#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z8r n PRO 2 N 0.00 0.91 -3.71 1.61 -0.02 -1.26 -4.96 135.00 127.57 1z8r n PRO 2 Ca 0.00 0.34 -0.37 0.00 -2.02 0.00 0.00 63.50 61.45 1z8r n PRO 2 Cb 0.00 -1.97 -0.10 0.00 -0.02 0.00 0.00 33.50 31.41 1z8r n PRO 2 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1z8r s TYR 3 N -1.50 3.50 0.00 6.00 6.14 -1.26 -4.55 117.35 125.68 1z8r s TYR 3 Ca 0.70 -2.44 0.00 0.00 0.64 0.00 0.00 57.07 55.96 1z8r s TYR 3 Cb -0.48 -3.28 0.00 0.00 0.42 0.00 0.00 41.96 38.63 1z8r s TYR 3 CO 0.52 -0.93 0.00 0.41 0.64 0.00 0.00 175.55 176.20 1z8r n GLY 4 N 4.19 1.30 0.21 8.97 0.00 -1.26 -5.03 105.19 113.58 1z8r n GLY 4 Ca 0.01 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.05 1z8r n GLY 4 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1z8r h HIS 5 N 0.00 0.19 -1.79 1.61 2.76 -2.00 -3.45 115.15 112.47 1z8r h HIS 5 Ca 0.00 -0.03 -0.60 0.00 -2.20 0.00 0.00 60.37 57.53 1z8r h HIS 5 Cb 0.00 -0.05 -0.13 0.00 1.55 0.00 0.00 27.41 28.78 1z8r h HIS 5 CO 0.00 0.43 -0.52 1.14 -1.30 0.00 0.00 177.93 177.68 1z8r s GLN 6 N -4.44 2.03 0.00 5.26 -2.07 -1.26 -5.07 119.66 114.11 1z8r s GLN 6 Ca -0.04 -2.26 0.00 0.00 -1.82 0.00 0.00 55.36 51.24 1z8r s GLN 6 Cb 0.15 -0.97 0.00 0.00 -1.09 0.00 0.00 33.01 31.10 1z8r s GLN 6 CO 0.74 -0.43 0.00 0.43 -1.32 0.00 0.00 175.29 174.71 1z8r n SER 7 N -1.29 0.00 0.00 12.60 7.64 -1.26 -5.06 113.62 126.26 1z8r n SER 7 Ca -0.11 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.77 1z8r n SER 7 Cb 0.66 0.21 0.00 0.00 -1.01 0.00 0.00 64.21 64.07 1z8r n SER 7 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1z8r n GLY 8 N -0.48 1.25 3.86 0.23 0.00 -1.26 -4.87 105.19 103.92 1z8r n GLY 8 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 3.28 -0.22 4.61 0.00 -1.26 -4.48 121.76 123.69 1z8r s ALA 9 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 51.96 51.87 1z8r s ALA 9 Cb 0.00 -2.82 -0.05 0.00 0.00 0.00 0.00 23.12 20.25 1z8r s ALA 9 CO 0.00 0.12 0.13 0.08 0.00 0.00 0.00 175.76 176.09 1z8r s VAL 10 N -2.22 5.19 -0.26 0.00 1.01 -0.88 -5.02 120.40 118.23 1z8r s VAL 10 Ca 0.54 0.12 -0.04 0.00 0.00 0.00 0.00 61.98 62.60 1z8r s VAL 10 Cb -0.10 -3.39 0.01 0.00 0.00 0.00 0.00 36.38 32.90 1z8r s VAL 10 CO 0.24 0.39 0.00 -0.47 0.00 0.00 0.00 175.10 175.26 1z8r s TYR 11 N 0.75 3.08 -0.25 5.22 6.14 -1.26 -1.33 117.35 129.70 1z8r s TYR 11 Ca 0.07 -1.18 0.02 0.00 0.64 0.00 0.00 57.07 56.62 1z8r s TYR 11 Cb -0.13 -2.15 0.06 0.00 0.42 0.00 0.00 41.96 40.16 1z8r s TYR 11 CO 0.02 -0.63 -0.11 0.08 0.64 0.00 0.00 175.55 175.55 1z8r s VAL 12 N 1.43 2.07 0.00 3.14 1.01 0.41 -3.74 120.40 124.72 1z8r s VAL 12 Ca 0.02 -1.50 0.00 0.00 0.00 0.00 0.00 61.98 60.51 1z8r s VAL 12 Cb -0.16 -2.16 0.00 0.00 0.00 0.00 0.00 36.38 34.05 1z8r s VAL 12 CO -0.01 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.73 1z8r n GLY 13 N 4.49 3.21 1.16 4.51 0.00 -1.26 -0.24 105.19 117.06 1z8r n GLY 13 Ca -0.15 0.10 0.05 0.00 0.00 0.00 0.00 46.02 46.02 1z8r n GLY 13 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1z8r n ASN 14 N 4.38 3.33 -3.97 1.61 3.02 -1.26 -4.36 115.26 118.02 1z8r n ASN 14 Ca 0.00 -2.39 -0.24 0.00 -0.03 0.00 0.00 54.58 51.92 1z8r n ASN 14 Cb 0.00 -0.52 -0.17 0.00 -0.61 0.00 0.00 39.78 38.49 1z8r n ASN 14 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1z8r s TYR 15 N -1.85 1.28 -0.22 3.10 2.02 0.67 -2.03 117.35 120.33 1z8r s TYR 15 Ca 0.31 -0.49 0.02 0.00 -0.37 0.00 0.00 57.07 56.54 1z8r s TYR 15 Cb 0.21 -1.00 0.04 0.00 -0.40 0.00 0.00 41.96 40.81 1z8r s TYR 15 CO 0.12 -0.30 -0.15 0.21 -1.57 0.00 0.00 175.55 173.86 1z8r s LYS 16 N 0.94 2.55 -0.26 -0.62 2.20 0.80 -0.45 119.74 124.90 1z8r s LYS 16 Ca -0.10 -1.07 -0.12 0.00 -0.36 0.00 0.00 55.97 54.32 1z8r s LYS 16 Cb -0.15 -2.70 -0.05 0.00 -1.51 0.00 0.00 37.83 33.42 1z8r s LYS 16 CO 0.01 -0.40 0.22 0.14 -0.36 0.00 0.00 175.35 174.96 1z8r s VAL 17 N 1.21 5.29 0.11 4.02 -7.23 -0.45 -1.81 120.40 121.54 1z8r s VAL 17 Ca -0.02 0.27 0.01 0.00 -1.81 0.00 0.00 61.98 60.43 1z8r s VAL 17 Cb -0.17 -3.56 -0.04 0.00 0.56 0.00 0.00 36.38 33.17 1z8r s VAL 17 CO -0.09 0.26 -0.04 0.54 -0.31 0.00 0.00 175.10 175.46 1z8r s VAL 18 N 1.61 0.56 0.41 1.32 0.11 -0.85 -2.07 120.40 121.49 1z8r s VAL 18 Ca 0.09 -1.92 -0.27 0.00 -2.93 0.00 0.00 61.98 56.95 1z8r s VAL 18 Cb -0.15 -1.78 -0.10 0.00 -1.53 0.00 0.00 36.38 32.83 1z8r s VAL 18 CO 0.09 -0.78 1.44 0.21 -3.33 0.00 0.00 175.10 172.73 1z8r s ASN 19 N -3.05 6.13 0.18 3.54 2.47 -1.26 -2.28 114.94 120.67 1z8r s ASN 19 Ca 0.15 2.96 -0.12 0.00 0.42 0.00 0.00 52.86 56.26 1z8r s ASN 19 Cb 0.06 -2.66 0.16 0.00 -1.45 0.00 0.00 41.25 37.36 1z8r s ASN 19 CO -0.03 -1.01 1.77 0.08 -3.72 0.00 0.00 177.10 174.19 1z8r h ARG 20 