#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 -0.69 0.00 1.61 0.11 -1.86 -3.45 132.00 127.73 1z8r h PRO 2 Ca 0.00 0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1z8r h PRO 2 Cb 0.00 0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.27 1z8r h PRO 2 CO 0.00 -0.46 0.00 0.98 -0.21 0.00 0.00 178.00 178.31 1z8r n TYR 3 N -4.91 0.00 0.00 0.65 9.36 -1.26 -3.01 117.16 117.99 1z8r n TYR 3 Ca -0.08 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.14 1z8r n TYR 3 Cb 0.36 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.07 1z8r n TYR 3 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1z8r n GLY 4 N 0.00 -0.09 3.67 2.98 0.00 -1.26 -5.13 105.19 105.35 1z8r n GLY 4 Ca 0.00 -0.05 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 1z8r n GLY 4 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1z8r s HIS 5 N -1.42 3.04 0.05 1.61 -3.43 -1.16 -4.91 115.29 109.06 1z8r s HIS 5 Ca 0.00 0.06 0.00 0.00 -0.80 0.00 0.00 55.06 54.32 1z8r s HIS 5 Cb 0.00 -1.66 0.00 0.00 -1.43 0.00 0.00 32.58 29.49 1z8r s HIS 5 CO 0.00 0.45 0.00 1.04 -2.00 0.00 0.00 174.74 174.23 1z8r n GLN 6 N 1.42 -5.14 -1.14 -0.38 3.00 -1.26 -4.75 117.38 109.13 1z8r n GLN 6 Ca -0.15 3.73 0.02 0.00 -0.01 0.00 0.00 57.00 60.59 1z8r n GLN 6 Cb 0.53 -4.56 0.12 0.00 0.00 0.00 0.00 30.24 26.33 1z8r n GLN 6 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1z8r n SER 7 N 1.80 1.75 -2.69 1.08 7.64 -1.26 -4.33 113.62 117.62 1z8r n SER 7 Ca 0.00 -3.17 -0.05 0.00 1.01 0.00 0.00 58.87 56.66 1z8r n SER 7 Cb 0.00 -0.44 0.10 0.00 -1.01 0.00 0.00 64.21 62.87 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 -0.53 -0.74 3.76 0.23 0.00 -1.26 -4.94 105.19 101.71 1z8r n GLY 8 Ca 0.16 0.56 -0.08 0.00 0.00 0.00 0.00 46.02 46.66 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 0.13 -0.85 -0.29 4.61 0.00 -1.26 -4.75 121.76 119.36 1z8r s ALA 9 Ca 0.21 -0.53 -0.07 0.00 0.00 0.00 0.00 51.96 51.57 1z8r s ALA 9 Cb 0.29 0.92 -0.00 0.00 0.00 0.00 0.00 23.12 24.33 1z8r s ALA 9 CO -0.15 -0.97 0.08 0.08 0.00 0.00 0.00 175.76 174.80 1z8r s VAL 10 N -3.87 4.11 -0.34 0.00 1.01 -0.98 -5.02 120.40 115.31 1z8r s VAL 10 Ca 0.15 -0.54 -0.14 0.00 0.00 0.00 0.00 61.98 61.45 1z8r s VAL 10 Cb -0.04 -3.07 -0.01 0.00 0.00 0.00 0.00 36.38 33.26 1z8r s VAL 10 CO 0.08 0.14 0.32 -0.47 0.00 0.00 0.00 175.10 175.18 1z8r s TYR 11 N 1.54 3.22 -0.26 5.22 5.04 -1.26 -2.02 117.35 128.83 1z8r s TYR 11 Ca 0.04 -0.07 0.03 0.00 -2.44 0.00 0.00 57.07 54.63 1z8r s TYR 11 Cb -0.17 -2.61 0.06 0.00 0.35 0.00 0.00 41.96 39.60 1z8r s TYR 11 CO 0.03 -0.40 -0.08 0.08 -1.34 0.00 0.00 175.55 173.84 1z8r s VAL 12 N 1.93 2.02 0.00 3.14 1.01 0.18 -2.03 120.40 126.64 1z8r s VAL 12 Ca 0.10 -1.62 0.00 0.00 0.00 0.00 0.00 61.98 60.46 1z8r s VAL 12 Cb -0.17 -2.20 0.00 0.00 0.00 0.00 0.00 36.38 34.01 1z8r s VAL 12 CO 0.11 -0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.71 1z8r n GLY 13 N 4.47 3.02 1.27 4.51 0.00 -1.26 0.14 105.19 117.35 1z8r n GLY 13 Ca -0.11 0.13 0.05 0.00 0.00 0.00 0.00 46.02 46.08 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 3.84 3.67 -4.13 1.61 4.13 -1.25 -3.28 115.26 119.84 1z8r n ASN 14 Ca 0.00 -2.46 -0.20 0.00 1.68 0.00 0.00 54.58 53.60 1z8r n ASN 14 Cb 0.00 -0.55 -0.14 0.00 -1.54 0.00 0.00 39.78 37.55 1z8r n ASN 14 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 1z8r s TYR 15 N -1.96 1.18 -0.10 3.10 2.02 0.12 -1.88 117.35 119.83 1z8r s TYR 15 Ca 0.34 -0.32 -0.01 0.00 -0.37 0.00 0.00 57.07 56.70 1z8r s TYR 15 Cb 0.24 -0.72 0.03 0.00 -0.40 0.00 0.00 41.96 41.12 1z8r s TYR 15 CO 0.12 0.02 -0.01 0.21 -1.57 0.00 0.00 175.55 174.32 1z8r s LYS 16 N -0.94 0.84 -0.24 -0.62 2.20 0.16 -0.65 119.74 120.49 1z8r s LYS 16 Ca 0.02 -0.08 -0.08 0.00 -0.36 0.00 0.00 55.97 55.47 1z8r s LYS 16 Cb -0.07 -1.32 -0.04 0.00 -1.51 0.00 0.00 37.83 34.89 1z8r s LYS 16 CO 0.01 -0.35 0.09 0.14 -0.36 0.00 0.00 175.35 174.88 1z8r s VAL 17 N 1.88 4.61 0.13 4.02 -7.23 -0.85 -1.02 120.40 121.94 1z8r s VAL 17 Ca 0.04 -0.07 0.01 0.00 -1.81 0.00 0.00 61.98 60.15 1z8r s VAL 17 Cb -0.13 -3.15 -0.04 0.00 0.56 0.00 0.00 36.38 33.61 1z8r s VAL 17 CO -0.06 0.35 -0.03 0.54 -0.31 0.00 0.00 175.10 175.58 1z8r s VAL 18 N 1.39 0.62 0.40 1.32 0.11 -0.99 -2.33 120.40 120.91 1z8r s VAL 18 Ca 0.06 -1.94 -0.27 0.00 -2.93 0.00 0.00 61.98 56.89 1z8r s VAL 18 Cb -0.15 -1.86 -0.10 0.00 -1.53 0.00 0.00 36.38 32.74 1z8r s VAL 18 CO 0.05 -0.70 1.40 0.59 -3.33 0.00 0.00 175.10 173.10 1z8r n ASN 19 N -0.11 3.26 -0.10 3.54 3.02 -1.26 -2.06 115.26 121.54 1z8r n ASN 19 Ca -0.10 1.17 -0.06 0.00 -0.03 0.00 0.00 54.58 55.57 1z8r n ASN 19 Cb 0.62 -1.57 0.02 0.00 -0.61 0.00 0.00 39.78 38.23 1z8r n ASN 19 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1z8r