#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dzk n TRP 46 N 0.00 0.00 -3.93 -0.14 2.14 -1.26 -4.91 117.44 109.34 3dzk n TRP 46 Ca 0.00 0.00 -0.15 0.00 2.07 0.00 0.00 57.50 59.42 3dzk n TRP 46 Cb 0.00 0.00 -0.15 0.00 -0.81 0.00 0.00 31.31 30.35 3dzk n TRP 46 CO 0.00 0.00 0.00 -0.98 2.07 0.00 0.00 177.69 178.78 3dzk s ARG 47 N -2.89 0.17 0.25 -2.67 1.70 -1.26 -5.16 118.95 109.09 3dzk s ARG 47 Ca 0.09 0.02 0.06 0.00 -0.47 0.00 0.00 55.73 55.42 3dzk s ARG 47 Cb 0.16 -0.27 -0.03 0.00 -0.57 0.00 0.00 34.95 34.23 3dzk s ARG 47 CO 0.82 -0.05 0.34 -0.65 -1.08 0.00 0.00 175.30 174.68 3dzk s GLN 48 N 0.49 3.30 0.07 3.89 -1.52 -1.26 -5.03 119.66 119.61 3dzk s GLN 48 Ca -0.04 -0.85 -0.19 0.00 -1.95 0.00 0.00 55.36 52.32 3dzk s GLN 48 Cb -0.07 -2.82 -0.10 0.00 -0.22 0.00 0.00 33.01 29.80 3dzk s GLN 48 CO -0.01 0.38 1.48 1.15 -0.25 0.00 0.00 175.29 178.04 3dzk h THR 49 N 1.20 1.27 -1.63 -0.19 2.02 -1.93 -3.46 112.91 110.19 3dzk h THR 49 Ca -0.51 -0.97 -0.55 0.00 0.77 0.00 0.00 66.41 65.16 3dzk h THR 49 Cb 1.23 1.48 -0.07 0.00 -1.74 0.00 0.00 68.15 69.05 3dzk h THR 49 CO 0.60 0.30 -0.48 0.26 0.37 0.00 0.00 175.52 176.57 3dzk s TRP 50 N -4.86 2.65 -0.94 3.16 0.52 -1.26 -5.06 118.94 113.15 3dzk s TRP 50 Ca -0.14 -0.53 0.24 0.00 0.02 0.00 0.00 56.10 55.69 3dzk s TRP 50 Cb 0.07 -1.94 0.23 0.00 -1.15 0.00 0.00 33.47 30.68 3dzk s TRP 50 CO 0.74 0.15 1.22 0.43 0.02 0.00 0.00 176.95 179.51 3dzk n SER 51 N -1.28 0.66 -4.95 2.95 7.64 -1.26 -4.76 113.62 112.61 3dzk n SER 51 Ca -0.00 -0.45 -0.23 0.00 1.01 0.00 0.00 58.87 59.20 3dzk n SER 51 Cb 0.63 0.53 -0.02 0.00 -1.01 0.00 0.00 64.21 64.35 3dzk n SER 51 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3dzk s GLY 52 N -3.10 1.35 0.42 0.23 0.00 -0.44 -4.79 107.32 100.99 3dzk s GLY 52 Ca 0.09 -1.06 -0.23 0.00 0.00 0.00 0.00 44.72 43.52 3dzk s GLY 52 CO 0.76 -1.04 0.77 -1.05 0.00 0.00 0.00 173.10 172.54 3dzk n PRO 53 N -1.41 0.91 -2.05 2.90 -0.02 -1.26 -2.28 135.00 131.78 3dzk n PRO 53 Ca -0.07 0.33 -0.29 0.00 -2.02 0.00 0.00 63.50 61.45 3dzk n PRO 53 Cb 0.56 -1.76 0.19 0.00 -0.02 0.00 0.00 33.50 32.47 3dzk n PRO 53 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3dzk s GLY 54 N -0.87 1.80 0.40 -1.23 0.00 -1.24 -2.56 107.32 103.61 3dzk s GLY 54 Ca 0.64 -1.39 -0.26 0.00 0.00 0.00 0.00 44.72 43.71 3dzk s GLY 54 CO 0.57 -0.60 1.24 2.41 0.00 0.00 0.00 173.10 176.72 3dzk n THR 55 N -3.68 2.41 -1.82 0.90 -1.04 -0.22 -4.75 114.28 106.08 3dzk n THR 55 Ca 0.16 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.05 61.26 3dzk n THR 55 Cb 0.59 -1.51 -0.01 0.00 -1.82 0.00 0.00 70.33 67.58 3dzk n THR 55 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 3dzk s THR 56 N -1.18 2.13 0.57 12.58 2.01 0.16 -4.73 115.64 127.18 3dzk s THR 56 Ca 0.60 0.12 -0.21 0.00 0.31 0.00 0.00 61.69 62.51 3dzk s THR 56 Cb -0.53 -3.08 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 3dzk s THR 56 CO 0.59 0.02 1.35 -1.59 -0.69 0.00 0.00 174.62 174.30 3dzk s LYS 57 N -1.14 3.01 -1.37 4.92 -2.85 -1.26 -1.49 119.74 119.55 3dzk s LYS 57 Ca 0.58 2.21 -0.11 0.00 -1.00 0.00 0.00 55.97 57.65 3dzk s LYS 57 Cb -0.47 -2.17 0.09 0.00 -2.06 0.00 0.00 37.83 33.23 3dzk s LYS 57 CO 0.54 -1.29 0.58 0.54 0.10 0.00 0.00 175.35 175.81 3dzk n ARG 58 N -1.22 -3.49 -0.15 1.78 1.74 -1.26 -4.89 116.66 109.17 3dzk n ARG 58 Ca 0.12 0.46 -0.05 0.00 -0.77 0.00 0.00 57.85 57.60 3dzk n ARG 58 Cb 0.46 -5.18 0.01 0.00 -1.02 0.00 0.00 32.46 26.72 3dzk n ARG 58 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 3dzk h PHE 59 N -1.14 -0.71 -0.18 -1.55 3.57 -1.62 -0.37 116.94 114.94 3dzk h PHE 59 Ca -0.47 0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.13 3dzk h PHE 59 Cb 1.31 0.39 -0.03 0.00 2.79 0.00 0.00 35.95 40.40 3dzk h PHE 59 CO 0.66 -0.34 -0.02 -1.35 -2.23 0.00 0.00 178.31 175.03 3dzk h PRO 60 N -0.16 0.03 -0.61 6.41 0.11 -1.90 -0.39 132.00 135.49 3dzk h PRO 60 Ca 0.21 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.27 3dzk h PRO 60 Cb 0.51 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.58 3dzk h PRO 60 CO -0.57 0.02 0.17 0.93 -0.21 0.00 0.00 178.00 178.34 3dzk h GLU 61 N 0.03 0.94 -0.27 1.05 3.07 -1.89 -1.56 114.58 115.95 3dzk h GLU 61 Ca 0.09 -0.19 -0.05 0.00 -0.50 0.00 0.00 59.36 58.71 3dzk h GLU 61 Cb 0.12 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.88 3dzk h GLU 61 CO -0.17 0.82 -0.01 1.15 -1.40 0.00 0.00 179.01 179.41 3dzk h THR 62 N 0.91 1.26 -0.17 1.13 2.02 -0.58 0.43 112.91 117.90 3dzk h THR 62 Ca 0.20 -0.95 -0.02 0.00 0.77 0.00 0.00 66.41 66.41 3dzk h THR 62 Cb 0.29 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 3dzk h THR 62 CO -0.00 0.30 0.03 0.58 0.37 0.00 0.00 175.52 176.80 3dzk h VAL 63 N 0.27 1.22 -0.30 3.16 2.07 -1.01 -0.98 116.25 120.68 3dzk h VAL 63 Ca 0.08 -0.69 0.04 0.00 0.82 0.00 0.00 66.70 66.94 3dzk h VAL 63 Cb 0.45 1.34 -0.04 0.00 -1.52 0.00 0.00 31.29 31.52 3dzk h VAL 63 CO 0.02 0.21 0.06 0.25 0.02 0.00 0.00 177.57 178.13 3dzk h LEU 64 N 0.08 0.02 -1.03 2.57 5.85 -1.21 -0.25 115.31 121.34 3dzk h LEU 64 Ca 0.05 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 3dzk h LEU 64 Cb 0.29 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 3dzk h LEU 64 CO 0.00 0.05 0.23 0.00 -0.34 0.00 0.00 178.44 178.38 3dzk h ALA 65 N 1.22 1.22 -0.55 1.25 0.00 -0.76 -1.40 119.26 120.25 3dzk h ALA 65 Ca 0.14 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 3dzk h ALA 65 Cb 0.15 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3dzk h ALA 65 CO -0.18 0.56 -0.05 0.00 0.00 0.00 0.00 179.25 179.57 3dzk h ARG 66 N 0.91 1.01 -0.18 0.00 3.08 -0.61 -0.50 114.38 118.09 3dzk h ARG 66 Ca 0.21 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 3dzk h ARG 66 Cb 0.21 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 3dzk h ARG 66 CO -0.02 1.03 0.06 0.00 -1.07 0.00 0.00 179.97 179.98 3dzk h VAL 68 N 0.12 0.49 -0.19 0.00 2.07 -1.19 -1.49 116.25 116.05 3dzk h VAL 68 Ca 0.06 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.61 3dzk h VAL 68 Cb 0.21 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 3dzk h VAL 68 CO -0.00 0.00 0.01 0.50 0.02 0.00 0.00 177.57 178.10 3dzk h LYS 69 N -0.23 0.08 -0.56 1.57 3.64 -0.93 -1.11 116.57 119.03 3dzk h LYS 69 Ca 0.11 -0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.51 3dzk h LYS 69 Cb 0.40 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 3dzk h LYS 69 CO -0.31 0.05 0.35 -0.92 -2.27 0.00 0.00 179.45 176.35 3dzk h TYR 70 N 0.08 0.65 0.00 1.91 3.20 -0.88 -2.30 116.97 119.63 3dzk h TYR 70 Ca 0.09 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.94 3dzk h TYR 70 Cb 0.10 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.15 3dzk h TYR 70 CO -0.16 0.38 -0.16 1.79 -1.64 0.00 0.00 178.16 178.38 3dzk h THR 71 N 0.69 0.34 -0.11 1.81 1.35 -1.09 -0.54 112.91 115.36 3dzk h THR 71 Ca 0.22 -1.06 -0.22 0.00 -0.55 0.00 0.00 66.41 64.80 3dzk h THR 71 Cb -0.00 1.82 0.01 0.00 -1.73 0.00 0.00 68.15 68.24 3dzk h THR 71 CO -0.08 0.15 -0.79 -0.33 -0.25 0.00 0.00 175.52 174.21 3dzk h GLU 72 N 0.00 0.65 0.11 4.72 5.08 -0.91 -3.36 114.58 120.87 3dzk h GLU 72 Ca -0.00 -0.55 -0.18 0.00 -1.00 0.00 0.00 59.36 57.63 3dzk h GLU 72 Cb 0.81 0.12 0.02 0.00 0.50 0.00 0.00 28.75 30.20 3dzk h GLU 72 CO 0.02 1.17 -0.76 0.82 -1.00 0.00 0.00 179.01 179.26 3dzk h ILE 73 N 0.44 1.50 -3.25 3.13 2.04 -1.08 -3.44 117.51 116.85 3dzk h ILE 73 Ca -0.05 -2.43 -0.71 0.00 1.00 0.00 0.00 64.86 62.66 3dzk h ILE 73 Cb 1.41 3.07 -0.20 0.00 -0.74 0.00 0.00 36.82 40.36 3dzk h ILE 73 CO 0.15 0.69 -0.12 -1.00 0.00 0.00 0.00 178.15 177.87 3dzk s HIS 74 N -2.61 3.14 0.46 1.37 3.76 -0.24 -4.96 115.29 116.21 3dzk s HIS 74 Ca -0.14 -0.76 0.12 0.00 -0.15 0.00 0.00 55.06 54.14 3dzk s HIS 74 Cb 0.01 -3.41 1.05 0.00 1.11 0.00 0.00 32.58 31.34 3dzk s HIS 74 CO 0.83 -0.94 2.08 -1.00 -0.85 0.00 0.00 174.74 174.86 3dzk h PRO 75 N 8.90 0.30 0.00 8.40 0.13 -1.85 -0.90 132.00 146.97 3dzk h PRO 75 Ca -0.28 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 3dzk h PRO 75 Cb 1.10 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.16 3dzk h PRO 75 CO 0.94 0.20 0.00 1.05 -0.23 0.00 0.00 178.00 179.96 3dzk h GLU 76 N 0.31 0.00 -0.46 0.86 9.09 -1.93 -2.49 114.58 119.96 3dzk h GLU 76 Ca 0.11 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.52 3dzk h GLU 76 Cb 0.06 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.16 3dzk h GLU 76 CO -0.02 0.00 0.00 -1.33 0.05 0.00 0.00 179.01 177.71 3dzk n MET 77 N -2.38 