#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 0.30 -5.68 1.61 0.13 -2.11 -3.46 132.00 122.80 1z8r h PRO 2 Ca 0.00 -0.16 -0.61 0.00 -0.87 0.00 0.00 66.00 64.36 1z8r h PRO 2 Cb 0.00 0.01 -0.09 0.00 0.13 0.00 0.00 31.00 31.05 1z8r h PRO 2 CO 0.00 0.71 -0.45 1.52 -0.23 0.00 0.00 178.00 179.55 1z8r s TYR 3 N -4.06 2.06 0.00 1.56 -0.85 -1.26 -4.83 117.35 109.98 1z8r s TYR 3 Ca -0.05 -0.79 0.00 0.00 -0.52 0.00 0.00 57.07 55.71 1z8r s TYR 3 Cb 0.13 -1.83 0.00 0.00 0.38 0.00 0.00 41.96 40.64 1z8r s TYR 3 CO 0.79 0.00 0.00 0.41 -1.52 0.00 0.00 175.55 175.23 1z8r n GLY 4 N -1.40 0.97 0.35 5.49 0.00 -1.26 -5.02 105.19 104.31 1z8r n GLY 4 Ca -0.07 -0.49 -0.13 0.00 0.00 0.00 0.00 46.02 45.33 1z8r n GLY 4 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1z8r h HIS 5 N 0.00 -0.80 -3.18 1.61 3.86 -1.93 -3.49 115.15 111.22 1z8r h HIS 5 Ca 0.00 -0.02 0.39 0.00 -1.16 0.00 0.00 60.37 59.58 1z8r h HIS 5 Cb 0.64 0.26 -0.10 0.00 1.06 0.00 0.00 27.41 29.28 1z8r h HIS 5 CO 0.00 -0.50 -0.53 1.04 0.86 0.00 0.00 177.93 178.80 1z8r n GLN 6 N -4.72 -2.89 -3.66 2.45 6.02 -1.26 -5.00 117.38 108.32 1z8r n GLN 6 Ca -0.11 1.91 -0.12 0.00 -0.01 0.00 0.00 57.00 58.68 1z8r n GLN 6 Cb 0.34 -3.51 -0.06 0.00 1.02 0.00 0.00 30.24 28.03 1z8r n GLN 6 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1z8r s SER 7 N -7.09 -0.24 -0.04 1.08 0.01 -1.26 -5.06 113.70 101.09 1z8r s SER 7 Ca 0.00 -0.17 0.17 0.00 1.31 0.00 0.00 55.95 57.27 1z8r s SER 7 Cb 0.00 0.44 0.33 0.00 0.21 0.00 0.00 66.02 66.99 1z8r s SER 7 CO 0.00 -0.74 1.14 0.61 0.41 0.00 0.00 173.24 174.66 1z8r n GLY 8 N 0.18 1.87 3.86 3.44 0.00 -1.26 -4.75 105.19 108.53 1z8r n GLY 8 Ca -0.17 -0.76 0.02 0.00 0.00 0.00 0.00 46.02 45.10 1z8r n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z8r n ALA 9 N -0.02 -3.38 -3.81 4.61 0.00 -1.26 -4.83 120.51 111.82 1z8r n ALA 9 Ca 0.08 -0.81 -0.34 0.00 0.00 0.00 0.00 53.44 52.36 1z8r n ALA 9 Cb 0.94 0.21 -0.14 0.00 0.00 0.00 0.00 19.45 20.46 1z8r n ALA 9 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1z8r s VAL 10 N -2.03 2.73 -0.33 0.00 1.01 -0.98 -5.01 120.40 115.80 1z8r s VAL 10 Ca 0.28 -1.60 -0.13 0.00 0.00 0.00 0.00 61.98 60.54 1z8r s VAL 10 Cb -0.01 -2.64 -0.02 0.00 0.00 0.00 0.00 36.38 33.70 1z8r s VAL 10 CO 0.00 -0.18 0.25 -0.47 0.00 0.00 0.00 175.10 174.70 1z8r s TYR 11 N 1.17 3.23 -0.27 5.22 6.14 -1.26 -1.32 117.35 130.26 1z8r s TYR 11 Ca -0.04 -0.11 0.03 0.00 0.64 0.00 0.00 57.07 57.60 1z8r s TYR 11 Cb -0.20 -2.48 0.06 0.00 0.42 0.00 0.00 41.96 39.76 1z8r s TYR 11 CO -0.03 -0.32 -0.09 0.08 0.64 0.00 0.00 175.55 175.83 1z8r s VAL 12 N 1.77 2.09 0.00 3.14 1.01 0.48 -3.91 120.40 124.99 1z8r s VAL 12 Ca 0.07 -1.66 0.00 0.00 0.00 0.00 0.00 61.98 60.39 1z8r s VAL 12 Cb -0.17 -2.26 0.00 0.00 0.00 0.00 0.00 36.38 33.95 1z8r s VAL 12 CO 0.11 -0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.72 1z8r n GLY 13 N 4.44 3.21 0.75 4.51 0.00 -1.26 -0.27 105.19 116.57 1z8r n GLY 13 Ca -0.12 0.05 0.04 0.00 0.00 0.00 0.00 46.02 46.00 1z8r n GLY 13 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1z8r n ASN 14 N 4.08 2.13 -3.96 1.61 6.94 -1.26 -4.60 115.26 120.19 1z8r n ASN 14 Ca 0.00 -2.12 -0.24 0.00 -0.02 0.00 0.00 54.58 52.20 1z8r n ASN 14 Cb 0.00 -0.33 -0.17 0.00 -2.36 0.00 0.00 39.78 36.93 1z8r n ASN 14 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1z8r s TYR 15 N -1.63 1.26 -0.22 -2.53 2.02 0.63 -1.77 117.35 115.11 1z8r s TYR 15 Ca 0.22 -0.48 0.02 0.00 -0.37 0.00 0.00 57.07 56.46 1z8r s TYR 15 Cb 0.13 -0.99 0.04 0.00 -0.40 0.00 0.00 41.96 40.75 1z8r s TYR 15 CO 0.12 -0.30 -0.15 0.21 -1.57 0.00 0.00 175.55 173.87 1z8r s LYS 16 N 0.94 2.53 -0.26 -0.62 2.20 0.13 -0.39 119.74 124.27 1z8r s LYS 16 Ca -0.10 -1.06 -0.11 0.00 -0.36 0.00 0.00 55.97 54.34 1z8r s LYS 16 Cb -0.15 -2.69 -0.05 0.00 -1.51 0.00 0.00 37.83 33.43 1z8r s LYS 16 CO 0.01 -0.40 0.21 0.14 -0.36 0.00 0.00 175.35 174.95 1z8r s VAL 17 N 1.22 5.31 0.10 4.02 -7.23 -0.43 -1.80 120.40 121.59 1z8r s VAL 17 Ca -0.02 0.24 0.01 0.00 -1.81 0.00 0.00 61.98 60.39 1z8r s VAL 17 Cb -0.17 -3.55 -0.04 0.00 0.56 0.00 0.00 36.38 33.19 1z8r s VAL 17 CO -0.09 0.27 -0.03 0.54 -0.31 0.00 0.00 175.10 175.48 1z8r s VAL 18 N 1.57 0.53 0.41 1.32 0.11 -0.90 -2.31 120.40 121.14 1z8r s VAL 18 Ca 0.08 -1.92 -0.27 0.00 -2.93 0.00 0.00 61.98 56.95 1z8r s VAL 18 Cb -0.15 -1.76 -0.10 0.00 -1.53 0.00 0.00 36.38 32.84 1z8r s VAL 18 CO 0.09 -0.79 1.47 0.59 -3.33 0.00 0.00 175.10 173.13 1z8r n ASN 19 N -0.05 3.62 -0.23 3.54 4.13 -1.26 -2.32 115.26 122.68 1z8r n ASN 19 Ca -0.11 1.18 -0.02 0.00 1.68 0.00 0.00 54.58 57.32 1z8r n ASN 19 Cb 0.62 -1.62 0.10 0.00 -1.54 0.00 0.00 39.78 37.34 1z8r n ASN 19 CO 0.00 0.00 0.00 0.08 0.28 0.00 0.00 177.26 177.62 1z8r h ARG 20 N 2.66 0.67 0.00 3.52 -0.00 -0.55 0.21 114.38 120.90 1z8r h ARG 20 Ca -0.51 -0.04 0.00 0.00 -0.00 0.00 0.00 59.98 59.43 1z8r h ARG 20 Cb 1.25 -0.15 0.00 0.00 -0.00 0.00 0.00 29.97 31.07 1z8r h ARG 20 CO 0.63 0.44 0.00 1.58 -0.00 0.00 0.00 179.97 182.62 1z8r n HIS 21 N -4.78 0.16 0.22 4.08 -0.00 -1.26 -2.20 115.22 111.43 1z8r n HIS 21 Ca 0.08 