#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zzs s ASP 23 N 0.00 6.19 0.29 1.61 -1.08 -1.26 -4.87 116.67 117.55 2zzs s ASP 23 Ca 0.00 -1.55 0.03 0.00 -0.52 0.00 0.00 52.55 50.51 2zzs s ASP 23 Cb 0.00 -2.25 0.64 0.00 -1.46 0.00 0.00 42.92 39.85 2zzs s ASP 23 CO 0.00 -0.94 1.79 0.00 0.52 0.00 0.00 175.17 176.54 2zzs h ALA 24 N 9.00 1.54 -0.19 3.66 0.00 -1.84 0.03 119.26 131.46 2zzs h ALA 24 Ca -0.29 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.58 2zzs h ALA 24 Cb 1.10 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 2zzs h ALA 24 CO 1.04 0.02 -0.28 0.00 0.00 0.00 0.00 179.25 180.04 2zzs h ALA 25 N 1.60 0.29 -0.58 0.00 0.00 -1.92 -0.59 119.26 118.05 2zzs h ALA 25 Ca 0.53 -0.40 0.06 0.00 0.00 0.00 0.00 54.91 55.11 2zzs h ALA 25 Cb 0.73 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 2zzs h ALA 25 CO -0.35 0.29 0.28 0.00 0.00 0.00 0.00 179.25 179.48 2zzs h ALA 26 N 0.61 0.75 -0.74 0.00 0.00 -1.79 -2.46 119.26 115.63 2zzs h ALA 26 Ca 0.02 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2zzs h ALA 26 Cb 0.85 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 2zzs h ALA 26 CO 0.06 -0.07 0.43 0.78 0.00 0.00 0.00 179.25 180.45 2zzs h GLY 27 N 0.54 1.09 1.01 0.00 0.00 -0.59 -0.49 103.07 104.63 2zzs h GLY 27 Ca 0.26 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 47.13 2zzs h GLY 27 CO -0.20 0.45 0.59 -1.61 0.00 0.00 0.00 176.54 175.77 2zzs h GLN 28 N 1.03 1.22 -0.22 4.80 4.15 -0.65 0.10 115.11 125.55 2zzs h GLN 28 Ca 0.26 -0.09 -0.03 0.00 0.77 0.00 0.00 58.65 59.57 2zzs h GLN 28 Cb -0.01 -0.27 -0.01 0.00 0.21 0.00 0.00 27.48 27.41 2zzs h GLN 28 CO -0.05 0.83 0.01 0.00 -1.93 0.00 0.00 178.83 177.69 2zzs h ALA 29 N 1.32 0.29 -0.11 3.38 0.00 -0.92 -2.55 119.26 120.68 2zzs h ALA 29 Ca 0.33 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2zzs h ALA 29 Cb -0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2zzs h ALA 29 CO -0.07 -0.01 -0.05 -0.22 0.00 0.00 0.00 179.25 178.91 2zzs h LYS 30 N 0.15 0.15 0.00 0.00 1.63 -0.94 -2.72 116.57 114.84 2zzs h LYS 30 Ca 0.06 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 2zzs h LYS 30 Cb 0.37 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.97 2zzs h LYS 30 CO 0.01 0.22 0.00 0.00 -3.45 0.00 0.00 179.45 176.23 2zzs n ALA 31 N -2.51 1.72 -0.12 5.00 0.00 0.33 -3.49 120.51 121.45 2zzs n ALA 31 Ca -0.01 -0.05 -0.06 0.00 0.00 0.00 0.00 53.44 53.32 2zzs n ALA 31 Cb 0.18 -1.17 0.01 0.00 0.00 0.00 0.00 19.45 18.47 2zzs n ALA 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zzs h ALA 32 N 2.54 0.04 0.00 0.00 0.00 -1.57 0.18 119.26 120.45 2zzs h ALA 32 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2zzs