2.85 -0.23 1.06 2.81 -0.35 -4.69 117.12 116.20 3dzk n MET 77 Ca 0.01 -2.26 0.31 0.00 -1.81 0.00 0.00 57.70 53.95 3dzk n MET 77 Cb 0.21 -1.38 0.73 0.00 -0.71 0.00 0.00 33.22 32.07 3dzk n MET 77 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3dzk h ARG 78 N 2.71 0.00 0.01 0.03 3.08 -1.39 -2.62 114.38 116.20 3dzk h ARG 78 Ca 0.00 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.71 3dzk h ARG 78 Cb 0.83 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.82 3dzk h ARG 78 CO 0.01 0.00 -2.07 -2.39 -1.07 0.00 0.00 179.97 174.45 3dzk n HIS 79 N -4.18 0.52 -1.25 3.04 1.44 -1.26 -4.97 115.22 108.55 3dzk n HIS 79 Ca 0.21 0.18 -0.46 0.00 -2.01 0.00 0.00 57.72 55.64 3dzk n HIS 79 Cb 1.07 -1.09 -0.04 0.00 0.12 0.00 0.00 29.99 30.05 3dzk n HIS 79 CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81 3dzk n VAL 80 N -2.94 0.99 -3.40 0.61 0.31 -0.99 -4.89 118.33 108.02 3dzk n VAL 80 Ca -0.26 -0.25 -0.43 0.00 -0.01 0.00 0.00 64.34 63.39 3dzk n VAL 80 Cb 1.10 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 33.93 3dzk n VAL 80 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3dzk s ASP 81 N -0.50 6.15 0.25 4.52 3.68 -1.26 -4.96 116.67 124.56 3dzk s ASP 81 Ca 0.65 -0.69 0.08 0.00 2.13 0.00 0.00 52.55 54.72 3dzk s ASP 81 Cb -0.93 -2.19 0.30 0.00 -1.45 0.00 0.00 42.92 38.65 3dzk s ASP 81 CO 0.49 -0.47 1.58 0.00 0.13 0.00 0.00 175.17 176.90 3dzk h GLN 83 N 0.07 0.36 -0.59 0.00 5.75 -1.95 0.23 115.11 118.98 3dzk h GLN 83 Ca -0.01 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 3dzk h GLN 83 Cb 1.12 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 29.56 3dzk h GLN 83 CO 0.09 0.24 0.37 0.77 -2.65 0.00 0.00 178.83 177.64 3dzk h SER 84 N 0.37 0.69 -0.00 -0.69 0.02 -1.84 0.41 113.55 112.50 3dzk h SER 84 Ca 0.24 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 3dzk h SER 84 Cb 0.25 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.62 3dzk h SER 84 CO -0.24 0.52 0.00 0.58 -1.14 0.00 0.00 176.83 176.56 3dzk h VAL 85 N 0.79 1.02 -0.40 2.27 2.07 -1.00 -0.40 116.25 120.60 3dzk h VAL 85 Ca 0.21 -0.06 0.07 0.00 0.82 0.00 0.00 66.70 67.74 3dzk h VAL 85 Cb -0.05 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 30.71 3dzk h VAL 85 CO -0.04 0.02 0.04 -0.25 0.02 0.00 0.00 177.57 177.35 3dzk h TRP 86 N -0.02 0.05 -0.51 1.57 2.91 -0.66 0.01 115.95 119.29 3dzk h TRP 86 Ca 0.00 0.03 0.07 0.00 1.13 0.00 0.00 58.89 60.11 3dzk h TRP 86 Cb 0.02 0.04 -0.06 0.00 -0.51 0.00 0.00 29.16 28.65 3dzk h TRP 86 CO -0.07 -0.03 0.20 -0.44 -1.03 0.00 0.00 178.44 177.06 3dzk h ASP 87 N 0.16 0.22 -0.39 2.65 3.32 -0.54 0.26 116.42 122.10 3dzk h ASP 87 Ca 0.20 0.06 -0.07 0.00 0.02 0.00 0.00 57.03 57.23 3dzk h ASP 87 Cb 0.26 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 3dzk h ASP 87 CO -0.29 0.15 -0.01 0.00 -1.72 0.00 0.00 179.24 177.37 3dzk h ALA 88 N 1.33 1.10 0.05 3.45 0.00 -0.69 -0.07 119.26 124.42 3dzk h ALA 88 Ca 0.24 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3dzk h ALA 88 Cb 0.25 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3dzk h ALA 88 CO -0.23 0.57 -0.02 0.35 0.00 0.00 0.00 179.25 179.91 3dzk h PHE 89 N 0.73 -0.06 -0.48 0.00 3.04 -0.23 -2.92 116.94 117.02 3dzk h PHE 89 Ca 0.14 -0.00 0.10 0.00 3.98 0.00 0.00 57.97 62.19 3dzk h PHE 89 Cb 0.46 0.02 -0.10 0.00 2.56 0.00 0.00 35.95 38.90 3dzk h PHE 89 CO 0.02 0.25 -0.18 0.87 -2.02 0.00 0.00 178.31 177.25 3dzk h LYS 90 N -0.37 -0.07 -0.36 1.11 1.57 -0.90 -2.59 116.57 114.96 3dzk h LYS 90 Ca -0.01 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.88 3dzk h LYS 90 Cb 0.34 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 3dzk h LYS 90 CO 0.01 -0.05 0.27 0.78 -0.57 0.00 0.00 179.45 179.89 3dzk h GLY 91 N -0.07 0.00 2.00 3.86 0.00 -0.88 -0.38 103.07 107.60 3dzk h GLY 91 Ca 0.23 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.50 3dzk h GLY 91 CO -0.54 0.00 -0.27 0.00 0.00 0.00 0.00 176.54 175.73 3dzk h ALA 92 N 1.80 1.55 0.00 3.60 0.00 -1.27 -3.39 119.26 121.54 3dzk h ALA 92 Ca 0.17 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3dzk h ALA 92 Cb 0.71 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3dzk h ALA 92 CO -0.00 0.34 -0.33 1.97 0.00 0.00 0.00 179.25 181.23 3dzk n PHE 93 N -4.21 0.00 -2.32 0.00 1.16 -0.77 -4.78 117.46 106.53 3dzk n PHE 93 Ca -0.02 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.16 3dzk n PHE 93 Cb 0.32 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.16 3dzk n PHE 93 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 3dzk s ILE 94 N -0.70 3.17 -0.98 1.97 -1.09 -0.22 -2.89 121.20 120.45 3dzk s ILE 94 Ca 0.00 1.14 0.00 0.00 -2.23 0.00 0.00 60.65 59.56 3dzk s ILE 94 Cb 0.00 -3.71 0.00 0.00 -1.58 0.00 0.00 42.46 37.17 3dzk s ILE 94 CO 0.00 0.25 0.00 -1.20 -1.23 0.00 0.00 174.94 172.76 3dzk n SER 95 N 0.86 -4.96 -4.40 3.58 7.64 -1.18 -4.92 113.62 110.24 3dzk n SER 95 Ca 0.00 0.23 -0.29 0.00 1.01 0.00 0.00 58.87 59.82 3dzk n SER 95 Cb 0.44 -3.28 -0.13 0.00 -1.01 0.00 0.00 64.21 60.23 3dzk n SER 95 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3dzk s LYS 96 N -2.57 1.57 0.05 1.43 1.02 -1.14 -3.62 119.74 116.48 3dzk s LYS 96 Ca 0.00 -1.26 -0.31 0.00 0.02 0.00 0.00 55.97 54.42 3dzk s LYS 96 Cb 0.00 -1.97 -0.08 0.00 -0.52 0.00 0.00 37.83 35.27 3dzk s LYS 96 CO 0.00 0.47 1.62 -1.58 -0.92 0.00 0.00 175.35 174.94 3dzk s HIS 97 N -1.03 2.43 -2.00 3.18 5.65 -1.26 -3.35 115.29 118.91 3dzk s HIS 97 Ca 0.14 0.37 0.14 0.00 0.25 0.00 0.00 55.06 55.96 3dzk s HIS 97 Cb -0.10 -3.92 0.81 0.00 -1.18 0.00 0.00 32.58 28.18 3dzk s HIS 97 CO 0.06 -3.69 1.40 -0.35 -0.65 0.00 0.00 174.74 171.50 3dzk n PRO 98 N 5.71 0.84 -0.26 2.88 -0.04 -1.26 -0.55 135.00 142.32 3dzk n PRO 98 Ca 0.16 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.69 3dzk n PRO 98 Cb 0.41 -1.25 0.21 0.00 -0.04 0.00 0.00 33.50 32.83 3dzk n PRO 98 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dzk n ASP 100 N 0.81 2.92 -4.85 0.00 4.64 0.29 -4.62 116.55 115.74 3dzk n ASP 100 Ca 0.16 -2.87 -0.37 0.00 -1.38 0.00 0.00 54.79 50.33 3dzk n ASP 100 Cb 0.52 -0.45 -0.06 0.00 -1.04 0.00 0.00 41.12 40.09 3dzk n ASP 100 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 3dzk s ILE 101 N -4.14 5.15 0.38 5.18 -1.09 -0.73 -4.81 121.20 121.13 3dzk s ILE 101 Ca 0.37 0.60 0.05 0.00 -2.23 0.00 0.00 60.65 59.43 3dzk s ILE 101 Cb 0.38 -3.63 -0.07 0.00 -1.58 0.00 0.00 42.46 37.57 3dzk s ILE 101 CO -0.02 0.51 0.04 0.42 -1.23 0.00 0.00 174.94 174.66 3dzk s THR 102 N -1.15 1.50 0.41 2.92 -4.23 -1.26 -4.74 115.64 109.08 3dzk s THR 102 Ca 0.24 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 58.89 3dzk s THR 102 Cb -0.15 -2.82 0.15 0.00 1.34 0.00 0.00 72.50 71.02 3dzk s THR 102 CO 0.13 0.00 1.92 -0.33 -0.54 0.00 0.00 174.62 175.80 3dzk h GLU 103 N 1.91 0.00 -0.74 3.99 5.08 -1.98 -2.06 114.58 120.76 3dzk h GLU 103 Ca -0.42 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 57.98 3dzk h GLU 103 Cb 1.25 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.46 3dzk h GLU 103 CO 0.74 0.26 0.49 0.93 -1.00 0.00 0.00 179.01 180.43 3dzk h GLU 104 N 0.00 0.85 -0.71 2.33 3.07 -1.99 -1.25 114.58 116.88 3dzk h GLU 104 Ca -0.00 -0.05 0.11 0.00 -0.50 0.00 0.00 59.36 58.92 3dzk h GLU 104 Cb 0.47 -0.19 -0.05 0.00 -0.84 0.00 0.00 28.75 28.14 3dzk h GLU 104 CO 0.03 0.57 0.47 -0.44 -1.40 0.00 0.00 179.01 178.24 3dzk h ASP 105 N 0.88 0.48 -0.07 1.42 3.32 -1.69 -1.72 116.42 119.04 3dzk h ASP 105 Ca 0.30 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.37 3dzk h ASP 105 Cb 0.09 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3dzk h ASP 105 CO -0.09 0.28 0.00 -1.22 -1.72 0.00 0.00 179.24 176.49 3dzk n TYR 106 N -4.49 0.07 -0.15 4.55 4.02 -0.48 -4.07 117.16 116.61 3dzk n TYR 106 Ca 0.12 -0.03 -0.08 0.00 -0.01 0.00 0.00 57.90 57.90 3dzk n TYR 106 Cb 0.40 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.72 3dzk n TYR 106 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 3dzk h GLN 107 N 2.52 0.62 -0.92 -0.72 1.08 -1.25 0.12 115.11 116.56 3dzk h GLN 107 Ca 0.00 -0.08 0.07 0.00 -1.45 0.00 0.00 58.65 57.19 3dzk h GLN 107 Cb 0.54 -0.12 -0.07 0.00 -0.05 0.00 0.00 27.48 27.78 3dzk h GLN 107 CO 0.00 0.50 0.58 -1.35 -0.95 0.00 0.00 178.83 177.61 3dzk h PRO 108 N 0.58 1.02 -0.52 1.46 0.11 -1.79 0.09 132.00 132.95 3dzk h PRO 108 Ca 0.16 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 66.09 3dzk h PRO 108 Cb 0.06 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 30.93 3dzk