#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1luz n SER 7 N 0.00 -3.16 -4.10 7.72 3.41 -1.26 -5.02 113.62 111.21 1luz n SER 7 Ca 0.00 0.59 -0.20 0.00 -0.26 0.00 0.00 58.87 59.00 1luz n SER 7 Cb 0.00 -0.95 -0.14 0.00 -0.26 0.00 0.00 64.21 62.86 1luz n SER 7 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1luz s LEU 8 N 3.86 2.11 0.48 1.04 1.43 -1.26 -5.07 118.68 121.27 1luz s LEU 8 Ca 0.58 -0.34 -0.20 0.00 -1.03 0.00 0.00 54.13 53.13 1luz s LEU 8 Cb -0.42 -0.56 -0.09 0.00 0.03 0.00 0.00 46.19 45.16 1luz s LEU 8 CO 0.65 0.07 1.02 -2.16 0.23 0.00 0.00 176.35 176.16 1luz s PRO 9 N -0.76 3.87 0.27 1.29 0.04 -1.26 -5.05 135.00 133.39 1luz s PRO 9 Ca 0.02 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.35 1luz s PRO 9 Cb -0.06 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 1luz s PRO 9 CO 0.00 -0.36 0.46 -0.80 0.04 0.00 0.00 177.00 176.34 1luz s ASN 10 N -2.11 6.35 0.19 6.66 0.01 -1.26 -4.94 114.94 119.84 1luz s ASN 10 Ca 0.66 0.41 -0.32 0.00 -0.71 0.00 0.00 52.86 52.90 1luz s ASN 10 Cb -0.14 -2.01 -0.11 0.00 0.41 0.00 0.00 41.25 39.39 1luz s ASN 10 CO 0.20 -0.15 1.66 0.00 -1.51 0.00 0.00 177.10 177.30 1luz s ALA 11 N -2.07 3.88 0.00 0.60 0.00 -1.26 -1.66 121.76 121.25 1luz s ALA 11 Ca 0.39 1.51 0.00 0.00 0.00 0.00 0.00 51.96 53.86 1luz s ALA 11 Cb -0.10 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.35 1luz s ALA 11 CO 0.32 -0.87 0.00 0.41 0.00 0.00 0.00 175.76 175.62 1luz n GLY 12 N 3.88 1.63 3.75 0.00 0.00 0.11 -5.00 105.19 109.57 1luz n GLY 12 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1luz n GLY 12 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1luz s ASP 13 N -1.55 6.58 -0.31 1.61 1.01 -0.66 -4.63 116.67 118.71 1luz s ASP 13 Ca 0.00 2.77 -0.09 0.00 0.71 0.00 0.00 52.55 55.94 1luz s ASP 13 Cb 0.00 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.30 1luz s ASP 13 CO 0.00 -0.74 0.14 -0.69 0.21 0.00 0.00 175.17 174.09 1luz s VAL 14 N -0.28 4.45 0.27 -1.27 1.01 -1.26 -0.78 120.40 122.54 1luz s VAL 14 Ca 0.58 -0.53 0.04 0.00 0.00 0.00 0.00 61.98 62.07 1luz s VAL 14 Cb -0.43 -3.30 -0.06 0.00 0.00 0.00 0.00 36.38 32.59 1luz s VAL 14 CO 0.48 0.04 0.01 0.27 0.00 0.00 0.00 175.10 175.89 1luz s ILE 15 N 1.58 1.15 0.13 2.22 -4.36 -0.46 -4.90 121.20 116.57 1luz s ILE 15 Ca 0.04 -2.04 0.03 0.00 -0.26 0.00 0.00 60.65 58.42 1luz s ILE 15 Cb -0.17 -2.51 -0.04 0.00 1.25 0.00 0.00 42.46 40.99 1luz s ILE 15 CO 0.05 -0.20 0.18 -0.54 0.24 0.00 0.00 174.94 174.67 1luz s LYS 16 N -3.86 3.14 0.06 0.37 1.02 -1.26 -0.57 119.74 118.64 1luz s LYS 16 Ca 0.32 -0.70 -0.27 0.00 0.02 0.00 0.00 55.97 55.33 1luz s LYS 16 Cb 0.06 -2.81 0.10 