#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z8r s PRO 2 N 0.00 3.96 -0.18 1.61 0.04 -1.26 -5.05 135.00 134.12 1z8r s PRO 2 Ca 0.00 1.84 -0.28 0.00 0.04 0.00 0.00 61.00 62.60 1z8r s PRO 2 Cb 0.00 -2.60 0.10 0.00 0.04 0.00 0.00 34.50 32.04 1z8r s PRO 2 CO 0.00 -0.40 0.87 1.52 0.04 0.00 0.00 177.00 179.03 1z8r s TYR 3 N -1.45 -0.55 0.00 0.56 -0.85 -1.26 -5.01 117.35 108.80 1z8r s TYR 3 Ca 0.59 1.13 0.00 0.00 -0.52 0.00 0.00 57.07 58.27 1z8r s TYR 3 Cb -0.30 0.39 0.00 0.00 0.38 0.00 0.00 41.96 42.42 1z8r s TYR 3 CO 0.38 -0.40 0.00 0.41 -1.52 0.00 0.00 175.55 174.42 1z8r n GLY 4 N 1.48 2.03 3.79 5.49 0.00 -1.26 -4.93 105.19 111.80 1z8r n GLY 4 Ca -0.14 -0.25 -0.39 0.00 0.00 0.00 0.00 46.02 45.24 1z8r n GLY 4 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1z8r s HIS 5 N 0.00 3.73 -0.19 1.61 2.46 -1.26 -5.07 115.29 116.57 1z8r s HIS 5 Ca 0.00 1.17 0.01 0.00 0.47 0.00 0.00 55.06 56.71 1z8r s HIS 5 Cb 0.00 -2.51 0.02 0.00 -0.13 0.00 0.00 32.58 29.96 1z8r s HIS 5 CO 0.00 0.48 -0.18 -0.65 -2.47 0.00 0.00 174.74 171.92 1z8r s GLN 6 N -0.64 2.96 -0.14 2.88 -0.21 -1.26 -5.05 119.66 118.21 1z8r s GLN 6 Ca 0.29 -0.85 -0.29 0.00 0.02 0.00 0.00 55.36 54.52 1z8r s GLN 6 Cb -0.18 -2.64 -0.01 0.00 1.00 0.00 0.00 33.01 31.18 1z8r s GLN 6 CO 0.17 -0.24 1.04 -1.54 -2.12 0.00 0.00 175.29 172.60 1z8r s SER 7 N 1.29 7.18 0.00 5.90 1.04 -1.26 -4.16 113.70 123.69 1z8r s SER 7 Ca 0.04 1.52 0.00 0.00 0.48 0.00 0.00 55.95 57.99 1z8r s SER 7 Cb -0.14 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.43 1z8r s SER 7 CO -0.11 -0.53 0.00 0.61 0.98 0.00 0.00 173.24 174.19 1z8r n GLY 8 N 3.20 2.25 3.41 7.32 0.00 -1.26 -4.92 105.19 115.18 1z8r n GLY 8 Ca 0.10 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.66 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 0.00 2.29 -0.22 4.61 0.00 -1.26 -3.72 121.76 123.45 1z8r s ALA 9 Ca 0.00 -1.73 0.01 0.00 0.00 0.00 0.00 51.96 50.24 1z8r s ALA 9 Cb 0.00 0.88 0.05 0.00 0.00 0.00 0.00 23.12 24.06 1z8r s ALA 9 CO 0.00 -0.39 -0.07 0.54 0.00 0.00 0.00 175.76 175.84 1z8r s VAL 10 N -3.44 1.55 -0.08 0.00 0.11 -0.96 -4.97 120.40 112.60 1z8r s VAL 10 Ca 0.33 -1.14 0.02 0.00 -2.93 0.00 0.00 61.98 58.25 1z8r s VAL 10 Cb 0.06 -1.76 -0.02 0.00 -1.53 0.00 0.00 36.38 33.13 1z8r s VAL 10 CO 0.15 -0.02 -0.13 -0.72 -3.33 0.00 0.00 175.10 171.05 1z8r s TYR 11 N 1.40 2.77 -0.07 1.54 1.13 -1.26 -1.71 117.35 121.15 1z8r s TYR 11 Ca -0.04 -0.32 0.05 0.00 -1.41 0.00 0.00 57.07 55.34 1z8r s TYR 11 Cb -0.18 -1.72 -0.01 0.00 -1.10 0.00 0.00 41.96 38.95 1z8r s TYR 11 CO -0.07 0.05 -0.23 0.08 -2.51 0.00 0.00 175.55 172.87 1z8r s VAL 12 N -0.31 2.24 0.00 -3.49 1.01 0.23 -4.63 120.40 115.44 1z8r s VAL 12 Ca 0.03 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 61.01 1z8r s VAL 12 Cb -0.13 -1.83 0.00 0.00 0.00 0.00 0.00 36.38 34.42 1z8r s VAL 12 CO 0.03 0.57 0.00 0.61 0.00 0.00 0.00 175.10 176.30 1z8r n GLY 13 N 2.98 2.78 1.21 4.51 0.00 -1.26 0.63 105.19 116.05 1z8r n GLY 13 Ca -0.18 0.16 0.05 0.00 0.00 0.00 0.00 46.02 46.05 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 3.15 3.48 -4.21 1.61 4.13 -1.26 -3.46 115.26 118.71 1z8r n ASN 14 Ca 0.00 -2.43 -0.22 0.00 1.68 0.00 0.00 54.58 53.61 1z8r n ASN 14 Cb 0.00 -0.54 -0.13 0.00 -1.54 0.00 0.00 39.78 37.57 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 -1.91 1.48 -0.14 3.10 2.02 0.21 -1.95 117.35 120.16 1z8r s TYR 15 Ca 0.31 -0.39 -0.02 0.00 -0.37 0.00 0.00 57.07 56.60 1z8r s TYR 15 Cb 0.22 -0.86 0.04 0.00 -0.40 0.00 0.00 41.96 40.97 1z8r s TYR 15 CO 0.11 0.09 0.00 0.21 -1.57 0.00 0.00 175.55 174.40 1z8r s LYS 16 N -1.44 0.82 -0.26 -0.62 2.36 0.20 0.74 119.74 121.54 1z8r s LYS 16 Ca 0.03 -0.26 -0.09 0.00 -2.55 0.00 0.00 55.97 53.10 1z8r s LYS 16 Cb -0.09 -1.69 -0.04 0.00 -1.05 0.00 0.00 37.83 34.95 1z8r s LYS 16 CO 0.02 -0.47 0.14 0.14 1.55 0.00 0.00 175.35 176.73 1z8r s VAL 17 N 1.85 4.95 0.10 4.02 -7.23 -0.70 -1.39 120.40 122.01 1z8r s VAL 17 Ca 0.02 0.05 0.01 0.00 -1.81 0.00 0.00 61.98 60.24 1z8r s VAL 17 Cb -0.15 -3.33 -0.04 0.00 0.56 0.00 0.00 36.38 33.42 1z8r s VAL 17 CO -0.07 0.31 -0.03 0.54 -0.31 0.00 0.00 175.10 175.54 1z8r s VAL 18 N 1.52 0.50 0.42 1.32 0.11 -0.91 -2.27 120.40 121.10 1z8r s VAL 18 Ca 0.07 -1.91 -0.26 0.00 -2.93 0.00 0.00 61.98 56.94 1z8r s VAL 18 Cb -0.15 -1.77 -0.10 0.00 -1.53 0.00 0.00 36.38 32.84 1z8r s VAL 18 CO 0.07 -0.78 1.45 0.59 -3.33 0.00 0.00 175.10 173.09 1z8r n ASN 19 N -0.05 3.47 -0.12 3.54 4.13 -1.26 -2.36 115.26 122.61 1z8r n ASN 19 Ca -0.11 1.16 -0.05 0.00 1.68 0.00 0.00 54.58 57.26 1z8r n ASN 19 Cb 0.62 -1.60 0.03 0.00 -1.54 0.00 0.00 39.78 