#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z8r h PRO 2 N 0.00 0.47 0.00 1.61 0.11 -2.08 -3.44 132.00 128.66 1z8r h PRO 2 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1z8r h PRO 2 Cb 0.00 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.00 1z8r h PRO 2 CO 0.00 0.31 0.00 0.98 -0.21 0.00 0.00 178.00 179.08 1z8r n TYR 3 N -4.55 -2.41 -2.74 0.65 4.19 -1.26 -5.04 117.16 106.00 1z8r n TYR 3 Ca 0.20 0.30 -0.43 0.00 3.31 0.00 0.00 57.90 61.28 1z8r n TYR 3 Cb 0.66 1.05 -0.00 0.00 0.49 0.00 0.00 39.34 41.54 1z8r n TYR 3 CO 0.00 0.00 0.00 0.20 0.91 0.00 0.00 176.86 177.97 1z8r s GLY 4 N -1.24 1.93 0.35 2.98 0.00 -1.26 -4.95 107.32 105.13 1z8r s GLY 4 Ca 0.00 -3.03 0.09 0.00 0.00 0.00 0.00 44.72 41.78 1z8r s GLY 4 CO 0.00 2.42 -0.05 -2.38 0.00 0.00 0.00 173.10 173.08 1z8r s HIS 5 N 3.15 2.45 -0.51 1.90 -3.43 -1.26 -5.04 115.29 112.56 1z8r s HIS 5 Ca 0.48 -0.51 0.04 0.00 -0.80 0.00 0.00 55.06 54.26 1z8r s HIS 5 Cb 0.01 -1.47 0.16 0.00 -1.43 0.00 0.00 32.58 29.85 1z8r s HIS 5 CO 0.02 0.54 0.37 -0.65 -2.00 0.00 0.00 174.74 173.02 1z8r s GLN 6 N -3.65 1.44 0.08 -0.38 -0.21 -1.26 -5.10 119.66 110.58 1z8r s GLN 6 Ca 0.33 -2.47 0.10 0.00 0.02 0.00 0.00 55.36 53.34 1z8r s GLN 6 Cb 0.03 -2.17 -0.03 0.00 1.00 0.00 0.00 33.01 31.83 1z8r s GLN 6 CO 0.17 -1.32 -0.25 0.45 -2.12 0.00 0.00 175.29 172.22 1z8r s SER 7 N -0.36 3.33 0.00 5.90 0.15 -1.26 -4.82 113.70 116.64 1z8r s SER 7 Ca 0.28 -0.63 0.00 0.00 0.70 0.00 0.00 55.95 56.30 1z8r s SER 7 Cb -0.03 -0.31 0.00 0.00 -1.71 0.00 0.00 66.02 63.96 1z8r s SER 7 CO -0.16 0.23 0.00 0.61 1.20 0.00 0.00 173.24 175.12 1z8r n GLY 8 N 1.39 4.31 3.81 9.45 0.00 -1.26 -5.05 105.19 117.84 1z8r n GLY 8 Ca -0.17 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 44.87 1z8r n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z8r s ALA 9 N 0.00 4.20 -0.33 4.61 0.00 -1.26 -4.61 121.76 124.37 1z8r s ALA 9 Ca 0.00 -0.76 -0.02 0.00 0.00 0.00 0.00 51.96 51.18 1z8r s ALA 9 Cb 0.00 -0.25 0.07 0.00 0.00 0.00 0.00 23.12 22.94 1z8r s ALA 9 CO 0.00 -0.17 0.05 0.08 0.00 0.00 0.00 175.76 175.72 1z8r s VAL 10 N -2.83 3.04 -0.33 0.00 1.01 -0.96 -4.97 120.40 115.36 1z8r s VAL 10 Ca 0.17 -1.59 -0.15 0.00 0.00 0.00 0.00 61.98 60.41 1z8r s VAL 10 Cb 0.00 -2.85 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 1z8r s VAL 10 CO 0.10 -0.27 0.38 -0.47 0.00 0.00 0.00 175.10 174.84 1z8r s TYR 11 N 1.21 3.21 -0.24 5.22 6.14 -1.26 -1.71 117.35 129.92 1z8r s TYR 11 Ca -0.01 0.08 0.02 0.00 0.64 0.00 0.00 57.07 57.81 1z8r s TYR 11 Cb -0.20 -2.68 0.05 0.00 0.42 0.00 0.00 41.96 39.55 1z8r s TYR 11 CO -0.02 -0.40 -0.12 0.08 0.64 0.00 0.00 175.55 175.73 1z8r s VAL 12 N 2.07 2.05 0.00 3.14 1.01 0.52 -3.78 120.40 125.40 1z8r s VAL 12 Ca 0.13 -1.46 0.00 0.00 0.00 0.00 0.00 61.98 60.65 1z8r s VAL 12 Cb -0.16 -2.13 0.00 0.00 0.00 0.00 0.00 36.38 34.09 1z8r s VAL 12 CO 0.12 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.88 1z8r n GLY 13 N 4.50 3.22 1.07 4.51 0.00 -1.26 -0.32 105.19 116.91 1z8r n GLY 13 Ca -0.15 0.06 0.04 0.00 0.00 0.00 0.00 46.02 45.97 1z8r n GLY 13 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1z8r n ASN 14 N 4.16 3.02 -4.14 1.61 0.23 -1.26 -4.32 115.26 114.56 1z8r n ASN 14 Ca 0.00 -2.35 -0.20 0.00 -0.53 0.00 0.00 54.58 51.50 1z8r n ASN 14 Cb 0.00 -0.51 -0.13 0.00 -2.08 0.00 0.00 39.78 37.06 1z8r n ASN 14 CO 0.00 0.00 0.00 -0.31 -0.93 0.00 0.00 177.26 176.02 1z8r s TYR 15 N -1.79 1.20 -0.12 -2.53 2.02 0.57 -1.90 117.35 114.80 1z8r s TYR 15 Ca 0.27 -0.35 -0.03 0.00 -0.37 0.00 0.00 57.07 56.59 1z8r s TYR 15 Cb 0.19 -0.72 0.04 0.00 -0.40 0.00 0.00 41.96 41.08 1z8r s TYR 15 CO 0.10 0.03 0.04 0.21 -1.57 0.00 0.00 175.55 174.36 1z8r s LYS 16 N -1.10 0.38 -0.26 -0.62 2.36 0.24 -0.35 119.74 120.38 1z8r s LYS 16 Ca 0.01 -0.04 -0.10 0.00 -2.55 0.00 0.00 55.97 53.29 1z8r s LYS 16 Cb -0.08 -1.42 -0.05 0.00 -1.05 0.00 0.00 37.83 35.23 1z8r s LYS 16 CO 0.01 -0.49 0.16 0.14 1.55 0.00 0.00 175.35 176.72 1z8r s VAL 17 N 2.01 5.12 0.11 4.02 -7.23 -0.69 -1.98 120.40 121.76 1z8r s VAL 17 Ca 0.03 0.10 0.01 0.00 -1.81 0.00 0.00 61.98 60.31 1z8r s VAL 17 Cb -0.14 -3.42 -0.04 0.00 0.56 0.00 0.00 36.38 33.33 1z8r s VAL 17 CO -0.07 0.29 -0.04 0.54 -0.31 0.00 0.00 175.10 175.52 1z8r s VAL 18 N 1.54 0.56 0.40 1.32 0.11 -0.92 -2.27 120.40 121.14 1z8r s VAL 18 Ca 0.07 -1.92 -0.27 0.00 -2.93 0.00 0.00 61.98 56.93 1z8r s VAL 18 Cb -0.15 -1.77 -0.10 0.00 -1.53 0.00 0.00 36.38 32.82 1z8r s VAL 18 CO 0.08 -0.78 1.42 -3.20 -3.33 0.00 0.00 175.10 169.30 1z8r n ASN 19 N -0.06 3.39 -0.12 3.54 5.15 -1.26 -2.28 115.26 123.62 1z8r n ASN 19 Ca -0.11 1.18 -0.06 0.00 -0.60 0.00 0.00 54.58 54.99 1z8r n ASN 19 Cb 0.62 -1.59 0.02 0.00 -0.53 0.00 0.00 39.78 38.30 1z8r n ASN 19 CO 0.00 0.00 0.00 0.08 1.40 0.00 0.00 177.26 178.74 