#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zae h LYS 13 N 0.00 0.37 -0.01 1.64 1.79 -2.04 -1.69 116.57 116.62 2zae h LYS 13 Ca 0.00 -0.18 -0.01 0.00 -2.18 0.00 0.00 60.65 58.28 2zae h LYS 13 Cb 0.00 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2zae h LYS 13 CO 0.00 0.73 -0.02 1.49 -1.08 0.00 0.00 179.45 180.57 2zae h GLU 14 N 0.31 0.04 -0.70 3.15 4.81 -2.05 -0.06 114.58 120.08 2zae h GLU 14 Ca 0.03 -0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.33 2zae h GLU 14 Cb 0.86 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 30.18 2zae h GLU 14 CO 0.07 0.56 0.34 -0.22 -0.73 0.00 0.00 179.01 179.03 2zae h LYS 15 N -0.48 0.57 -0.22 1.92 3.11 -1.99 0.91 116.57 120.38 2zae h LYS 15 Ca 0.00 -0.03 -0.07 0.00 -2.81 0.00 0.00 60.65 57.73 2zae h LYS 15 Cb 0.55 -0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 31.65 2zae h LYS 15 CO 0.00 0.38 -0.14 0.87 -2.81 0.00 0.00 179.45 177.75 2zae h LYS 16 N 0.59 0.49 -0.23 1.90 1.57 -1.31 -1.87 116.57 117.71 2zae h LYS 16 Ca 0.34 -0.23 0.06 0.00 -1.87 0.00 0.00 60.65 58.95 2zae h LYS 16 Cb 0.36 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.60 2zae h LYS 16 CO -0.27 0.79 -0.15 -0.22 -0.57 0.00 0.00 179.45 179.03 2zae h LYS 17 N 0.19 -0.13 -0.37 3.15 3.11 -0.60 -1.91 116.57 120.01 2zae h LYS 17 Ca 0.05 0.01 0.05 0.00 -2.81 0.00 0.00 60.65 57.94 2zae h LYS 17 Cb 0.66 0.03 -0.04 0.00 -1.00 0.00 0.00 32.23 31.88 2zae h LYS 17 CO 0.04 -0.09 0.12 0.82 -2.81 0.00 0.00 179.45 177.53 2zae h ILE 18 N -0.14 0.87 -0.61 2.00 1.08 -0.86 -1.06 117.51 118.79 2zae h ILE 18 Ca 0.13 -0.09 0.11 0.00 -0.39 0.00 0.00 64.86 64.62 2zae h ILE 18 Cb 0.33 0.58 -0.08 0.00 -3.07 0.00 0.00 36.82 34.59 2zae h ILE 18 CO -0.32 0.05 0.17 0.00 -0.69 0.00 0.00 178.15 177.36 2zae h ALA 19 N 1.25 0.75 0.00 1.87 0.00 -0.99 0.19 119.26 122.33 2zae h ALA 19 Ca 0.17 0.12 -0.16 0.00 0.00 0.00 0.00 54.91 55.04 2zae h ALA 19 Cb 0.17 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2zae h ALA 19 CO -0.19 -0.27 -0.78 -0.84 0.00 0.00 0.00 179.25 177.17 2zae h ILE 20 N 0.31 1.49 -0.96 0.00 -0.00 -0.95 -1.32 117.51 116.07 2zae h ILE 20 Ca 0.32 -2.72 0.00 0.00 -0.00 0.00 0.00 64.86 62.46 2zae h ILE 20 Cb 0.45 2.49 -0.05 0.00 -0.00 0.00 0.00 36.82 39.72 2zae h ILE 20 CO -0.38 0.76 0.61 -0.33 -0.00 0.00 0.00 178.15 178.81 2zae h GLU 21 N 0.00 1.28 0.07 0.16 5.08 0.11 0.12 114.58 121.40 2zae h GLU 21 Ca -0.01 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2zae h GLU 21 Cb 1.43 -0.28 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2zae h GLU 21 CO 0.10 0.87 -0.04 0.00 -1.00 0.00 0.00 179.01 178.94 2zae h ARG 22 N 1.31 -0.10 -0.52 2.33 3.08 -0.52 -0.11 114.38 119.86 2zae h ARG 22 Ca 0.35 0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.49 2zae h ARG 22 Cb -0.11 0.02 -0.07 0.00 0.08 0.00 0.00 29.97 29.90 2zae h ARG 22 CO -0.07 0.09 0.13 0.82 -1.07 0.00 0.00 179.97 179.87 2zae h ILE 23 N -0.27 0.74 -0.43 2.04 2.04 -1.14 -0.01 117.51 120.49 2zae h ILE 23 Ca -0.01 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.76 2zae h ILE 23 Cb 0.23 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 2zae h ILE 23 CO 0.02 0.05 0.28 -0.78 0.00 0.00 0.00 178.15 177.72 2zae h ASP 24 N 0.28 0.49 