h ALA 32 Cb 0.06 0.53 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2zzs h ALA 32 CO 0.00 -0.60 0.00 1.55 0.00 0.00 0.00 179.25 180.20 2zzs n VAL 33 N -5.39 0.42 0.09 0.00 3.14 -1.23 -2.79 118.33 112.57 2zzs n VAL 33 Ca 0.02 0.10 0.04 0.00 -2.96 0.00 0.00 64.34 61.54 2zzs n VAL 33 Cb 0.30 -0.73 -0.02 0.00 -1.06 0.00 0.00 33.84 32.33 2zzs n VAL 33 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2zzs h ALA 35 N 1.61 2.26 -0.91 0.00 0.00 -1.29 -1.92 119.26 119.00 2zzs h ALA 35 Ca -0.08 -0.01 0.23 0.00 0.00 0.00 0.00 54.91 55.05 2zzs h ALA 35 Cb 1.37 0.02 -0.13 0.00 0.00 0.00 0.00 17.79 19.05 2zzs h ALA 35 CO 0.04 -0.34 0.41 0.00 0.00 0.00 0.00 179.25 179.36 2zzs h ALA 36 N 1.86 1.48 0.00 0.00 0.00 -1.78 -2.49 119.26 118.33 2zzs h ALA 36 Ca 0.13 0.16 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 2zzs h ALA 36 Cb 0.53 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2zzs h ALA 36 CO -0.00 -0.35 -1.37 0.00 0.00 0.00 0.00 179.25 177.53 2zzs n HIS 38 N -2.07 0.73 0.00 0.00 -0.00 -0.91 -4.40 115.22 108.58 2zzs n HIS 38 Ca -0.07 -0.55 0.00 0.00 -0.00 0.00 0.00 57.72 57.10 2zzs n HIS 38 Cb 0.53 -0.08 0.00 0.00 -0.00 0.00 0.00 29.99 30.45 2zzs n HIS 38 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2zzs n GLY 39 N 0.71 0.00 0.32 -1.41 0.00 -0.94 -1.01 105.19 102.85 2zzs n GLY 39 Ca 0.17 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.37 2zzs n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zzs h ALA 40 N -2.31 1.48 -0.05 4.61 0.00 -1.77 -2.39 119.26 118.82 2zzs h ALA 40 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2zzs h ALA 40 Cb 0.00 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2zzs h ALA 40 CO 0.00 -0.58 0.00 -3.47 0.00 0.00 0.00 179.25 175.20 2zzs n ASP 41 N -5.27 1.77 0.00 0.00 4.64 -1.26 -4.92 116.55 111.51 2zzs n ASP 41 Ca 0.26 -1.43 0.00 0.00 -1.38 0.00 0.00 54.79 52.24 2zzs n ASP 41 Cb 0.83 -0.03 0.00 0.00 -1.04 0.00 0.00 41.12 40.89 2zzs n ASP 41 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2zzs n GLY 42 N 0.34 0.70 3.45 0.27 0.00 -0.90 -4.52 105.19 104.53 2zzs n GLY 42 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 2zzs n GLY 42 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2zzs s ASN 43 N -2.78 5.73 0.95 1.61 2.47 -0.49 0.30 114.94 122.74 2zzs s ASN 43 Ca 0.00 -0.59 -0.12 0.00 0.42 0.00 0.00 52.86 52.57 2zzs s ASN 43 Cb 0.00 -2.05 0.16 0.00 -1.45 0.00 0.00 41.25 37.91 2zzs s ASN 43 CO 0.00 -0.25 1.09 0.00 -3.72 0.00 0.00 177.10 174.23 2zzs s ALA 44 N 1.64 1.22 0.00 1.71 0.00 -0.18 -3.55 121.76 122.60 2zzs s ALA 44 Ca 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 51.96 51.78 