0.07 0.03 0.00 0.46 0.00 0.00 57.72 58.36 1z8r n HIS 21 Cb 0.17 -0.61 0.03 0.00 -0.12 0.00 0.00 29.99 29.46 1z8r n HIS 21 CO 0.00 0.00 0.00 -0.11 0.46 0.00 0.00 176.34 176.69 1z8r n LEU 22 N -1.65 1.53 -4.69 0.27 7.94 0.43 -5.00 117.00 115.83 1z8r n LEU 22 Ca 0.02 -1.06 -0.40 0.00 -1.11 0.00 0.00 56.01 53.46 1z8r n LEU 22 Cb 0.14 -0.01 -0.05 0.00 0.53 0.00 0.00 43.42 44.04 1z8r n LEU 22 CO 0.12 0.33 0.44 0.00 -1.11 0.00 0.00 177.39 177.17 1z8r s ALA 23 N -0.51 3.43 0.82 1.96 0.00 0.46 -4.84 121.76 123.08 1z8r s ALA 23 Ca 0.07 0.02 -0.12 0.00 0.00 0.00 0.00 51.96 51.93 1z8r s ALA 23 Cb 0.05 -3.02 0.08 0.00 0.00 0.00 0.00 23.12 20.23 1z8r s ALA 23 CO 0.07 -0.33 1.10 -0.08 0.00 0.00 0.00 175.76 176.52 1z8r s THR 24 N 1.36 2.90 0.53 0.00 -1.32 -1.26 -4.82 115.64 113.03 1z8r s THR 24 Ca 0.36 0.29 0.27 0.00 -1.21 0.00 0.00 61.69 61.40 1z8r s THR 24 Cb -0.17 -3.02 0.42 0.00 -1.51 0.00 0.00 72.50 68.22 1z8r s THR 24 CO 0.15 -0.38 1.96 0.45 -2.21 0.00 0.00 174.62 174.59 1z8r h HIS 25 N -1.17 0.00 -0.04 9.09 3.86 -1.99 0.19 115.15 125.08 1z8r h HIS 25 Ca -0.48 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 58.60 1z8r h HIS 25 Cb 1.28 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.73 1z8r h HIS 25 CO 0.44 0.00 -0.60 -0.24 0.86 0.00 0.00 177.93 178.39 1z8r h VAL 26 N 0.00 1.40 -0.30 2.45 3.04 -1.98 0.14 116.25 121.01 1z8r h VAL 26 Ca 0.30 -1.99 -0.08 0.00 -1.01 0.00 0.00 66.70 63.92 1z8r h VAL 26 Cb 1.21 2.03 -0.01 0.00 -2.01 0.00 0.00 31.29 32.51 1z8r h VAL 26 CO -0.00 0.58 -0.12 -0.78 -1.01 0.00 0.00 177.57 176.23 1z8r h ASP 27 N 0.11 0.63 0.27 3.17 3.58 -0.98 -2.55 116.42 120.64 1z8r h ASP 27 Ca -0.01 -0.40 -0.19 0.00 0.42 0.00 0.00 57.03 56.85 1z8r h ASP 27 Cb 1.08 -0.17 -0.00 0.00 1.72 0.00 0.00 39.33 41.95 1z8r h ASP 27 CO 0.09 0.88 -0.78 -0.50 -2.88 0.00 0.00 179.24 176.05 1z8r h TRP 28 N 0.37 0.57 -0.93 0.28 4.06 -1.40 -0.53 115.95 118.37 1z8r h TRP 28 Ca 0.07 -0.27 0.06 0.00 2.06 0.00 0.00 58.89 60.81 1z8r h TRP 28 Cb 0.64 -0.08 -0.06 0.00 -1.00 0.00 0.00 29.16 28.65 1z8r h TRP 28 CO 0.06 1.04 0.59 1.96 -3.56 0.00 0.00 178.44 178.53 1z8r h GLN 29 N 0.27 1.06 -0.45 0.49 1.08 -0.63 -2.57 115.11 114.36 1z8r h GLN 29 Ca -0.04 -0.06 -0.31 0.00 -1.45 0.00 0.00 58.65 56.79 1z8r h GLN 29 Cb 1.37 -0.24 -0.21 0.00 -0.05 0.00 0.00 27.48 28.35 1z8r h GLN 29 CO 0.13 0.70 -0.43 -1.71 -0.95 0.00 0.00 178.83 176.57 1z8r n ASN 30 N -4.55 3.57 -4.69 1.46 4.05 -0.97 -5.03 115.26 109.10 1z8r n ASN 30 Ca 0.13 -3.81 -0.42 0.00 0.45 0.00 0.00 54.58 50.93 1z8r n ASN 