 4 N 1.67 -9.45 0.24 1.61 7.64 -1.26 -4.93 113.62 109.15 1v9j n SER 4 Ca 0.00 1.84 -0.10 0.00 1.01 0.00 0.00 58.87 61.63 1v9j n SER 4 Cb 0.49 -5.17 -0.05 0.00 -1.01 0.00 0.00 64.21 58.47 1v9j n SER 4 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1v9j h SER 5 N 4.21 -0.53 -1.93 6.43 0.02 -1.84 -3.38 113.55 116.54 1v9j h SER 5 Ca -0.00 0.02 -0.50 0.00 -0.84 0.00 0.00 61.79 60.47 1v9j h SER 5 Cb 0.01 0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.64 1v9j h SER 5 CO 0.00 -0.37 1.22 -1.38 -1.14 0.00 0.00 176.83 175.16 1v9j s HIS 6 N -4.30 1.89 0.40 3.45 -3.43 -1.26 -4.98 115.29 107.06 1v9j s HIS 6 Ca -0.09 0.46 -0.06 0.00 -0.80 0.00 0.00 55.06 54.57 1v9j s HIS 6 Cb 0.01 -4.27 -0.05 0.00 -1.43 0.00 0.00 32.58 26.85 1v9j s HIS 6 CO 0.27 -2.18 0.70 -1.58 -2.00 0.00 0.00 174.74 169.96 1v9j s HIS 7 N 8.05 3.51 0.00 0.38 2.46 -1.26 -4.90 115.29 123.53 1v9j s HIS 7 Ca 0.57 0.78 0.00 0.00 0.47 0.00 0.00 55.06 56.88 1v9j s HIS 7 Cb -0.10 -2.24 0.00 0.00 -0.13 0.00 0.00 32.58 30.10 1v9j s HIS 7 CO 0.16 -0.09 0.00 1.58 -2.47 0.00 0.00 174.74 173.92 1v9j n HIS 8 N -1.68 -0.01 -1.70 3.88 -0.00 -1.26 -5.12 115.22 109.32 1v9j n HIS 8 Ca -0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.30 1v9j n HIS 8 Cb 0.55 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.51 1v9j n HIS 8 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 1v9j n HIS 9 N -0.71 2.69 -3.21 1.57 1.44 -1.26 -4.95 115.22 110.79 1v9j n HIS 9 Ca 0.00 -0.08 -0.16 0.00 -2.01 0.00 0.00 57.72 55.47 1v9j n HIS 9 Cb 0.00 -2.71 -0.06 0.00 0.12 0.00 0.00 29.99 27.34 1v9j n HIS 9 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 1v9j s HIS 10 N 2.10 -0.25 -1.58 -1.40 0.09 -1.26 -4.91 115.29 108.08 1v9j s HIS 10 Ca 0.79 -1.21 -0.04 0.00 -0.00 0.00 0.00 55.06 54.60 1v9j s HIS 10 Cb -0.48 -0.35 0.00 0.00 -0.00 0.00 0.00 32.58 31.75 1v9j s HIS 10 CO 0.35 -1.01 0.48 1.58 -0.00 0.00 0.00 174.74 176.13 1v9j n HIS 11 N 3.45 -1.74 -0.10 1.40 -0.00 -1.26 -4.91 115.22 112.06 1v9j n HIS 11 Ca 0.19 0.41 -0.19 0.00 0.46 0.00 0.00 57.72 58.59 1v9j n HIS 11 Cb 0.49 -4.34 -0.09 0.00 -0.12 0.00 0.00 29.99 25.92 1v9j n HIS 11 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1v9j n SER 12 N -2.32 1.86 -4.90 0.26 2.88 -1.26 -4.96 113.62 105.18 1v9j n SER 12 Ca -0.14 0.46 -0.29 0.00 -1.33 0.00 0.00 58.87 57.57 1v9j n SER 12 Cb 0.63 -0.94 0.03 0.00 -0.75 0.00 0.00 64.21 63.19 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 -6.68 5.68 -0.22 -3.46 0.15 -1.26 -5.04 113.70 102.88 1v9j s SER 13 Ca -0.27 1.01 -0.13 0.00 0.70 0.00 0.00 55.95 57.26 1v9j s SER 13 Cb 0.06 -1.95 -0.09 0.00 -1.71 0.00 0.00 66.02 62.32 1v9j s SER 13 CO 0.51 -1.11 -0.30 0.61 1.20 0.00 0.00 173.24 174.15 1v9j n GLY 14 N -2.76 -0.40 2.78 9.45 0.00 -1.26 -4.90 105.19 108.11 1v9j n GLY 14 Ca 0.05 -0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 1v9j n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v9j s ALA 15 N -2.50 2.29 -0.29 4.61 0.00 -1.26 -5.05 121.76 119.56 1v9j s ALA 15 Ca -0.31 -2.54 -0.02 0.00 0.00 0.00 0.00 51.96 49.09 1v9j s ALA 15 Cb 0.11 -1.89 0.12 0.00 0.00 0.00 0.00 23.12 21.45 1v9j s ALA 15 CO 0.40 -1.96 0.23 0.45 0.00 0.00 0.00 175.76 174.88 1v9j s SER 16 N 0.52 2.41 -0.41 0.00 0.15 -1.26 -5.02 113.70 110.08 1v9j s SER 16 Ca 0.16 -0.97 0.11 0.00 0.70 0.00 0.00 55.95 55.95 1v9j s SER 16 Cb -0.23 0.17 0.39 0.00 -1.71 0.00 0.00 66.02 64.64 1v9j s SER 16 CO -0.05 -0.41 0.88 0.18 1.20 0.00 0.00 173.24 175.05 1v9j n LEU 17 N 5.28 2.24 -4.06 3.45 4.77 -1.26 -5.01 117.00 122.42 1v9j n LEU 17 Ca -0.04 -4.84 -0.35 0.00 -0.03 0.00 0.00 56.01 50.76 1v9j n LEU 17 Cb 0.45 0.23 -0.10 0.00 -2.33 0.00 0.00 43.42 41.67 1v9j