#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 0.28 -0.54 0.03 2.20 -1.26 -5.04 119.74 115.42 1v9j s LYS 2 Ca 0.00 -0.14 -0.03 0.00 -0.36 0.00 0.00 55.97 55.44 1v9j s LYS 2 Cb 0.00 0.11 0.15 0.00 -1.51 0.00 0.00 37.83 36.58 1v9j s LYS 2 CO 0.00 -0.13 2.53 0.41 -0.36 0.00 0.00 175.35 177.80 1v9j n GLY 3 N -0.32 4.65 2.95 5.54 0.00 -1.26 -4.89 105.19 111.85 1v9j n GLY 3 Ca -0.05 -1.98 -0.10 0.00 0.00 0.00 0.00 46.02 43.89 1v9j n GLY 3 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1v9j s SER 4 N -0.06 0.13 -0.30 1.61 0.15 -1.26 -5.13 113.70 108.84 1v9j s SER 4 Ca 0.56 -0.27 0.06 0.00 0.70 0.00 0.00 55.95 57.00 1v9j s SER 4 Cb 0.39 0.08 0.20 0.00 -1.71 0.00 0.00 66.02 64.97 1v9j s SER 4 CO -0.24 -0.18 0.59 -0.44 1.20 0.00 0.00 173.24 174.16 1v9j s SER 5 N -0.86 -1.55 0.44 5.45 0.01 -1.26 -5.09 113.70 110.84 1v9j s SER 5 Ca -0.09 0.08 0.00 0.00 1.31 0.00 0.00 55.95 57.25 1v9j s SER 5 Cb -0.06 2.00 0.00 0.00 0.21 0.00 0.00 66.02 68.17 1v9j s SER 5 CO -0.00 -0.29 0.00 1.41 0.41 0.00 0.00 173.24 174.76 1v9j n HIS 6 N 5.33 -3.70 -3.70 2.43 8.25 -1.26 -4.78 115.22 117.79 1v9j n HIS 6 Ca 0.05 1.91 -0.29 0.00 -0.26 0.00 0.00 57.72 59.13 1v9j n HIS 6 Cb 0.54 -3.36 -0.13 0.00 1.12 0.00 0.00 29.99 28.16 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 -2.96 2.08 0.34 4.41 3.76 -1.26 -5.09 115.29 116.57 1v9j s HIS 7 Ca 0.00 -2.52 -0.15 0.00 -0.15 0.00 0.00 55.06 52.24 1v9j s HIS 7 Cb 0.00 -1.89 0.03 0.00 1.11 0.00 0.00 32.58 31.83 1v9j s HIS 7 CO 0.00 -0.76 0.70 -3.38 -0.85 0.00 0.00 174.74 170.45 1v9j s HIS 8 N 0.13 0.18 0.41 1.40 -3.43 -1.26 -5.19 115.29 107.53 1v9j s HIS 8 Ca 0.20 -0.71 0.03 0.00 -0.80 0.00 0.00 55.06 53.78 1v9j s HIS 8 Cb -0.19 0.63 -0.03 0.00 -1.43 0.00 0.00 32.58 31.56 1v9j s HIS 8 CO -0.03 -1.38 0.10 -1.01 -2.00 0.00 0.00 174.74 170.41 1v9j s HIS 9 N -2.99 1.84 0.47 0.38 3.76 -1.26 -5.08 115.29 112.40 1v9j s HIS 9 Ca 0.17 -1.17 0.00 0.00 -0.15 0.00 0.00 55.06 53.91 1v9j s HIS 9 Cb -0.04 -1.26 0.00 0.00 1.11 0.00 0.00 32.58 32.38 1v9j s HIS 9 CO 0.11 -0.15 0.00 1.58 -0.85 0.00 0.00 174.74 175.43 1v9j n HIS 10 N -0.94 -3.99 -2.54 1.40 -0.00 -1.26 -4.97 115.22 102.92 1v9j n HIS 10 Ca -0.08 2.12 -0.04 0.00 -0.00 0.00 0.00 57.72 59.72 1v9j n HIS 10 Cb 0.66 -3.29 -0.04 0.00 -0.00 0.00 0.00 29.99 27.32 1v9j n HIS 10 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 1v9j n HIS 11 N -0.84 -4.66 -2.97 1.57 -0.00 -1.26 -4.89 115.22 102.17 1v9j n HIS 11 Ca 0.00 2.73 -0.43 0.00 -0.00 0.00 0.00 57.72 60.02 1v9j n HIS 11 Cb 0.00 -3.95 -0.05 0.00 -0.00 0.00 0.00 29.99 26.00 1v9j n HIS 11 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.34 175.22 1v9j s SER 12 N -0.65 6.26 -0.10 0.26 0.01 -1.26 -4.89 113.70 113.33 1v9j s SER 12 Ca -0.22 -0.72 -0.19 0.00 1.31 0.00 0.00 55.95 56.13 1v9j s SER 12 Cb 0.01 -2.37 -0.28 0.00 0.21 0.00 0.00 66.02 63.60 1v9j s SER 12 CO 0.60 -1.13 0.65 0.28 0.41 0.00 0.00 173.24 174.05 1v9j h SER 13 N 9.23 0.36 -3.49 2.44 0.02 -2.00 -3.45 113.55 116.65 1v9j h SER 13 Ca -0.27 -0.87 -0.64 0.00 -0.84 0.00 0.00 61.79 59.17 1v9j h SER 13 Cb 1.08 -0.12 -0.20 0.00 0.14 0.00 0.00 62.40 63.31 1v9j h SER 13 CO 1.06 1.50 -0.61 -0.83 -1.14 0.00 0.00 176.83 176.81 1v9j s GLY 14 N -4.75 1.81 0.00 -3.77 0.00 -1.26 -4.77 107.32 94.58 1v9j s GLY 14 Ca -0.19 -0.95 0.00 0.00 0.00 0.00 0.00 44.72 43.58 1v9j s GLY 14 CO 0.77 0.29 0.00 0.00 0.00 0.00 0.00 173.10 174.16 1v9j n ALA 15 N 4.26 0.00 -3.08 3.20 0.00 -1.26 -5.11 120.51 118.51 1v9j n ALA 15 Ca -0.16 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.16 1v9j n ALA 15 Cb 0.52 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.90 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 -1.55 -0.21 0.15 0.00 0.01 -1.26 -5.18 113.70 105.66 1v9j s SER 16 Ca 0.00 -0.10 0.04 0.00 1.31 0.00 0.00 55.95 57.21 1v9j s SER 16 Cb 0.00 0.39 -0.04 0.00 0.21 0.00 0.00 66.02 66.58 1v9j s SER 16 CO 0.00 -0.64 -0.09 -0.76 0.41 0.00 0.00 173.24 172.15 1v9j s LEU 17 N -2.04 2.51 0.10 2.44 1.02 -1.26 -5.15 118.68 116.30 1v9j s LEU 17 Ca -0.05 -1.02 -0.11 0.00 0.02 0.00 0.00 54.13 52.97 1v9j s LEU 17 Cb -0.01 -0.33 0.01 0.00 0.02 0.00 0.00 46.19 45.88 1v9j s LEU 17 CO -0.03 -0.35 0.25 0.68 0.02 0.00 0.00 176.35 176.93 1v9j s VAL 18 N -3.34 0.12 0.55 -1.59 -7.23 -1.26 -5.15 120.40 102.50 1v9j s VAL 18 Ca 0.17 -1.00 -0.19 0.00 -1.81 0.00 0.00 61.98 59.15 1v9j s VAL 18 Cb 0.03 -1.29 -0.08 0.00 0.56 0.00 0.00 36.38 35.61 1v9j s VAL 18 CO 0.01 -0.55 0.79 -2.65 -0.31 0.00 0.00 175.10 172.39 1v9j n PRO 19 N -0.11 0.81 -0.08 4.82 -0.02 -1.26 -4.98 135.00 134.19 1v9j n PRO 19 Ca -0.15 0.31 -0.10 0.00 -2.02 0.00 0.00 63.50 61.54 1v9j n PRO 19 Cb 0.63 -1.94 -0.03 0.00 -0.02 0.00 0.00 33.50 32.13 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 -0.39 0.46 -1.48 -0.52 1.74 -1.26 -5.12 116.66 110.09 1v9j n ARG 20 Ca 0.12 0.18 -0.01 0.00 -0.77 0.00 0.00 57.85 57.38 1v9j n ARG 20 Cb 0.46 -1.30 -0.00 0.00 -1.02 0.00 0.00 32.46 30.59 1v9j n ARG 20 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1v9j n GLY 21 N 1.73 -3.25 3.99 -0.13 0.00 -1.26 -5.07 105.19 101.19 1v9j n GLY 21 Ca -0.16 -0.23 -0.19 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.09 5.79 -0.28 1.61 0.01 -1.26 -4.84 113.70 114.64 1v9j s SER 22 Ca -0.03 -0.18 -0.02 0.00 1.31 0.00 0.00 55.95 57.04 1v9j s SER 22 Cb 0.00 -1.07 0.01 0.00 0.21 0.00 0.00 66.02 65.17 1v9j s SER 22 CO 0.07 -0.63 0.04 1.21 0.41 0.00 0.00 173.24 174.33 1v9j n GLU 23 N -1.83 -3.59 -0.99 12.44 2.13 -1.26 -4.90 120.64 122.65 1v9j n GLU 23 Ca 0.03 2.85 -0.16 0.00 0.66 0.00 0.00 57.16 60.54 1v9j n GLU 23 Cb 0.58 -5.25 0.18 0.00 0.27 0.00 0.00 31.44 27.23 1v9j n GLU 23 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1v9j n GLY 24 N 0.83 3.89 1.38 8.31 0.00 -1.26 -4.36 105.19 113.97 1v9j n GLY 24 Ca -0.06 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.07 1v9j n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v9j n ALA 25 N -0.66 2.05 -2.26 4.61 0.00 -1.26 -5.04 120.51 117.95 1v9j n ALA 25 Ca 0.46 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.71 1v9j n ALA 25 Cb 1.42 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.85 1v9j n ALA 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v9j n ALA 26 N -2.19 -0.53 0.18 0.00 0.00 -1.26 -4.86 120.51 111.85 1v9j n ALA 26 Ca 0.00 0.17 0.12 0.00 0.00 0.00 0.00 53.44 53.73 1v9j n ALA 26 Cb 0.00 -2.03 0.65 0.00 0.00 0.00 0.00 19.45 18.07 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 0.00 0.92 0.00 0.00 1.35 -1.97 -2.88 112.91 110.34 1v9j h THR 27 Ca -0.44 -0.00 -0.13 0.00 -0.55 0.00 0.00 66.41 65.28 1v9j h THR 27 Cb 1.32 0.91 -0.02 0.00 -1.73 0.00 0.00 68.15 68.63 1v9j h THR 27 CO 0.54 0.00 -1.63 0.23 -0.25 0.00 0.00 175.52 174.41 1v9j n MET 28 N -4.49 1.74 -2.64 4.72 2.81 -1.26 -5.09 117.12 112.90 1v9j n MET 28 Ca 0.01 -0.03 -0.02 0.00 -1.81 0.00 0.00 57.70 55.85 1v9j n MET 28 Cb 0.24 -1.26 -0.01 0.00 -0.71 0.00 0.00 33.22 31.48 1v9j n MET 28 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1v9j n GLU 29 N -2.22 -3.72 -2.30 0.03 2.13 -1.09 -4.81 120.64 108.66 1v9j n GLU 29 Ca -0.12 2.92 0.00 0.00 0.66 0.00 0.00 57.16 60.62 1v9j n GLU 29 Cb 0.66 -5.17 0.00 0.00 0.27 0.00 0.00 31.44 27.20 1v9j n GLU 29 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1v9j n LEU 30 N 0.96 -6.55 -4.89 4.31 4.32 -1.26 -5.04 117.00 108.85 1v9j n LEU 30 Ca -0.12 2.94 -0.22 0.00 -0.02 0.00 0.00 56.01 58.59 1v9j n LEU 30 Cb 0.19 -3.24 -0.02 0.00 -1.62 