0.00 -0.52 0.00 0.00 37.83 34.66 1luz s LYS 16 CO 0.12 0.52 1.17 0.20 -0.92 0.00 0.00 175.35 176.44 1luz s GLY 17 N -2.96 -0.22 -0.19 -3.33 0.00 -0.70 -2.03 107.32 97.89 1luz s GLY 17 Ca 0.32 0.25 -0.05 0.00 0.00 0.00 0.00 44.72 45.25 1luz s GLY 17 CO 0.25 1.50 -0.00 -1.60 0.00 0.00 0.00 173.10 173.25 1luz s ARG 18 N -2.50 3.66 0.34 2.90 3.52 -0.54 -0.92 118.95 125.41 1luz s ARG 18 Ca 0.18 -0.51 -0.26 0.00 -0.13 0.00 0.00 55.73 55.01 1luz s ARG 18 Cb 0.01 -3.05 -0.09 0.00 -1.56 0.00 0.00 34.95 30.25 1luz s ARG 18 CO -0.00 0.08 1.02 0.08 -0.81 0.00 0.00 175.30 175.67 1luz s VAL 19 N 0.82 3.86 0.11 7.11 1.01 -0.43 -0.74 120.40 132.14 1luz s VAL 19 Ca 0.00 1.57 -0.10 0.00 0.00 0.00 0.00 61.98 63.45 1luz s VAL 19 Cb -0.14 -3.88 0.01 0.00 0.00 0.00 0.00 36.38 32.36 1luz s VAL 19 CO 0.02 0.15 0.25 -0.72 0.00 0.00 0.00 175.10 174.80 1luz s TYR 20 N -1.52 0.11 -0.11 5.22 -0.85 -0.15 -0.64 117.35 119.42 1luz s TYR 20 Ca 0.52 -0.51 -0.04 0.00 -0.52 0.00 0.00 57.07 56.51 1luz s TYR 20 Cb -0.23 0.01 -0.04 0.00 0.38 0.00 0.00 41.96 42.09 1luz s TYR 20 CO 0.29 -0.61 0.06 -2.00 -1.52 0.00 0.00 175.55 171.77 1luz s GLU 21 N -3.87 3.28 -0.15 -3.49 2.12 -1.26 -0.11 118.70 115.22 1luz s GLU 21 Ca 0.06 -0.29 -0.06 0.00 0.36 0.00 0.00 54.97 55.04 1luz s GLU 21 Cb 0.04 -2.99 0.07 0.00 0.26 0.00 0.00 34.13 31.50 1luz s GLU 21 CO -0.09 0.68 0.32 0.21 -0.54 0.00 0.00 175.26 175.84 1luz s LYS 22 N -0.79 0.23 -1.16 4.30 2.20 -0.02 -4.94 119.74 119.55 1luz s LYS 22 Ca 0.13 0.81 -0.20 0.00 -0.36 0.00 0.00 55.97 56.34 1luz s LYS 22 Cb -0.12 0.06 -0.01 0.00 -1.51 0.00 0.00 37.83 36.26 1luz s LYS 22 CO 0.03 -0.25 0.77 -0.25 -0.36 0.00 0.00 175.35 175.29 1luz n ASP 23 N 5.11 -4.91 -2.59 1.43 8.00 -1.26 -2.05 116.55 120.28 1luz n ASP 23 Ca -0.11 -1.03 -0.16 0.00 0.71 0.00 0.00 54.79 54.20 1luz n ASP 23 Cb 0.51 -3.26 -0.00 0.00 -0.02 0.00 0.00 41.12 38.34 1luz n ASP 23 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1luz n TYR 24 N -4.26 -1.43 -3.87 1.24 4.02 -1.26 -4.95 117.16 106.64 1luz n TYR 24 Ca -0.11 0.10 -0.10 0.00 -0.01 0.00 0.00 57.90 57.79 1luz n TYR 24 Cb 0.60 -3.14 -0.08 0.00 -0.02 0.00 0.00 39.34 36.69 1luz n TYR 24 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1luz s ALA 25 N -2.78 -0.23 -0.16 -0.72 0.00 -0.87 -4.84 121.76 112.17 1luz s ALA 25 Ca 0.07 -0.46 -0.12 0.00 0.00 0.00 0.00 51.96 51.45 1luz s ALA 25 Cb -0.04 0.33 -0.05 0.00 0.00 0.00 0.00 23.12 23.36 1luz s ALA 25 CO 0.09 -0.39 0.24 -0.51 0.00 0.00 0.00 175.76 175.19 1luz s LEU 26 N -2.33 4.26 0.46 0.00 1.43 -1.26 -0.84 118.68 120.39 1luz s LEU 26 Ca -0.02 0.46 0.03 0.00 -1.03 0.00 0.00 54.13 53.58 