1z8r h ARG 20 N 2.60 0.29 0.00 1.20 -0.00 -0.08 0.22 114.38 118.61 1z8r h ARG 20 Ca -0.50 -0.02 0.00 0.00 -0.00 0.00 0.00 59.98 59.46 1z8r h ARG 20 Cb 1.26 -0.07 0.00 0.00 -0.00 0.00 0.00 29.97 31.17 1z8r h ARG 20 CO 0.62 0.19 0.00 1.58 -0.00 0.00 0.00 179.97 182.37 1z8r n HIS 21 N -5.01 0.00 0.17 4.08 -0.00 -1.26 -2.12 115.22 111.08 1z8r n HIS 21 Ca 0.02 0.00 0.03 0.00 0.46 0.00 0.00 57.72 58.23 1z8r n HIS 21 Cb 0.13 -0.48 0.04 0.00 -0.12 0.00 0.00 29.99 29.56 1z8r n HIS 21 CO 0.00 0.00 0.00 -0.11 0.46 0.00 0.00 176.34 176.69 1z8r n LEU 22 N -1.48 1.68 -4.73 0.27 7.94 0.21 -5.01 117.00 115.89 1z8r n LEU 22 Ca 0.03 -1.21 -0.39 0.00 -1.11 0.00 0.00 56.01 53.33 1z8r n LEU 22 Cb 0.13 -0.02 -0.05 0.00 0.53 0.00 0.00 43.42 44.00 1z8r n LEU 22 CO 0.10 0.37 0.35 0.00 -1.11 0.00 0.00 177.39 177.10 1z8r s ALA 23 N -0.58 3.40 0.77 1.96 0.00 0.53 -4.82 121.76 123.01 1z8r s ALA 23 Ca 0.08 0.08 -0.11 0.00 0.00 0.00 0.00 51.96 52.01 1z8r s ALA 23 Cb 0.05 -2.86 0.05 0.00 0.00 0.00 0.00 23.12 20.36 1z8r s ALA 23 CO 0.07 0.00 1.09 0.95 0.00 0.00 0.00 175.76 177.87 1z8r s THR 24 N 0.42 3.33 0.54 0.00 -4.23 -1.26 -4.84 115.64 109.60 1z8r s THR 24 Ca 0.34 0.43 0.27 0.00 -1.18 0.00 0.00 61.69 61.56 1z8r s THR 24 Cb -0.18 -3.16 0.42 0.00 1.34 0.00 0.00 72.50 70.92 1z8r s THR 24 CO 0.17 -0.57 1.97 1.12 -0.54 0.00 0.00 174.62 176.78 1z8r h HIS 25 N -1.00 0.00 -0.15 3.99 2.07 -1.99 0.31 115.15 118.38 1z8r h HIS 25 Ca -0.46 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 56.95 1z8r h HIS 25 Cb 1.25 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.22 1z8r h HIS 25 CO 0.51 0.00 -0.38 0.28 -3.07 0.00 0.00 177.93 175.27 1z8r h VAL 26 N 0.00 1.30 -0.30 6.12 2.07 -1.98 0.28 116.25 123.73 1z8r h VAL 26 Ca 0.29 -1.46 -0.08 0.00 0.82 0.00 0.00 66.70 66.27 1z8r h VAL 26 Cb 1.18 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 32.54 1z8r h VAL 26 CO -0.00 0.44 -0.12 0.44 0.02 0.00 0.00 177.57 178.35 1z8r h ASP 27 N 0.27 0.63 0.70 0.57 3.32 -0.74 -2.57 116.42 118.60 1z8r h ASP 27 Ca 0.03 -0.39 -0.15 0.00 0.02 0.00 0.00 57.03 56.54 1z8r h ASP 27 Cb 0.79 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 1z8r h ASP 27 CO 0.06 0.88 -0.69 -0.50 -1.72 0.00 0.00 179.24 177.27 1z8r h TRP 28 N 0.38 0.00 -0.56 4.55 4.06 -1.30 0.23 115.95 123.31 1z8r h TRP 28 Ca 0.07 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 61.02 1z8r h TRP 28 Cb 0.63 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.76 1z8r h TRP 28 CO 0.06 0.69 0.34 0.37 -3.56 0.00 0.00 178.44 176.34 1z8r h GLN 29 N 0.00 0.76 -0.44 0.49 5.75 -0.27 -2.95 115.11 118.44 1z8r h GLN 29 Ca -0.01 -0.07 -0.29 0.00 -0.15 0.00 0.00 58.65 58.13 1z8r h GLN 29 Cb 1.23 -0.16 -0.20 0.00 1.07 0.00 0.00 27.48 29.43 1z8r h GLN 29 CO 0.09 0.55 -0.33 -1.71 -2.65 0.00 0.00 178.83 174.78 1z8r n ASN 30 N -4.64 3.47 -4.68 -0.69 2.85 -0.98 -5.03 115.26 105.56 1z8r n ASN 30 Ca 0.03 -3.81 -0.42 0.00 -0.11 0.00 0.00 54.58 50.27 1z8r n ASN 30 Cb 0.06 -0.55 -0.03 0.00 1.24 0.00 0.00 39.78 40.50 1z8r n ASN 30 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1z8r h VAL 32 N 5.20 0.88 -4.01 0.00 -1.51 0.71 -3.48 116.25 114.04 1z8r h VAL 32 Ca -0.34 -2.48 -0.17 0.00 -1.23 0.00 0.00 66.70 62.48 1z8r h VAL 32 Cb 1.15 2.73 -0.20 0.00 -2.13 0.00 0.00 31.29 32.83 1z8r h VAL 32 CO 0.92 0.87 -0.70 0.86 -1.23 0.00 0.00 177.57 178.29 1z8r s TRP 33 N -2.58 0.30 -0.24 5.19 -0.00 -1.04 -4.97 118.94 115.61 1z8r s TRP 33 Ca -0.17 -0.59 -0.06 0.00 -0.00 0.00 0.00 56.10 55.28 1z8r s TRP 33 Cb 0.06 -0.22 0.12 0.00 -0.00 0.00 0.00 33.47 33.43 1z8r s TRP 33 CO 0.84 -0.21 0.49 -1.21 -0.00 0.00 0.00 176.95 176.86 1z8r s GLU 34 N -1.75 0.42 -0.35 5.86 2.02 -1.26 0.71 118.70 124.34 1z8r s GLU 34 Ca -0.13 1.01 -0.08 0.00 0.02 0.00 0.00 54.97 55.79 1z8r s GLU 34 Cb -0.08 0.30 0.03 0.00 0.10 0.00 0.00 34.13 34.49 1z8r s GLU 34 CO -0.02 -0.38 0.15 -0.51 0.02 0.00 0.00 175.26 174.52 1z8r s ASP 35 N 2.70 5.49 0.42 -0.19 1.01 0.16 -4.96 116.67 121.30 1z8r s ASP 35 Ca 0.04 -1.06 0.14 0.00 0.71 0.00 0.00 52.55 52.38 1z8r s ASP 35 Cb -0.13 -1.94 0.90 0.00 1.01 0.00 0.00 42.92 42.76 1z8r s ASP 35 CO -0.16 -0.35 1.93 0.22 0.21 0.00 0.00 175.17 177.02 1z8r h TYR 36 N 8.31 0.00 0.00 4.23 3.20 -1.96 0.15 116.97 130.90 1z8r h TYR 36 Ca -0.24 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.59 1z8r h TYR 36 Cb 1.09 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.36 1z8r h TYR 36 CO 0.58 0.26 -0.15 -0.91 -1.64 0.00 0.00 178.16 176.30 1z8r h ASN 37 N 0.00 0.00 -0.06 -2.11 -0.26 -1.92 -2.74 115.58 108.49 1z8r h ASN 37 Ca -0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1z8r h ASN 37 Cb 0.45 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.71 1z8r h ASN 37 CO 0.03 0.15 0.00 -2.11 -1.06 0.00 0.00 177.43 174.44 1z8r