2zzs s ALA 44 Cb -0.18 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 19.79 2zzs s ALA 44 CO 0.08 -2.62 0.00 2.41 0.00 0.00 0.00 175.76 175.63 2zzs n THR 45 N -4.04 0.00 -1.52 0.00 -1.04 -1.26 -4.84 114.28 101.58 2zzs n THR 45 Ca 0.06 0.00 -0.57 0.00 -2.04 0.00 0.00 64.05 61.50 2zzs n THR 45 Cb 0.56 -1.21 -0.07 0.00 -1.82 0.00 0.00 70.33 67.79 2zzs n THR 45 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 2zzs n ILE 46 N -2.84 0.08 -2.70 12.58 5.41 -1.26 -4.88 119.36 125.73 2zzs n ILE 46 Ca 0.00 -0.02 -0.35 0.00 1.00 0.00 0.00 62.75 63.38 2zzs n ILE 46 Cb 0.40 -0.20 -0.06 0.00 -0.71 0.00 0.00 39.64 39.07 2zzs n ILE 46 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2zzs s PRO 47 N 0.07 4.30 0.00 0.38 0.05 -1.26 -2.96 135.00 135.58 2zzs s PRO 47 Ca 0.88 1.32 0.00 0.00 0.05 0.00 0.00 61.00 63.26 2zzs s PRO 47 Cb -1.18 -2.49 0.00 0.00 0.05 0.00 0.00 34.50 30.88 2zzs s PRO 47 CO 0.55 0.01 0.00 0.41 0.05 0.00 0.00 177.00 178.02 2zzs n GLY 48 N 0.08 0.67 3.66 0.56 0.00 -1.26 -5.04 105.19 103.85 2zzs n GLY 48 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 2zzs n GLY 48 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2zzs s TYR 49 N -2.51 3.10 -0.01 1.61 4.12 -1.16 -5.08 117.35 117.41 2zzs s TYR 49 Ca 0.00 0.14 -0.30 0.00 0.02 0.00 0.00 57.07 56.93 2zzs s TYR 49 Cb 0.00 -1.76 -0.03 0.00 -1.52 0.00 0.00 41.96 38.65 2zzs s TYR 49 CO 0.00 0.43 0.98 -1.25 0.02 0.00 0.00 175.55 175.73 2zzs s PRO 50 N -0.90 4.54 0.30 -1.71 0.04 -1.26 -4.77 135.00 131.24 2zzs s PRO 50 Ca 0.13 1.41 -0.30 0.00 0.04 0.00 0.00 61.00 62.28 2zzs s PRO 50 Cb -0.11 -3.47 -0.11 0.00 0.04 0.00 0.00 34.50 30.85 2zzs s PRO 50 CO 0.02 -0.08 1.56 -0.80 0.04 0.00 0.00 177.00 177.74 2zzs s ASN 51 N 1.02 6.42 -0.01 6.66 0.01 -1.26 -4.49 114.94 123.29 2zzs s ASN 51 Ca 0.51 2.92 0.09 0.00 -0.71 0.00 0.00 52.86 55.67 2zzs s ASN 51 Cb -0.21 -2.64 -0.12 0.00 0.41 0.00 0.00 41.25 38.69 2zzs s ASN 51 CO 0.27 -0.87 0.31 0.18 -1.51 0.00 0.00 177.10 175.47 2zzs n LEU 52 N 1.99 0.23 -4.64 0.60 4.77 0.86 -4.94 117.00 115.87 2zzs n LEU 52 Ca 0.07 -0.26 -0.49 0.00 -0.03 0.00 0.00 56.01 55.29 2zzs n LEU 52 Cb 0.38 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.42 2zzs n LEU 52 CO 0.63 0.06 1.55 1.17 -1.33 0.00 0.00 177.39 179.47 2zzs n LYS 53 N -1.51 1.88 -1.00 3.23 4.81 0.71 -1.75 118.16 124.53 2zzs n LYS 53 Ca 0.00 0.66 -0.00 0.00 -0.87 0.00 0.00 58.31 58.10 2zzs n LYS 53 Cb 0.20 -2.60 -0.00 0.00 0.02 0.00 0.00 35.03 32.64 2zzs n LYS 53 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2zzs n GLY 54 N 4.81 0.45 3.76 3.14 0.00 0.54 -4.99 105.19 112.91 2zzs n GLY 54 Ca 0.26 