#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dzf n TRP 46 N 0.00 0.23 -4.55 -0.14 2.14 -1.26 -4.94 117.44 108.92 3dzf n TRP 46 Ca 0.00 -0.24 -0.25 0.00 2.07 0.00 0.00 57.50 59.08 3dzf n TRP 46 Cb 0.00 -0.01 -0.14 0.00 -0.81 0.00 0.00 31.31 30.35 3dzf n TRP 46 CO 0.00 0.00 0.00 0.50 2.07 0.00 0.00 177.69 180.26 3dzf s ARG 47 N -0.99 1.33 0.12 -2.67 6.06 -1.26 -5.13 118.95 116.41 3dzf s ARG 47 Ca 0.19 -1.01 0.08 0.00 -2.50 0.00 0.00 55.73 52.49 3dzf s ARG 47 Cb 0.11 -1.49 -0.04 0.00 0.06 0.00 0.00 34.95 33.59 3dzf s ARG 47 CO 0.16 0.37 -0.11 -0.65 -2.50 0.00 0.00 175.30 172.57 3dzf s GLN 48 N -1.38 2.06 0.08 5.12 -0.21 -1.26 -5.03 119.66 119.04 3dzf s GLN 48 Ca 0.07 -1.09 -0.06 0.00 0.02 0.00 0.00 55.36 54.30 3dzf s GLN 48 Cb -0.09 -2.25 -0.25 0.00 1.00 0.00 0.00 33.01 31.41 3dzf s GLN 48 CO 0.02 0.49 1.16 1.15 -2.12 0.00 0.00 175.29 175.99 3dzf h THR 49 N 3.20 1.44 -2.78 -0.19 2.02 -1.96 -3.47 112.91 111.17 3dzf h THR 49 Ca -0.49 -2.86 -0.49 0.00 0.77 0.00 0.00 66.41 63.35 3dzf h THR 49 Cb 1.17 2.84 -0.14 0.00 -1.74 0.00 0.00 68.15 70.29 3dzf h THR 49 CO 0.52 0.84 -0.60 0.26 0.37 0.00 0.00 175.52 176.91 3dzf s TRP 50 N -2.79 1.94 0.02 3.16 0.52 -1.26 -5.06 118.94 115.47 3dzf s TRP 50 Ca -0.05 -1.00 0.04 0.00 0.02 0.00 0.00 56.10 55.11 3dzf s TRP 50 Cb 0.07 -1.27 -0.25 0.00 -1.15 0.00 0.00 33.47 30.87 3dzf s TRP 50 CO 0.89 -0.02 0.92 0.77 0.02 0.00 0.00 176.95 179.53 3dzf h SER 51 N 2.06 0.18 -2.91 2.95 0.02 -1.92 -3.44 113.55 110.49 3dzf h SER 51 Ca -0.40 -0.26 -0.45 0.00 -0.84 0.00 0.00 61.79 59.85 3dzf h SER 51 Cb 1.25 -0.06 0.05 0.00 0.14 0.00 0.00 62.40 63.78 3dzf h SER 51 CO 0.68 1.21 0.03 -0.83 -1.14 0.00 0.00 176.83 176.79 3dzf s GLY 52 N -4.93 1.75 0.43 -3.77 0.00 -0.15 -4.86 107.32 95.78 3dzf s GLY 52 Ca -0.05 -1.15 -0.24 0.00 0.00 0.00 0.00 44.72 43.28 3dzf s GLY 52 CO 0.83 -0.86 0.93 -1.05 0.00 0.00 0.00 173.10 172.96 3dzf n PRO 53 N -2.46 1.19 -1.37 2.90 -0.02 -1.26 -1.78 135.00 132.19 3dzf n PRO 53 Ca 0.07 0.43 -0.23 0.00 -2.02 0.00 0.00 63.50 61.75 3dzf n PRO 53 Cb 0.59 -1.96 0.16 0.00 -0.02 0.00 0.00 33.50 32.28 3dzf n PRO 53 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dzf n GLY 54 N 1.29 -1.61 3.66 -1.23 0.00 -1.23 -2.43 105.19 103.64 3dzf n GLY 54 Ca 0.10 -1.67 -0.45 0.00 0.00 0.00 0.00 46.02 44.00 3dzf n GLY 54 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3dzf n THR 55 N -3.56 1.13 -1.72 2.61 -1.04 -0.08 -4.65 114.28 106.98 3dzf n THR 55 Ca 0.13 -0.28 -0.41 0.00 -2.04 0.00 0.00 64.05 61.44 3dzf n THR 55 Cb 0.45 -1.42 0.01 0.00 -1.82 0.00 0.00 70.33 67.54 3dzf n THR 55 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 3dzf n THR 56 N 1.60 2.38 -1.78 12.58 -1.04 -0.17 -4.72 114.28 123.13 3dzf n THR 56 Ca 0.11 -0.50 -0.40 0.00 -2.04 0.00 0.00 64.05 61.22 3dzf n THR 56 Cb 0.32 -1.65 0.02 0.00 -1.82 0.00 0.00 70.33 67.20 3dzf n THR 56 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 3dzf s LYS 57 N -2.14 3.71 -1.55 -2.82 -2.85 -1.26 -2.31 119.74 110.52 3dzf s LYS 57 Ca 0.59 2.45 -0.04 0.00 -1.00 0.00 0.00 55.97 57.97 3dzf s LYS 57 Cb -0.51 -2.68 0.01 0.00 -2.06 0.00 0.00 37.83 32.59 3dzf s LYS 57 CO 0.60 -0.81 0.42 0.54 0.10 0.00 0.00 175.35 176.20 3dzf n ARG 58 N -0.14 -3.84 -0.12 1.78 1.74 -1.26 -4.89 116.66 109.93 3dzf n ARG 58 Ca 0.05 0.87 -0.05 0.00 -0.77 0.00 0.00 57.85 57.94 3dzf n ARG 58 Cb 0.41 -5.65 0.03 0.00 -1.02 0.00 0.00 32.46 26.23 3dzf n ARG 58 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 3dzf h PHE 59 N -0.94 0.14 -0.27 -1.55 3.57 -1.82 0.12 116.94 116.20 3dzf h PHE 59 Ca -0.50 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.03 3dzf h PHE 59 Cb 1.35 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 40.07 3dzf h PHE 59 CO 0.57 0.02 0.17 -1.35 -2.23 0.00 0.00 178.31 175.49 3dzf h PRO 60 N 0.22 0.34 -0.86 6.41 0.11 -1.90 -0.19 132.00 136.12 3dzf h PRO 60 Ca 0.19 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 66.32 3dzf h PRO 60 Cb 0.22 -0.08 -0.05 0.00 0.11 0.00 0.00 31.00 31.20 3dzf h PRO 60 CO -0.24 0.22 0.56 0.93 -0.21 0.00 0.00 178.00 179.27 3dzf h GLU 61 N 0.35 1.02 -0.07 1.05 3.07 -1.80 -2.70 114.58 115.49 3dzf h GLU 61 Ca 0.10 -0.06 -0.04 0.00 -0.50 0.00 0.00 59.36 58.86 3dzf h GLU 61 Cb -0.02 -0.23 -0.00 0.00 -0.84 0.00 0.00 28.75 27.66 3dzf h GLU 61 CO -0.04 0.67 -0.10 1.15 -1.40 0.00 0.00 179.01 179.30 3dzf h THR 62 N 1.05 1.39 -0.41 1.13 2.02 -0.13 -1.90 112.91 116.05 3dzf h THR 62 Ca 0.35 -1.33 0.04 0.00 0.77 0.00 0.00 66.41 66.23 3dzf h THR 62 Cb 0.06 2.12 -0.04 0.00 -1.74 0.00 0.00 68.15 68.55 3dzf h THR 62 CO -0.11 0.37 0.19 0.58 0.37 0.00 0.00 175.52 176.93 3dzf h VAL 63 N -0.27 0.95 -0.54 3.16 2.07 -1.06 0.12 116.25 120.68 3dzf h VAL 63 Ca 0.01 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.39 3dzf h VAL 63 Cb 0.65 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 3dzf h VAL 63 CO 0.02 0.07 0.32 0.25 0.02 0.00 0.00 177.57 178.26 3dzf h LEU 64 N 0.40 0.65 -0.86 2.57 5.85 -1.54 0.21 115.31 122.59 3dzf h LEU 64 Ca 0.18 -0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.78 3dzf h LEU 64 Cb 0.11 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 3dzf h LEU 64 CO -0.14 0.52 0.16 0.00 -0.34 0.00 0.00 178.44 178.64 3dzf h ALA 65 N 1.15 1.07 -0.11 1.25 0.00 -0.97 0.26 119.26 121.91 3dzf h ALA 65 Ca 0.19 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 3dzf h ALA 65 Cb -0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3dzf h ALA 65 CO -0.04 0.62 -0.35 0.00 0.00 0.00 0.00 179.25 179.48 3dzf h ARG 66 N 0.96 0.22 -0.08 0.00 3.08 -0.61 0.23 114.38 118.19 3dzf h ARG 66 Ca 0.20 -0.09 -0.16 0.00 0.07 0.00 0.00 59.98 60.00 3dzf h ARG 66 Cb 0.34 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.39 3dzf h ARG 66 CO 0.00 0.55 -0.57 0.00 -1.07 0.00 0.00 179.97 178.89 3dzf h VAL 68 N 0.10 1.26 0.31 0.00 2.07 -0.57 -1.42 116.25 118.01 3dzf h VAL 68 Ca -0.05 -1.12 -0.02 0.00 0.82 0.00 0.00 66.70 66.34 3dzf h VAL 68 Cb 1.23 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 3dzf h VAL 68 CO 0.12 0.41 -0.15 0.50 0.02 0.00 0.00 177.57 178.46 3dzf h LYS 69 N 0.97 -0.40 -0.90 1.57 1.63 -0.51 -2.40 116.57 116.53 3dzf h LYS 69 Ca 0.18 0.03 0.21 0.00 -0.85 0.00 0.00 60.65 60.21 3dzf h LYS 69 Cb 0.52 0.09 -0.12 0.00 -0.60 0.00 0.00 32.23 32.12 3dzf h LYS 69 CO 0.03 -0.20 0.42 -0.92 -3.45 0.00 0.00 179.45 175.33 3dzf h TYR 70 N -0.52 0.70 0.00 1.91 3.20 -0.97 -1.01 116.97 120.28 3dzf h TYR 70 Ca -0.04 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.83 3dzf h TYR 70 Cb 0.39 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 3dzf h TYR 70 CO -0.03 0.00 -0.17 1.79 -1.64 0.00 0.00 178.16 178.12 3dzf h THR 71 N 0.45 0.30 0.07 1.81 1.35 -1.14 -0.25 112.91 115.49 3dzf h THR 71 Ca 0.55 -1.37 -0.00 0.00 -0.55 0.00 0.00 66.41 65.04 3dzf h THR 71 Cb 1.00 2.10 0.00 0.00 -1.73 0.00 0.00 68.15 69.53 3dzf h THR 71 CO -0.49 0.16 -0.03 -0.33 -0.25 0.00 0.00 175.52 174.58 3dzf h GLU 72 N 0.00 -0.09 0.00 4.72 5.08 -0.69 -3.16 114.58 120.45 3dzf h GLU 72 Ca -0.00 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 3dzf h GLU 72 Cb 1.09 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.35 3dzf h GLU 72 CO 0.02 0.25 -0.16 0.82 -1.00 0.00 0.00 179.01 178.94 3dzf h ILE 73 N -0.43 0.59 -2.79 3.13 2.04 -1.31 -3.36 117.51 115.38 3dzf h ILE 73 Ca -0.01 -0.73 -0.61 0.00 1.00 0.00 0.00 64.86 64.52 3dzf h ILE 73 Cb 0.37 1.47 -0.40 0.00 -0.74 0.00 0.00 36.82 37.53 3dzf h ILE 73 CO 0.02 0.16 -0.74 -1.00 0.00 0.00 0.00 178.15 176.59 3dzf s HIS 74 N -4.04 2.56 0.58 1.37 3.76 -0.11 -4.96 115.29 114.46 3dzf s HIS 74 Ca -0.02 -2.93 0.28 0.00 -0.15 0.00 0.00 55.06 52.24 3dzf s HIS 74 Cb 0.12 -1.98 1.60 0.00 1.11 0.00 0.00 32.58 33.43 3dzf s HIS 74 CO 0.60 -0.66 2.07 -1.35 -0.85 0.00 0.00 174.74 174.55 3dzf h PRO 75 N 5.50 0.00 0.00 8.40 0.11 -1.71 -1.31 132.00 142.99 3dzf h PRO 75 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 3dzf h PRO 75 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 3dzf h PRO 75 CO 0.58 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.52 3dzf n GLU 76 N -3.86 0.28 -0.16 1.05 0.00 -1.26 -1.63 120.64 115.06 3dzf n GLU 76 Ca 0.03 0.11 0.06 0.00 0.00 0.00 0.00 57.16 57.36 3dzf n GLU 76 Cb 0.38 -1.50 0.13 0.00 0.00 0.00 0.00 31.44 30.45 3dzf n GLU 76 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 3dzf n MET 77 N -1.26 2.51 0.00 3.44 2.81 -0.49 -4.72 117.12 119.41 3dzf n MET 77 Ca 0.09 -2.21 0.09 0.00 -1.81 0.00 0.00 57.70 53.86 3dzf n MET 77 Cb 0.13 -1.38 0.46 0.00 -0.71 0.00 0.00 33.22 31.72 3dzf n MET 77 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3dzf n ARG 78 N -0.51 0.21 0.19 0.03 1.74 -0.64 -1.98 116.66 115.69 3dzf n ARG 78 Ca 0.12 0.12 0.07 0.00 -0.77 0.00 0.00 57.85 57.39 3dzf n ARG 78 Cb 0.54 -1.50 0.29 0.00 -1.02 0.00 0.00 32.46 30.76 3dzf n ARG 78 CO 0.00 0.00 0.00 1.12 -1.52 0.00 0.00 177.63 177.23 3dzf h HIS 79 N 0.00 0.00 -2.32 -1.55 2.07 -1.84 -3.45 115.15 108.06 3dzf h HIS 79 Ca 0.00 0.00 -0.58 0.00 -2.85 0.00 0.00 60.37 56.94 3dzf h HIS 79 Cb 0.21 0.00 0.06 0.00 2.57 0.00 0.00 27.41 30.25 3dzf h HIS 79 CO 0.00 0.30 0.79 0.28 -3.07 0.00 0.00 177.93 176.23 3dzf n VAL 80 N -3.32 0.08 -2.98 6.12 0.31 -0.84 -4.95 118.33 112.75 3dzf n VAL 80 Ca 0.01 -0.02 -0.43 0.00 -0.01 0.00 0.00 64.34 63.89 3dzf n VAL 80 Cb 0.54 -1.55 -0.05 0.00 -0.91 0.00 0.00 33.84 31.87 3dzf n VAL 80 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3dzf s ASP 81 N 0.87 6.24 0.45 4.52 3.68 -1.26 -4.94 116.67 126.23 3dzf s ASP 81 Ca 0.78 -0.85 0.12 0.00 2.13 0.00 0.00 52.55 54.73 3dzf s ASP 81 Cb -0.67 -2.37 1.03 0.00 -1.45 0.00 0.00 42.92 39.46 3dzf s ASP 81 CO 0.39 -1.17 2.06 0.00 0.13 0.00 0.00 175.17 176.57 3dzf h GLN 83 N 0.20 0.72 -0.96 0.00 5.75 -1.96 -1.47 115.11 117.39 3dzf h GLN 83 Ca 0.05 -0.26 0.07 0.00 -0.15 0.00 0.00 58.65 58.36 3dzf h GLN 83 Cb 0.09 -0.05 -0.07 0.00 1.07 0.00 0.00 27.48 28.52 3dzf h GLN 83 CO -0.00 0.85 0.61 0.77 -2.65 0.00 0.00 178.83 178.41 3dzf h SER 84 N 0.53 0.97 -0.24 -0.69 0.02 -1.64 -1.93 113.55 110.57 3dzf h SER 84 Ca 0.10 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.02 3dzf h SER 84 Cb 0.56 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 3dzf h SER 84 CO 0.03 0.62 -0.02 0.58 -1.14 0.00 0.00 176.83 176.90 3dzf h VAL 85 N 1.11 1.27 -0.34 2.27 2.07 -0.32 -1.76 116.25 120.55 3dzf h VAL 85 Ca 0.42 -0.95 0.03 0.00 0.82 0.00 0.00 66.70 67.02 3dzf h VAL 85 Cb 0.18 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 3dzf h VAL 85 CO -0.18 0.30 0.13 -0.25 0.02 0.00 0.00 177.57 177.59 3dzf h TRP 86 N 0.20 0.24 -0.81 1.57 2.91 -1.16 -0.38 115.95 118.52 3dzf h TRP 86 Ca 0.07 0.02 0.04 0.00 1.13 0.00 0.00 58.89 60.14 3dzf h TRP 86 Cb 0.45 -0.06 -0.05 0.00 -0.51 0.00 0.00 29.16 28.99 3dzf h TRP 86 CO 0.04 0.11 0.53 -0.44 -1.03 0.00 0.00 178.44 177.66 3dzf h ASP 87 N 0.29 0.86 0.34 2.65 3.32 -1.24 0.45 116.42 123.09 3dzf h ASP 87 Ca 0.15 -0.01 -0.19 0.00 0.02 0.00 0.00 57.03 57.00 3dzf h ASP 87 Cb 0.10 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 3dzf h ASP 87 CO -0.14 0.59 -0.79 0.00 -1.72 0.00 0.00 179.24 177.18 3dzf h ALA 88 N 1.53 0.55 0.81 3.45 0.00 -0.95 -0.02 119.26 124.63 3dzf h ALA 88 Ca 0.32 -0.65 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 3dzf h ALA 88 Cb 0.05 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.79 3dzf h ALA 88 CO -0.10 0.80 -0.39 0.35 0.00 0.00 0.00 179.25 179.92 3dzf h PHE 89 N 0.23 -1.00 -0.92 0.00 3.04 -0.14 -2.05 116.94 116.08 3dzf h PHE 89 Ca -0.04 -0.02 0.17 0.00 3.98 0.00 0.00 57.97 62.06 3dzf h PHE 89 Cb 1.39 0.33 -0.17 0.00 2.56 0.00 0.00 35.95 40.06 3dzf h PHE 89 CO 0.04 -0.62 -0.28 -0.22 -2.02 0.00 0.00 178.31 175.21 3dzf h LYS 90 N -1.22 -0.01 0.00 1.11 3.64 -0.23 -1.27 116.57 118.60 3dzf h LYS 90 Ca -0.11 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 3dzf h LYS 90 Cb 0.83 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.65 3dzf h LYS 90 CO 0.18 -0.01 -0.04 0.78 -2.27 0.00 0.00 179.45 178.10 3dzf h GLY 91 N -0.01 0.00 1.87 5.01 0.00 -0.87 0.27 103.07 109.34 3dzf h GLY 91 Ca 0.41 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.71 3dzf h GLY 91 CO -0.95 0.00 -0.03 0.00 0.00 0.00 0.00 176.54 175.56 3dzf h ALA 92 N 1.96 1.73 0.00 3.60 0.00 -0.48 -3.38 119.26 122.70 3dzf h ALA 92 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3dzf h ALA 92 Cb 0.33 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3dzf h ALA 92 CO 0.00 0.20 -0.29 1.97 0.00 0.00 0.00 179.25 181.13 3dzf n PHE 93 N -4.40 0.00 -1.84 0.00 1.16 -0.85 -4.78 117.46 106.75 3dzf n PHE 93 Ca -0.01 0.00 -0.41 0.00 -1.87 0.00 0.00 57.45 55.16 3dzf n PHE 93 Cb 0.17 0.00 -0.01 0.00 -1.61 0.00 0.00 39.48 38.04 3dzf n PHE 93 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 3dzf s ILE 94 N -0.72 2.14 -1.67 1.97 -1.09 0.89 -2.41 121.20 120.32 3dzf s ILE 94 Ca 0.00 0.13 0.00 0.00 -2.23 0.00 0.00 60.65 58.55 3dzf s ILE 94 Cb 0.00 -3.09 0.00 0.00 -1.58 0.00 0.00 42.46 37.79 3dzf s ILE 94 CO 0.00 0.03 0.00 -1.20 -1.23 0.00 0.00 174.94 172.54 3dzf n SER 95 N 0.68 -5.14 -4.25 3.58 7.64 -1.08 -4.93 113.62 110.12 3dzf n SER 95 Ca 0.02 0.17 -0.21 0.00 1.01 0.00 0.00 58.87 59.86 3dzf n SER 95 Cb 0.39 -4.38 -0.12 0.00 -1.01 0.00 0.00 64.21 59.09 3dzf n SER 95 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3dzf s LYS 96 N -4.59 1.05 -0.12 1.43 1.02 -1.01 -4.71 119.74 112.80 3dzf s LYS 96 Ca 0.00 -1.16 -0.29 0.00 0.02 0.00 0.00 55.97 54.53 3dzf s LYS 96 Cb 0.00 -1.13 -0.02 0.00 -0.52 0.00 0.00 37.83 36.15 3dzf s LYS 96 CO 0.00 0.25 1.29 -1.58 -0.92 0.00 0.00 175.35 174.39 3dzf s HIS 97 N -1.53 2.85 -1.32 3.18 5.65 -1.26 -3.37 115.29 119.49 3dzf s HIS 97 Ca 0.06 0.97 0.03 0.00 0.25 0.00 0.00 55.06 56.37 3dzf s HIS 97 Cb -0.08 -3.53 0.13 0.00 -1.18 0.00 0.00 32.58 27.91 3dzf s HIS 97 CO 0.04 -1.84 0.94 -0.35 -0.65 0.00 0.00 174.74 172.88 3dzf n PRO 98 N 6.27 0.03 0.00 2.88 -0.05 -1.26 -0.84 135.00 142.02 3dzf n PRO 98 Ca 0.13 0.31 0.12 0.00 -0.05 0.00 0.00 63.50 64.01 3dzf n PRO 98 Cb 0.45 -1.50 0.08 0.00 -0.05 0.00 0.00 33.50 32.48 3dzf n PRO 98 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 3dzf n ASP 100 N 1.11 2.20 -4.78 0.00 10.43 -0.02 -4.56 116.55 120.93 3dzf n ASP 100 Ca 0.13 -3.11 -0.37 0.00 2.57 0.00 0.00 54.79 54.01 3dzf n ASP 100 Cb 0.56 -0.43 -0.05 0.00 1.84 0.00 0.00 41.12 43.05 3dzf n ASP 100 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 3dzf s ILE 101 N -2.79 3.78 0.17 0.53 -1.09 -1.17 -4.94 121.20 115.70 3dzf s ILE 101 Ca 0.31 1.44 0.04 0.00 -2.23 0.00 0.00 60.65 60.22 3dzf s ILE 101 Cb 0.28 -3.78 -0.05 0.00 -1.58 0.00 0.00 42.46 37.33 3dzf s ILE 101 CO 0.02 0.09 -0.08 0.42 -1.23 0.00 0.00 174.94 174.15 3dzf s THR 102 N -1.58 1.17 0.32 2.92 -4.23 -1.26 -4.80 115.64 108.18 3dzf s THR 102 Ca 0.54 -2.06 0.05 0.00 -1.18 0.00 0.00 61.69 59.04 3dzf s THR 102 Cb -0.23 -1.98 0.41 0.00 1.34 0.00 0.00 72.50 72.04 3dzf s THR 102 CO 0.29 -0.64 1.57 -0.33 -0.54 0.00 0.00 174.62 174.97 3dzf h GLU 103 N 2.69 0.00 -0.50 3.99 5.08 -1.97 0.27 114.58 124.15 3dzf h GLU 103 Ca -0.37 -0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.08 3dzf h GLU 103 Cb 1.20 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 3dzf h GLU 103 CO 0.64 0.00 0.34 0.93 -1.00 0.00 0.00 179.01 179.92 3dzf h GLU 104 N 0.00 0.29 -0.22 2.33 3.07 -1.99 0.39 114.58 118.45 3dzf h GLU 104 Ca 0.64 -0.02 0.04 0.00 -0.50 0.00 0.00 59.36 59.52 3dzf h GLU 104 Cb 1.41 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 29.24 3dzf h GLU 104 CO -0.91 0.19 0.15 -0.44 -1.40 0.00 0.00 179.01 176.61 3dzf h ASP 105 N 0.29 0.12 -0.29 1.42 3.32 -0.79 -2.66 116.42 117.84 3dzf h ASP 105 Ca 0.23 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 3dzf h ASP 105 Cb 0.51 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.04 3dzf h ASP 105 CO -0.05 0.08 0.00 -1.22 -1.72 0.00 0.00 179.24 176.33 3dzf n TYR 106 N -4.49 0.38 -0.18 4.55 4.02 0.14 -4.27 117.16 117.30 3dzf n TYR 106 Ca 0.02 -0.19 -0.07 0.00 -0.01 0.00 0.00 57.90 57.64 3dzf n TYR 106 Cb 0.20 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.54 3dzf n TYR 106 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 3dzf h GLN 107 N 2.95 0.71 -0.59 -0.72 1.08 -1.42 -0.63 115.11 116.49 3dzf h GLN 107 Ca 0.00 -0.07 0.01 0.00 -1.45 0.00 0.00 58.65 57.14 3dzf h GLN 107 Cb 0.65 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.91 3dzf h GLN 107 CO 0.00 0.54 0.38 -1.35 -0.95 0.00 0.00 178.83 177.45 3dzf h PRO 108 N 0.69 0.75 -0.53 1.46 0.11 -1.82 -1.27 132.00 131.40 3dzf h PRO 108 Ca 0.18 -0.05 0.05 0.00 0.11 0.00 0.00 66.00 66.30 3dzf h PRO 108 Cb 0.02 -0.17 -0.05 0.00 0.11 0.00 0.00 31.00 30.91 3dzf h PRO 108 CO -0.03 0.50 0.26 1.25 -0.21 0.00 0.00 178.00 179.76 3dzf h LEU 109 N 0.77 0.35 -0.89 