h ARG 20 N 2.53 0.24 0.00 3.52 3.08 0.04 0.13 114.38 123.92 1z8r h ARG 20 Ca -0.49 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.54 1z8r h ARG 20 Cb 1.27 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.26 1z8r h ARG 20 CO 0.62 0.16 0.00 0.72 -1.07 0.00 0.00 179.97 180.40 1z8r n HIS 21 N -5.04 0.00 0.05 3.04 8.25 -1.26 -2.35 115.22 117.90 1z8r n HIS 21 Ca 0.01 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.50 1z8r n HIS 21 Cb 0.14 -0.38 0.05 0.00 1.12 0.00 0.00 29.99 30.92 1z8r n HIS 21 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1z8r n LEU 22 N -1.38 2.04 -4.74 2.41 7.94 0.25 -5.01 117.00 118.51 1z8r n LEU 22 Ca 0.05 -1.57 -0.39 0.00 -1.11 0.00 0.00 56.01 52.99 1z8r n LEU 22 Cb 0.14 -0.07 -0.05 0.00 0.53 0.00 0.00 43.42 43.96 1z8r n LEU 22 CO 0.12 0.49 0.28 0.00 -1.11 0.00 0.00 177.39 177.16 1z8r s ALA 23 N -0.77 3.44 0.75 1.96 0.00 -0.06 -4.79 121.76 122.28 1z8r s ALA 23 Ca 0.09 -0.02 -0.11 0.00 0.00 0.00 0.00 51.96 51.93 1z8r s ALA 23 Cb 0.05 -2.77 0.04 0.00 0.00 0.00 0.00 23.12 20.45 1z8r s ALA 23 CO 0.08 0.04 1.08 0.95 0.00 0.00 0.00 175.76 177.90 1z8r s THR 24 N 0.37 3.50 0.54 0.00 -4.23 -1.26 -4.85 115.64 109.70 1z8r s THR 24 Ca 0.31 0.49 0.27 0.00 -1.18 0.00 0.00 61.69 61.58 1z8r s THR 24 Cb -0.17 -3.22 0.42 0.00 1.34 0.00 0.00 72.50 70.87 1z8r s THR 24 CO 0.15 -0.64 1.97 -0.74 -0.54 0.00 0.00 174.62 174.82 1z8r h HIS 25 N -0.93 0.00 -0.08 3.99 2.76 -1.99 0.34 115.15 119.24 1z8r h HIS 25 Ca -0.45 0.00 -0.11 0.00 -2.20 0.00 0.00 60.37 57.60 1z8r h HIS 25 Cb 1.24 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.19 1z8r h HIS 25 CO 0.54 0.00 -0.46 0.28 -1.30 0.00 0.00 177.93 176.99 1z8r h VAL 26 N 0.00 1.33 -0.31 5.26 2.07 -1.98 0.31 116.25 122.93 1z8r h VAL 26 Ca 0.29 -1.62 -0.07 0.00 0.82 0.00 0.00 66.70 66.11 1z8r h VAL 26 Cb 1.19 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 32.73 1z8r h VAL 26 CO -0.00 0.48 -0.10 0.44 0.02 0.00 0.00 177.57 178.41 1z8r h ASP 27 N 0.15 0.62 0.69 0.57 3.32 -0.66 -2.56 116.42 118.55 1z8r h ASP 27 Ca 0.01 -0.38 -0.14 0.00 0.02 0.00 0.00 57.03 56.54 1z8r h ASP 27 Cb 0.87 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.23 1z8r h ASP 27 CO 0.07 0.86 -0.67 -0.50 -1.72 0.00 0.00 179.24 177.27 1z8r h TRP 28 N 0.38 0.00 -0.64 4.55 4.06 -1.31 0.15 115.95 123.15 1z8r h TRP 28 Ca 0.08 0.00 0.03 0.00 2.06 0.00 0.00 58.89 61.05 1z8r h TRP 28 Cb 0.60 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.72 1z8r h TRP 28 CO 0.05 0.67 0.40 0.37 -3.56 0.00 0.00 178.44 176.37 1z8r h GLN 29 N 0.00 0.76 -0.10 0.49 5.75 -0.15 -2.91 115.11 118.95 1z8r h GLN 29 Ca -0.01 -0.05 -0.05 0.00 -0.15 0.00 0.00 58.65 58.39 1z8r h GLN 29 Cb 1.19 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 29.54 1z8r h GLN 29 CO 0.09 0.50 -0.40 0.09 -2.65 0.00 0.00 178.83 176.46 1z8r n ASN 30 N -4.70 1.94 -4.68 -0.69 3.02 -0.99 -5.03 115.26 104.13 1z8r n ASN 30 Ca 0.06 -3.88 -0.42 0.00 -0.03 0.00 0.00 54.58 50.31 1z8r n ASN 30 Cb 0.08 -0.56 -0.03 0.00 -0.61 0.00 0.00 39.78 38.66 1z8r n ASN 30 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1z8r h VAL 32 N 5.17 0.89 -4.05 0.00 -1.51 0.64 -3.48 116.25 113.91 1z8r h VAL 32 Ca -0.38 -2.50 -0.16 0.00 -1.23 0.00 0.00 66.70 62.44 1z8r h VAL 32 Cb 1.17 2.72 -0.19 0.00 -2.13 0.00 0.00 31.29 32.86 1z8r h VAL 32 CO 0.93 0.86 -0.70 0.86 -1.23 0.00 0.00 177.57 178.30 1z8r s TRP 33 N -2.58 0.38 -0.30 5.19 -0.00 -1.05 -4.97 118.94 115.61 1z8r s TRP 33 Ca -0.17 -0.70 -0.07 0.00 -0.00 0.00 0.00 56.10 55.17 1z8r s TRP 33 Cb 0.06 -0.27 0.16 0.00 -0.00 0.00 0.00 33.47 33.41 1z8r s TRP 33 CO 0.84 -0.24 0.64 -2.00 -0.00 0.00 0.00 176.95 176.20 1z8r s GLU 34 N -2.26 0.56 -0.27 5.86 -6.30 -1.26 0.67 118.70 115.70 1z8r s GLU 34 Ca -0.08 1.25 -0.07 0.00 -2.50 0.00 0.00 54.97 53.57 1z8r s GLU 34 Cb -0.04 0.73 -0.01 0.00 0.00 0.00 0.00 34.13 34.81 1z8r s GLU 34 CO -0.04 -0.36 0.07 -0.51 0.02 0.00 0.00 175.26 174.44 1z8r s ASP 35 N 2.87 5.10 0.08 -1.70 1.01 0.43 -4.97 116.67 119.49 1z8r s ASP 35 Ca 0.05 -0.43 -0.22 0.00 0.71 0.00 0.00 52.55 52.66 1z8r s ASP 35 Cb -0.13 -1.90 -0.12 0.00 1.01 0.00 0.00 42.92 41.78 1z8r s ASP 35 CO -0.20 -0.10 1.65 0.22 0.21 0.00 0.00 175.17 176.95 1z8r h TYR 36 N 8.24 0.14 0.00 4.23 5.03 -1.97 0.50 116.97 133.14 1z8r h TYR 36 Ca -0.36 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 60.95 1z8r h TYR 36 Cb 1.15 -0.04 0.00 0.00 1.55 0.00 0.00 36.73 39.39 1z8r h TYR 36 CO 0.64 0.20 0.00 -0.91 -1.32 0.00 0.00 178.16 176.78 1z8r h ASN 37 N 0.04 0.00 -0.00 -2.11 4.21 -1.93 -0.40 115.58 115.38 1z8r h ASN 37 Ca 0.03 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.54 1z8r h ASN 37 Cb 