N 2.67 0.45 0.00 0.43 -0.00 -0.44 0.17 114.38 117.65 1z8r h ARG 20 Ca -0.51 -0.03 0.00 0.00 -0.00 0.00 0.00 59.98 59.45 1z8r h ARG 20 Cb 1.25 -0.10 0.00 0.00 -0.00 0.00 0.00 29.97 31.12 1z8r h ARG 20 CO 0.63 0.30 0.00 1.58 -0.00 0.00 0.00 179.97 182.47 1z8r n HIS 21 N -4.92 0.05 0.21 4.08 -0.00 -1.26 -1.97 115.22 111.41 1z8r n HIS 21 Ca 0.05 0.02 0.03 0.00 0.46 0.00 0.00 57.72 58.28 1z8r n HIS 21 Cb 0.16 -0.53 0.03 0.00 -0.12 0.00 0.00 29.99 29.53 1z8r n HIS 21 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 1z8r n LEU 22 N -1.55 1.56 -4.70 0.27 4.77 0.34 -5.00 117.00 112.71 1z8r n LEU 22 Ca 0.02 -1.08 -0.39 0.00 -0.03 0.00 0.00 56.01 54.52 1z8r n LEU 22 Cb 0.11 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.14 1z8r n LEU 22 CO 0.09 0.34 0.33 0.00 -1.33 0.00 0.00 177.39 176.82 1z8r s ALA 23 N -0.52 3.46 0.77 -1.18 0.00 0.22 -4.85 121.76 119.66 1z8r s ALA 23 Ca 0.07 -0.11 -0.11 0.00 0.00 0.00 0.00 51.96 51.81 1z8r s ALA 23 Cb 0.05 -2.88 0.05 0.00 0.00 0.00 0.00 23.12 20.34 1z8r s ALA 23 CO 0.07 -0.26 1.09 -0.08 0.00 0.00 0.00 175.76 176.58 1z8r s THR 24 N 1.20 3.34 0.54 0.00 -1.32 -1.26 -4.83 115.64 113.31 1z8r s THR 24 Ca 0.31 0.44 0.27 0.00 -1.21 0.00 0.00 61.69 61.50 1z8r s THR 24 Cb -0.16 -3.16 0.42 0.00 -1.51 0.00 0.00 72.50 68.09 1z8r s THR 24 CO 0.13 -0.57 1.96 0.45 -2.21 0.00 0.00 174.62 174.38 1z8r h HIS 25 N -1.00 0.00 -0.09 9.09 3.86 -1.99 0.35 115.15 125.37 1z8r h HIS 25 Ca -0.46 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 58.63 1z8r h HIS 25 Cb 1.25 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.71 1z8r h HIS 25 CO 0.51 0.00 -0.47 0.28 0.86 0.00 0.00 177.93 179.12 1z8r h VAL 26 N 0.00 1.33 -0.30 2.45 2.07 -1.99 -0.13 116.25 119.69 1z8r h VAL 26 Ca 0.30 -1.65 -0.09 0.00 0.82 0.00 0.00 66.70 66.08 1z8r h VAL 26 Cb 1.21 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 1z8r h VAL 26 CO -0.00 0.49 -0.16 0.44 0.02 0.00 0.00 177.57 178.35 1z8r h ASP 27 N 0.17 0.66 -0.07 0.57 3.32 -0.64 -2.59 116.42 117.84 1z8r h ASP 27 Ca 0.01 -0.42 -0.09 0.00 0.02 0.00 0.00 57.03 56.55 1z8r h ASP 27 Cb 0.89 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.26 1z8r h ASP 27 CO 0.07 0.93 -0.31 -0.50 -1.72 0.00 0.00 179.24 177.71 1z8r h TRP 28 N 0.39 0.44 -0.70 4.55 4.06 -1.36 -1.10 115.95 122.23 1z8r h TRP 28 Ca 0.06 -0.19 0.09 0.00 2.06 0.00 0.00 58.89 60.91 1z8r h TRP 28 Cb 0.69 -0.07 -0.07 0.00 -1.00 0.00 0.00 29.16 28.71 1z8r h TRP 28 CO 0.06 0.92 0.35 -0.56 -3.56 0.00 0.00 178.44 175.66 1z8r h GLN 29 N -0.17 0.59 -0.86 0.49 3.07 -1.08 -0.38 115.11 116.78 1z8r h GLN 29 Ca -0.02 -0.04 -0.44 0.00 0.09 0.00 0.00 58.65 58.24 1z8r h GLN 29 Cb 0.96 -0.13 -0.26 0.00 0.08 0.00 0.00 27.48 28.12 1z8r h GLN 29 CO 0.06 0.39 0.49 0.09 0.09 0.00 0.00 178.83 179.96 1z8r n ASN 30 N -4.85 3.48 -4.79 0.06 4.13 -0.98 -4.99 115.26 107.32 1z8r n ASN 30 Ca 0.10 -3.65 -0.36 0.00 1.68 0.00 0.00 54.58 52.36 1z8r n ASN 30 Cb 0.26 -0.79 -0.07 0.00 -1.54 0.00 0.00 39.78 37.64 1z8r n ASN 30 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1z8r n VAL 32 N 0.31 1.22 -4.02 0.00 0.24 0.25 -4.95 118.33 111.38 1z8r n VAL 32 Ca 0.03 -0.44 -0.09 0.00 -2.04 0.00 0.00 64.34 61.81 1z8r n VAL 32 Cb 0.51 -1.36 -0.11 0.00 -1.47 0.00 0.00 33.84 31.41 1z8r n VAL 32 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 1z8r s TRP 33 N -2.42 0.36 -0.27 6.34 -0.00 -1.04 -4.97 118.94 116.94 1z8r s TRP 33 Ca -0.29 -0.68 -0.07 0.00 -0.00 0.00 0.00 56.10 55.06 1z8r s TRP 33 Cb 0.08 -0.26 0.13 0.00 -0.00 0.00 0.00 33.47 33.42 1z8r s TRP 33 CO 0.47 -0.23 0.56 -2.00 -0.00 0.00 0.00 176.95 175.75 1z8r s GLU 34 N -2.17 0.49 -0.41 5.86 -6.30 -1.26 0.70 118.70 115.61 1z8r s GLU 34 Ca -0.09 1.21 -0.09 0.00 -2.50 0.00 0.00 54.97 53.50 1z8r s GLU 34 Cb -0.05 0.59 0.08 0.00 0.00 0.00 0.00 34.13 34.74 1z8r s GLU 34 CO -0.03 -0.31 0.25 0.34 0.02 0.00 0.00 175.26 175.52 1z8r s ASP 35 N 2.79 5.60 0.47 -1.70 -1.08 0.14 -4.95 116.67 117.94 1z8r s ASP 35 Ca 0.01 -1.50 0.17 0.00 -0.52 0.00 0.00 52.55 50.70 1z8r s ASP 35 Cb -0.13 -1.97 1.11 0.00 -1.46 0.00 0.00 42.92 40.47 1z8r s ASP 35 CO -0.17 -0.52 2.03 0.22 0.52 0.00 0.00 175.17 177.24 1z8r h TYR 36 N 8.38 0.00 -0.01 -5.34 3.20 -1.96 0.15 116.97 121.39 1z8r h TYR 36 Ca -0.22 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.62 1z8r h TYR 36 Cb 1.08 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.35 1z8r h TYR 36 CO 0.61 0.15 -0.10 -0.91 -1.64 0.00 0.00 178.16 176.27 1z8r h ASN 37 N 0.00 0.02 -0.01 -2.11 2.35 -1.93 -2.82 115.58 111.09 1z8r h ASN 37 Ca -0.00 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1z8r h ASN 37 Cb 0.28 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1z8r h ASN 37 CO 0.02 0.12 -0.11 -2.11 -1.65 0.00 0.00 177.43 173.70 1z8r n ARG 38 N -4.41 1.68 -3.46 0.81 1.85 -0.89 0.11 116.66 112.35 1z8r n ARG 38 Ca -0.02 -0.62 -0.19 0.00 -1.00 0.00 0.00 57.85 56.01 1z8r n ARG 38 Cb 0.18 -1.03 0.08 0.00 -1.05 0.00 0.00 32.46 30.65 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 -0.12 -3.64 -4.12 2.89 9.92 0.49 -4.72 116.55 117.26 1z8r n ASP 39 Ca 0.03 -0.58 -0.13 0.00 -0.53 0.00 0.00 54.79 53.59 1z8r n ASP 39 Cb 0.16 -4.98 -0.11 0.00 -0.64 0.00 0.00 41.12 35.54 1z8r n ASP 39 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1z8r s LEU 40 N -6.60 2.34 0.06 0.64 2.96 -0.91 0.33 118.68 117.51 1z8r s LEU 40 Ca 0.22 -0.71 -0.16 0.00 -0.22 0.00 0.00 54.13 53.26 1z8r s LEU 40 Cb -0.10 -0.19 0.03 0.00 0.50 0.00 0.00 46.19 46.43 1z8r s LEU 40 CO 0.71 -0.27 0.37 -1.48 -1.32 0.00 0.00 176.35 174.36 1z8r s LEU 41 N -2.09 0.58 -0.09 -0.68 -0.00 -0.97 0.28 118.68 115.71 1z8r s LEU 41 Ca -0.01 -0.14 0.03 0.00 -0.00 0.00 0.00 54.13 54.01 1z8r s LEU 41 Cb -0.05 1.61 -0.01 0.00 -0.00 0.00 0.00 46.19 47.74 1z8r s LEU 41 CO -0.01 -0.68 -0.18 -0.69 -0.00 0.00 0.00 176.35 174.79 1z8r s VAL 42 N -2.78 2.63 0.18 1.48 1.01 0.22 -2.01 120.40 121.13 1z8r s VAL 42 Ca -0.03 -0.84 0.08 0.00 0.00 0.00 0.00 61.98 61.19 1z8r s VAL 42 Cb -0.00 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 1z8r s VAL 42 CO -0.05 0.55 -0.17 -0.55 0.00 0.00 0.00 175.10 174.89 1z8r s SER 43 N 0.03 2.63 -0.00 3.32 0.15 -0.75 0.84 113.70 119.92 1z8r s SER 43 Ca -0.07 -0.92 -0.06 0.00 0.70 0.00 0.00 55.95 55.60 1z8r s SER 43 Cb -0.15 -0.15 -0.05 0.00 -1.71 0.00 0.00 66.02 63.97 1z8r s SER 43 CO 0.05 -0.09 0.26 0.42 1.20 0.00 0.00 173.24 175.08 1z8r s THR 44 N -2.41 5.32 0.27 6.45 -4.23 -1.05 -0.14 115.64 119.85 1z8r s THR 44 Ca 0.18 0.16 0.02 0.00 -1.18 0.00 0.00 61.69 60.87 1z8r s THR 44 Cb -0.04 -3.56 -0.05 0.00 1.34 0.00 0.00 72.50 70.20 1z8r s THR 44 CO 0.07 0.38 0.12 0.28 -0.54 0.00 0.00 174.62 174.93 1z8r s THR 45 N -1.28 0.46 -0.61 3.99 -1.32 -0.86 -4.95 115.64 111.08 1z8r s THR 45 Ca 0.27 -2.00 0.04 0.00 -1.21 0.00 0.00 61.69 58.78 1z8r s THR 45 Cb -0.13 -2.59 0.37 0.00 -1.51 0.00 0.00 72.50 68.64 1z8r s THR 45 CO 0.15 0.00 1.22 0.41 -2.21 0.00 0.00 174.62 174.19 1z8r n THR 46 N -0.50 3.23 -4.23 5.08 -1.04 -1.26 -4.71 114.28 110.85 1z8r n THR 46 Ca 0.00 -5.27 -0.13 0.00 -2.04 0.00 0.00 64.05 56.62 1z8r n THR 46 Cb 0.66 -1.35 -0.04 0.00 -1.82 0.00 0.00 70.33 67.78 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 -0.34 0.33 -2.88 2.41 0.00 -1.26 -5.16 120.51 113.61 1z8r n ALA 47 Ca 0.38 -1.09 -0.32 0.00 0.00 0.00 0.00 53.44 52.41 1z8r n ALA 47 Cb 0.46 0.78 -0.04 0.00 0.00 0.00 0.00 19.45 20.64 1z8r n ALA 47 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1z8r s HIS 48 N -2.47 3.53 1.07 0.00 5.65 -1.26 -4.61 115.29 117.20 1z8r s HIS 48 Ca 0.14 0.35 -0.13 0.00 0.25 0.00 0.00 55.06 55.67 1z8r s HIS 48 Cb 0.01 -1.83 0.23 0.00 -1.18 0.00 0.00 32.58 29.81 1z8r s HIS 48 CO 0.10 0.60 1.07 0.20 -0.65 0.00 0.00 174.74 176.06 1z8r s GLY 49 N -2.22 1.55 0.37 1.59 0.00 -1.26 -4.76 107.32 102.60 1z8r s GLY 49 Ca 0.32 -0.37 0.00 0.00 0.00 0.00 0.00 44.72 44.67 1z8r s GLY 49 CO 0.23 0.30 0.00 0.00 0.00 0.00 0.00 173.10 173.63 1z8r s ASP 51 N -3.56 6.81 -0.17 0.00 1.11 -1.25 -5.07 116.67 114.54 1z8r s ASP 51 Ca 0.00 1.42 0.01 0.00 0.18 0.00 0.00 52.55 54.16 1z8r s ASP 51 Cb 0.00 -2.43 0.02 0.00 1.07 0.00 0.00 42.92 41.58 1z8r s ASP 51 CO 0.00 -0.28 -0.16 -0.89 1.18 0.00 0.00 175.17 175.01 1z8r s THR 52 N -2.09 1.81 0.26 -1.27 2.01 -1.26 -4.72 115.64 110.37 1z8r s THR 52 Ca 0.57 -0.83 -0.30 0.00 0.31 0.00 0.00 61.69 61.45 1z8r s THR 52 Cb -0.10 -1.69 -0.09 0.00 0.01 0.00 0.00 72.50 70.63 1z8r s THR 52 CO 0.17 0.46 1.04 -0.63 -0.69 0.00 0.00 174.62 174.97 1z8r s ILE 53 N 1.38 3.72 -0.02 1.82 1.01 -1.26 0.41 121.20 128.25 1z8r s ILE 53 Ca 0.04 1.72 -0.18 0.00 0.00 0.00 0.00 60.65 62.23 1z8r s ILE 53 Cb -0.13 -4.09 -0.05 0.00 0.01 0.00 0.00 42.46 38.19 1z8r s ILE 53 CO -0.11 0.40 0.51 0.00 0.00 0.00 0.00 174.94 175.74 1z8r s ALA 54 N -1.11 3.55 -0.36 9.38 0.00 0.14 -3.66 121.76 129.70 1z8r s ALA 54 Ca 0.43 -0.09 0.05 0.00 0.00 0.00 0.00 51.96 52.35 1z8r s ALA 54 Cb -0.30 -2.61 0.51 0.00 0.00 0.00 0.00 23.12 20.72 1z8r s ALA 54 CO 0.37 0.23 1.58 -2.13 0.00 0.00 0.00 175.76 175.82 1z8r n ARG 55 N 2.62 2.42 -3.27 0.00 0.63 -1.00 -4.76 116.66 113.30 1z8r n ARG 55 Ca -0.09 -2.17 -0.18 0.00 -0.92 0.00 0.00 57.85 54.49 1z8r n ARG 55 Cb 0.51 -1.90 0.00 0.00 0.45 0.00 0.00 32.46 31.53 1z8r n ARG 55 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1z8r n GLN 57 N -1.73 1.68 -1.71 0.00 7.27 -1.26 -5.06 117.38 116.56 1z8r n GLN 57 Ca 0.03 -3.28 -0.43 0.00 0.07 0.00 0.00 57.00 53.40 1z8r n GLN 