0.14 1.72 3.58 -0.63 -1.96 116.42 120.04 2zae h ASP 24 Ca 0.26 -0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.70 2zae h ASP 24 Cb 0.33 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.25 2zae h ASP 24 CO -0.31 0.35 -0.11 0.74 -2.88 0.00 0.00 179.24 177.03 2zae h THR 25 N 0.58 0.76 -0.60 2.25 2.02 -0.66 -1.15 112.91 116.10 2zae h THR 25 Ca 0.16 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.34 2zae h THR 25 Cb -0.07 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 2zae h THR 25 CO -0.03 0.00 0.39 -0.07 0.37 0.00 0.00 175.52 176.17 2zae h LEU 26 N -0.26 0.71 -0.35 2.58 3.38 -0.81 0.48 115.31 121.04 2zae h LEU 26 Ca -0.00 -0.03 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 2zae h LEU 26 Cb 0.23 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2zae h LEU 26 CO -0.01 0.53 -0.35 -0.26 0.09 0.00 0.00 178.44 178.44 2zae h PHE 27 N 0.82 1.02 -0.65 1.13 0.04 -1.37 0.41 116.94 118.34 2zae h PHE 27 Ca 0.22 -0.31 0.05 0.00 2.80 0.00 0.00 57.97 60.74 2zae h PHE 27 Cb -0.07 -0.21 -0.05 0.00 2.20 0.00 0.00 35.95 37.82 2zae h PHE 27 CO -0.03 1.10 0.36 1.15 -0.60 0.00 0.00 178.31 180.30 2zae h THR 28 N 0.64 0.98 -0.33 -1.55 2.02 -1.01 -1.24 112.91 112.42 2zae h THR 28 Ca 0.06 -0.23 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 2zae h THR 28 Cb 0.93 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 2zae h THR 28 CO 0.09 0.12 0.13 -0.07 0.37 0.00 0.00 175.52 176.16 2zae h LEU 29 N 0.68 0.46 -0.90 2.58 3.38 -0.70 -2.42 115.31 118.39 2zae h LEU 29 Ca 0.29 -0.17 0.11 0.00 0.09 0.00 0.00 57.88 58.20 2zae h LEU 29 Cb 0.16 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.71 2zae h LEU 29 CO -0.17 0.50 0.53 0.00 0.09 0.00 0.00 178.44 179.39 2zae h ALA 30 N 0.98 1.33 -0.59 1.53 0.00 -0.67 -0.47 119.26 121.37 2zae h ALA 30 Ca 0.11 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 2zae h ALA 30 Cb 0.18 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2zae h ALA 30 CO -0.01 0.12 0.04 1.49 0.00 0.00 0.00 179.25 180.89 2zae h GLU 31 N 0.84 1.00 -0.23 0.00 4.81 -1.01 -1.90 114.58 118.09 2zae h GLU 31 Ca 0.45 -0.28 -0.05 0.00 -0.13 0.00 0.00 59.36 59.35 2zae h GLU 31 Cb 0.47 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 2zae h GLU 31 CO -0.28 0.95 -0.04 0.00 -0.73 0.00 0.00 179.01 178.92 2zae h ARG 32 N 0.93 0.44 -0.00 1.92 2.47 -0.81 -3.34 114.38 115.99 2zae h ARG 32 Ca 0.18 -0.16 0.00 0.00 -1.26 0.00 0.00 59.98 58.74 2zae h ARG 32 Cb 0.48 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.77 2zae h ARG 32 CO 0.02 0.65 -0.42 1.33 0.56 0.00 0.00 179.97 182.11 2zae n VAL 33 N -4.60 0.00 -0.24 2.04 0.24 -0.28 -4.52 118.33 110.97 2zae n VAL 33 Ca -0.04 -0.03 -0.01 0.00 -2.04 0.00 0.00 64.34 62.21 2zae n VAL 33 Cb 0.28 0.27 0.19 0.00 -1.47 0.00 0.00 33.84 33.10 2zae n VAL 33 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2zae h ALA 34 N 3.19 1.34 0.00 2.33 0.00 -1.46 0.37 119.26 125.02 2zae h ALA 34 Ca 0.00 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2zae h ALA 34 Cb 0.50 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2zae h ALA 34 CO 0.00 0.56 -0.17 0.07 0.00 0.00 0.00 179.25 179.70 2zae h ARG 35 N 1.07 0.00 0.00 0.00 0.11 -1.84 -2.97 114.38 110.74 2zae h ARG 