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 2zzs n GLY 54 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2zzs s GLN 55 N -0.32 2.78 0.25 1.61 2.00 -0.71 -4.84 119.66 120.43 2zzs s GLN 55 Ca 0.00 1.53 -0.31 0.00 -2.00 0.00 0.00 55.36 54.58 2zzs s GLN 55 Cb 0.00 -1.94 -0.12 0.00 0.80 0.00 0.00 33.01 31.76 2zzs s GLN 55 CO 0.00 -1.29 1.66 1.21 -0.50 0.00 0.00 175.29 176.38 2zzs s ASN 56 N -2.27 6.38 0.10 6.67 3.84 -1.26 -4.01 114.94 124.39 2zzs s ASN 56 Ca 0.70 2.90 -0.26 0.00 0.21 0.00 0.00 52.86 56.41 2zzs s ASN 56 Cb -0.23 -2.62 -0.11 0.00 -0.55 0.00 0.00 41.25 37.74 2zzs s ASN 56 CO 0.39 -0.95 1.67 -0.08 -2.79 0.00 0.00 177.10 175.34 2zzs h GLU 57 N 5.92 -0.37 0.00 0.43 4.81 -1.91 -1.23 114.58 122.22 2zzs h GLU 57 Ca -0.45 0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 58.78 2zzs h GLU 57 Cb 1.21 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.67 2zzs h GLU 57 CO 0.88 -0.25 -0.14 1.96 -0.73 0.00 0.00 179.01 180.73 2zzs h GLN 58 N -0.39 0.00 -0.51 1.92 1.08 -1.95 -2.14 115.11 113.13 2zzs h GLN 58 Ca 0.01 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.08 2zzs h GLN 58 Cb 0.38 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.79 2zzs h GLN 58 CO -0.06 0.14 -0.17 -0.92 -0.95 0.00 0.00 178.83 176.87 2zzs h TYR 59 N 0.00 1.15 -0.76 2.96 3.20 -1.80 -1.02 116.97 120.70 2zzs h TYR 59 Ca -0.00 -0.26 -0.02 0.00 3.14 0.00 0.00 58.73 61.58 2zzs h TYR 59 Cb 0.79 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.76 2zzs h TYR 59 CO 0.00 1.09 0.38 0.82 -1.64 0.00 0.00 178.16 178.81 2zzs h ILE 60 N 0.88 1.24 0.51 1.81 2.04 -0.63 0.13 117.51 123.49 2zzs h ILE 60 Ca 0.12 -0.65 -0.02 0.00 1.00 0.00 0.00 64.86 65.31 2zzs h ILE 60 Cb 0.75 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 2zzs h ILE 60 CO 0.06 0.28 -0.26 0.58 0.00 0.00 0.00 178.15 178.81 2zzs h VAL 61 N 1.06 0.47 -0.58 1.67 2.07 -1.23 -1.91 116.25 117.80 2zzs h VAL 61 Ca 0.26 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.75 2zzs h VAL 61 Cb 0.09 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 2zzs h VAL 61 CO -0.04 0.00 0.25 0.77 0.02 0.00 0.00 177.57 178.58 2zzs h SER 62 N -0.71 0.78 -0.47 0.57 4.64 -0.99 -2.07 113.55 115.30 2zzs h SER 62 Ca -0.07 -0.15 -0.12 0.00 -0.47 0.00 0.00 61.79 60.98 2zzs h SER 62 Cb 0.55 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 2zzs h SER 62 CO 0.10 0.72 -0.15 0.77 -0.87 0.00 0.00 176.83 177.40 2zzs h SER 63 N 0.79 0.96 -0.36 4.97 4.64 -0.96 -1.61 113.55 121.98 2zzs h SER 63 Ca 0.20 -0.38 0.03 0.00 -0.47 0.00 0.00 61.79 61.17 2zzs h SER 63 Cb 0.17 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 61.96 2zzs h SER 63 CO -0.02 1.11 0.17 0.40 -0.87 0.00 