37.28 1z8r n ASN 19 CO 0.00 0.00 0.00 0.03 0.28 0.00 0.00 177.26 177.57 1z8r h ARG 20 N 2.54 0.27 0.00 3.52 3.08 -0.20 0.14 114.38 123.73 1z8r h ARG 20 Ca -0.51 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.53 1z8r h ARG 20 Cb 1.26 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.25 1z8r h ARG 20 CO 0.62 0.18 0.00 0.72 -1.07 0.00 0.00 179.97 180.42 1z8r n HIS 21 N -5.03 0.00 0.04 3.04 8.25 -1.26 -2.30 115.22 117.97 1z8r n HIS 21 Ca 0.02 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.51 1z8r n HIS 21 Cb 0.15 -0.42 0.05 0.00 1.12 0.00 0.00 29.99 30.89 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 -1.42 2.05 -4.71 2.41 7.94 0.28 -5.01 117.00 118.54 1z8r n LEU 22 Ca 0.04 -1.59 -0.39 0.00 -1.11 0.00 0.00 56.01 52.97 1z8r n LEU 22 Cb 0.14 -0.07 -0.05 0.00 0.53 0.00 0.00 43.42 43.97 1z8r n LEU 22 CO 0.12 0.49 0.31 0.00 -1.11 0.00 0.00 177.39 177.19 1z8r s ALA 23 N -0.78 3.41 0.80 1.96 0.00 0.04 -4.79 121.76 122.40 1z8r s ALA 23 Ca 0.10 -0.03 -0.11 0.00 0.00 0.00 0.00 51.96 51.91 1z8r s ALA 23 Cb 0.05 -2.84 0.07 0.00 0.00 0.00 0.00 23.12 20.41 1z8r s ALA 23 CO 0.08 -0.11 1.10 0.95 0.00 0.00 0.00 175.76 177.77 1z8r s THR 24 N 0.86 3.07 0.54 0.00 -4.23 -1.26 -4.83 115.64 109.78 1z8r s THR 24 Ca 0.32 0.35 0.27 0.00 -1.18 0.00 0.00 61.69 61.45 1z8r s THR 24 Cb -0.16 -3.09 0.42 0.00 1.34 0.00 0.00 72.50 71.01 1z8r s THR 24 CO 0.14 -0.45 1.97 0.45 -0.54 0.00 0.00 174.62 176.19 1z8r h HIS 25 N -1.09 0.00 -0.18 3.99 3.86 -1.99 0.23 115.15 119.96 1z8r h HIS 25 Ca -0.47 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 58.63 1z8r h HIS 25 Cb 1.27 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.73 1z8r h HIS 25 CO 0.47 0.00 -0.37 0.28 0.86 0.00 0.00 177.93 179.16 1z8r h VAL 26 N 0.00 1.30 -0.31 2.45 2.07 -1.98 0.14 116.25 119.92 1z8r h VAL 26 Ca 0.29 -1.48 -0.09 0.00 0.82 0.00 0.00 66.70 66.24 1z8r h VAL 26 Cb 1.18 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 1z8r h VAL 26 CO -0.00 0.46 -0.16 0.44 0.02 0.00 0.00 177.57 178.32 1z8r h ASP 27 N 0.33 0.67 -0.06 0.57 5.19 -0.90 -2.56 116.42 119.66 1z8r h ASP 27 Ca 0.03 -0.41 -0.10 0.00 -0.62 0.00 0.00 57.03 55.94 1z8r h ASP 27 Cb 0.81 -0.19 0.00 0.00 0.18 0.00 0.00 39.33 40.14 1z8r h ASP 27 CO 0.07 0.94 -0.34 -0.50 -3.12 0.00 0.00 179.24 176.28 1z8r h TRP 28 N 0.41 0.45 -0.88 4.55 4.06 -1.34 0.26 115.95 123.46 1z8r h TRP 28 Ca 0.07 -0.20 0.12 0.00 2.06 0.00 0.00 58.89 60.93 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 0.95 0.57 -0.56 -3.56 0.00 0.00 178.44 175.90 1z8r h GLN 29 N -0.18 0.74 -0.49 0.49 3.07 -0.77 -1.46 115.11 116.51 1z8r h GLN 29 Ca -0.03 -0.04 -0.32 0.00 0.09 0.00 0.00 58.65 58.35 1z8r h GLN 29 Cb 1.00 -0.17 -0.22 0.00 0.08 0.00 0.00 27.48 28.18 1z8r h GLN 29 CO 0.07 0.49 -0.32 0.09 0.09 0.00 0.00 178.83 179.25 1z8r n ASN 30 N -4.55 3.68 -4.70 0.06 3.02 -0.97 -5.02 115.26 106.79 1z8r n ASN 30 Ca 0.16 -3.80 -0.42 0.00 -0.03 0.00 0.00 54.58 50.48 1z8r n ASN 30 Cb 0.40 -0.55 -0.03 0.00 -0.61 0.00 0.00 39.78 38.99 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 4.97 0.78 -4.06 0.00 -1.51 0.47 -3.48 116.25 113.42 1z8r h VAL 32 Ca -0.35 -2.46 -0.16 0.00 -1.23 0.00 0.00 66.70 62.50 1z8r h VAL 32 Cb 1.18 2.60 -0.19 0.00 -2.13 0.00 0.00 31.29 32.75 1z8r h VAL 32 CO 0.81 0.86 -0.70 0.86 -1.23 0.00 0.00 177.57 178.17 1z8r s TRP 33 N -2.57 0.36 -0.30 5.19 -0.00 -1.05 -4.97 118.94 115.60 1z8r s TRP 33 Ca -0.18 -0.70 -0.05 0.00 -0.00 0.00 0.00 56.10 55.17 1z8r s TRP 33 Cb 0.06 -0.26 0.19 0.00 -0.00 0.00 0.00 33.47 33.46 1z8r s TRP 33 CO 0.81 -0.24 0.80 -2.00 -0.00 0.00 0.00 176.95 176.31 1z8r s GLU 34 N -2.23 0.39 -0.20 5.86 2.12 -1.26 0.18 118.70 123.55 1z8r s GLU 34 Ca -0.09 0.61 -0.06 0.00 0.36 0.00 0.00 54.97 55.80 1z8r s GLU 34 Cb -0.04 0.33 -0.03 0.00 0.26 0.00 0.00 34.13 34.64 1z8r s GLU 34 CO -0.04 -0.52 0.02 0.16 -0.54 0.00 0.00 175.26 174.34 1z8r s ASP 35 N 2.90 5.01 0.29 -1.70 -4.77 -0.45 -4.98 116.67 112.96 1z8r s ASP 35 Ca 0.13 -0.15 0.03 0.00 -3.30 0.00 0.00 52.55 49.26 1z8r s ASP 35 Cb -0.11 -1.86 0.43 0.00 -1.09 0.00 0.00 42.92 40.29 1z8r s ASP 35 CO -0.19 0.07 1.74 0.22 0.70 0.00 0.00 175.17 177.71 1z8r h TYR 36 N 7.43 0.53 -0.01 2.11 5.03 -1.96 0.22 116.97 130.32 1z8r h TYR 36 Ca -0.36 -0.11 0.00 0.00 2.58 0.00 0.00 58.73 60.85 1z8r h TYR 36 Cb 1.18 -0.13 -0.00 0.00 1.55 0.00 0.00 36.73 39.32 1z8r h TYR 36 CO 0.59 0.67 0.01 -0.91 -1.32 0.00 0.00 178.16 177.21 1z8r h ASN 37 N 0.42 0.00 -0.01 -2.11 -0.26 -1.92 -1.34 115.58 110.38 1z8r h ASN 37 Ca 0.07 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.81 1z8r h ASN 37 Cb 0.64 