n ARG 38 N -4.05 1.78 -4.08 0.81 1.85 -0.90 0.89 116.66 112.96 1z8r n ARG 38 Ca -0.02 -1.32 -0.31 0.00 -1.00 0.00 0.00 57.85 55.20 1z8r n ARG 38 Cb 0.23 -1.07 -0.02 0.00 -1.05 0.00 0.00 32.46 30.55 1z8r n ARG 38 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1z8r n ASP 39 N -0.10 -1.83 -4.13 2.89 8.00 0.46 -4.87 116.55 116.98 1z8r n ASP 39 Ca 0.03 -1.01 -0.15 0.00 0.71 0.00 0.00 54.79 54.37 1z8r n ASP 39 Cb 0.22 -2.91 -0.11 0.00 -0.02 0.00 0.00 41.12 38.29 1z8r n ASP 39 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1z8r s LEU 40 N -7.14 2.30 0.05 0.64 2.96 -0.85 0.67 118.68 117.31 1z8r s LEU 40 Ca 0.36 -0.64 -0.11 0.00 -0.22 0.00 0.00 54.13 53.52 1z8r s LEU 40 Cb -0.20 -0.34 0.01 0.00 0.50 0.00 0.00 46.19 46.17 1z8r s LEU 40 CO 0.91 -0.17 0.25 -1.48 -1.32 0.00 0.00 176.35 174.54 1z8r s LEU 41 N -1.84 1.13 -0.09 -0.68 -0.00 -0.97 0.38 118.68 116.61 1z8r s LEU 41 Ca -0.03 -0.33 0.04 0.00 -0.00 0.00 0.00 54.13 53.81 1z8r s LEU 41 Cb -0.08 1.17 -0.01 0.00 -0.00 0.00 0.00 46.19 47.26 1z8r s LEU 41 CO 0.01 -0.61 -0.21 -0.69 -0.00 0.00 0.00 176.35 174.85 1z8r s VAL 42 N -2.77 2.40 0.20 1.48 1.01 0.22 -2.16 120.40 120.78 1z8r s VAL 42 Ca -0.03 -0.92 0.09 0.00 0.00 0.00 0.00 61.98 61.12 1z8r s VAL 42 Cb -0.00 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 1z8r s VAL 42 CO -0.05 0.56 -0.18 -0.55 0.00 0.00 0.00 175.10 174.87 1z8r s SER 43 N 0.09 2.91 -0.19 3.32 0.15 -0.84 0.12 113.70 119.28 1z8r s SER 43 Ca -0.10 -0.93 -0.12 0.00 0.70 0.00 0.00 55.95 55.50 1z8r s SER 43 Cb -0.16 -0.19 -0.05 0.00 -1.71 0.00 0.00 66.02 63.92 1z8r s SER 43 CO 0.06 -0.03 0.23 0.42 1.20 0.00 0.00 173.24 175.12 1z8r s THR 44 N -2.29 5.34 0.36 6.45 -4.23 -1.16 -0.60 115.64 119.51 1z8r s THR 44 Ca 0.20 0.40 0.08 0.00 -1.18 0.00 0.00 61.69 61.19 1z8r s THR 44 Cb -0.05 -3.57 -0.07 0.00 1.34 0.00 0.00 72.50 70.15 1z8r s THR 44 CO 0.09 0.39 -0.04 0.28 -0.54 0.00 0.00 174.62 174.79 1z8r s THR 45 N 0.60 1.99 -0.37 3.99 -1.32 -0.80 -4.98 115.64 114.75 1z8r s THR 45 Ca 0.13 -2.11 0.05 0.00 -1.21 0.00 0.00 61.69 58.56 1z8r s THR 45 Cb -0.13 -2.76 0.46 0.00 -1.51 0.00 0.00 72.50 68.57 1z8r s THR 45 CO 0.02 -0.13 1.41 0.41 -2.21 0.00 0.00 174.62 174.13 1z8r n THR 46 N -0.82 2.77 -3.54 5.08 -1.04 -1.26 -4.61 114.28 110.85 1z8r n THR 46 Ca -0.05 -3.75 0.00 0.00 -2.04 0.00 0.00 64.05 58.21 1z8r n THR 46 Cb 0.65 -1.03 0.00 0.00 -1.82 0.00 0.00 70.33 68.13 1z8r n THR 46 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1z8r n ALA 47 N -0.81 0.00 -2.86 2.41 0.00 -1.26 -5.14 120.51 112.85 1z8r n ALA 47 Ca 0.46 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.56 1z8r n ALA 47 Cb 0.90 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.29 1z8r n ALA 47 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1z8r s HIS 48 N -0.12 3.46 -0.17 0.00 3.76 -1.26 -4.73 115.29 116.23 1z8r s HIS 48 Ca 0.00 0.33 -0.06 0.00 -0.15 0.00 0.00 55.06 55.19 1z8r s HIS 48 Cb 0.00 -1.82 -0.03 0.00 1.11 0.00 0.00 32.58 31.84 1z8r s HIS 48 CO 0.00 0.63 0.01 0.20 -0.85 0.00 0.00 174.74 174.73 1z8r s GLY 49 N -1.70 1.81 -0.07 -2.22 0.00 -1.26 -4.83 107.32 99.05 1z8r s GLY 49 Ca 0.24 -0.80 0.05 0.00 0.00 0.00 0.00 44.72 44.21 1z8r s GLY 49 CO 0.14 0.01 0.00 0.00 0.00 0.00 0.00 173.10 173.26 1z8r s ASP 51 N -3.99 6.92 -0.21 0.00 1.01 -1.25 -5.02 116.67 114.13 1z8r s ASP 51 Ca -0.05 2.37 0.01 0.00 0.71 0.00 0.00 52.55 55.59 1z8r s ASP 51 Cb 0.02 -2.61 0.03 0.00 1.01 0.00 0.00 42.92 41.37 1z8r s ASP 51 CO 0.25 -0.51 -0.15 -0.89 0.21 0.00 0.00 175.17 174.07 1z8r s THR 52 N 0.17 2.26 0.25 -1.27 2.01 -1.26 -4.67 115.64 113.12 1z8r s THR 52 Ca 0.57 -1.08 -0.30 0.00 0.31 0.00 0.00 61.69 61.19 1z8r s THR 52 Cb -0.36 -2.06 -0.09 0.00 0.01 0.00 0.00 72.50 70.00 1z8r s THR 52 CO 0.37 0.37 1.05 -0.63 -0.69 0.00 0.00 174.62 175.09 1z8r s ILE 53 N 1.26 3.73 -0.55 1.82 1.01 -1.26 0.50 121.20 127.71 1z8r s ILE 53 Ca 0.01 1.71 -0.18 0.00 0.00 0.00 0.00 60.65 62.19 1z8r s ILE 53 Cb -0.15 -4.09 0.10 0.00 0.01 0.00 0.00 42.46 38.33 1z8r s ILE 53 CO -0.10 0.39 0.60 0.00 0.00 0.00 0.00 174.94 175.84 1z8r s ALA 54 N -1.05 3.49 -1.49 9.38 0.00 0.17 -4.27 121.76 127.98 1z8r s ALA 54 Ca 0.44 -2.21 -0.10 0.00 0.00 0.00 0.00 51.96 50.09 1z8r s ALA 54 Cb -0.30 -3.38 -0.10 0.00 0.00 0.00 0.00 23.12 19.34 1z8r s ALA 54 CO 0.37 -2.14 3.01 -2.13 0.00 0.00 0.00 175.76 174.88 1z8r n ARG 55 N 5.90 3.59 -4.45 0.00 3.00 -1.26 -4.74 116.66 118.70 1z8r n ARG 55 Ca -0.10 -2.12 -0.24 0.00 -0.00 0.00 0.00 57.85 55.38 1z8r n ARG 55 Cb 0.42 -2.73 -0.10 0.00 0.00 0.00 0.00 32.46 30.05 1z8r n ARG 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1z8r n GLN 57 N -0.44 4.07 -1.69 0.00 0.00 -1.26 -4.97 117.38 113.09 1z8r n GLN 57 Ca -0.07 -2.61 -0.44 0.00 -0.00 0.00 0.00 57.00 53.88 1z8r n GLN 57 Cb 0.59 -2.07 -0.04 0.00 0.00 0.00 0.00 30.24 28.73 1z8r n GLN 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1z8r n THR 59 N 3.81 0.85 -4.50 0.00 -1.04 -1.26 -4.83 114.28 107.31 1z8r n THR 59 Ca 0.17 -0.66 -0.23 0.00 -2.04 0.00 0.00 64.05 61.29 1z8r n THR 59 Cb 0.32 0.14 -0.16 0.00 -1.82 0.00 0.00 70.33 68.81 1z8r n THR 59 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1z8r s THR 60 N -1.56 1.00 0.00 12.58 -4.23 -1.26 -2.20 115.64 119.98 1z8r s THR 60 Ca 0.31 -0.41 0.00 0.00 -1.18 0.00 0.00 61.69 60.41 1z8r s THR 60 Cb 0.18 -0.92 0.00 0.00 1.34 0.00 0.00 72.50 73.09 1z8r s THR 60 CO 0.18 0.32 0.00 0.61 -0.54 0.00 0.00 174.62 175.19 1z8r n GLY 61 N 3.77 3.48 2.83 3.99 0.00 -0.51 -4.73 105.19 114.02 1z8r n GLY 61 Ca -0.23 -1.00 -0.13 0.00 0.00 0.00 0.00 46.02 44.66 1z8r n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1z8r s VAL 62 N -2.45 -0.03 -0.18 1.61 0.11 -0.75 0.97 120.40 119.69 1z8r s VAL 62 Ca 0.00 0.10 -0.04 0.00 -2.93 0.00 0.00 61.98 59.11 1z8r s VAL 62 Cb 0.00 -0.04 -0.02 0.00 -1.53 0.00 0.00 36.38 34.79 1z8r s VAL 62 CO 0.00 0.04 -0.03 -0.72 -3.33 0.00 0.00 175.10 171.06 1z8r s TYR 63 N 0.48 2.99 -0.09 1.54 -0.85 0.19 -2.16 117.35 119.45 1z8r s TYR 63 Ca -0.04 -0.52 0.02 0.00 -0.52 0.00 0.00 57.07 56.00 1z8r s TYR 63 Cb -0.06 -2.02 -0.02 0.00 0.38 0.00 0.00 41.96 40.24 1z8r s TYR 63 CO -0.01 -0.23 -0.14 0.12 -1.52 0.00 0.00 175.55 173.76 1z8r s PHE 64 N 0.83 2.75 -1.55 -3.49 2.19 -1.26 0.11 117.98 117.56 1z8r s PHE 64 Ca -0.01 -0.43 0.00 0.00 0.33 0.00 0.00 56.93 56.83 1z8r s PHE 64 Cb -0.14 -1.74 0.00 0.00 -1.31 0.00 0.00 43.02 39.82 1z8r s PHE 64 CO 0.02 -0.03 0.00 0.00 1.83 0.00 0.00 175.22 177.04 1z8r n ALA 66 N 1.27 0.92 -0.03 0.00 0.00 -1.26 -3.87 120.51 117.54 1z8r n ALA 66 Ca -0.15 -0.65 -0.04 0.00 0.00 0.00 0.00 53.44 52.61 1z8r n ALA 66 Cb 0.49 -0.49 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1z8r n ALA 66 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1z8r n SER 67 N -3.95 3.57 -2.51 0.00 2.88 -1.26 -4.24 113.62 108.11 1z8r n SER 67 Ca -0.36 -0.03 -0.10 0.00 -1.33 0.00 0.00 58.87 57.06 1z8r n SER 67 Cb 0.87 0.05 -0.03 0.00 -0.75 0.00 0.00 64.21 64.35 1z8r n SER 67 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1z8r n LYS 68 N -2.58 1.00 -0.80 -1.46 4.76 -1.26 -4.08 118.16 113.73 1z8r n LYS 68 Ca -0.10 -1.29 -0.15 0.00 -2.87 0.00 0.00 58.31 53.90 1z8r n LYS 68 Cb 0.63 0.61 0.13 0.00 -1.84 0.00 0.00 35.03 34.55 1z8r n LYS 68 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1z8r n SER 69 N -1.67 3.54 -4.01 4.39 7.64 -1.26 -2.98 113.62 119.27 1z8r n SER 69 Ca -0.04 -3.04 -0.12 0.00 1.01 0.00 0.00 58.87 56.68 1z8r n SER 69 Cb 0.23 -0.72 -0.08 0.00 -1.01 0.00 0.00 64.21 62.63 1z8r n SER 69 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1z8r s LYS 70 N -2.19 1.38 0.10 1.43 3.01 -1.26 -4.82 119.74 117.39 1z8r s LYS 70 Ca 0.38 -1.58 -0.26 0.00 -1.01 0.00 0.00 55.97 53.50 1z8r s LYS 70 Cb 0.32 0.33 -0.06 0.00 -1.01 0.00 0.00 37.83 37.41 1z8r s LYS 70 CO 0.08 -0.50 0.79 -3.38 0.51 0.00 0.00 175.35 172.85 1z8r s HIS 71 N -3.98 3.81 -0.16 3.18 -3.43 -1.26 -2.48 115.29 110.96 1z8r s HIS 71 Ca 0.35 1.57 -0.01 0.00 -0.80 0.00 0.00 55.06 56.17 1z8r s HIS 71 Cb 0.04 -2.83 0.04 0.00 -1.43 0.00 0.00 32.58 28.40 1z8r s HIS 71 CO 0.13 0.35 -0.04 0.71 -2.00 0.00 0.00 174.74 173.89 1z8r s TYR 72 N -0.43 1.60 -0.08 0.38 1.51 0.30 -4.92 117.35 115.70 1z8r s TYR 72 Ca 0.39 -1.03 -0.30 0.00 -1.01 0.00 0.00 57.07 55.12 1z8r s TYR 72 Cb -0.22 -1.27 -0.04 0.00 -0.11 0.00 0.00 41.96 40.32 1z8r s TYR 72 CO 0.25 -0.60 1.50 -2.14 -1.11 0.00 0.00 175.55 173.45 1z8r s PRO 73 N 1.67 4.21 0.03 -1.71 0.02 -1.26 0.55 135.00 138.51 1z8r s PRO 73 Ca 0.01 2.00 -0.05 0.00 0.02 0.00 0.00 61.00 62.97 1z8r s PRO 73 Cb -0.15 -3.86 -0.01 0.00 0.02 0.00 0.00 34.50 30.49 1z8r s PRO 73 CO -0.08 -0.77 0.10 0.54 -0.33 0.00 0.00 177.00 176.46 1z8r s VAL 74 N 3.66 0.12 -0.12 3.83 0.11 0.27 -4.93 120.40 123.36 1z8r s VAL 74 Ca 0.66 -1.02 -0.14 0.00 -2.93 0.00 0.00 61.98 58.55 1z8r s VAL 74 Cb -0.29 -0.78 -0.05 0.00 -1.53 0.00 0.00 36.38 33.72 1z8r s VAL 74 CO 0.24 -0.56 0.34 -0.44 -3.33 0.00 0.00 175.10 171.35 1z8r s SER 75 N -1.97 6.56 0.15 3.54 0.01 -1.26 -1.42 113.70 119.31 1z8r s SER 75 Ca -0.07 0.66 0.02 0.00 1.31 0.00 0.00 55.95 57.87 1z8r s SER 75 Cb -0.03 -2.21 -0.04 0.00 0.21 0.00 0.00 66.02 63.95 1z8r s SER 75 CO -0.03 0.15 -0.02 0.72 0.41 0.00 0.00 173.24 174.47 1z8r s PHE 76 N 0.06 1.14 0.24 2.43 -0.12 -0.93 -4.34 117.98 116.45 1z8r s PHE 76 Ca 0.20 -0.99 0.09 0.00 -0.05 0.00 0.00 56.93 56.17 1z8r s PHE 76 Cb -0.14 -0.65 -0.04 0.00 -0.63 0.00 0.00 43.02 41.56 1z8r s PHE 76 CO 0.07 -0.19 0.01 -1.83 -0.05 0.00 0.00 175.22 173.23 1z8r s GLU 77 N -3.89 2.37 -0.92 1.99 -1.05 -0.94 -4.69 118.70 