0.00 176.83 177.63 2zzs h ILE 64 N 0.79 0.98 0.00 0.95 2.04 -1.15 -1.46 117.51 119.65 2zzs h ILE 64 Ca 0.12 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.85 2zzs h ILE 64 Cb 0.72 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 2zzs h ILE 64 CO 0.05 0.07 0.00 0.11 0.00 0.00 0.00 178.15 178.38 2zzs h LYS 65 N 0.36 0.00 0.00 2.37 1.57 -1.26 -1.31 116.57 118.31 2zzs h LYS 65 Ca 0.15 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.68 2zzs h LYS 65 Cb 0.07 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.39 2zzs h LYS 65 CO -0.11 0.00 -1.00 0.00 -0.57 0.00 0.00 179.45 177.78 2zzs h ALA 66 N 2.01 0.25 -0.45 3.86 0.00 -0.25 0.18 119.26 124.85 2zzs h ALA 66 Ca 0.00 -0.71 -0.08 0.00 0.00 0.00 0.00 54.91 54.13 2zzs h ALA 66 Cb 0.18 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2zzs h ALA 66 CO 0.00 0.75 -0.03 1.88 0.00 0.00 0.00 179.25 181.86 2zzs h TYR 67 N 0.31 0.89 -0.80 0.00 0.05 -1.11 0.68 116.97 116.99 2zzs h TYR 67 Ca -0.10 -0.16 -0.02 0.00 0.05 0.00 0.00 58.73 58.49 2zzs h TYR 67 Cb 1.64 -0.23 -0.04 0.00 1.01 0.00 0.00 36.73 39.12 2zzs h TYR 67 CO 0.08 0.87 0.41 -0.22 -1.05 0.00 0.00 178.16 178.25 2zzs h LYS 68 N 0.65 1.12 -0.70 4.88 3.64 -0.99 -1.99 116.57 123.18 2zzs h LYS 68 Ca 0.12 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2zzs h LYS 68 Cb 0.53 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 2zzs h LYS 68 CO 0.03 0.84 0.00 0.09 -2.27 0.00 0.00 179.45 178.14 2zzs n ASN 69 N -4.33 3.31 -3.28 4.20 3.02 0.61 -4.86 115.26 113.92 2zzs n ASN 69 Ca 0.08 -2.41 -0.24 0.00 -0.03 0.00 0.00 54.58 51.98 2zzs n ASN 69 Cb 0.12 -0.54 0.03 0.00 -0.61 0.00 0.00 39.78 38.78 2zzs n ASN 69 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2zzs n LYS 70 N 0.40 -4.94 0.05 3.52 5.02 -0.75 -4.87 118.16 116.59 2zzs n LYS 70 Ca 0.15 0.75 0.11 0.00 -2.02 0.00 0.00 58.31 57.30 2zzs n LYS 70 Cb 0.69 -5.60 -0.00 0.00 -0.02 0.00 0.00 35.03 30.09 2zzs n LYS 70 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2zzs n GLU 71 N -4.14 0.44 -4.05 1.97 1.02 0.23 -4.79 120.64 111.32 2zzs n GLU 71 Ca -0.06 0.01 -0.34 0.00 -0.02 0.00 0.00 57.16 56.75 2zzs n GLU 71 Cb 0.58 -1.66 -0.10 0.00 -0.02 0.00 0.00 31.44 30.24 2zzs n GLU 71 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2zzs s ARG 72 N -3.29 3.94 0.00 3.49 0.52 -1.24 -5.00 118.95 117.36 2zzs s ARG 72 Ca 0.01 -0.37 0.00 0.00 -0.52 0.00 0.00 55.73 54.85 2zzs s ARG 72 Cb 0.13 -3.18 0.00 0.00 0.52 0.00 0.00 34.95 32.42 2zzs s ARG 72 CO 0.81 0.26 0.00 0.43 0.02 0.00 0.00 175.30 176.82 2zzs n SER 73 N 3.56 1.80 -0.37 0.23 7.64 -1.26 -4.68 113.62 120.54 2zzs n SER 73 Ca -0.17 -0.57 0.29 0.00 1.01 0.00 0.00 