h PRO 108 CO -0.02 0.67 -0.12 1.25 -0.21 0.00 0.00 178.00 179.57 3dzk h LEU 109 N 1.05 1.00 -0.62 2.35 5.85 -1.68 -2.20 115.31 121.06 3dzk h LEU 109 Ca 0.41 -0.36 0.02 0.00 0.84 0.00 0.00 57.88 58.79 3dzk h LEU 109 Cb 0.20 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 3dzk h LEU 109 CO -0.18 1.12 0.40 0.24 -0.34 0.00 0.00 178.44 179.68 3dzk h MET 110 N 0.86 0.78 0.21 1.25 2.86 -0.09 -0.35 114.93 120.45 3dzk h MET 110 Ca 0.13 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.72 3dzk h MET 110 Cb 0.68 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.16 3dzk h MET 110 CO 0.05 0.52 -0.17 -0.22 1.06 0.00 0.00 176.91 178.15 3dzk h LYS 111 N 0.80 -0.37 -0.26 1.72 3.64 -0.83 -2.37 116.57 118.90 3dzk h LYS 111 Ca 0.24 0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.65 3dzk h LYS 111 Cb -0.04 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 3dzk h LYS 111 CO -0.07 -0.25 0.17 -0.07 -2.27 0.00 0.00 179.45 176.96 3dzk h LEU 112 N -0.39 0.28 -2.78 5.20 3.38 -1.10 -2.36 115.31 117.54 3dzk h LEU 112 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3dzk h LEU 112 Cb 0.35 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3dzk h LEU 112 CO -0.01 0.20 0.00 0.61 0.09 0.00 0.00 178.44 179.33 3dzk n GLY 113 N -1.50 2.43 3.75 0.83 0.00 -0.17 -4.96 105.19 105.57 3dzk n GLY 113 Ca 0.01 -0.69 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 3dzk n GLY 113 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dzk s THR 114 N -2.11 2.18 -0.24 2.61 2.01 -0.89 -4.75 115.64 114.45 3dzk s THR 114 Ca 0.41 0.15 -0.15 0.00 0.31 0.00 0.00 61.69 62.42 3dzk s THR 114 Cb 0.29 -3.10 0.07 0.00 0.01 0.00 0.00 72.50 69.78 3dzk s THR 114 CO 0.15 0.02 0.59 -1.58 -0.69 0.00 0.00 174.62 173.12 3dzk s GLN 115 N -0.57 0.61 0.01 4.92 0.74 -1.26 -5.10 119.66 119.02 3dzk s GLN 115 Ca 0.62 1.03 -0.30 0.00 0.05 0.00 0.00 55.36 56.75 3dzk s GLN 115 Cb -0.47 0.13 -0.04 0.00 1.10 0.00 0.00 33.01 33.73 3dzk s GLN 115 CO 0.48 -0.14 1.11 0.99 -0.55 0.00 0.00 175.29 177.18 3dzk s THR 116 N 1.33 4.40 -0.06 -0.34 2.01 -1.26 -5.05 115.64 116.67 3dzk s THR 116 Ca -0.08 1.72 0.05 0.00 0.31 0.00 0.00 61.69 63.69 3dzk s THR 116 Cb -0.06 -4.10 -0.01 0.00 0.01 0.00 0.00 72.50 68.34 3dzk s THR 116 CO -0.14 0.10 -0.22 0.68 -0.69 0.00 0.00 174.62 174.35 3dzk s VAL 117 N 1.33 2.33 -0.30 3.82 -7.23 -1.26 -5.06 120.40 114.04 3dzk s VAL 117 Ca 0.55 -0.97 -0.32 0.00 -1.81 0.00 0.00 61.98 59.43 3dzk s VAL 117 Cb -0.25 -1.87 -0.09 0.00 0.56 0.00 0.00 36.38 34.73 3dzk s VAL 117 CO 0.27 0.57 2.21 -2.65 -0.31 0.00 0.00 175.10 175.18 3dzk n PRO 118 N 2.87 1.43 0.27 4.82 -0.02 -1.26 -4.79 135.00 138.32 3dzk n PRO 118 Ca -0.17 0.38 0.13 0.00 -2.02 0.00 0.00 63.50 61.82 3dzk n PRO 118 Cb 0.52 -2.78 0.79 0.00 -0.02 0.00 0.00 33.50 32.00 3dzk n PRO 118 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dzk n ASN 120 N -3.74 1.88 -1.10 0.00 6.94 -1.26 -1.05 115.26 116.93 3dzk n ASN 120 Ca -0.02 -1.83 0.02 0.00 -0.02 0.00 0.00 54.58 52.73 3dzk n ASN 120 Cb 0.18 -0.17 0.13 0.00 -2.36 0.00 0.00 39.78 37.56 3dzk n ASN 120 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3dzk n LYS 121 N 0.48 1.34 -3.13 -3.83 5.02 -0.89 -4.64 118.16 112.51 3dzk n LYS 121 Ca 0.15 -3.03 -0.39 0.00 -2.02 0.00 0.00 58.31 53.02 3dzk n LYS 121 Cb 0.34 -1.22 -0.05 0.00 -0.02 0.00 0.00 35.03 34.07 3dzk n LYS 121 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3dzk s ILE 122 N -2.48 4.98 -0.22 -0.18 1.01 -1.26 -0.58 121.20 122.48 3dzk s ILE 122 Ca 0.38 1.34 -0.01 0.00 0.00 0.00 0.00 60.65 62.35 3dzk s ILE 122 Cb 0.38 -3.98 0.02 0.00 0.01 0.00 0.00 42.46 38.88 3dzk s ILE 122 CO -0.09 0.33 -0.11 -0.22 0.00 0.00 0.00 174.94 174.86 3dzk s LEU 123 N 0.34 2.76 0.47 2.97 2.96 -0.13 -2.17 118.68 125.87 3dzk s LEU 123 Ca 0.34 -0.69 0.01 0.00 -0.22 0.00 0.00 54.13 53.57 3dzk s LEU 123 Cb -0.18 -1.61 0.01 0.00 0.50 0.00 0.00 46.19 44.90 3dzk s LEU 123 CO 0.17 -0.06 0.68 -0.76 -1.32 0.00 0.00 176.35 175.07 3dzk s LEU 124 N 1.34 3.56 0.15 -0.68 1.43 1.00 -4.19 118.68 121.29 3dzk s LEU 124 Ca 0.03 0.13 -0.17 0.00 -1.03 0.00 0.00 54.13 53.09 3dzk s LEU 124 Cb -0.15 -3.02 0.04 0.00 0.03 0.00 0.00 46.19 43.08 3dzk s LEU 124 CO -0.07 -0.81 0.45 -1.66 0.23 0.00 0.00 176.35 174.48 3dzk s TRP 125 N -2.58 -0.20 -0.11 0.29 1.48 -1.26 -1.60 118.94 114.97 3dzk s TRP 125 Ca 0.51 -0.12 -0.03 0.00 -1.06 0.00 0.00 56.10 55.41 3dzk s TRP 125 Cb -0.10 0.31 0.04 0.00 -1.16 0.00 0.00 33.47 32.56 3dzk s TRP 125 CO 0.37 -0.77 0.04 0.45 -4.06 0.00 0.00 176.95 172.99 3dzk s SER 126 N -2.82 1.89 -1.42 -2.66 0.15 -0.57 -4.68 113.70 103.59 3dzk s SER 126 Ca 0.05 -0.30 -0.06 0.00 0.70 0.00 0.00 55.95 56.34 3dzk s SER 126 Cb 0.01 -0.35 0.03 0.00 -1.71 0.00 0.00 66.02 64.00 3dzk s SER 126 CO -0.10 -0.26 0.46 0.54 1.20 0.00 0.00 173.24 175.08 3dzk n ARG 127 N 5.20 -3.85 -2.69 5.44 1.74 -1.26 -3.61 116.66 117.63 3dzk n ARG 127 Ca -0.06 0.72 -0.07 0.00 -0.77 0.00 0.00 57.85 57.67 3dzk n ARG 127 Cb 0.49 -5.49 0.09 0.00 -1.02 0.00 0.00 32.46 26.53 3dzk n ARG 127 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 3dzk n ILE 128 N -4.15 0.35 0.05 0.55 0.13 -1.26 -4.68 119.36 110.35 3dzk n ILE 128 Ca -0.09 -2.01 -0.06 0.00 -1.10 0.00 0.00 62.75 59.49 3dzk n ILE 128 Cb 0.60 0.90 0.13 0.00 -0.84 0.00 0.00 39.64 40.42 3dzk n ILE 128 CO 0.00 0.00 0.00 0.07 2.80 0.00 0.00 176.55 179.42 3dzk h LYS 129 N 2.29 0.37 -0.00 9.51 2.10 -1.96 -3.02 116.57 125.87 3dzk h LYS 129 Ca -0.23 -0.22 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 3dzk h LYS 129 Cb 1.26 0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 32.60 3dzk h LYS 129 CO 0.11 0.79 -0.01 -0.44 -2.00 0.00 0.00 179.45 177.90 3dzk h ASP 130 N 0.30 -0.04 -0.41 7.07 5.19 -1.99 0.55 116.42 127.09 3dzk h ASP 130 Ca 0.01 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 3dzk h ASP 130 Cb 0.99 0.02 -0.02 0.00 0.18 0.00 0.00 39.33 40.50 3dzk h ASP 130 CO 0.09 -0.02 0.27 0.25 -3.12 0.00 0.00 179.24 176.71 3dzk h LEU 131 N -0.03 0.47 -0.78 1.55 6.46 -1.99 0.64 115.31 121.64 3dzk h LEU 131 Ca 0.01 -0.01 0.05 0.00 -0.12 0.00 0.00 57.88 57.81 3dzk h LEU 131 Cb 0.04 -0.12 -0.06 0.00 -0.73 0.00 0.00 40.66 39.79 3dzk h LEU 131 CO -0.02 0.34 0.47 0.00 -0.62 0.00 0.00 178.44 178.62 3dzk h ALA 132 N 1.15 1.05 -0.34 1.25 0.00 -1.27 -0.09 119.26 121.01 3dzk h ALA 132 Ca 0.15 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.89 3dzk h ALA 132 Cb -0.06 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 3dzk h ALA 132 CO -0.03 0.21 -0.43 0.45 0.00 0.00 0.00 179.25 179.45 3dzk h HIS 133 N 0.88 1.08 -0.61 0.00 3.86 -0.57 -2.40 115.15 117.39 3dzk h HIS 133 Ca 0.33 -0.35 -0.03 0.00 -1.16 0.00 0.00 60.37 59.17 3dzk h HIS 133 Cb 0.13 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.36 3dzk h HIS 133 CO -0.05 1.17 0.26 1.96 0.86 0.00 0.00 177.93 182.14 3dzk h GLN 134 N 0.69 0.88 0.12 2.45 4.20 -0.47 -1.68 115.11 121.30 3dzk h GLN 134 Ca 0.04 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 3dzk h GLN 134 Cb 1.03 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.65 3dzk h GLN 134 CO 0.10 0.71 -0.06 0.35 -0.67 0.00 0.00 178.83 179.27 3dzk h PHE 135 N 0.87 -0.14 0.00 2.96 3.04 -0.91 -3.11 116.94 119.65 3dzk h PHE 135 Ca 0.21 -0.00 -0.03 0.00 3.98 0.00 0.00 57.97 62.12 3dzk h PHE 135 Cb 0.14 0.05 -0.00 0.00 2.56 0.00 0.00 35.95 38.70 3dzk h PHE 135 CO 0.01 0.18 -0.16 1.79 -2.02 0.00 0.00 178.31 178.11 3dzk h THR 136 N -0.48 0.42 0.00 4.41 1.35 -1.28 -2.67 112.91 114.65 3dzk h THR 136 Ca -0.02 -0.92 -0.02 0.00 -0.55 0.00 0.00 66.41 64.91 3dzk h THR 136 Cb 0.39 1.66 -0.00 0.00 -1.73 0.00 0.00 68.15 68.47 3dzk h THR 136 CO 0.03 0.16 -0.09 1.56 -0.25 0.00 0.00 175.52 176.92 3dzk h GLN 137 N 0.00 0.00 0.52 4.72 4.20 -1.23 -2.15 115.11 121.17 3dzk h GLN 137 Ca -0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 3dzk h GLN 137 Cb 0.65 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.44 3dzk h GLN 137 CO 0.02 0.09 -0.25 0.28 -0.67 0.00 0.00 178.83 178.30 3dzk h VAL 138 N 0.00 0.42 0.00 -0.54 2.07 -1.48 -3.41 116.25 113.31 3dzk h VAL 138 Ca -0.00 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 3dzk h VAL 138 Cb 0.28 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 3dzk h VAL 138 CO 0.01 0.04 -0.34 0.00 0.02 0.00 0.00 177.57 177.31 3dzk n GLN 139 N -5.32 0.00 -3.79 1.57 10.64 -1.26 -5.03 117.38 114.20 3dzk n GLN 139 Ca -0.11 -0.70 -0.26 0.00 -1.83 0.00 0.00 57.00 54.10 3dzk n GLN 139 