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.90 1z8r h ASN 37 CO 0.05 0.00 -0.16 -1.14 -1.06 0.00 0.00 177.43 175.11 1z8r n ARG 38 N -3.73 2.26 -3.60 0.81 3.00 -0.93 0.11 116.66 114.57 1z8r n ARG 38 Ca -0.03 -0.52 -0.27 0.00 -0.00 0.00 0.00 57.85 57.04 1z8r n ARG 38 Cb 0.09 -1.01 -0.01 0.00 0.00 0.00 0.00 32.46 31.54 1z8r n ARG 38 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1z8r n ASP 39 N -0.31 -3.68 -4.21 6.15 8.00 0.73 -4.89 116.55 118.33 1z8r n ASP 39 Ca 0.03 -0.56 -0.17 0.00 0.71 0.00 0.00 54.79 54.81 1z8r n ASP 39 Cb 0.16 -3.03 -0.11 0.00 -0.02 0.00 0.00 41.12 38.12 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 -6.72 2.40 0.05 0.64 2.96 -1.01 0.58 118.68 117.57 1z8r s LEU 40 Ca 0.50 -0.80 -0.09 0.00 -0.22 0.00 0.00 54.13 53.52 1z8r s LEU 40 Cb -0.27 -0.46 0.00 0.00 0.50 0.00 0.00 46.19 45.97 1z8r s LEU 40 CO 0.62 -0.18 0.19 -1.48 -1.32 0.00 0.00 176.35 174.17 1z8r s LEU 41 N -2.40 1.40 -0.10 -0.68 -0.00 -0.99 -1.34 118.68 114.57 1z8r s LEU 41 Ca 0.07 -0.44 0.04 0.00 -0.00 0.00 0.00 54.13 53.79 1z8r s LEU 41 Cb -0.05 0.96 0.00 0.00 -0.00 0.00 0.00 46.19 47.10 1z8r s LEU 41 CO 0.02 -0.59 -0.24 -0.69 -0.00 0.00 0.00 176.35 174.85 1z8r s VAL 42 N -2.87 2.03 0.23 1.48 1.01 0.13 -2.13 120.40 120.27 1z8r s VAL 42 Ca -0.03 -1.00 0.11 0.00 0.00 0.00 0.00 61.98 61.06 1z8r s VAL 42 Cb 0.00 -1.76 -0.05 0.00 0.00 0.00 0.00 36.38 34.58 1z8r s VAL 42 CO -0.06 0.55 -0.21 -0.94 0.00 0.00 0.00 175.10 174.45 1z8r s SER 43 N 0.37 3.34 -0.28 3.32 1.04 -0.49 0.11 113.70 121.11 1z8r s SER 43 Ca -0.18 -0.95 -0.13 0.00 0.48 0.00 0.00 55.95 55.16 1z8r s SER 43 Cb -0.18 -0.25 -0.04 0.00 0.10 0.00 0.00 66.02 65.65 1z8r s SER 43 CO 0.08 0.04 0.30 0.42 0.98 0.00 0.00 173.24 175.07 1z8r s THR 44 N -2.19 5.23 -0.09 2.02 -4.23 -1.13 0.58 115.64 115.82 1z8r s THR 44 Ca 0.24 0.39 0.05 0.00 -1.18 0.00 0.00 61.69 61.19 1z8r s THR 44 Cb -0.06 -3.63 -0.09 0.00 1.34 0.00 0.00 72.50 70.06 1z8r s THR 44 CO 0.11 0.19 -0.02 1.07 -0.54 0.00 0.00 174.62 175.43 1z8r n THR 45 N 5.10 0.59 -3.26 3.99 5.66 -0.82 -4.97 114.28 120.57 1z8r n THR 45 Ca -0.11 -0.31 -0.16 0.00 -3.05 0.00 0.00 64.05 60.42 1z8r n THR 45 Cb 0.51 -0.82 0.07 0.00 -1.55 0.00 0.00 70.33 68.54 1z8r n THR 45 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1z8r n THR 46 N -2.50 -3.61 -4.23 1.09 -1.04 -1.22 -5.02 114.28 97.75 1z8r n THR 46 Ca -0.16 -0.20 -0.13 0.00 -2.04 0.00 0.00 64.05 61.52 1z8r n THR 46 Cb 0.75 -4.00 -0.10 0.00 -1.82 0.00 0.00 70.33 65.16 1z8r n THR 46 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1z8r s ALA 47 N -3.27 1.35 0.20 2.41 0.00 -1.22 -4.93 121.76 116.29 1z8r s ALA 47 Ca 0.23 -1.47 -0.32 0.00 0.00 0.00 0.00 51.96 50.40 1z8r s ALA 47 Cb -0.10 0.10 -0.12 0.00 0.00 0.00 0.00 23.12 22.99 1z8r s ALA 47 CO 0.58 -0.14 1.68 0.72 0.00 0.00 0.00 175.76 178.60 1z8r n HIS 48 N -0.17 2.64 -0.08 0.00 8.25 -1.26 -4.43 115.22 120.17 1z8r n HIS 48 Ca -0.10 0.11 -0.09 0.00 -0.26 0.00 0.00 57.72 57.37 1z8r n HIS 48 Cb 0.61 -2.64 -0.12 0.00 1.12 0.00 0.00 29.99 28.96 1z8r n HIS 48 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1z8r n GLY 49 N 3.74 -0.65 2.54 -1.41 0.00 -1.26 -4.95 105.19 103.20 1z8r n GLY 49 Ca 0.16 -0.23 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.66 1.53 -0.16 0.00 1.01 -1.26 -5.13 116.67 110.00 1z8r s ASP 51 Ca 0.00 -0.24 0.01 0.00 0.71 0.00 0.00 52.55 53.03 1z8r s ASP 51 Cb 0.00 -0.33 0.02 0.00 1.01 0.00 0.00 42.92 43.62 1z8r s ASP 51 CO 0.00 0.12 -0.18 -0.89 0.21 0.00 0.00 175.17 174.43 1z8r s THR 52 N -0.03 1.84 0.27 -1.27 2.01 -1.26 -4.70 115.64 112.51 1z8r s THR 52 Ca -0.00 -0.81 -0.29 0.00 0.31 0.00 0.00 61.69 60.90 1z8r s THR 52 Cb -0.08 -1.69 -0.09 0.00 0.01 0.00 0.00 72.50 70.65 1z8r s THR 52 CO 0.00 0.50 1.15 -0.63 -0.69 0.00 0.00 174.62 174.96 1z8r s ILE 53 N 1.34 3.37 -0.23 1.82 -1.09 -1.26 0.77 121.20 125.91 1z8r s ILE 53 Ca 0.04 1.34 -0.19 0.00 -2.23 0.00 0.00 60.65 59.61 1z8r s ILE 53 Cb -0.13 -3.85 -0.03 0.00 -1.58 0.00 0.00 42.46 36.87 1z8r s ILE 53 CO -0.11 0.30 0.56 0.00 -1.23 0.00 0.00 174.94 174.46 1z8r s ALA 54 N -0.98 3.58 -0.46 9.38 0.00 0.20 -3.56 121.76 129.91 1z8r s ALA 54 Ca 0.46 -0.46 -0.01 0.00 0.00 0.00 0.00 51.96 51.96 1z8r s ALA 54 Cb -0.33 -2.91 0.35 0.00 0.00 0.00 0.00 23.12 20.22 1z8r s ALA 54 CO 0.42 -0.65 1.98 -2.13 0.00 0.00 0.00 175.76 175.39 1z8r n ARG 55 N 5.30 2.18 -3.28 0.00 3.00 -1.18 -4.73 116.66 117.95 1z8r n ARG 55 Ca -0.03 -2.35 -0.18 0.00 -0.00 0.00 0.00 57.85 55.29 1z8r n ARG 55 Cb 0.50 -1.92 0.00 0.00 0.00 0.00 0.00 32.46 31.04 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 -1.73 1.81 -0.60 0.00 