35 Ca 0.28 0.00 -0.37 0.00 0.10 0.00 0.00 59.98 59.98 2zae h ARG 35 Cb -0.02 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 30.99 2zae h ARG 35 CO -0.05 0.17 -2.42 0.66 0.10 0.00 0.00 179.97 178.44 2zae n TYR 36 N -3.25 0.00 -3.55 4.08 4.02 -0.50 -4.82 117.16 113.14 2zae n TYR 36 Ca 0.01 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.62 2zae n TYR 36 Cb 0.46 -0.97 -0.12 0.00 -0.02 0.00 0.00 39.34 38.69 2zae n TYR 36 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2zae s SER 37 N -6.26 2.85 0.52 7.72 0.15 0.12 -4.99 113.70 113.81 2zae s SER 37 Ca -0.30 -2.70 0.16 0.00 0.70 0.00 0.00 55.95 53.81 2zae s SER 37 Cb 0.08 -0.68 1.27 0.00 -1.71 0.00 0.00 66.02 64.97 2zae s SER 37 CO 0.62 -0.24 2.14 -0.65 1.20 0.00 0.00 173.24 176.31 2zae h PRO 38 N 6.40 0.00 -0.22 5.44 0.11 -1.73 -1.62 132.00 140.37 2zae h PRO 38 Ca 0.11 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.05 2zae h PRO 38 Cb 0.92 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 2zae h PRO 38 CO 0.39 0.01 -0.54 -0.44 -0.21 0.00 0.00 178.00 177.22 2zae h ASP 39 N 0.00 0.73 -0.31 -2.05 3.32 -1.94 -1.88 116.42 114.31 2zae h ASP 39 Ca -0.00 -0.39 -0.04 0.00 0.02 0.00 0.00 57.03 56.62 2zae h ASP 39 Cb 0.02 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 2zae h ASP 39 CO 0.00 1.13 0.02 0.25 -1.72 0.00 0.00 179.24 178.92 2zae h LEU 40 N 0.51 0.51 -0.88 1.55 5.85 -1.70 -2.16 115.31 118.99 2zae h LEU 40 Ca 0.01 -0.29 0.07 0.00 0.84 0.00 0.00 57.88 58.51 2zae h LEU 40 Cb 1.10 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.93 2zae h LEU 40 CO 0.11 0.68 0.55 0.00 -0.34 0.00 0.00 178.44 179.44 2zae h ALA 41 N 0.85 1.22 -0.54 1.25 0.00 -1.32 -1.44 119.26 119.28 2zae h ALA 41 Ca 0.09 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.01 2zae h ALA 41 Cb 0.41 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 2zae h ALA 41 CO 0.01 0.28 0.34 -0.22 0.00 0.00 0.00 179.25 179.67 2zae h LYS 42 N 0.99 0.66 -0.64 0.00 1.63 -1.23 -0.93 116.57 117.06 2zae h LYS 42 Ca 0.39 -0.04 0.04 0.00 -0.85 0.00 0.00 60.65 60.19 2zae h LYS 42 Cb 0.20 -0.15 -0.05 0.00 -0.60 0.00 0.00 32.23 31.63 2zae h LYS 42 CO -0.18 0.44 0.37 -0.09 -3.45 0.00 0.00 179.45 176.54 2zae h ARG 43 N 0.68 0.70 -0.72 1.90 9.65 -0.77 0.18 114.38 126.00 2zae h ARG 43 Ca 0.21 -0.04 -0.05 0.00 -1.10 0.00 0.00 59.98 59.00 2zae h ARG 43 Cb -0.02 -0.16 -0.03 0.00 -1.39 0.00 0.00 29.97 28.37 2zae h ARG 43 CO -0.07 0.46 0.25 1.88 2.80 0.00 0.00 179.97 185.29 2zae h TYR 44 N 0.72 1.14 0.07 2.20 0.05 -0.81 0.53 116.97 120.86 2zae h TYR 44 Ca 0.27 -0.10 -0.00 0.00 0.05 0.00 0.00 58.73 58.94 2zae h TYR 44 Cb 0.09 -0.33 0.00 0.00 1.01 0.00 0.00 36.73 37.50 2zae h TYR 44 CO -0.06 0.89 -0.03 0.28 -1.05 0.00 0.00 178.16 178.19 2zae h VAL 45 N 1.05 1.06 -1.00 -2.88 2.07 -0.85 0.23 116.25 115.94 2zae h VAL 45 Ca 0.24 -0.42 0.04 0.00 0.82 0.00 0.00 66.70 67.37 2zae h VAL 45 Cb 0.27 1.33 -0.06 0.00 -1.52 0.00 0.00 31.29 31.31 2zae h VAL 45 CO -0.01 0.10 0.65 -0.33 0.02 0.00 0.00 177.57 178.01 2zae h GLU 46 N -0.27 1.23 -0.22 1.57 5.08 -0.53 -1.99 114.58 119.45 2zae h GLU 46 Ca -0.01 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2zae h GLU 46 Cb 0.24 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2zae