Cb 0.32 -0.20 0.03 0.00 -0.86 0.00 0.00 30.24 29.54 3dzk n GLN 139 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 3dzk n ARG 140 N 0.04 -5.47 -0.21 2.61 3.00 -0.81 -4.88 116.66 110.94 3dzk n ARG 140 Ca -0.01 0.63 -0.02 0.00 -0.01 0.00 0.00 57.85 58.44 3dzk n ARG 140 Cb 0.66 -5.39 0.19 0.00 0.00 0.00 0.00 32.46 27.92 3dzk n ARG 140 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 3dzk h ASP 141 N -2.04 0.89 -5.73 0.55 3.32 -1.86 -3.46 116.42 108.10 3dzk h ASP 141 Ca -0.59 -0.08 -0.40 0.00 0.02 0.00 0.00 57.03 55.97 3dzk h ASP 141 Cb 1.37 -0.23 -0.14 0.00 0.22 0.00 0.00 39.33 40.55 3dzk h ASP 141 CO 0.61 0.74 -0.53 -0.04 -1.72 0.00 0.00 179.24 178.30 3dzk s MET 142 N -5.61 1.59 -0.09 3.56 -1.94 -1.26 -4.91 119.30 110.65 3dzk s MET 142 Ca -0.11 -1.91 0.01 0.00 -1.71 0.00 0.00 55.69 51.97 3dzk s MET 142 Cb 0.17 0.28 0.02 0.00 2.01 0.00 0.00 34.83 37.31 3dzk s MET 142 CO 0.80 -0.57 -0.09 -0.06 -0.01 0.00 0.00 175.02 175.09 3dzk s PHE 143 N -3.65 1.41 0.64 -0.03 0.08 0.26 -4.76 117.98 111.93 3dzk s PHE 143 Ca 0.40 -0.61 0.00 0.00 0.12 0.00 0.00 56.93 56.84 3dzk s PHE 143 Cb 0.04 -1.12 0.08 0.00 -0.57 0.00 0.00 43.02 41.45 3dzk s PHE 143 CO 0.23 -0.40 0.90 0.95 -0.10 0.00 0.00 175.22 176.80 3dzk s THR 144 N 1.25 2.36 0.44 0.64 -4.23 -1.26 -0.95 115.64 113.88 3dzk s THR 144 Ca -0.04 -0.63 0.11 0.00 -1.18 0.00 0.00 61.69 59.95 3dzk s THR 144 Cb -0.14 -2.73 0.28 0.00 1.34 0.00 0.00 72.50 71.25 3dzk s THR 144 CO -0.03 0.00 2.06 0.25 -0.54 0.00 0.00 174.62 176.36 3dzk h LEU 145 N -0.26 0.34 0.00 4.79 5.85 -1.98 -0.79 115.31 123.27 3dzk h LEU 145 Ca -0.39 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.33 3dzk h LEU 145 Cb 1.28 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.23 3dzk h LEU 145 CO 0.46 0.24 0.00 -0.62 -0.34 0.00 0.00 178.44 178.18 3dzk n GLU 146 N -4.49 0.49 0.00 1.25 4.71 -1.26 -1.84 120.64 119.50 3dzk n GLU 146 Ca 0.03 0.01 0.12 0.00 -0.01 0.00 0.00 57.16 57.31 3dzk n GLU 146 Cb 0.14 -1.50 0.29 0.00 -1.01 0.00 0.00 31.44 29.35 3dzk n GLU 146 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 3dzk n ASP 147 N -1.25 0.55 -4.88 1.62 10.43 -0.30 -3.15 116.55 119.57 3dzk n ASP 147 Ca 0.15 -0.31 -0.30 0.00 2.57 0.00 0.00 54.79 56.90 3dzk n ASP 147 Cb 0.22 0.20 -0.02 0.00 1.84 0.00 0.00 41.12 43.36 3dzk n ASP 147 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 3dzk s THR 148 N -2.93 4.80 0.15 -3.53 -4.23 -0.77 -4.92 115.64 104.22 3dzk s THR 148 Ca 0.13 0.55 -0.18 0.00 -1.18 0.00 0.00 61.69 61.01 3dzk s THR 148 Cb 0.18 -3.79 0.04 0.00 1.34 0.00 0.00 72.50 70.27 3dzk s THR 148 CO 0.67 -0.71 1.69 0.25 -0.54 0.00 0.00 174.62 175.98 3dzk h LEU 149 N 0.73 -0.25 -0.37 4.79 5.85 -1.89 0.09 115.31 124.26 3dzk h LEU 149 Ca -0.47 0.09 -0.18 0.00 0.84 0.00 0.00 57.88 58.17 3dzk h LEU 149 Cb 1.19 0.18 -0.00 0.00 0.37 0.00 0.00 40.66 42.40 3dzk h LEU 149 CO 0.63 -0.09 -0.53 -0.07 -0.34 0.00 0.00 178.44 178.04 3dzk h LEU 150 N 0.02 0.89 -0.70 2.25 3.38 -1.87 0.05 115.31 119.33 3dzk h LEU 150 Ca 0.15 -0.47 -0.06 0.00 0.09 0.00 0.00 57.88 57.60 3dzk h LEU 150 Cb 0.23 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 3dzk h LEU 150 CO -0.31 1.24 0.22 1.23 0.09 0.00 0.00 178.44 180.91 3dzk h GLY 151 N 0.80 1.17 1.00 0.83 0.00 -1.59 -2.78 103.07 102.50 3dzk h GLY 151 Ca 0.02 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 46.65 3dzk h GLY 151 CO 0.11 0.65 0.43 -1.82 0.00 0.00 0.00 176.54 175.92 3dzk h TYR 152 N 1.03 0.90 -0.87 5.60 5.03 -0.60 -0.54 116.97 127.52 3dzk h TYR 152 Ca 0.22 0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.54 3dzk h TYR 152 Cb 0.31 -0.30 -0.04 0.00 1.55 0.00 0.00 36.73 38.25 3dzk h TYR 152 CO 0.02 0.60 0.53 -0.07 -1.32 0.00 0.00 178.16 177.92 3dzk h LEU 153 N 0.94 1.03 0.00 2.82 3.38 -0.80 -3.26 115.31 119.43 3dzk h LEU 153 Ca 0.25 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3dzk h LEU 153 Cb -0.05 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.43 3dzk h LEU 153 CO -0.05 0.79 -1.34 0.00 0.09 0.00 0.00 178.44 177.93 3dzk n ALA 154 N -2.36 4.00 -1.64 1.53 0.00 -1.07 -4.81 120.51 116.16 3dzk n ALA 154 Ca 0.09 -0.56 -0.55 0.00 0.00 0.00 0.00 53.44 52.43 3dzk n ALA 154 Cb 0.05 -0.78 -0.07 0.00 0.00 0.00 0.00 19.45 18.65 3dzk n ALA 154 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3dzk n ASP 155 N -1.79 1.93 0.00 0.00 4.64 -0.23 -1.21 116.55 119.88 3dzk n ASP 155 Ca 0.01 1.10 0.00 0.00 -1.38 0.00 0.00 54.79 54.52 3dzk n ASP 155 Cb 0.42 -1.16 0.00 0.00 -1.04 0.00 0.00 41.12 39.34 3dzk n ASP 155 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 3dzk n ASP 156 N 3.74 -3.85 -4.92 1.67 8.00 -1.26 -4.99 116.55 114.94 3dzk n ASP 156 Ca 0.22 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.43 3dzk n ASP 156 Cb 0.16 -2.14 -0.04 0.00 -0.02 0.00 0.00 41.12 39.09 3dzk n ASP 156 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3dzk s LEU 157 N 0.00 4.32 0.01 0.64 1.43 -0.35 -5.06 118.68 119.67 3dzk s LEU 157 Ca 0.00 0.21 0.08 0.00 -1.03 0.00 0.00 54.13 53.40 3dzk s LEU 157 Cb 0.00 -2.91 -0.02 0.00 0.03 0.00 0.00 46.19 43.29 3dzk s LEU 157 CO 0.00 0.12 -0.26 -0.89 0.23 0.00 0.00 176.35 175.55 3dzk s THR 158 N -1.60 2.07 -0.04 5.49 2.01 -1.26 -5.01 115.64 117.29 3dzk s THR 158 Ca 0.34 -1.23 -0.25 0.00 0.31 0.00 0.00 61.69 60.87 3dzk s THR 158 Cb -0.12 -1.74 0.05 0.00 0.01 0.00 0.00 72.50 70.70 3dzk s THR 158 CO 0.28 0.47 0.55 -1.66 -0.69 0.00 0.00 174.62 173.57 3dzk s TRP 159 N -0.70 -0.49 0.06 4.92 -2.14 -1.26 -0.66 118.94 118.67 3dzk s TRP 159 Ca 0.11 0.83 -0.27 0.00 2.66 0.00 0.00 56.10 59.43 3dzk s TRP 159 Cb -0.10 0.30 0.09 0.00 -3.10 0.00 0.00 33.47 30.65 3dzk s TRP 159 CO 0.00 -0.53 0.84 0.00 -2.66 0.00 0.00 176.95 174.61 3dzk n GLY 161 N -0.31 6.40 2.96 0.00 0.00 -1.26 -0.97 105.19 112.01 3dzk n GLY 161 Ca -0.10 -1.95 -0.12 0.00 0.00 0.00 0.00 46.02 43.85 3dzk n GLY 161 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dzk s GLU 162 N 1.54 0.29 0.22 1.61 2.02 -1.22 -4.53 118.70 118.63 3dzk s GLU 162 Ca 0.00 -0.36 -0.30 0.00 0.02 0.00 0.00 54.97 54.32 3dzk s GLU 162 Cb 0.00 -0.13 -0.10 0.00 0.10 0.00 0.00 34.13 34.00 3dzk s GLU 162 CO 0.00 0.02 1.41 0.12 0.02 0.00 0.00 175.26 176.83 3dzk s PHE 163 N -0.70 3.11 -1.47 1.61 5.36 -1.21 -2.86 117.98 121.81 3dzk s PHE 163 Ca -0.06 1.04 0.00 0.00 -0.96 0.00 0.00 56.93 56.95 3dzk s PHE 163 Cb -0.05 -3.76 0.00 0.00 -0.34 0.00 0.00 43.02 38.87 3dzk s PHE 163 CO -0.00 -2.48 0.00 -0.25 -1.46 0.00 0.00 175.22 171.02 3dzk n ASP 164 N 2.67 -4.86 -4.06 6.13 9.92 -1.24 -4.93 116.55 120.18 3dzk n ASP 164 Ca 0.07 0.34 -0.08 0.00 -0.53 0.00 0.00 54.79 54.60 3dzk n ASP 164 Cb 0.41 -3.58 -0.10 0.00 -0.64 0.00 0.00 41.12 37.21 3dzk n ASP 164 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 3dzk s THR 165 N -2.45 0.19 -0.76 -3.53 -1.32 -1.24 -5.05 115.64 101.48 3dzk s THR 165 Ca 0.00 -1.55 0.10 0.00 -1.21 0.00 0.00 61.69 59.03 3dzk s THR 165 Cb 0.00 -1.17 0.52 0.00 -1.51 0.00 0.00 72.50 70.34 3dzk s THR 165 CO 0.00 -0.86 1.32 -1.54 -2.21 0.00 0.00 174.62 171.34 3dzk n SER 166 N 0.52 3.85 -4.79 8.08 3.41 -1.26 -3.09 113.62 120.34 3dzk n SER 166 Ca -0.17 -2.51 -0.37 0.00 -0.26 0.00 0.00 58.87 55.56 3dzk n SER 166 Cb 0.59 -0.57 -0.06 0.00 -0.26 0.00 0.00 64.21 63.91 3dzk n SER 166 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3dzk s LYS 167 N -2.02 4.50 0.32 4.33 1.02 -1.26 -4.76 119.74 121.87 3dzk s LYS 167 Ca 0.35 1.17 -0.27 0.00 0.02 0.00 0.00 55.97 57.24 3dzk s LYS 167 Cb 0.25 -2.94 -0.09 0.00 -0.52 0.00 0.00 37.83 34.53 3dzk s LYS 167 CO 0.12 0.38 1.02 0.42 -0.92 0.00 0.00 175.35 176.38 3dzk s ILE 168 N -1.47 3.82 -0.48 2.17 1.01 -1.26 -3.46 121.20 121.54 3dzk s ILE 168 Ca 0.45 1.62 -0.18 0.00 0.00 0.00 0.00 60.65 62.54 3dzk s ILE 168 Cb -0.19 -3.95 0.05 0.00 0.01 0.00 0.00 42.46 38.38 3dzk s ILE 168 CO 0.24 0.23 0.53 0.21 0.00 0.00 0.00 174.94 176.15 3dzk s ASN 169 N -1.31 6.20 0.00 3.58 3.84 -0.14 -4.92 114.94 122.19 3dzk s ASN 169 Ca 0.49 -0.92 0.27 0.00 0.21 0.00 0.00 52.86 52.91 3dzk s ASN 169 Cb -0.25 -2.25 0.79 0.00 -0.55 0.00 0.00 41.25 38.99 3dzk s ASN 169 CO 0.31 -0.76 1.59 -1.22 -2.79 0.00 0.00 177.10 174.24 3dzk n TYR 170 N 5.83 0.00 -0.11 0.43 4.02 -1.26 -1.05 117.16 125.02 3dzk n TYR 170 Ca -0.08 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.63 3dzk n TYR 170 Cb 0.46 -0.01 -0.12 0.00 -0.02 0.00 0.00 39.34 39.64 3dzk n TYR 170 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 3dzk n