0.11 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.31 1z8r h ASN 37 CO -0.00 0.00 -0.47 0.54 -1.29 0.00 0.00 177.43 176.21 1z8r n ARG 38 N -2.93 2.54 -4.03 0.81 3.00 -0.81 0.64 116.66 115.87 1z8r n ARG 38 Ca -0.03 -0.26 -0.31 0.00 -0.01 0.00 0.00 57.85 57.24 1z8r n ARG 38 Cb 0.07 -1.12 -0.01 0.00 0.00 0.00 0.00 32.46 31.40 1z8r n ARG 38 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1z8r n ASP 39 N -0.88 -2.86 -4.08 0.55 2.03 0.17 -4.87 116.55 106.61 1z8r n ASP 39 Ca 0.03 -0.93 -0.11 0.00 0.52 0.00 0.00 54.79 54.31 1z8r n ASP 39 Cb 0.22 -3.24 -0.11 0.00 -0.72 0.00 0.00 41.12 37.27 1z8r n ASP 39 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1z8r s LEU 40 N -7.16 2.36 -0.16 -2.67 2.96 -0.97 0.76 118.68 113.79 1z8r s LEU 40 Ca 0.49 -0.73 -0.13 0.00 -0.22 0.00 0.00 54.13 53.54 1z8r s LEU 40 Cb -0.26 -0.05 0.05 0.00 0.50 0.00 0.00 46.19 46.43 1z8r s LEU 40 CO 0.88 -0.35 0.43 -1.48 -1.32 0.00 0.00 176.35 174.51 1z8r s LEU 41 N -2.15 0.23 -0.19 -0.68 2.34 -0.88 -0.43 118.68 116.92 1z8r s LEU 41 Ca -0.03 0.88 -0.09 0.00 0.06 0.00 0.00 54.13 54.95 1z8r s LEU 41 Cb -0.03 1.44 -0.05 0.00 -0.56 0.00 0.00 46.19 46.99 1z8r s LEU 41 CO -0.03 -0.16 0.11 -0.69 -1.06 0.00 0.00 176.35 174.52 1z8r s VAL 42 N 0.56 5.25 0.21 1.48 1.01 0.21 -2.36 120.40 126.77 1z8r s VAL 42 Ca -0.03 0.13 0.10 0.00 0.00 0.00 0.00 61.98 62.18 1z8r s VAL 42 Cb -0.04 -3.38 -0.05 0.00 0.00 0.00 0.00 36.38 32.91 1z8r s VAL 42 CO -0.03 0.46 -0.19 -0.94 0.00 0.00 0.00 175.10 174.40 1z8r s SER 43 N 0.28 3.03 -0.13 3.32 1.04 -0.19 0.12 113.70 121.17 1z8r s SER 43 Ca 0.07 -0.94 -0.12 0.00 0.48 0.00 0.00 55.95 55.44 1z8r s SER 43 Cb -0.11 -0.21 -0.05 0.00 0.10 0.00 0.00 66.02 65.75 1z8r s SER 43 CO -0.01 -0.02 0.25 0.42 0.98 0.00 0.00 173.24 174.86 1z8r s THR 44 N -2.32 5.32 -0.17 2.02 -4.23 -1.17 0.35 115.64 115.44 1z8r s THR 44 Ca 0.22 0.46 0.16 0.00 -1.18 0.00 0.00 61.69 61.35 1z8r s THR 44 Cb -0.05 -3.56 -0.22 0.00 1.34 0.00 0.00 72.50 70.01 1z8r s THR 44 CO 0.09 0.49 0.08 0.35 -0.54 0.00 0.00 174.62 175.09 1z8r n THR 45 N 2.83 1.16 -2.41 3.99 -2.24 -0.79 -4.96 114.28 111.86 1z8r n THR 45 Ca -0.15 -0.74 -0.14 0.00 -2.27 0.00 0.00 64.05 60.75 1z8r n THR 45 Cb 0.53 -0.50 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 1z8r n THR 45 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1z8r n THR 46 N -2.63 -0.86 -3.63 4.28 -1.04 -1.26 -4.98 114.28 104.16 1z8r n THR 46 Ca -0.28 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.73 1z8r n THR 46 Cb 1.05 -2.32 0.00 0.00 -1.82 0.00 0.00 70.33 67.25 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 -2.04 0.00 -1.78 2.41 0.00 -1.26 -5.08 120.51 112.76 1z8r n ALA 47 Ca -0.14 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.93 1z8r n ALA 47 Cb 0.61 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.03 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 -2.65 3.31 0.00 0.00 5.65 -1.26 -3.97 115.29 116.36 1z8r s HIS 48 Ca 0.00 1.65 0.00 0.00 0.25 0.00 0.00 55.06 56.96 1z8r s HIS 48 Cb 0.00 -3.16 0.00 0.00 -1.18 0.00 0.00 32.58 28.24 1z8r s HIS 48 CO 0.00 -0.65 0.00 0.41 -0.65 0.00 0.00 174.74 173.85 1z8r n GLY 49 N 0.50 -0.78 0.36 1.59 0.00 -1.21 -4.80 105.19 100.85 1z8r n GLY 49 Ca 0.04 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.90 1z8r n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z8r s ASP 51 N -1.46 4.02 -0.13 0.00 1.01 -0.86 -5.06 116.67 114.19 1z8r s ASP 51 Ca 0.00 -1.00 0.01 0.00 0.71 0.00 0.00 52.55 52.27 1z8r s ASP 51 Cb 0.00 -0.49 0.02 0.00 1.01 0.00 0.00 42.92 43.46 1z8r s ASP 51 CO 0.00 -0.15 -0.14 -0.89 0.21 0.00 0.00 175.17 174.20 1z8r s THR 52 N -2.51 1.49 0.26 -1.27 2.01 -1.26 -4.51 115.64 109.85 1z8r s THR 52 Ca 0.33 -0.61 -0.30 0.00 0.31 0.00 0.00 61.69 61.43 1z8r s THR 52 Cb -0.01 -1.39 -0.09 0.00 0.01 0.00 0.00 72.50 71.01 1z8r s THR 52 CO 0.18 0.44 1.08 -0.63 -0.69 0.00 0.00 174.62 175.00 1z8r s ILE 53 N 1.28 3.61 -0.16 1.82 1.01 -1.26 0.05 121.20 127.54 1z8r s ILE 53 Ca -0.00 1.60 -0.16 0.00 0.00 0.00 0.00 60.65 62.09 1z8r s ILE 53 Cb -0.14 -4.02 -0.04 0.00 0.01 0.00 0.00 42.46 38.27 1z8r s ILE 53 CO -0.06 0.37 0.37 0.00 0.00 0.00 0.00 174.94 175.62 1z8r s ALA 54 N -1.06 3.55 -0.33 9.38 0.00 0.47 -3.60 121.76 130.18 1z8r s ALA 54 Ca 0.44 -0.42 0.01 0.00 0.00 0.00 0.00 51.96 52.00 1z8r s ALA 54 Cb -0.31 -2.53 0.36 0.00 0.00 0.00 0.00 23.12 20.64 1z8r s ALA 54 CO 0.39 -0.06 1.74 2.89 0.00 0.00 0.00 175.76 180.72 1z8r n ARG 55 N 3.90 1.87 -3.27 0.00 1.85 -1.26 -4.71 116.66 115.04 1z8r n ARG 55 Ca -0.10 -1.92 -0.19 0.00 -1.00 0.00 0.00 57.85 54.65 1z8r n ARG 55 Cb 0.52 -1.75 0.00 0.00 -1.05 0.00 0.00 32.46 30.18 1z8r n ARG 55 