0.00 0.00 43.42 38.73 1v9j n LEU 30 CO 0.42 -2.72 0.03 -0.44 -1.22 0.00 0.00 177.39 173.46 1v9j s SER 31 N -0.58 4.98 -0.02 -1.43 0.01 -1.26 -5.05 113.70 110.35 1v9j s SER 31 Ca 0.00 -0.83 -0.24 0.00 1.31 0.00 0.00 55.95 56.19 1v9j s SER 31 Cb 0.00 -0.36 -0.17 0.00 0.21 0.00 0.00 66.02 65.70 1v9j s SER 31 CO 0.00 -0.76 1.12 0.00 0.41 0.00 0.00 173.24 174.00 1v9j h ALA 32 N 0.94 -0.29 -0.02 1.44 0.00 -1.96 -3.08 119.26 116.28 1v9j h ALA 32 Ca -0.40 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1v9j h ALA 32 Cb 1.27 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 1v9j h ALA 32 CO 0.56 -0.43 0.02 0.22 0.00 0.00 0.00 179.25 179.62 1v9j h ASP 33 N -0.75 0.01 0.66 0.00 3.58 -1.95 -1.74 116.42 116.23 1v9j h ASP 33 Ca -0.03 -0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.39 1v9j h ASP 33 Cb 0.50 -0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.55 1v9j h ASP 33 CO 0.05 0.01 -0.37 0.22 -2.88 0.00 0.00 179.24 176.27 1v9j h TYR 34 N 0.01 -0.97 -0.07 0.28 3.20 -1.96 0.28 116.97 117.75 1v9j h TYR 34 Ca 0.01 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.80 1v9j h TYR 34 Cb 0.02 0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 1v9j h TYR 34 CO -0.00 -0.57 -0.26 -0.07 -1.64 0.00 0.00 178.16 175.62 1v9j h LEU 35 N -0.96 0.12 0.28 2.82 3.38 -1.41 -2.17 115.31 117.37 1v9j h LEU 35 Ca -0.08 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1v9j h LEU 35 Cb 0.76 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1v9j h LEU 35 CO 0.11 0.38 -0.13 -0.09 0.09 0.00 0.00 178.44 178.80 1v9j h ARG 36 N 0.11 -0.36 -0.10 1.13 2.43 -1.03 -1.88 114.38 114.67 1v9j h ARG 36 Ca 0.02 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1v9j h ARG 36 Cb 0.52 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.15 1v9j h ARG 36 CO 0.04 -0.02 0.07 0.93 -1.51 0.00 0.00 179.97 179.47 1v9j h GLU 37 N -0.78 0.08 0.49 0.20 5.08 -0.39 -0.57 114.58 118.68 1v9j h GLU 37 Ca -0.04 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1v9j h GLU 37 Cb 0.51 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1v9j h GLU 37 CO 0.06 0.05 -0.23 -0.22 -1.00 0.00 0.00 179.01 177.67 1v9j h LYS 38 N 0.08 -0.63 -0.35 2.33 3.64 -1.32 -2.81 116.57 117.50 1v9j h LYS 38 Ca 0.04 0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.50 1v9j h LYS 38 Cb 0.07 0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 1v9j h LYS 38 CO -0.01 -0.36 0.24 -0.07 -2.27 0.00 0.00 179.45 176.98 1v9j h LEU 39 N -1.11 0.28 0.32 5.20 3.38 -1.16 0.24 115.31 122.46 1v9j h LEU 39 Ca -0.07 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1v9j h LEU 39 Cb 0.55 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1v9j h LEU 39 CO 0.11 0.19 -0.16 -0.09 0.09 0.00 0.00 178.44 178.58 1v9j h ARG 40 N 0.32 -0.43 -0.01 1.13 2.43 -1.11 -1.00 114.38 115.71 1v9j h ARG 40 Ca 0.15 0.03 -0.18 0.00 -0.81 0.00 0.00 59.98 59.17 1v9j h ARG 40 Cb 0.20 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 1v9j h ARG 40 CO -0.03 -0.29 -0.81 -0.56 -1.51 0.00 0.00 179.97 176.77 1v9j h GLN 41 N -0.44 0.16 0.20 0.20 3.07 -1.19 0.82 115.11 117.93 1v9j h GLN 41 Ca -0.04 -0.16 -0.00 0.00 0.09 0.00 0.00 58.65 58.53 1v9j h GLN 41 Cb 0.35 0.04 -0.01 0.00 0.08 0.00 0.00 27.48 27.94 1v9j h GLN 41 CO 0.07 0.88 -0.14 0.22 0.09 0.00 0.00 178.83 179.95 1v9j h ASP 42 N 0.10 -0.36 0.06 0.06 3.58 -0.37 -3.07 116.42 116.41 1v9j h ASP 42 Ca -0.03 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1v9j h ASP 42 Cb 1.41 0.11 0.00 0.00 1.72 0.00 0.00 39.33 42.57 1v9j h ASP 42 CO 0.12 -0.22 -0.64 0.18 -2.88 0.00 0.00 179.24 175.79 1v9j n LEU 43 N -5.26 1.44 -3.04 2.28 4.77 -0.39 -4.97 117.00 111.83 1v9j n LEU 43 Ca -0.08 -0.55 -0.22 0.00 -0.03 0.00 0.00 56.01 55.12 1v9j n LEU 43 