h GLU 46 CO 0.01 0.81 0.11 -0.07 -1.00 0.00 0.00 179.01 178.88 2zae h LEU 47 N 1.27 0.28 -0.99 1.33 3.38 -0.72 -2.10 115.31 117.76 2zae h LEU 47 Ca 0.39 -0.11 0.09 0.00 0.09 0.00 0.00 57.88 58.35 2zae h LEU 47 Cb -0.01 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 40.59 2zae h LEU 47 CO -0.12 0.31 0.63 0.00 0.09 0.00 0.00 178.44 179.35 2zae h ALA 48 N 0.98 1.44 -0.36 1.53 0.00 -0.58 -1.77 119.26 120.50 2zae h ALA 48 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 2zae h ALA 48 Cb 0.10 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2zae h ALA 48 CO -0.01 0.31 -0.27 -0.07 0.00 0.00 0.00 179.25 179.21 2zae h LEU 49 N 1.06 0.78 -0.60 0.00 3.38 -1.23 -1.12 115.31 117.57 2zae h LEU 49 Ca 0.46 -0.30 0.05 0.00 0.09 0.00 0.00 57.88 58.18 2zae h LEU 49 Cb 0.34 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 2zae h LEU 49 CO -0.22 1.01 0.33 -0.33 0.09 0.00 0.00 178.44 179.31 2zae h GLU 50 N 0.65 0.60 -0.33 1.13 4.39 -0.90 -1.78 114.58 118.34 2zae h GLU 50 Ca 0.08 -0.04 -0.07 0.00 0.34 0.00 0.00 59.36 59.67 2zae h GLU 50 Cb 0.79 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 2zae h GLU 50 CO 0.07 0.40 -0.07 0.82 -1.16 0.00 0.00 179.01 179.07 2zae h ILE 51 N 0.62 1.28 -0.49 3.13 2.04 -1.07 -2.31 117.51 120.71 2zae h ILE 51 Ca 0.26 -1.11 0.09 0.00 1.00 0.00 0.00 64.86 65.11 2zae h ILE 51 Cb 0.15 1.32 -0.08 0.00 -0.74 0.00 0.00 36.82 37.47 2zae h ILE 51 CO -0.16 0.36 0.03 -0.61 0.00 0.00 0.00 178.15 177.76 2zae h GLN 52 N 0.41 0.14 -0.04 2.37 -0.00 -1.10 0.54 115.11 117.43 2zae h GLN 52 Ca 0.08 -0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 58.73 2zae h GLN 52 Cb 0.56 -0.03 -0.00 0.00 0.00 0.00 0.00 27.48 28.00 2zae h GLN 52 CO 0.03 0.09 0.02 0.87 0.00 0.00 0.00 178.83 179.84 2zae h LYS 53 N 0.14 0.06 -0.45 1.69 1.57 -1.11 -1.31 116.57 117.16 2zae h LYS 53 Ca 0.24 -0.01 -0.13 0.00 -1.87 0.00 0.00 60.65 58.88 2zae h LYS 53 Cb 0.36 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 2zae h LYS 53 CO -0.38 0.15 -0.24 0.87 -0.57 0.00 0.00 179.45 179.28 2zae h LYS 54 N -0.05 0.94 0.00 3.15 1.79 -1.10 -2.99 116.57 118.31 2zae h LYS 54 Ca 0.01 -0.41 -0.02 0.00 -2.18 0.00 0.00 60.65 58.06 2zae h LYS 54 Cb 0.11 -0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 30.73 2zae h LYS 54 CO -0.00 1.07 -0.14 0.00 -1.08 0.00 0.00 179.45 179.30 2zae h ALA 55 N 0.91 0.92 -3.19 3.86 0.00 -0.91 -3.48 119.26 117.37 2zae h ALA 55 Ca 0.10 -0.08 -0.24 0.00 0.00 0.00 0.00 54.91 54.69 2zae h ALA 55 Cb 0.81 -0.01 0.05 0.00 0.00 0.00 0.00 17.79 18.64 2zae h ALA 55 CO 0.07 0.11 -0.38 1.63 0.00 0.00 0.00 179.25 180.68 2zae n LYS 56 N -3.10 -3.52 -4.03 0.00 4.76 -0.52 -4.93 118.16 106.83 2zae n LYS 56 Ca 0.03 0.53 -0.22 0.00 -2.87 0.00 0.00 58.31 55.79 2zae n LYS 56 Cb 0.57 -4.62 -0.05 0.00 -1.84 0.00 0.00 35.03 29.09 2zae n LYS 56 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2zae s VAL 57 N -3.00 3.93 0.20 -0.18 -7.23 -1.06 -5.06 120.40 107.99 2zae s VAL 57 Ca 0.23 -1.47 -0.12 0.00 -1.81 0.00 0.00 61.98 58.82 2zae s VAL 57 Cb -0.10 -3.24 -0.07 0.00 0.56 0.00 0.00 36.38 33.53 2zae s VAL 57 CO 0.29 -0.28 0.56 -1.59 -0.31 0.00 0.00 175.10 173.77 2zae s LYS 58 N -3.88 3.89 0.02 4.82 -2.85 -1.26 -4.71 119.74 115.77 2zae s LYS 58 Ca 0.36 0.39 -0.30 0.00 -1.00 0.00 0.00 55.97 55.41 2zae s LYS 58 Cb -0.07 -2.76 -0.07 0.00 -2.06 0.00 0.00 37.83 32.87 2zae s LYS 58 CO 0.25 0.38 1.60 0.42 0.10 0.00 0.00 175.35 178.10 2zae s ILE 59 N -1.67 3.34 0.80 3.79 1.01 -1.26 -4.95 121.20 122.26 2zae s ILE 59 Ca 0.43 0.67 -0.14 0.00 0.00 0.00 0.00 60.65 61.62 2zae s ILE 59 Cb -0.13 -3.43 0.07 0.00 0.01 0.00 0.00 42.46 38.98 2zae s ILE 59 CO 0.20 -0.02 1.16 -0.81 0.00 0.00 0.00 174.94 175.47 2zae n PRO 60 N 6.02 0.22 -0.26 2.79 -0.04 -1.26 -4.56 135.00 137.90 2zae n PRO 60 Ca 0.16 0.15 0.15 0.00 -0.04 0.00 0.00 63.50 63.92 2zae n PRO 60 Cb 0.42 -2.40 0.43 0.00 -0.04 0.00 0.00 33.50 31.91 2zae n PRO 60 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 2zae h ARG 61 N -0.84 0.55 0.00 0.54 9.65 -2.00 -1.64 114.38 120.65 2zae h ARG 61 Ca -0.46 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.38 2zae h ARG 61 Cb 1.30 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 29.76 2zae h ARG 61 CO 0.46 0.37 0.00 1.57 2.80 0.00 0.00 179.97 185.16 2zae h LYS 62 N 0.57 0.00 0.00 0.20 2.10 -2.03 -3.26 116.57 114.15 2zae h LYS 62 Ca 0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.12 2zae h LYS 62 Cb 0.93 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.26 2zae h LYS 62 CO -0.21 0.00 -1.11 0.91 -2.00 0.00 0.00 179.45 177.03 2zae n TRP 63 N -2.64 0.00 0.30 0.07 5.03 -0.69 -4.74 117.44 114.77 2zae n TRP 63 Ca 0.02 0.00 0.17 0.00 3.03 0.00 0.00 57.50 60.72 2zae n TRP 63 Cb 0.30 -0.14 0.93 0.00 -1.03 0.00 0.00 31.31 31.37 2zae n TRP 63 CO 0.00 0.00 0.00 1.57 -0.03 0.00 0.00 177.69 179.23 2zae h LYS 64 N 0.00 0.00 -0.29 -0.99 2.10 -1.40 -0.87 116.57 115.12 2zae h LYS 64 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2zae h LYS 64 Cb 0.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.65 2zae h LYS 64 CO 0.00 0.04 0.00 0.54 -2.00 0.00 0.00 179.45 178.03 2zae n ARG 65 N -3.46 2.39 -0.47 0.07 1.74 -1.26 -4.61 116.66 111.06 2zae n ARG 65 Ca -0.02 -2.16 0.11 0.00 -0.77 0.00 0.00 57.85 55.01 2zae n ARG 65 Cb 0.15 -1.48 0.33 0.00 -1.02 0.00 0.00 32.46 30.44 2zae n ARG 65 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2zae n ARG 66 N 1.40 3.14 -3.93 5.56 5.12 -0.33 -4.90 116.66 122.73 2zae n ARG 66 Ca 0.17 -2.75 -0.10 0.00 -1.93 0.00 0.00 57.85 53.25 2zae n ARG 66 Cb 0.59 -1.69 -0.11 0.00 -1.16 0.00 0.00 32.46 30.08 2zae n ARG 66 CO 0.00 0.00 0.00 1.52 -1.93 0.00 0.00 177.63 177.22 2zae s TYR 67 N -1.35 0.14 -0.08 -1.55 -0.85 -1.26 0.19 117.35 112.60 2zae s TYR 67 Ca 0.49 -0.30 -0.30 0.00 -0.52 0.00 0.00 57.07 56.44 2zae s TYR 67 Cb 0.28 -0.11 -0.03 0.00 0.38 0.00 0.00 41.96 42.48 2zae s TYR 67 CO 0.29 -0.20 1.27 0.00 -1.52 0.00 0.00 175.55 175.39 2zae n LYS 69 N 5.70 0.05 -0.08 0.00 5.02 -1.26 -0.63 118.16 126.96 2zae n LYS 69 Ca 0.12 0.21 -0.07 0.00 -2.02 0.00 0.00 58.31 56.55 2zae n LYS 69 Cb 0.45 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.94 2zae n LYS 69 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2zae n ARG 70 N -1.46 0.46 0.00 1.97 0.63 -1.26 -4.71 116.66 112.29 2zae n ARG 70 Ca 0.05 0.24 0.12 0.00 -0.92 0.00 0.00 57.85 57.33 2zae n ARG 70 Cb 0.17 -1.36 0.23 0.00 0.45 0.00 0.00 32.46 31.95 2zae