1.13 -1.26 -5.05 117.38 111.67 1z8r n GLN 57 Ca 0.03 -3.25 -0.30 0.00 -1.94 0.00 0.00 57.00 51.54 1z8r n GLN 57 Cb 0.58 -1.78 0.20 0.00 0.11 0.00 0.00 30.24 29.35 1z8r n GLN 57 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1z8r n THR 59 N -4.51 0.27 -3.95 0.00 -1.04 -1.26 -4.98 114.28 98.81 1z8r n THR 59 Ca 0.08 -0.63 -0.20 0.00 -2.04 0.00 0.00 64.05 61.26 1z8r n THR 59 Cb 0.53 0.92 -0.17 0.00 -1.82 0.00 0.00 70.33 69.79 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 -0.49 0.35 0.00 12.58 -4.23 -1.26 -1.21 115.64 121.38 1z8r s THR 60 Ca 0.05 0.04 0.00 0.00 -1.18 0.00 0.00 61.69 60.60 1z8r s THR 60 Cb 0.03 -0.45 0.00 0.00 1.34 0.00 0.00 72.50 73.43 1z8r s THR 60 CO 0.05 0.21 0.00 0.61 -0.54 0.00 0.00 174.62 174.95 1z8r n GLY 61 N 4.47 5.58 2.86 3.99 0.00 0.29 -4.84 105.19 117.54 1z8r n GLY 61 Ca -0.19 -1.62 -0.13 0.00 0.00 0.00 0.00 46.02 44.08 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 -0.69 -0.01 -0.07 1.61 0.11 -0.92 0.11 120.40 120.54 1z8r s VAL 62 Ca 0.00 0.05 -0.03 0.00 -2.93 0.00 0.00 61.98 59.07 1z8r s VAL 62 Cb 0.00 -0.04 0.04 0.00 -1.53 0.00 0.00 36.38 34.85 1z8r s VAL 62 CO 0.00 0.02 0.15 -0.72 -3.33 0.00 0.00 175.10 171.22 1z8r s TYR 63 N 0.25 -0.16 0.28 1.54 -0.85 0.77 -2.35 117.35 116.82 1z8r s TYR 63 Ca -0.02 0.49 -0.30 0.00 -0.52 0.00 0.00 57.07 56.71 1z8r s TYR 63 Cb -0.03 -0.09 -0.12 0.00 0.38 0.00 0.00 41.96 42.11 1z8r s TYR 63 CO -0.01 -0.17 1.63 1.97 -1.52 0.00 0.00 175.55 177.46 1z8r n PHE 64 N 4.22 2.86 -1.36 -3.49 -1.74 -1.26 -1.70 117.46 114.98 1z8r n PHE 64 Ca -0.26 0.20 -0.31 0.00 -0.56 0.00 0.00 57.45 56.51 1z8r n PHE 64 Cb 0.52 -2.62 0.08 0.00 1.52 0.00 0.00 39.48 38.98 1z8r n PHE 64 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1z8r h ALA 66 N -0.91 0.14 0.13 0.00 0.00 -1.93 -3.36 119.26 113.33 1z8r h ALA 66 Ca -0.44 -0.48 -0.29 0.00 0.00 0.00 0.00 54.91 53.70 1z8r h ALA 66 Cb 1.23 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1z8r h ALA 66 CO 0.52 0.26 -1.47 0.77 0.00 0.00 0.00 179.25 179.33 1z8r h SER 67 N -0.09 0.43 -3.38 0.00 0.02 -1.93 -3.46 113.55 105.15 1z8r h SER 67 Ca -0.03 -0.88 -0.55 0.00 -0.84 0.00 0.00 61.79 59.50 1z8r h SER 67 Cb 1.07 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.43 1z8r h SER 67 CO 0.08 1.65 0.34 -0.54 -1.14 0.00 0.00 176.83 177.23 1z8r s LYS 68 N -2.50 4.51 -0.31 3.45 -0.14 -1.26 -4.94 119.74 118.55 1z8r s LYS 68 Ca -0.19 1.31 -0.05 0.00 -1.36 0.00 0.00 55.97 55.69 1z8r s LYS 68 Cb 0.04 -3.47 -0.05 0.00 -1.68 0.00 0.00 37.83 32.68 1z8r s LYS 68 CO 0.79 -0.07 3.05 0.45 -0.76 0.00 0.00 175.35 178.81 1z8r n SER 69 N 4.05 6.08 -4.09 2.83 2.88 -1.26 -3.51 113.62 120.60 1z8r n SER 69 Ca 0.05 -2.97 -0.10 0.00 -1.33 0.00 0.00 58.87 54.52 1z8r n SER 69 Cb 0.51 -1.29 -0.07 0.00 -0.75 0.00 0.00 64.21 62.60 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 -0.82 1.39 0.16 -1.46 3.01 -1.26 -5.05 119.74 115.71 1z8r s LYS 70 Ca 0.62 -1.43 -0.26 0.00 -1.01 0.00 0.00 55.97 53.89 1z8r s LYS 70 Cb 0.36 0.38 -0.08 0.00 -1.01 0.00 0.00 37.83 37.48 1z8r s LYS 70 CO -0.15 -0.53 0.79 -3.38 0.51 0.00 0.00 175.35 172.59 1z8r s HIS 71 N -4.08 3.90 -0.21 3.18 -3.43 -1.26 -2.23 115.29 111.17 1z8r s HIS 71 Ca 0.30 1.65 0.01 0.00 -0.80 0.00 0.00 55.06 56.22 1z8r s HIS 71 Cb 0.03 -2.79 0.04 0.00 -1.43 0.00 0.00 32.58 28.43 1z8r s HIS 71 CO 0.10 0.49 -0.10 0.71 -2.00 0.00 0.00 174.74 173.94 1z8r s TYR 72 N -1.05 2.50 -0.11 0.38 1.51 -0.69 -4.88 117.35 115.01 1z8r s TYR 72 Ca 0.37 -1.67 -0.29 0.00 -1.01 0.00 0.00 57.07 54.46 1z8r s TYR 72 Cb -0.23 -1.67 -0.03 0.00 -0.11 0.00 0.00 41.96 39.91 1z8r s TYR 72 CO 0.27 -0.76 1.41 -2.14 -1.11 0.00 0.00 175.55 173.22 1z8r s PRO 73 N 1.37 4.22 0.01 -1.71 0.02 -1.26 -0.16 135.00 137.48 1z8r s PRO 73 Ca -0.02 1.88 0.03 0.00 0.02 0.00 0.00 61.00 62.91 1z8r s PRO 73 Cb -0.17 -3.82 -0.01 0.00 0.02 0.00 0.00 34.50 30.52 1z8r s PRO 73 CO -0.08 -0.74 -0.10 0.08 -0.33 0.00 0.00 177.00 175.83 1z8r s VAL 74 N 3.57 0.78 -0.25 3.83 1.01 0.31 -4.93 120.40 124.71 1z8r s VAL 74 Ca 0.62 -0.57 -0.16 0.00 0.00 0.00 0.00 61.98 61.87 1z8r s VAL 74 Cb -0.27 -0.68 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 1z8r s VAL 74 CO 0.21 0.11 0.44 -0.94 0.00 0.00 0.00 175.10 174.93 1z8r s SER 75 N -0.52 6.37 0.28 3.32 1.04 -1.26 -0.55 113.70 122.39 1z8r s SER 75 Ca 0.02 0.44 0.07 0.00 0.48 0.00 0.00 55.95 56.96 1z8r s SER 75 Cb -0.05 -2.25 -0.06 0.00 0.10 0.00 0.00 66.02 63.77 1z8r s SER 75 CO 0.00 -0.21 -0.06 0.72 0.98 0.00 0.00 173.24 174.67 1z8r s PHE 76 N 2.04 1.98 0.25 5.02 -0.12 -0.35 -4.43 117.98 122.36 1z8r s PHE 76 Ca 0.19 -0.69 0.09 0.00 -0.05 0.00 0.00 56.93 56.47 1z8r s PHE 76 Cb -0.16 -1.13 -0.04 0.00 -0.63 0.00 0.00 43.02 41.06 1z8r s PHE 76 CO 0.09 0.30 0.02 -1.21 -0.05 0.00 0.00 175.22 174.37 1z8r s GLU 77 N -3.72 2.39 -0.95 1.99 2.02 -0.69 -4.61 118.70 115.12 1z8r s GLU 77 Ca 0.30 -1.32 -0.01 0.00 0.02 0.00 0.00 54.97 53.96 1z8r s GLU 77 Cb 0.04 -2.24 0.31 0.00 0.10 0.00 0.00 34.13 32.33 1z8r s GLU 77 CO 0.12 0.39 1.47 0.41 0.02 0.00 0.00 175.26 177.67 1z8r n GLY 78 N -0.79 5.57 3.75 -1.39 0.00 -1.26 -2.20 105.19 108.86 1z8r n GLY 78 Ca -0.07 -2.66 -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 -3.44 4.36 0.00 1.61 0.04 -1.08 -4.87 135.00 131.61 1z8r s PRO 79 Ca 0.37 2.15 0.00 0.00 0.04 0.00 0.00 61.00 63.56 1z8r s PRO 79 Cb 0.14 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.54 1z8r s PRO 79 CO -0.02 -0.27 0.12 0.41 0.04 0.00 0.00 177.00 177.28 1z8r n GLY 80 N 1.91 -2.27 3.62 0.56 0.00 -1.26 -2.36 105.19 105.39 1z8r n GLY 80 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.26 4.07 -0.11 0.99 1.98 -1.26 0.10 118.68 124.20 1z8r s LEU 81 Ca 0.00 0.60 0.00 0.00 -2.89 0.00 0.00 54.13 51.84 1z8r s LEU 81 Cb 0.00 -2.78 0.02 0.00 0.66 0.00 0.00 46.19 44.09 1z8r s LEU 81 CO 0.00 -0.35 -0.09 -0.69 -1.89 0.00 0.00 176.35 173.33 1z8r s VAL 82 N 2.44 1.08 -0.46 1.68 1.01 0.79 -4.94 120.40 122.01 1z8r s VAL 82 Ca 0.24 -0.35 -0.28 0.00 0.00 0.00 0.00 61.98 61.59 1z8r s VAL 82 Cb -0.15 -1.07 0.01 0.00 0.00 0.00 0.00 36.38 35.16 1z8r s VAL 82 CO 0.09 0.37 1.47 -1.83 0.00 0.00 0.00 175.10 175.21 1z8r s GLU 83 N 1.47 3.42 -0.04 2.72 -1.05 -1.26 -2.26 118.70 121.70 1z8r s GLU 83 Ca 0.01 0.83 -0.30 0.00 -0.15 0.00 0.00 54.97 55.36 1z8r s GLU 83 Cb -0.13 -4.09 -0.04 0.00 -0.44 0.00 0.00 34.13 29.42 1z8r s GLU 83 CO -0.06 -1.76 1.33 0.14 0.95 0.00 0.00 175.26 175.85 1z8r s VAL 84 N 5.95 3.95 0.54 1.83 -7.23 0.14 -4.87 120.40 120.71 1z8r s VAL 84 Ca 0.61 1.29 -0.20 0.00 -1.81 0.00 0.00 61.98 61.88 1z8r s VAL 84 Cb -0.14 -3.83 -0.06 0.00 0.56 0.00 0.00 36.38 32.92 1z8r s VAL 84 CO 0.30 -0.02 1.14 0.00 -0.31 0.00 0.00 175.10 176.22 1z8r s GLN 85 N 2.48 3.33 -0.52 4.82 -2.07 -1.26 -2.00 119.66 124.44 1z8r s GLN 85 Ca 0.60 1.64 -0.27 0.00 -1.82 0.00 0.00 55.36 55.52 1z8r s GLN 85 Cb -0.28 -2.01 -0.02 0.00 -1.09 0.00 0.00 33.01 29.60 1z8r s GLN 85 CO 0.24 -0.87 1.90 -1.83 -1.32 0.00 0.00 175.29 173.40 1z8r s GLU 86 N -3.26 2.78 0.04 9.60 -1.05 -1.25 -4.59 118.70 120.96 1z8r s GLU 86 Ca 0.73 0.92 -0.05 0.00 -0.15 0.00 0.00 54.97 56.42 1z8r s GLU 86 Cb -0.25 -4.35 -0.01 0.00 -0.44 0.00 0.00 34.13 29.08 1z8r s GLU 86 CO 0.28 -2.54 0.09 -1.12 0.95 0.00 0.00 175.26 172.92 1z8r s SER 87 N 7.93 0.19 0.00 0.83 0.01 -0.67 -4.92 113.70 117.07 1z8r s SER 87 Ca 0.74 -0.56 0.00 0.00 1.31 0.00 0.00 55.95 57.43 1z8r s SER 87 Cb -0.16 0.23 0.00 0.00 0.21 0.00 0.00 66.02 66.30 1z8r s SER 87 CO 0.25 -0.52 0.00 1.21 0.41 0.00 0.00 173.24 174.59 1z8r n GLU 88 N 0.72 0.00 -0.75 12.44 2.13 -1.26 -0.88 120.64 133.04 1z8r n GLU 88 Ca -0.19 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.61 1z8r n GLU 88 Cb 0.59 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 32.27 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 -5.18 4.31 0.18 -1.26 -5.11 117.16 110.10 1z8r n TYR 89 Ca 0.00 -0.21 -0.32 0.00 1.88 0.00 0.00 57.90 59.25 1z8r n TYR 89 Cb 0.00 0.27 -0.17 0.00 -0.38 0.00 0.00 39.34 39.06 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 2.58 0.33 -3.48 5.04 -0.06 -5.13 117.35 116.63 1z8r s TYR 90 Ca 0.03 -1.01 -0.18 0.00 -2.44 0.00 0.00 57.07 53.47 1z8r s TYR 90 Cb 0.03 -1.72 -0.09 0.00 0.35 0.00 0.00 41.96 40.53 1z8r s TYR 90 CO -0.01 -0.40 0.80 -1.25 -1.34 0.00 0.00 175.55 173.35 1z8r s PRO 91 N 0.32 4.16 -0.89 4.97 0.04 -1.26 -1.67 135.00 140.67 1z8r s PRO 91 Ca -0.18 0.87 -0.19 0.00 0.04 0.00 0.00 61.00 61.54 1z8r s PRO 91 Cb -0.18 -2.49 -0.24 0.00 0.04 0.00 0.00 34.50 31.63 1z8r s PRO 91 CO 0.09 0.17 2.34 1.17 0.04 0.00 0.00 177.00 180.81 1z8r n LYS 92 N -0.13 0.25 -4.49 4.56 3.00 -1.25 -4.65 118.16 115.45 1z8r n LYS 92 Ca 0.03 -0.23 -0.23 0.00 -0.00 0.00 0.00 58.31 57.88 1z8r n LYS 92 Cb 0.53 -2.05 -0.11 0.00 0.00 0.00 0.00 35.03 33.41 1z8r n LYS 92 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 1z8r s ARG 93 N 7.98 1.69 -0.17 1.64 0.52 -0.85 -4.93 118.95 124.83 1z8r s ARG 93 Ca 1.19 -1.89 -0.13 0.00 -0.52 0.00 0.00 55.73 54.39 1z8r s ARG 93 Cb -0.66 -1.31 -0.05 0.00 0.52 0.00 0.00 34.95 33.45 1z8r s ARG 93 CO 0.40 0.02 0.24 0.71 0.02 0.00 0.00 175.30 176.68 1z8r s TYR 94 N -2.91 3.44 -0.02 -0.53 1.51 -1.26 0.29 117.35 117.86 1z8r s TYR 94 Ca 0.32 0.51 0.03 0.00 -1.01 0.00 0.00 