n LEU 17 CO 0.02 2.11 0.04 -0.69 -1.33 0.00 0.00 177.39 177.53 1v9j s VAL 18 N -3.43 3.55 0.96 4.08 1.01 -1.26 -5.09 120.40 120.21 1v9j s VAL 18 Ca 0.39 -3.23 -0.13 0.00 0.00 0.00 0.00 61.98 59.01 1v9j s VAL 18 Cb 0.37 -3.32 0.03 0.00 0.00 0.00 0.00 36.38 33.46 1v9j s VAL 18 CO -0.08 -0.90 0.34 -2.65 0.00 0.00 0.00 175.10 171.81 1v9j n PRO 19 N 3.17 -0.31 -3.79 2.72 -0.02 -1.26 -5.04 135.00 130.47 1v9j n PRO 19 Ca 0.10 -0.05 -0.22 0.00 -2.02 0.00 0.00 63.50 61.31 1v9j n PRO 19 Cb 0.36 -1.81 -0.05 0.00 -0.02 0.00 0.00 33.50 31.99 1v9j n PRO 19 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1v9j n ARG 20 N -1.51 1.16 0.00 -0.52 5.12 -1.26 -5.17 116.66 114.48 1v9j n ARG 20 Ca 0.06 -2.48 0.00 0.00 -1.93 0.00 0.00 57.85 53.51 1v9j n ARG 20 Cb 0.54 0.69 0.00 0.00 -1.16 0.00 0.00 32.46 32.53 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 0.91 5.68 3.12 -0.13 0.00 -1.26 -5.15 105.19 108.35 1v9j n GLY 21 Ca -0.14 -1.59 -0.29 0.00 0.00 0.00 0.00 46.02 44.01 1v9j n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v9j s SER 22 N 1.00 2.51 -0.06 1.61 0.01 -1.26 -5.13 113.70 112.38 1v9j s SER 22 Ca 0.00 -0.45 0.04 0.00 1.31 0.00 0.00 55.95 56.85 1v9j s SER 22 Cb 0.00 -1.15 -0.02 0.00 0.21 0.00 0.00 66.02 65.06 1v9j s SER 22 CO 0.00 0.09 -0.17 -0.70 0.41 0.00 0.00 173.24 172.87 1v9j s GLU 23 N 0.57 2.59 0.00 12.44 2.12 -1.26 -4.70 118.70 130.47 1v9j s GLU 23 Ca -0.15 -0.75 0.00 0.00 0.36 0.00 0.00 54.97 54.43 1v9j s GLU 23 Cb -0.17 -2.35 0.00 0.00 0.26 0.00 0.00 34.13 31.87 1v9j s GLU 23 CO 0.05 0.53 0.00 0.41 -0.54 0.00 0.00 175.26 175.71 1v9j n GLY 24 N 2.58 1.89 3.18 -1.50 0.00 -1.26 -5.12 105.19 104.96 1v9j n GLY 24 Ca -0.17 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.76 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 0.10 -0.39 4.61 0.00 -1.26 -5.04 121.76 117.77 1v9j s ALA 25 Ca 0.00 -0.89 0.05 0.00 0.00 0.00 0.00 51.96 51.13 1v9j s ALA 25 Cb 0.00 0.50 0.64 0.00 0.00 0.00 0.00 23.12 24.26 1v9j s ALA 25 CO 0.00 -0.48 1.81 0.00 0.00 0.00 0.00 175.76 177.09 1v9j n ALA 26 N -0.03 5.10 0.16 0.00 0.00 -1.26 -4.50 120.51 119.98 1v9j n ALA 26 Ca -0.13 -2.52 0.10 0.00 0.00 0.00 0.00 53.44 50.89 1v9j n ALA 26 Cb 0.62 -1.37 0.61 0.00 0.00 0.00 0.00 19.45 19.32 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 1.37 0.96 0.00 0.00 2.02 -1.96 -2.92 112.91 112.38 1v9j h THR 27 Ca 0.49 -0.03 -0.12 0.00 0.77 0.00 0.00 66.41 67.52 1v9j h THR 27 Cb 2.59 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 69.84 1v9j h THR 27 CO 0.93 0.02 -1.64 0.80 0.37 0.00 0.00 175.52 176.00 1v9j n MET 28 N -4.50 1.58 -3.56 6.66 0.00 -1.26 -4.97 117.12 111.07 1v9j n MET 28 Ca 0.01 -0.04 -0.36 0.00 0.00 0.00 0.00 57.70 57.30 1v9j n MET 28 Cb 0.19 -1.27 -0.07 0.00 0.00 0.00 0.00 33.22 32.07 1v9j n MET 28 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 175.97 174.76 1v9j s GLU 29 N -2.45 4.22 0.28 2.12 2.02 -1.10 -5.04 118.70 118.75 1v9j s GLU 29 Ca -0.05 0.08 -0.27 0.00 0.02 0.00 0.00 54.97 54.76 1v9j s GLU 29 Cb 0.05 -3.41 -0.15 0.00 0.10 0.00 0.00 34.13 30.71 1v9j s GLU 29 CO 0.44 0.27 0.63 1.28 0.02 0.00 0.00 175.26 177.90 1v9j n LEU 30 N 3.47 -0.30 -4.02 1.80 7.99 -1.26 -4.57 117.00 120.10 1v9j n LEU 30 Ca -0.12 1.08 -0.13 0.00 -0.01 0.00 0.00 56.01 56.83 1v9j n LEU 30 Cb 0.52 -1.07 -0.12 0.00 -0.11 0.00 0.00 43.42 42.64 1v9j n LEU 30 CO 0.39 -2.61 -0.40 -0.55 -1.51 0.00 0.00 177.39 172.72 1v9j s SER 31 N -0.86 0.72 0.17 -1.43 0.15 -1.26 -4.99 113.70 106.19 1v9j s SER 31 Ca 0.62 -0.41 -0.15 0.00 0.70 0.00 0.00 55.95 56.71 1v9j s SER 31 Cb -0.79 0.01 0.05 0.00 -1.71 0.00 0.00 66.02 63.59 1v9j s SER 31 CO 0.58 -0.14 1.83 0.00 1.20 0.00 0.00 173.24 176.72 