57 Cb 0.58 -1.52 -0.03 0.00 2.41 0.00 0.00 30.24 31.69 1z8r n GLN 57 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1z8r n THR 59 N 3.09 0.41 -4.18 0.00 5.66 -1.26 -4.67 114.28 113.33 1z8r n THR 59 Ca 0.13 0.10 -0.34 0.00 -3.05 0.00 0.00 64.05 60.89 1z8r n THR 59 Cb 0.34 -0.73 -0.12 0.00 -1.55 0.00 0.00 70.33 68.27 1z8r n THR 59 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1z8r s THR 60 N -2.82 4.06 -0.05 1.09 -4.23 -1.26 -0.83 115.64 111.59 1z8r s THR 60 Ca 0.15 -0.29 -0.14 0.00 -1.18 0.00 0.00 61.69 60.23 1z8r s THR 60 Cb 0.15 -2.81 0.03 0.00 1.34 0.00 0.00 72.50 71.20 1z8r s THR 60 CO 0.37 0.45 0.32 -0.83 -0.54 0.00 0.00 174.62 174.40 1z8r s GLY 61 N 0.69 -0.19 -0.22 3.99 0.00 0.10 -4.81 107.32 106.89 1z8r s GLY 61 Ca -0.00 0.55 -0.08 0.00 0.00 0.00 0.00 44.72 45.19 1z8r s GLY 61 CO 0.02 0.36 0.08 0.54 0.00 0.00 0.00 173.10 174.11 1z8r s VAL 62 N -0.82 4.73 0.31 1.40 0.11 -0.97 0.82 120.40 125.99 1z8r s VAL 62 Ca -0.09 -0.04 0.08 0.00 -2.93 0.00 0.00 61.98 58.99 1z8r s VAL 62 Cb -0.04 -3.17 -0.03 0.00 -1.53 0.00 0.00 36.38 31.60 1z8r s VAL 62 CO 0.03 0.39 0.21 -0.72 -3.33 0.00 0.00 175.10 171.68 1z8r s TYR 63 N 0.96 2.88 -0.13 1.54 -0.85 -0.72 -2.13 117.35 118.91 1z8r s TYR 63 Ca 0.05 -0.28 -0.20 0.00 -0.52 0.00 0.00 57.07 56.12 1z8r s TYR 63 Cb -0.14 -1.63 -0.04 0.00 0.38 0.00 0.00 41.96 40.54 1z8r s TYR 63 CO 0.03 0.33 0.55 0.12 -1.52 0.00 0.00 175.55 175.06 1z8r s PHE 64 N -2.30 3.49 0.37 -3.49 2.19 -1.25 -1.88 117.98 115.11 1z8r s PHE 64 Ca 0.38 0.96 -0.15 0.00 0.33 0.00 0.00 56.93 58.45 1z8r s PHE 64 Cb -0.05 -2.66 -0.09 0.00 -1.31 0.00 0.00 43.02 38.91 1z8r s PHE 64 CO 0.25 0.07 0.80 0.00 1.83 0.00 0.00 175.22 178.16 1z8r n ALA 66 N -0.74 0.95 -0.09 0.00 0.00 -1.26 -3.67 120.51 115.70 1z8r n ALA 66 Ca 0.04 -0.66 -0.22 0.00 0.00 0.00 0.00 53.44 52.60 1z8r n ALA 66 Cb 0.54 -0.54 -0.12 0.00 0.00 0.00 0.00 19.45 19.32 1z8r n ALA 66 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1z8r h SER 67 N -0.18 0.04 -0.01 0.00 4.64 -1.95 -3.36 113.55 112.74 1z8r h SER 67 Ca -0.45 -0.56 0.00 0.00 -0.47 0.00 0.00 61.79 60.32 1z8r h SER 67 Cb 1.87 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.94 1z8r h SER 67 CO -0.01 1.52 0.01 0.11 -0.87 0.00 0.00 176.83 177.59 1z8r h LYS 68 N -0.90 0.00 -2.10 4.77 1.79 -2.00 -3.45 116.57 114.68 1z8r h LYS 68 Ca -0.35 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 57.79 1z8r h LYS 68 Cb 1.37 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 31.93 1z8r h LYS 68 CO -0.18 0.00 -0.35 0.45 -1.08 0.00 0.00 179.45 178.29 1z8r n SER 69 N -3.92 -4.55 -4.30 0.86 2.88 -1.24 -4.92 113.62 98.42 1z8r n SER 69 Ca -0.03 0.28 -0.16 0.00 -1.33 0.00 0.00 58.87 57.64 1z8r n SER 69 Cb 0.09 -4.00 -0.10 0.00 -0.75 0.00 0.00 64.21 59.45 1z8r n SER 69 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1z8r s LYS 70 N -4.05 1.38 0.06 -1.46 1.02 -1.26 -4.96 119.74 110.47 1z8r s LYS 70 Ca 0.00 -1.75 -0.25 0.00 0.02 0.00 0.00 55.97 53.99 1z8r s LYS 70 Cb 0.00 -0.18 -0.06 0.00 -0.52 0.00 0.00 37.83 37.07 1z8r s LYS 70 CO 0.00 -0.31 0.78 -3.38 -0.92 0.00 0.00 175.35 171.52 1z8r s HIS 71 N -3.81 3.76 -0.19 3.18 -3.43 -1.26 -2.30 115.29 111.24 1z8r s HIS 71 Ca 0.38 1.51 0.00 0.00 -0.80 0.00 0.00 55.06 56.15 1z8r s HIS 71 Cb 0.08 -2.83 0.04 0.00 -1.43 0.00 0.00 32.58 28.44 1z8r s HIS 71 CO 0.13 0.30 -0.08 0.71 -2.00 0.00 0.00 174.74 173.80 1z8r s TYR 72 N -0.17 2.18 -0.12 0.38 1.51 -0.79 -4.99 117.35 115.36 1z8r s TYR 72 Ca 0.39 -1.45 -0.29 0.00 -1.01 0.00 0.00 57.07 54.71 1z8r s TYR 72 Cb -0.21 -1.53 -0.03 0.00 -0.11 0.00 0.00 41.96 40.09 1z8r s TYR 72 CO 0.24 -0.71 1.37 -2.14 -1.11 0.00 0.00 175.55 173.20 1z8r s PRO 73 N 1.47 4.23 0.00 -1.71 0.02 -1.26 -1.75 135.00 136.00 1z8r s PRO 73 Ca -0.01 1.82 0.01 0.00 0.02 0.00 0.00 61.00 62.84 1z8r s PRO 73 Cb -0.16 -3.79 -0.01 0.00 0.02 0.00 0.00 34.50 30.56 1z8r s PRO 73 CO -0.08 -0.71 -0.04 0.08 -0.33 0.00 0.00 177.00 175.92 1z8r s VAL 74 N 3.46 0.27 -0.12 3.83 1.01 0.24 -4.93 120.40 124.16 1z8r s VAL 74 Ca 0.60 -0.31 -0.12 0.00 0.00 0.00 0.00 61.98 62.16 1z8r s VAL 74 Cb -0.26 -0.26 -0.05 0.00 0.00 0.00 0.00 36.38 35.82 1z8r s VAL 74 CO 0.20 -0.03 0.25 -0.94 0.00 0.00 0.00 175.10 174.58 1z8r s SER 75 N -0.37 6.47 0.25 3.32 1.04 -1.26 0.02 113.70 123.17 1z8r s SER 75 Ca -0.02 0.55 -0.01 0.00 0.48 0.00 0.00 55.95 56.96 1z8r s SER 75 Cb -0.03 -2.15 -0.03 0.00 0.10 0.00 0.00 66.02 63.91 1z8r s SER 75 CO -0.00 0.25 0.23 0.72 0.98 0.00 0.00 173.24 175.42 1z8r s PHE 76 N -0.30 1.20 0.25 5.02 -0.12 -0.01 -4.53 117.98 119.48 1z8r s PHE 76 Ca 0.16 -1.36 0.09 0.00 -0.05 0.00 0.00 56.93 55.77 1z8r s PHE 76 Cb -0.13 -0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 41.74 