n ARG 70 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2zae n HIS 72 N -0.80 0.00 -2.23 0.00 8.25 0.20 -4.98 115.22 115.65 2zae n HIS 72 Ca 0.09 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.18 2zae n HIS 72 Cb 0.37 -1.95 -0.01 0.00 1.12 0.00 0.00 29.99 29.51 2zae n HIS 72 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2zae s THR 73 N -1.87 3.05 0.04 1.59 -1.32 -1.26 -4.57 115.64 111.30 2zae s THR 73 Ca 0.00 0.80 -0.30 0.00 -1.21 0.00 0.00 61.69 60.98 2zae s THR 73 Cb 0.00 -3.41 -0.06 0.00 -1.51 0.00 0.00 72.50 67.52 2zae s THR 73 CO 0.00 0.00 1.26 0.12 -2.21 0.00 0.00 174.62 173.79 2zae s PHE 74 N -1.51 3.28 -0.18 9.09 5.36 -1.26 -1.62 117.98 131.13 2zae s PHE 74 Ca 0.63 1.16 -0.14 0.00 -0.96 0.00 0.00 56.93 57.62 2zae s PHE 74 Cb -0.30 -3.50 -0.04 0.00 -0.34 0.00 0.00 43.02 38.84 2zae s PHE 74 CO 0.36 -1.64 0.30 -0.51 -1.46 0.00 0.00 175.22 172.27 2zae s LEU 75 N 1.45 4.20 -0.28 6.12 1.43 0.13 -4.95 118.68 126.78 2zae s LEU 75 Ca 0.60 0.44 0.03 0.00 -1.03 0.00 0.00 54.13 54.17 2zae s LEU 75 Cb -0.30 -2.36 0.07 0.00 0.03 0.00 0.00 46.19 43.63 2zae s LEU 75 CO 0.28 0.05 -0.04 -0.63 0.23 0.00 0.00 176.35 176.24 2zae s ILE 76 N 0.78 1.98 0.21 -0.59 1.01 -1.26 -4.82 121.20 118.50 2zae s ILE 76 Ca 0.16 -1.72 -0.32 0.00 0.00 0.00 0.00 60.65 58.76 2zae s ILE 76 Cb -0.13 -2.24 -0.14 0.00 0.01 0.00 0.00 42.46 39.95 2zae s ILE 76 CO 0.05 -0.24 1.43 -2.65 0.00 0.00 0.00 174.94 173.53 2zae n PRO 77 N 4.46 1.96 -0.33 2.79 -0.02 -1.26 -1.10 135.00 141.50 2zae n PRO 77 Ca -0.08 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 2zae n PRO 77 Cb 0.42 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2zae n PRO 77 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2zae n GLY 78 N 2.47 1.46 0.94 -1.23 0.00 0.03 -4.82 105.19 104.05 2zae n GLY 78 Ca 0.13 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.15 2zae n GLY 78 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2zae n VAL 79 N -2.00 0.28 -1.24 1.61 0.31 -0.26 -4.91 118.33 112.12 2zae n VAL 79 Ca 0.00 0.11 0.08 0.00 -0.01 0.00 0.00 64.34 64.53 2zae n VAL 79 Cb 0.00 -1.17 0.12 0.00 -0.91 0.00 0.00 33.84 31.88 2zae n VAL 79 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 2zae n ASN 80 N -2.74 1.97 -3.73 4.52 6.94 -0.87 -5.01 115.26 116.35 2zae n ASN 80 Ca -0.00 -2.95 -0.13 0.00 -0.02 0.00 0.00 54.58 51.48 2zae n ASN 80 Cb 0.01 -0.40 -0.10 0.00 -2.36 0.00 0.00 39.78 36.93 2zae n ASN 80 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2zae s ALA 81 N -2.45 -1.03 -0.20 -2.53 0.00 -1.20 -1.19 121.76 113.17 2zae s ALA 81 Ca 0.28 1.22 -0.07 0.00 0.00 0.00 0.00 51.96 53.38 2zae s ALA 81 Cb 0.24 -0.71 -0.04 0.00 0.00 0.00 0.00 23.12 22.61 2zae s ALA 81 CO 0.02 -0.21 0.06 0.50 0.00 0.00 0.00 175.76 176.13 2zae s ARG 82 N 0.39 3.86 -0.19 0.00 3.52 -0.38 -0.79 118.95 125.36 2zae s ARG 82 Ca -0.01 -0.40 -0.01 0.00 -0.13 0.00 0.00 55.73 55.18 2zae s ARG 82 Cb -0.04 -3.22 0.00 0.00 -1.56 0.00 0.00 34.95 30.14 2zae s ARG 82 CO -0.01 0.14 -0.13 0.08 -0.81 0.00 0.00 175.30 174.57 2zae s VAL 83 N 0.72 2.71 -0.15 7.11 1.01 -1.26 -0.78 120.40 129.77 2zae s VAL 83 Ca 0.03 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.30 2zae s VAL 83 Cb -0.13 -2.19 