1v9j h ALA 32 N 4.95 0.64 -0.10 5.45 0.00 -1.94 -1.93 119.26 126.32 1v9j h ALA 32 Ca -0.33 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1v9j h ALA 32 Cb 1.20 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1v9j h ALA 32 CO 0.43 0.08 0.03 0.22 0.00 0.00 0.00 179.25 180.02 1v9j h ASP 33 N 0.68 0.12 -0.14 0.00 1.82 -1.97 -1.90 116.42 115.03 1v9j h ASP 33 Ca 0.18 -0.01 -0.00 0.00 -0.39 0.00 0.00 57.03 56.82 1v9j h ASP 33 Cb -0.08 -0.03 -0.01 0.00 0.68 0.00 0.00 39.33 39.89 1v9j h ASP 33 CO -0.04 0.13 0.08 0.22 -1.61 0.00 0.00 179.24 178.02 1v9j h TYR 34 N 0.14 0.19 -0.34 0.28 3.20 -1.77 0.44 116.97 119.12 1v9j h TYR 34 Ca 0.04 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.78 1v9j h TYR 34 Cb 0.05 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 1v9j h TYR 34 CO 0.00 0.19 -0.28 -0.07 -1.64 0.00 0.00 178.16 176.36 1v9j h LEU 35 N 0.15 0.72 0.20 2.82 3.38 -1.33 -1.34 115.31 119.90 1v9j h LEU 35 Ca 0.05 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1v9j h LEU 35 Cb 0.05 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1v9j h LEU 35 CO -0.01 0.96 -0.10 -0.09 0.09 0.00 0.00 178.44 179.30 1v9j h ARG 36 N 0.60 -0.26 -0.07 1.13 2.43 -1.12 -2.73 114.38 114.37 1v9j h ARG 36 Ca 0.08 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1v9j h ARG 36 Cb 0.78 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.39 1v9j h ARG 36 CO 0.06 0.12 0.04 0.93 -1.51 0.00 0.00 179.97 179.61 1v9j h GLU 37 N -0.73 0.09 0.82 0.20 4.39 -0.15 0.15 114.58 119.35 1v9j h GLU 37 Ca -0.03 -0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.63 1v9j h GLU 37 Cb 0.50 -0.02 0.01 0.00 -0.10 0.00 0.00 28.75 29.14 1v9j h GLU 37 CO 0.04 0.07 -0.39 -0.22 -1.16 0.00 0.00 179.01 177.35 1v9j h LYS 38 N 0.10 -1.06 -0.00 2.33 3.64 -1.19 -2.42 116.57 117.96 1v9j h LYS 38 Ca 0.03 0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.41 1v9j h LYS 38 Cb 0.01 0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 1v9j h LYS 38 CO -0.00 -0.71 -0.34 -0.07 -2.27 0.00 0.00 179.45 176.06 1v9j h LEU 39 N -1.29 0.00 0.37 5.20 3.38 -1.32 -0.91 115.31 120.74 1v9j h LEU 39 Ca -0.11 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1v9j h LEU 39 Cb 0.85 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1v9j h LEU 39 CO 0.19 0.34 -0.29 -0.09 0.09 0.00 0.00 178.44 178.68 1v9j h ARG 40 N 0.00 -0.64 -0.00 1.13 2.43 -0.66 0.21 114.38 116.85 1v9j h ARG 40 Ca -0.00 0.04 -0.17 0.00 -0.81 0.00 0.00 59.98 59.04 1v9j h ARG 40 Cb 0.61 0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.28 1v9j h ARG 40 CO 0.04 -0.42 -0.78 1.96 -1.51 0.00 0.00 179.97 179.27 1v9j h GLN 41 N -0.66 0.05 0.57 0.20 1.08 -1.39 0.64 115.11 115.60 1v9j h GLN 41 Ca -0.03 -0.05 -0.03 0.00 -1.45 0.00 0.00 58.65 57.10 1v9j h GLN 41 Cb 0.57 0.01 0.01 0.00 -0.05 0.00 0.00 27.48 28.02 1v9j h GLN 41 CO -0.01 0.80 -0.27 -0.44 -0.95 0.00 0.00 178.83 177.95 1v9j h ASP 42 N 0.03 -0.65 0.91 1.46 5.19 -0.93 -3.22 116.42 119.21 1v9j h ASP 42 Ca -0.01 -0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.36 1v9j h ASP 42 Cb 1.37 0.17 0.00 0.00 0.18 0.00 0.00 39.33 41.04 1v9j h ASP 42 CO 0.10 -0.33 -0.56 0.18 -3.12 0.00 0.00 179.24 175.51 1v9j n LEU 43 N -5.35 0.70 -3.15 1.55 4.77 0.70 -4.98 117.00 111.24 1v9j n LEU 43 Ca -0.12 0.26 -0.14 0.00 -0.03 0.00 0.00 56.01 55.98 1v9j n LEU 43 Cb 0.34 -0.20 0.07 0.00 -2.33 0.00 0.00 43.42 41.30 1v9j n LEU 43 CO 0.33 -0.06 0.03 -0.62 -1.33 0.00 0.00 177.39 175.74 1v9j n GLU 44 N -2.11 -2.37 -2.02 3.23 1.02 0.22 -4.75 120.64 113.86 1v9j n GLU 44 Ca 0.04 0.82 -0.28 0.00 -0.02 0.00 0.00 57.16 57.71 1v9j n GLU 44 Cb 0.44 -5.58 0.13 0.00 -0.02 0.00 0.00 31.44 26.41 