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1z8r n GLN 57 N -1.75 2.13 -1.73 0.00 6.02 -1.26 -5.06 117.38 115.73 1z8r n GLN 57 Ca 0.03 -3.50 -0.42 0.00 -0.01 0.00 0.00 57.00 53.10 1z8r n GLN 57 Cb 0.58 -1.73 -0.03 0.00 1.02 0.00 0.00 30.24 30.09 1z8r n GLN 57 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1z8r n THR 59 N 4.40 0.57 -4.46 0.00 -1.04 -1.26 -4.62 114.28 107.87 1z8r n THR 59 Ca 0.17 0.14 -0.33 0.00 -2.04 0.00 0.00 64.05 61.99 1z8r n THR 59 Cb 0.37 -0.80 -0.16 0.00 -1.82 0.00 0.00 70.33 67.92 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 -2.93 2.42 0.33 12.58 -4.23 -1.26 -2.23 115.64 120.31 1z8r s THR 60 Ca 0.11 -0.85 0.05 0.00 -1.18 0.00 0.00 61.69 59.82 1z8r s THR 60 Cb 0.13 -2.01 -0.02 0.00 1.34 0.00 0.00 72.50 71.94 1z8r s THR 60 CO 0.36 0.52 0.33 -0.83 -0.54 0.00 0.00 174.62 174.46 1z8r s GLY 61 N 0.94 2.10 -0.14 3.99 0.00 -0.70 -4.89 107.32 108.61 1z8r s GLY 61 Ca -0.03 -1.93 0.02 0.00 0.00 0.00 0.00 44.72 42.78 1z8r s GLY 61 CO -0.03 -1.35 -0.21 0.54 0.00 0.00 0.00 173.10 172.05 1z8r s VAL 62 N -3.35 2.18 0.23 1.40 0.11 -0.99 0.11 120.40 120.08 1z8r s VAL 62 Ca 0.38 -0.94 0.03 0.00 -2.93 0.00 0.00 61.98 58.52 1z8r s VAL 62 Cb 0.02 -1.88 0.03 0.00 -1.53 0.00 0.00 36.38 33.01 1z8r s VAL 62 CO 0.25 0.54 0.24 0.00 -3.33 0.00 0.00 175.10 172.80 1z8r n TYR 63 N 4.10 -1.83 0.00 1.54 0.18 0.32 -2.31 117.16 119.16 1z8r n TYR 63 Ca -0.20 -0.91 0.00 0.00 1.88 0.00 0.00 57.90 58.67 1z8r n TYR 63 Cb 0.51 -0.20 0.00 0.00 -0.38 0.00 0.00 39.34 39.27 1z8r n TYR 63 CO 0.00 0.00 0.00 1.19 -2.08 0.00 0.00 176.86 175.97 1z8r n PHE 64 N -1.24 0.00 0.00 -3.48 3.01 -1.26 -2.05 117.46 112.44 1z8r n PHE 64 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.48 1z8r n PHE 64 Cb 0.25 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.72 1z8r n PHE 64 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1z8r n ALA 66 N 0.00 1.01 -0.02 0.00 0.00 -1.26 -1.23 120.51 119.00 1z8r n ALA 66 Ca 0.00 -0.69 -0.03 0.00 0.00 0.00 0.00 53.44 52.72 1z8r n ALA 66 Cb 0.00 -0.58 -0.02 0.00 0.00 0.00 0.00 19.45 18.85 1z8r n ALA 66 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1z8r h SER 67 N 0.06 -0.37 -0.21 0.00 0.87 -1.87 -1.11 113.55 110.92 1z8r h SER 67 Ca -0.45 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.16 1z8r h SER 67 Cb 2.01 0.15 0.00 0.00 -0.44 0.00 0.00 62.40 64.12 1z8r h SER 67 CO 0.06 -0.08 0.00 1.17 -0.53 0.00 0.00 176.83 177.44 1z8r n LYS 68 N -3.23 1.55 -1.13 2.24 3.00 -1.26 -4.87 118.16 114.47 1z8r n LYS 68 Ca -0.01 -0.84 -0.04 0.00 -0.00 0.00 0.00 58.31 57.41 1z8r n LYS 68 Cb 0.07 -1.23 -0.02 0.00 0.00 0.00 0.00 35.03 33.85 1z8r n LYS 68 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1z8r n SER 69 N 0.16 -5.06 -4.14 3.14 2.88 -0.42 -4.94 113.62 105.24 1z8r n SER 69 Ca 0.10 0.11 -0.11 0.00 -1.33 0.00 0.00 58.87 57.63 1z8r n SER 69 Cb 0.21 -2.94 -0.09 0.00 -0.75 0.00 0.00 64.21 60.64 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 -1.96 1.22 -0.32 -1.46 3.01 -0.37 -4.89 119.74 114.97 1z8r s LYS 70 Ca 0.00 -1.50 -0.19 0.00 -1.01 0.00 0.00 55.97 53.27 1z8r s LYS 70 Cb 0.00 0.31 -0.01 0.00 -1.01 0.00 0.00 37.83 37.12 1z8r s LYS 70 CO 0.00 -0.42 0.56 -3.38 0.51 0.00 0.00 175.35 172.62 1z8r s HIS 71 N -4.10 3.20 -0.34 3.18 -3.43 -1.26 -0.60 115.29 111.94 1z8r s HIS 71 Ca 0.32 0.41 -0.09 0.00 -0.80 0.00 0.00 55.06 54.90 1z8r s HIS 71 Cb 0.05 -2.93 0.02 0.00 -1.43 0.00 0.00 32.58 28.29 1z8r s HIS 71 CO 0.09 -0.48 0.16 0.71 -2.00 0.00 0.00 174.74 173.22 1z8r s TYR 72 N 2.48 3.21 -0.22 0.38 1.51 -0.87 -4.93 117.35 118.91 1z8r s TYR 72 Ca 0.22 -0.92 -0.25 0.00 -1.01 0.00 0.00 57.07 55.11 1z8r s TYR 72 Cb -0.15 -2.37 -0.00 0.00 -0.11 0.00 0.00 41.96 39.33 1z8r s TYR 72 CO 0.12 -0.59 0.86 -1.25 -1.11 0.00 0.00 175.55 173.58 1z8r s PRO 73 N 1.54 4.22 0.05 -1.71 0.05 -1.26 0.12 135.00 138.01 1z8r s PRO 73 Ca 0.02 1.03 0.01 0.00 0.05 0.00 0.00 61.00 62.11 1z8r s PRO 73 Cb -0.18 -3.63 -0.03 0.00 0.05 0.00 0.00 34.50 30.71 1z8r s PRO 73 CO 0.05 -0.49 -0.06 0.54 0.05 0.00 0.00 177.00 177.10 1z8r s VAL 74 N 2.73 0.42 -0.18 -0.36 0.11 0.29 -4.94 120.40 118.48 1z8r s VAL 74 Ca 0.37 -1.34 -0.15 0.00 -2.93 0.00 0.00 61.98 57.92 1z8r s VAL 74 Cb -0.16 -0.91 -0.04 0.00 -1.53 0.00 0.00 36.38 33.74 1z8r s VAL 74 CO 0.08 -0.62 0.37 -0.44 -3.33 0.00 0.00 175.10 171.16 1z8r s SER 75 N -2.09 6.46 0.19 3.54 0.01 -1.26 -1.72 113.70 118.83 1z8r s SER 75 Ca -0.04 0.55 0.04 0.00 1.31 0.00 0.00 55.95 57.81 1z8r s SER 75 Cb -0.04 -2.22 -0.05 0.00 0.21 0.00 0.00 66.02 63.93 1z8r s SER 75 CO -0.03 0.00 -0.05 0.72 0.41 0.00 0.00 173.24 174.29 1z8r s PHE 76 N 0.90 1.40 0.25 2.43 -0.12 -0.95 -4.22 117.98 117.67 1z8r s PHE 76 Ca 0.19 -0.84 0.09 