Cb 0.18 -0.03 0.03 0.00 -2.33 0.00 0.00 43.42 41.27 1v9j n LEU 43 CO 0.33 0.29 -0.01 -0.62 -1.33 0.00 0.00 177.39 176.05 1v9j n GLU 44 N -0.73 -4.70 -0.57 3.23 1.02 0.28 -4.78 120.64 114.39 1v9j n GLU 44 Ca 0.07 0.87 -0.30 0.00 -0.02 0.00 0.00 57.16 57.79 1v9j n GLU 44 Cb 0.40 -5.72 0.22 0.00 -0.02 0.00 0.00 31.44 26.31 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 -3.52 -2.36 -0.04 0.62 0.00 -0.85 -4.97 120.51 109.39 1v9j n ALA 45 Ca -0.11 -0.97 -0.01 0.00 0.00 0.00 0.00 53.44 52.35 1v9j n ALA 45 Cb 0.62 -2.01 -0.00 0.00 0.00 0.00 0.00 19.45 18.05 1v9j n ALA 45 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1v9j h GLU 46 N -2.34 0.00 -6.21 0.00 4.81 -1.56 -3.48 114.58 105.80 1v9j h GLU 46 Ca -0.54 0.00 -0.61 0.00 -0.13 0.00 0.00 59.36 58.08 1v9j h GLU 46 Cb 1.31 0.00 -0.27 0.00 0.63 0.00 0.00 28.75 30.43 1v9j h GLU 46 CO 0.45 0.00 -0.85 -1.58 -0.73 0.00 0.00 179.01 176.30 1v9j s HIS 47 N -1.58 1.93 0.07 0.92 2.46 -1.17 -5.03 115.29 112.88 1v9j s HIS 47 Ca -0.04 -0.38 -0.08 0.00 0.47 0.00 0.00 55.06 55.03 1v9j s HIS 47 Cb 0.01 -1.17 -0.00 0.00 -0.13 0.00 0.00 32.58 31.28 1v9j s HIS 47 CO 0.06 0.07 0.16 0.14 -2.47 0.00 0.00 174.74 172.70 1v9j s VAL 48 N -0.73 0.14 -0.17 0.89 -7.23 -1.26 -2.43 120.40 109.61 1v9j s VAL 48 Ca 0.08 -1.15 -0.06 0.00 -1.81 0.00 0.00 61.98 59.04 1v9j s VAL 48 Cb -0.09 -1.20 0.08 0.00 0.56 0.00 0.00 36.38 35.73 1v9j s VAL 48 CO 0.01 -0.63 0.36 -0.70 -0.31 0.00 0.00 175.10 173.82 1v9j s GLU 49 N -3.41 0.26 0.22 4.82 2.12 -1.11 -4.92 118.70 116.68 1v9j s GLU 49 Ca 0.02 0.90 0.06 0.00 0.36 0.00 0.00 54.97 56.31 1v9j s GLU 49 Cb 0.03 0.16 -0.04 0.00 0.26 0.00 0.00 34.13 34.55 1v9j s GLU 49 CO -0.08 -0.25 0.19 0.54 -0.54 0.00 0.00 175.26 175.11 1v9j s VAL 50 N 2.41 4.55 0.18 3.70 0.11 -1.26 -0.67 120.40 129.41 1v9j s VAL 50 Ca -0.01 -1.26 -0.03 0.00 -2.93 0.00 0.00 61.98 57.75 1v9j s VAL 50 Cb -0.12 -3.41 -0.03 0.00 -1.53 0.00 0.00 36.38 31.29 1v9j s VAL 50 CO -0.11 -0.27 0.15 -0.70 -3.33 0.00 0.00 175.10 170.84 1v9j s GLU 51 N -3.61 1.14 -0.15 1.54 2.12 0.14 -4.95 118.70 114.92 1v9j s GLU 51 Ca 0.32 -1.49 -0.08 0.00 0.36 0.00 0.00 54.97 54.08 1v9j s GLU 51 Cb -0.09 0.29 0.05 0.00 0.26 0.00 0.00 34.13 34.65 1v9j s GLU 51 CO 0.25 -0.37 0.36 0.34 -0.54 0.00 0.00 175.26 175.30 1v9j s ASP 52 N -3.09 -0.44 -0.26 -1.70 2.15 -1.26 -2.81 116.67 109.26 1v9j s ASP 52 Ca 0.30 0.78 0.10 0.00 0.43 0.00 0.00 52.55 54.16 1v9j s ASP 52 Cb 0.06 0.67 0.45 0.00 -0.30 0.00 0.00 42.92 43.80 1v9j s ASP 52 CO 0.07 -0.18 1.19 0.35 -0.17 0.00 0.00 175.17 176.43 1v9j n THR 53 N 4.17 2.27 -3.73 1.71 -2.24 -1.17 -4.99 114.28 110.30 1v9j n THR 53 Ca -0.23 -3.79 -0.22 0.00 -2.27 0.00 0.00 64.05 57.54 1v9j n THR 53 Cb 0.55 -0.65 -0.18 0.00 -2.10 0.00 0.00 70.33 67.95 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 -4.08 0.18 -0.20 4.28 2.01 -1.26 -4.74 115.64 111.83 1v9j s THR 54 Ca 0.45 0.25 -0.03 0.00 0.31 0.00 0.00 61.69 62.67 1v9j s THR 54 Cb 0.39 -0.38 -0.21 0.00 0.01 0.00 0.00 72.50 72.31 1v9j s THR 54 CO 0.00 0.22 0.05 0.18 -0.69 0.00 0.00 174.62 174.38 1v9j n LEU 55 N 5.21 2.78 0.00 4.42 4.77 -1.26 -5.00 117.00 127.93 1v9j n LEU 55 Ca -0.05 0.04 -0.17 0.00 -0.03 0.00 0.00 56.01 55.79 1v9j n LEU 55 Cb 0.50 -1.01 0.05 0.00 -2.33 0.00 0.00 43.42 40.63 1v9j n LEU 55 CO 0.09 0.88 0.27 -0.46 -1.33 0.00 0.00 177.39 176.84 1v9j n ASN 56 N -3.41 1.91 -4.50 -1.43 0.23 -1.26 -5.03 115.26 101.77 1v9j n ASN 56 Ca -0.40 -2.35 -0.43 0.00 -0.53 0.00 0.00 54.58 50.87 1v9j n ASN 56 Cb 1.01 -0.31 -0.02 0.00 -2.08 0.00 0.00 39.78 38.38 1v9j n ASN 56 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1v9j s ARG 57 N -4.18 3.79 -0.29 -3.83 0.52 -1.26 -4.80 118.95 108.90 1v9j s ARG 57 Ca 0.48 -1.86 -0.16 0.00 -0.52 0.00 0.00 55.73 53.67 1v9j s ARG 57 Cb -0.04 -5.17 0.15 0.00 0.52 0.00 0.00 34.95 30.41 1v9j s ARG 57 CO 0.30 -1.96 0.97 0.00 0.02 0.00 0.00 175.30 174.63 1v9j n ALA 59 N 4.06 0.00 -2.67 0.00 0.00 -1.26 -4.69 120.51 115.95 1v9j n ALA 59 Ca -0.16 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.23 1v9j n ALA 59 Cb 0.56 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.02 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 -9.48 -3.47 0.00 -1.04 -1.26 -2.10 114.28 96.93 1v9j n THR 60 Ca 0.00 0.55 -0.36 0.00 -2.04 0.00 0.00 64.05 62.20 1v9j n THR 60 Cb 0.00 -6.71 -0.06 0.00 -1.82 0.00 0.00 70.33 61.75 1v9j n THR 60 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1v9j s SER 61 N -2.46 6.76 0.02 8.00 1.04 -1.26 -3.93 113.70 121.88 1v9j s SER 61 Ca 0.17 0.95 -0.01 0.00 0.48 0.00 0.00 55.95 57.54 1v9j s SER 61 Cb -0.05 -2.24 -0.02 0.00 0.10 0.00 0.00 66.02 63.81 1v9j s SER 61 CO 0.64 0.20 -0.01 -0.36 0.98 0.00 0.00 173.24 174.69 1v9j s PHE 62 N -1.32 0.26 -0.05 5.02 0.08 -1.11 -3.04 117.98 117.83 1v9j s PHE 62 Ca 0.32 -0.54 -0.02 0.00 0.12 0.00 0.00 56.93 56.81 1v9j s PHE 62 Cb -0.15 -0.19 0.03 0.00 -0.57 0.00 0.00 43.02 42.13 1v9j s PHE 62 CO 0.17 -0.22 0.04 1.03 -0.10 0.00 0.00 175.22 176.14 1v9j s ARG 63 N -1.68 0.17 0.19 0.44 0.52 -1.12 -2.81 118.95 114.65 1v9j s ARG 63 Ca -0.14 0.28 0.11 0.00 -0.52 0.00 0.00 55.73 55.46 1v9j s ARG 63 Cb -0.08 -0.67 -0.04 0.00 0.52 0.00 0.00 34.95 34.67 1v9j s ARG 63 CO -0.02 -0.32 -0.20 0.14 0.02 0.00 0.00 175.30 174.92 1v9j s VAL 64 N 2.09 2.56 -0.03 3.52 -7.23 -1.09 0.27 120.40 120.50 1v9j s VAL 64 Ca 0.05 -1.94 0.06 0.00 -1.81 0.00 0.00 61.98 58.34 1v9j s VAL 64 Cb -0.12 -2.24 -0.01 0.00 0.56 0.00 0.00 36.38 34.57 1v9j s VAL 64 CO -0.04 -0.12 -0.21 -0.22 -0.31 0.00 0.00 175.10 174.21 1v9j s LEU 65 N -2.71 2.01 -0.05 1.32 1.98 0.15 -2.87 118.68 118.52 1v9j s LEU 65 Ca 0.22 -0.40 0.02 0.00 -2.89 0.00 0.00 54.13 51.07 1v9j s LEU 65 Cb -0.08 -1.12 0.01 0.00 0.66 0.00 0.00 46.19 45.66 1v9j s LEU 65 CO 0.11 0.23 -0.10 -0.69 -1.89 0.00 0.00 176.35 174.02 1v9j s VAL 66 N -0.30 0.91 -0.05 1.68 1.01 -1.10 -2.74 120.40 119.81 1v9j s VAL 66 Ca 0.03 -0.36 -0.02 0.00 0.00 0.00 0.00 61.98 61.62 1v9j s VAL 66 Cb -0.10 -0.84 0.03 0.00 0.00 0.00 0.00 36.38 35.47 1v9j s VAL 66 CO 0.01 0.30 0.07 -0.69 0.00 0.00 0.00 175.10 174.79 1v9j s VAL 67 N 0.62 -0.13 -0.07 2.92 1.01 -1.02 -2.78 120.40 120.96 1v9j s VAL 67 Ca -0.11 0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.98 1v9j s VAL 67 Cb -0.14 -0.17 0.10 0.00 0.00 0.00 0.00 36.38 36.18 1v9j s VAL 67 CO 0.02 0.17 1.35 -0.55 0.00 0.00 0.00 175.10 176.10 1v9j s SER 68 N 2.18 -0.00 0.38 3.32 0.15 -1.13 -1.33 113.70 117.28 1v9j s SER 68 Ca 0.05 -0.08 0.24 0.00 0.70 0.00 0.00 55.95 56.86 1v9j s SER 68 Cb -0.12 0.06 0.51 0.00 -1.71 0.00 0.00 66.02 64.76 1v9j s SER 68 CO -0.03 -0.11 1.67 0.00 1.20 0.00 0.00 173.24 175.96 1v9j h ALA 69 N 2.00 1.00 -0.97 5.45 0.00 -1.94 -3.29 119.26 121.52 1v9j h ALA 69 Ca -0.22 0.00 0.24 0.00 0.00 0.00 0.00 54.91 54.93 1v9j h ALA 69 Cb 1.18 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.89 1v9j h ALA 69 CO 0.30 0.00 0.64 -0.22 0.00 0.00 0.00 179.25 179.97 1v9j h LYS 70 N 0.00 0.35 -0.00 0.00 1.63 -1.93 0.40 116.57 117.02 1v9j h LYS 70 Ca 0.00 -0.02 -0.17 0.00 -0.85 0.00 0.00 60.65 59.61 1v9j h LYS 70 Cb 0.90 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 32.43 1v9j h LYS 70 CO 0.00 0.23 -0.77 0.74 -3.45 0.00 0.00 179.45 176.20 1v9j h PHE 71 N 0.36 0.10 -0.24 1.91 0.04 -1.87 -3.21 116.94 114.03 1v9j h PHE 71 Ca 0.52 -0.05 -0.01 0.00 2.80 0.00 0.00 57.97 61.24 1v9j h PHE 71 Cb 1.38 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 39.51 1v9j h PHE 71 CO -0.00 