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 -3.36 2.63 -0.22 0.62 0.00 -0.87 -4.82 121.76 115.74 1v9j s ALA 45 Ca 0.40 -1.03 -0.17 0.00 0.00 0.00 0.00 51.96 51.16 1v9j s ALA 45 Cb -0.05 -2.74 -0.13 0.00 0.00 0.00 0.00 23.12 20.20 1v9j s ALA 45 CO 0.69 -1.95 -0.08 -1.91 0.00 0.00 0.00 175.76 172.52 1v9j n GLU 46 N -3.42 0.55 -4.86 0.00 2.13 -0.60 -4.96 120.64 109.48 1v9j n GLU 46 Ca 0.12 0.44 -0.27 0.00 0.66 0.00 0.00 57.16 58.11 1v9j n GLU 46 Cb 0.60 -1.63 -0.16 0.00 0.27 0.00 0.00 31.44 30.52 1v9j n GLU 46 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 1v9j s HIS 47 N -2.44 1.79 0.03 4.31 3.76 -1.19 -5.04 115.29 116.51 1v9j s HIS 47 Ca -0.30 -0.54 0.04 0.00 -0.15 0.00 0.00 55.06 54.11 1v9j s HIS 47 Cb 0.08 -1.21 -0.02 0.00 1.11 0.00 0.00 32.58 32.54 1v9j s HIS 47 CO 0.49 -0.19 -0.12 0.14 -0.85 0.00 0.00 174.74 174.20 1v9j s VAL 48 N 0.10 0.92 -0.08 -0.90 -7.23 -1.26 -2.66 120.40 109.29 1v9j s VAL 48 Ca -0.06 -0.90 -0.03 0.00 -1.81 0.00 0.00 61.98 59.18 1v9j s VAL 48 Cb -0.12 -0.85 0.04 0.00 0.56 0.00 0.00 36.38 36.01 1v9j s VAL 48 CO 0.03 -0.04 0.15 -1.61 -0.31 0.00 0.00 175.10 173.32 1v9j s GLU 49 N -1.06 0.06 0.05 4.82 2.02 -1.11 -4.97 118.70 118.51 1v9j s GLU 49 Ca -0.00 0.47 0.06 0.00 0.02 0.00 0.00 54.97 55.52 1v9j s GLU 49 Cb -0.07 -0.23 -0.02 0.00 0.10 0.00 0.00 34.13 33.90 1v9j s GLU 49 CO 0.01 -0.24 -0.18 0.54 0.02 0.00 0.00 175.26 175.41 1v9j s VAL 50 N 1.76 1.43 0.15 2.63 0.11 -1.26 -1.00 120.40 124.21 1v9j s VAL 50 Ca -0.03 -1.14 -0.05 0.00 -2.93 0.00 0.00 61.98 57.83 1v9j s VAL 50 Cb -0.12 -1.27 -0.02 0.00 -1.53 0.00 0.00 36.38 33.44 1v9j s VAL 50 CO -0.06 0.10 0.18 -0.70 -3.33 0.00 0.00 175.10 171.29 1v9j s GLU 51 N -1.22 1.04 -0.03 1.54 2.56 -0.87 -4.97 118.70 116.76 1v9j s GLU 51 Ca 0.05 -1.28 -0.00 0.00 0.00 0.00 0.00 54.97 53.73 1v9j s GLU 51 Cb -0.08 0.32 0.03 0.00 2.00 0.00 0.00 34.13 36.39 1v9j s GLU 51 CO 0.02 -0.35 0.03 0.34 -0.56 0.00 0.00 175.26 174.74 1v9j s ASP 52 N -3.00 0.44 -0.52 -1.70 2.15 -1.26 -1.93 116.67 110.85 1v9j s ASP 52 Ca 0.20 0.03 0.01 0.00 0.43 0.00 0.00 52.55 53.22 1v9j s ASP 52 Cb 0.05 -0.13 0.50 0.00 -0.30 0.00 0.00 42.92 43.05 1v9j s ASP 52 CO 0.00 -0.16 1.95 0.35 -0.17 0.00 0.00 175.17 177.15 1v9j n THR 53 N 4.48 3.28 -3.83 1.71 -2.24 -1.25 -4.93 114.28 111.51 1v9j n THR 53 Ca -0.21 -2.28 -0.07 0.00 -2.27 0.00 0.00 64.05 59.22 1v9j n THR 53 Cb 0.50 -0.89 0.01 0.00 -2.10 0.00 0.00 70.33 67.85 1v9j n THR 53 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1v9j s THR 54 N -3.78 0.00 0.00 4.28 2.01 -1.26 -4.85 115.64 112.04 1v9j s THR 54 Ca 0.56 -0.91 0.00 0.00 0.31 0.00 0.00 61.69 61.65 1v9j s THR 54 Cb 0.45 -2.59 0.00 0.00 0.01 0.00 0.00 72.50 70.38 1v9j s THR 54 CO 0.04 0.00 0.00 0.18 -0.69 0.00 0.00 174.62 174.15 1v9j n LEU 55 N -0.53 -0.00 -4.80 4.42 4.77 -1.26 -5.05 117.00 114.55 1v9j n LEU 55 Ca -0.06 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.60 1v9j n LEU 55 Cb 0.60 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.73 1v9j n LEU 55 CO 0.22 -0.50 0.72 0.20 -1.33 0.00 0.00 177.39 176.70 1v9j s ASN 56 N -5.00 5.34 1.09 -1.43 -0.87 -1.26 -5.05 114.94 107.77 1v9j s ASN 56 Ca 0.00 1.80 -0.08 0.00 -1.57 0.00 0.00 52.86 53.01 1v9j s ASN 56 Cb 0.00 -2.52 0.12 0.00 -0.02 0.00 0.00 41.25 38.82 1v9j s ASN 56 CO 0.00 -1.47 0.43 0.54 -2.57 0.00 0.00 177.10 174.03 1v9j n ARG 57 N -2.62 -1.81 -2.34 -0.60 1.74 -1.26 -4.78 116.66 104.98 1v9j n ARG 57 Ca 0.09 -0.68 0.00 0.00 -0.77 0.00 0.00 57.85 56.48 1v9j n ARG 57 Cb 0.53 -0.63 0.00 0.00 -1.02 0.00 0.00 32.46 31.33 1v9j n ARG 57 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1v9j n ALA 59 N 1.83 -3.24 -3.90 0.00 0.00 -1.26 -5.04 120.51 108.91 