0.00 -0.05 0.00 0.00 56.93 56.31 1z8r s PHE 76 Cb -0.14 -0.76 -0.04 0.00 -0.63 0.00 0.00 43.02 41.45 1z8r s PHE 76 CO 0.07 0.01 0.02 -1.21 -0.05 0.00 0.00 175.22 174.06 1z8r s GLU 77 N -3.81 2.38 -0.95 1.99 8.01 -0.79 -4.79 118.70 120.75 1z8r s GLU 77 Ca 0.22 -1.31 -0.01 0.00 0.01 0.00 0.00 54.97 53.88 1z8r s GLU 77 Cb 0.04 -2.24 0.31 0.00 -4.31 0.00 0.00 34.13 27.93 1z8r s GLU 77 CO 0.04 0.39 1.45 0.41 0.01 0.00 0.00 175.26 177.56 1z8r n GLY 78 N -0.76 5.52 3.74 -1.39 0.00 -1.26 -2.23 105.19 108.81 1z8r n GLY 78 Ca -0.07 -2.67 -0.41 0.00 0.00 0.00 0.00 46.02 42.87 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 -3.37 4.36 0.00 1.61 0.04 -1.10 -4.88 135.00 131.66 1z8r s PRO 79 Ca 0.37 2.13 0.00 0.00 0.04 0.00 0.00 61.00 63.54 1z8r s PRO 79 Cb 0.14 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.52 1z8r s PRO 79 CO -0.02 -0.28 0.24 0.41 0.04 0.00 0.00 177.00 177.39 1z8r n GLY 80 N 2.14 -2.69 3.59 0.56 0.00 -1.26 -2.41 105.19 105.12 1z8r n GLY 80 Ca 0.06 0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.49 4.07 -0.14 0.99 1.98 -1.26 0.12 118.68 123.95 1z8r s LEU 81 Ca 0.00 0.13 0.01 0.00 -2.89 0.00 0.00 54.13 51.38 1z8r s LEU 81 Cb 0.00 -2.31 0.02 0.00 0.66 0.00 0.00 46.19 44.56 1z8r s LEU 81 CO 0.00 -0.15 -0.17 -0.69 -1.89 0.00 0.00 176.35 173.45 1z8r s VAL 82 N 1.95 1.71 -0.45 1.68 1.01 0.18 -4.94 120.40 121.54 1z8r s VAL 82 Ca 0.12 -0.74 -0.28 0.00 0.00 0.00 0.00 61.98 61.07 1z8r s VAL 82 Cb -0.16 -1.56 -0.00 0.00 0.00 0.00 0.00 36.38 34.66 1z8r s VAL 82 CO 0.10 0.48 1.58 -1.83 0.00 0.00 0.00 175.10 175.44 1z8r s GLU 83 N 1.20 3.32 -0.17 2.72 1.03 -1.26 -0.94 118.70 124.59 1z8r s GLU 83 Ca -0.00 0.92 -0.29 0.00 0.03 0.00 0.00 54.97 55.63 1z8r s GLU 83 Cb -0.14 -4.15 -0.02 0.00 -0.80 0.00 0.00 34.13 29.03 1z8r s GLU 83 CO -0.07 -1.89 1.31 0.54 -1.33 0.00 0.00 175.26 173.82 1z8r s VAL 84 N 6.48 4.20 0.53 1.83 0.11 0.28 -4.91 120.40 128.91 1z8r s VAL 84 Ca 0.65 1.43 -0.20 0.00 -2.93 0.00 0.00 61.98 60.94 1z8r s VAL 84 Cb -0.15 -3.97 -0.06 0.00 -1.53 0.00 0.00 36.38 30.67 1z8r s VAL 84 CO 0.30 -0.17 1.14 -1.10 -3.33 0.00 0.00 175.10 171.93 1z8r s GLN 85 N 3.65 3.42 -0.53 1.54 -0.21 -1.26 -1.47 119.66 124.80 1z8r s GLN 85 Ca 0.57 1.64 -0.27 0.00 0.02 0.00 0.00 55.36 57.32 1z8r s GLN 85 Cb -0.22 -2.07 -0.02 0.00 1.00 0.00 0.00 33.01 31.70 1z8r s GLN 85 CO 0.17 -0.80 1.89 -2.00 -2.12 0.00 0.00 175.29 172.42 1z8r s GLU 86 N -3.19 2.77 0.06 2.91 2.12 -1.26 -4.54 118.70 117.57 1z8r s GLU 86 Ca 0.71 0.88 -0.05 0.00 0.36 0.00 0.00 54.97 56.87 1z8r s GLU 86 Cb -0.25 -4.35 -0.02 0.00 0.26 0.00 0.00 34.13 29.77 1z8r s GLU 86 CO 0.28 -2.55 0.09 0.45 -0.54 0.00 0.00 175.26 172.99 1z8r s SER 87 N 7.90 0.27 0.00 -1.70 0.15 -0.53 -4.88 113.70 114.91 1z8r s SER 87 Ca 0.73 -0.74 0.00 0.00 0.70 0.00 0.00 55.95 56.63 1z8r s SER 87 Cb -0.15 0.26 0.00 0.00 -1.71 0.00 0.00 66.02 64.42 1z8r s SER 87 CO 0.24 -0.63 0.00 1.21 1.20 0.00 0.00 173.24 175.27 1z8r n GLU 88 N 0.22 0.00 -0.47 5.44 2.13 -1.26 -0.08 120.64 126.62 1z8r n GLU 88 Ca -0.16 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.66 1z8r n GLU 88 Cb 0.61 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.32 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 0.00 0.00 -4.84 4.31 0.18 -1.26 -5.09 117.16 110.45 1z8r n TYR 89 Ca 0.00 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.45 1z8r n TYR 89 Cb 0.00 0.03 -0.13 0.00 -0.38 0.00 0.00 39.34 38.86 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 2.75 0.30 -3.48 5.04 0.89 -5.12 117.35 117.72 1z8r s TYR 90 Ca 0.00 -0.26 -0.16 0.00 -2.44 0.00 0.00 57.07 54.21 1z8r s TYR 90 Cb 0.00 -1.69 -0.09 0.00 0.35 0.00 0.00 41.96 40.53 1z8r s TYR 90 CO 0.00 0.10 0.73 -1.25 -1.34 0.00 0.00 175.55 173.79 1z8r s PRO 91 N -0.47 4.06 -0.86 4.97 0.04 -1.26 -1.45 135.00 140.03 1z8r s PRO 91 Ca 0.06 0.72 -0.22 0.00 0.04 0.00 0.00 61.00 61.60 1z8r s PRO 91 Cb -0.12 -2.55 -0.19 0.00 0.04 0.00 0.00 34.50 31.69 1z8r s PRO 91 CO 0.02 0.22 2.00 1.17 0.04 0.00 0.00 177.00 180.45 1z8r n LYS 92 N -0.09 0.16 -4.61 4.56 0.00 -1.25 -4.49 118.16 112.44 1z8r n LYS 92 Ca 0.02 -1.21 -0.28 0.00 0.00 0.00 0.00 58.31 56.85 1z8r n LYS 92 Cb 0.53 -3.31 -0.09 0.00 0.00 0.00 0.00 35.03 32.15 1z8r n LYS 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 1z8r s ARG 93 N 8.01 1.96 -0.10 1.64 3.00 -0.54 -4.90 118.95 128.02 1z8r s ARG 93 Ca 0.73 -2.17 -0.16 0.00 -1.00 0.00 0.00 55.73 53.13 1z8r s ARG 93 Cb -0.09 -1.22 -0.05 0.00 0.00 0.00 0.00 34.95 33.59 1z8r s ARG 93 CO 0.16 -0.27 0.41 0.71 0.00 0.00 0.00 175.30 176.31 1z8r s TYR 94 N -2.99 3.56 -0.10 5.12 1.51 -1.26 1.00 117.35 124.18 1z8r s TYR 94 Ca 0.24 0.85 0.02 0.00 -1.01 0.00 0.00 57.07 57.16 