GLN 171 N 0.34 0.67 -3.46 -0.72 1.13 -1.26 -4.21 117.38 109.87 3dzk n GLN 171 Ca 0.17 0.17 -0.13 0.00 -1.94 0.00 0.00 57.00 55.27 3dzk n GLN 171 Cb 0.41 -1.55 -0.03 0.00 0.11 0.00 0.00 30.24 29.18 3dzk n GLN 171 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 3dzk s SER 172 N -6.61 -0.55 0.06 1.08 1.04 -1.26 -3.73 113.70 103.73 3dzk s SER 172 Ca -0.33 0.15 0.01 0.00 0.48 0.00 0.00 55.95 56.26 3dzk s SER 172 Cb 0.09 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.72 3dzk s SER 172 CO 0.63 -0.83 -0.06 0.00 0.98 0.00 0.00 173.24 173.96 3dzk n PRO 174 N 0.61 2.07 -2.58 0.00 -0.02 -1.26 -1.33 135.00 132.49 3dzk n PRO 174 Ca -0.17 0.74 -0.41 0.00 -2.02 0.00 0.00 63.50 61.64 3dzk n PRO 174 Cb 0.58 -2.48 -0.04 0.00 -0.02 0.00 0.00 33.50 31.55 3dzk n PRO 174 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3dzk s ASP 175 N 0.74 7.30 0.23 2.55 -1.08 -1.26 -4.66 116.67 120.49 3dzk s ASP 175 Ca 0.77 1.92 -0.07 0.00 -0.52 0.00 0.00 52.55 54.65 3dzk s ASP 175 Cb -0.69 -2.59 0.37 0.00 -1.46 0.00 0.00 42.92 38.56 3dzk s ASP 175 CO 0.41 -0.25 1.74 -0.25 0.52 0.00 0.00 175.17 177.34 3dzk h TRP 176 N 5.93 0.47 0.00 -5.34 7.01 -1.94 0.06 115.95 122.14 3dzk h TRP 176 Ca -0.43 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 60.60 3dzk h TRP 176 Cb 1.21 -0.10 -0.00 0.00 -2.10 0.00 0.00 29.16 28.17 3dzk h TRP 176 CO 0.65 0.09 -0.04 -0.09 -2.79 0.00 0.00 178.44 176.26 3dzk h ARG 177 N 0.44 0.00 -0.01 2.65 2.43 -1.93 -3.24 114.38 114.72 3dzk h ARG 177 Ca 0.36 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.37 3dzk h ARG 177 Cb 0.50 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 3dzk h ARG 177 CO -0.35 0.54 -0.75 0.87 -1.51 0.00 0.00 179.97 178.76 3dzk h LYS 178 N -1.00 0.08 0.00 0.20 1.57 -1.97 -3.42 116.57 112.02 3dzk h LYS 178 Ca -0.01 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 3dzk h LYS 178 Cb 0.55 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.88 3dzk h LYS 178 CO -0.01 0.79 -0.05 -0.25 -0.57 0.00 0.00 179.45 179.37 3dzk n ASP 179 N -3.69 0.14 -3.57 0.86 8.00 -0.05 -4.99 116.55 113.25 3dzk n ASP 179 Ca -0.02 0.02 -0.14 0.00 0.71 0.00 0.00 54.79 55.36 3dzk n ASP 179 Cb 0.72 -0.28 -0.06 0.00 -0.02 0.00 0.00 41.12 41.48 3dzk n ASP 179 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dzk h SER 181 N 3.35 0.00 -0.99 0.00 4.64 -1.83 -3.34 113.55 115.39 3dzk h SER 181 Ca -0.25 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.52 3dzk h SER 181 Cb 1.15 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.10 3dzk h SER 181 CO 0.27 0.26 1.02 0.59 -0.87 0.00 0.00 176.83 178.11 3dzk n ASN 182 N -3.07 6.91 -4.97 4.97 3.02 -1.26 -4.42 115.26 116.44 3dzk n ASN 182 Ca 0.01 -3.12 -0.21 0.00 -0.03 0.00 0.00 54.58 51.23 3dzk n ASN 182 Cb 0.65 -1.29 -0.02 0.00 -0.61 0.00 0.00 39.78 38.51 3dzk n ASN 182 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3dzk s ASN 183 N 0.52 6.28 0.34 6.41 4.22 -1.25 -1.78 114.94 129.68 3dzk s ASN 183 Ca 0.58 0.11 0.06 0.00 -2.14 0.00 0.00 52.86 51.47 3dzk s ASN 183 Cb 0.32 -1.83 0.72 0.00 1.28 0.00 0.00 41.25 41.74 3dzk s ASN 183 CO -0.17 -0.15 1.90 -0.65 -2.04 0.00 0.00 177.10 175.99 3dzk h PRO 184 N 1.07 0.77 -0.00 3.55 0.11 -1.81 -1.27 132.00 134.41 3dzk h PRO 184 Ca -0.51 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.53 3dzk h PRO 184 Cb 1.23 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3dzk h PRO 184 CO 0.60 0.51 -0.10 0.28 -0.21 0.00 0.00 178.00 179.09 3dzk h VAL 185 N 0.80 1.59 -0.90 3.15 2.07 -1.95 -2.34 116.25 118.67 3dzk h VAL 185 Ca 0.41 -1.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.05 3dzk h VAL 185 Cb 0.49 2.81 -0.04 0.00 -1.52 0.00 0.00 31.29 33.03 3dzk h VAL 185 CO -0.17 0.49 0.51 0.28 0.02 0.00 0.00 177.57 178.70 3dzk h SER 186 N -0.66 1.11 -0.25 0.57 0.02 -1.79 -1.84 113.55 110.71 3dzk h SER 186 Ca -0.01 -0.09 -0.16 0.00 -0.84 0.00 0.00 61.79 60.69 3dzk h SER 186 Cb 0.86 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 3dzk h SER 186 CO 0.02 0.88 -0.42 0.58 -1.14 0.00 0.00 176.83 176.74 3dzk h VAL 187 N 1.25 1.28 -0.00 2.27 2.07 -1.31 -1.57 116.25 120.24 3dzk h VAL 187 Ca 0.32 -1.60 0.02 0.00 0.82 0.00 0.00 66.70 66.25 3dzk h VAL 187 Cb 0.00 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 3dzk h VAL 187 CO -0.05 0.52 -0.09 0.15 0.02 0.00 0.00 177.57 178.12 3dzk h PHE 188 N 0.65 -0.23 -0.23 1.57 3.57 -0.99 -1.37 116.94 119.91 3dzk h PHE 188 Ca 0.05 0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.41 3dzk h PHE 188 Cb 0.99 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.83 3dzk h PHE 188 CO 0.06 -0.14 -0.45 -1.49 -2.23 0.00 0.00 178.31 174.05 3dzk h TRP 189 N -0.16 0.71 -0.65 0.41 4.06 -1.17 -1.32 115.95 117.84 3dzk h TRP 189 Ca 0.04 -0.22 -0.01 0.00 2.06 0.00 0.00 58.89 60.75 3dzk h TRP 189 Cb 0.20 -0.15 -0.03 0.00 -1.00 0.00 0.00 29.16 28.19 3dzk h TRP 189 CO -0.16 0.93 0.37 -0.22 -3.56 0.00 0.00 178.44 175.80 3dzk h LYS 190 N 0.47 0.90 0.04 0.49 3.64 -1.18 0.10 116.57 121.03 3dzk h LYS 190 Ca 0.03 -0.10 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3dzk h LYS 190 Cb 0.98 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 3dzk h LYS 190 CO 0.09 0.67 -0.02 1.15 -2.27 0.00 0.00 179.45 179.07 3dzk h THR 191 N 0.89 1.22 -0.17 1.00 2.02 -0.77 -1.97 112.91 115.13 3dzk h THR 191 Ca 0.23 -0.84 -0.12 0.00 0.77 0.00 0.00 66.41 66.44 3dzk h THR 191 Cb 0.02 1.78 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 3dzk h THR 191 CO -0.04 0.21 -0.43 -0.37 0.37 0.00 0.00 175.52 175.27 3dzk h VAL 192 N -0.43 1.31 -0.38 3.16 -1.51 -1.25 -2.72 116.25 114.44 3dzk h VAL 192 Ca -0.01 -1.59 -0.16 0.00 -1.23 0.00 0.00 66.70 63.71 3dzk h VAL 192 Cb 0.39 1.65 -0.01 0.00 -2.13 0.00 0.00 31.29 31.20 3dzk h VAL 192 CO 0.01 0.49 -0.39 0.28 -1.23 0.00 0.00 177.57 176.72 3dzk h SER 193 N 0.32 1.00 0.01 4.19 0.02 -0.93 -0.83 113.55 117.33 3dzk h SER 193 Ca 0.03 -0.46 0.03 0.00 -0.84 0.00 0.00 61.79 60.54 3dzk h SER 193 Cb 0.89 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 63.11 3dzk h SER 193 CO 0.07 1.26 -0.18 -0.09 -1.14 0.00 0.00 176.83 176.76 3dzk h ARG 194 N 0.76 -0.29 -0.97 3.45 2.43 -1.33 -0.65 114.38 117.79 3dzk h ARG 194 Ca 0.06 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.26 3dzk h ARG 194 Cb 0.99 0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 30.56 3dzk h ARG 194 CO 0.10 -0.19 0.64 0.00 -1.51 0.00 0.00 179.97 179.00 3dzk h ARG 195 N -0.30 1.27 -0.18 0.20 3.08 -1.34 -1.09 114.38 116.02 3dzk h ARG 195 Ca 0.05 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 3dzk h ARG 195 Cb 0.37 -0.29 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3dzk h ARG 195 CO -0.17 0.85 0.07 0.35 -1.07 0.00 0.00 179.97 180.00 3dzk h PHE 196 N 1.31 0.28 -0.63 3.04 3.57 -0.94 -2.51 116.94 121.06 3dzk h PHE 196 Ca 0.35 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.82 3dzk h PHE 196 Cb -0.14 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.48 3dzk h PHE 196 CO 0.00 0.35 0.37 0.00 -2.23 0.00 0.00 178.31 176.79 3dzk h ALA 197 N 0.90 1.46 0.00 2.41 0.00 -0.87 -1.76 119.26 121.41 3dzk h ALA 197 Ca 0.06 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3dzk h ALA 197 Cb 0.19 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 3dzk h ALA 197 CO -0.00 0.46 -0.11 0.93 0.00 0.00 0.00 179.25 180.52 3dzk h GLU 198 N 0.87 0.00 0.00 0.00 5.08 -0.91 -2.42 114.58 117.19 3dzk h GLU 198 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3dzk h GLU 198 Cb -0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.23 3dzk h GLU 198 CO -0.04 0.11 -0.27 0.00 -1.00 0.00 0.00 179.01 177.81 3dzk n ALA 199 N -2.22 2.78 -1.75 3.43 0.00 -0.66 -4.76 120.51 117.33 3dzk n ALA 199 Ca -0.01 -0.19 -0.34 0.00 0.00 0.00 0.00 53.44 52.90 3dzk n ALA 199 Cb 0.27 -1.31 -0.01 0.00 0.00 0.00 0.00 19.45 18.40 3dzk n ALA 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dzk s ALA 200 N -3.05 2.78 0.20 0.00 0.00 -0.91 -4.61 121.76 116.16 3dzk s ALA 200 Ca 0.11 0.61 -0.10 0.00 0.00 0.00 0.00 51.96 52.58 3dzk s ALA 200 Cb 0.16 -3.28 -0.01 0.00 0.00 0.00 0.00 23.12 19.99 3dzk s ALA 200 CO 0.63 -0.59 0.36 0.00 0.00 0.00 0.00 175.76 176.17 3dzk n ASP 202 N -0.29 0.00 -4.62 0.00 8.00 -0.31 -4.12 116.55 115.20 3dzk n ASP 202 Ca -0.04 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.09 3dzk n ASP 202 Cb 0.63 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.63 3dzk n ASP 202 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3dzk