1v9j n ALA 59 Ca 0.00 0.84 -0.27 0.00 0.00 0.00 0.00 53.44 54.02 1v9j n ALA 59 Cb 0.00 -2.44 -0.17 0.00 0.00 0.00 0.00 19.45 16.84 1v9j n ALA 59 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1v9j s THR 60 N -2.11 1.06 0.47 0.00 2.01 -1.26 -4.95 115.64 110.84 1v9j s THR 60 Ca 0.13 -0.31 -0.11 0.00 0.31 0.00 0.00 61.69 61.71 1v9j s THR 60 Cb -0.04 -1.07 -0.06 0.00 0.01 0.00 0.00 72.50 71.35 1v9j s THR 60 CO 0.76 0.37 0.84 -0.94 -0.69 0.00 0.00 174.62 174.96 1v9j s SER 61 N 1.67 6.45 -0.01 3.53 1.04 -1.26 -2.48 113.70 122.64 1v9j s SER 61 Ca 0.04 1.20 -0.16 0.00 0.48 0.00 0.00 55.95 57.52 1v9j s SER 61 Cb -0.13 -2.36 0.03 0.00 0.10 0.00 0.00 66.02 63.66 1v9j s SER 61 CO -0.08 -0.53 0.33 -0.36 0.98 0.00 0.00 173.24 173.58 1v9j s PHE 62 N -2.59 -0.20 -0.01 5.02 0.08 0.12 -3.86 117.98 116.54 1v9j s PHE 62 Ca 0.52 0.29 0.05 0.00 0.12 0.00 0.00 56.93 57.91 1v9j s PHE 62 Cb -0.10 0.11 -0.01 0.00 -0.57 0.00 0.00 43.02 42.44 1v9j s PHE 62 CO 0.37 -0.41 -0.16 1.03 -0.10 0.00 0.00 175.22 175.95 1v9j s ARG 63 N -1.38 1.28 0.03 0.44 3.00 -0.81 -2.85 118.95 118.66 1v9j s ARG 63 Ca -0.13 -0.60 0.02 0.00 0.00 0.00 0.00 55.73 55.02 1v9j s ARG 63 Cb -0.05 -1.25 -0.02 0.00 0.00 0.00 0.00 34.95 33.64 1v9j s ARG 63 CO 0.04 0.34 -0.08 0.14 0.00 0.00 0.00 175.30 175.74 1v9j s VAL 64 N -0.42 0.57 -0.03 3.52 -7.23 -0.19 -2.05 120.40 114.56 1v9j s VAL 64 Ca 0.06 -0.84 0.02 0.00 -1.81 0.00 0.00 61.98 59.41 1v9j s VAL 64 Cb -0.06 -0.58 0.01 0.00 0.56 0.00 0.00 36.38 36.30 1v9j s VAL 64 CO -0.00 -0.21 -0.07 -0.22 -0.31 0.00 0.00 175.10 174.29 1v9j s LEU 65 N -1.14 1.64 -0.05 1.32 1.98 -0.17 -2.78 118.68 119.49 1v9j s LEU 65 Ca -0.05 -0.15 0.01 0.00 -2.89 0.00 0.00 54.13 51.04 1v9j s LEU 65 Cb -0.08 -0.48 0.02 0.00 0.66 0.00 0.00 46.19 46.32 1v9j s LEU 65 CO 0.00 0.02 -0.03 -0.69 -1.89 0.00 0.00 176.35 173.76 1v9j s VAL 66 N 0.43 0.48 -0.08 1.68 1.01 -0.98 -2.75 120.40 120.18 1v9j s VAL 66 Ca -0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 61.98 61.84 1v9j s VAL 66 Cb -0.10 -0.53 0.03 0.00 0.00 0.00 0.00 36.38 35.77 1v9j s VAL 66 CO 0.00 0.22 -0.01 -0.69 0.00 0.00 0.00 175.10 174.62 1v9j s VAL 67 N 1.10 0.51 -0.07 2.92 1.01 -1.09 -2.86 120.40 121.91 1v9j s VAL 67 Ca -0.08 0.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.63 1v9j s VAL 67 Cb -0.14 -0.64 0.10 0.00 0.00 0.00 0.00 36.38 35.70 1v9j s VAL 67 CO -0.01 0.28 1.35 -0.55 0.00 0.00 0.00 175.10 176.16 1v9j s SER 68 N 1.92 0.00 0.22 3.32 0.15 -1.13 -1.55 113.70 116.63 1v9j s SER 68 Ca 0.05 -0.07 0.24 0.00 0.70 0.00 0.00 55.95 56.87 1v9j s SER 68 Cb -0.12 0.05 0.42 0.00 -1.71 0.00 0.00 66.02 64.65 1v9j s SER 68 CO -0.06 -0.10 1.46 0.00 1.20 0.00 0.00 173.24 175.75 1v9j h ALA 69 N 2.00 0.77 -0.89 5.45 0.00 -1.90 -3.33 119.26 121.36 1v9j h ALA 69 Ca -0.20 0.00 0.22 0.00 0.00 0.00 0.00 54.91 54.93 1v9j h ALA 69 Cb 1.17 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.91 1v9j h ALA 69 CO 0.30 0.00 0.60 -0.22 0.00 0.00 0.00 179.25 179.93 1v9j h LYS 70 N 0.00 0.27 -0.00 0.00 1.63 -1.87 0.34 116.57 116.93 1v9j h LYS 70 Ca 0.00 -0.02 -0.16 0.00 -0.85 0.00 0.00 60.65 59.62 1v9j h LYS 70 Cb 0.84 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 32.39 1v9j h LYS 70 CO 0.00 0.18 -0.76 0.74 -3.45 0.00 0.00 179.45 176.16 1v9j h PHE 71 N 0.27 0.07 -0.13 1.91 0.04 -1.91 -3.13 116.94 114.07 1v9j h PHE 71 Ca 0.45 -0.04 -0.04 0.00 2.80 0.00 0.00 57.97 61.15 1v9j h PHE 71 Cb 1.33 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 39.46 1v9j h PHE 71 CO -0.00 0.79 -0.11 0.93 -0.60 0.00 0.00 178.31 179.32 1v9j h GLU 72 N 0.03 0.19 -0.05 1.51 4.39 -0.53 -2.96 114.58 117.16 1v9j h GLU 72 Ca -0.01 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.65 