0.81 0.13 0.93 -0.60 0.00 0.00 178.31 179.58 1v9j h GLU 72 N 0.04 0.34 0.91 1.51 4.39 -0.40 -3.24 114.58 118.13 1v9j h GLU 72 Ca -0.02 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.60 1v9j h GLU 72 Cb 1.36 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.94 1v9j h GLU 72 CO 0.11 0.32 -0.49 0.78 -1.16 0.00 0.00 179.01 178.56 1v9j h GLY 73 N 0.28 -1.40 -1.53 -3.84 0.00 -1.50 -3.43 103.07 91.65 1v9j h GLY 73 Ca 0.09 0.54 -0.50 0.00 0.00 0.00 0.00 47.33 47.46 1v9j h GLY 73 CO -0.01 -0.49 0.39 0.54 0.00 0.00 0.00 176.54 176.97 1v9j s LYS 74 N -5.96 3.50 0.00 4.80 1.02 -1.21 -5.07 119.74 116.81 1v9j s LYS 74 Ca -0.20 0.94 0.00 0.00 0.02 0.00 0.00 55.97 56.73 1v9j s LYS 74 Cb 0.03 -2.07 0.00 0.00 -0.52 0.00 0.00 37.83 35.27 1v9j s LYS 74 CO 0.60 -0.65 0.00 -0.35 -0.92 0.00 0.00 175.35 174.03 1v9j n PRO 75 N -2.38 -0.68 0.05 -1.68 -0.04 -1.26 -4.80 135.00 124.22 1v9j n PRO 75 Ca 0.07 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.40 1v9j n PRO 75 Cb 0.54 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.86 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 0.24 -0.38 1.53 6.46 -1.98 -2.98 115.31 118.20 1v9j h LEU 76 Ca 0.00 -0.32 -0.18 0.00 -0.12 0.00 0.00 57.88 57.26 1v9j h LEU 76 Cb 0.00 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 39.84 1v9j h LEU 76 CO 0.00 1.26 -0.80 0.17 -0.62 0.00 0.00 178.44 178.45 1v9j h LEU 77 N 0.04 0.26 -0.08 2.25 -0.00 -1.99 -2.80 115.31 112.99 1v9j h LEU 77 Ca -0.18 -0.19 -0.09 0.00 -0.00 0.00 0.00 57.88 57.41 1v9j h LEU 77 Cb 1.95 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 42.54 1v9j h LEU 77 CO 0.14 0.96 -0.32 -0.61 -0.00 0.00 0.00 178.44 178.61 1v9j h GLN 78 N 0.13 0.35 -0.59 0.17 5.75 -1.93 -2.65 115.11 116.34 1v9j h GLN 78 Ca -0.03 -0.28 0.01 0.00 -0.15 0.00 0.00 58.65 58.20 1v9j h GLN 78 Cb 1.40 0.05 -0.03 0.00 1.07 0.00 0.00 27.48 29.97 1v9j h GLN 78 CO 0.12 0.91 0.38 0.07 -2.65 0.00 0.00 178.83 177.67 1v9j h ARG 79 N -0.12 0.75 -0.50 1.69 0.11 -1.59 0.84 114.38 115.57 1v9j h ARG 79 Ca -0.02 -0.05 -0.04 0.00 0.10 0.00 0.00 59.98 59.98 1v9j h ARG 79 Cb 0.96 -0.17 -0.02 0.00 1.11 0.00 0.00 29.97 31.85 1v9j h ARG 79 CO 0.07 0.50 0.14 0.45 0.10 0.00 0.00 179.97 181.23 1v9j h HIS 80 N 0.78 0.75 -0.02 4.08 3.86 -1.55 -2.40 115.15 120.65 1v9j h HIS 80 Ca 0.22 -0.05 -0.17 0.00 -1.16 0.00 0.00 60.37 59.20 1v9j h HIS 80 Cb -0.07 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.16 1v9j h HIS 80 CO -0.04 0.63 -0.76 0.00 0.86 0.00 0.00 177.93 178.62 1v9j h ARG 81 N 0.72 0.18 -0.06 2.45 3.08 -1.02 -3.06 114.38 116.68 1v9j h ARG 81 Ca 0.17 -0.16 0.01 0.00 0.07 0.00 0.00 59.98 60.07 1v9j h ARG 81 Cb 0.23 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1v9j h ARG 81 CO -0.01 0.85 -0.01 -0.07 -1.07 0.00 0.00 179.97 179.66 1v9j h LEU 82 N 0.11 -0.05 -0.59 3.04 3.38 -0.34 0.59 115.31 121.45 1v9j h LEU 82 Ca -0.02 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1v9j h LEU 82 Cb 1.33 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 42.08 1v9j h LEU 82 CO 0.11 -0.02 0.33 0.58 0.09 0.00 0.00 178.44 179.54 1v9j h VAL 83 N 0.00 1.19 -0.48 1.22 2.07 -1.56 -1.97 116.25 116.72 1v9j h VAL 83 Ca 0.03 -0.47 -0.12 0.00 0.82 0.00 0.00 66.70 66.96 1v9j h VAL 83 Cb 0.04 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 1v9j h VAL 83 CO -0.06 0.20 -0.17 0.78 0.02 0.00 0.00 177.57 178.35 1v9j h ASN 84 N 0.80 0.99 -0.77 0.57 2.35 -1.38 -2.96 115.58 115.17 1v9j h ASN 84 Ca 0.21 -0.38 0.02 0.00 -0.55 0.00 0.00 56.30 55.60 1v9j h ASN 84 Cb 0.03 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.09 1v9j h ASN 84 CO -0.03 1.14 0.51 -0.33 -1.65 0.00 0.00 177.43 177.07 1v9j h GLU 85 N 0.82 0.96 0.75 0.81 5.08 0.45 -1.47 114.58 122.00 1v9j