111.56 1z8r s GLU 77 Ca 0.21 -1.29 -0.00 0.00 -0.15 0.00 0.00 54.97 53.74 1z8r s GLU 77 Cb 0.06 -2.25 0.31 0.00 -0.44 0.00 0.00 34.13 31.80 1z8r s GLU 77 CO 0.02 0.40 1.39 0.41 0.95 0.00 0.00 175.26 178.43 1z8r n GLY 78 N -0.68 5.46 3.74 -3.83 0.00 -1.26 -2.25 105.19 106.38 1z8r n GLY 78 Ca -0.08 -2.68 -0.41 0.00 0.00 0.00 0.00 46.02 42.85 1z8r n GLY 78 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1z8r s PRO 79 N -3.29 4.33 0.00 1.61 0.04 -1.12 -4.86 135.00 131.71 1z8r s PRO 79 Ca 0.37 2.16 0.00 0.00 0.04 0.00 0.00 61.00 63.57 1z8r s PRO 79 Cb 0.14 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.51 1z8r s PRO 79 CO -0.01 -0.34 0.28 0.41 0.04 0.00 0.00 177.00 177.37 1z8r n GLY 80 N 2.44 -2.70 3.60 0.56 0.00 -1.26 -2.38 105.19 105.45 1z8r n GLY 80 Ca 0.07 0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1z8r n GLY 80 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1z8r s LEU 81 N -0.60 4.04 -0.14 0.99 1.98 -1.26 0.11 118.68 123.80 1z8r s LEU 81 Ca 0.00 0.19 0.01 0.00 -2.89 0.00 0.00 54.13 51.45 1z8r s LEU 81 Cb 0.00 -2.32 0.02 0.00 0.66 0.00 0.00 46.19 44.55 1z8r s LEU 81 CO 0.00 -0.13 -0.16 -0.69 -1.89 0.00 0.00 176.35 173.48 1z8r s VAL 82 N 1.91 1.64 -0.43 1.68 1.01 0.55 -4.97 120.40 121.79 1z8r s VAL 82 Ca 0.12 -0.70 -0.28 0.00 0.00 0.00 0.00 61.98 61.12 1z8r s VAL 82 Cb -0.16 -1.51 -0.00 0.00 0.00 0.00 0.00 36.38 34.72 1z8r s VAL 82 CO 0.10 0.47 1.58 -0.70 0.00 0.00 0.00 175.10 176.55 1z8r s GLU 83 N 1.21 3.34 -0.10 2.72 2.12 -1.26 -1.89 118.70 124.84 1z8r s GLU 83 Ca -0.01 0.97 -0.30 0.00 0.36 0.00 0.00 54.97 56.00 1z8r s GLU 83 Cb -0.14 -4.14 -0.02 0.00 0.26 0.00 0.00 34.13 30.09 1z8r s GLU 83 CO -0.06 -1.85 1.19 0.14 -0.54 0.00 0.00 175.26 174.13 1z8r s VAL 84 N 6.41 4.34 0.55 3.70 -7.23 0.65 -4.93 120.40 123.89 1z8r s VAL 84 Ca 0.66 1.64 -0.19 0.00 -1.81 0.00 0.00 61.98 62.29 1z8r s VAL 84 Cb -0.16 -4.06 -0.05 0.00 0.56 0.00 0.00 36.38 32.67 1z8r s VAL 84 CO 0.30 -0.05 1.12 -1.10 -0.31 0.00 0.00 175.10 175.07 1z8r s GLN 85 N 2.62 3.32 -0.52 4.82 -0.21 -1.26 -1.86 119.66 126.56 1z8r s GLN 85 Ca 0.54 1.58 -0.27 0.00 0.02 0.00 0.00 55.36 57.23 1z8r s GLN 85 Cb -0.23 -2.00 -0.03 0.00 1.00 0.00 0.00 33.01 31.75 1z8r s GLN 85 CO 0.18 -0.87 1.94 -2.00 -2.12 0.00 0.00 175.29 172.42 1z8r s GLU 86 N -3.36 2.71 0.16 2.91 2.12 -1.26 -4.59 118.70 117.39 1z8r s GLU 86 Ca 0.72 0.95 -0.05 0.00 0.36 0.00 0.00 54.97 56.95 1z8r s GLU 86 Cb -0.23 -4.38 -0.02 0.00 0.26 0.00 0.00 34.13 29.76 1z8r s GLU 86 CO 0.28 -2.61 0.18 -1.12 -0.54 0.00 0.00 175.26 171.45 1z8r s SER 87 N 8.30 0.16 0.00 -1.70 0.01 -0.69 -4.91 113.70 114.87 1z8r s SER 87 Ca 0.75 -1.06 0.00 0.00 1.31 0.00 0.00 55.95 56.95 1z8r s SER 87 Cb -0.16 0.38 0.00 0.00 0.21 0.00 0.00 66.02 66.45 1z8r s SER 87 CO 0.25 -0.83 0.00 1.21 0.41 0.00 0.00 173.24 174.27 1z8r n GLU 88 N -0.18 0.00 -0.68 12.44 4.07 -1.26 -0.54 120.64 134.49 1z8r n GLU 88 Ca -0.05 0.00 -0.01 0.00 -0.06 0.00 0.00 57.16 57.03 1z8r n GLU 88 Cb 0.63 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 32.00 1z8r n GLU 88 CO 0.00 0.00 0.00 2.48 -0.06 0.00 0.00 177.13 179.55 1z8r n TYR 89 N 0.00 0.00 -5.04 4.31 0.18 -1.26 -5.11 117.16 110.24 1z8r n TYR 89 Ca 0.00 -0.14 -0.29 0.00 1.88 0.00 0.00 57.90 59.35 1z8r n TYR 89 Cb 0.00 0.22 -0.16 0.00 -0.38 0.00 0.00 39.34 39.01 1z8r n TYR 89 CO 0.00 0.00 0.00 -0.47 -2.08 0.00 0.00 176.86 174.31 1z8r s TYR 90 N 0.00 2.13 0.35 -3.48 5.04 0.29 -5.13 117.35 116.55 1z8r s TYR 90 Ca 0.02 -0.72 -0.19 0.00 -2.44 0.00 0.00 57.07 53.75 1z8r s TYR 90 Cb 0.03 -1.43 -0.10 0.00 0.35 0.00 0.00 41.96 40.81 1z8r s TYR 90 CO -0.01 -0.26 0.83 -1.25 -1.34 0.00 0.00 175.55 173.52 1z8r s PRO 91 N 0.14 4.16 -1.00 4.97 0.04 -1.26 -1.70 135.00 140.35 1z8r s PRO 91 Ca -0.09 0.92 -0.15 0.00 0.04 0.00 0.00 61.00 61.71 1z8r s PRO 91 Cb -0.15 -2.41 -0.31 0.00 0.04 0.00 0.00 34.50 31.68 1z8r s PRO 91 CO 0.05 0.12 2.30 1.63 0.04 0.00 0.00 177.00 181.14 1z8r n LYS 92 N -0.28 0.01 -4.48 4.56 4.76 -1.26 -4.68 118.16 116.79 1z8r n LYS 92 Ca 0.04 -0.01 -0.29 0.00 -2.87 0.00 0.00 58.31 55.19 1z8r n LYS 92 Cb 0.53 -1.16 -0.07 0.00 -1.84 0.00 0.00 35.03 32.49 1z8r n LYS 92 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 1z8r n ARG 93 N 6.36 0.74 -4.24 1.97 3.00 -0.78 -4.96 116.66 118.76 1z8r n ARG 93 Ca 0.67 -3.47 -0.34 0.00 -0.00 0.00 0.00 57.85 54.71 1z8r n ARG 93 Cb 0.11 1.25 -0.10 0.00 0.00 0.00 0.00 32.46 33.72 1z8r n ARG 93 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 1z8r s TYR 94 N -2.85 3.15 -0.10 -0.14 1.51 -1.26 -0.25 117.35 117.41 1z8r s TYR 94 Ca 0.07 -0.03 0.01 0.00 -1.01 0.00 0.00 57.07 56.10 1z8r s TYR 94 Cb 0.00 -1.97 0.02 0.00 -0.11 0.00 0.00 41.96 39.91 1z8r s TYR 94 CO 0.05 0.16 -0.10 -0.65 -1.11 0.00 0.00 175.55 173.90 1z8r s GLN 95 N 