1z8r s PHE 76 CO 0.05 -0.77 0.02 -1.21 -0.05 0.00 0.00 175.22 173.26 1z8r s GLU 77 N -3.90 2.38 -0.99 1.99 2.02 -0.97 -4.74 118.70 114.50 1z8r s GLU 77 Ca 0.37 -1.31 -0.02 0.00 0.02 0.00 0.00 54.97 54.03 1z8r s GLU 77 Cb 0.05 -2.25 0.30 0.00 0.10 0.00 0.00 34.13 32.33 1z8r s GLU 77 CO 0.16 0.39 1.40 0.41 0.02 0.00 0.00 175.26 177.63 1z8r n GLY 78 N -0.76 5.26 3.76 -1.39 0.00 -1.26 -2.24 105.19 108.56 1z8r n GLY 78 Ca -0.07 -2.68 -0.41 0.00 0.00 0.00 0.00 46.02 42.86 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 -2.96 4.38 0.00 1.61 0.04 -1.00 -4.87 135.00 132.20 1z8r s PRO 79 Ca 0.34 2.17 0.00 0.00 0.04 0.00 0.00 61.00 63.55 1z8r s PRO 79 Cb 0.09 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 31.53 1z8r s PRO 79 CO 0.06 -0.17 0.00 0.41 0.04 0.00 0.00 177.00 177.34 1z8r n GLY 80 N 1.06 -2.04 3.63 0.56 0.00 -1.26 -2.29 105.19 104.85 1z8r n GLY 80 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 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 0.00 4.08 -0.13 0.99 1.98 -1.26 0.11 118.68 124.44 1z8r s LEU 81 Ca 0.00 0.15 0.02 0.00 -2.89 0.00 0.00 54.13 51.42 1z8r s LEU 81 Cb 0.00 -2.21 0.01 0.00 0.66 0.00 0.00 46.19 44.64 1z8r s LEU 81 CO 0.00 -0.03 -0.21 -0.69 -1.89 0.00 0.00 176.35 173.53 1z8r s VAL 82 N 1.46 2.18 -0.44 1.68 1.01 -0.81 -5.00 120.40 120.49 1z8r s VAL 82 Ca 0.10 -0.95 -0.28 0.00 0.00 0.00 0.00 61.98 60.85 1z8r s VAL 82 Cb -0.15 -1.87 -0.00 0.00 0.00 0.00 0.00 36.38 34.36 1z8r s VAL 82 CO 0.08 0.55 1.59 -0.70 0.00 0.00 0.00 175.10 176.62 1z8r s GLU 83 N 0.71 3.33 -0.29 2.72 -6.30 -1.26 -2.30 118.70 115.31 1z8r s GLU 83 Ca -0.09 0.97 -0.29 0.00 -2.50 0.00 0.00 54.97 53.06 1z8r s GLU 83 Cb -0.16 -4.14 -0.00 0.00 0.00 0.00 0.00 34.13 29.82 1z8r s GLU 83 CO 0.01 -1.87 1.37 0.08 0.02 0.00 0.00 175.26 174.87 1z8r s VAL 84 N 6.46 4.04 0.53 3.70 1.01 0.14 -4.97 120.40 131.32 1z8r s VAL 84 Ca 0.66 1.17 -0.20 0.00 0.00 0.00 0.00 61.98 63.62 1z8r s VAL 84 Cb -0.16 -4.07 -0.06 0.00 0.00 0.00 0.00 36.38 32.09 1z8r s VAL 84 CO 0.30 -0.45 1.11 -1.10 0.00 0.00 0.00 175.10 174.97 1z8r s GLN 85 N 4.30 3.47 -0.56 2.72 -1.52 -1.26 -1.56 119.66 125.23 1z8r s GLN 85 Ca 0.59 1.57 -0.27 0.00 -1.95 0.00 0.00 55.36 55.31 1z8r s GLN 85 Cb -0.18 -2.05 -0.03 0.00 -0.22 0.00 0.00 33.01 30.53 1z8r s GLN 85 CO 0.25 -0.75 1.94 -1.83 -0.25 0.00 0.00 175.29 174.65 1z8r s GLU 86 N -3.24 2.61 -0.03 2.91 -1.05 -1.26 -4.58 118.70 114.06 1z8r s GLU 86 Ca 0.71 0.82 -0.07 0.00 -0.15 0.00 0.00 54.97 56.28 1z8r s GLU 86 Cb -0.23 -4.40 0.01 0.00 -0.44 0.00 0.00 34.13 29.07 1z8r s GLU 86 CO 0.26 -2.74 0.16 -1.54 0.95 0.00 0.00 175.26 172.36 1z8r s SER 87 N 8.56 -0.08 -0.04 0.83 1.04 0.03 -4.90 113.70 119.14 1z8r s SER 87 Ca 0.73 0.08 -0.01 0.00 0.48 0.00 0.00 55.95 57.23 1z8r s SER 87 Cb -0.14 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.27 1z8r s SER 87 CO 0.23 -0.23 0.02 1.21 0.98 0.00 0.00 173.24 175.45 1z8r n GLU 88 N 2.18 -1.19 -2.13 4.02 2.13 -1.26 -2.02 120.64 122.36 1z8r n GLU 88 Ca -0.18 1.30 0.00 0.00 0.66 0.00 0.00 57.16 58.94 1z8r n GLU 88 Cb 0.57 -1.65 0.00 0.00 0.27 0.00 0.00 31.44 30.63 1z8r n GLU 88 CO 0.00 0.00 0.00 2.48 -0.41 0.00 0.00 177.13 179.20 1z8r n TYR 89 N 1.64 -1.69 -4.13 4.31 0.18 -1.26 -4.87 117.16 111.34 1z8r n TYR 89 Ca -0.03 0.00 -0.24 0.00 1.88 0.00 0.00 57.90 59.51 1z8r n TYR 89 Cb 0.30 -0.90 -0.17 0.00 -0.38 0.00 0.00 39.34 38.20 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 -1.69 1.17 0.28 -3.48 5.04 -0.86 -5.14 117.35 112.68 1z8r s TYR 90 Ca 0.00 -0.47 -0.15 0.00 -2.44 0.00 0.00 57.07 54.01 1z8r s TYR 90 Cb 0.00 -0.98 -0.09 0.00 0.35 0.00 0.00 41.96 41.24 1z8r s TYR 90 CO 0.00 -0.34 0.70 -1.25 -1.34 0.00 0.00 175.55 173.32 1z8r s PRO 91 N 1.26 4.01 -0.91 4.97 0.04 -1.26 -0.79 135.00 142.33 1z8r s PRO 91 Ca -0.04 0.64 -0.20 0.00 0.04 0.00 0.00 61.00 61.44 1z8r s PRO 91 Cb -0.14 -2.56 -0.24 0.00 0.04 0.00 0.00 34.50 31.60 1z8r s PRO 91 CO -0.02 0.23 2.37 1.63 0.04 0.00 0.00 177.00 181.25 1z8r n LYS 92 N -0.10 0.21 -4.55 4.56 5.02 -1.26 -4.61 118.16 117.43 1z8r n LYS 92 Ca 0.02 -0.16 -0.26 0.00 -2.02 0.00 0.00 58.31 55.89 1z8r n LYS 92 Cb 0.53 -1.88 -0.11 0.00 -0.02 0.00 0.00 35.03 33.55 1z8r n LYS 92 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1z8r s ARG 93 N 8.01 1.85 -0.17 1.97 6.06 -0.60 -4.95 118.95 131.12 1z8r s ARG 93 Ca 1.22 -2.05 -0.07 0.00 -2.50 0.00 0.00 55.73 52.33 1z8r s ARG 93 Cb -0.75 -1.28 -0.04 0.00 0.06 0.00 0.00 34.95 32.94 1z8r s ARG 93 CO 0.43 -0.14 0.08 0.71 -2.50 0.00 0.00 175.30 173.88 1z8r s TYR 94 N -2.98 3.32 -0.22 5.12 1.51 -1.26 0.28 117.35 123.12 1z8r s TYR 94 Ca 0.34 0.19 0.01 0.00 -1.01 0.00 0.00 57.07 56.59 1z8r s TYR 94 Cb 0.09 -2.04 0.06 0.00 -0.11 0.00 0.00 