h GLU 85 Ca 0.12 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 1v9j h GLU 85 Cb 0.74 -0.22 0.01 0.00 0.50 0.00 0.00 28.75 29.78 1v9j h GLU 85 CO 0.06 0.64 -0.36 0.00 -1.00 0.00 0.00 179.01 178.34 1v9j n LEU 87 N -5.52 7.29 0.04 0.00 4.77 -1.10 -4.67 117.00 117.80 1v9j n LEU 87 Ca -0.14 -4.43 -0.12 0.00 -0.03 0.00 0.00 56.01 51.29 1v9j n LEU 87 Cb 0.41 -1.08 -0.08 0.00 -2.33 0.00 0.00 43.42 40.35 1v9j n LEU 87 CO 0.39 1.64 0.82 0.00 -1.33 0.00 0.00 177.39 178.91 1v9j h ALA 88 N 2.62 -0.02 -0.02 -1.18 0.00 -1.16 0.84 119.26 120.33 1v9j h ALA 88 Ca 0.52 -0.05 -0.20 0.00 0.00 0.00 0.00 54.91 55.18 1v9j h ALA 88 Cb 0.43 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1v9j h ALA 88 CO 1.32 -0.47 -0.85 0.93 0.00 0.00 0.00 179.25 180.18 1v9j h GLU 89 N -0.11 0.34 0.00 0.00 5.08 -1.87 -3.22 114.58 114.80 1v9j h GLU 89 Ca -0.00 -0.33 -0.16 0.00 -1.00 0.00 0.00 59.36 57.87 1v9j h GLU 89 Cb 0.10 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1v9j h GLU 89 CO 0.00 1.01 -0.75 0.93 -1.00 0.00 0.00 179.01 179.20 1v9j h GLU 90 N 0.20 0.00 -0.06 2.33 3.07 -1.87 -3.33 114.58 114.93 1v9j h GLU 90 Ca -0.05 0.00 0.03 0.00 -0.50 0.00 0.00 59.36 58.84 1v9j h GLU 90 Cb 1.46 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 29.31 1v9j h GLU 90 CO 0.14 0.75 -0.47 -0.07 -1.40 0.00 0.00 179.01 177.97 1v9j h LEU 91 N 0.00 -1.44 -1.76 1.33 3.38 0.70 -0.97 115.31 116.56 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 1.33 0.57 -0.08 0.00 0.09 0.00 0.00 40.66 42.57 1v9j h LEU 91 CO 0.10 -0.47 0.97 -0.65 0.09 0.00 0.00 178.44 178.47 1v9j h PRO 92 N -0.58 0.08 -0.01 1.13 0.11 -1.70 0.99 132.00 132.02 1v9j h PRO 92 Ca 0.05 -0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.98 1v9j h PRO 92 Cb 0.67 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 1v9j h PRO 92 CO -0.37 0.05 -0.78 0.45 -0.21 0.00 0.00 178.00 177.14 1v9j h HIS 93 N 0.08 0.16 -3.11 0.65 3.86 -1.37 -3.43 115.15 111.99 1v9j h HIS 93 Ca 0.73 -0.08 -0.57 0.00 -1.16 0.00 0.00 60.37 59.29 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 0.84 0.99 0.42 0.86 0.00 0.00 177.93 181.04 1v9j s ILE 94 N -3.33 4.07 0.37 2.45 -1.09 0.34 -4.89 121.20 119.12 1v9j s ILE 94 Ca -0.02 1.20 0.10 0.00 -2.23 0.00 0.00 60.65 59.71 1v9j s ILE 94 Cb 0.11 -4.11 0.12 0.00 -1.58 0.00 0.00 42.46 37.01 1v9j s ILE 94 CO 0.80 -0.47 1.86 -0.74 -1.23 0.00 0.00 174.94 175.16 1v9j h HIS 95 N 9.55 0.18 -2.12 3.97 2.76 -1.54 -3.42 115.15 124.53 1v9j h HIS 95 Ca -0.27 -0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 57.82 1v9j h HIS 95 Cb 1.10 -0.05 -0.26 0.00 1.55 0.00 0.00 27.41 29.76 1v9j h HIS 95 CO 0.89 0.41 -0.34 0.00 -1.30 0.00 0.00 177.93 177.59 1v9j s ALA 96 N -4.47 -1.43 -0.03 5.26 0.00 -1.26 -5.05 121.76 114.78 1v9j s ALA 96 Ca -0.05 1.58 0.08 0.00 0.00 0.00 0.00 51.96 53.57 1v9j s ALA 96 Cb 0.15 -1.58 -0.02 0.00 0.00 0.00 0.00 23.12 21.67 1v9j s ALA 96 CO 0.74 -0.96 -0.25 0.12 0.00 0.00 0.00 175.76 175.40 1v9j s PHE 97 N 2.68 2.31 -0.15 0.00 2.19 -1.26 -2.75 117.98 121.01 1v9j s PHE 97 Ca 0.03 -0.48 -0.05 0.00 0.33 0.00 0.00 56.93 56.76 1v9j s PHE 97 Cb -0.13 -1.49 0.07 0.00 -1.31 0.00 0.00 43.02 40.16 1v9j s PHE 97 CO -0.15 -0.07 0.30 -2.00 1.83 0.00 0.00 175.22 175.13 1v9j s GLU 98 N -0.53 0.19 0.03 10.12 2.12 -1.12 -5.04 118.70 124.47 1v9j s GLU 98 Ca 0.08 0.82 0.02 0.00 0.36 0.00 0.00 54.97 56.25 1v9j s GLU 98 Cb -0.10 0.05 -0.02 0.00 0.26 0.00 0.00 34.13 34.32 1v9j s GLU 98 CO -0.00 -0.28 -0.08 1.14 -0.54 0.00 0.00 175.26 175.50 1v9j s GLN 99 N 2.47 0.52 0.36 4.30 1.03 -1.26 -2.66 119.66 124.41 1v9j s GLN 99 Ca 0.01 -0.64 0.08 0.00 0.04 0.00 0.00 55.36 54.85 1v9j s GLN 99 Cb -0.12 -0.34 -0.05 0.00 0.03 0.00 0.00 33.01 32.53 1v9j s GLN 99 CO -0.09 