1v9j h GLU 72 Cb 1.34 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.95 1v9j h GLU 72 CO 0.10 0.31 0.01 0.78 -1.16 0.00 0.00 179.01 179.05 1v9j h GLY 73 N 0.64 0.05 -2.98 -3.84 0.00 -1.43 -3.43 103.07 92.08 1v9j h GLY 73 Ca 0.04 -0.00 -0.47 0.00 0.00 0.00 0.00 47.33 46.90 1v9j h GLY 73 CO 0.02 0.00 -0.31 0.54 0.00 0.00 0.00 176.54 176.79 1v9j s LYS 74 N -6.19 3.47 0.65 4.80 3.01 -1.12 -5.10 119.74 119.26 1v9j s LYS 74 Ca -0.13 -0.53 -0.09 0.00 -1.01 0.00 0.00 55.97 54.21 1v9j s LYS 74 Cb 0.07 -2.78 0.14 0.00 -1.01 0.00 0.00 37.83 34.25 1v9j s LYS 74 CO 0.67 0.29 0.31 -2.30 0.51 0.00 0.00 175.35 174.83 1v9j n PRO 75 N -1.54 -1.54 0.05 -1.68 -0.02 -1.26 -4.67 135.00 124.33 1v9j n PRO 75 Ca -0.07 -0.53 -0.20 0.00 -2.02 0.00 0.00 63.50 60.68 1v9j n PRO 75 Cb 0.56 -0.91 -0.15 0.00 -0.02 0.00 0.00 33.50 32.99 1v9j n PRO 75 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1v9j h LEU 76 N 0.00 0.49 -0.45 2.45 5.85 -1.97 -2.95 115.31 118.74 1v9j h LEU 76 Ca -0.14 -0.95 -0.17 0.00 0.84 0.00 0.00 57.88 57.46 1v9j h LEU 76 Cb 0.48 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 1v9j h LEU 76 CO 0.09 1.40 -0.78 0.17 -0.34 0.00 0.00 178.44 178.98 1v9j h LEU 77 N -0.34 0.10 -0.11 2.25 8.10 -1.99 -3.04 115.31 120.28 1v9j h LEU 77 Ca -0.14 -0.08 -0.02 0.00 0.11 0.00 0.00 57.88 57.75 1v9j h LEU 77 Cb 1.65 -0.03 -0.00 0.00 -0.44 0.00 0.00 40.66 41.84 1v9j h LEU 77 CO 0.16 0.83 -0.01 -0.61 -4.11 0.00 0.00 178.44 174.70 1v9j h GLN 78 N 0.05 0.21 -0.88 0.17 5.75 -1.91 -2.64 115.11 115.85 1v9j h GLN 78 Ca -0.02 -0.07 0.02 0.00 -0.15 0.00 0.00 58.65 58.43 1v9j h GLN 78 Cb 1.36 -0.01 -0.05 0.00 1.07 0.00 0.00 27.48 29.85 1v9j h GLN 78 CO 0.11 0.49 0.58 0.07 -2.65 0.00 0.00 178.83 177.43 1v9j h ARG 79 N -0.09 1.13 -0.81 1.69 0.11 -1.57 -1.73 114.38 113.10 1v9j h ARG 79 Ca 0.03 -0.07 -0.03 0.00 0.10 0.00 0.00 59.98 60.02 1v9j h ARG 79 Cb 0.40 -0.25 -0.04 0.00 1.11 0.00 0.00 29.97 31.19 1v9j h ARG 79 CO 0.01 0.75 0.41 0.45 0.10 0.00 0.00 179.97 181.68 1v9j h HIS 80 N 1.16 1.15 -0.03 4.08 3.86 -1.44 -2.21 115.15 121.72 1v9j h HIS 80 Ca 0.33 -0.04 -0.12 0.00 -1.16 0.00 0.00 60.37 59.38 1v9j h HIS 80 Cb -0.08 -0.36 -0.01 0.00 1.06 0.00 0.00 27.41 28.01 1v9j h HIS 80 CO -0.00 0.82 -0.52 0.00 0.86 0.00 0.00 177.93 179.09 1v9j h ARG 81 N 1.15 0.07 -0.51 2.45 3.08 -1.00 -2.99 114.38 116.63 1v9j h ARG 81 Ca 0.28 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.31 1v9j h ARG 81 Cb 0.09 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 1v9j h ARG 81 CO -0.04 0.58 0.31 -0.07 -1.07 0.00 0.00 179.97 179.68 1v9j h LEU 82 N 0.06 0.50 -0.78 3.04 3.38 -0.70 0.75 115.31 121.56 1v9j h LEU 82 Ca -0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1v9j h LEU 82 Cb 0.94 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1v9j h LEU 82 CO 0.07 0.36 -0.23 0.58 0.09 0.00 0.00 178.44 179.31 1v9j h VAL 83 N 0.62 1.27 -0.05 1.22 2.07 -1.47 -2.57 116.25 117.34 1v9j h VAL 83 Ca 0.20 -1.31 -0.23 0.00 0.82 0.00 0.00 66.70 66.18 1v9j h VAL 83 Cb 0.01 1.26 0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1v9j h VAL 83 CO -0.08 0.43 -0.89 0.78 0.02 0.00 0.00 177.57 177.83 1v9j h ASN 84 N 0.59 0.69 0.10 0.57 2.35 -1.28 -2.92 115.58 115.67 1v9j h ASN 84 Ca 0.08 -0.51 -0.00 0.00 -0.55 0.00 0.00 56.30 55.32 1v9j h ASN 84 Cb 0.71 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.87 1v9j h ASN 84 CO 0.05 1.30 -0.06 -0.33 -1.65 0.00 0.00 177.43 176.74 1v9j h GLU 85 N 0.34 -0.15 -0.94 0.81 5.08 0.61 0.27 114.58 120.61 1v9j h GLU 85 Ca -0.08 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1v9j h GLU 85 Cb 1.52 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 