41.96 39.95 1z8r s TYR 94 CO 0.16 0.30 -0.06 -1.14 -1.11 0.00 0.00 175.55 173.70 1z8r s GLN 95 N 0.03 1.62 0.45 -0.62 0.74 -0.89 -4.10 119.66 116.89 1z8r s GLN 95 Ca 0.07 -0.92 -0.14 0.00 0.05 0.00 0.00 55.36 54.42 1z8r s GLN 95 Cb -0.12 -2.51 -0.08 0.00 1.10 0.00 0.00 33.01 31.40 1z8r s GLN 95 CO 0.01 -0.57 0.88 -1.54 -0.55 0.00 0.00 175.29 173.52 1z8r s SER 96 N 1.43 6.62 -1.02 6.67 1.04 0.31 -1.93 113.70 126.80 1z8r s SER 96 Ca -0.05 1.39 -0.11 0.00 0.48 0.00 0.00 55.95 57.66 1z8r s SER 96 Cb -0.18 -2.43 -0.03 0.00 0.10 0.00 0.00 66.02 63.48 1z8r s SER 96 CO -0.07 -0.47 0.81 1.41 0.98 0.00 0.00 173.24 175.91 1z8r n HIS 97 N -1.31 -2.29 -4.61 5.02 8.25 0.29 -4.49 115.22 116.08 1z8r n HIS 97 Ca 0.05 0.73 -0.26 0.00 -0.26 0.00 0.00 57.72 57.97 1z8r n HIS 97 Cb 0.54 -3.75 -0.14 0.00 1.12 0.00 0.00 29.99 27.76 1z8r n HIS 97 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1z8r s VAL 98 N -3.33 1.79 0.02 1.59 0.11 -0.97 -2.22 120.40 117.39 1z8r s VAL 98 Ca 0.37 -1.33 0.01 0.00 -2.93 0.00 0.00 61.98 58.10 1z8r s VAL 98 Cb -0.09 -1.57 -0.04 0.00 -1.53 0.00 0.00 36.38 33.15 1z8r s VAL 98 CO 0.80 0.18 0.07 -0.76 -3.33 0.00 0.00 175.10 172.06 1z8r s LEU 99 N -1.37 3.80 0.01 2.54 1.02 0.26 -2.38 118.68 122.57 1z8r s LEU 99 Ca 0.08 0.08 0.03 0.00 0.02 0.00 0.00 54.13 54.34 1z8r s LEU 99 Cb -0.09 -2.29 -0.01 0.00 0.02 0.00 0.00 46.19 43.81 1z8r s LEU 99 CO 0.03 0.24 -0.10 -0.76 0.02 0.00 0.00 176.35 175.78 1z8r s LEU 100 N -1.90 2.10 -0.14 1.79 1.43 -0.95 -0.16 118.68 120.86 1z8r s LEU 100 Ca 0.24 -0.30 -0.14 0.00 -1.03 0.00 0.00 54.13 52.90 1z8r s LEU 100 Cb -0.12 -0.43 0.04 0.00 0.03 0.00 0.00 46.19 45.71 1z8r s LEU 100 CO 0.16 0.03 0.39 0.00 0.23 0.00 0.00 176.35 177.16 1z8r s ALA 101 N -0.57 -0.97 -0.30 4.21 0.00 -0.92 -2.28 121.76 120.93 1z8r s ALA 101 Ca 0.01 1.06 -0.16 0.00 0.00 0.00 0.00 51.96 52.87 1z8r s ALA 101 Cb -0.06 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.46 1z8r s ALA 101 CO 0.00 -0.20 0.40 -0.08 0.00 0.00 0.00 175.76 175.89 1z8r s THR 102 N 0.07 5.14 0.00 0.00 -1.32 -1.26 0.14 115.64 118.41 1z8r s THR 102 Ca -0.01 0.43 0.00 0.00 -1.21 0.00 0.00 61.69 60.90 1z8r s THR 102 Cb -0.03 -3.78 0.00 0.00 -1.51 0.00 0.00 72.50 67.19 1z8r s THR 102 CO 0.01 0.04 0.00 0.61 -2.21 0.00 0.00 174.62 173.07 1z8r n GLY 103 N 4.75 -0.09 2.72 6.08 0.00 -0.73 -4.98 105.19 112.94 1z8r n GLY 103 Ca -0.08 -0.03 -0.05 0.00 0.00 0.00 0.00 46.02 45.86 1z8r n GLY 103 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1z8r n PHE 104 N 0.00 -2.40 -2.58 1.61 7.35 -1.26 -5.05 117.46 115.13 1z8r n PHE 104 Ca 0.00 -1.21 -0.03 0.00 -0.76 0.00 0.00 57.45 55.44 1z8r n PHE 104 Cb 0.00 1.36 0.00 0.00 0.35 0.00 0.00 39.48 41.19 1z8r n PHE 104 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1z8r n SER 105 N 2.16 -7.05 -4.05 -2.13 7.64 -1.26 -5.07 113.62 103.86 1z8r n SER 105 Ca 0.10 0.85 -0.19 0.00 1.01 0.00 0.00 58.87 60.65 1z8r n SER 105 Cb 0.63 -4.68 -0.14 0.00 -1.01 0.00 0.00 64.21 59.00 1z8r n SER 105 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1z8r s GLU 106 N -1.85 0.76 0.06 1.43 2.02 -1.26 -5.08 118.70 114.79 1z8r s GLU 106 Ca 0.10 -0.43 -0.26 0.00 0.02 0.00 0.00 54.97 54.40 1z8r s GLU 106 Cb -0.03 -0.73 -0.12 0.00 0.10 0.00 0.00 34.13 33.35 1z8r s GLU 106 CO 0.65 0.19 1.40 -1.35 0.02 0.00 0.00 175.26 176.18 1z8r h PRO 107 N 5.65 -0.70 0.00 0.39 0.11 -1.97 -3.45 132.00 132.03 1z8r h PRO 107 Ca -0.32 0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1z8r h PRO 107 Cb 1.18 0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.45 1z8r h PRO 107 CO 0.48 -0.47 -0.00 0.41 -0.21 0.00 0.00 178.00 178.21 1z8r n GLY 108 N -1.40 -0.17 4.31 -0.55 0.00 -1.26 -5.01 105.19 101.10 1z8r n GLY 108 Ca -0.09 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.02 1z8r n GLY 108 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1z8r n ASP 109 N -3.03 -6.63 -1.72 1.61 8.00 -1.26 -4.86 116.55 108.65 1z8r n ASP 109 Ca 0.00 0.68 0.00 0.00 0.71 0.00 0.00 54.79 56.18 1z8r n ASP 109 Cb 0.00 -1.92 0.00 0.00 -0.02 0.00 0.00 41.12 39.18 1z8r n ASP 109 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1z8r n ALA 110 N -1.04 -2.39 -2.08 2.24 0.00 -1.26 -4.75 120.51 111.23 1z8r n ALA 110 Ca 0.00 0.30 -0.01 0.00 0.00 0.00 0.00 53.44 53.73 1z8r n ALA 110 Cb 0.29 -0.98 0.01 0.00 0.00 0.00 0.00 19.45 18.77 1z8r n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1z8r n GLY 111 N 1.16 -0.11 0.00 0.00 0.00 -1.18 -4.64 105.19 100.41 1z8r n GLY 111 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1z8r n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1z8r n GLY 112 N -0.23 2.91 3.24 -0.02 0.00 -1.26 -4.76 105.19 105.07 1z8r n GLY 112 Ca -0.07 -0.11 -0.24 0.00 