0.07 1.66 0.24 -0.62 1.11 -0.79 -4.79 119.66 116.53 1z8r s GLN 95 Ca 0.03 -0.34 0.00 0.00 0.01 0.00 0.00 55.36 55.06 1z8r s GLN 95 Cb -0.13 -1.56 -0.04 0.00 -1.01 0.00 0.00 33.01 30.28 1z8r s GLN 95 CO 0.02 -0.15 0.42 0.45 0.01 0.00 0.00 175.29 176.04 1z8r s SER 96 N 1.27 6.36 -1.13 5.90 0.15 0.26 -0.33 113.70 126.18 1z8r s SER 96 Ca -0.03 0.36 -0.08 0.00 0.70 0.00 0.00 55.95 56.91 1z8r s SER 96 Cb -0.14 -1.99 -0.04 0.00 -1.71 0.00 0.00 66.02 62.14 1z8r s SER 96 CO -0.04 -0.10 0.87 1.57 1.20 0.00 0.00 173.24 176.74 1z8r n HIS 97 N -1.02 -2.23 -5.03 3.44 -0.00 0.31 -4.21 115.22 106.48 1z8r n HIS 97 Ca -0.05 0.78 -0.28 0.00 -0.00 0.00 0.00 57.72 58.16 1z8r n HIS 97 Cb 0.55 -4.15 -0.16 0.00 -0.00 0.00 0.00 29.99 26.23 1z8r n HIS 97 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1z8r s VAL 98 N -3.44 1.70 0.01 3.57 0.11 -1.00 -2.27 120.40 119.08 1z8r s VAL 98 Ca 0.33 -0.87 -0.01 0.00 -2.93 0.00 0.00 61.98 58.50 1z8r s VAL 98 Cb -0.07 -1.45 -0.04 0.00 -1.53 0.00 0.00 36.38 33.29 1z8r s VAL 98 CO 0.78 0.48 0.15 -0.76 -3.33 0.00 0.00 175.10 172.41 1z8r s LEU 99 N -0.07 4.17 -0.01 2.54 1.02 0.23 -2.78 118.68 123.77 1z8r s LEU 99 Ca -0.03 0.24 0.03 0.00 0.02 0.00 0.00 54.13 54.38 1z8r s LEU 99 Cb -0.12 -2.55 -0.01 0.00 0.02 0.00 0.00 46.19 43.53 1z8r s LEU 99 CO 0.03 0.24 -0.09 -0.76 0.02 0.00 0.00 176.35 175.79 1z8r s LEU 100 N -2.01 2.01 0.01 1.79 1.43 -0.95 -0.16 118.68 120.80 1z8r s LEU 100 Ca 0.27 -0.16 -0.06 0.00 -1.03 0.00 0.00 54.13 53.15 1z8r s LEU 100 Cb -0.12 -0.47 -0.00 0.00 0.03 0.00 0.00 46.19 45.63 1z8r s LEU 100 CO 0.19 0.11 0.12 0.00 0.23 0.00 0.00 176.35 177.00 1z8r s ALA 101 N -0.20 -0.24 -0.06 4.21 0.00 -0.85 -2.22 121.76 122.40 1z8r s ALA 101 Ca 0.03 -0.26 0.01 0.00 0.00 0.00 0.00 51.96 51.75 1z8r s ALA 101 Cb -0.04 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.20 1z8r s ALA 101 CO -0.00 -0.23 -0.08 -0.08 0.00 0.00 0.00 175.76 175.37 1z8r s THR 102 N -1.65 3.58 0.00 0.00 -1.32 -1.26 0.19 115.64 115.19 1z8r s THR 102 Ca -0.13 -0.53 0.00 0.00 -1.21 0.00 0.00 61.69 59.82 1z8r s THR 102 Cb -0.07 -2.45 0.00 0.00 -1.51 0.00 0.00 72.50 68.47 1z8r s THR 102 CO 0.00 0.60 0.00 0.61 -2.21 0.00 0.00 174.62 173.62 1z8r n GLY 103 N 2.23 0.12 3.37 6.08 0.00 -0.96 -4.82 105.19 111.22 1z8r n GLY 103 Ca -0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 1z8r n GLY 103 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1z8r s PHE 104 N 0.00 1.93 -0.90 1.61 0.40 -1.26 -5.08 117.98 114.69 1z8r s PHE 104 Ca 0.00 -0.46 -0.25 0.00 -0.60 0.00 0.00 56.93 55.62 1z8r s PHE 104 Cb 0.00 -0.92 0.04 0.00 0.51 0.00 0.00 43.02 42.65 1z8r s PHE 104 CO 0.00 0.44 1.39 0.45 0.70 0.00 0.00 175.22 178.19 1z8r s SER 105 N -3.02 6.33 -0.18 1.36 0.15 -1.26 -4.39 113.70 112.69 1z8r s SER 105 Ca 0.21 -1.01 -0.30 0.00 0.70 0.00 0.00 55.95 55.55 1z8r s SER 105 Cb -0.04 -2.57 0.14 0.00 -1.71 0.00 0.00 66.02 61.84 1z8r s SER 105 CO 0.09 -1.67 1.10 -1.61 1.20 0.00 0.00 173.24 172.35 1z8r s GLU 106 N 5.34 0.45 0.10 5.44 2.02 -0.49 -5.01 118.70 126.55 1z8r s GLU 106 Ca 0.42 0.04 -0.35 0.00 0.02 0.00 0.00 54.97 55.10 1z8r s GLU 106 Cb -0.04 0.21 -0.15 0.00 0.10 0.00 0.00 34.13 34.25 1z8r s GLU 106 CO 0.01 -0.16 1.56 -1.35 0.02 0.00 0.00 175.26 175.34 1z8r h PRO 107 N 2.31 -0.80 0.00 0.39 0.11 -1.82 -3.39 132.00 128.80 1z8r h PRO 107 Ca -0.15 0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.01 1z8r h PRO 107 Cb 1.18 0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.47 1z8r h PRO 107 CO 0.28 -0.54 0.00 0.41 -0.21 0.00 0.00 178.00 177.94 1z8r n GLY 108 N -1.51 2.92 1.39 -0.55 0.00 -1.26 -4.76 105.19 101.42 1z8r n GLY 108 Ca -0.10 -0.83 0.18 0.00 0.00 0.00 0.00 46.02 45.27 1z8r n GLY 108 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1z8r n ASP 109 N 0.37 -8.37 -1.02 1.61 2.03 -1.26 -4.53 116.55 105.38 1z8r n ASP 109 Ca 0.00 0.98 0.04 0.00 0.52 0.00 0.00 54.79 56.34 1z8r n ASP 109 Cb 0.00 -4.50 -0.01 0.00 -0.72 0.00 0.00 41.12 35.89 1z8r n ASP 109 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1z8r n ALA 110 N -3.28 -0.78 -3.61 -1.67 0.00 -1.26 -4.71 120.51 105.21 1z8r n ALA 110 Ca -0.04 0.10 -0.10 0.00 0.00 0.00 0.00 53.44 53.40 1z8r n ALA 110 Cb 0.65 -0.27 -0.09 0.00 0.00 0.00 0.00 19.45 19.74 1z8r n ALA 110 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1z8r s GLY 111 N -5.91 -0.48 0.00 0.00 0.00 -1.25 -4.95 107.32 94.73 1z8r s GLY 111 Ca 0.00 1.91 0.00 0.00 0.00 0.00 0.00 44.72 46.63 1z8r s GLY 111 CO 0.00 1.87 0.00 0.61 0.00 0.00 0.00 173.10 175.58 1z8r n GLY 112 N 3.78 5.22 3.23 0.20 0.00 -1.25 -4.55 105.19 111.82 1z8r n GLY 112 Ca -0.19 -1.50 -0.24 0.00 0.00 0.00 0.00 46.02 44.10 1z8r n GLY 112 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1z8r s ILE 113 N -0.98 1.54 -0.38 -0.61 -4.36 -1.26 