1luz s LEU 26 Cb 0.01 -2.29 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 1luz s LEU 26 CO -0.06 0.17 0.02 -0.31 0.23 0.00 0.00 176.35 176.40 1luz s TYR 27 N 0.19 2.06 -0.05 0.29 1.51 0.85 -0.84 117.35 121.36 1luz s TYR 27 Ca 0.15 -0.91 -0.04 0.00 -1.01 0.00 0.00 57.07 55.26 1luz s TYR 27 Cb -0.13 -1.59 0.02 0.00 -0.11 0.00 0.00 41.96 40.15 1luz s TYR 27 CO 0.03 0.22 0.12 -1.50 -1.11 0.00 0.00 175.55 173.31 1luz s ILE 28 N -2.89 -0.01 -0.53 2.71 2.07 -0.14 -0.98 121.20 121.43 1luz s ILE 28 Ca 0.18 0.03 -0.21 0.00 -1.41 0.00 0.00 60.65 59.24 1luz s ILE 28 Cb 0.05 -0.18 0.06 0.00 0.13 0.00 0.00 42.46 42.52 1luz s ILE 28 CO 0.09 0.01 0.75 -0.31 -1.91 0.00 0.00 174.94 173.58 1luz s TYR 29 N 0.23 2.94 -0.18 3.50 4.12 0.08 -3.93 117.35 124.11 1luz s TYR 29 Ca -0.01 -0.39 -0.29 0.00 0.02 0.00 0.00 57.07 56.39 1luz s TYR 29 Cb -0.03 -3.78 -0.01 0.00 -1.52 0.00 0.00 41.96 36.63 1luz s TYR 29 CO -0.01 -1.18 1.21 -0.51 0.02 0.00 0.00 175.55 175.07 1luz s LEU 30 N 3.14 4.16 0.39 -1.29 1.43 -1.26 -1.47 118.68 123.77 1luz s LEU 30 Ca 0.20 1.61 0.11 0.00 -1.03 0.00 0.00 54.13 55.01 1luz s LEU 30 Cb -0.17 -3.54 0.89 0.00 0.03 0.00 0.00 46.19 43.40 1luz s LEU 30 CO 0.14 -0.74 1.92 -0.26 0.23 0.00 0.00 176.35 177.64 1luz h PHE 31 N 8.02 0.66 0.00 0.29 0.05 -1.78 -1.90 116.94 122.28 1luz h PHE 31 Ca -0.24 0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.56 1luz h PHE 31 Cb 1.09 -0.21 0.00 0.00 2.00 0.00 0.00 35.95 38.83 1luz h PHE 31 CO 0.79 0.28 -0.56 -0.44 -0.18 0.00 0.00 178.31 178.20 1luz h ASP 32 N 0.59 0.00 -2.08 2.17 3.32 -1.91 -3.40 116.42 115.10 1luz h ASP 32 Ca 0.37 -0.15 -0.57 0.00 0.02 0.00 0.00 57.03 56.69 1luz h ASP 32 Cb 0.61 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.76 1luz h ASP 32 CO -0.14 0.07 -0.93 -1.22 -1.72 0.00 0.00 179.24 175.30 1luz n TYR 33 N -2.26 0.95 -0.00 4.55 4.02 -0.72 -4.96 117.16 118.74 1luz n TYR 33 Ca 0.03 -3.75 0.15 0.00 -0.01 0.00 0.00 57.90 54.32 1luz n TYR 33 Cb 0.46 -0.40 0.60 0.00 -0.02 0.00 0.00 39.34 39.98 1luz n TYR 33 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1luz h PRO 34 N 4.12 0.17 -0.71 -0.72 0.11 -1.79 -2.84 132.00 130.33 1luz h PRO 34 Ca 0.12 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1luz h PRO 34 Cb 0.81 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.88 1luz h PRO 34 CO 0.58 0.11 0.00 0.72 -0.21 0.00 0.00 178.00 179.20 1luz n HIS 35 N -4.44 1.20 -4.61 0.65 8.25 -1.26 -4.86 115.22 110.15 1luz n HIS 35 Ca 0.08 -0.42 -0.24 0.00 -0.26 0.00 0.00 57.72 56.88 1luz n HIS 35 Cb 0.44 -0.31 -0.14 0.00 1.12 0.00 0.00 29.99 31.10 1luz n HIS 35 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1luz