0.01 0.00 0.00 0.00 0.00 36.38 34.07 2zae s VAL 83 CO 0.02 0.49 -0.20 -0.60 0.00 0.00 0.00 175.10 174.81 2zae s ARG 84 N 1.28 2.86 -0.06 2.72 3.52 0.74 -4.98 118.95 125.02 2zae s ARG 84 Ca 0.03 -0.79 -0.21 0.00 -0.13 0.00 0.00 55.73 54.63 2zae s ARG 84 Cb -0.14 -2.38 -0.04 0.00 -1.56 0.00 0.00 34.95 30.82 2zae s ARG 84 CO -0.07 -0.09 0.62 -1.17 -0.81 0.00 0.00 175.30 173.78 2zae s LEU 85 N 1.03 4.33 -0.21 -0.88 0.20 -1.26 -0.56 118.68 121.33 2zae s LEU 85 Ca -0.03 1.10 0.01 0.00 0.69 0.00 0.00 54.13 55.90 2zae s LEU 85 Cb -0.14 -2.95 0.04 0.00 -0.43 0.00 0.00 46.19 42.71 2zae s LEU 85 CO -0.06 -0.03 -0.11 -0.13 -0.29 0.00 0.00 176.35 175.73 2zae s ARG 86 N 0.50 2.16 0.00 1.98 3.00 0.23 -5.00 118.95 121.82 2zae s ARG 86 Ca 0.33 -0.91 0.09 0.00 0.00 0.00 0.00 55.73 55.24 2zae s ARG 86 Cb -0.17 -2.50 0.16 0.00 0.00 0.00 0.00 34.95 32.44 2zae s ARG 86 CO 0.16 -0.42 1.01 0.25 0.00 0.00 0.00 175.30 176.29 2zae n THR 87 N 4.64 0.51 -0.12 0.02 -2.24 -1.26 -0.62 114.28 115.20 2zae n THR 87 Ca -0.15 -0.75 -0.11 0.00 -2.27 0.00 0.00 64.05 60.76 2zae n THR 87 Cb 0.46 0.84 -0.02 0.00 -2.10 0.00 0.00 70.33 69.51 2zae n THR 87 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2zae h LYS 88 N 1.74 0.68 0.00 -0.78 1.57 -1.97 -3.44 116.57 114.38 2zae h LYS 88 Ca 0.00 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 2zae h LYS 88 Cb 0.54 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.80 2zae h LYS 88 CO 0.00 0.82 0.00 2.89 -0.57 0.00 0.00 179.45 182.59 2zae n ARG 89 N -4.43 0.00 -2.52 3.15 1.85 -1.26 -5.00 116.66 108.45 2zae n ARG 89 Ca -0.02 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.41 2zae n ARG 89 Cb 0.32 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 31.71 2zae n ARG 89 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 2zae s MET 90 N 1.79 3.54 0.29 2.89 -1.94 -1.26 -4.97 119.30 119.65 2zae s MET 90 Ca 0.00 0.45 -0.30 0.00 -1.71 0.00 0.00 55.69 54.14 2zae s MET 90 Cb 0.00 -4.01 -0.11 0.00 2.01 0.00 0.00 34.83 32.72 2zae s MET 90 CO 0.00 -1.64 1.52 -2.14 -0.01 0.00 0.00 175.02 172.75 2zae s PRO 91 N 4.92 4.18 0.12 2.03 0.02 -1.26 -4.92 135.00 140.09 2zae s PRO 91 Ca 0.48 2.48 -0.04 0.00 0.02 0.00 0.00 61.00 63.94 2zae s PRO 91 Cb -0.09 -3.04 -0.03 0.00 0.02 0.00 0.00 34.50 31.36 2zae s PRO 91 CO 0.28 -0.53 0.11 -3.38 -0.33 0.00 0.00 177.00 173.15 2zae s HIS 92 N -0.22 0.61 -0.13 6.54 -3.43 0.21 -0.51 115.29 118.35 2zae s HIS 92 Ca 0.60 -1.02 -0.02 0.00 -0.80 0.00 0.00 55.06 53.82 2zae s HIS 92 Cb -0.45 -0.31 -0.02 0.00 -1.43 0.00 0.00 32.58 30.36 2zae s HIS 92 CO 0.49 -0.55 -0.07 0.08 -2.00 0.00 0.00 174.74 172.69 2zae s VAL 93 N -3.98 3.60 -0.23 -5.38 1.01 0.11 -0.60 120.40 114.93 2zae s VAL 93 Ca 0.17 -0.48 -0.05 0.00 0.00 0.00 0.00 61.98 61.62 2zae s VAL 93 Cb 0.06 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.89 2zae s VAL 93 CO -0.02 0.53 0.01 -0.69 0.00 0.00 0.00 175.10 174.92 2zae s VAL 94 N 0.08 3.87 -0.18 2.92 1.01 0.28 -1.24 120.40 127.14 2zae s VAL 94 Ca -0.02 -0.33 -0.00 0.00 0.00 0.00 0.00 61.98 61.63 2zae s VAL 94 Cb -0.14 -2.78 0.00 0.00 0.00 0.00 0.00 36.38 33.47 2zae s VAL 94 CO 0.03 0.39 -0.15 -0.63 0.00 0.00 0.00 175.10 174.75 2zae s ILE 95 N 1.41 2.60 -0.19 2.22 1.01 