58.87 59.42 2zzs n SER 73 Cb 0.52 0.00 0.55 0.00 -1.01 0.00 0.00 64.21 64.27 2zzs n SER 73 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2zzs h GLY 74 N 0.00 1.52 0.00 0.23 0.00 -1.98 -3.41 103.07 99.42 2zzs h GLY 74 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.15 2zzs h GLY 74 CO 0.00 -0.35 0.00 0.61 0.00 0.00 0.00 176.54 176.80 2zzs n GLY 75 N -1.43 -2.84 0.37 4.60 0.00 -1.26 0.65 105.19 105.28 2zzs n GLY 75 Ca 0.32 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.64 2zzs n GLY 75 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2zzs n LEU 76 N 0.00 0.16 -0.11 0.99 4.77 -1.26 -4.73 117.00 116.83 2zzs n LEU 76 Ca 0.00 -0.08 -0.12 0.00 -0.03 0.00 0.00 56.01 55.78 2zzs n LEU 76 Cb 0.00 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 40.98 2zzs n LEU 76 CO 0.00 0.04 0.66 0.00 -1.33 0.00 0.00 177.39 176.76 2zzs h ALA 77 N 1.28 0.45 -0.99 -1.18 0.00 -1.50 -2.86 119.26 114.46 2zzs h ALA 77 Ca 0.00 -0.34 0.38 0.00 0.00 0.00 0.00 54.91 54.95 2zzs h ALA 77 Cb 0.08 -0.11 -0.17 0.00 0.00 0.00 0.00 17.79 17.59 2zzs h ALA 77 CO 0.00 0.36 0.46 0.00 0.00 0.00 0.00 179.25 180.07 2zzs h ALA 78 N 0.77 1.96 0.71 0.00 0.00 -0.06 -0.60 119.26 122.04 2zzs h ALA 78 Ca 0.07 0.27 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 2zzs h ALA 78 Cb 0.69 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2zzs h ALA 78 CO 0.05 -0.82 -0.44 0.28 0.00 0.00 0.00 179.25 178.32 2zzs h VAL 79 N 0.06 0.11 -0.08 0.00 2.07 -1.78 -2.37 116.25 114.27 2zzs h VAL 79 Ca 0.78 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 68.25 2zzs h VAL 79 Cb 1.97 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 2zzs h VAL 79 CO -0.76 0.00 -0.22 0.24 0.02 0.00 0.00 177.57 176.84 2zzs h MET 80 N -1.09 0.13 -0.84 1.57 2.86 -1.45 -2.39 114.93 113.72 2zzs h MET 80 Ca -0.09 -0.04 0.05 0.00 -2.06 0.00 0.00 59.70 57.56 2zzs h MET 80 Cb 0.87 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 32.47 2zzs h MET 80 CO 0.09 0.35 0.55 0.37 1.06 0.00 0.00 176.91 179.34 2zzs h GLN 81 N 0.12 0.97 -0.16 1.72 4.15 -0.80 0.13 115.11 121.23 2zzs h GLN 81 Ca 0.02 -0.06 -0.16 0.00 0.77 0.00 0.00 58.65 59.22 2zzs h GLN 81 Cb 0.47 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 2zzs h GLN 81 CO 0.03 0.64 -0.58 0.00 -1.93 0.00 0.00 178.83 176.99 2zzs h ALA 82 N 1.52 0.68 -0.03 3.38 0.00 -0.93 -0.60 119.26 123.29 2zzs h ALA 82 Ca 0.34 -0.53 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 2zzs h ALA 82 Cb 0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2zzs h ALA 82 CO -0.11 0.70 -0.33 1.96 0.00 0.00 0.00 179.25 181.47 2zzs h GLN 83 N 0.40 0.05 0.00 0.00 1.08 -1.10 -3.16 115.11 112.38 2zzs