0.19 121.20 115.33 1z8r s ILE 113 Ca 0.00 -1.22 -0.23 0.00 -0.26 0.00 0.00 60.65 58.94 1z8r s ILE 113 Cb 0.00 -1.36 0.01 0.00 1.25 0.00 0.00 42.46 42.36 1z8r s ILE 113 CO 0.00 0.10 0.78 -0.22 0.24 0.00 0.00 174.94 175.84 1z8r s LEU 114 N -1.31 4.16 -0.03 0.37 2.96 -0.71 -4.11 118.68 120.01 1z8r s LEU 114 Ca 0.06 0.25 0.07 0.00 -0.22 0.00 0.00 54.13 54.28 1z8r s LEU 114 Cb -0.09 -3.00 -0.02 0.00 0.50 0.00 0.00 46.19 43.58 1z8r s LEU 114 CO 0.02 -0.76 -0.24 0.00 -1.32 0.00 0.00 176.35 174.05 1z8r s ARG 115 N 3.12 2.25 0.37 1.98 1.70 -0.92 0.26 118.95 127.70 1z8r s ARG 115 Ca 0.31 -0.88 0.07 0.00 -0.47 0.00 0.00 55.73 54.76 1z8r s ARG 115 Cb -0.13 -2.12 -0.02 0.00 -0.57 0.00 0.00 34.95 32.11 1z8r s ARG 115 CO 0.18 0.55 0.35 0.00 -1.08 0.00 0.00 175.30 175.29 1z8r h GLU 117 N 1.12 0.00 0.00 0.00 4.39 -1.95 0.12 114.58 118.27 1z8r h GLU 117 Ca -0.43 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.20 1z8r h GLU 117 Cb 1.26 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.90 1z8r h GLU 117 CO 0.57 0.00 -1.26 0.72 -1.16 0.00 0.00 179.01 177.88 1z8r n HIS 118 N -2.99 0.87 0.00 4.33 8.25 -1.26 -5.07 115.22 119.35 1z8r n HIS 118 Ca -0.02 0.27 0.00 0.00 -0.26 0.00 0.00 57.72 57.71 1z8r n HIS 118 Cb 0.26 -0.97 0.00 0.00 1.12 0.00 0.00 29.99 30.41 1z8r n HIS 118 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1z8r n GLY 119 N 1.27 -0.58 3.81 -1.41 0.00 0.43 -4.55 105.19 104.16 1z8r n GLY 119 Ca -0.04 -0.47 -0.36 0.00 0.00 0.00 0.00 46.02 45.15 1z8r n GLY 119 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1z8r s VAL 120 N -4.00 5.42 -0.05 1.61 1.01 0.18 0.10 120.40 124.68 1z8r s VAL 120 Ca 0.00 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.12 1z8r s VAL 120 Cb 0.00 -3.41 -0.01 0.00 0.00 0.00 0.00 36.38 32.95 1z8r s VAL 120 CO 0.00 0.54 -0.08 -0.38 0.00 0.00 0.00 175.10 175.18 1z8r n ILE 121 N 2.67 0.42 -1.63 2.22 2.08 0.14 0.43 119.36 125.69 1z8r n ILE 121 Ca -0.18 0.40 0.00 0.00 0.56 0.00 0.00 62.75 63.53 1z8r n ILE 121 Cb 0.54 -1.75 0.00 0.00 -0.75 0.00 0.00 39.64 37.68 1z8r n ILE 121 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1z8r n GLY 122 N 1.56 3.72 3.32 7.39 0.00 -0.81 -0.56 105.19 119.82 1z8r n GLY 122 Ca -0.03 -0.74 -0.17 0.00 0.00 0.00 0.00 46.02 45.08 1z8r n GLY 122 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1z8r s LEU 123 N 0.00 2.30 -0.13 0.99 -0.00 -0.27 -1.73 118.68 119.84 1z8r s LEU 123 Ca 0.00 -1.17 -0.31 0.00 -0.00 0.00 0.00 54.13 52.66 1z8r s LEU 123 Cb 0.00 -0.34 -0.08 0.00 -0.00 0.00 0.00 46.19 45.77 1z8r s LEU 123 CO 0.00 -0.45 2.08 0.55 -0.00 0.00 0.00 176.35 178.53 1z8r n VAL 124 N -0.39 0.50 0.00 1.48 3.14 0.13 0.38 118.33 123.57 1z8r n VAL 124 Ca -0.06 -0.27 0.00 0.00 -2.96 0.00 0.00 64.34 61.05 1z8r n VAL 124 Cb 0.63 -2.24 0.00 0.00 -1.06 0.00 0.00 33.84 31.17 1z8r n VAL 124 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 1z8r n THR 125 N 6.50 0.00 -4.04 1.55 -1.04 0.28 -4.78 114.28 112.75 1z8r n THR 125 Ca 0.27 0.00 -0.18 0.00 -2.04 0.00 0.00 64.05 62.09 1z8r n THR 125 Cb 0.38 -0.60 -0.16 0.00 -1.82 0.00 0.00 70.33 68.12 1z8r n THR 125 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 1z8r s MET 126 N 0.00 0.56 0.08 -2.82 -1.94 -0.53 -4.97 119.30 109.67 1z8r s MET 126 Ca 0.00 -0.01 0.05 0.00 -1.71 0.00 0.00 55.69 54.01 1z8r s MET 126 Cb 0.00 -0.65 -0.04 0.00 2.01 0.00 0.00 34.83 36.15 1z8r s MET 126 CO 0.00 -0.11 -0.01 0.20 -0.01 0.00 0.00 175.02 175.09 1z8r s GLY 127 N 0.96 1.90 0.00 -0.03 0.00 -1.26 -0.31 107.32 108.58 1z8r s GLY 127 Ca -0.11 -1.10 0.00 0.00 0.00 0.00 0.00 44.72 43.51 1z8r s GLY 127 CO -0.01 -1.07 0.00 0.61 0.00 0.00 0.00 173.10 172.64 1z8r n GLY 128 N 0.71 3.05 0.25 0.20 0.00 -0.33 -4.94 105.19 104.14 1z8r n GLY 128 Ca -0.12 -1.99 0.16 0.00 0.00 0.00 0.00 46.02 44.08 1z8r n GLY 128 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1z8r h GLU 129 N 0.00 0.00 0.00 1.61 4.11 -1.89 -3.37 114.58 115.04 1z8r h GLU 129 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1z8r h GLU 129 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1z8r h GLU 129 CO 0.00 0.00 -0.02 0.41 0.07 0.00 0.00 179.01 179.47 1z8r n GLY 130 N 0.21 0.91 3.32 1.06 0.00 -1.26 -1.39 105.19 108.04 1z8r n GLY 130 Ca 0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.84 1z8r n GLY 130 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1z8r s VAL 131 N 0.00 1.69 -0.21 1.61 1.01 -1.26 -2.25 120.40 120.99 1z8r s VAL 131 Ca 0.00 -2.01 -0.01 0.00 0.00 0.00 0.00 61.98 59.96 1z8r s VAL 131 Cb 0.00 -1.88 0.02 0.00 0.00 0.00 0.00 36.38 34.52 1z8r s VAL 131 CO 0.00 -0.46 -0.13 0.68 0.00 0.00 0.00 175.10 175.20 1z8r s VAL 132 N -2.48 2.57 -0.36 2.92 -7.23 0.51 -1.18 120.40 115.15 1z8r s VAL 132 Ca 0.17 -0.89 -0.14 0.00 -1.81 0.00 0.00 61.98 59.32 1z8r