30.75 1v9j h GLU 85 CO 0.16 -0.10 0.62 0.00 -1.00 0.00 0.00 179.01 178.70 1v9j n LEU 87 N -4.39 6.01 -0.18 0.00 7.99 -1.02 -4.50 117.00 120.91 1v9j n LEU 87 Ca 0.11 -3.16 -0.08 0.00 -0.01 0.00 0.00 56.01 52.87 1v9j n LEU 87 Cb 0.02 -0.76 0.01 0.00 -0.11 0.00 0.00 43.42 42.58 1v9j n LEU 87 CO 0.37 0.85 0.93 0.00 -1.51 0.00 0.00 177.39 178.03 1v9j h ALA 88 N 2.10 0.68 -0.04 -1.18 0.00 0.59 0.83 119.26 122.23 1v9j h ALA 88 Ca 0.37 -0.18 -0.23 0.00 0.00 0.00 0.00 54.91 54.86 1v9j h ALA 88 Cb 2.40 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 20.00 1v9j h ALA 88 CO 0.80 0.33 -0.89 0.93 0.00 0.00 0.00 179.25 180.43 1v9j h GLU 89 N 0.71 0.68 -0.01 0.00 5.08 -1.80 -3.29 114.58 115.94 1v9j h GLU 89 Ca 0.17 -0.67 -0.19 0.00 -1.00 0.00 0.00 59.36 57.67 1v9j h GLU 89 Cb 0.26 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1v9j h GLU 89 CO -0.01 1.27 -0.82 0.93 -1.00 0.00 0.00 179.01 179.38 1v9j h GLU 90 N 0.35 0.19 -0.54 2.33 3.07 -1.84 -3.34 114.58 114.79 1v9j h GLU 90 Ca -0.10 -0.19 0.08 0.00 -0.50 0.00 0.00 59.36 58.66 1v9j h GLU 90 Cb 1.54 0.05 -0.10 0.00 -0.84 0.00 0.00 28.75 29.40 1v9j h GLU 90 CO 0.18 0.91 -0.45 -0.07 -1.40 0.00 0.00 179.01 178.17 1v9j h LEU 91 N 0.11 -1.54 -1.40 1.33 3.38 0.63 0.53 115.31 118.36 1v9j h LEU 91 Ca -0.03 0.24 0.37 0.00 0.09 0.00 0.00 57.88 58.55 1v9j h LEU 91 Cb 1.43 0.69 -0.11 0.00 0.09 0.00 0.00 40.66 42.75 1v9j h LEU 91 CO 0.12 -0.35 0.78 -0.65 0.09 0.00 0.00 178.44 178.44 1v9j h PRO 92 N -0.26 0.19 -0.01 1.13 0.11 -1.71 0.97 132.00 132.43 1v9j h PRO 92 Ca 0.16 -0.01 -0.17 0.00 0.11 0.00 0.00 66.00 66.09 1v9j h PRO 92 Cb 0.57 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.62 1v9j h PRO 92 CO -0.67 0.12 -0.78 0.45 -0.21 0.00 0.00 178.00 176.92 1v9j h HIS 93 N 0.19 0.11 -3.14 0.65 3.86 -1.11 -3.43 115.15 112.29 1v9j h HIS 93 Ca 0.73 -0.06 -0.57 0.00 -1.16 0.00 0.00 60.37 59.32 1v9j h HIS 93 Cb 2.18 -0.01 -0.05 0.00 1.06 0.00 0.00 27.41 30.59 1v9j h HIS 93 CO -0.00 0.82 1.02 0.42 0.86 0.00 0.00 177.93 181.05 1v9j s ILE 94 N -3.30 4.01 0.40 2.45 -1.09 0.34 -4.71 121.20 119.30 1v9j s ILE 94 Ca -0.01 1.11 0.07 0.00 -2.23 0.00 0.00 60.65 59.59 1v9j s ILE 94 Cb 0.11 -4.11 0.23 0.00 -1.58 0.00 0.00 42.46 37.11 1v9j s ILE 94 CO 0.80 -0.54 2.02 -0.74 -1.23 0.00 0.00 174.94 175.25 1v9j h HIS 95 N 9.91 0.46 -2.42 3.97 2.76 -1.72 -3.41 115.15 124.71 1v9j h HIS 95 Ca -0.27 -0.01 -0.16 0.00 -2.20 0.00 0.00 60.37 57.73 1v9j h HIS 95 Cb 1.11 -0.15 -0.30 0.00 1.55 0.00 0.00 27.41 29.62 1v9j h HIS 95 CO 0.91 0.35 -0.46 0.00 -1.30 0.00 0.00 177.93 177.43 1v9j s ALA 96 N -5.29 -0.92 -0.19 5.26 0.00 -1.25 -4.94 121.76 114.43 1v9j s ALA 96 Ca -0.08 1.09 -0.01 0.00 0.00 0.00 0.00 51.96 52.97 1v9j s ALA 96 Cb 0.17 -1.35 0.01 0.00 0.00 0.00 0.00 23.12 21.94 1v9j s ALA 96 CO 0.73 -0.91 -0.14 0.12 0.00 0.00 0.00 175.76 175.56 1v9j s PHE 97 N 2.52 2.84 -0.12 0.00 2.19 -1.26 -0.71 117.98 123.45 1v9j s PHE 97 Ca 0.04 -1.33 -0.00 0.00 0.33 0.00 0.00 56.93 55.96 1v9j s PHE 97 Cb -0.13 -1.98 0.02 0.00 -1.31 0.00 0.00 43.02 39.62 1v9j s PHE 97 CO -0.13 -0.68 -0.08 -2.00 1.83 0.00 0.00 175.22 174.16 1v9j s GLU 98 N 1.30 1.61 0.00 10.12 2.12 -1.13 -5.05 118.70 127.67 1v9j s GLU 98 Ca 0.04 -0.29 0.05 0.00 0.36 0.00 0.00 54.97 55.13 1v9j s GLU 98 Cb -0.14 -1.65 -0.02 0.00 0.26 0.00 0.00 34.13 32.59 1v9j s GLU 98 CO -0.08 -0.27 -0.17 1.14 -0.54 0.00 0.00 175.26 175.35 1v9j s GLN 99 N 1.68 1.28 -0.13 4.30 1.03 -1.26 -1.03 119.66 125.54 1v9j s GLN 99 Ca 0.05 -0.66 -0.00 0.00 0.04 0.00 0.00 55.36 54.79 1v9j s GLN 99 Cb -0.13 -1.27 0.02 0.00 0.03 0.00 0.00 33.01 31.67 1v9j s GLN 99 CO -0.09 0.34 -0.10 0.21 -2.54 0.00 0.00 175.29 173.11 