1z8r s TYR 94 Cb 0.06 -2.43 0.01 0.00 -0.11 0.00 0.00 41.96 39.49 1z8r s TYR 94 CO 0.12 0.32 -0.15 -1.14 -1.11 0.00 0.00 175.55 173.58 1z8r s GLN 95 N 0.12 2.20 0.21 -0.62 -0.44 -0.12 -4.71 119.66 116.30 1z8r s GLN 95 Ca 0.23 -0.56 -0.01 0.00 -2.50 0.00 0.00 55.36 52.52 1z8r s GLN 95 Cb -0.15 -1.85 -0.04 0.00 -1.64 0.00 0.00 33.01 29.33 1z8r s GLN 95 CO 0.10 -0.04 0.41 0.45 0.50 0.00 0.00 175.29 176.71 1z8r s SER 96 N 0.91 6.39 -1.11 6.67 0.15 0.21 0.47 113.70 127.38 1z8r s SER 96 Ca -0.08 0.43 -0.07 0.00 0.70 0.00 0.00 55.95 56.93 1z8r s SER 96 Cb -0.15 -2.02 -0.04 0.00 -1.71 0.00 0.00 66.02 62.09 1z8r s SER 96 CO -0.00 -0.06 0.89 1.57 1.20 0.00 0.00 173.24 176.84 1z8r n HIS 97 N -0.71 -2.28 -4.96 3.44 -0.00 0.32 -4.34 115.22 106.67 1z8r n HIS 97 Ca -0.04 0.80 -0.27 0.00 -0.00 0.00 0.00 57.72 58.21 1z8r n HIS 97 Cb 0.54 -4.19 -0.15 0.00 -0.00 0.00 0.00 29.99 26.18 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 -3.42 1.69 -0.07 3.57 0.11 -1.01 -2.26 120.40 119.00 1z8r s VAL 98 Ca 0.35 -0.98 -0.03 0.00 -2.93 0.00 0.00 61.98 58.39 1z8r s VAL 98 Cb -0.06 -1.42 -0.04 0.00 -1.53 0.00 0.00 36.38 33.33 1z8r s VAL 98 CO 0.76 0.42 0.07 -0.76 -3.33 0.00 0.00 175.10 172.26 1z8r s LEU 99 N -0.65 3.92 -0.04 2.54 1.02 0.26 -2.70 118.68 123.04 1z8r s LEU 99 Ca 0.08 0.25 0.05 0.00 0.02 0.00 0.00 54.13 54.53 1z8r s LEU 99 Cb -0.08 -2.02 -0.01 0.00 0.02 0.00 0.00 46.19 44.10 1z8r s LEU 99 CO -0.00 0.36 -0.17 -0.76 0.02 0.00 0.00 176.35 175.79 1z8r s LEU 100 N -1.16 1.95 -0.03 1.79 1.43 -0.95 0.61 118.68 122.31 1z8r s LEU 100 Ca 0.16 -0.35 -0.05 0.00 -1.03 0.00 0.00 54.13 52.87 1z8r s LEU 100 Cb -0.12 -0.97 0.01 0.00 0.03 0.00 0.00 46.19 45.14 1z8r s LEU 100 CO 0.06 0.17 0.12 0.00 0.23 0.00 0.00 176.35 176.93 1z8r s ALA 101 N -0.07 -0.30 -0.15 4.21 0.00 -0.79 -1.89 121.76 122.77 1z8r s ALA 101 Ca -0.01 0.20 -0.11 0.00 0.00 0.00 0.00 51.96 52.04 1z8r s ALA 101 Cb -0.10 -0.12 -0.05 0.00 0.00 0.00 0.00 23.12 22.85 1z8r s ALA 101 CO 0.02 -0.10 0.21 -0.08 0.00 0.00 0.00 175.76 175.80 1z8r s THR 102 N -0.35 5.37 0.00 0.00 -1.32 -1.26 0.20 115.64 118.28 1z8r s THR 102 Ca -0.04 0.36 0.00 0.00 -1.21 0.00 0.00 61.69 60.80 1z8r s THR 102 Cb -0.03 -3.52 0.00 0.00 -1.51 0.00 0.00 72.50 67.44 1z8r s THR 102 CO 0.00 0.48 0.00 0.61 -2.21 0.00 0.00 174.62 173.51 1z8r n GLY 103 N 2.95 2.84 0.13 6.08 0.00 -0.93 -4.79 105.19 111.46 1z8r n GLY 103 Ca -0.16 -0.69 -0.04 0.00 0.00 0.00 0.00 46.02 45.14 1z8r n GLY 103 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1z8r n PHE 104 N 0.00 0.00 -3.83 1.61 3.72 -1.26 -5.02 117.46 112.68 1z8r n PHE 104 Ca 0.00 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.29 1z8r n PHE 104 Cb 0.00 -0.21 -0.09 0.00 -0.94 0.00 0.00 39.48 38.24 1z8r n PHE 104 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1z8r s SER 105 N -4.67 -0.03 0.24 4.37 0.01 -1.26 -5.09 113.70 107.27 1z8r s SER 105 Ca -0.08 -0.21 -0.14 0.00 1.31 0.00 0.00 55.95 56.83 1z8r s SER 105 Cb 0.02 0.27 -0.08 0.00 0.21 0.00 0.00 66.02 66.44 1z8r s SER 105 CO 0.13 -0.48 0.64 -1.61 0.41 0.00 0.00 173.24 172.32 1z8r s GLU 106 N -1.93 3.98 0.00 12.44 0.41 -1.26 -5.08 118.70 127.26 1z8r s GLU 106 Ca -0.10 0.55 0.00 0.00 -0.41 0.00 0.00 54.97 55.01 1z8r s GLU 106 Cb -0.04 -2.68 0.00 0.00 -1.78 0.00 0.00 34.13 29.63 1z8r s GLU 106 CO -0.00 0.32 0.00 -0.35 -0.49 0.00 0.00 175.26 174.73 1z8r n PRO 107 N 0.15 -0.64 -0.00 0.39 -0.04 -1.26 -5.07 135.00 128.53 1z8r n PRO 107 Ca -0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.44 1z8r n PRO 107 Cb 0.52 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 33.98 1z8r n PRO 107 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1z8r n GLY 108 N 3.12 -0.17 0.09 0.55 0.00 -1.26 -4.87 105.19 102.64 1z8r n GLY 108 Ca 0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 46.02 45.88 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 -3.06 0.31 -1.31 1.61 9.92 -1.26 -5.08 116.55 117.68 1z8r n ASP 109 Ca -0.02 0.15 0.11 0.00 -0.53 0.00 0.00 54.79 54.49 1z8r n ASP 109 Cb 0.08 0.67 -0.06 0.00 -0.64 0.00 0.00 41.12 41.17 1z8r n ASP 109 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1z8r n ALA 110 N -2.65 -2.91 0.00 2.24 0.00 -1.26 -5.05 120.51 110.88 1z8r n ALA 110 Ca -0.26 0.72 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1z8r n ALA 110 Cb 1.09 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 19.14 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 -3.61 0.00 3.49 0.00 0.00 -1.26 -5.08 105.19 98.73 1z8r n GLY 111 Ca -0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.71 1z8r n GLY 111 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1z8r s GLY 112 N 0.00 2.51 0.06 -0.02 0.00 -1.26 -4.68 107.32 103.92 1z8r s GLY 112 Ca 0.00 -1.37 0.07 0.00 0.00 0.00 0.00 44.72 43.42 1z8r s GLY 112 CO 0.00 -1.80 -0.19 -0.26 0.00 0.00 0.00 173.10 170.85 1z8r s ILE 113 N -3.25 1.52 -0.31 0.90 -4.36 -1.26 -2.04 121.20 112.40 1z8r s ILE 113 Ca 0.26 -1.23 -0.23 0.00 -0.26 0.00 0.00 60.65 59.19 1z8r s ILE 113 Cb 0.03 -1.35 -0.00 0.00 1.25 0.00 0.00 42.46 42.39 1z8r s ILE 113 CO 0.15 0.08 0.75 -0.22 0.24 0.00 0.00 174.94 175.95 1z8r s LEU 114 N -1.35 4.10 0.17 0.37 2.96 -0.17 -4.49 118.68 120.27 1z8r s LEU 114 Ca 0.05 0.60 0.10 0.00 -0.22 0.00 0.00 54.13 54.66 1z8r s LEU 114 Cb -0.09 -3.02 -0.04 0.00 0.50 0.00 0.00 46.19 43.54 1z8r s LEU 114 CO 0.02 -0.59 -0.20 0.00 -1.32 0.00 0.00 176.35 174.26 1z8r s ARG 115 N 2.89 1.67 0.31 1.98 3.03 -0.98 -0.60 118.95 127.25 1z8r s ARG 115 Ca 0.31 -1.39 0.10 0.00 2.03 0.00 0.00 55.73 56.78 1z8r s ARG 115 Cb -0.14 -1.96 -0.05 0.00 -1.03 0.00 0.00 34.95 31.76 1z8r s ARG 115 CO 0.13 0.43 -0.08 0.00 -1.13 0.00 0.00 175.30 174.64 1z8r h GLU 117 N 2.01 0.00 0.06 0.00 4.39 -2.00 -0.57 114.58 118.47 1z8r h GLU 117 Ca -0.42 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 58.95 1z8r h GLU 117 Cb 1.25 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.87 1z8r h GLU 117 CO 0.64 0.00 -1.84 0.72 -1.16 0.00 0.00 179.01 177.37 1z8r n HIS 118 N -3.09 1.13 0.00 4.33 8.25 -1.26 -5.08 115.22 119.51 1z8r n HIS 118 Ca -0.02 0.32 0.00 0.00 -0.26 0.00 0.00 57.72 57.76 1z8r n HIS 118 Cb 0.27 -1.18 0.00 0.00 1.12 0.00 0.00 29.99 30.21 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 1.76 -0.97 3.76 -1.41 0.00 -0.22 -4.63 105.19 103.48 1z8r n GLY 119 Ca -0.24 0.04 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 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 -3.65 5.12 -0.06 1.61 1.01 0.11 0.91 120.40 125.45 1z8r s VAL 120 Ca 0.00 0.07 -0.05 0.00 0.00 0.00 0.00 61.98 62.01 1z8r s VAL 120 Cb 0.00 -3.26 -0.02 0.00 0.00 0.00 0.00 36.38 33.10 1z8r s VAL 120 CO 0.00 0.54 -0.09 -0.38 0.00 0.00 0.00 175.10 175.17 1z8r n ILE 121 N 2.70 0.53 -2.38 2.22 2.08 0.23 -0.39 119.36 124.34 1z8r n ILE 121 Ca -0.18 0.38 0.00 0.00 0.56 0.00 0.00 62.75 63.51 1z8r n ILE 121 Cb 0.53 -1.82 0.00 0.00 -0.75 0.00 0.00 39.64 37.61 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 1.61 2.39 3.60 7.39 0.00 -0.86 -1.04 105.19 118.28 1z8r n GLY 122 Ca -0.04 -0.77 -0.25 0.00 0.00 0.00 0.00 46.02 44.97 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 0.05 0.99 2.34 0.35 -1.00 118.68 124.33 1z8r s LEU 123 Ca 0.00 -1.01 -0.31 0.00 0.06 0.00 0.00 54.13 52.88 1z8r s LEU 123 Cb 0.00 -1.29 -0.05 0.00 -0.56 0.00 0.00 46.19 44.28 1z8r s LEU 123 CO 0.00 -0.19 1.22 0.68 -1.06 0.00 0.00 176.35 176.99 1z8r s VAL 124 N -2.52 4.01 0.00 1.48 -7.23 -0.87 0.11 120.40 115.38 1z8r s VAL 124 Ca 0.34 1.43 0.00 0.00 -1.81 0.00 0.00 61.98 61.94 1z8r s VAL 124 Cb -0.00 -3.92 0.00 0.00 0.56 0.00 0.00 36.38 33.02 1z8r s VAL 124 CO 0.18 0.10 0.00 0.41 -0.31 0.00 0.00 175.10 175.48 1z8r n THR 125 N 4.03 0.00 -3.83 5.32 -1.04 0.28 -4.71 114.28 114.34 1z8r n THR 125 Ca 0.09 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.98 1z8r n THR 125 Cb 0.46 -0.14 -0.12 0.00 -1.82 0.00 0.00 70.33 68.71 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 0.42 0.25 0.53 -2.82 -1.94 0.54 -4.91 119.30 111.38 1z8r s MET 126 Ca 0.00 0.10 0.04 0.00 -1.71 0.00 0.00 55.69 54.12 1z8r s MET 126 Cb 0.00 0.11 0.02 0.00 2.01 0.00 0.00 34.83 36.98 1z8r s MET 126 CO 0.00 -0.04 0.27 0.20 -0.01 0.00 0.00 175.02 175.44 1z8r s GLY 127 N -0.22 2.60 0.00 -0.03 0.00 -1.26 -0.42 107.32 108.00 1z8r s GLY 127 Ca -0.03 -0.94 0.00 0.00 0.00 0.00 0.00 44.72 43.75 1z8r s GLY 127 CO 0.00 -2.03 0.00 0.61 0.00 0.00 0.00 173.10 171.69 1z8r n GLY 128 N -1.60 3.16 0.25 0.20 0.00 -0.35 -4.82 105.19 102.03 1z8r n GLY 128 Ca -0.08 -1.58 0.16 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.02 -3.38 114.58 115.88 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 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 1z8r n GLY 130 N 0.29 0.72 3.41 -3.84 0.00 -1.26 -4.88 105.19 99.63 1z8r n GLY 130 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 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 2.21 -0.22 1.61 1.01 -1.26 -2.20 120.40 121.56 1z8r s VAL 131 Ca 0.00 -2.18 -0.02 0.00 0.00 0.00 0.00 61.98 59.79 1z8r s VAL 131 Cb 0.00 -2.12 0.01 0.00 0.00 0.00 0.00 36.38 34.27 1z8r s VAL 131 CO 0.00 -0.33 -0.10 0.68 0.00 0.00 0.00 175.10 175.36 1z8r s VAL 132 N -2.23 2.82 -0.33 2.92 -7.23 0.54 -1.21 120.40 115.68 1z8r s VAL 132 Ca 0.23 -0.80 -0.15 0.00 -1.81 0.00 0.00 61.98 59.45 1z8r s VAL 132 Cb -0.05 -2.31 -0.02 0.00 0.56 0.00 0.00 36.38 34.56 1z8r s VAL 132 CO 0.11 