0.00 0.00 0.00 46.02 45.60 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 0.16 1.56 -0.24 -0.61 -5.25 -1.26 0.61 121.20 116.16 1z8r s ILE 113 Ca 0.00 -1.27 -0.23 0.00 -0.99 0.00 0.00 60.65 58.17 1z8r s ILE 113 Cb 0.00 -1.38 -0.01 0.00 2.95 0.00 0.00 42.46 44.01 1z8r s ILE 113 CO 0.00 0.07 0.73 -0.22 -1.79 0.00 0.00 174.94 173.74 1z8r s LEU 114 N -1.41 4.08 0.05 0.37 2.96 0.14 -3.97 118.68 120.91 1z8r s LEU 114 Ca 0.06 0.89 0.08 0.00 -0.22 0.00 0.00 54.13 54.94 1z8r s LEU 114 Cb -0.09 -3.03 -0.03 0.00 0.50 0.00 0.00 46.19 43.54 1z8r s LEU 114 CO 0.02 -0.43 -0.22 0.00 -1.32 0.00 0.00 176.35 174.40 1z8r s ARG 115 N 2.61 1.92 0.33 1.98 1.70 -0.91 -0.38 118.95 126.20 1z8r s ARG 115 Ca 0.31 -1.06 0.08 0.00 -0.47 0.00 0.00 55.73 54.59 1z8r s ARG 115 Cb -0.15 -2.08 -0.03 0.00 -0.57 0.00 0.00 34.95 32.11 1z8r s ARG 115 CO 0.08 0.52 0.22 0.00 -1.08 0.00 0.00 175.30 175.05 1z8r h GLU 117 N 1.40 0.00 0.03 0.00 4.81 -1.99 -0.59 114.58 118.24 1z8r h GLU 117 Ca -0.45 0.00 -0.33 0.00 -0.13 0.00 0.00 59.36 58.45 1z8r h GLU 117 Cb 1.25 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.59 1z8r h GLU 117 CO 0.60 0.00 -1.97 0.72 -0.73 0.00 0.00 179.01 177.64 1z8r n HIS 118 N -2.89 0.82 0.00 0.92 8.25 -1.26 -5.08 115.22 115.98 1z8r n HIS 118 Ca -0.02 0.25 0.00 0.00 -0.26 0.00 0.00 57.72 57.68 1z8r n HIS 118 Cb 0.18 -1.13 0.00 0.00 1.12 0.00 0.00 29.99 30.15 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 1.77 -0.49 3.46 -1.41 0.00 -0.23 -4.68 105.19 103.62 1z8r n GLY 119 Ca -0.26 0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 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 0.00 3.25 -0.28 1.61 1.01 0.16 0.11 120.40 126.27 1z8r s VAL 120 Ca 0.00 -0.63 -0.12 0.00 0.00 0.00 0.00 61.98 61.23 1z8r s VAL 120 Cb 0.00 -2.33 -0.12 0.00 0.00 0.00 0.00 36.38 33.93 1z8r s VAL 120 CO 0.00 0.56 -0.35 -0.38 0.00 0.00 0.00 175.10 174.94 1z8r n ILE 121 N 2.82 1.52 -3.08 2.22 5.41 0.49 0.29 119.36 129.03 1z8r n ILE 121 Ca -0.18 -0.41 0.00 0.00 1.00 0.00 0.00 62.75 63.17 1z8r n ILE 121 Cb 0.53 -1.83 0.00 0.00 -0.71 0.00 0.00 39.64 37.62 1z8r n ILE 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1z8r n GLY 122 N 1.36 1.45 3.60 7.39 0.00 -0.82 0.43 105.19 118.60 1z8r n GLY 122 Ca -0.54 -0.80 -0.25 0.00 0.00 0.00 0.00 46.02 44.43 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 2.92 0.11 0.99 2.34 0.25 0.29 118.68 125.57 1z8r s LEU 123 Ca 0.00 -1.01 -0.31 0.00 0.06 0.00 0.00 54.13 52.87 1z8r s LEU 123 Cb 0.00 -1.29 -0.08 0.00 -0.56 0.00 0.00 46.19 44.27 1z8r s LEU 123 CO 0.00 -0.20 1.38 0.54 -1.06 0.00 0.00 176.35 177.01 1z8r s VAL 124 N -2.52 3.36 0.00 1.48 0.11 0.20 0.11 120.40 123.14 1z8r s VAL 124 Ca 0.34 0.97 0.00 0.00 -2.93 0.00 0.00 61.98 60.36 1z8r s VAL 124 Cb -0.00 -3.62 0.00 0.00 -1.53 0.00 0.00 36.38 31.22 1z8r s VAL 124 CO 0.18 0.07 0.00 0.41 -3.33 0.00 0.00 175.10 172.44 1z8r n THR 125 N 3.95 0.00 -3.82 5.04 -1.04 0.41 -4.68 114.28 114.14 1z8r n THR 125 Ca 0.11 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 62.00 1z8r n THR 125 Cb 0.43 -0.09 -0.13 0.00 -1.82 0.00 0.00 70.33 68.72 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 0.54 0.18 0.18 -2.82 -1.94 0.60 -4.95 119.30 111.09 1z8r s MET 126 Ca 0.00 0.19 0.09 0.00 -1.71 0.00 0.00 55.69 54.26 1z8r s MET 126 Cb 0.00 0.09 -0.04 0.00 2.01 0.00 0.00 34.83 36.88 1z8r s MET 126 CO 0.00 -0.02 -0.12 0.20 -0.01 0.00 0.00 175.02 175.07 1z8r s GLY 127 N 0.05 1.73 0.00 -0.03 0.00 -1.26 -0.30 107.32 107.50 1z8r s GLY 127 Ca -0.00 -1.50 0.00 0.00 0.00 0.00 0.00 44.72 43.22 1z8r s GLY 127 CO 0.00 -1.52 0.00 0.61 0.00 0.00 0.00 173.10 172.19 1z8r n GLY 128 N 0.06 1.25 0.25 0.20 0.00 0.04 -4.89 105.19 102.11 1z8r n GLY 128 Ca -0.11 -1.63 0.16 0.00 0.00 0.00 0.00 46.02 44.44 1z8r n GLY 128 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1z8r h GLU 129 N 0.00 0.00 0.00 1.61 5.08 -1.95 -3.36 114.58 115.96 1z8r h GLU 129 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 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 -0.03 0.41 -1.00 0.00 0.00 179.01 178.39 1z8r n GLY 130 N 0.22 0.66 3.42 -3.84 0.00 -1.26 -4.66 105.19 99.73 1z8r n GLY 130 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 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 2.26 -0.22 1.61 1.01 -1.26 -1.77 120.40 122.03 1z8r s VAL 131 Ca 0.00 -2.17 -0.01 0.00 0.00 0.00 0.00 61.98 59.79 1z8r s VAL 131 Cb 0.00 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 34.25 1z8r s VAL 131 CO 0.00 -0.30 -0.10 0.68 0.00 0.00 0.00 175.10 175.38 1z8r s VAL 132 N -2.16 2.78 -0.33 2.92 -7.23 0.38 -0.78 120.40 115.97 1z8r s VAL 132 Ca 0.24 -0.81 -0.12 0.00 -1.81 0.00 0.00 61.98 59.47 1z8r s VAL 132 Cb -0.06 -2.29 -0.01 