2.35 5.85 -1.68 -2.03 115.31 120.03 3dzf h LEU 109 Ca 0.22 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 3dzf h LEU 109 Cb -0.06 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 3dzf h LEU 109 CO -0.06 0.24 0.47 0.24 -0.34 0.00 0.00 178.44 178.98 3dzf h MET 110 N 0.49 1.26 0.19 1.25 2.86 -0.80 0.17 114.93 120.34 3dzf h MET 110 Ca 0.24 -0.16 -0.01 0.00 -2.06 0.00 0.00 59.70 57.71 3dzf h MET 110 Cb 0.17 -0.24 -0.00 0.00 0.06 0.00 0.00 31.60 31.59 3dzf h MET 110 CO -0.18 0.93 -0.11 -0.22 1.06 0.00 0.00 176.91 178.39 3dzf h LYS 111 N 1.25 -0.28 0.00 1.72 3.64 -1.05 -0.96 116.57 120.89 3dzf h LYS 111 Ca 0.31 0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.64 3dzf h LYS 111 Cb 0.06 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 3dzf h LYS 111 CO -0.05 -0.19 -0.32 -0.07 -2.27 0.00 0.00 179.45 176.56 3dzf h LEU 112 N -0.29 0.00 -1.30 5.20 3.38 -1.06 -2.79 115.31 118.44 3dzf h LEU 112 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3dzf h LEU 112 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3dzf h LEU 112 CO 0.02 0.32 0.00 0.61 0.09 0.00 0.00 178.44 179.48 3dzf n GLY 113 N -0.24 0.55 3.58 0.83 0.00 0.56 -4.97 105.19 105.50 3dzf n GLY 113 Ca -0.01 -0.45 -0.50 0.00 0.00 0.00 0.00 46.02 45.06 3dzf n GLY 113 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3dzf n THR 114 N 0.51 0.65 -3.63 2.61 -1.04 -0.39 -4.76 114.28 108.23 3dzf n THR 114 Ca 0.16 -0.16 -0.04 0.00 -2.04 0.00 0.00 64.05 61.96 3dzf n THR 114 Cb 0.36 -0.84 -0.06 0.00 -1.82 0.00 0.00 70.33 67.96 3dzf n THR 114 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 3dzf s GLN 115 N -0.15 0.61 -0.41 -2.82 0.74 -1.26 -5.08 119.66 111.29 3dzf s GLN 115 Ca 0.76 1.18 -0.17 0.00 0.05 0.00 0.00 55.36 57.18 3dzf s GLN 115 Cb -0.88 0.33 0.02 0.00 1.10 0.00 0.00 33.01 33.58 3dzf s GLN 115 CO 0.51 -0.15 0.40 0.99 -0.55 0.00 0.00 175.29 176.49 3dzf s THR 116 N 1.95 5.13 0.16 -0.34 2.01 -1.26 -5.06 115.64 118.23 3dzf s THR 116 Ca -0.08 -0.41 0.01 0.00 0.31 0.00 0.00 61.69 61.51 3dzf s THR 116 Cb -0.07 -4.00 -0.04 0.00 0.01 0.00 0.00 72.50 68.40 3dzf s THR 116 CO -0.19 -0.38 0.33 0.68 -0.69 0.00 0.00 174.62 174.37 3dzf s VAL 117 N 2.02 5.27 -0.11 3.82 -7.23 -1.26 -5.03 120.40 117.88 3dzf s VAL 117 Ca 0.10 -0.49 -0.33 0.00 -1.81 0.00 0.00 61.98 59.45 3dzf s VAL 117 Cb -0.17 -3.72 -0.11 0.00 0.56 0.00 0.00 36.38 32.93 3dzf s VAL 117 CO 0.13 -0.10 1.94 -2.65 -0.31 0.00 0.00 175.10 174.11 3dzf n PRO 118 N -0.49 2.14 0.25 4.82 -0.02 -1.26 -4.86 135.00 135.58 3dzf n PRO 118 Ca -0.06 0.76 0.12 0.00 -2.02 0.00 0.00 63.50 62.31 3dzf n PRO 118 Cb 0.53 -2.71 0.65 0.00 -0.02 0.00 0.00 33.50 31.96 3dzf n PRO 118 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dzf n ASN 120 N -3.53 1.46 -1.31 0.00 6.94 -1.25 -1.18 115.26 116.39 3dzf n ASN 120 Ca -0.01 -2.05 -0.07 0.00 -0.02 0.00 0.00 54.58 52.42 3dzf n ASN 120 Cb 0.30 -0.23 0.12 0.00 -2.36 0.00 0.00 39.78 37.61 3dzf n ASN 120 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3dzf n LYS 121 N 0.18 2.43 -4.31 -3.83 4.76 -0.88 -4.69 118.16 111.81 3dzf n LYS 121 Ca 0.08 -3.65 -0.34 0.00 -2.87 0.00 0.00 58.31 51.52 3dzf n LYS 121 Cb 0.26 -1.86 -0.10 0.00 -1.84 0.00 0.00 35.03 31.49 3dzf n LYS 121 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3dzf s ILE 122 N -3.75 4.27 -0.24 -0.18 1.01 -1.26 -1.34 121.20 119.70 3dzf s ILE 122 Ca 0.43 -0.24 0.01 0.00 0.00 0.00 0.00 60.65 60.85 3dzf s ILE 122 Cb 0.39 -2.85 0.06 0.00 0.01 0.00 0.00 42.46 40.07 3dzf s ILE 122 CO -0.02 0.54 -0.05 -0.22 0.00 0.00 0.00 174.94 175.19 3dzf s LEU 123 N -0.21 2.72 0.57 2.97 2.96 0.31 -2.20 118.68 125.81 3dzf s LEU 123 Ca 0.05 -1.25 -0.00 0.00 -0.22 0.00 0.00 54.13 52.70 3dzf s LEU 123 Cb -0.12 -1.22 0.03 0.00 0.50 0.00 0.00 46.19 45.38 3dzf s LEU 123 CO 0.02 -0.24 0.81 -0.76 -1.32 0.00 0.00 176.35 174.85 3dzf s LEU 124 N 1.36 3.24 0.09 -0.68 1.43 0.10 -3.96 118.68 120.26 3dzf s LEU 124 Ca -0.05 0.13 -0.14 0.00 -1.03 0.00 0.00 54.13 53.05 3dzf s LEU 124 Cb -0.19 -2.97 0.02 0.00 0.03 0.00 0.00 46.19 43.08 3dzf s LEU 124 CO -0.07 -1.16 0.32 -1.66 0.23 0.00 0.00 176.35 174.01 3dzf s TRP 125 N -2.83 -0.08 -0.09 0.29 1.48 -1.26 -0.54 118.94 115.90 3dzf s TRP 125 Ca 0.57 -0.21 -0.01 0.00 -1.06 0.00 0.00 56.10 55.38 3dzf s TRP 125 Cb -0.10 0.13 0.03 0.00 -1.16 0.00 0.00 33.47 32.37 3dzf s TRP 125 CO 0.40 -0.61 -0.00 0.45 -4.06 0.00 0.00 176.95 173.13 3dzf s SER 126 N -2.62 1.82 -0.51 -2.66 0.15 -0.42 -4.75 113.70 104.72 3dzf s SER 126 Ca 0.01 -0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.46 3dzf s SER 126 Cb 0.02 -0.50 0.00 0.00 -1.71 0.00 0.00 66.02 63.83 3dzf s SER 126 CO -0.09 -0.20 0.00 0.54 1.20 0.00 0.00 173.24 174.68 3dzf n ARG 127 N 5.12 -0.56 -2.71 5.44 3.00 -1.26 -3.85 116.66 121.84 3dzf n ARG 127 Ca -0.08 0.56 -0.07 0.00 -0.01 0.00 0.00 57.85 58.25 3dzf n ARG 127 Cb 0.50 -4.27 0.11 0.00 0.00 0.00 0.00 32.46 28.80 3dzf n ARG 127 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.63 179.14 3dzf n ILE 128 N -2.75 0.03 0.10 0.55 3.06 -1.26 -4.74 119.36 114.34 3dzf n ILE 128 Ca -0.05 -1.56 -0.03 0.00 -2.50 0.00 0.00 62.75 58.62 3dzf n ILE 128 Cb 0.21 1.07 -0.00 0.00 0.54 0.00 0.00 39.64 41.46 3dzf n ILE 128 CO 0.00 0.00 0.00 0.07 -2.50 0.00 0.00 176.55 174.12 3dzf h LYS 129 N 2.20 0.00 0.12 9.51 2.10 -1.95 -3.22 116.57 125.33 3dzf h LYS 129 Ca -0.24 0.00 0.02 0.00 -2.00 0.00 0.00 60.65 58.42 3dzf h LYS 129 Cb 1.26 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.56 3dzf h LYS 129 CO -0.02 0.77 -0.28 -0.44 -2.00 0.00 0.00 179.45 177.48 3dzf h ASP 130 N 0.00 -0.80 -0.74 7.07 3.32 -1.99 -0.77 116.42 122.50 3dzf h ASP 130 Ca -0.01 0.09 0.07 0.00 0.02 0.00 0.00 57.03 57.21 3dzf h ASP 130 Cb 1.51 0.30 -0.06 0.00 0.22 0.00 0.00 39.33 41.30 3dzf h ASP 130 CO 0.10 -0.37 0.42 0.25 -1.72 0.00 0.00 179.24 177.91 3dzf h LEU 131 N -0.50 0.61 -0.71 1.55 6.46 -2.00 -1.09 115.31 119.64 3dzf h LEU 131 Ca 0.03 0.04 0.03 0.00 -0.12 0.00 0.00 57.88 57.85 3dzf h LEU 131 Cb 0.53 -0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.33 3dzf h LEU 131 CO -0.16 0.38 0.44 0.00 -0.62 0.00 0.00 178.44 178.48 3dzf h ALA 132 N 1.39 0.92 -0.25 1.25 0.00 -1.46 0.27 119.26 121.37 3dzf h ALA 132 Ca 0.34 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.10 3dzf h ALA 132 Cb 0.24 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3dzf h ALA 132 CO -0.21 0.22 -0.36 0.45 0.00 0.00 0.00 179.25 179.36 3dzf h HIS 133 N 0.87 0.65 -0.37 0.00 3.86 -0.81 -2.10 115.15 117.24 3dzf h HIS 133 Ca 0.28 -0.17 -0.04 0.00 -1.16 0.00 0.00 60.37 59.28 3dzf h HIS 133 Cb 0.01 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.32 3dzf h HIS 133 CO -0.04 0.84 0.07 1.96 0.86 0.00 0.00 177.93 181.62 3dzf h GLN 134 N 0.47 0.61 -0.25 2.45 4.20 -0.67 -1.68 115.11 120.24 3dzf h GLN 134 Ca 0.05 -0.16 0.03 0.00 0.06 0.00 0.00 58.65 58.63 3dzf h GLN 134 Cb 0.84 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.51 3dzf h GLN 134 CO 0.07 0.67 0.06 0.35 -0.67 0.00 0.00 178.83 179.30 3dzf h PHE 135 N 0.46 0.10 0.00 2.96 3.04 -0.27 -2.15 116.94 121.08 3dzf h PHE 135 Ca 0.12 0.01 -0.03 0.00 3.98 0.00 0.00 57.97 62.05 3dzf h PHE 135 Cb 0.34 -0.01 -0.00 0.00 2.56 0.00 0.00 35.95 38.84 3dzf h PHE 135 CO 0.02 0.03 -0.16 1.79 -2.02 0.00 0.00 178.31 177.97 3dzf h THR 136 N 0.16 0.46 0.00 4.41 1.35 -1.21 0.71 112.91 118.79 3dzf h THR 136 Ca 0.11 -0.86 0.00 0.00 -0.55 0.00 0.00 66.41 65.11 3dzf h THR 136 Cb 0.11 1.61 0.00 0.00 -1.73 0.00 0.00 68.15 68.13 3dzf h THR 136 CO -0.14 0.16 0.00 0.00 -0.25 0.00 0.00 175.52 175.29 3dzf n GLN 137 N -3.40 0.23 -0.11 4.72 6.02 -0.65 -3.26 117.38 120.94 3dzf n GLN 137 Ca -0.00 0.31 -0.17 0.00 -0.01 0.00 0.00 57.00 57.13 3dzf n GLN 137 Cb 0.36 -1.84 -0.06 0.00 1.02 0.00 0.00 30.24 29.72 3dzf n GLN 137 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 3dzf n VAL 138 N -2.26 1.51 -2.50 5.09 0.31 -0.64 -4.59 118.33 115.26 3dzf n VAL 138 Ca 0.04 -0.06 -0.43 0.00 -0.01 0.00 0.00 64.34 63.88 3dzf n VAL 138 Cb 0.34 -2.17 0.00 0.00 -0.91 0.00 0.00 33.84 31.10 3dzf n VAL 138 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 3dzf n GLN 139 N -4.39 3.20 0.00 5.55 -0.06 0.24 -4.76 117.38 117.16 3dzf n GLN 139 Ca -0.29 -3.29 0.00 0.00 -2.00 0.00 0.00 57.00 51.41 3dzf n GLN 139 Cb 0.65 -3.35 0.01 0.00 -4.06 0.00 0.00 30.24 23.49 3dzf n GLN 139 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 