0.38 0.36 -0.83 -0.31 0.00 0.00 175.10 174.81 1z8r s GLY 133 N 1.37 1.90 -0.01 2.32 0.00 0.44 -1.89 107.32 111.45 1z8r s GLY 133 Ca 0.04 -1.14 0.06 0.00 0.00 0.00 0.00 44.72 43.68 1z8r s GLY 133 CO -0.07 0.99 -0.18 -1.36 0.00 0.00 0.00 173.10 172.48 1z8r s PHE 134 N 2.03 2.57 -0.46 1.90 0.08 0.20 0.10 117.98 124.40 1z8r s PHE 134 Ca 0.12 -0.26 -0.23 0.00 0.12 0.00 0.00 56.93 56.69 1z8r s PHE 134 Cb -0.16 -1.54 0.03 0.00 -0.57 0.00 0.00 43.02 40.77 1z8r s PHE 134 CO 0.11 0.15 0.78 0.00 -0.10 0.00 0.00 175.22 176.17 1z8r s ALA 135 N -0.77 3.29 0.61 5.36 0.00 0.30 0.93 121.76 131.48 1z8r s ALA 135 Ca 0.12 -1.09 -0.17 0.00 0.00 0.00 0.00 51.96 50.82 1z8r s ALA 135 Cb -0.10 -3.47 -0.02 0.00 0.00 0.00 0.00 23.12 19.52 1z8r s ALA 135 CO 0.02 -1.96 1.15 0.34 0.00 0.00 0.00 175.76 175.31 1z8r s ASP 136 N 2.22 5.23 0.00 0.00 -1.08 -0.96 -0.50 116.67 121.59 1z8r s ASP 136 Ca 0.28 2.19 0.22 0.00 -0.52 0.00 0.00 52.55 54.73 1z8r s ASP 136 Cb -0.13 -2.58 0.61 0.00 -1.46 0.00 0.00 42.92 39.37 1z8r s ASP 136 CO 0.21 -1.55 1.52 0.52 0.52 0.00 0.00 175.17 176.39 1z8r n VAL 137 N -1.87 0.91 0.80 1.11 0.31 -0.20 -4.29 118.33 115.09 1z8r n VAL 137 Ca 0.12 -0.94 0.09 0.00 -0.01 0.00 0.00 64.34 63.60 1z8r n VAL 137 Cb 0.51 0.54 0.44 0.00 -0.91 0.00 0.00 33.84 34.42 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 1.60 0.19 -0.31 5.55 1.74 -1.26 -2.26 116.66 121.90 1z8r n ARG 138 Ca 0.24 0.13 0.09 0.00 -0.77 0.00 0.00 57.85 57.54 1z8r n ARG 138 Cb 0.61 -1.50 0.25 0.00 -1.02 0.00 0.00 32.46 30.80 1z8r n ARG 138 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1z8r n ASP 139 N -1.35 3.11 -2.66 0.55 -0.08 -1.26 -4.45 116.55 110.41 1z8r n ASP 139 Ca 0.08 -2.05 -0.03 0.00 -1.51 0.00 0.00 54.79 51.27 1z8r n ASP 139 Cb 0.17 -0.39 0.09 0.00 2.34 0.00 0.00 41.12 43.32 1z8r n ASP 139 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1z8r n LEU 140 N 1.08 -1.21 0.13 -2.67 -0.00 -0.96 -5.00 117.00 108.37 1z8r n LEU 140 Ca 0.19 -1.85 0.12 0.00 -0.00 0.00 0.00 56.01 54.47 1z8r n LEU 140 Cb 0.51 0.97 0.47 0.00 -0.00 0.00 0.00 43.42 45.36 1z8r n LEU 140 CO 0.14 1.52 0.87 -0.11 -0.00 0.00 0.00 177.39 179.80 1z8r n LEU 141 N 0.31 0.74 -4.51 1.47 -0.00 -1.12 -4.64 117.00 109.25 1z8r n LEU 141 Ca -0.09 0.64 -0.13 0.00 -0.00 0.00 0.00 56.01 56.43 1z8r n LEU 141 Cb 0.74 -0.50 -0.10 0.00 -0.00 0.00 0.00 43.42 43.56 1z8r n LEU 141 CO -0.10 -0.45 1.14 -2.67 -0.00 0.00 0.00 177.39 175.30 1z8r n TRP 142 N -2.27 0.83 0.00 1.96 4.27 -1.26 -3.67 117.44 117.30 1z8r n TRP 142 Ca 0.03 -0.10 0.00 0.00 -3.89 0.00 0.00 57.50 53.54 1z8r n TRP 142 Cb 0.29 -2.29 0.00 0.00 -1.36 0.00 0.00 31.31 27.95 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 17.40 0.00 0.00 5.67 4.32 -1.26 -5.01 117.00 138.12 1z8r n LEU 143 Ca 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.38 1z8r n LEU 143 Cb 0.45 0.19 0.00 0.00 -1.62 0.00 0.00 43.42 42.44 1z8r n LEU 143 CO 0.59 -0.35 0.00 -0.62 -1.22 0.00 0.00 177.39 175.79 1z8r n GLU 144 N -2.20 0.00 -2.08 3.23 -0.58 -1.24 -4.49 120.64 113.28 1z8r n GLU 144 Ca 0.00 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.38 1z8r n GLU 144 Cb 0.00 0.00 0.02 0.00 -0.57 0.00 0.00 31.44 30.89 1z8r n GLU 144 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1z8r s ASP 145 N -0.18 5.47 0.23 1.62 1.11 -1.26 -5.03 116.67 118.63 1z8r s ASP 145 Ca 0.00 2.37 -0.02 0.00 0.18 0.00 0.00 52.55 55.08 1z8r s ASP 145 Cb 0.00 -2.60 -0.05 0.00 1.07 0.00 0.00 42.92 41.35 1z8r s ASP 145 CO 0.00 -1.40 0.44 -1.81 1.18 0.00 0.00 175.17 173.58 1z8r s ASP 146 N -1.53 6.41 0.48 0.27 1.01 -1.26 -4.55 116.67 117.49 1z8r s ASP 146 Ca 0.74 0.51 -0.24 0.00 0.71 0.00 0.00 52.55 54.27 1z8r s ASP 146 Cb -0.30 -2.05 -0.07 0.00 1.01 0.00 0.00 42.92 41.51 1z8r s ASP 146 CO 0.33 -0.09 1.32 0.00 0.21 0.00 0.00 175.17 176.94 1z8r s ALA 147 N -1.94 3.03 0.00 5.23 0.00 -1.24 -4.69 121.76 122.16 1z8r s ALA 147 Ca 0.40 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.61 1z8r s ALA 147 Cb -0.11 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.50 1z8r s ALA 147 CO 0.29 -1.06 0.00 0.00 0.00 0.00 0.00 175.76 174.99 1z8r n MET 148 N -0.49 0.00 -2.28 0.00 0.00 -1.26 -4.54 117.12 108.55 1z8r n MET 148 Ca 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 57.70 57.75 1z8r n MET 148 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.67 1z8r n MET 148 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1z8r n GLU 149 N 0.00 -1.86 0.00 3.17 1.02 -1.26 -5.23 120.64 116.48 1z8r n GLU 149 Ca 0.00 1.73 0.04 0.00 -0.02 0.00 0.00 57.16 58.92 1z8r n GLU 149 Cb 0.00 -3.87 0.04 0.00 -0.02 0.00 0.00 31.44 27.59 1z8r n GLU 149 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31