30 Cb 0.16 -0.51 -0.03 0.00 1.23 0.00 0.00 39.78 40.63 1z8r n ASN 30 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1z8r h VAL 32 N 5.02 0.86 -4.05 0.00 -1.51 0.54 -3.48 116.25 113.61 1z8r h VAL 32 Ca -0.33 -2.53 -0.16 0.00 -1.23 0.00 0.00 66.70 62.44 1z8r h VAL 32 Cb 1.16 2.64 -0.19 0.00 -2.13 0.00 0.00 31.29 32.77 1z8r h VAL 32 CO 0.87 0.83 -0.70 0.86 -1.23 0.00 0.00 177.57 178.20 1z8r s TRP 33 N -2.58 0.39 -0.30 5.19 -0.00 -1.04 -4.97 118.94 115.64 1z8r s TRP 33 Ca -0.16 -0.71 -0.12 0.00 -0.00 0.00 0.00 56.10 55.12 1z8r s TRP 33 Cb 0.06 -0.28 0.14 0.00 -0.00 0.00 0.00 33.47 33.39 1z8r s TRP 33 CO 0.82 -0.24 0.74 -2.00 -0.00 0.00 0.00 176.95 176.27 1z8r s GLU 34 N -2.33 0.51 -0.50 5.86 -6.30 -1.26 0.77 118.70 115.44 1z8r s GLU 34 Ca -0.07 1.25 -0.09 0.00 -2.50 0.00 0.00 54.97 53.56 1z8r s GLU 34 Cb -0.04 0.73 0.13 0.00 0.00 0.00 0.00 34.13 34.95 1z8r s GLU 34 CO -0.04 -0.17 0.37 -0.51 0.02 0.00 0.00 175.26 174.93 1z8r s ASP 35 N 2.71 5.72 0.53 -1.70 1.01 0.24 -4.94 116.67 120.24 1z8r s ASP 35 Ca -0.05 -2.04 0.22 0.00 0.71 0.00 0.00 52.55 51.39 1z8r s ASP 35 Cb -0.10 -2.01 1.38 0.00 1.01 0.00 0.00 42.92 43.20 1z8r s ASP 35 CO -0.19 -0.66 2.07 0.22 0.21 0.00 0.00 175.17 176.82 1z8r h TYR 36 N 8.29 0.00 -0.65 4.23 5.03 -1.96 0.46 116.97 132.37 1z8r h TYR 36 Ca -0.18 0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.07 1z8r h TYR 36 Cb 1.06 0.00 -0.03 0.00 1.55 0.00 0.00 36.73 39.31 1z8r h TYR 36 CO 0.66 0.00 0.17 -0.97 -1.32 0.00 0.00 178.16 176.71 1z8r h ASN 37 N 0.00 0.98 -0.01 -2.11 -0.73 -1.92 -2.94 115.58 108.85 1z8r h ASN 37 Ca 0.14 -0.23 0.00 0.00 1.87 0.00 0.00 56.30 58.08 1z8r h ASN 37 Cb 0.57 -0.26 0.00 0.00 0.27 0.00 0.00 38.32 38.90 1z8r h ASN 37 CO -0.00 0.95 -0.41 -2.11 -0.37 0.00 0.00 177.43 175.48 1z8r n ARG 38 N -4.31 1.33 -3.46 6.67 1.85 -0.62 -1.72 116.66 116.40 1z8r n ARG 38 Ca 0.04 -1.09 -0.18 0.00 -1.00 0.00 0.00 57.85 55.62 1z8r n ARG 38 Cb 0.24 -1.48 0.09 0.00 -1.05 0.00 0.00 32.46 30.26 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 -2.76 -4.02 2.89 9.92 0.15 -4.81 116.55 118.04 1z8r n ASP 39 Ca 0.10 -0.61 -0.14 0.00 -0.53 0.00 0.00 54.79 53.62 1z8r n ASP 39 Cb 0.48 -5.11 -0.12 0.00 -0.64 0.00 0.00 41.12 35.73 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 -6.51 2.17 0.05 0.64 2.96 -0.97 0.23 118.68 117.25 1z8r s LEU 40 Ca 0.10 -0.38 -0.10 0.00 -0.22 0.00 0.00 54.13 53.52 1z8r s LEU 40 Cb -0.04 -0.17 0.01 0.00 0.50 0.00 0.00 46.19 46.48 1z8r s LEU 40 CO 0.73 -0.12 0.21 -1.48 -1.32 0.00 0.00 176.35 174.37 1z8r