3dzf n ARG 140 N 7.24 0.02 0.03 3.69 5.12 -1.20 -1.64 116.66 129.92 3dzf n ARG 140 Ca 0.47 0.00 0.04 0.00 -1.93 0.00 0.00 57.85 56.42 3dzf n ARG 140 Cb 0.44 -1.14 -0.08 0.00 -1.16 0.00 0.00 32.46 30.52 3dzf n ARG 140 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 3dzf n ASP 141 N -0.64 0.63 -4.47 0.55 2.03 -1.26 -4.96 116.55 108.43 3dzf n ASP 141 Ca 0.00 0.27 -0.28 0.00 0.52 0.00 0.00 54.79 55.30 3dzf n ASP 141 Cb 0.00 0.62 -0.11 0.00 -0.72 0.00 0.00 41.12 40.91 3dzf n ASP 141 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 3dzf s MET 142 N -3.10 1.69 -0.02 -0.67 -1.94 -0.65 -4.88 119.30 109.73 3dzf s MET 142 Ca -0.04 -1.36 0.03 0.00 -1.71 0.00 0.00 55.69 52.61 3dzf s MET 142 Cb 0.10 -1.99 -0.00 0.00 2.01 0.00 0.00 34.83 34.95 3dzf s MET 142 CO 0.82 0.43 -0.11 -0.06 -0.01 0.00 0.00 175.02 176.10 3dzf s PHE 143 N -1.47 1.11 0.53 -0.03 0.08 -0.45 -4.81 117.98 112.94 3dzf s PHE 143 Ca 0.20 -0.27 0.09 0.00 0.12 0.00 0.00 56.93 57.07 3dzf s PHE 143 Cb -0.09 -0.76 0.06 0.00 -0.57 0.00 0.00 43.02 41.66 3dzf s PHE 143 CO 0.11 -0.09 0.69 0.95 -0.10 0.00 0.00 175.22 176.78 3dzf s THR 144 N 0.03 2.32 0.31 0.64 -4.23 -1.25 -0.53 115.64 112.92 3dzf s THR 144 Ca -0.01 -1.06 0.02 0.00 -1.18 0.00 0.00 61.69 59.46 3dzf s THR 144 Cb -0.08 -2.38 0.16 0.00 1.34 0.00 0.00 72.50 71.55 3dzf s THR 144 CO 0.00 0.00 1.86 0.25 -0.54 0.00 0.00 174.62 176.19 3dzf h LEU 145 N 0.37 0.64 0.00 4.79 5.85 -1.98 -2.38 115.31 122.60 3dzf h LEU 145 Ca -0.33 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.28 3dzf h LEU 145 Cb 1.29 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.15 3dzf h LEU 145 CO 0.44 0.65 0.00 -0.62 -0.34 0.00 0.00 178.44 178.57 3dzf n GLU 146 N -4.29 0.33 0.00 1.25 4.71 -1.26 -1.85 120.64 119.53 3dzf n GLU 146 Ca 0.03 0.08 0.13 0.00 -0.01 0.00 0.00 57.16 57.39 3dzf n GLU 146 Cb 0.23 -1.50 0.39 0.00 -1.01 0.00 0.00 31.44 29.55 3dzf n GLU 146 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 3dzf n ASP 147 N -1.26 0.57 -4.93 1.62 9.92 -0.90 -3.36 116.55 118.21 3dzf n ASP 147 Ca 0.10 -0.38 -0.25 0.00 -0.53 0.00 0.00 54.79 53.73 3dzf n ASP 147 Cb 0.16 0.07 0.02 0.00 -0.64 0.00 0.00 41.12 40.73 3dzf n ASP 147 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 3dzf s THR 148 N -2.78 3.94 0.22 -3.53 -4.23 -0.77 -4.94 115.64 103.55 3dzf s THR 148 Ca 0.18 -0.23 -0.09 0.00 -1.18 0.00 0.00 61.69 60.38 3dzf s THR 148 Cb 0.19 -3.50 0.18 0.00 1.34 0.00 0.00 72.50 70.70 3dzf s THR 148 CO 0.59 -0.44 1.86 0.25 -0.54 0.00 0.00 174.62 176.35 3dzf h LEU 149 N 0.14 1.00 0.21 4.79 5.85 -1.87 -1.61 115.31 123.83 3dzf h LEU 149 Ca -0.46 -0.07 -0.30 0.00 0.84 0.00 0.00 57.88 57.90 3dzf h LEU 149 Cb 1.25 -0.25 0.03 0.00 0.37 0.00 0.00 40.66 42.06 3dzf h LEU 149 CO 0.59 0.77 -1.29 -0.07 -0.34 0.00 0.00 178.44 178.10 3dzf h LEU 150 N 1.14 0.77 -0.66 2.25 3.38 -1.86 -1.45 115.31 118.88 3dzf h LEU 150 Ca 0.30 -0.91 0.13 0.00 0.09 0.00 0.00 57.88 57.48 3dzf h LEU 150 Cb -0.04 -0.25 -0.09 0.00 0.09 0.00 0.00 40.66 40.37 3dzf h LEU 150 CO -0.06 1.63 0.18 1.23 0.09 0.00 0.00 178.44 181.51 3dzf h GLY 151 N 0.04 0.90 1.21 0.83 0.00 -1.61 -2.79 103.07 101.65 3dzf h GLY 151 Ca -0.22 -0.06 -0.10 0.00 0.00 0.00 0.00 47.33 46.95 3dzf h GLY 151 CO 0.24 -0.12 -0.08 -1.82 0.00 0.00 0.00 176.54 174.76 3dzf h TYR 152 N 0.31 1.03 -0.52 5.60 5.03 -1.05 -1.03 116.97 126.35 3dzf h TYR 152 Ca 0.35 -0.19 -0.07 0.00 2.58 0.00 0.00 58.73 61.40 3dzf h TYR 152 Cb 0.54 -0.26 -0.02 0.00 1.55 0.00 0.00 36.73 38.53 3dzf h TYR 152 CO -0.23 0.96 0.03 -0.07 -1.32 0.00 0.00 178.16 177.53 3dzf h LEU 153 N 0.85 0.82 0.00 2.82 3.38 -1.04 -3.29 115.31 118.85 3dzf h LEU 153 Ca 0.14 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3dzf h LEU 153 Cb 0.61 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3dzf h LEU 153 CO 0.04 0.87 -1.27 0.00 0.09 0.00 0.00 178.44 178.17 3dzf n ALA 154 N -2.47 3.91 -1.65 1.53 0.00 -1.00 -4.76 120.51 116.06 3dzf n ALA 154 Ca 0.03 -0.53 -0.52 0.00 0.00 0.00 0.00 53.44 52.42 3dzf n ALA 154 Cb 0.30 -0.82 -0.06 0.00 0.00 0.00 0.00 19.45 18.87 3dzf n ALA 154 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3dzf n ASP 155 N -1.80 2.41 0.00 0.00 4.64 -0.42 -1.00 116.55 120.38 3dzf n ASP 155 Ca 0.01 1.08 0.00 0.00 -1.38 0.00 0.00 54.79 54.50 3dzf n ASP 155 Cb 0.42 -1.25 0.00 0.00 -1.04 0.00 0.00 41.12 39.25 3dzf n ASP 155 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 3dzf n ASP 156 N 4.17 -4.74 -5.01 1.67 8.00 -1.26 -5.02 116.55 114.36 3dzf n ASP 156 Ca 0.21 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.54 3dzf n ASP 156 Cb 0.21 -2.43 0.01 0.00 -0.02 0.00 0.00 41.12 38.88 3dzf n ASP 156 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3dzf s LEU 157 N 0.00 3.69 0.05 0.64 1.43 -0.17 -5.05 118.68 119.26 3dzf s LEU 157 Ca 0.00 -0.37 0.01 0.00 -1.03 0.00 0.00 54.13 52.74 3dzf s LEU 157 Cb 0.00 -2.68 -0.03 0.00 0.03 0.00 0.00 46.19 43.51 3dzf s LEU 157 CO 0.00 -0.73 -0.06 -0.89 0.23 0.00 0.00 176.35 174.90 3dzf s THR 158 N -2.34 0.45 -0.02 5.49 2.01 -1.26 -4.98 115.64 114.99 3dzf s THR 158 Ca 0.54 -1.30 -0.29 0.00 0.31 0.00 0.00 61.69 60.94 3dzf s THR 158 Cb -0.10 -0.86 0.08 0.00 0.01 0.00 0.00 72.50 71.63 3dzf s THR 158 CO 0.33 -0.57 0.70 -1.66 -0.69 0.00 0.00 174.62 172.73 3dzf s TRP 159 N -2.13 -0.59 -0.07 4.92 -2.14 -1.26 -0.99 118.94 116.67 3dzf s TRP 159 Ca -0.05 0.88 -0.32 0.00 2.66 0.00 0.00 56.10 59.28 3dzf s TRP 159 Cb -0.05 0.45 0.12 0.00 -3.10 0.00 0.00 33.47 30.89 3dzf s TRP 159 CO -0.02 -0.63 1.12 0.00 -2.66 0.00 0.00 176.95 174.76 3dzf n GLY 161 N -0.25 5.80 3.19 0.00 0.00 -1.26 -1.55 105.19 111.12 3dzf n GLY 161 Ca -0.04 -1.82 -0.13 0.00 0.00 0.00 0.00 46.02 44.03 3dzf n GLY 161 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dzf s GLU 162 N 1.72 0.37 0.16 1.61 2.02 -1.24 -4.57 118.70 118.76 3dzf s GLU 162 Ca 0.00 0.39 -0.16 0.00 0.02 0.00 0.00 54.97 55.22 3dzf s GLU 162 Cb 0.00 0.18 0.07 0.00 0.10 0.00 0.00 34.13 34.47 3dzf s GLU 162 CO 0.00 -0.05 1.75 0.35 0.02 0.00 0.00 175.26 177.33 3dzf h PHE 163 N 5.57 0.24 0.00 1.61 3.57 -1.83 -3.03 116.94 123.06 3dzf h PHE 163 Ca -0.26 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.26 3dzf h PHE 163 Cb 1.19 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.87 3dzf h PHE 163 CO 0.41 0.10 0.00 -0.25 -2.23 0.00 0.00 178.31 176.34 3dzf n ASP 164 N -5.01 0.00 -3.51 0.41 8.00 -1.26 -4.51 116.55 110.67 3dzf n ASP 164 Ca 0.01 -1.28 -0.08 0.00 0.71 0.00 0.00 54.79 54.15 3dzf n ASP 164 Cb 0.13 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.21 3dzf n ASP 164 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3dzf s THR 165 N -2.00 0.00 -0.68 -3.53 -1.32 -1.15 -5.02 115.64 101.95 3dzf s THR 165 Ca 0.06 -0.01 0.13 0.00 -1.21 0.00 0.00 61.69 60.65 3dzf s THR 165 Cb 0.03 -1.02 0.67 0.00 -1.51 0.00 0.00 72.50 70.66 3dzf s THR 165 CO 0.04 0.00 1.54 -1.54 -2.21 0.00 0.00 174.62 172.45 3dzf n SER 166 N -0.24 4.69 -4.80 8.08 3.41 -1.26 -2.63 113.62 120.87 3dzf n SER 166 Ca -0.08 -2.63 -0.38 0.00 -0.26 0.00 0.00 58.87 55.52 3dzf n SER 166 Cb 0.62 -0.61 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 3dzf n SER 166 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3dzf s LYS 167 N -2.23 4.35 0.23 4.33 1.02 -1.26 -4.72 119.74 121.47 3dzf s LYS 167 Ca 0.45 0.95 -0.30 0.00 0.02 0.00 0.00 55.97 57.09 3dzf s LYS 167 Cb 0.33 -3.07 -0.09 0.00 -0.52 0.00 0.00 37.83 34.47 3dzf s LYS 167 CO 0.16 0.50 1.32 0.42 -0.92 0.00 0.00 175.35 176.82 3dzf s ILE 168 N -1.33 3.06 -0.52 2.17 1.01 -1.26 -3.77 121.20 120.56 3dzf s ILE 168 Ca 0.38 0.91 -0.20 0.00 0.00 0.00 0.00 60.65 61.75 3dzf s ILE 168 Cb -0.19 -3.58 0.06 0.00 0.01 0.00 0.00 42.46 38.75 3dzf s ILE 168 CO 0.23 0.16 0.69 0.21 0.00 0.00 0.00 174.94 176.22 3dzf s ASN 169 N 0.13 6.24 0.00 3.58 3.84 -0.60 -4.87 114.94 123.27 3dzf s ASN 169 Ca 0.55 -0.86 0.25 0.00 0.21 0.00 0.00 52.86 53.01 3dzf s ASN 169 Cb -0.38 -2.32 0.42 0.00 -0.55 0.00 0.00 41.25 38.43 3dzf s ASN 169 CO 0.42 -0.98 1.36 -1.22 -2.79 0.00 0.00 177.10 173.88 3dzf n TYR 170 N 6.43 0.00 -0.05 0.43 4.02 -1.26 -0.90 117.16 125.83 3dzf n TYR 170 Ca -0.05 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.64 3dzf n TYR 170 Cb 0.45 -0.08 -0.13 0.00 -0.02 0.00 0.00 39.34 39.57 3dzf n TYR 170 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 3dzf h GLN 171 N 1.57 0.10 -3.13 -0.72 