0.00 0.56 0.00 0.00 36.38 34.58 1z8r s VAL 132 CO 0.11 0.39 0.22 -0.83 -0.31 0.00 0.00 175.10 174.67 1z8r s GLY 133 N 1.37 1.94 -0.03 2.32 0.00 0.59 -2.16 107.32 111.34 1z8r s GLY 133 Ca 0.04 -1.39 0.06 0.00 0.00 0.00 0.00 44.72 43.42 1z8r s GLY 133 CO -0.07 0.76 -0.21 -1.36 0.00 0.00 0.00 173.10 172.22 1z8r s PHE 134 N 1.69 2.49 -0.36 1.90 0.08 0.78 -0.29 117.98 124.27 1z8r s PHE 134 Ca 0.06 -0.33 -0.22 0.00 0.12 0.00 0.00 56.93 56.56 1z8r s PHE 134 Cb -0.17 -1.56 0.01 0.00 -0.57 0.00 0.00 43.02 40.72 1z8r s PHE 134 CO 0.09 0.05 0.72 0.00 -0.10 0.00 0.00 175.22 175.98 1z8r s ALA 135 N -0.64 3.45 0.30 5.36 0.00 0.31 0.90 121.76 131.43 1z8r s ALA 135 Ca 0.10 -0.72 -0.29 0.00 0.00 0.00 0.00 51.96 51.05 1z8r s ALA 135 Cb -0.10 -3.27 -0.09 0.00 0.00 0.00 0.00 23.12 19.65 1z8r s ALA 135 CO -0.00 -1.40 1.09 0.16 0.00 0.00 0.00 175.76 175.61 1z8r s ASP 136 N 1.80 7.20 -0.00 0.00 1.47 -0.94 0.85 116.67 127.05 1z8r s ASP 136 Ca 0.28 2.22 0.11 0.00 1.18 0.00 0.00 52.55 56.35 1z8r s ASP 136 Cb -0.14 -2.62 0.31 0.00 -0.34 0.00 0.00 42.92 40.14 1z8r s ASP 136 CO 0.16 -0.19 1.26 0.52 0.68 0.00 0.00 175.17 177.60 1z8r n VAL 137 N 1.00 0.48 0.71 2.11 0.31 0.17 -4.04 118.33 119.07 1z8r n VAL 137 Ca -0.00 -0.48 0.08 0.00 -0.01 0.00 0.00 64.34 63.93 1z8r n VAL 137 Cb 0.46 0.23 0.39 0.00 -0.91 0.00 0.00 33.84 34.01 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 0.54 0.17 -0.32 5.55 5.12 -1.26 -2.26 116.66 124.20 1z8r n ARG 138 Ca 0.12 0.16 0.08 0.00 -1.93 0.00 0.00 57.85 56.28 1z8r n ARG 138 Cb 0.30 -1.50 0.25 0.00 -1.16 0.00 0.00 32.46 30.35 1z8r n ARG 138 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1z8r n ASP 139 N -1.35 3.12 -2.66 0.55 2.03 -1.26 -4.49 116.55 112.50 1z8r n ASP 139 Ca 0.07 -2.08 -0.03 0.00 0.52 0.00 0.00 54.79 53.27 1z8r n ASP 139 Cb 0.15 -0.40 0.11 0.00 -0.72 0.00 0.00 41.12 40.25 1z8r n ASP 139 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1z8r n LEU 140 N 1.04 -1.14 0.11 -2.67 -0.00 -0.96 -5.01 117.00 108.38 1z8r n LEU 140 Ca 0.19 -1.69 0.13 0.00 -0.00 0.00 0.00 56.01 54.63 1z8r n LEU 140 Cb 0.52 0.87 0.43 0.00 -0.00 0.00 0.00 43.42 45.24 1z8r n LEU 140 CO 0.14 1.55 0.88 -0.11 -0.00 0.00 0.00 177.39 179.85 1z8r n LEU 141 N 0.76 0.78 -4.35 1.47 -0.00 -1.18 -4.65 117.00 109.82 1z8r n LEU 141 Ca -0.05 0.60 -0.15 0.00 -0.00 0.00 0.00 56.01 56.42 1z8r n LEU 141 Cb 0.75 -0.39 -0.10 0.00 -0.00 0.00 0.00 43.42 43.68 1z8r n LEU 141 CO -0.12 -0.28 1.08 -2.67 -0.00 0.00 0.00 177.39 175.39 1z8r n TRP 142 N -2.26 0.63 0.00 1.96 4.27 -1.26 -3.64 117.44 117.14 1z8r n TRP 142 Ca 0.05 -0.17 0.00 0.00 -3.89 0.00 0.00 57.50 53.49 1z8r n TRP 142 Cb 0.38 -2.01 0.00 0.00 -1.36 0.00 0.00 31.31 28.31 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 15.95 0.00 0.00 5.67 4.32 -1.26 -5.02 117.00 136.65 1z8r n LEU 143 Ca 0.34 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.33 1z8r n LEU 143 Cb 0.46 0.05 0.00 0.00 -1.62 0.00 0.00 43.42 42.31 1z8r n LEU 143 CO 0.63 -0.33 0.00 -1.84 -1.22 0.00 0.00 177.39 174.63 1z8r n GLU 144 N -2.17 0.00 -2.07 3.23 0.28 -1.24 -4.64 120.64 114.04 1z8r n GLU 144 Ca 0.00 0.00 -0.40 0.00 -0.16 0.00 0.00 57.16 56.60 1z8r n GLU 144 Cb 0.00 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 32.86 1z8r n GLU 144 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1z8r s ASP 145 N 0.66 6.38 0.39 -1.84 1.01 -1.26 -5.01 116.67 116.99 1z8r s ASP 145 Ca 0.00 2.65 -0.11 0.00 0.71 0.00 0.00 52.55 55.81 1z8r s ASP 145 Cb 0.00 -2.64 -0.07 0.00 1.01 0.00 0.00 42.92 41.22 1z8r s ASP 145 CO 0.00 -0.80 0.75 -1.81 0.21 0.00 0.00 175.17 173.52 1z8r s ASP 146 N -0.71 6.55 -0.27 0.27 1.01 -1.26 -4.72 116.67 117.53 1z8r s ASP 146 Ca 0.56 1.12 -0.15 0.00 0.71 0.00 0.00 52.55 54.79 1z8r s ASP 146 Cb -0.38 -2.32 -0.04 0.00 1.01 0.00 0.00 42.92 41.19 1z8r s ASP 146 CO 0.49 -0.36 0.36 0.00 0.21 0.00 0.00 175.17 175.88 1z8r s ALA 147 N -2.30 3.56 1.08 5.23 0.00 -1.24 -4.87 121.76 123.23 1z8r s ALA 147 Ca 0.51 -0.83 -0.14 0.00 0.00 0.00 0.00 51.96 51.50 1z8r s ALA 147 Cb -0.10 -2.70 0.20 0.00 0.00 0.00 0.00 23.12 20.52 1z8r s ALA 147 CO 0.29 -0.65 0.95 -1.33 0.00 0.00 0.00 175.76 175.02 1z8r n MET 148 N 5.32 -1.72 -3.98 0.00 0.00 -1.26 -2.38 117.12 113.09 1z8r n MET 148 Ca -0.09 -1.48 -0.11 0.00 0.00 0.00 0.00 57.70 56.02 1z8r n MET 148 Cb 0.51 -1.14 -0.03 0.00 0.00 0.00 0.00 33.22 32.56 1z8r n MET 148 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 175.97 174.14 1z8r s GLU 149 N -5.10 1.90 0.00 0.03 4.04 -1.26 -4.84 118.70 113.48 1z8r s GLU 149 Ca 0.57 -1.51 0.00 0.00 0.04 0.00 0.00 54.97 54.06 1z8r s GLU 149 Cb -0.03 0.51 0.00 0.00 0.02 0.00 0.00 34.13 34.62 1z8r s GLU 149 CO 0.41 -0.82 0.00 0.00 -1.84 0.00 0.00 175.26 173.01