h GLN 83 Ca 0.00 -0.02 -0.14 0.00 -1.45 0.00 0.00 58.65 57.04 2zzs h GLN 83 Cb 1.13 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.53 2zzs h GLN 83 CO 0.11 0.38 -1.07 0.00 -0.95 0.00 0.00 178.83 177.29 2zzs h ALA 84 N 1.63 0.65 -0.96 3.87 0.00 -0.37 -3.22 119.26 120.86 2zzs h ALA 84 Ca 0.00 -0.67 0.09 0.00 0.00 0.00 0.00 54.91 54.33 2zzs h ALA 84 Cb 0.60 0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.45 2zzs h ALA 84 CO 0.04 0.78 0.60 0.77 0.00 0.00 0.00 179.25 181.44 2zzs h SER 85 N 0.00 0.92 -1.40 0.00 0.02 -1.08 -3.16 113.55 108.85 2zzs h SER 85 Ca -0.10 0.03 -0.46 0.00 -0.84 0.00 0.00 61.79 60.42 2zzs h SER 85 Cb 1.49 -0.16 -0.06 0.00 0.14 0.00 0.00 62.40 63.80 2zzs h SER 85 CO 0.05 0.55 1.13 -0.76 -1.14 0.00 0.00 176.83 176.66 2zzs s LEU 86 N -10.21 3.28 0.00 5.07 1.02 -1.22 -4.84 118.68 111.78 2zzs s LEU 86 Ca -0.12 -0.59 0.00 0.00 0.02 0.00 0.00 54.13 53.44 2zzs s LEU 86 Cb 0.20 -2.56 0.00 0.00 0.02 0.00 0.00 46.19 43.86 2zzs s LEU 86 CO 0.80 -2.19 0.00 0.18 0.02 0.00 0.00 176.35 175.16 2zzs n LEU 87 N 11.63 0.00 -4.88 1.79 4.32 -1.19 -4.90 117.00 123.76 2zzs n LEU 87 Ca 0.27 0.00 -0.30 0.00 -0.02 0.00 0.00 56.01 55.96 2zzs n LEU 87 Cb 0.50 0.00 0.03 0.00 -1.62 0.00 0.00 43.42 42.33 2zzs n LEU 87 CO 0.66 0.00 0.72 -0.94 -1.22 0.00 0.00 177.39 176.61 2zzs s SER 88 N 0.00 5.69 0.27 -1.43 1.04 -1.26 -4.90 113.70 113.10 2zzs s SER 88 Ca 0.00 1.17 -0.01 0.00 0.48 0.00 0.00 55.95 57.59 2zzs s SER 88 Cb 0.00 -2.06 0.50 0.00 0.10 0.00 0.00 66.02 64.56 2zzs s SER 88 CO 0.00 -1.17 1.81 0.44 0.98 0.00 0.00 173.24 175.30 2zzs h ASP 89 N -0.51 0.77 -0.24 7.02 3.32 -2.00 -0.84 116.42 123.94 2zzs h ASP 89 Ca -0.45 0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.66 2zzs h ASP 89 Cb 1.24 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.68 2zzs h ASP 89 CO 0.63 0.40 0.16 -0.78 -1.72 0.00 0.00 179.24 177.94 2zzs h ASP 90 N 0.86 0.28 -0.33 6.45 3.58 -1.99 -0.66 116.42 124.61 2zzs h ASP 90 Ca 0.46 -0.01 0.05 0.00 0.42 0.00 0.00 57.03 57.96 2zzs h ASP 90 Cb 0.49 -0.07 -0.05 0.00 1.72 0.00 0.00 39.33 41.42 2zzs h ASP 90 CO -0.28 0.21 0.02 0.44 -2.88 0.00 0.00 179.24 176.75 2zzs h ASP 91 N 0.33 -0.09 -0.57 2.28 3.32 -1.69 -1.32 116.42 118.68 2zzs h ASP 91 Ca 0.09 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 2zzs h ASP 91 Cb -0.04 0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.60 2zzs h ASP 91 CO -0.02 -0.01 0.25 0.40 -1.72 0.00 0.00 179.24 178.14 2zzs h ILE 92 N 0.12 1.21 -0.44 0.35 2.04 -0.95 0.73 117.51 120.57 2zzs h ILE 92 Ca 0.16 -0.63 -0.04 0.00 1.00 0.00 0.00 64.86 65.35 2zzs h ILE 92 Cb 0.20 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 