1v9j s LYS 100 N -0.61 1.86 -0.11 9.60 2.20 -1.12 -5.02 119.74 126.55 1v9j s LYS 100 Ca 0.06 -0.39 -0.02 0.00 -0.36 0.00 0.00 55.97 55.26 1v9j s LYS 100 Cb -0.07 -1.81 -0.03 0.00 -1.51 0.00 0.00 37.83 34.41 1v9j s LYS 100 CO -0.00 -0.25 -0.04 0.95 -0.36 0.00 0.00 175.35 175.65 1v9j s THR 101 N 1.61 3.90 0.15 3.43 -4.23 -1.26 -2.32 115.64 116.92 1v9j s THR 101 Ca 0.05 -0.38 -0.11 0.00 -1.18 0.00 0.00 61.69 60.07 1v9j s THR 101 Cb -0.13 -2.66 0.00 0.00 1.34 0.00 0.00 72.50 71.06 1v9j s THR 101 CO -0.09 0.55 0.33 -0.76 -0.54 0.00 0.00 174.62 174.10 1v9j s LEU 102 N -0.26 0.81 0.49 4.79 1.43 -1.14 -5.05 118.68 119.74 1v9j s LEU 102 Ca 0.04 -0.70 -0.18 0.00 -1.03 0.00 0.00 54.13 52.27 1v9j s LEU 102 Cb -0.13 1.42 -0.09 0.00 0.03 0.00 0.00 46.19 47.43 1v9j s LEU 102 CO 0.02 -0.89 0.97 0.42 0.23 0.00 0.00 176.35 177.10 1v9j s THR 103 N -3.91 4.50 0.14 5.49 -4.23 -1.26 -2.84 115.64 113.52 1v9j s THR 103 Ca 0.12 1.28 -0.24 0.00 -1.18 0.00 0.00 61.69 61.66 1v9j s THR 103 Cb 0.03 -3.68 -0.01 0.00 1.34 0.00 0.00 72.50 70.17 1v9j s THR 103 CO -0.04 -0.57 1.63 -0.65 -0.54 0.00 0.00 174.62 174.45 1v9j h PRO 104 N 1.23 -0.32 -0.66 3.99 0.11 -1.89 -1.35 132.00 133.10 1v9j h PRO 104 Ca -0.47 0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.68 1v9j h PRO 104 Cb 1.18 0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 1v9j h PRO 104 CO 0.61 -0.22 0.44 0.93 -0.21 0.00 0.00 178.00 179.55 1v9j h GLU 105 N -0.33 0.82 -0.54 1.05 5.08 -1.96 0.78 114.58 119.48 1v9j h GLU 105 Ca 0.10 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1v9j h GLU 105 Cb 0.49 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.53 1v9j h GLU 105 CO -0.33 0.54 0.32 1.96 -1.00 0.00 0.00 179.01 180.51 1v9j h GLN 106 N 0.84 0.73 -0.03 2.33 1.08 -1.67 -2.37 115.11 116.02 1v9j h GLN 106 Ca 0.25 -0.07 -0.20 0.00 -1.45 0.00 0.00 58.65 57.18 1v9j h GLN 106 Cb -0.02 -0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 27.25 1v9j h GLN 106 CO -0.06 0.53 -0.84 2.35 -0.95 0.00 0.00 178.83 179.86 1v9j h TRP 107 N 0.72 0.53 -0.23 2.96 2.91 -0.71 -3.09 115.95 119.05 1v9j h TRP 107 Ca 0.19 -0.26 0.04 0.00 1.13 0.00 0.00 58.89 59.99 1v9j h TRP 107 Cb -0.01 -0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 28.56 1v9j h TRP 107 CO -0.02 1.05 0.16 1.15 -1.03 0.00 0.00 178.44 179.75 1v9j h THR 108 N 0.23 0.96 0.03 2.65 2.02 -0.57 -1.16 112.91 117.07 1v9j h THR 108 Ca -0.05 -0.05 -0.23 0.00 0.77 0.00 0.00 66.41 66.85 1v9j h THR 108 Cb 1.45 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 68.64 1v9j h THR 108 CO 0.14 0.03 -1.06 0.03 0.37 0.00 0.00 175.52 175.03 1v9j h ARG 109 N 0.15 0.08 -1.61 6.66 3.08 -1.39 -3.30 114.38 118.04 1v9j h ARG 109 Ca 0.10 -0.13 -0.70 0.00 0.07 0.00 0.00 59.98 59.32 1v9j h ARG 109 Cb 0.22 0.05 -0.26 0.00 0.08 0.00 0.00 29.97 30.05 1v9j h ARG 109 CO -0.01 1.05 0.92 1.04 -1.07 0.00 0.00 179.97 181.90 1v9j n GLN 110 N -3.41 2.66 -1.20 0.04 6.02 -0.45 -4.65 117.38 116.39 1v9j n GLN 110 Ca -0.02 -3.26 -0.29 0.00 -0.01 0.00 0.00 57.00 53.41 1v9j n GLN 110 Cb 0.96 -2.24 0.08 0.00 1.02 0.00 0.00 30.24 30.05 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 -0.54 2.41 -2.79 -1.09 5.12 -1.12 -4.96 116.66 113.70 1v9j n ARG 111 Ca 0.56 -2.80 -0.40 0.00 -1.93 0.00 0.00 57.85 53.27 1v9j n ARG 111 Cb 0.43 -2.10 -0.05 0.00 -1.16 0.00 0.00 32.46 29.58 1v9j n ARG 111 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 1v9j s ARG 112 N -3.24 4.72 0.00 5.56 3.52 -1.26 -5.14 118.95 123.10 1v9j s ARG 112 Ca 0.55 1.39 0.32 0.00 -0.13 0.00 0.00 55.73 57.86 1v9j s ARG 112 Cb 0.44 -3.33 1.84 0.00 -1.56 0.00 0.00 34.95 32.33 1v9j s ARG 112 CO 0.00 0.35 2.19 0.39 -0.81 0.00 0.00 175.30 177.43