0.29 -0.19 121.20 128.36 2zae s ILE 95 Ca 0.05 -0.77 -0.02 0.00 0.00 0.00 0.00 60.65 59.91 2zae s ILE 95 Cb -0.15 -2.12 -0.00 0.00 0.01 0.00 0.00 42.46 40.20 2zae s ILE 95 CO 0.01 0.50 -0.09 -0.89 0.00 0.00 0.00 174.94 174.47 2zae s THR 96 N 1.12 3.05 -0.12 2.92 2.01 0.04 -0.96 115.64 123.69 2zae s THR 96 Ca 0.01 -0.62 -0.29 0.00 0.31 0.00 0.00 61.69 61.09 2zae s THR 96 Cb -0.14 -2.35 -0.03 0.00 0.01 0.00 0.00 72.50 69.99 2zae s THR 96 CO -0.05 0.47 1.47 0.00 -0.69 0.00 0.00 174.62 175.82 2zae n LEU 98 N 6.99 1.96 -0.09 0.00 4.77 -0.33 0.21 117.00 130.51 2zae n LEU 98 Ca 0.16 -0.98 -0.18 0.00 -0.03 0.00 0.00 56.01 54.97 2zae n LEU 98 Cb 0.44 -0.25 -0.13 0.00 -2.33 0.00 0.00 43.42 41.15 2zae n LEU 98 CO 0.60 0.47 -1.17 -0.62 -1.33 0.00 0.00 177.39 175.34 2zae n GLU 99 N 0.53 0.68 0.00 3.23 1.02 -1.26 -4.77 120.64 120.07 2zae n GLU 99 Ca 0.12 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.44 2zae n GLU 99 Cb 0.32 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 2zae n GLU 99 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2zae n GLY 101 N 0.39 0.74 3.77 0.00 0.00 0.13 -5.04 105.19 105.18 2zae n GLY 101 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2zae n GLY 101 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2zae s TYR 102 N -2.40 3.19 -0.15 1.61 5.04 -1.24 -4.69 117.35 118.71 2zae s TYR 102 Ca 0.00 1.48 -0.04 0.00 -2.44 0.00 0.00 57.07 56.07 2zae s TYR 102 Cb 0.00 -3.58 -0.03 0.00 0.35 0.00 0.00 41.96 38.70 2zae s TYR 102 CO 0.00 -1.52 -0.02 0.42 -1.34 0.00 0.00 175.55 173.09 2zae s ILE 103 N -1.11 4.09 -0.04 3.14 -1.09 -1.26 -1.30 121.20 123.62 2zae s ILE 103 Ca 0.48 -0.29 0.03 0.00 -2.23 0.00 0.00 60.65 58.64 2zae s ILE 103 Cb -0.38 -2.79 0.00 0.00 -1.58 0.00 0.00 42.46 37.71 2zae s ILE 103 CO 0.50 0.50 -0.13 -0.04 -1.23 0.00 0.00 174.94 174.53 2zae s MET 104 N 0.25 1.50 -0.05 2.79 -1.94 -0.14 -5.01 119.30 116.70 2zae s MET 104 Ca -0.01 -0.45 0.07 0.00 -1.71 0.00 0.00 55.69 53.58 2zae s MET 104 Cb -0.14 -1.30 -0.01 0.00 2.01 0.00 0.00 34.83 35.39 2zae s MET 104 CO 0.02 0.13 -0.25 1.03 -0.01 0.00 0.00 175.02 175.95 2zae s ARG 105 N 0.29 2.41 0.04 2.03 0.52 -1.26 -0.54 118.95 122.44 2zae s ARG 105 Ca -0.07 -0.90 0.03 0.00 -0.52 0.00 0.00 55.73 54.26 2zae s ARG 105 Cb -0.12 -2.14 -0.02 0.00 0.52 0.00 0.00 34.95 33.19 2zae s ARG 105 CO 0.02 0.45 -0.09 0.71 0.02 0.00 0.00 175.30 176.41 2zae s TYR 106 N -0.32 0.75 0.42 -0.53 2.02 -0.37 -4.99 117.35 114.32 2zae s TYR 106 Ca 0.01 -0.43 -0.26 0.00 -0.37 0.00 0.00 57.07 56.03 2zae s TYR 106 Cb -0.12 -0.45 -0.08 0.00 -0.40 0.00 0.00 41.96 40.91 2zae s TYR 106 CO 0.02 -0.05 1.30 -1.25 -1.57 0.00 0.00 175.55 174.00 2zae s PRO 107 N -1.37 3.91 -0.11 -1.71 0.04 -1.26 0.08 135.00 134.58 2zae s PRO 107 Ca -0.07 2.15 -0.27 0.00 0.04 0.00 0.00 61.00 62.85 2zae s PRO 107 Cb -0.09 -2.71 -0.28 0.00 0.04 0.00 0.00 34.50 31.46 2zae s PRO 107 CO 0.01 -0.53 0.81 -0.92 0.04 0.00 0.00 177.00 176.40 2zae h TYR 108 N 2.58 0.17 0.00 0.56 5.03 -1.09 -3.43 116.97 120.80 2zae h TYR 108 Ca -0.50 -0.13 0.00 0.00 2.58 0.00 0.00 58.73 60.69 2zae h TYR 108 Cb 1.25 -0.01 0.00 0.00 1.55 0.00 0.00 36.73 39.52 2zae h TYR 108 CO 0.53 1.10 0.00 1.47 -1.32 0.00 0.00 178.16 179.93