2zzs h ILE 92 CO -0.25 0.25 0.11 0.00 0.00 0.00 0.00 178.15 178.27 2zzs h ALA 93 N 1.09 1.38 -0.06 1.87 0.00 -0.62 -0.76 119.26 122.16 2zzs h ALA 93 Ca 0.19 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 2zzs h ALA 93 Cb 0.16 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2zzs h ALA 93 CO -0.02 0.45 -0.12 -0.91 0.00 0.00 0.00 179.25 178.65 2zzs h ASN 94 N 0.64 0.21 -0.86 0.00 2.35 -0.49 -1.47 115.58 115.95 2zzs h ASN 94 Ca 0.15 -0.56 0.10 0.00 -0.55 0.00 0.00 56.30 55.43 2zzs h ASN 94 Cb 0.23 -0.06 -0.07 0.00 0.05 0.00 0.00 38.32 38.46 2zzs h ASN 94 CO -0.00 0.74 0.51 -0.07 -1.65 0.00 0.00 177.43 176.95 2zzs h LEU 95 N -0.30 0.74 -0.09 1.61 3.38 -0.70 0.09 115.31 120.02 2zzs h LEU 95 Ca 0.00 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2zzs h LEU 95 Cb 0.70 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 2zzs h LEU 95 CO 0.03 0.42 0.02 0.00 0.09 0.00 0.00 178.44 179.00 2zzs h ALA 96 N 1.47 0.12 -0.87 1.53 0.00 -1.07 -1.22 119.26 119.23 2zzs h ALA 96 Ca 0.42 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.26 2zzs h ALA 96 Cb 0.38 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.07 2zzs h ALA 96 CO -0.25 -0.25 0.55 0.00 0.00 0.00 0.00 179.25 179.30 2zzs h ALA 97 N 0.82 1.19 0.14 0.00 0.00 -0.88 -0.62 119.26 119.91 2zzs h ALA 97 Ca 0.03 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2zzs h ALA 97 Cb 0.24 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2zzs h ALA 97 CO 0.00 0.31 -0.11 -0.92 0.00 0.00 0.00 179.25 178.52 2zzs h TYR 98 N 1.00 -0.31 -0.23 0.00 3.20 -0.78 -2.69 116.97 117.15 2zzs h TYR 98 Ca 0.38 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.22 2zzs h TYR 98 Cb 0.15 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 2zzs h TYR 98 CO -0.03 -0.16 0.05 1.88 -1.64 0.00 0.00 178.16 178.26 2zzs h TYR 99 N -0.24 0.33 0.00 -3.82 0.05 -1.10 -1.91 116.97 110.27 2zzs h TYR 99 Ca -0.02 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.73 2zzs h TYR 99 Cb 0.20 -0.10 -0.00 0.00 1.01 0.00 0.00 36.73 37.84 2zzs h TYR 99 CO -0.05 0.30 -0.09 0.66 -1.05 0.00 0.00 178.16 177.93 2zzs h SER 100 N 0.33 0.00 1.56 3.88 4.64 -1.17 0.16 113.55 122.95 2zzs h SER 100 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2zzs h SER 100 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 2zzs h SER 100 CO -0.00 0.09 -0.17 0.77 -0.87 0.00 0.00 176.83 176.64 2zzs h SER 101 N 0.00 0.00 0.00 4.97 4.64 -0.99 -3.43 113.55 118.75 2zzs h SER 101 Ca -0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2zzs h SER 101 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2zzs h SER 101 CO 0.01 0.01 0.00 0.18 -0.87 0.00 0.00 176.83 176.16