57.07 56.92 1z8r s TYR 94 Cb 0.05 -2.29 -0.00 0.00 -0.11 0.00 0.00 41.96 39.61 1z8r s TYR 94 CO 0.14 0.25 -0.11 -0.65 -1.11 0.00 0.00 175.55 174.08 1z8r s GLN 95 N 0.45 0.98 -0.05 -0.62 -1.52 -0.96 -4.76 119.66 113.17 1z8r s GLN 95 Ca 0.14 -0.37 -0.02 0.00 -1.95 0.00 0.00 55.36 53.15 1z8r s GLN 95 Cb -0.12 -0.93 -0.04 0.00 -0.22 0.00 0.00 33.01 31.70 1z8r s GLN 95 CO 0.02 0.19 0.08 0.45 -0.25 0.00 0.00 175.29 175.78 1z8r s SER 96 N -0.05 5.79 -0.23 5.90 0.15 0.30 -0.15 113.70 125.41 1z8r s SER 96 Ca 0.01 0.24 -0.01 0.00 0.70 0.00 0.00 55.95 56.89 1z8r s SER 96 Cb -0.07 -1.72 -0.01 0.00 -1.71 0.00 0.00 66.02 62.51 1z8r s SER 96 CO 0.00 0.33 0.19 1.41 1.20 0.00 0.00 173.24 176.38 1z8r n HIS 97 N 1.60 -0.48 -4.77 3.44 8.25 0.28 -4.28 115.22 119.26 1z8r n HIS 97 Ca -0.16 0.18 -0.27 0.00 -0.26 0.00 0.00 57.72 57.21 1z8r n HIS 97 Cb 0.53 -2.75 -0.14 0.00 1.12 0.00 0.00 29.99 28.75 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 -3.08 1.76 -0.10 1.59 0.11 -0.99 -2.35 120.40 117.34 1z8r s VAL 98 Ca 0.06 -1.18 -0.05 0.00 -2.93 0.00 0.00 61.98 57.88 1z8r s VAL 98 Cb -0.01 -1.51 -0.04 0.00 -1.53 0.00 0.00 36.38 33.30 1z8r s VAL 98 CO 0.15 0.29 0.09 -0.76 -3.33 0.00 0.00 175.10 171.54 1z8r s LEU 99 N -1.06 4.07 -0.01 2.54 1.02 0.27 -2.64 118.68 122.88 1z8r s LEU 99 Ca 0.08 0.33 0.04 0.00 0.02 0.00 0.00 54.13 54.60 1z8r s LEU 99 Cb -0.09 -2.01 -0.01 0.00 0.02 0.00 0.00 46.19 44.10 1z8r s LEU 99 CO 0.01 0.39 -0.12 -0.76 0.02 0.00 0.00 176.35 175.89 1z8r s LEU 100 N -1.05 2.03 0.11 1.79 1.43 -0.94 0.29 118.68 122.34 1z8r s LEU 100 Ca 0.15 -0.23 -0.15 0.00 -1.03 0.00 0.00 54.13 52.88 1z8r s LEU 100 Cb -0.12 -0.60 0.03 0.00 0.03 0.00 0.00 46.19 45.53 1z8r s LEU 100 CO 0.04 0.14 0.35 0.00 0.23 0.00 0.00 176.35 177.12 1z8r s ALA 101 N -0.31 -0.78 -0.16 4.21 0.00 -0.87 -1.71 121.76 122.14 1z8r s ALA 101 Ca 0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 51.96 51.85 1z8r s ALA 101 Cb -0.05 0.61 -0.02 0.00 0.00 0.00 0.00 23.12 23.66 1z8r s ALA 101 CO -0.00 -0.59 -0.08 -0.08 0.00 0.00 0.00 175.76 175.00 1z8r s THR 102 N -3.66 3.36 0.00 0.00 -1.32 -1.26 0.20 115.64 112.96 1z8r s THR 102 Ca 0.02 -0.54 0.00 0.00 -1.21 0.00 0.00 61.69 59.97 1z8r s THR 102 Cb 0.02 -2.46 0.00 0.00 -1.51 0.00 0.00 72.50 68.55 1z8r s THR 102 CO -0.11 0.49 0.00 0.61 -2.21 0.00 0.00 174.62 173.40 1z8r n GLY 103 N 3.88 2.52 2.64 6.08 0.00 -0.81 -4.88 105.19 114.62 1z8r n GLY 103 Ca -0.18 -0.15 -0.11 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.93 -3.30 1.61 3.72 -1.26 -4.98 117.46 110.32 1z8r n PHE 104 Ca 0.00 -1.98 0.00 0.00 -0.05 0.00 0.00 57.45 55.42 1z8r n PHE 104 Cb 0.00 1.13 0.00 0.00 -0.94 0.00 0.00 39.48 39.67 1z8r n PHE 104 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1z8r n SER 105 N 2.61 0.53 0.11 4.37 3.41 -1.26 -5.03 113.62 118.36 1z8r n SER 105 Ca 0.19 -0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.50 1z8r n SER 105 Cb 0.55 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 1z8r n SER 105 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1z8r n GLU 106 N 0.00 0.00 -0.14 4.33 4.71 -1.26 -4.67 120.64 123.61 1z8r n GLU 106 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.16 57.06 1z8r n GLU 106 Cb 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 31.44 30.43 1z8r n GLU 106 CO 0.00 0.00 0.00 -1.00 0.09 0.00 0.00 177.13 176.22 1z8r h PRO 107 N 0.00 0.61 0.00 3.49 0.13 -1.96 -3.41 132.00 130.86 1z8r h PRO 107 Ca 0.00 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1z8r h PRO 107 Cb 0.00 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.02 1z8r h PRO 107 CO 0.00 0.53 0.00 0.41 -0.23 0.00 0.00 178.00 178.71 1z8r n GLY 108 N -0.88 0.87 1.39 1.56 0.00 -1.26 -4.91 105.19 101.96 1z8r n GLY 108 Ca 0.00 -0.01 0.19 0.00 0.00 0.00 0.00 46.02 46.20 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 2.08 -8.24 -3.54 1.61 9.92 -1.26 -4.58 116.55 112.54 1z8r n ASP 109 Ca 0.00 0.60 -0.11 0.00 -0.53 0.00 0.00 54.79 54.75 1z8r n ASP 109 Cb 0.00 -4.22 0.03 0.00 -0.64 0.00 0.00 41.12 36.29 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 -2.35 0.62 -1.12 2.24 0.00 -1.26 -5.03 120.51 113.61 1z8r n ALA 110 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 53.44 52.33 1z8r n ALA 110 Cb 0.63 0.33 0.00 0.00 0.00 0.00 0.00 19.45 20.41 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 1.31 -4.25 0.00 0.00 0.00 -1.26 -5.04 105.19 95.96 1z8r n GLY 111 Ca 0.07 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 -0.43 4.21 3.23 -0.02 0.00 -1.24 -4.87 105.19 106.06 1z8r n GLY 112 Ca 0.00 -1.27 -0.24 0.00 0.00 0.00 0.00 46.02 44.51 