s PHE 36 N -2.00 1.61 -0.09 4.41 0.40 -1.07 -4.96 117.98 116.27 1luz s PHE 36 Ca 0.33 -0.35 -0.17 0.00 -0.60 0.00 0.00 56.93 56.13 1luz s PHE 36 Cb 0.24 -0.97 -0.05 0.00 0.51 0.00 0.00 43.02 42.75 1luz s PHE 36 CO 0.11 0.05 0.45 -1.21 0.70 0.00 0.00 175.22 175.33 1luz s GLU 37 N -1.01 4.26 -0.07 0.44 2.02 -0.63 -4.80 118.70 118.91 1luz s GLU 37 Ca 0.06 0.43 0.04 0.00 0.02 0.00 0.00 54.97 55.51 1luz s GLU 37 Cb -0.08 -3.39 0.00 0.00 0.10 0.00 0.00 34.13 30.76 1luz s GLU 37 CO 0.01 0.27 -0.18 0.00 0.02 0.00 0.00 175.26 175.38 1luz s ALA 38 N 0.26 1.70 0.03 5.21 0.00 -1.25 -0.32 121.76 127.39 1luz s ALA 38 Ca 0.25 -0.71 0.09 0.00 0.00 0.00 0.00 51.96 51.59 1luz s ALA 38 Cb -0.15 -0.65 -0.03 0.00 0.00 0.00 0.00 23.12 22.29 1luz s ALA 38 CO 0.11 0.23 -0.24 -1.50 0.00 0.00 0.00 175.76 174.35 1luz s ILE 39 N 0.38 2.30 -0.80 0.00 2.07 -0.27 -0.97 121.20 123.91 1luz s ILE 39 Ca -0.14 -1.30 -0.24 0.00 -1.41 0.00 0.00 60.65 57.57 1luz s ILE 39 Cb -0.16 -1.90 0.06 0.00 0.13 0.00 0.00 42.46 40.59 1luz s ILE 39 CO 0.05 0.39 1.20 -0.76 -1.91 0.00 0.00 174.94 173.91 1luz s LEU 40 N -1.20 3.85 0.34 8.50 1.02 -0.02 -1.13 118.68 130.03 1luz s LEU 40 Ca 0.12 -1.03 0.11 0.00 0.02 0.00 0.00 54.13 53.35 1luz s LEU 40 Cb -0.10 -2.50 0.92 0.00 0.02 0.00 0.00 46.19 44.53 1luz s LEU 40 CO 0.02 -1.55 1.74 0.00 0.02 0.00 0.00 176.35 176.59 1luz h ALA 41 N 9.69 1.89 0.00 4.21 0.00 -1.52 -1.47 119.26 132.05 1luz h ALA 41 Ca -0.12 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1luz h ALA 41 Cb 1.04 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1luz h ALA 41 CO 1.26 -0.33 0.00 -0.85 0.00 0.00 0.00 179.25 179.33 1luz n GLU 42 N -4.81 0.18 0.13 0.00 0.28 -1.26 -2.86 120.64 112.30 1luz n GLU 42 Ca 0.26 0.38 0.12 0.00 -0.16 0.00 0.00 57.16 57.76 1luz n GLU 42 Cb 0.76 -1.82 0.20 0.00 1.43 0.00 0.00 31.44 32.00 1luz n GLU 42 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1luz h SER 43 N 0.00 0.00 0.34 -1.84 4.64 -1.61 -3.38 113.55 111.69 1luz h SER 43 Ca 0.00 -0.05 -0.02 0.00 -0.47 0.00 0.00 61.79 61.26 1luz h SER 43 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 1luz h SER 43 CO 0.00 0.02 -0.16 0.58 -0.87 0.00 0.00 176.83 176.40 1luz h VAL 44 N 0.00 0.68 -3.35 0.95 2.07 -1.64 -3.44 116.25 111.52 1luz h VAL 44 Ca 0.00 -0.07 -0.73 0.00 0.82 0.00 0.00 66.70 66.72 1luz h VAL 44 Cb 0.88 0.72 -0.26 0.00 -1.52 0.00 0.00 31.29 31.10 1luz h VAL 44 CO 0.00 0.01 -0.39 -0.54 0.02 0.00 0.00 177.57 176.67 1luz s LYS 45 N -5.97 2.72 0.00 1.57 -0.14 -1.26 -4.97 119.74 111.69 1luz s LYS 45 Ca -0.15 -1.51 0.00 0.00 -1.36 0.00 0.00 55.97 52.95 1luz s LYS 45 Cb 0.04 -3.95 0.00 0.00 -1.68 0.00 0.00 37.83 32.24 1luz s LYS 45 CO 0.63 -1.05 0.00 0.72 -0.76 0.00 0.00 175.35 174.89 1luz n HIS 47 N 5.02 0.00 0.00 3.18 8.25 -1.26 -5.13 115.22 125.29 1luz n HIS 47 Ca -0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.35 1luz n HIS 47 Cb 0.42 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.53 1luz n HIS 47 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1luz n ASP 49 N 0.00 0.00 0.09 0.41 5.75 -1.26 0.02 116.55 121.56 1luz n ASP 49 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 54.79 54.73 1luz n ASP 49 Cb 0.00 0.00 0.13 0.00 -1.03 0.00 0.00 41.12 40.22 1luz n ASP 49 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1luz h ARG 50 N 0.00 0.23 -0.41 0.11 3.08 -2.03 -3.16 114.38 112.21 1luz h ARG 50 Ca 0.00 -0.16 -0.05 0.00 0.07 0.00 0.00 59.98 59.85 1luz h ARG 50 Cb 0.00 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 1luz h ARG 50 CO 0.00 0.76 0.07 -0.92 -1.07 0.00 0.00 179.97 178.81 1luz h TYR 51 N 0.17 0.71 -0.82 3.04 3.20 -0.81 -0.58 116.97 121.89 1luz h TYR 51 Ca -0.00 -0.10 0.04 0.00 3.14 0.00 0.00 58.73 61.81 1luz h TYR 51 Cb 1.09 -0.20 -0.05 0.00 1.54 0.00 0.00 36.73 39.12 1luz h TYR 51 CO 0.02 0.69 0.52 0.28 -1.64 0.00 0.00 178.16 178.03 1luz h VAL 52 N 0.53 1.10 -0.45 1.81 2.07 -1.80 0.13 116.25 119.63 1luz h VAL 52 Ca 0.12 -0.34 -0.07 0.00 0.82 0.00 0.00 66.70 67.24 1luz h VAL 52 Cb 0.36 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 1luz h VAL 52 CO 0.01 0.18 0.02 -0.33 0.02 0.00 0.00 177.57 177.46 1luz h GLU 53 N 0.99 0.78 -0.21 1.57 5.08 -1.47 -0.93 114.58 120.39 1luz h GLU 53 Ca 0.34 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1luz h GLU 53 Cb 0.06 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1luz h GLU 53 CO -0.13 0.84 0.11 -0.92 -1.00 0.00 0.00 179.01 177.90 1luz h TYR 54 N 0.63 0.29 -0.39 4.33 3.20 -0.39 -1.32 116.97 123.32 1luz h TYR 54 Ca 0.13 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.95 1luz h TYR 54 Cb 0.47 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.63 1luz h TYR 54 CO 0.04 0.29 0.10 0.07 -1.64 0.00 0.00 178.16 177.01 1luz h ARG 55 N 0.21 0.63 -0.45 1.82 0.11 -0.72 -1.48 114.38 114.51 1luz h ARG 55 Ca 0.07 -0.15 0.00 0.00 0.10 0.00 0.00 59.98 60.01 1luz h ARG 55 Cb 0.10 -0.08 -0.02 0.00 1.11 0.00 0.00 29.97 31.07 1luz h ARG 55 CO -0.01 0.65 0.28 -0.44 0.10 0.00 0.00 179.97 180.55 1luz h ASP 56 N 0.49 0.52 0.88 0.08 3.32 -0.99 -0.96 116.42 119.77 1luz h ASP 56 Ca 0.12 -0.02 -0.23 0.00 0.02 0.00 0.00 57.03 56.93 1luz h ASP 56 Cb 0.30 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 1luz h ASP 56 CO 0.00 0.39 -1.17 0.07 -1.72 