s VAL 203 N 0.00 5.28 -0.10 2.53 1.01 -1.26 -0.17 120.40 127.69 3dzk s VAL 203 Ca 0.00 0.16 -0.01 0.00 0.00 0.00 0.00 61.98 62.13 3dzk s VAL 203 Cb 0.00 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 3dzk s VAL 203 CO 0.00 0.31 -0.06 -0.69 0.00 0.00 0.00 175.10 174.66 3dzk s VAL 204 N 1.34 3.77 0.11 2.92 1.01 -0.37 -4.61 120.40 124.58 3dzk s VAL 204 Ca 0.07 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.67 3dzk s VAL 204 Cb -0.15 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.61 3dzk s VAL 204 CO 0.07 0.56 0.01 -1.00 0.00 0.00 0.00 175.10 174.75 3dzk s HIS 205 N -0.39 2.98 -0.03 5.22 3.76 -0.92 -0.52 115.29 125.39 3dzk s HIS 205 Ca 0.06 -0.05 0.00 0.00 -0.15 0.00 0.00 55.06 54.92 3dzk s HIS 205 Cb -0.12 -1.50 0.03 0.00 1.11 0.00 0.00 32.58 32.09 3dzk s HIS 205 CO 0.02 0.49 0.01 0.54 -0.85 0.00 0.00 174.74 174.95 3dzk s VAL 206 N -1.44 0.10 -0.14 -0.90 0.11 0.09 -0.00 120.40 118.22 3dzk s VAL 206 Ca 0.27 0.12 -0.16 0.00 -2.93 0.00 0.00 61.98 59.28 3dzk s VAL 206 Cb -0.11 -0.21 -0.04 0.00 -1.53 0.00 0.00 36.38 34.49 3dzk s VAL 206 CO 0.19 0.12 0.40 -0.04 -3.33 0.00 0.00 175.10 172.45 3dzk s MET 207 N 1.01 4.29 0.12 1.54 -1.94 -0.62 -0.19 119.30 123.50 3dzk s MET 207 Ca -0.10 0.30 0.10 0.00 -1.71 0.00 0.00 55.69 54.28 3dzk s MET 207 Cb -0.13 -3.45 -0.04 0.00 2.01 0.00 0.00 34.83 33.22 3dzk s MET 207 CO -0.02 0.16 -0.26 -0.51 -0.01 0.00 0.00 175.02 174.38 3dzk s LEU 208 N 0.67 2.31 -0.65 -0.03 1.43 -0.46 -1.51 118.68 120.44 3dzk s LEU 208 Ca 0.22 -0.73 -0.24 0.00 -1.03 0.00 0.00 54.13 52.36 3dzk s LEU 208 Cb -0.14 -1.17 0.06 0.00 0.03 0.00 0.00 46.19 44.97 3dzk s LEU 208 CO 0.08 0.16 1.00 -0.62 0.23 0.00 0.00 176.35 177.21 3dzk s ASP 209 N -1.98 6.21 0.00 2.29 -1.08 -1.24 -0.84 116.67 120.03 3dzk s ASP 209 Ca 0.13 -0.78 0.17 0.00 -0.52 0.00 0.00 52.55 51.55 3dzk s ASP 209 Cb -0.10 -2.44 0.95 0.00 -1.46 0.00 0.00 42.92 39.87 3dzk s ASP 209 CO 0.05 -1.45 1.45 0.61 0.52 0.00 0.00 175.17 176.35 3dzk n GLY 210 N 5.29 -0.65 0.20 2.66 0.00 0.51 -2.55 105.19 110.66 3dzk n GLY 210 Ca -0.02 -0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.01 3dzk n GLY 210 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3dzk n SER 211 N -1.11 1.38 -4.83 1.61 3.41 -1.26 -4.69 113.62 108.13 3dzk n SER 211 Ca 0.11 -1.17 -0.32 0.00 -0.26 0.00 0.00 58.87 57.23 3dzk n SER 211 Cb 0.09 0.75 -0.03 0.00 -0.26 0.00 0.00 64.21 64.75 3dzk n SER 211 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3dzk s ARG 212 N -2.79 3.88 0.54 4.33 0.52 -1.06 -4.97 118.95 119.41 3dzk s ARG 212 Ca 0.13 1.03 0.33 0.00 -0.52 0.00 0.00 55.73 56.70 3dzk s ARG 212 Cb 0.17 -2.12 1.31 0.00 0.52 0.00 0.00 34.95 34.83 3dzk s ARG 212 CO 0.74 -0.33 1.97 0.66 0.02 0.00 0.00 175.30 178.36 3dzk h SER 213 N 1.00 0.00 -4.36 0.23 4.64 -1.92 -3.30 113.55 109.84 3dzk h SER 213 Ca -0.47 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.21 3dzk h SER 213 Cb 1.19 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.87 3dzk h SER 213 CO 0.61 0.01 -0.63 -0.54 -0.87 0.00 0.00 176.83 175.41 3dzk s LYS 214 N -3.66 1.96 0.16 4.77 1.02 -1.26 -4.99 119.74 117.74 3dzk s LYS 214 Ca 0.01 -2.61 -0.16 0.00 0.02 0.00 0.00 55.97 53.23 3dzk s LYS 214 Cb 0.09 -3.30 0.09 0.00 -0.52 0.00 0.00 37.83 34.18 3dzk s LYS 214 CO 0.55 -1.11 1.72 0.82 -0.92 0.00 0.00 175.35 176.42 3dzk h ILE 215 N 5.50 0.80 -3.57 2.17 2.04 -1.79 -3.33 117.51 119.34 3dzk h ILE 215 Ca -0.08 -0.06 -0.63 0.00 1.00 0.00 0.00 64.86 65.09 3dzk h ILE 215 Cb 0.89 0.60 -0.18 0.00 -0.74 0.00 0.00 36.82 37.39 3dzk h ILE 215 CO 0.69 0.03 -0.56 0.12 0.00 0.00 0.00 178.15 178.43 3dzk s PHE 216 N -6.17 3.21 -0.25 1.37 5.36 -1.26 -4.32 117.98 115.92 3dzk s PHE 216 Ca -0.13 -0.03 -0.00 0.00 -0.96 0.00 0.00 56.93 55.80 3dzk s PHE 216 Cb 0.13 -2.22 0.04 0.00 -0.34 0.00 0.00 43.02 40.62 3dzk s PHE 216 CO 0.71 -0.07 -0.08 0.34 -1.46 0.00 0.00 175.22 174.66 3dzk s ASP 217 N 1.13 4.27 0.54 6.13 -1.08 -1.25 -4.85 116.67 121.54 3dzk s ASP 217 Ca 0.06 -1.00 0.36 0.00 -0.52 0.00 0.00 52.55 51.44 3dzk s ASP 217 Cb -0.14 -1.62 1.76 0.00 -1.46 0.00 0.00 42.92 41.46 3dzk s ASP 217 CO 0.04 -0.14 2.08 0.11 0.52 0.00 0.00 175.17 177.78 3dzk h LYS 218 N 7.95 0.00 0.00 4.34 1.57 -1.95 -2.33 116.57 126.15 3dzk h LYS 218 Ca -0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 3dzk h LYS 218 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.40 3dzk h LYS 218 CO 0.55 0.00 -0.47 -0.25 -0.57 0.00 0.00 179.45 178.71 3dzk n ASP 219 N -2.87 0.48 -4.47 0.86 10.43 -1.26 -2.79 116.55 116.93 3dzk n ASP 219 Ca -0.01 -0.14 -0.29 0.00 2.57 0.00 0.00 54.79 56.92 3dzk n ASP 219 Cb 0.16 0.18 0.20 0.00 1.84 0.00 0.00 41.12 43.50 3dzk n ASP 219 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 3dzk s SER 220 N -3.14 2.04 0.16 -2.24 1.04 -0.88 -4.72 113.70 105.97 3dzk s SER 220 Ca 0.11 1.06 -0.12 0.00 0.48 0.00 0.00 55.95 57.47 3dzk s SER 220 Cb 0.17 -1.63 0.05 0.00 0.10 0.00 0.00 66.02 64.71 3dzk s SER 220 CO 0.69 -3.48 1.68 0.74 0.98 0.00 0.00 173.24 173.85 3dzk h THR 221 N -2.13 1.24 -0.06 2.02 2.02 -1.92 0.28 112.91 114.36 3dzk h THR 221 Ca -0.53 -0.85 0.02 0.00 0.77 0.00 0.00 66.41 65.82 3dzk h THR 221 Cb 1.33 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 68.45 3dzk h THR 221 CO 0.52 0.31 -0.08 0.15 0.37 0.00 0.00 175.52 176.80 3dzk h PHE 222 N 0.78 -0.19 0.00 3.16 3.57 -1.90 -0.63 116.94 121.73 3dzk h PHE 222 Ca 0.18 0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.54 3dzk h PHE 222 Cb 0.32 0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 3dzk h PHE 222 CO 0.02 -0.12 -0.68 0.78 -2.23 0.00 0.00 178.31 176.08 3dzk h GLY 223 N -0.11 0.00 0.41 2.40 0.00 -1.63 -0.62 103.07 103.52 3dzk h GLY 223 Ca 0.05 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.20 3dzk h GLY 223 CO -0.12 0.00 -1.87 -1.14 0.00 0.00 0.00 176.54 173.41 3dzk n SER 224 N -3.49 0.36 0.03 0.19 3.41 0.95 -4.56 113.62 110.50 3dzk n SER 224 Ca -0.00 0.16 -0.01 0.00 -0.26 0.00 0.00 58.87 58.76 3dzk n SER 224 Cb 0.73 0.91 -0.00 0.00 -0.26 0.00 0.00 64.21 65.59 3dzk n SER 224 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3dzk n VAL 225 N -2.68 1.10 -0.11 -3.33 0.31 -0.31 -4.75 118.33 108.57 3dzk n VAL 225 Ca -0.15 0.32 -0.10 0.00 -0.01 0.00 0.00 64.34 64.39 3dzk n VAL 225 Cb 0.87 -1.65 -0.02 0.00 -0.91 0.00 0.00 33.84 32.13 3dzk n VAL 225 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3dzk h GLU 226 N -0.10 0.54 -0.88 5.55 5.08 -1.01 -2.61 114.58 121.14 3dzk h GLU 226 Ca -0.01 -0.14 0.08 0.00 -1.00 0.00 0.00 59.36 58.29 3dzk h GLU 226 Cb 0.24 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.37 3dzk h GLU 226 CO -0.01 0.62 0.57 0.28 -1.00 0.00 0.00 179.01 179.48 3dzk h VAL 227 N 0.37 1.02 -0.01 3.13 2.07 -1.36 -1.42 116.25 120.06 3dzk h VAL 227 Ca 0.10 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.29 3dzk h VAL 227 Cb 0.34 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.10 3dzk h VAL 227 CO 0.01 0.17 -0.16 1.41 0.02 0.00 0.00 177.57 179.02 3dzk n HIS 228 N -4.50 0.00 0.23 1.57 8.25 -1.07 -3.94 115.22 115.76 3dzk n HIS 228 Ca 0.14 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.63 3dzk n HIS 228 Cb 0.24 -0.16 0.02 0.00 1.12 0.00 0.00 29.99 31.21 3dzk n HIS 228 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3dzk n ASN 229 N -0.84 1.44 -4.76 0.41 3.02 -0.57 -4.98 115.26 108.99 3dzk n ASN 229 Ca 0.14 -1.22 -0.41 0.00 -0.03 0.00 0.00 54.58 53.05 3dzk n ASN 229 Cb 0.30 0.02 -0.02 0.00 -0.61 0.00 0.00 39.78 39.48 3dzk n ASN 229 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3dzk s LEU 230 N -0.50 4.38 -0.40 3.41 1.43 -1.01 -3.50 118.68 122.50 3dzk s LEU 230 Ca 0.06 2.79 -0.16 0.00 -1.03 0.00 0.00 54.13 55.80 3dzk s LEU 230 Cb 0.05 -3.65 0.01 0.00 0.03 0.00 0.00 46.19 42.63 3dzk s LEU 230 CO 0.07 -0.69 0.37 -1.10 0.23 0.00 0.00 176.35 175.23 3dzk s GLN 231 N -1.37 3.18 0.60 1.70 -1.52 -1.26 -4.95 119.66 116.05 3dzk s GLN 231 Ca 0.54 -0.75 0.32 0.00 -1.95 0.00 0.00 55.36 53.52 3dzk s GLN 231 Cb -0.43 -3.93 1.91 0.00 -0.22 0.00 0.00 33.01 30.35 3dzk s GLN 231 CO 0.52 -0.73 2.27 -1.35 -0.25 0.00 0.00 175.29 175.75 3dzk h PRO 232 N 8.63 0.00 0.00 2.91 0.11 -1.85 0.39 132.00 142.19 3dzk h PRO 232 Ca -0.28 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.82 3dzk h PRO 232 Cb 1.12 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3dzk h PRO 232 CO 0.75 0.00 -0.09 0.93 -0.21 0.00 0.00 178.00 179.38 3dzk h GLU 233 N 0.00 0.00 0.00 