4.20 -1.89 -3.37 115.11 111.87 3dzf h GLN 171 Ca 0.00 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.53 3dzf h GLN 171 Cb 0.60 0.06 -0.10 0.00 0.30 0.00 0.00 27.48 28.34 3dzf h GLN 171 CO 0.00 1.08 0.13 -1.54 -0.67 0.00 0.00 178.83 177.83 3dzf s SER 172 N -6.78 -0.39 0.10 1.46 1.04 -1.26 -3.50 113.70 104.37 3dzf s SER 172 Ca -0.23 -0.28 -0.08 0.00 0.48 0.00 0.00 55.95 55.84 3dzf s SER 172 Cb 0.03 0.60 -0.01 0.00 0.10 0.00 0.00 66.02 66.75 3dzf s SER 172 CO 0.69 -1.05 0.18 0.00 0.98 0.00 0.00 173.24 174.03 3dzf s PRO 174 N -3.89 4.25 -0.12 0.00 0.02 -1.26 -0.98 135.00 133.02 3dzf s PRO 174 Ca 0.08 2.25 -0.30 0.00 0.02 0.00 0.00 61.00 63.06 3dzf s PRO 174 Cb 0.05 -3.24 -0.01 0.00 0.02 0.00 0.00 34.50 31.32 3dzf s PRO 174 CO -0.08 -0.56 1.06 0.34 -0.33 0.00 0.00 177.00 177.42 3dzf s ASP 175 N 1.27 7.18 0.31 2.53 -1.08 -1.26 -4.67 116.67 120.94 3dzf s ASP 175 Ca 0.68 1.57 0.07 0.00 -0.52 0.00 0.00 52.55 54.35 3dzf s ASP 175 Cb -0.41 -2.55 0.84 0.00 -1.46 0.00 0.00 42.92 39.34 3dzf s ASP 175 CO 0.31 -0.52 1.70 -0.25 0.52 0.00 0.00 175.17 176.93 3dzf h TRP 176 N 7.26 0.79 0.07 -5.34 7.01 -1.94 0.11 115.95 123.92 3dzf h TRP 176 Ca -0.30 0.04 -0.26 0.00 2.11 0.00 0.00 58.89 60.48 3dzf h TRP 176 Cb 1.13 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 27.98 3dzf h TRP 176 CO 0.72 -0.05 -1.37 -0.09 -2.79 0.00 0.00 178.44 174.87 3dzf h ARG 177 N 0.43 0.16 0.00 2.65 2.43 -1.92 -3.10 114.38 115.04 3dzf h ARG 177 Ca 0.62 -0.27 -0.01 0.00 -0.81 0.00 0.00 59.98 59.50 3dzf h ARG 177 Cb 1.22 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.87 3dzf h ARG 177 CO -0.53 1.13 -0.67 0.87 -1.51 0.00 0.00 179.97 179.26 3dzf h LYS 178 N -0.50 0.00 0.00 0.20 1.57 -1.90 -3.43 116.57 112.51 3dzf h LYS 178 Ca -0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 3dzf h LYS 178 Cb 1.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.93 3dzf h LYS 178 CO -0.02 0.04 0.00 -0.25 -0.57 0.00 0.00 179.45 178.65 3dzf n ASP 179 N -2.86 0.00 -3.58 0.86 8.00 0.33 -4.96 116.55 114.35 3dzf n ASP 179 Ca 0.01 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.37 3dzf n ASP 179 Cb 0.57 -0.09 -0.06 0.00 -0.02 0.00 0.00 41.12 41.52 3dzf n ASP 179 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dzf h SER 181 N 3.63 0.00 -1.41 0.00 4.64 -1.81 -3.35 113.55 115.25 3dzf h SER 181 Ca -0.26 -0.03 -0.76 0.00 -0.47 0.00 0.00 61.79 60.28 3dzf h SER 181 Cb 1.16 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.09 3dzf h SER 181 CO 0.23 0.01 2.09 0.59 -0.87 0.00 0.00 176.83 178.89 3dzf n ASN 182 N -2.72 6.69 -4.91 4.97 3.02 -1.26 -4.59 115.26 116.46 3dzf n ASN 182 Ca 0.02 -3.17 -0.20 0.00 -0.03 0.00 0.00 54.58 51.20 3dzf n ASN 182 Cb 0.52 -1.39 -0.02 0.00 -0.61 0.00 0.00 39.78 38.27 3dzf n ASN 182 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3dzf s ASN 183 N 0.34 5.30 0.25 6.41 4.22 -1.22 -3.02 114.94 127.23 3dzf s ASN 183 Ca 0.46 -0.58 -0.06 0.00 -2.14 0.00 0.00 52.86 50.55 3dzf s ASN 183 Cb 0.14 -0.73 0.28 0.00 1.28 0.00 0.00 41.25 42.22 3dzf s ASN 183 CO -0.04 -0.59 1.92 -0.65 -2.04 0.00 0.00 177.10 175.70 3dzf h PRO 184 N 0.99 1.26 0.14 3.55 0.11 -1.83 -0.03 132.00 136.20 3dzf h PRO 184 Ca -0.42 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 3dzf h PRO 184 Cb 1.27 -0.29 0.00 0.00 0.11 0.00 0.00 31.00 32.09 3dzf h PRO 184 CO 0.55 0.84 -0.07 0.28 -0.21 0.00 0.00 178.00 179.39 3dzf h VAL 185 N 1.30 1.03 -0.73 3.15 2.07 -1.95 -1.67 116.25 119.45 3dzf h VAL 185 Ca 0.38 -0.96 -0.04 0.00 0.82 0.00 0.00 66.70 66.90 3dzf h VAL 185 Cb -0.08 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 3dzf h VAL 185 CO -0.10 0.22 0.30 0.28 0.02 0.00 0.00 177.57 178.29 3dzf h SER 186 N -0.66 1.00 -0.73 0.57 0.02 -1.83 -2.15 113.55 109.78 3dzf h SER 186 Ca -0.02 -0.17 -0.05 0.00 -0.84 0.00 0.00 61.79 60.71 3dzf h SER 186 Cb 0.50 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 3dzf h SER 186 CO 0.03 0.89 0.25 0.58 -1.14 0.00 0.00 176.83 177.44 3dzf h VAL 187 N 1.04 1.26 -0.00 2.27 2.07 -1.07 -1.57 116.25 120.24 3dzf h VAL 187 Ca 0.24 -0.87 0.03 0.00 0.82 0.00 0.00 66.70 66.93 3dzf h VAL 187 Cb 0.20 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 30.36 3dzf h VAL 187 CO -0.02 0.34 -0.31 0.15 0.02 0.00 0.00 177.57 177.75 3dzf h PHE 188 N 1.07 -0.86 -0.55 1.57 3.57 -0.81 -2.24 116.94 118.68 3dzf h PHE 188 Ca 0.24 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.66 3dzf h PHE 188 Cb 0.28 0.38 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 3dzf h PHE 188 CO 0.02 -0.41 -0.08 -1.49 -2.23 0.00 0.00 178.31 174.13 3dzf h TRP 189 N -0.46 1.14 -0.85 0.41 4.06 -1.33 -0.90 115.95 118.02 3dzf h TRP 189 Ca 0.06 -0.23 0.04 0.00 2.06 0.00 0.00 58.89 60.83 3dzf h TRP 189 Cb 0.55 -0.29 -0.05 0.00 -1.00 0.00 0.00 29.16 28.38 3dzf h TRP 189 CO -0.34 1.04 0.56 -0.22 -3.56 0.00 0.00 178.44 175.92 3dzf h LYS 190 N 0.91 1.01 0.14 0.49 3.64 -1.25 0.11 116.57 121.62 3dzf h LYS 190 Ca 0.15 -0.06 -0.25 0.00 -1.27 0.00 0.00 60.65 59.22 3dzf h LYS 190 Cb 0.64 -0.23 0.01 0.00 -0.41 0.00 0.00 32.23 32.25 3dzf h LYS 190 CO 0.04 0.67 -1.19 1.15 -2.27 0.00 0.00 179.45 177.85 3dzf h THR 191 N 1.04 1.25 -0.23 1.00 2.02 -0.95 -2.05 112.91 114.99 3dzf h THR 191 Ca 0.34 -2.49 -0.12 0.00 0.77 0.00 0.00 66.41 64.91 3dzf h THR 191 Cb 0.05 2.94 -0.01 0.00 -1.74 0.00 0.00 68.15 69.40 3dzf h THR 191 CO -0.10 0.72 -0.37 -0.37 0.37 0.00 0.00 175.52 175.77 3dzf h VAL 192 N -0.28 1.30 0.36 3.16 -1.51 -1.10 -2.99 116.25 115.19 3dzf h VAL 192 Ca -0.24 -1.51 -0.01 0.00 -1.23 0.00 0.00 66.70 63.71 3dzf h VAL 192 Cb 1.76 1.53 -0.01 0.00 -2.13 0.00 0.00 31.29 32.45 3dzf h VAL 192 CO 0.12 0.47 -0.23 0.28 -1.23 0.00 0.00 177.57 176.98 3dzf h SER 193 N 0.43 -0.59 -0.54 4.19 0.02 -0.81 0.34 113.55 116.60 3dzf h SER 193 Ca 0.04 0.04 0.05 0.00 -0.84 0.00 0.00 61.79 61.09 3dzf h SER 193 Cb 0.85 0.18 -0.05 0.00 0.14 0.00 0.00 62.40 63.52 3dzf h SER 193 CO 0.07 -0.37 0.26 -0.09 -1.14 0.00 0.00 176.83 175.57 3dzf h ARG 194 N -0.58 0.49 -0.11 3.45 2.43 -1.42 0.26 114.38 118.90 3dzf h ARG 194 Ca -0.04 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 58.97 3dzf h ARG 194 Cb 0.48 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 3dzf h ARG 194 CO 0.03 0.32 -0.52 0.00 -1.51 0.00 0.00 179.97 178.29 3dzf h ARG 195 N 0.50 0.29 0.41 0.20 3.08 -1.43 0.12 114.38 117.56 3dzf h ARG 195 Ca 0.25 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 3dzf h ARG 195 Cb 0.18 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.25 3dzf h ARG 195 CO -0.19 0.75 -0.20 0.35 -1.07 0.00 0.00 179.97 179.61 3dzf h PHE 196 N 0.23 -0.51 -1.01 3.04 3.57 -0.36 -2.18 116.94 119.73 3dzf h PHE 196 Ca 0.01 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.60 3dzf h PHE 196 Cb 1.00 0.17 -0.08 0.00 2.79 0.00 0.00 35.95 39.83 3dzf h PHE 196 CO 0.02 -0.23 0.64 0.00 -2.23 0.00 0.00 178.31 176.51 3dzf h ALA 197 N -0.21 1.48 -0.43 2.41 0.00 -0.89 -2.39 119.26 119.23 3dzf h ALA 197 Ca -0.06 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 3dzf h ALA 197 Cb 0.51 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3dzf h ALA 197 CO 0.09 0.30 0.13 0.93 0.00 0.00 0.00 179.25 180.70 3dzf h GLU 198 N 1.06 0.62 0.00 0.00 5.08 -0.67 -2.49 114.58 118.18 3dzf h GLU 198 Ca 0.48 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 3dzf h GLU 198 Cb 0.38 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3dzf h GLU 198 CO -0.24 0.55 0.00 0.00 -1.00 0.00 0.00 179.01 178.33 3dzf n ALA 199 N -2.47 2.54 -1.82 3.43 0.00 -0.83 -4.75 120.51 116.61 3dzf n ALA 199 Ca 0.03 -0.16 -0.31 0.00 0.00 0.00 0.00 53.44 53.00 3dzf n ALA 199 Cb 0.18 -1.50 0.02 0.00 0.00 0.00 0.00 19.45 18.15 3dzf n ALA 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dzf s ALA 200 N -2.40 3.01 0.29 0.00 0.00 -0.94 -4.60 121.76 117.12 3dzf s ALA 200 Ca 0.34 -0.09 -0.18 0.00 0.00 0.00 0.00 51.96 52.03 3dzf s ALA 200 Cb 0.21 -3.09 0.02 0.00 0.00 0.00 0.00 23.12 20.26 3dzf s ALA 200 CO 0.43 -0.81 0.68 0.00 0.00 0.00 0.00 175.76 176.06 3dzf n ASP 202 N -0.59 0.00 -4.67 0.00 8.00 0.49 -3.76 116.55 116.02 3dzf n ASP 202 Ca -0.04 0.00 -0.38 0.00 0.71 0.00 0.00 54.79 55.08 3dzf n ASP 202 Cb 0.60 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.62 3dzf n ASP 202 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3dzf s VAL 203 N 0.00 5.19 -0.15 2.53 1.01 -1.26 -1.23 120.40 126.49 3dzf s VAL 203 Ca 0.00 