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 -1.05 1.52 -0.19 -0.61 -5.25 -1.26 0.35 121.20 114.72 1z8r s ILE 113 Ca 0.00 -1.23 -0.22 0.00 -0.99 0.00 0.00 60.65 58.21 1z8r s ILE 113 Cb 0.00 -1.35 -0.02 0.00 2.95 0.00 0.00 42.46 44.04 1z8r s ILE 113 CO 0.00 0.08 0.70 -0.22 -1.79 0.00 0.00 174.94 173.71 1z8r s LEU 114 N -1.35 4.15 0.04 0.37 2.96 0.27 -4.75 118.68 120.37 1z8r s LEU 114 Ca 0.05 0.95 0.07 0.00 -0.22 0.00 0.00 54.13 54.98 1z8r s LEU 114 Cb -0.09 -3.01 -0.03 0.00 0.50 0.00 0.00 46.19 43.56 1z8r s LEU 114 CO 0.02 -0.32 -0.17 -0.13 -1.32 0.00 0.00 176.35 174.44 1z8r s ARG 115 N 2.00 2.11 0.34 1.98 0.52 -0.99 -0.46 118.95 124.45 1z8r s ARG 115 Ca 0.32 -0.97 0.08 0.00 -0.52 0.00 0.00 55.73 54.64 1z8r s ARG 115 Cb -0.16 -2.22 -0.04 0.00 0.52 0.00 0.00 34.95 33.05 1z8r s ARG 115 CO 0.11 0.54 0.21 0.00 0.02 0.00 0.00 175.30 176.18 1z8r h GLU 117 N 1.41 0.00 0.00 0.00 4.11 -1.98 -1.31 114.58 116.80 1z8r h GLU 117 Ca -0.44 0.00 -0.31 0.00 0.07 0.00 0.00 59.36 58.68 1z8r h GLU 117 Cb 1.25 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.45 1z8r h GLU 117 CO 0.61 0.00 -2.03 0.72 0.07 0.00 0.00 179.01 178.38 1z8r n HIS 118 N -2.49 0.47 0.00 2.06 8.25 -1.26 -5.09 115.22 117.16 1z8r n HIS 118 Ca -0.02 0.17 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 1z8r n HIS 118 Cb 0.06 -1.06 0.00 0.00 1.12 0.00 0.00 29.99 30.11 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 1.62 -0.82 3.81 -1.41 0.00 -0.50 -4.58 105.19 103.32 1z8r n GLY 119 Ca -0.24 -0.15 -0.36 0.00 0.00 0.00 0.00 46.02 45.27 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 0.00 1.61 1.01 0.23 0.11 120.40 124.78 1z8r s VAL 120 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.25 1z8r s VAL 120 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.91 1z8r s VAL 120 CO 0.00 0.53 0.00 -0.38 0.00 0.00 0.00 175.10 175.25 1z8r n ILE 121 N 2.71 0.00 -3.12 2.22 5.41 0.39 0.61 119.36 127.58 1z8r n ILE 121 Ca -0.17 0.43 0.00 0.00 1.00 0.00 0.00 62.75 64.00 1z8r n ILE 121 Cb 0.53 -1.42 0.00 0.00 -0.71 0.00 0.00 39.64 38.04 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 1.65 2.85 3.60 7.39 0.00 -0.93 -0.24 105.19 119.51 1z8r n GLY 122 Ca 0.00 -1.17 -0.25 0.00 0.00 0.00 0.00 46.02 44.61 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 0.08 0.99 2.34 0.46 0.95 118.68 126.42 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 44.26 1z8r s LEU 123 CO 0.00 -0.20 1.56 0.68 -1.06 0.00 0.00 176.35 177.34 1z8r s VAL 124 N -2.52 3.11 0.00 1.48 -7.23 0.16 0.12 120.40 115.52 1z8r s VAL 124 Ca 0.34 0.64 0.00 0.00 -1.81 0.00 0.00 61.98 61.15 1z8r s VAL 124 Cb -0.00 -3.41 0.00 0.00 0.56 0.00 0.00 36.38 33.53 1z8r s VAL 124 CO 0.19 0.01 0.00 0.41 -0.31 0.00 0.00 175.10 175.40 1z8r n THR 125 N 4.49 0.00 -4.00 5.32 -1.04 0.23 -4.71 114.28 114.58 1z8r n THR 125 Ca 0.15 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 62.07 1z8r n THR 125 Cb 0.41 -0.17 -0.08 0.00 -1.82 0.00 0.00 70.33 68.66 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 0.40 0.88 0.00 -2.82 -1.94 -0.53 -4.96 119.30 110.33 1z8r s MET 126 Ca 0.00 -1.17 0.00 0.00 -1.71 0.00 0.00 55.69 52.81 1z8r s MET 126 Cb 0.00 0.30 0.00 0.00 2.01 0.00 0.00 34.83 37.14 1z8r s MET 126 CO 0.00 -0.26 0.00 0.41 -0.01 0.00 0.00 175.02 175.16 1z8r n GLY 127 N -0.06 -0.56 0.00 -0.03 0.00 -1.26 -0.33 105.19 102.94 1z8r n GLY 127 Ca -0.11 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1z8r n GLY 127 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1z8r n GLY 128 N 0.00 5.66 0.77 -0.02 0.00 -0.95 -4.85 105.19 105.79 1z8r n GLY 128 Ca 0.00 -1.55 0.05 0.00 0.00 0.00 0.00 46.02 44.53 1z8r n GLY 128 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1z8r n GLU 129 N 0.00 2.04 0.00 1.61 0.28 -1.26 -4.17 120.64 119.14 1z8r n GLU 129 Ca 0.00 -1.35 0.00 0.00 -0.16 0.00 0.00 57.16 55.65 1z8r n GLU 129 Cb 0.00 -1.39 0.00 0.00 1.43 0.00 0.00 31.44 31.48 1z8r n GLU 129 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1z8r n GLY 130 N 0.94 0.00 3.56 -1.84 0.00 -1.26 -4.25 105.19 102.33 1z8r n GLY 130 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.29 3.04 -0.17 1.61 1.01 -1.26 -1.92 120.40 121.42 1z8r s VAL 131 Ca 0.00 -1.93 0.01 0.00 0.00 0.00 0.00 61.98 60.06 1z8r s VAL 131 Cb 0.00 -2.56 0.03 0.00 0.00 0.00 0.00 36.38 33.85 1z8r s VAL 131 CO 0.00 -0.25 -0.16 0.68 0.00 0.00 0.00 175.10 175.37 1z8r s VAL 132 N -2.06 1.81 -0.34 2.92 -7.23 0.53 -2.24 120.40 113.80 1z8r s VAL 132 Ca 0.28 -0.85 -0.12 0.00 -1.81 0.00 0.00 61.98 59.47 1z8r s VAL 132 Cb -0.07 -1.70 -0.01 0.00 0.56 0.00 0.00 36.38 35.16 1z8r s VAL 132 CO 0.16 0.43 0.21 -0.83 -0.31 0.00 0.00 175.10 174.76 1z8r s GLY 133 N 1.38 1.93 -0.04 2.32 0.00 0.55 -2.05 107.32 111.41 1z8r s GLY 133 Ca 0.04 -1.42 0.04 0.00 0.00 0.00 0.00 44.72 43.38 1z8r s GLY 133 CO -0.11 0.76 -0.15 -1.36 0.00 0.00 0.00 173.10 172.23 1z8r s PHE 134 N 1.67 2.66 -0.34 1.90 0.08 0.15 0.76 117.98 124.86 1z8r s PHE 134 Ca 0.05 -0.19 -0.22 0.00 0.12 0.00 0.00 56.93 56.70 1z8r s PHE 134 Cb -0.17 -1.60 0.00 0.00 -0.57 0.00 0.00 43.02 40.68 1z8r s PHE 134 CO 0.09 0.18 0.71 0.00 -0.10 0.00 0.00 175.22 176.10 1z8r s ALA 135 N -0.74 3.47 0.39 5.36 0.00 0.33 0.95 121.76 131.51 1z8r s ALA 135 Ca 0.12 -0.68 -0.26 0.00 0.00 0.00 0.00 51.96 51.13 1z8r s ALA 135 Cb -0.11 -3.25 -0.09 0.00 0.00 0.00 0.00 23.12 19.67 1z8r s ALA 135 CO 0.01 -1.33 1.25 -0.51 0.00 0.00 0.00 175.76 175.17 1z8r s ASP 136 N 1.76 6.50 0.00 0.00 1.11 -0.99 -0.40 116.67 124.65 1z8r s ASP 136 Ca 0.28 2.53 0.14 0.00 0.18 0.00 0.00 52.55 55.68 1z8r s ASP 136 Cb -0.14 -2.63 0.39 0.00 1.07 0.00 0.00 42.92 41.61 1z8r s ASP 136 CO 0.15 -0.71 1.32 0.52 1.18 0.00 0.00 175.17 177.63 1z8r n VAL 137 N 0.26 0.55 0.76 -1.27 0.31 0.66 -4.08 118.33 115.53 1z8r n VAL 137 Ca 0.03 -0.56 0.08 0.00 -0.01 0.00 0.00 64.34 63.89 1z8r n VAL 137 Cb 0.44 0.30 0.42 0.00 -0.91 0.00 0.00 33.84 34.09 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 0.73 0.19 -0.33 5.55 1.74 -1.26 -2.29 116.66 121.00 1z8r n ARG 138 Ca 0.14 0.14 0.09 0.00 -0.77 0.00 0.00 57.85 57.45 1z8r n ARG 138 Cb 0.36 -1.50 0.25 0.00 -1.02 0.00 0.00 32.46 30.55 1z8r n ARG 138 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1z8r n ASP 139 N -1.34 3.16 -2.67 0.55 5.68 -1.26 -4.49 116.55 116.20 1z8r n ASP 139 Ca 0.07 -2.07 -0.04 0.00 -0.50 0.00 0.00 54.79 52.26 1z8r n ASP 139 Cb 0.15 -0.40 0.11 0.00 -1.14 0.00 0.00 41.12 39.84 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 1.08 -1.28 0.11 -2.12 -0.00 -0.97 -5.01 117.00 108.81 1z8r n LEU 140 Ca 0.19 -1.92 0.13 0.00 -0.00 0.00 0.00 56.01 54.41 1z8r n LEU 140 Cb 0.52 0.91 0.42 0.00 -0.00 0.00 0.00 43.42 45.27 1z8r n LEU 140 CO 0.14 1.61 0.89 -0.11 -0.00 0.00 0.00 177.39 179.92 1z8r n LEU 141 N 0.67 0.78 -4.20 1.47 -0.00 -1.19 -4.64 117.00 109.90 1z8r n LEU 141 Ca -0.04 0.58 -0.25 0.00 -0.00 0.00 0.00 56.01 56.31 1z8r n LEU 141 Cb 0.75 -0.35 -0.12 0.00 -0.00 0.00 0.00 43.42 43.70 1z8r n LEU 141 CO -0.10 -0.22 1.20 -2.67 -0.00 0.00 0.00 177.39 175.60 1z8r n TRP 142 N -2.25 0.57 0.00 1.96 4.27 -1.26 -3.62 117.44 117.12 1z8r n TRP 142 Ca 0.05 -0.28 0.00 0.00 -3.89 0.00 0.00 57.50 53.38 1z8r n TRP 142 Cb 0.41 -1.94 0.00 0.00 -1.36 0.00 0.00 31.31 28.42 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 16.06 0.00 0.00 5.67 4.32 -1.26 -5.03 117.00 136.76 1z8r n LEU 143 Ca 0.43 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.42 1z8r n LEU 143 Cb 0.45 0.01 0.00 0.00 -1.62 0.00 0.00 43.42 42.27 1z8r n LEU 143 CO 0.80 -0.37 0.00 1.21 -1.22 0.00 0.00 177.39 177.81 1z8r n GLU 144 N -2.24 0.00 -2.24 3.23 4.07 -1.24 -4.65 120.64 117.58 1z8r n GLU 144 Ca 0.00 0.00 -0.37 0.00 -0.06 0.00 0.00 57.16 56.73 1z8r n GLU 144 Cb 0.00 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 31.37 1z8r n GLU 144 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1z8r s ASP 145 N 1.03 6.14 0.26 4.31 1.01 -1.26 -5.03 116.67 123.13 1z8r s ASP 145 Ca 0.00 2.33 -0.04 0.00 0.71 0.00 0.00 52.55 55.54 1z8r s ASP 145 Cb 0.00 -2.60 -0.05 0.00 1.01 0.00 0.00 42.92 41.27 1z8r s ASP 145 CO 0.00 -0.94 0.51 -1.81 0.21 0.00 0.00 175.17 173.14 1z8r s ASP 146 N -1.34 6.45 -0.08 0.27 1.01 -1.26 -4.59 116.67 117.12 1z8r s ASP 146 Ca 0.64 0.66 -0.18 0.00 0.71 0.00 0.00 52.55 54.38 1z8r s ASP 146 Cb -0.29 -2.12 -0.05 0.00 1.01 0.00 0.00 42.92 41.47 1z8r s ASP 146 CO 0.35 -0.15 0.48 0.00 0.21 0.00 0.00 175.17 176.06 1z8r s ALA 147 N -2.01 3.52 0.22 5.23 0.00 -1.23 -4.81 121.76 122.67 1z8r s ALA 147 Ca 0.43 -0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.22 1z8r s ALA 147 Cb -0.11 -2.61 0.00 0.00 0.00 0.00 0.00 23.12 20.40 1z8r s ALA 147 CO 0.29 0.11 0.00 -0.12 0.00 0.00 0.00 175.76 176.04 1z8r n MET 148 N 3.22 0.00 -4.01 0.00 1.56 -1.26 -3.11 117.12 113.51 1z8r n MET 148 Ca -0.08 0.00 -0.22 0.00 -0.27 0.00 0.00 57.70 57.13 1z8r n MET 148 Cb 0.52 0.00 -0.05 0.00 2.15 0.00 0.00 33.22 35.83 1z8r n MET 148 CO 0.00 0.00 0.00 -2.00 -0.73 0.00 0.00 175.97 173.24 1z8r s GLU 149 N -2.00 2.56 0.00 2.12 2.12 -1.26 -5.11 118.70 117.13 1z8r s GLU 149 Ca 0.00 -1.39 0.01 0.00 0.36 0.00 0.00 54.97 53.95 1z8r s GLU 149 Cb 0.00 -2.33 0.05 0.00 0.26 0.00 0.00 34.13 32.11 1z8r s GLU 149 CO 0.00 0.16 0.54 0.94 -0.54 0.00 0.00 175.26 176.36