0.00 0.00 179.24 176.81 1luz h LYS 57 N 0.61 0.00 0.00 3.56 2.10 -0.97 -3.40 116.57 118.46 1luz h LYS 57 Ca 0.16 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 58.49 1luz h LYS 57 Cb -0.05 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 31.22 1luz h LYS 57 CO -0.03 0.86 -2.23 1.28 -2.00 0.00 0.00 179.45 177.33 1luz n LEU 58 N -3.27 0.00 -4.66 7.07 4.77 -0.58 -4.84 117.00 115.49 1luz n LEU 58 Ca -0.04 0.00 -0.47 0.00 -0.03 0.00 0.00 56.01 55.47 1luz n LEU 58 Cb 0.96 0.44 -0.04 0.00 -2.33 0.00 0.00 43.42 42.45 1luz n LEU 58 CO 0.46 0.44 1.20 0.52 -1.33 0.00 0.00 177.39 178.68 1luz n VAL 59 N -2.66 0.07 0.00 4.08 0.31 -0.39 -0.97 118.33 118.77 1luz n VAL 59 Ca -0.29 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 1luz n VAL 59 Cb 1.08 -1.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.51 1luz n VAL 59 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1luz n GLY 60 N 3.44 2.39 3.85 2.92 0.00 0.19 -4.99 105.19 112.99 1luz n GLY 60 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1luz n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1luz s LYS 61 N -0.43 4.02 -0.12 1.61 -0.14 -0.14 -4.76 119.74 119.77 1luz s LYS 61 Ca 0.00 0.73 -0.18 0.00 -1.36 0.00 0.00 55.97 55.16 1luz s LYS 61 Cb 0.00 -2.38 -0.04 0.00 -1.68 0.00 0.00 37.83 33.73 1luz s LYS 61 CO 0.00 0.10 0.47 0.99 -0.76 0.00 0.00 175.35 176.15 1luz s THR 62 N -2.06 5.19 0.21 2.17 2.01 -1.26 -1.31 115.64 120.59 1luz s THR 62 Ca 0.55 0.94 -0.00 0.00 0.31 0.00 0.00 61.69 63.49 1luz s THR 62 Cb -0.10 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.56 1luz s THR 62 CO 0.18 0.32 0.13 0.68 -0.69 0.00 0.00 174.62 175.24 1luz s VAL 63 N 0.68 0.05 -0.12 3.82 -7.23 -0.10 -1.35 120.40 116.16 1luz s VAL 63 Ca 0.26 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.40 1luz s VAL 63 Cb -0.15 -2.51 -0.03 0.00 0.56 0.00 0.00 36.38 34.25 1luz s VAL 63 CO 0.10 0.00 -0.02 -0.54 -0.31 0.00 0.00 175.10 174.33 1luz s LYS 64 N -4.12 3.32 0.17 4.82 1.02 0.08 -1.72 119.74 123.31 1luz s LYS 64 Ca 0.39 -0.48 0.06 0.00 0.02 0.00 0.00 55.97 55.97 1luz s LYS 64 Cb 0.07 -2.84 -0.04 0.00 -0.52 0.00 0.00 37.83 34.49 1luz s LYS 64 CO 0.13 0.46 -0.13 0.14 -0.92 0.00 0.00 175.35 175.03 1luz s VAL 65 N -0.23 1.50 -0.18 3.17 -7.23 0.26 -1.21 120.40 116.48 1luz s VAL 65 Ca 0.05 -2.06 -0.06 0.00 -1.81 0.00 0.00 61.98 58.10 1luz s VAL 65 Cb -0.13 -1.88 -0.03 0.00 0.56 0.00 0.00 36.38 34.90 1luz s VAL 65 CO 0.02 -0.59 0.03 -0.75 -0.31 0.00 0.00 175.10 173.51 1luz s LYS 66 N -3.43 3.83 -0.01 4.82 2.20 0.29 -1.35 119.74 126.10 1luz s LYS 66 Ca 0.18 -0.42 -0.30 0.00 -0.36 0.00 0.00 55.97 55.06 1luz s LYS 66 