0.74 -0.05 0.00 0.00 0.00 0.00 61.98 62.66 3dzf s VAL 203 Cb 0.00 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 3dzf s VAL 203 CO 0.00 0.24 0.03 -0.69 0.00 0.00 0.00 175.10 174.68 3dzf s VAL 204 N 1.37 4.54 -0.01 2.92 1.01 0.58 -4.66 120.40 126.15 3dzf s VAL 204 Ca 0.20 -0.13 -0.03 0.00 0.00 0.00 0.00 61.98 62.01 3dzf s VAL 204 Cb -0.15 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 3dzf s VAL 204 CO 0.08 0.51 0.19 -1.00 0.00 0.00 0.00 175.10 174.88 3dzf s HIS 205 N -0.03 3.55 -0.08 5.22 3.76 -0.93 -0.17 115.29 126.61 3dzf s HIS 205 Ca 0.05 0.38 0.01 0.00 -0.15 0.00 0.00 55.06 55.35 3dzf s HIS 205 Cb -0.12 -1.85 0.02 0.00 1.11 0.00 0.00 32.58 31.74 3dzf s HIS 205 CO 0.01 0.65 -0.08 0.54 -0.85 0.00 0.00 174.74 175.01 3dzf s VAL 206 N -1.31 0.94 -0.06 -0.90 0.11 -0.62 0.02 120.40 118.58 3dzf s VAL 206 Ca 0.27 -0.31 -0.25 0.00 -2.93 0.00 0.00 61.98 58.76 3dzf s VAL 206 Cb -0.13 -0.93 -0.03 0.00 -1.53 0.00 0.00 36.38 33.76 3dzf s VAL 206 CO 0.18 0.33 0.75 -0.04 -3.33 0.00 0.00 175.10 172.99 3dzf s MET 207 N 1.17 4.45 0.04 1.54 -1.94 0.30 0.16 119.30 125.01 3dzf s MET 207 Ca -0.06 0.98 0.08 0.00 -1.71 0.00 0.00 55.69 54.98 3dzf s MET 207 Cb -0.14 -3.46 -0.03 0.00 2.01 0.00 0.00 34.83 33.21 3dzf s MET 207 CO -0.02 0.02 -0.22 -0.51 -0.01 0.00 0.00 175.02 174.28 3dzf s LEU 208 N 0.93 2.42 -0.64 -0.03 1.43 -0.18 -1.29 118.68 121.32 3dzf s LEU 208 Ca 0.40 -0.50 -0.25 0.00 -1.03 0.00 0.00 54.13 52.75 3dzf s LEU 208 Cb -0.18 -1.42 0.05 0.00 0.03 0.00 0.00 46.19 44.67 3dzf s LEU 208 CO 0.19 0.26 1.06 -0.62 0.23 0.00 0.00 176.35 177.47 3dzf s ASP 209 N -1.37 6.25 0.00 2.29 -1.08 -1.25 -1.60 116.67 119.91 3dzf s ASP 209 Ca 0.13 -0.53 0.08 0.00 -0.52 0.00 0.00 52.55 51.72 3dzf s ASP 209 Cb -0.10 -2.48 0.46 0.00 -1.46 0.00 0.00 42.92 39.34 3dzf s ASP 209 CO 0.04 -1.48 1.04 0.61 0.52 0.00 0.00 175.17 175.90 3dzf n GLY 210 N 5.24 -0.40 1.18 2.66 0.00 0.33 -1.55 105.19 112.64 3dzf n GLY 210 Ca 0.01 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.10 3dzf n GLY 210 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3dzf n SER 211 N -1.14 3.48 -4.46 1.61 3.41 -1.25 -4.81 113.62 110.46 3dzf n SER 211 Ca 0.05 -1.98 -0.29 0.00 -0.26 0.00 0.00 58.87 56.39 3dzf n SER 211 Cb 0.05 -0.34 0.14 0.00 -0.26 0.00 0.00 64.21 63.80 3dzf n SER 211 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3dzf s ARG 212 N -1.33 1.21 -0.02 4.33 1.81 -0.60 -4.98 118.95 119.37 3dzf s ARG 212 Ca 0.42 -0.23 -0.22 0.00 -1.72 0.00 0.00 55.73 53.98 3dzf s ARG 212 Cb 0.23 -1.91 -0.23 0.00 -0.45 0.00 0.00 34.95 32.60 3dzf s ARG 212 CO 0.31 -2.05 1.09 1.03 -0.68 0.00 0.00 175.30 175.00 3dzf h SER 213 N -1.36 0.35 -3.55 0.23 0.87 -1.94 -3.38 113.55 104.78 3dzf h SER 213 Ca -0.45 -0.74 -0.69 0.00 -1.23 0.00 0.00 61.79 58.68 3dzf h SER 213 Cb 1.27 -0.11 -0.35 0.00 -0.44 0.00 0.00 62.40 62.77 3dzf h SER 213 CO 0.49 1.05 -0.57 -0.54 -0.53 0.00 0.00 176.83 176.73 3dzf s LYS 214 N -3.27 1.94 0.17 2.24 1.02 -1.26 -4.97 119.74 115.61 3dzf s LYS 214 Ca -0.15 -1.86 -0.15 0.00 0.02 0.00 0.00 55.97 53.83 3dzf s LYS 214 Cb 0.02 -3.53 0.11 0.00 -0.52 0.00 0.00 37.83 33.91 3dzf s LYS 214 CO 0.77 -1.06 1.74 0.82 -0.92 0.00 0.00 175.35 176.70 3dzf h ILE 215 N 6.35 0.83 -3.60 2.17 2.04 -1.79 -3.31 117.51 120.19 3dzf h ILE 215 Ca -0.11 -0.09 -0.62 0.00 1.00 0.00 0.00 64.86 65.04 3dzf h ILE 215 Cb 1.04 0.55 -0.14 0.00 -0.74 0.00 0.00 36.82 37.52 3dzf h ILE 215 CO 0.67 0.05 -0.47 0.12 0.00 0.00 0.00 178.15 178.52 3dzf s PHE 216 N -6.15 3.31 -0.29 1.37 5.36 -1.26 -4.35 117.98 115.97 3dzf s PHE 216 Ca -0.13 0.26 -0.01 0.00 -0.96 0.00 0.00 56.93 56.08 3dzf s PHE 216 Cb 0.13 -2.31 0.05 0.00 -0.34 0.00 0.00 43.02 40.55 3dzf s PHE 216 CO 0.72 0.03 -0.02 0.34 -1.46 0.00 0.00 175.22 174.83 3dzf s ASP 217 N 1.13 4.77 0.47 6.13 -1.08 -1.25 -4.82 116.67 122.02 3dzf s ASP 217 Ca 0.09 -1.23 0.31 0.00 -0.52 0.00 0.00 52.55 51.20 3dzf s ASP 217 Cb -0.14 -1.69 1.70 0.00 -1.46 0.00 0.00 42.92 41.33 3dzf s ASP 217 CO 0.05 -0.23 1.96 0.07 0.52 0.00 0.00 175.17 177.54 3dzf h LYS 218 N 7.98 0.00 -0.63 4.34 2.10 -1.95 -0.36 116.57 128.05 3dzf h LYS 218 Ca -0.22 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.43 3dzf h LYS 218 Cb 1.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.40 3dzf h LYS 218 CO 0.53 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.73 3dzf n ASP 219 N -2.61 3.82 -3.54 7.07 8.00 -1.26 -3.41 116.55 124.63 3dzf n ASP 219 Ca -0.02 -2.00 -0.25 0.00 0.71 0.00 0.00 54.79 53.24 3dzf n ASP 219 Cb 0.06 -0.42 0.18 0.00 -0.02 0.00 0.00 41.12 40.92 3dzf n ASP 219 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3dzf n SER 220 N 1.61 -0.37 0.01 -2.24 3.41 -0.14 -4.79 113.62 111.11 3dzf n SER 220 Ca 0.23 -1.32 -0.09 0.00 -0.26 0.00 0.00 58.87 57.43 3dzf n SER 220 Cb 0.62 -0.85 0.06 0.00 -0.26 0.00 0.00 64.21 63.78 3dzf n SER 220 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3dzf h THR 221 N -1.84 1.33 0.23 6.66 2.02 -1.93 -1.96 112.91 117.42 3dzf h THR 221 Ca -0.35 -1.84 -0.01 0.00 0.77 0.00 0.00 66.41 64.98 3dzf h THR 221 Cb 1.00 1.82 0.00 0.00 -1.74 0.00 0.00 68.15 69.23 3dzf h THR 221 CO 0.25 0.57 -0.11 0.15 0.37 0.00 0.00 175.52 176.74 3dzf h PHE 222 N 0.40 -0.28 0.00 3.16 3.57 -1.89 -0.68 116.94 121.21 3dzf h PHE 222 Ca 0.00 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 3dzf h PHE 222 Cb 1.11 0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.94 3dzf h PHE 222 CO 0.04 -0.13 -0.13 0.78 -2.23 0.00 0.00 178.31 176.64 3dzf h GLY 223 N -0.36 0.00 0.00 2.40 0.00 -1.66 -2.05 103.07 101.40 3dzf h GLY 223 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.30 3dzf h GLY 223 CO 0.05 0.00 -1.39 -1.14 0.00 0.00 0.00 176.54 174.06 3dzf n SER 224 N -3.99 2.62 -0.00 0.19 3.41 -0.74 -4.70 113.62 110.41 3dzf n SER 224 Ca -0.02 -0.04 -0.00 0.00 -0.26 0.00 0.00 58.87 58.54 3dzf n SER 224 Cb 0.22 1.42 -0.00 0.00 -0.26 0.00 0.00 64.21 65.59 3dzf n SER 224 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3dzf n VAL 225 N -1.81 0.16 -0.00 -3.33 0.31 -0.28 -4.70 118.33 108.68 3dzf n VAL 225 Ca -0.02 0.22 -0.11 0.00 -0.01 0.00 0.00 64.34 64.43 3dzf n VAL 225 Cb 0.25 -1.30 -0.05 0.00 -0.91 0.00 0.00 33.84 31.83 3dzf n VAL 225 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3dzf h GLU 226 N -0.05 0.08 -0.65 5.55 5.08 -1.40 -2.37 114.58 120.81 3dzf h GLU 226 Ca 0.00 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 3dzf h GLU 226 Cb 0.05 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 3dzf h GLU 226 CO 0.00 0.05 0.33 -0.24 -1.00 0.00 0.00 179.01 178.15 3dzf h VAL 227 N 0.08 1.20 -0.05 3.13 3.04 -1.65 -0.37 116.25 121.65 3dzf h VAL 227 Ca 0.04 -0.55 0.00 0.00 -1.01 0.00 0.00 66.70 65.18 3dzf h VAL 227 Cb 0.03 0.36 0.00 0.00 -2.01 0.00 0.00 31.29 29.66 3dzf h VAL 227 CO -0.05 0.24 0.00 1.41 -1.01 0.00 0.00 177.57 178.16 3dzf n HIS 228 N -4.36 0.05 -0.79 3.17 8.25 -0.91 -3.28 115.22 117.35 3dzf n HIS 228 Ca 0.06 -0.03 0.08 0.00 -0.26 0.00 0.00 57.72 57.57 3dzf n HIS 228 Cb 0.12 0.00 0.18 0.00 1.12 0.00 0.00 29.99 31.41 3dzf n HIS 228 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3dzf n ASN 229 N -0.38 3.07 -4.68 0.41 3.02 -0.15 -4.97 115.26 111.58 3dzf n ASN 229 Ca 0.18 -2.79 -0.43 0.00 -0.03 0.00 0.00 54.58 51.52 3dzf n ASN 229 Cb 0.20 -0.41 -0.02 0.00 -0.61 0.00 0.00 39.78 38.94 3dzf n ASN 229 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3dzf s LEU 230 N -2.39 4.19 -0.14 3.41 1.43 -1.18 -3.09 118.68 120.91 3dzf s LEU 230 Ca 0.32 1.48 -0.22 0.00 -1.03 0.00 0.00 54.13 54.68 3dzf s LEU 230 Cb 0.25 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.89 3dzf s LEU 230 CO 0.07 -0.53 0.67 -1.10 0.23 0.00 0.00 176.35 175.68 3dzf s GLN 231 N 2.46 4.32 0.51 1.70 -1.52 -1.26 -4.94 119.66 120.93 3dzf s GLN 231 Ca 0.47 0.75 0.34 0.00 -1.95 0.00 0.00 55.36 54.96 3dzf s GLN 231 Cb -0.17 -3.51 1.53 0.00 -0.22 0.00 0.00 33.01 30.63 3dzf s GLN 231 CO 0.14 -0.10 2.00 -1.35 -0.25 0.00 0.00 175.29 175.73 3dzf h PRO 232 N 7.11 0.00 0.00 2.91 0.11 -1.80 0.30 132.00 140.63 3dzf h PRO 232 Ca -0.36 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.66 3dzf h PRO 232 Cb 1.16 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 3dzf h PRO 232 CO 0.77 0.00 -0.45 0.93 -0.21 0.00 0.00 178.00 179.04 3dzf h GLU 233 N 0.00 0.00 0.00 1.05 3.07 -1.94 -3.36 114.58 113.40 3dzf h GLU 233 Ca 0.00 