1.05 3.07 -1.92 -3.33 114.58 113.45 3dzk h GLU 233 Ca -0.00 0.00 -0.18 0.00 -0.50 0.00 0.00 59.36 58.68 3dzk h GLU 233 Cb 0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.88 3dzk h GLU 233 CO 0.00 0.09 -1.67 1.63 -1.40 0.00 0.00 179.01 177.65 3dzk n LYS 234 N -4.16 1.75 -3.28 2.33 5.02 -0.06 -4.99 118.16 114.77 3dzk n LYS 234 Ca -0.03 0.02 -0.40 0.00 -2.02 0.00 0.00 58.31 55.88 3dzk n LYS 234 Cb 0.17 -1.25 -0.08 0.00 -0.02 0.00 0.00 35.03 33.85 3dzk n LYS 234 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3dzk s VAL 235 N -2.24 5.07 -0.08 -0.18 1.01 -0.13 -1.16 120.40 122.70 3dzk s VAL 235 Ca -0.09 0.48 -0.24 0.00 0.00 0.00 0.00 61.98 62.14 3dzk s VAL 235 Cb 0.03 -3.87 -0.29 0.00 0.00 0.00 0.00 36.38 32.26 3dzk s VAL 235 CO 0.36 -0.06 0.82 -0.61 0.00 0.00 0.00 175.10 175.60 3dzk h GLN 236 N 8.30 0.20 -3.52 2.72 4.15 -0.87 -3.44 115.11 122.65 3dzk h GLN 236 Ca -0.29 -0.34 -0.18 0.00 0.77 0.00 0.00 58.65 58.60 3dzk h GLN 236 Cb 1.14 0.13 -0.25 0.00 0.21 0.00 0.00 27.48 28.71 3dzk h GLN 236 CO 0.73 1.16 -0.58 0.99 -1.93 0.00 0.00 178.83 179.20 3dzk s THR 237 N -2.37 0.03 -0.21 2.39 2.01 -1.04 -1.52 115.64 114.93 3dzk s THR 237 Ca -0.16 -0.24 -0.05 0.00 0.31 0.00 0.00 61.69 61.55 3dzk s THR 237 Cb 0.00 -0.23 -0.02 0.00 0.01 0.00 0.00 72.50 72.26 3dzk s THR 237 CO 0.78 -0.13 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.35 3dzk s LEU 238 N -0.40 3.16 -0.23 4.42 2.96 -0.02 -1.24 118.68 127.33 3dzk s LEU 238 Ca -0.05 -0.26 -0.03 0.00 -0.22 0.00 0.00 54.13 53.57 3dzk s LEU 238 Cb -0.03 -1.81 0.00 0.00 0.50 0.00 0.00 46.19 44.86 3dzk s LEU 238 CO 0.00 0.03 -0.04 -0.70 -1.32 0.00 0.00 176.35 174.33 3dzk s GLU 239 N 1.18 3.20 -0.04 1.98 2.12 0.33 -1.44 118.70 126.03 3dzk s GLU 239 Ca 0.03 -0.74 -0.15 0.00 0.36 0.00 0.00 54.97 54.46 3dzk s GLU 239 Cb -0.14 -3.02 -0.05 0.00 0.26 0.00 0.00 34.13 31.17 3dzk s GLU 239 CO 0.01 -0.27 0.42 0.00 -0.54 0.00 0.00 175.26 174.87 3dzk s ALA 240 N 1.44 3.64 -0.36 6.30 0.00 -0.25 -0.73 121.76 131.80 3dzk s ALA 240 Ca 0.04 -0.23 -0.05 0.00 0.00 0.00 0.00 51.96 51.72 3dzk s ALA 240 Cb -0.15 -2.44 0.06 0.00 0.00 0.00 0.00 23.12 20.59 3dzk s ALA 240 CO -0.03 0.35 0.14 -1.58 0.00 0.00 0.00 175.76 174.63 3dzk s TRP 241 N -0.60 3.34 -0.46 0.00 0.51 0.74 -1.26 118.94 121.20 3dzk s TRP 241 Ca 0.24 -1.72 -0.26 0.00 -2.12 0.00 0.00 56.10 52.23 3dzk s TRP 241 Cb -0.16 -2.57 0.03 0.00 -0.81 0.00 0.00 33.47 29.95 3dzk s TRP 241 CO 0.12 -0.82 0.97 0.08 -0.51 0.00 0.00 176.95 176.80 3dzk s VAL 242 N 1.33 4.42 -0.32 4.03 1.01 -0.22 -1.35 120.40 129.29 3dzk s VAL 242 Ca 0.01 0.90 -0.24 0.00 0.00 0.00 0.00 61.98 62.65 3dzk s VAL 242 Cb -0.21 -4.46 0.00 0.00 0.00 0.00 0.00 36.38 31.71 3dzk s VAL 242 CO 0.01 -0.85 0.81 -0.63 0.00 0.00 0.00 175.10 174.44 3dzk s ILE 243 N 3.89 4.75 0.37 2.22 -1.09 -0.02 -0.68 121.20 130.64 3dzk s ILE 243 Ca 0.40 1.15 -0.26 0.00 -2.23 0.00 0.00 60.65 59.71 3dzk s ILE 243 Cb -0.10 -4.19 -0.09 0.00 -1.58 0.00 0.00 42.46 36.51 3dzk s ILE 243 CO 0.27 -0.32 1.13 -1.00 -1.23 0.00 0.00 174.94 173.79 3dzk s HIS 244 N 3.06 3.22 -0.01 3.97 3.76 -0.30 -0.36 115.29 128.63 3dzk s HIS 244 Ca 0.33 1.60 0.06 0.00 -0.15 0.00 0.00 55.06 56.90 3dzk s HIS 244 Cb -0.14 -3.32 -0.09 0.00 1.11 0.00 0.00 32.58 30.14 3dzk s HIS 244 CO 0.14 -1.03 0.12 0.41 -0.85 0.00 0.00 174.74 173.53 3dzk n GLY 245 N 0.69 -0.26 3.63 -2.22 0.00 -1.26 -4.64 105.19 101.14 3dzk n GLY 245 Ca 0.03 -0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 3dzk n GLY 245 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dzk s GLY 246 N -2.67 1.18 0.63 -0.02 0.00 -1.26 -4.97 107.32 100.20 3dzk s GLY 246 Ca -0.02 0.69 -0.18 0.00 0.00 0.00 0.00 44.72 45.20 3dzk s GLY 246 CO 0.23 3.19 1.27 -1.60 0.00 0.00 0.00 173.10 176.19 3dzk s ARG 247 N 4.82 2.71 5.58 2.90 3.52 -1.26 -4.81 118.95 132.40 3dzk s ARG 247 Ca 0.78 1.99 0.00 0.00 -0.13 0.00 0.00 55.73 58.37 3dzk s ARG 247 Cb -0.29 -1.88 0.00 0.00 -1.56 0.00 0.00 34.95 31.21 3dzk s ARG 247 CO 0.32 -1.46 0.00 0.39 -0.81 0.00 0.00 175.30 173.74 3dzk n GLU 248 N -1.78 0.00 -2.54 5.12 1.02 -1.26 -4.74 120.64 116.46 3dzk n GLU 248 Ca 0.15 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.88 3dzk n GLU 248 Cb 0.49 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.86 3dzk n GLU 248 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 3dzk s ASP 249 N -4.00 7.32 0.34 1.62 -4.77 -1.26 -4.94 116.67 110.98 3dzk s ASP 249 Ca 0.00 2.11 -0.10 0.00 -3.30 0.00 0.00 52.55 51.26 3dzk s ASP 249 Cb 0.00 -2.61 0.02 0.00 -1.09 0.00 0.00 42.92 39.24 3dzk s ASP 249 CO 0.00 -0.15 0.60 -0.55 0.70 0.00 0.00 175.17 175.78 3dzk s SER 250 N -0.46 0.35 1.05 2.11 0.15 -1.26 -5.08 113.70 110.57 3dzk s SER 250 Ca 0.47 -1.22 -0.13 0.00 0.70 0.00 0.00 55.95 55.77 3dzk s SER 250 Cb -0.29 0.72 0.22 0.00 -1.71 0.00 0.00 66.02 64.95 3dzk s SER 250 CO 0.36 -1.42 1.08 -0.13 1.20 0.00 0.00 173.24 174.33 3dzk s ARG 251 N -2.99 0.04 -1.00 5.44 3.00 -1.26 -4.96 118.95 117.21 3dzk s ARG 251 Ca 0.23 0.52 -0.20 0.00 0.00 0.00 0.00 55.73 56.27 3dzk s ARG 251 Cb -0.03 -1.69 0.10 0.00 0.00 0.00 0.00 34.95 33.33 3dzk s ARG 251 CO 0.14 -2.99 1.31 0.34 0.00 0.00 0.00 175.30 174.10 3dzk s ASP 252 N -3.31 6.61 0.09 0.23 2.15 -1.26 -4.86 116.67 116.32 3dzk s ASP 252 Ca 0.66 -1.88 0.15 0.00 0.43 0.00 0.00 52.55 51.91 3dzk s ASP 252 Cb -0.20 -2.48 0.64 0.00 -0.30 0.00 0.00 42.92 40.58 3dzk s ASP 252 CO 0.59 -1.23 1.46 0.18 -0.17 0.00 0.00 175.17 175.99 3dzk n LEU 253 N 7.56 0.20 0.01 -1.34 4.77 -1.26 -1.53 117.00 125.40 3dzk n LEU 253 Ca 0.30 0.56 0.05 0.00 -0.03 0.00 0.00 56.01 56.89 3dzk n LEU 253 Cb 0.49 -0.54 0.24 0.00 -2.33 0.00 0.00 43.42 41.28 3dzk n LEU 253 CO 0.59 -0.42 0.68 0.00 -1.33 0.00 0.00 177.39 176.90 3dzk n GLN 255 N -1.54 2.20 -2.07 0.00 1.13 -0.58 -4.62 117.38 111.90 3dzk n GLN 255 Ca 0.02 -1.80 -0.40 0.00 -1.94 0.00 0.00 57.00 52.88 3dzk n GLN 255 Cb 0.13 -1.47 -0.01 0.00 0.11 0.00 0.00 30.24 29.00 3dzk n GLN 255 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 3dzk s ASP 256 N -1.60 6.52 0.35 1.08 -1.08 -0.73 -4.81 116.67 116.39 3dzk s ASP 256 Ca 0.35 2.69 0.12 0.00 -0.52 0.00 0.00 52.55 55.19 3dzk s ASP 256 Cb 0.21 -2.64 0.92 0.00 -1.46 0.00 0.00 42.92 39.94 3dzk s ASP 256 CO 0.30 -0.71 1.77 -0.65 0.52 0.00 0.00 175.17 176.40 3dzk h PRO 257 N 3.01 0.56 0.00 4.34 0.11 -1.94 0.77 132.00 138.84 3dzk h PRO 257 Ca -0.49 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.46 3dzk h PRO 257 Cb 1.24 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 3dzk h PRO 257 CO 0.64 0.37 -0.57 1.79 -0.21 0.00 0.00 178.00 180.02 3dzk h THR 258 N 0.58 1.38 -0.40 -1.15 1.35 -1.90 -1.57 112.91 111.19 3dzk h THR 258 Ca 0.59 -1.99 -0.15 0.00 -0.55 0.00 0.00 66.41 64.31 3dzk h THR 258 Cb 1.19 2.08 -0.01 0.00 -1.73 0.00 0.00 68.15 69.68 3dzk h THR 258 CO -0.36 0.56 -0.34 0.40 -0.25 0.00 0.00 175.52 175.53 3dzk h ILE 259 N 0.00 1.27 -0.30 6.82 1.08 -1.21 -1.55 117.51 123.62 3dzk h ILE 259 Ca -0.01 -1.51 -0.04 0.00 -0.39 0.00 0.00 64.86 62.91 3dzk h ILE 259 Cb 1.04 1.33 -0.02 0.00 -3.07 0.00 0.00 36.82 36.10 3dzk h ILE 259 CO 0.07 0.51 0.01 0.11 -0.69 0.00 0.00 178.15 178.17 3dzk h LYS 260 N 0.77 0.46 -0.26 2.37 1.79 -1.09 0.22 116.57 120.83 3dzk h LYS 260 Ca 0.07 -0.09 -0.07 0.00 -2.18 0.00 0.00 60.65 58.39 3dzk h LYS 260 Cb 0.93 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.50 3dzk h LYS 260 CO 0.09 0.47 -0.10 1.49 -1.08 0.00 0.00 179.45 180.33 3dzk h GLU 261 N 0.44 0.52 -0.60 3.15 4.81 -1.02 -1.27 114.58 120.61 3dzk h GLU 261 Ca 0.10 -0.21 0.04 0.00 -0.13 0.00 0.00 59.36 59.15 3dzk h GLU 261 Cb 0.27 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.59 3dzk h GLU 261 CO 0.01 0.76 0.35 1.25 -0.73 0.00 0.00 179.01 180.64 3dzk h LEU 262 N 0.25 0.54 -0.35 1.64 5.85 -0.92 0.06 115.31 122.38 3dzk h LEU 262 Ca 0.06 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.85 3dzk h LEU 262 Cb 0.59 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.48 3dzk h LEU 262 CO 0.03 0.37 0.07 -0.08 -0.34 0.00 0.00 178.44 178.50 3dzk h GLU 263 N 0.67 0.19 -0.50 1.25 4.81 -0.81 -0.97 114.58 119.22 3dzk h GLU 263 Ca 0.26 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.47 3dzk h GLU 263 Cb 0.09 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 3dzk h GLU 263 CO -0.14 0.13 0.28 1.03 -0.73 0.00 0.00 179.01 179.58 3dzk h SER 264 N 0.20 0.62 -0.27 1.04 0.87 -0.55 0.04 113.55 115.49 3dzk h SER 264 Ca 0.17 -0.08 -0.03 0.00 -1.23 0.00 0.00 61.79 60.61 3dzk h SER 264 Cb 0.18 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 3dzk h SER 264 CO -0.21 0.53 0.05 0.40 -0.53 0.00 0.00 176.83 177.06 3dzk h ILE 265 N 0.66 1.23 -0.38 2.23 2.04 -0.65 -1.11 117.51 121.53 3dzk h ILE 265 Ca 0.18 -0.77 -0.08 0.00 1.00 0.00 0.00 64.86 65.18 3dzk h ILE 265 Cb 0.04 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 3dzk h ILE 265 CO -0.03 0.25 -0.08 0.40 0.00 0.00 0.00 178.15 178.69 3dzk h ILE 266 N 0.27 1.27 -0.88 -0.67 1.08 -1.07 -2.61 117.51 114.91 3dzk h ILE 266 Ca 0.08 -1.15 0.01 0.00 -0.39 0.00 0.00 64.86 63.41 3dzk h ILE 266 Cb 0.33 1.24 -0.05 0.00 -3.07 0.00 0.00 36.82 35.27 3dzk h ILE 266 CO 0.00 0.38 0.58 0.28 -0.69 0.00 0.00 178.15 178.71 3dzk h SER 267 N 0.53 0.99 0.62 1.72 0.02 -0.91 0.02 113.55 116.55 3dzk h SER 267 Ca 0.10 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 3dzk h SER 267 Cb 0.59 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.89 3dzk h SER 267 CO 0.04 0.71 0.00 0.29 -1.14 0.00 0.00 176.83 176.73 3dzk n LYS 268 N -4.49 0.02 -0.09 3.45 5.02 -0.43 -1.34 118.16 120.30 3dzk n LYS 268 Ca 0.10 0.23 0.11 0.00 -2.02 0.00 0.00 58.31 56.73 3dzk n LYS 268 Cb 0.03 -1.54 0.32 0.00 -0.02 0.00 0.00 35.03 33.82 3dzk n LYS 268 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3dzk n ARG 269 N -1.59 1.98 -2.88 1.97 1.74 -0.03 -4.94 116.66 112.91 3dzk n ARG 269 Ca 0.04 -1.46 -0.11 0.00 -0.77 0.00 0.00 57.85 55.55 3dzk n ARG 269 Cb 0.21 -1.44 0.03 0.00 -1.02 0.00 0.00 32.46 30.24 3dzk n ARG 269 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3dzk n ASN 270 N 0.70 -3.92 -4.19 0.55 3.02 -0.45 -4.74 115.26 106.22 3dzk n ASN 270 Ca 0.17 -0.21 -0.27 0.00 -0.03 0.00 0.00 54.58 54.24 3dzk n ASN 270 Cb 0.43 -2.60 -0.16 0.00 -0.61 0.00 0.00 39.78 36.84 3dzk n ASN 270 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3dzk s ILE 271 N -3.04 1.58 0.46 2.41 1.01 -1.06 -4.94 121.20 117.62 3dzk s ILE 271 Ca 0.23 -0.83 -0.21 0.00 0.00 0.00 0.00 60.65 59.85 3dzk s ILE 271 Cb -0.10 -1.33 -0.09 0.00 0.01 0.00 0.00 42.46 40.95 3dzk s ILE 271 CO 0.28 0.45 1.00 -1.10 0.00 0.00 0.00 174.94 175.58 3dzk s GLN 272 N -0.25 3.97 -0.04 2.79 -0.21 -0.57 -3.30 119.66 122.04 3dzk s GLN 272 Ca 0.02 1.27 0.06 0.00 0.02 0.00 0.00 55.36 56.73 3dzk s GLN 272 Cb -0.10 -2.13 -0.01 0.00 1.00 0.00 0.00 33.01 31.77 3dzk s GLN 272 CO 0.01 -0.28 -0.22 0.12 -2.12 0.00 0.00 175.29 172.81 3dzk s PHE 273 N -2.06 2.04 0.06 0.91 5.36 -1.26 -0.84 117.98 122.19 3dzk s PHE 273 Ca 0.65 -0.52 0.05 0.00 -0.96 0.00 0.00 56.93 56.15 3dzk s PHE 273 Cb -0.13 -1.34 -0.03 0.00 -0.34 0.00 0.00 43.02 41.18 3dzk s PHE 273 CO 0.17 -0.13 -0.13 0.45 -1.46 0.00 0.00 175.22 174.12 3dzk s SER 274 N -0.24 1.56 0.02 6.13 0.15 -0.52 -4.98 113.70 115.82 3dzk s SER 274 Ca 0.01 -0.55 0.01 0.00 0.70 0.00 0.00 55.95 56.11 3dzk s SER 274 Cb -0.11 -0.06 -0.02 0.00 -1.71 0.00 0.00 66.02 64.13 3dzk s SER 274 CO 0.01 -0.06 -0.04 0.00 1.20 0.00 0.00 173.24 174.36 3dzk s LYS 276 N -1.13 0.15 0.12 0.00 1.02 -0.39 -4.96 119.74 114.54 3dzk s LYS 276 Ca -0.10 0.22 -0.26 0.00 0.02 0.00 0.00 55.97 55.86 3dzk s LYS 276 Cb -0.08 0.03 -0.07 0.00 -0.52 0.00 0.00 37.83 37.20 3dzk s LYS 276 CO -0.00 -0.05 0.79 -0.80 -0.92 0.00 0.00 175.35 174.37 3dzk s ASN 277 N 0.27 7.33 -0.51 2.83 0.01 -1.26 -1.06 114.94 122.56 3dzk s ASN 277 Ca -0.02 1.59 -0.05 0.00 -0.71 0.00 0.00 52.86 53.67 3dzk s ASN 277 Cb -0.03 -2.50 0.13 0.00 0.41 0.00 0.00 41.25 39.27 3dzk s ASN 277 CO -0.01 0.12 0.33 -0.63 -1.51 0.00 0.00 177.10 175.40 3dzk s ILE 278 N -0.65 3.72 0.21 0.60 1.01 0.14 -4.90 121.20 121.34 3dzk s ILE 278 Ca 0.38 -2.30 -0.01 0.00 0.00 0.00 0.00 60.65 58.71 3dzk s ILE 278 Cb -0.22 -3.48 -0.02 0.00 0.01 0.00 0.00 42.46 38.75 3dzk s ILE 278 CO 0.25 -0.78 1.56 1.88 0.00 0.00 0.00 174.94 177.85 3dzk h TYR 279 N 7.80 0.65 -2.91 3.97 0.05 -1.92 -0.80 116.97 123.81 3dzk h TYR 279 Ca -0.10 -0.21 -0.59 0.00 0.05 0.00 0.00 58.73 57.88 3dzk h TYR 279 Cb 1.02 -0.13 -0.40 0.00 1.01 0.00 0.00 36.73 38.23 3dzk h TYR 279 CO 0.64 0.90 -0.77 1.03 -1.05 0.00 0.00 178.16 178.91 3dzk s ARG 280 N -4.12 0.89 0.50 4.88 0.52 -1.26 -4.60 118.95 115.76 3dzk s ARG 280 Ca -0.07 -1.52 0.16 0.00 -0.52 0.00 0.00 55.73 53.78 3dzk s ARG 280 Cb 0.12 -1.91 1.21 0.00 0.52 0.00 0.00 34.95 34.90 3dzk s ARG 280 CO 0.83 -1.12 2.10 -1.00 0.02 0.00 0.00 175.30 176.13 3dzk h PRO 281 N 7.23 0.10 -0.42 3.54 0.13 -1.82 -1.33 132.00 139.43 3dzk h PRO 281 Ca -0.03 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 3dzk h PRO 281 Cb 0.96 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.05 3dzk h PRO 281 CO 0.42 0.07 0.27 0.38 -0.23 0.00 0.00 178.00 178.91 3dzk h ASP 282 N 0.11 0.48 -0.56 1.44 2.03 -1.97 -0.95 116.42 117.00 3dzk h ASP 282 Ca 0.07 -0.02 -0.07 0.00 -0.73 0.00 0.00 57.03 56.28 3dzk h ASP 282 Cb 0.17 -0.12 -0.02 0.00 -0.83 0.00 0.00 39.33 38.53 3dzk h ASP 282 CO -0.01 0.35 0.06 0.50 -1.03 0.00 0.00 179.24 179.12 3dzk h LYS 283 N 0.56 0.94 -0.01 4.15 3.64 -1.75 -2.31 116.57 121.79 3dzk h LYS 283 Ca 0.15 -0.27 0.03 0.00 -1.27 0.00 0.00 60.65 59.30 3dzk h LYS 283 Cb -0.06 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.62 3dzk h LYS 283 CO -0.03 0.92 -0.23 0.35 -2.27 0.00 0.00 179.45 178.18 3dzk h PHE 284 N 0.83 -0.62 -0.28 1.91 3.57 -1.06 0.13 116.94 121.42 3dzk h PHE 284 Ca 0.17 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.64 3dzk h PHE 284 Cb 0.45 0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.45 3dzk h PHE 284 CO 0.03 -0.32 -0.03 -0.07 -2.23 0.00 0.00 178.31 175.69 3dzk h LEU 285 N -0.36 0.40 -0.70 0.59 3.38 -1.05 -0.20 115.31 117.37 3dzk h LEU 285 Ca 0.06 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 3dzk h LEU 285 Cb 0.44 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3dzk h LEU 285 CO -0.21 0.49 -0.25 -0.61 0.09 0.00 0.00 178.44 177.95 3dzk h GLN 286 N 0.41 0.74 -0.19 1.13 5.75 -0.89 -2.08 115.11 119.98 3dzk h GLN 286 Ca 0.09 -0.31 -0.11 0.00 -0.15 0.00 0.00 58.65 58.17 3dzk h GLN 286 Cb 0.32 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.83 3dzk h GLN 286 CO 0.01 0.91 -0.38 0.00 -2.65 0.00 0.00 178.83 176.73 3dzk h VAL 288 N 0.35 1.22 -0.41 0.00 2.07 -0.86 -1.42 116.25 117.20 3dzk h VAL 288 Ca 0.04 -0.76 -0.13 0.00 0.82 0.00 0.00 66.70 66.66 3dzk h VAL 288 Cb 0.82 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 3dzk h VAL 288 CO 0.07 0.26 -0.27 0.11 0.02 0.00 0.00 177.57 177.75 3dzk h LYS 289 N 0.44 0.88 -2.25 1.57 1.57 -1.08 -3.38 116.57 114.32 3dzk h LYS 289 Ca 0.12 -0.40 -0.58 0.00 -1.87 0.00 0.00 60.65 57.92 3dzk h LYS 289 Cb 0.30 -0.02 -0.39 0.00 0.08 0.00 0.00 32.23 32.20 3dzk h LYS 289 CO 0.00 1.04 -0.98 0.09 -0.57 0.00 0.00 179.45 179.03 3dzk n ASN 290 N -4.09 0.23 -4.81 0.86 3.02 0.21 -5.10 115.26 105.59 3dzk n ASN 290 Ca -0.01 -2.61 -0.30 0.00 -0.03 0.00 0.00 54.58 51.64 3dzk n ASN 290 Cb 0.48 -0.61 0.10 0.00 -0.61 0.00 0.00 39.78 39.14 3dzk n ASN 290 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3dzk s PRO 291 N -0.68 1.90 -0.87 3.52 0.04 -0.54 -3.21 135.00 135.17 3dzk s PRO 291 Ca 0.34 0.53 0.00 0.00 0.04 0.00 0.00 61.00 61.91 3dzk s PRO 291 Cb 0.09 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.73 3dzk s PRO 291 CO -0.15 -1.72 0.00 -1.91 0.04 0.00 0.00 177.00 173.26 3dzk n GLU 292 N -3.48 -1.42 0.11 4.56 4.07 -1.26 -4.80 120.64 118.41 3dzk n GLU 292 Ca 0.07 0.55 -0.04 0.00 -0.06 0.00 0.00 57.16 57.67 3dzk n GLU 292 Cb 0.57 -4.58 -0.02 0.00 -0.06 0.00 0.00 31.44 27.35 3dzk n GLU 292 CO 0.00 0.00 0.00 0.22 -0.06 0.00 0.00 177.13 177.29 3dzk h ASP 293 N 0.00 -0.24 0.00 4.31 1.82 -1.92 -3.49 116.42 116.89 3dzk h ASP 293 Ca -0.17 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.48 3dzk h ASP 293 Cb 0.66 0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.73 3dzk h ASP 293 CO 0.25 -0.16 0.00 -1.54 -1.61 0.00 0.00 179.24 176.18 3dzk n SER 294 N -2.86 0.00 0.00 2.28 3.41 -1.26 -4.98 113.62 110.20 3dzk n SER 294 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 3dzk n SER 294 Cb 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 3dzk n SER 294 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3dzk n SER 295 N 0.00 0.00 -0.30 4.04 3.41 -1.26 -5.08 113.62 114.43 3dzk n SER 295 Ca 0.00 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.76 3dzk n SER 295 Cb 0.00 -2.07 0.68 0.00 -0.26 0.00 0.00 64.21 62.56 3dzk n SER 295 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88