Cb -0.01 -3.13 -0.04 0.00 -1.51 0.00 0.00 37.83 33.14 1luz s LYS 66 CO 0.04 0.20 1.16 0.08 -0.36 0.00 0.00 175.35 176.46 1luz s VAL 67 N 0.55 4.29 -0.12 4.02 1.01 0.04 -1.21 120.40 128.97 1luz s VAL 67 Ca 0.01 1.63 0.02 0.00 0.00 0.00 0.00 61.98 63.64 1luz s VAL 67 Cb -0.13 -4.05 -0.09 0.00 0.00 0.00 0.00 36.38 32.11 1luz s VAL 67 CO 0.02 0.07 -0.08 2.30 0.00 0.00 0.00 175.10 177.40 1luz n ILE 68 N 4.24 0.70 -3.77 2.22 -5.35 -0.31 0.08 119.36 117.16 1luz n ILE 68 Ca 0.09 -0.29 -0.13 0.00 -0.27 0.00 0.00 62.75 62.15 1luz n ILE 68 Cb 0.47 -0.90 -0.12 0.00 -1.74 0.00 0.00 39.64 37.35 1luz n ILE 68 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1luz s ARG 69 N -2.24 0.26 -0.14 6.28 3.52 -1.07 -4.84 118.95 120.72 1luz s ARG 69 Ca -0.15 0.39 0.01 0.00 -0.13 0.00 0.00 55.73 55.86 1luz s ARG 69 Cb 0.04 0.06 0.02 0.00 -1.56 0.00 0.00 34.95 33.51 1luz s ARG 69 CO 0.30 -0.07 -0.17 0.08 -0.81 0.00 0.00 175.30 174.63 1luz s VAL 70 N 0.45 1.74 -0.55 7.11 1.01 -1.26 -0.62 120.40 128.29 1luz s VAL 70 Ca -0.03 -0.76 -0.00 0.00 0.00 0.00 0.00 61.98 61.19 1luz s VAL 70 Cb -0.04 -1.58 0.14 0.00 0.00 0.00 0.00 36.38 34.90 1luz s VAL 70 CO -0.02 0.49 0.33 -0.62 0.00 0.00 0.00 175.10 175.27 1luz s ASP 71 N 1.14 4.91 0.25 3.32 -1.08 0.04 -4.92 116.67 120.33 1luz s ASP 71 Ca -0.01 -2.76 0.25 0.00 -0.52 0.00 0.00 52.55 49.50 1luz s ASP 71 Cb -0.14 -1.77 0.93 0.00 -1.46 0.00 0.00 42.92 40.48 1luz s ASP 71 CO -0.06 -0.35 1.74 0.00 0.52 0.00 0.00 175.17 177.02 1luz n TYR 72 N 3.55 0.87 -0.03 -5.34 0.18 -1.26 -0.45 117.16 114.68 1luz n TYR 72 Ca 0.05 0.31 -0.16 0.00 1.88 0.00 0.00 57.90 59.98 1luz n TYR 72 Cb 0.37 -1.00 -0.09 0.00 -0.38 0.00 0.00 39.34 38.24 1luz n TYR 72 CO 0.00 0.00 0.00 1.15 -2.08 0.00 0.00 176.86 175.93 1luz h THR 73 N 0.00 1.38 0.00 -3.48 2.02 -1.94 -3.30 112.91 107.58 1luz h THR 73 Ca 0.00 -1.81 0.00 0.00 0.77 0.00 0.00 66.41 65.37 1luz h THR 73 Cb 0.50 2.23 0.00 0.00 -1.74 0.00 0.00 68.15 69.14 1luz h THR 73 CO 0.00 0.54 -0.98 0.29 0.37 0.00 0.00 175.52 175.74 1luz n LYS 74 N -4.27 0.19 -2.75 6.66 5.02 -1.16 -4.99 118.16 116.85 1luz n LYS 74 Ca -0.08 -0.01 -0.06 0.00 -2.02 0.00 0.00 58.31 56.14 1luz n LYS 74 Cb 0.58 -1.55 0.02 0.00 -0.02 0.00 0.00 35.03 34.06 1luz n LYS 74 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1luz n GLY 75 N 1.42 0.58 3.25 0.72 0.00 0.40 -4.96 105.19 106.60 1luz n GLY 75 Ca 0.03 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 45.34 1luz n GLY 75 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1luz s TYR 76 N -3.08 1.84 -0.05 1.61 2.02 -0.62 -1.61 117.35 117.46 1luz s TYR 76 Ca 0.14 -0.37 0.02 0.00 -0.37 0.00 