0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 58.72 3dzf h GLU 233 Cb 0.34 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.23 3dzf h GLU 233 CO 0.00 0.45 -1.53 1.63 -1.40 0.00 0.00 179.01 178.16 3dzf n LYS 234 N -3.97 0.23 -3.14 2.33 5.02 -1.06 -4.98 118.16 112.59 3dzf n LYS 234 Ca -0.02 0.06 -0.40 0.00 -2.02 0.00 0.00 58.31 55.94 3dzf n LYS 234 Cb 0.48 -1.12 -0.06 0.00 -0.02 0.00 0.00 35.03 34.31 3dzf n LYS 234 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3dzf s VAL 235 N -2.18 5.04 -0.12 -0.18 1.01 0.10 -0.38 120.40 123.68 3dzf s VAL 235 Ca -0.13 1.14 0.18 0.00 0.00 0.00 0.00 61.98 63.17 3dzf s VAL 235 Cb 0.04 -3.92 -0.21 0.00 0.00 0.00 0.00 36.38 32.28 3dzf s VAL 235 CO 0.21 0.12 0.52 1.67 0.00 0.00 0.00 175.10 177.62 3dzf n GLN 236 N 5.00 0.65 -3.69 2.72 7.27 -0.36 -4.40 117.38 124.57 3dzf n GLN 236 Ca -0.02 0.08 -0.10 0.00 0.07 0.00 0.00 57.00 57.03 3dzf n GLN 236 Cb 0.50 -1.67 -0.10 0.00 2.41 0.00 0.00 30.24 31.38 3dzf n GLN 236 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 3dzf s THR 237 N -2.89 -0.04 -0.35 1.69 2.01 -1.16 -0.73 115.64 114.17 3dzf s THR 237 Ca -0.06 0.08 -0.12 0.00 0.31 0.00 0.00 61.69 61.90 3dzf s THR 237 Cb 0.09 -0.67 -0.00 0.00 0.01 0.00 0.00 72.50 71.93 3dzf s THR 237 CO 0.84 0.03 0.23 -0.22 -0.69 0.00 0.00 174.62 174.81 3dzf s LEU 238 N 1.48 4.56 -0.30 4.42 2.96 0.13 -0.31 118.68 131.62 3dzf s LEU 238 Ca -0.09 -0.60 -0.09 0.00 -0.22 0.00 0.00 54.13 53.13 3dzf s LEU 238 Cb -0.08 -2.10 -0.00 0.00 0.50 0.00 0.00 46.19 44.51 3dzf s LEU 238 CO -0.14 -0.28 0.13 -0.70 -1.32 0.00 0.00 176.35 174.03 3dzf s GLU 239 N 1.67 3.28 0.01 1.98 2.12 0.76 -0.93 118.70 127.59 3dzf s GLU 239 Ca 0.05 -0.75 -0.23 0.00 0.36 0.00 0.00 54.97 54.40 3dzf s GLU 239 Cb -0.18 -3.49 -0.05 0.00 0.26 0.00 0.00 34.13 30.67 3dzf s GLU 239 CO 0.09 -0.41 0.70 0.00 -0.54 0.00 0.00 175.26 175.10 3dzf s ALA 240 N 1.58 3.40 -0.42 6.30 0.00 0.11 -1.59 121.76 131.14 3dzf s ALA 240 Ca 0.04 0.18 -0.09 0.00 0.00 0.00 0.00 51.96 52.09 3dzf s ALA 240 Cb -0.17 -2.91 0.08 0.00 0.00 0.00 0.00 23.12 20.12 3dzf s ALA 240 CO 0.05 0.07 0.26 -1.58 0.00 0.00 0.00 175.76 174.57 3dzf s TRP 241 N 0.02 3.33 -0.87 0.00 0.51 0.12 -0.66 118.94 121.39 3dzf s TRP 241 Ca 0.36 -1.49 -0.22 0.00 -2.12 0.00 0.00 56.10 52.64 3dzf s TRP 241 Cb -0.19 -2.95 0.08 0.00 -0.81 0.00 0.00 33.47 29.60 3dzf s TRP 241 CO 0.20 -0.84 1.20 0.08 -0.51 0.00 0.00 176.95 177.08 3dzf s VAL 242 N 1.44 4.31 -0.21 4.03 1.01 -0.28 -1.01 120.40 129.68 3dzf s VAL 242 Ca 0.03 -0.87 -0.29 0.00 0.00 0.00 0.00 61.98 60.85 3dzf s VAL 242 Cb -0.23 -4.85 -0.04 0.00 0.00 0.00 0.00 36.38 31.26 3dzf s VAL 242 CO 0.02 -1.65 1.78 -0.63 0.00 0.00 0.00 175.10 174.62 3dzf s ILE 243 N 3.95 3.47 -0.69 2.22 1.01 -0.63 -2.34 121.20 128.19 3dzf s ILE 243 Ca 0.34 0.52 -0.27 0.00 0.00 0.00 0.00 60.65 61.24 3dzf s ILE 243 Cb -0.07 -3.51 0.01 0.00 0.01 0.00 0.00 42.46 38.90 3dzf s ILE 243 CO -0.03 -0.24 1.57 -1.00 0.00 0.00 0.00 174.94 175.24 3dzf s HIS 244 N 5.90 1.99 -0.01 3.97 3.76 -0.75 -0.52 115.29 129.63 3dzf s HIS 244 Ca 0.79 0.34 -0.17 0.00 -0.15 0.00 0.00 55.06 55.88 3dzf s HIS 244 Cb -0.28 -4.37 -0.34 0.00 1.11 0.00 0.00 32.58 28.71 3dzf s HIS 244 CO 0.32 -2.18 0.90 0.78 -0.85 0.00 0.00 174.74 173.71 3dzf h GLY 245 N 14.70 0.52 -3.35 -2.22 0.00 -1.87 -3.42 103.07 107.43 3dzf h GLY 245 Ca -0.26 -1.33 -0.17 0.00 0.00 0.00 0.00 47.33 45.57 3dzf h GLY 245 CO 1.25 1.17 0.20 0.61 0.00 0.00 0.00 176.54 179.77 3dzf n GLY 246 N 1.73 3.73 0.00 4.60 0.00 -1.26 -4.80 105.19 109.19 3dzf n GLY 246 Ca -0.18 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 44.83 3dzf n GLY 246 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3dzf n ARG 247 N -0.18 0.00 0.00 1.61 3.00 -1.26 -5.13 116.66 114.69 3dzf n ARG 247 Ca 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.22 3dzf n ARG 247 Cb 1.30 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.76 3dzf n ARG 247 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 3dzf n GLU 248 N 0.00 0.00 0.00 -0.14 1.02 -1.26 -4.27 120.64 115.99 3dzf n GLU 248 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3dzf n GLU 248 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 3dzf n GLU 248 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3dzf n ASP 249 N 9.19 1.99 -2.64 1.62 5.75 -1.26 -4.75 116.55 126.45 3dzf n ASP 249 Ca 0.00 -1.41 0.00 0.00 -0.01 0.00 0.00 54.79 53.37 3dzf n ASP 249 Cb 0.00 -0.35 0.00 0.00 -1.03 0.00 0.00 41.12 39.74 3dzf n ASP 249 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 3dzf n SER 250 N 0.60 -0.07 -2.96 -1.12 2.88 -1.26 -4.98 113.62 106.71 3dzf n SER 250 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 3dzf n SER 250 Cb 0.34 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 63.86 3dzf n SER 250 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3dzf n ARG 251 N -0.07 -0.06 -2.94 -1.46 3.00 -1.26 -5.00 116.66 108.86 3dzf n ARG 251 Ca 0.00 -1.03 -0.44 0.00 -0.01 0.00 0.00 57.85 56.38 3dzf n ARG 251 Cb 0.00 -0.41 -0.04 0.00 0.00 0.00 0.00 32.46 32.01 3dzf n ARG 251 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 3dzf s ASP 252 N -2.87 6.21 0.00 0.55 2.15 -1.26 -4.86 116.67 116.59 3dzf s ASP 252 Ca 0.30 -1.21 0.31 0.00 0.43 0.00 0.00 52.55 52.37 3dzf s ASP 252 Cb -0.01 -2.38 1.59 0.00 -0.30 0.00 0.00 42.92 41.82 3dzf s ASP 252 CO 0.20 -1.31 2.07 0.18 -0.17 0.00 0.00 175.17 176.14 3dzf n LEU 253 N 7.19 0.14 0.08 -1.34 4.77 -1.26 -1.73 117.00 124.84 3dzf n LEU 253 Ca -0.03 0.11 0.10 0.00 -0.03 0.00 0.00 56.01 56.15 3dzf n LEU 253 Cb 0.45 -0.16 0.42 0.00 -2.33 0.00 0.00 43.42 41.80 3dzf n LEU 253 CO 0.61 0.02 0.81 0.00 -1.33 0.00 0.00 177.39 177.51 3dzf n GLN 255 N -1.94 1.00 -1.86 0.00 1.13 -0.70 -4.63 117.38 110.38 3dzf n GLN 255 Ca 0.03 -0.59 -0.41 0.00 -1.94 0.00 0.00 57.00 54.10 3dzf n GLN 255 Cb 0.21 -1.49 -0.00 0.00 0.11 0.00 0.00 30.24 29.07 3dzf n GLN 255 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 3dzf s ASP 256 N -2.41 6.29 0.28 1.08 3.68 -0.73 -4.86 116.67 120.01 3dzf s ASP 256 Ca 0.27 2.96 -0.01 0.00 2.13 0.00 0.00 52.55 57.89 3dzf s ASP 256 Cb 0.20 -2.66 0.63 0.00 -1.45 0.00 0.00 42.92 39.63 3dzf s ASP 256 CO 0.48 -0.90 1.62 -0.65 0.13 0.00 0.00 175.17 175.85 3dzf h PRO 257 N 2.88 0.10 0.00 4.34 0.11 -1.92 0.11 132.00 137.62 3dzf h PRO 257 Ca -0.51 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3dzf h PRO 257 Cb 1.24 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3dzf h PRO 257 CO 0.64 0.06 0.00 1.79 -0.21 0.00 0.00 178.00 180.28 3dzf h THR 258 N 0.10 0.00 0.14 -1.15 1.35 -1.92 -2.63 112.91 108.80 3dzf h THR 258 Ca 0.52 -0.30 -0.35 0.00 -0.55 0.00 0.00 66.41 65.73 3dzf h THR 258 Cb 1.01 1.16 -0.01 0.00 -1.73 0.00 0.00 68.15 68.58 3dzf h THR 258 CO -0.76 0.00 -1.86 0.40 -0.25 0.00 0.00 175.52 173.05 3dzf h ILE 259 N 0.00 0.79 -0.94 6.82 1.08 -1.12 -2.05 117.51 122.08 3dzf h ILE 259 Ca 0.00 -2.46 0.19 0.00 -0.39 0.00 0.00 64.86 62.20 3dzf h ILE 259 Cb 0.35 2.61 -0.08 0.00 -3.07 0.00 0.00 36.82 36.63 3dzf h ILE 259 CO 0.00 0.86 0.60 0.11 -0.69 0.00 0.00 178.15 179.03 3dzf h LYS 260 N 0.08 0.58 0.04 2.37 1.79 -1.39 -0.88 116.57 119.16 3dzf h LYS 260 Ca -0.37 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.06 3dzf h LYS 260 Cb 2.06 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 32.58 3dzf h LYS 260 CO 0.13 0.38 -0.02 1.49 -1.08 0.00 0.00 179.45 180.35 3dzf h GLU 261 N 0.59 -0.05 -0.92 3.15 4.81 -1.30 -0.17 114.58 120.70 3dzf h GLU 261 Ca 0.50 0.00 0.25 0.00 -0.13 0.00 0.00 59.36 59.98 3dzf h GLU 261 Cb 0.99 0.01 -0.14 0.00 0.63 0.00 0.00 28.75 30.24 3dzf h GLU 261 CO -0.25 0.44 0.38 1.25 -0.73 0.00 0.00 179.01 180.11 3dzf h LEU 262 N -0.57 0.26 -0.52 1.64 5.85 -1.05 0.20 115.31 121.13 3dzf h LEU 262 Ca -0.01 0.18 -0.16 0.00 0.84 0.00 0.00 57.88 58.74 3dzf h LEU 262 Cb 0.51 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 3dzf h LEU 262 CO 0.01 -0.08 -0.49 -0.08 -0.34 0.00 0.00 178.44 177.46 3dzf h GLU 263 N 0.32 0.64 0.02 1.25 4.81 -0.48 -1.41 114.58 119.73 3dzf h GLU 263 Ca 0.60 -0.37 -0.00 0.00 -0.13 0.00 0.00 59.36 59.46 3dzf h GLU 263 Cb 1.22 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.63 3dzf h GLU 263 CO -0.59 0.98 -0.01 1.03 -0.73 0.00 0.00 179.01 179.69 3dzf h SER 264 N 0.50 -0.02 -0.96 1.04 0.87 0.11 0.41 113.55 115.50 3dzf h SER 264 Ca 0.02 -0.24 0.10 0.00 -1.23 0.00 0.00 