s VAL 132 Cb -0.03 -2.18 -0.01 0.00 0.56 0.00 0.00 36.38 34.72 1z8r s VAL 132 CO 0.06 0.40 0.26 -0.83 -0.31 0.00 0.00 175.10 174.68 1z8r s GLY 133 N 1.33 1.97 -0.04 2.32 0.00 0.58 -2.01 107.32 111.47 1z8r s GLY 133 Ca 0.03 -1.46 0.06 0.00 0.00 0.00 0.00 44.72 43.35 1z8r s GLY 133 CO -0.08 0.82 -0.22 -1.36 0.00 0.00 0.00 173.10 172.26 1z8r s PHE 134 N 1.73 2.49 -0.34 1.90 0.08 0.78 0.10 117.98 124.71 1z8r s PHE 134 Ca 0.06 -0.46 -0.22 0.00 0.12 0.00 0.00 56.93 56.43 1z8r s PHE 134 Cb -0.18 -1.58 0.00 0.00 -0.57 0.00 0.00 43.02 40.69 1z8r s PHE 134 CO 0.10 -0.04 0.73 0.00 -0.10 0.00 0.00 175.22 175.91 1z8r s ALA 135 N -0.45 3.47 0.37 5.36 0.00 0.16 0.74 121.76 131.41 1z8r s ALA 135 Ca 0.05 -0.65 -0.27 0.00 0.00 0.00 0.00 51.96 51.09 1z8r s ALA 135 Cb -0.12 -3.27 -0.09 0.00 0.00 0.00 0.00 23.12 19.64 1z8r s ALA 135 CO 0.01 -1.34 1.27 0.34 0.00 0.00 0.00 175.76 176.04 1z8r s ASP 136 N 1.76 6.54 0.00 0.00 -1.08 -0.96 -1.11 116.67 121.82 1z8r s ASP 136 Ca 0.29 2.59 0.12 0.00 -0.52 0.00 0.00 52.55 55.03 1z8r s ASP 136 Cb -0.14 -2.64 0.34 0.00 -1.46 0.00 0.00 42.92 39.02 1z8r s ASP 136 CO 0.15 -0.68 1.28 0.52 0.52 0.00 0.00 175.17 176.95 1z8r n VAL 137 N 0.38 0.49 0.70 1.11 0.31 0.28 -4.07 118.33 117.53 1z8r n VAL 137 Ca 0.02 -0.49 0.08 0.00 -0.01 0.00 0.00 64.34 63.94 1z8r n VAL 137 Cb 0.44 0.25 0.39 0.00 -0.91 0.00 0.00 33.84 34.00 1z8r n VAL 137 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1z8r n ARG 138 N 0.58 0.17 -0.40 5.55 5.12 -1.26 -2.19 116.66 124.23 1z8r n ARG 138 Ca 0.12 0.16 0.10 0.00 -1.93 0.00 0.00 57.85 56.31 1z8r n ARG 138 Cb 0.31 -1.50 0.31 0.00 -1.16 0.00 0.00 32.46 30.42 1z8r n ARG 138 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 1z8r n ASP 139 N -1.34 3.83 -2.41 0.55 5.68 -1.26 -4.49 116.55 117.12 1z8r n ASP 139 Ca 0.07 -2.09 -0.03 0.00 -0.50 0.00 0.00 54.79 52.24 1z8r n ASP 139 Cb 0.14 -0.48 -0.01 0.00 -1.14 0.00 0.00 41.12 39.63 1z8r n ASP 139 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1z8r n LEU 140 N 1.40 -0.90 0.14 -2.12 -0.00 -0.95 -5.00 117.00 109.58 1z8r n LEU 140 Ca 0.23 -1.66 0.11 0.00 -0.00 0.00 0.00 56.01 54.70 1z8r n LEU 140 Cb 0.63 0.86 0.52 0.00 -0.00 0.00 0.00 43.42 45.43 1z8r n LEU 140 CO 0.17 1.12 0.84 -0.11 -0.00 0.00 0.00 177.39 179.41 1z8r n LEU 141 N -0.44 0.62 -4.44 1.47 -0.00 -0.93 -4.58 117.00 108.69 1z8r n LEU 141 Ca -0.22 0.70 -0.11 0.00 -0.00 0.00 0.00 56.01 56.38 1z8r n LEU 141 Cb 0.62 -0.66 -0.09 0.00 -0.00 0.00 0.00 43.42 43.29 1z8r n LEU 141 CO -0.09 -0.69 1.11 -2.67 -0.00 0.00 0.00 177.39 175.04 1z8r n TRP 142 N -2.23 0.69 0.00 1.96 4.27 -1.26 -3.52 117.44 117.34 1z8r n TRP 142 Ca 0.01 -0.10 0.00 0.00 -3.89 0.00 0.00 57.50 53.52 1z8r n TRP 142 Cb 0.16 -2.04 0.00 0.00 -1.36 0.00 0.00 31.31 28.07 1z8r n TRP 142 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1z8r n LEU 143 N 15.74 0.00 0.00 5.67 4.32 -1.26 -5.01 117.00 136.46 1z8r n LEU 143 Ca 0.33 0.00 -0.01 0.00 -0.02 0.00 0.00 56.01 56.32 1z8r n LEU 143 Cb 0.46 0.09 -0.00 0.00 -1.62 0.00 0.00 43.42 42.35 1z8r n LEU 143 CO 0.59 -0.19 0.01 -0.62 -1.22 0.00 0.00 177.39 175.95 1z8r n GLU 144 N -1.89 0.04 -1.72 3.23 1.02 -1.23 -4.59 120.64 115.49 1z8r n GLU 144 Ca 0.00 -0.11 -0.43 0.00 -0.02 0.00 0.00 57.16 56.60 1z8r n GLU 144 Cb 0.00 0.12 -0.03 0.00 -0.02 0.00 0.00 31.44 31.51 1z8r n GLU 144 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1z8r n ASP 145 N -1.76 3.74 -4.91 1.62 9.92 -1.26 -4.99 116.55 118.91 1z8r n ASP 145 Ca -0.00 1.10 -0.28 0.00 -0.53 0.00 0.00 54.79 55.08 1z8r n ASP 145 Cb 0.03 -1.55 -0.03 0.00 -0.64 0.00 0.00 41.12 38.92 1z8r n ASP 145 CO 0.00 0.00 0.00 1.51 0.13 0.00 0.00 177.20 178.84 1z8r s ASP 146 N 0.82 6.43 0.46 -2.24 1.47 -1.26 -4.72 116.67 117.62 1z8r s ASP 146 Ca 0.71 0.56 -0.22 0.00 1.18 0.00 0.00 52.55 54.78 1z8r s ASP 146 Cb -0.53 -2.08 -0.08 0.00 -0.34 0.00 0.00 42.92 39.89 1z8r s ASP 146 CO 0.40 -0.10 1.08 0.00 0.68 0.00 0.00 175.17 177.23 1z8r s ALA 147 N -1.94 2.94 -0.12 2.11 0.00 -1.26 -4.85 121.76 118.64 1z8r s ALA 147 Ca 0.41 0.74 -0.01 0.00 0.00 0.00 0.00 51.96 53.10 1z8r s ALA 147 Cb -0.11 -3.30 0.03 0.00 0.00 0.00 0.00 23.12 19.74 1z8r s ALA 147 CO 0.29 -0.41 -0.06 -1.64 0.00 0.00 0.00 175.76 173.94 1z8r s MET 148 N -2.87 1.38 -0.26 0.00 -1.94 -1.26 -4.47 119.30 109.87 1z8r s MET 148 Ca 0.64 -0.28 0.09 0.00 -1.71 0.00 0.00 55.69 54.43 1z8r s MET 148 Cb -0.22 -1.64 0.46 0.00 2.01 0.00 0.00 34.83 35.45 1z8r s MET 148 CO 0.27 -0.32 1.34 -1.91 -0.01 0.00 0.00 175.02 174.39 1z8r n GLU 149 N 4.95 1.89 -0.50 2.03 4.07 -1.26 -5.12 120.64 126.70 1z8r n GLU 149 Ca -0.12 -3.34 0.00 0.00 -0.06 0.00 0.00 57.16 53.65 1z8r n GLU 149 Cb 0.49 -1.78 0.00 0.00 -0.06 0.00 0.00 31.44 30.10 1z8r n GLU 149 CO 0.00 0.00 0.00 0.94 -0.06 0.00 0.00 177.13 178.01