0.07 0.10 0.21 -2.54 0.00 0.00 175.29 173.03 1v9j s LYS 100 N -1.27 2.23 -0.12 9.60 2.47 -1.14 -5.02 119.74 126.49 1v9j s LYS 100 Ca -0.07 -1.69 -0.07 0.00 -1.56 0.00 0.00 55.97 52.57 1v9j s LYS 100 Cb -0.08 -2.04 0.05 0.00 -1.46 0.00 0.00 37.83 34.30 1v9j s LYS 100 CO 0.00 0.07 0.30 0.95 0.16 0.00 0.00 175.35 176.83 1v9j s THR 101 N -2.50 -0.03 0.12 3.43 -4.23 -1.26 -2.72 115.64 108.45 1v9j s THR 101 Ca 0.37 0.11 -0.11 0.00 -1.18 0.00 0.00 61.69 60.88 1v9j s THR 101 Cb -0.00 -0.45 0.01 0.00 1.34 0.00 0.00 72.50 73.40 1v9j s THR 101 CO 0.21 0.04 0.29 -0.76 -0.54 0.00 0.00 174.62 173.86 1v9j s LEU 102 N 1.11 0.97 0.44 4.79 1.43 -1.12 -5.05 118.68 121.25 1v9j s LEU 102 Ca -0.08 -0.61 -0.12 0.00 -1.03 0.00 0.00 54.13 52.30 1v9j s LEU 102 Cb -0.08 1.35 -0.06 0.00 0.03 0.00 0.00 46.19 47.42 1v9j s LEU 102 CO -0.08 -0.82 0.83 0.42 0.23 0.00 0.00 176.35 176.93 1v9j s THR 103 N -3.87 4.73 0.17 5.49 -4.23 -1.26 -2.83 115.64 113.83 1v9j s THR 103 Ca 0.08 0.74 -0.16 0.00 -1.18 0.00 0.00 61.69 61.17 1v9j s THR 103 Cb 0.03 -3.74 0.06 0.00 1.34 0.00 0.00 72.50 70.19 1v9j s THR 103 CO -0.08 -0.61 1.71 -0.65 -0.54 0.00 0.00 174.62 174.45 1v9j h PRO 104 N 1.04 0.16 -0.21 3.99 0.11 -1.90 -0.68 132.00 134.52 1v9j h PRO 104 Ca -0.47 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.67 1v9j h PRO 104 Cb 1.19 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1v9j h PRO 104 CO 0.63 0.11 0.14 0.93 -0.21 0.00 0.00 178.00 179.60 1v9j h GLU 105 N 0.16 0.13 0.13 1.05 5.08 -1.95 0.39 114.58 119.57 1v9j h GLU 105 Ca 0.19 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1v9j h GLU 105 Cb 0.25 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1v9j h GLU 105 CO -0.28 0.08 -0.06 1.96 -1.00 0.00 0.00 179.01 179.71 1v9j h GLN 106 N 0.13 -0.17 -0.17 2.33 4.20 -1.56 -2.55 115.11 117.32 1v9j h GLN 106 Ca 0.09 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 1v9j h GLN 106 Cb 0.20 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 1v9j h GLN 106 CO -0.01 0.30 0.05 2.35 -0.67 0.00 0.00 178.83 180.85 1v9j h TRP 107 N -0.85 0.28 -0.28 2.96 2.91 -0.92 0.31 115.95 120.35 1v9j h TRP 107 Ca -0.02 -0.03 0.06 0.00 1.13 0.00 0.00 58.89 60.04 1v9j h TRP 107 Cb 0.55 -0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 29.10 1v9j h TRP 107 CO 0.10 0.38 0.20 1.15 -1.03 0.00 0.00 178.44 179.24 1v9j h THR 108 N 0.09 0.91 0.19 2.65 2.02 -0.35 -1.04 112.91 117.39 1v9j h THR 108 Ca 0.05 -0.03 -0.35 0.00 0.77 0.00 0.00 66.41 66.85 1v9j h THR 108 Cb 0.24 0.81 0.01 0.00 -1.74 0.00 0.00 68.15 67.46 1v9j h THR 108 CO -0.00 0.02 -1.72 0.03 0.37 0.00 0.00 175.52 174.22 1v9j h ARG 109 N 0.10 0.40 -1.96 6.66 2.47 -1.10 -3.36 114.38 117.58 1v9j h ARG 109 Ca 0.13 -0.68 -0.74 0.00 -1.26 0.00 0.00 59.98 57.43 1v9j h ARG 109 Cb 0.39 0.25 -0.29 0.00 -1.65 0.00 0.00 29.97 28.67 1v9j h ARG 109 CO -0.01 1.33 0.78 0.94 0.56 0.00 0.00 179.97 183.56 1v9j n GLN 110 N -3.63 3.10 -1.58 0.04 7.27 0.10 -4.81 117.38 117.87 1v9j n GLN 110 Ca -0.24 -3.79 -0.30 0.00 0.07 0.00 0.00 57.00 52.74 1v9j n GLN 110 Cb 1.07 -2.28 -0.05 0.00 2.41 0.00 0.00 30.24 31.38 1v9j n GLN 110 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1v9j n ARG 111 N -0.48 3.10 -3.34 3.69 1.74 -0.45 -4.81 116.66 116.11 1v9j n ARG 111 Ca 0.51 -2.54 -0.43 0.00 -0.77 0.00 0.00 57.85 54.61 1v9j n ARG 111 Cb 0.30 -2.31 -0.01 0.00 -1.02 0.00 0.00 32.46 29.42 1v9j n ARG 111 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1v9j n ARG 112 N 1.44 3.53 0.00 5.56 1.85 -1.26 -5.11 116.66 122.66 1v9j n ARG 112 Ca 0.54 -4.48 0.16 0.00 -1.00 0.00 0.00 57.85 53.07 1v9j n ARG 112 Cb 0.48 -2.53 0.93 0.00 -1.05 0.00 0.00 32.46 30.29 1v9j n ARG 112 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01