61.79 60.45 3dzf h SER 264 Cb 1.03 0.01 -0.08 0.00 -0.44 0.00 0.00 62.40 62.92 3dzf h SER 264 CO 0.10 0.22 0.60 0.40 -0.53 0.00 0.00 176.83 177.62 3dzf h ILE 265 N -0.27 0.96 0.00 2.23 2.04 -0.67 0.19 117.51 121.99 3dzf h ILE 265 Ca -0.00 -0.34 -0.26 0.00 1.00 0.00 0.00 64.86 65.25 3dzf h ILE 265 Cb 0.26 -0.12 -0.04 0.00 -0.74 0.00 0.00 36.82 36.17 3dzf h ILE 265 CO 0.00 0.18 -1.56 0.16 0.00 0.00 0.00 178.15 176.94 3dzf h ILE 266 N 1.00 0.90 0.52 -0.67 -0.00 -0.93 -2.85 117.51 115.48 3dzf h ILE 266 Ca 0.46 -2.68 -0.02 0.00 -0.00 0.00 0.00 64.86 62.62 3dzf h ILE 266 Cb 0.37 2.41 -0.01 0.00 -0.00 0.00 0.00 36.82 39.60 3dzf h ILE 266 CO -0.24 0.51 -0.33 0.28 -0.00 0.00 0.00 178.15 178.38 3dzf h SER 267 N 0.00 -0.83 -1.21 2.16 0.02 0.22 -0.26 113.55 113.65 3dzf h SER 267 Ca -0.23 0.05 0.35 0.00 -0.84 0.00 0.00 61.79 61.12 3dzf h SER 267 Cb 1.91 0.25 -0.05 0.00 0.14 0.00 0.00 62.40 64.65 3dzf h SER 267 CO 0.08 -0.51 1.02 0.11 -1.14 0.00 0.00 176.83 176.38 3dzf h LYS 268 N -0.81 0.00 -0.01 3.45 1.57 -0.71 0.57 116.57 120.63 3dzf h LYS 268 Ca -0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3dzf h LYS 268 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.98 3dzf h LYS 268 CO 0.05 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.47 3dzf n ARG 269 N -3.80 1.05 -2.58 3.15 1.74 -0.22 -4.88 116.66 111.12 3dzf n ARG 269 Ca 0.26 -0.07 -0.14 0.00 -0.77 0.00 0.00 57.85 57.13 3dzf n ARG 269 Cb 1.40 -1.38 -0.00 0.00 -1.02 0.00 0.00 32.46 31.46 3dzf n ARG 269 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3dzf n ASN 270 N -0.79 -3.92 -4.89 0.55 3.02 0.20 -4.56 115.26 104.88 3dzf n ASN 270 Ca 0.18 0.11 -0.32 0.00 -0.03 0.00 0.00 54.58 54.51 3dzf n ASN 270 Cb 0.10 -3.31 -0.05 0.00 -0.61 0.00 0.00 39.78 35.91 3dzf n ASN 270 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3dzf s ILE 271 N -2.67 5.28 0.23 2.41 1.01 -0.56 -4.90 121.20 122.01 3dzf s ILE 271 Ca 0.06 -0.31 -0.30 0.00 0.00 0.00 0.00 60.65 60.10 3dzf s ILE 271 Cb -0.03 -3.51 -0.09 0.00 0.01 0.00 0.00 42.46 38.84 3dzf s ILE 271 CO 0.08 0.25 1.10 -1.58 0.00 0.00 0.00 174.94 174.79 3dzf s GLN 272 N -2.16 4.61 -0.03 2.79 0.74 0.09 -3.64 119.66 122.07 3dzf s GLN 272 Ca 0.30 1.77 0.05 0.00 0.05 0.00 0.00 55.36 57.53 3dzf s GLN 272 Cb -0.13 -3.23 -0.03 0.00 1.10 0.00 0.00 33.01 30.73 3dzf s GLN 272 CO 0.22 0.14 -0.18 0.12 -0.55 0.00 0.00 175.29 175.04 3dzf s PHE 273 N -0.71 2.59 0.04 1.67 5.36 -1.26 0.22 117.98 125.89 3dzf s PHE 273 Ca 0.47 -0.24 -0.09 0.00 -0.96 0.00 0.00 56.93 56.11 3dzf s PHE 273 Cb -0.31 -1.58 0.00 0.00 -0.34 0.00 0.00 43.02 40.80 3dzf s PHE 273 CO 0.38 0.14 0.19 -1.54 -1.46 0.00 0.00 175.22 172.92 3dzf s SER 274 N -0.78 0.04 -0.04 6.13 1.04 -0.11 -4.94 113.70 115.05 3dzf s SER 274 Ca 0.11 -0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.19 3dzf s SER 274 Cb -0.10 0.28 0.03 0.00 0.10 0.00 0.00 66.02 66.32 3dzf s SER 274 CO 0.01 -0.54 -0.01 0.00 0.98 0.00 0.00 173.24 173.68 3dzf s LYS 276 N 1.07 1.95 0.00 0.00 1.02 0.17 -4.95 119.74 119.00 3dzf s LYS 276 Ca -0.09 -0.53 -0.30 0.00 0.02 0.00 0.00 55.97 55.07 3dzf s LYS 276 Cb -0.14 -1.58 -0.05 0.00 -0.52 0.00 0.00 37.83 35.54 3dzf s LYS 276 CO -0.02 0.09 1.28 -0.80 -0.92 0.00 0.00 175.35 174.99 3dzf s ASN 277 N 0.49 6.98 -0.87 2.83 0.01 -1.26 -1.13 114.94 121.99 3dzf s ASN 277 Ca -0.13 1.99 -0.11 0.00 -0.71 0.00 0.00 52.86 53.90 3dzf s ASN 277 Cb -0.15 -2.57 0.23 0.00 0.41 0.00 0.00 41.25 39.17 3dzf s ASN 277 CO 0.04 -0.61 0.80 -0.63 -1.51 0.00 0.00 177.10 175.20 3dzf s ILE 278 N 1.93 5.40 0.09 0.60 1.01 -0.99 -4.93 121.20 124.32 3dzf s ILE 278 Ca 0.60 -2.83 -0.32 0.00 0.00 0.00 0.00 60.65 58.10 3dzf s ILE 278 Cb -0.29 -4.33 -0.14 0.00 0.01 0.00 0.00 42.46 37.71 3dzf s ILE 278 CO 0.26 -1.05 1.61 1.88 0.00 0.00 0.00 174.94 177.63 3dzf h TYR 279 N 7.33 -1.00 -3.61 3.97 0.05 -1.87 -2.00 116.97 119.85 3dzf h TYR 279 Ca 0.11 0.00 -0.75 0.00 0.05 0.00 0.00 58.73 58.15 3dzf h TYR 279 Cb 0.98 0.38 -0.29 0.00 1.01 0.00 0.00 36.73 38.81 3dzf h TYR 279 CO 0.92 -0.53 -0.14 1.03 -1.05 0.00 0.00 178.16 178.39 3dzf s ARG 280 N -5.99 3.07 0.59 4.88 3.00 -1.26 -4.49 118.95 118.75 3dzf s ARG 280 Ca -0.17 -2.34 0.35 0.00 0.00 0.00 0.00 55.73 53.57 3dzf s ARG 280 Cb 0.05 -4.12 1.88 0.00 0.00 0.00 0.00 34.95 32.76 3dzf s ARG 280 CO 0.63 -1.24 2.22 -1.35 0.00 0.00 0.00 175.30 175.55 3dzf h PRO 281 N 7.71 0.00 0.47 3.54 0.10 -1.82 -0.37 132.00 141.62 3dzf h PRO 281 Ca -0.01 0.00 -0.02 0.00 0.10 0.00 0.00 66.00 66.07 3dzf h PRO 281 Cb 1.02 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.12 3dzf h PRO 281 CO 0.77 0.03 -0.23 0.38 0.10 0.00 0.00 178.00 179.06 3dzf h ASP 282 N 0.00 -0.53 -0.57 -2.05 2.03 -1.96 -2.29 116.42 111.04 3dzf h ASP 282 Ca -0.00 -0.04 -0.05 0.00 -0.73 0.00 0.00 57.03 56.21 3dzf h ASP 282 Cb 0.16 0.14 -0.02 0.00 -0.83 0.00 0.00 39.33 38.77 3dzf h ASP 282 CO 0.00 -0.29 0.17 0.50 -1.03 0.00 0.00 179.24 178.60 3dzf h LYS 283 N -0.76 0.89 -0.11 4.15 3.64 -1.93 -2.88 116.57 119.57 3dzf h LYS 283 Ca -0.06 -0.20 0.02 0.00 -1.27 0.00 0.00 60.65 59.14 3dzf h LYS 283 Cb 0.54 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 3dzf h LYS 283 CO 0.11 0.81 -0.23 0.35 -2.27 0.00 0.00 179.45 178.22 3dzf h PHE 284 N 0.81 -0.68 -0.72 1.91 3.57 -1.01 0.54 116.94 121.36 3dzf h PHE 284 Ca 0.18 0.03 0.20 0.00 3.53 0.00 0.00 57.97 61.91 3dzf h PHE 284 Cb 0.29 0.31 -0.03 0.00 2.79 0.00 0.00 35.95 39.31 3dzf h PHE 284 CO 0.02 -0.21 0.51 -0.07 -2.23 0.00 0.00 178.31 176.33 3dzf h LEU 285 N -0.20 0.05 -0.12 0.59 3.38 -1.44 0.35 115.31 117.92 3dzf h LEU 285 Ca 0.02 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 3dzf h LEU 285 Cb 0.26 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.01 3dzf h LEU 285 CO -0.21 0.02 -0.48 -0.61 0.09 0.00 0.00 178.44 177.25 3dzf h GLN 286 N 0.06 0.55 -0.27 1.13 5.75 -0.58 0.10 115.11 121.84 3dzf h GLN 286 Ca 0.35 -0.42 -0.00 0.00 -0.15 0.00 0.00 58.65 58.42 3dzf h GLN 286 Cb 1.30 0.08 -0.01 0.00 1.07 0.00 0.00 27.48 29.91 3dzf h GLN 286 CO -0.02 1.05 0.16 0.00 -2.65 0.00 0.00 178.83 177.36 3dzf h VAL 288 N 0.34 0.83 0.09 0.00 2.07 -0.95 -1.24 116.25 117.38 3dzf h VAL 288 Ca 0.10 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 3dzf h VAL 288 Cb 0.01 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 3dzf h VAL 288 CO -0.02 0.07 -0.04 0.11 0.02 0.00 0.00 177.57 177.71 3dzf h LYS 289 N 0.40 -0.11 -4.55 1.57 1.57 -0.19 -3.42 116.57 111.85 3dzf h LYS 289 Ca 0.33 0.01 -0.67 0.00 -1.87 0.00 0.00 60.65 58.45 3dzf h LYS 289 Cb 0.73 0.03 -0.39 0.00 0.08 0.00 0.00 32.23 32.68 3dzf h LYS 289 CO -0.10 -0.07 -0.67 -0.80 -0.57 0.00 0.00 179.45 177.24 3dzf s ASN 290 N -2.91 4.86 0.58 0.86 0.01 0.16 -5.08 114.94 113.43 3dzf s ASN 290 Ca -0.02 -2.19 -0.19 0.00 -0.71 0.00 0.00 52.86 49.74 3dzf s ASN 290 Cb 0.00 -1.68 -0.05 0.00 0.41 0.00 0.00 41.25 39.93 3dzf s ASN 290 CO 0.05 -0.41 1.02 -2.65 -1.51 0.00 0.00 177.10 173.60 3dzf n PRO 291 N 4.25 1.05 0.00 -0.60 -0.02 -0.48 -4.25 135.00 134.94 3dzf n PRO 291 Ca 0.03 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 3dzf n PRO 291 Cb 0.41 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 3dzf n PRO 291 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3dzf n GLU 292 N -0.89 0.00 0.00 -0.52 1.02 -1.26 -4.90 120.64 114.08 3dzf n GLU 292 Ca 0.13 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.27 3dzf n GLU 292 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.88 3dzf n GLU 292 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3dzf n ASP 293 N -1.22 0.00 -3.91 1.62 2.03 -1.26 -4.43 116.55 109.39 3dzf n ASP 293 Ca 0.00 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.03 3dzf n ASP 293 Cb 0.00 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.30 3dzf n ASP 293 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 3dzf n SER 294 N 3.02 0.70 -3.20 1.67 3.41 -1.26 -4.59 113.62 113.38 3dzf n SER 294 Ca 0.00 -2.22 0.00 0.00 -0.26 0.00 0.00 58.87 56.39 3dzf n SER 294 Cb 0.00 -0.82 0.00 0.00 -0.26 0.00 0.00 64.21 63.13 3dzf n SER 294 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3dzf n SER 295 N 11.47 -1.28 0.00 4.04 3.41 -1.26 -5.03 113.62 124.97 3dzf n SER 295 Ca 0.37 -0.84 0.08 0.00 -0.26 0.00 0.00 58.87 58.22 3dzf n SER 295 Cb 0.42 -0.29 0.49 0.00 -0.26 0.00 0.00 64.21 64.57 3dzf n SER 295 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88