0.00 57.07 56.48 1luz s TYR 76 Cb -0.06 -1.10 0.02 0.00 -0.40 0.00 0.00 41.96 40.41 1luz s TYR 76 CO 0.18 0.08 -0.08 0.42 -1.57 0.00 0.00 175.55 174.58 1luz s ILE 77 N -0.78 0.83 -0.19 2.71 -1.09 0.56 -0.78 121.20 122.47 1luz s ILE 77 Ca 0.08 -0.31 -0.09 0.00 -2.23 0.00 0.00 60.65 58.10 1luz s ILE 77 Cb -0.09 -0.78 -0.05 0.00 -1.58 0.00 0.00 42.46 39.96 1luz s ILE 77 CO 0.02 0.28 0.11 -1.81 -1.23 0.00 0.00 174.94 172.31 1luz s ASP 78 N 0.70 6.07 0.24 3.58 1.01 0.21 -1.12 116.67 127.35 1luz s ASP 78 Ca -0.12 0.21 0.01 0.00 0.71 0.00 0.00 52.55 53.36 1luz s ASP 78 Cb -0.14 -2.05 -0.05 0.00 1.01 0.00 0.00 42.92 41.69 1luz s ASP 78 CO 0.02 0.20 0.09 0.68 0.21 0.00 0.00 175.17 176.37 1luz s VAL 79 N 0.23 0.49 -0.06 -1.27 -7.23 -0.28 -1.16 120.40 111.11 1luz s VAL 79 Ca 0.07 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.28 1luz s VAL 79 Cb -0.11 -2.54 0.01 0.00 0.56 0.00 0.00 36.38 34.29 1luz s VAL 79 CO -0.01 -0.07 -0.14 0.20 -0.31 0.00 0.00 175.10 174.77 1luz s ASN 80 N -3.27 1.92 0.34 4.85 0.01 -0.35 -1.38 114.94 117.05 1luz s ASN 80 Ca 0.36 -0.32 -0.29 0.00 -0.71 0.00 0.00 52.86 51.90 1luz s ASN 80 Cb 0.07 -0.78 -0.11 0.00 0.41 0.00 0.00 41.25 40.84 1luz s ASN 80 CO 0.12 0.07 1.40 -0.47 -1.51 0.00 0.00 177.10 176.71 1luz s TYR 81 N 0.47 2.85 0.01 2.20 5.04 -1.26 -0.54 117.35 126.11 1luz s TYR 81 Ca -0.12 1.26 -0.04 0.00 -2.44 0.00 0.00 57.07 55.72 1luz s TYR 81 Cb -0.14 -3.84 -0.02 0.00 0.35 0.00 0.00 41.96 38.30 1luz s TYR 81 CO 0.04 -2.45 -0.09 1.63 -1.34 0.00 0.00 175.55 173.33 1luz n LYS 82 N 0.87 0.14 0.00 4.97 4.76 -0.35 -4.84 118.16 123.70 1luz n LYS 82 Ca 0.01 0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.51 1luz n LYS 82 Cb 0.40 -0.74 0.00 0.00 -1.84 0.00 0.00 35.03 32.85 1luz n LYS 82 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 1luz n ARG 83 N -3.65 0.00 -4.88 1.97 1.85 -1.14 -5.01 116.66 105.80 1luz n ARG 83 Ca -0.06 0.00 -0.33 0.00 -1.00 0.00 0.00 57.85 56.46 1luz n ARG 83 Cb 0.24 0.00 -0.14 0.00 -1.05 0.00 0.00 32.46 31.51 1luz n ARG 83 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1luz h ARG 86 N 5.82 0.09 -4.39 0.00 2.43 -2.02 -3.31 114.38 112.99 1luz h ARG 86 Ca -0.39 -0.01 -0.73 0.00 -0.81 0.00 0.00 59.98 58.05 1luz h ARG 86 Cb 1.17 -0.02 -0.22 0.00 -0.42 0.00 0.00 29.97 30.49 1luz h ARG 86 CO 0.52 0.06 -0.30 -1.01 -1.51 0.00 0.00 179.97 177.72 1luz s HIS 87 N -6.18 3.22 -2.00 2.20 3.76 -1.26 -5.21 115.29 109.82 1luz s HIS 87 Ca -0.14 -0.85 0.18 0.00 -0.15 0.00 0.00 55.06 54.10 1luz s HIS 87 Cb 0.16 -3.15 1.04 0.00 1.11 0.00 0.00 32.58 31.75 1luz s HIS 87 CO 0.72 -0.80 1.45 0.94 -0.85 0.00 0.00 174.74 176.20