s LEU 41 N -1.06 1.30 -0.15 -0.68 -0.00 -0.98 0.81 118.68 117.92 1z8r s LEU 41 Ca -0.06 -0.39 0.01 0.00 -0.00 0.00 0.00 54.13 53.68 1z8r s LEU 41 Cb -0.07 1.03 0.00 0.00 -0.00 0.00 0.00 46.19 47.15 1z8r s LEU 41 CO 0.00 -0.60 -0.17 -0.69 -0.00 0.00 0.00 176.35 174.89 1z8r s VAL 42 N -2.81 2.50 0.24 1.48 1.01 0.23 -2.12 120.40 120.93 1z8r s VAL 42 Ca -0.03 -0.83 0.11 0.00 0.00 0.00 0.00 61.98 61.23 1z8r s VAL 42 Cb 0.00 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.29 1z8r s VAL 42 CO -0.05 0.52 -0.17 -0.94 0.00 0.00 0.00 175.10 174.46 1z8r s SER 43 N 0.85 3.77 -0.02 3.32 1.04 -0.74 0.11 113.70 122.03 1z8r s SER 43 Ca -0.05 -0.86 -0.08 0.00 0.48 0.00 0.00 55.95 55.44 1z8r s SER 43 Cb -0.15 -0.42 -0.05 0.00 0.10 0.00 0.00 66.02 65.50 1z8r s SER 43 CO -0.01 0.07 0.27 0.42 0.98 0.00 0.00 173.24 174.96 1z8r s THR 44 N -2.11 5.30 0.26 2.02 -4.23 -1.12 0.21 115.64 115.96 1z8r s THR 44 Ca 0.27 0.30 0.02 0.00 -1.18 0.00 0.00 61.69 61.10 1z8r s THR 44 Cb -0.07 -3.55 -0.04 0.00 1.34 0.00 0.00 72.50 70.18 1z8r s THR 44 CO 0.14 0.46 0.15 0.28 -0.54 0.00 0.00 174.62 175.11 1z8r s THR 45 N -1.20 0.22 -0.24 3.99 -1.32 -0.73 -4.94 115.64 111.41 1z8r s THR 45 Ca 0.24 -2.00 0.11 0.00 -1.21 0.00 0.00 61.69 58.83 1z8r s THR 45 Cb -0.14 -2.53 0.45 0.00 -1.51 0.00 0.00 72.50 68.77 1z8r s THR 45 CO 0.13 0.00 1.19 0.35 -2.21 0.00 0.00 174.62 174.08 1z8r n THR 46 N -0.45 2.18 -3.16 5.08 -2.24 -1.26 -4.60 114.28 109.84 1z8r n THR 46 Ca 0.02 -3.61 0.00 0.00 -2.27 0.00 0.00 64.05 58.19 1z8r n THR 46 Cb 0.65 -0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 1z8r n THR 46 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1z8r n ALA 47 N -0.78 0.00 -2.84 6.98 0.00 -1.26 -5.13 120.51 117.48 1z8r n ALA 47 Ca 0.30 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.43 1z8r n ALA 47 Cb 0.87 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.26 1z8r n ALA 47 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1z8r s HIS 48 N 0.55 3.36 0.59 0.00 0.09 -1.26 -4.79 115.29 113.84 1z8r s HIS 48 Ca 0.00 0.21 -0.09 0.00 -0.00 0.00 0.00 55.06 55.17 1z8r s HIS 48 Cb 0.00 -1.73 0.15 0.00 -0.00 0.00 0.00 32.58 31.00 1z8r s HIS 48 CO 0.00 0.57 0.33 0.41 -0.00 0.00 0.00 174.74 176.05 1z8r n GLY 49 N 0.71 -3.28 1.19 -2.22 0.00 -1.26 -4.85 105.19 95.47 1z8r n GLY 49 Ca -0.09 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.30 2.33 -0.12 0.00 1.01 -1.26 -5.13 116.67 111.20 1z8r s ASP 51 Ca 0.00 -1.40 0.01 0.00 0.71 0.00 0.00 52.55 51.87 1z8r s ASP 51 Cb 0.00 -0.01 0.02 0.00 1.01 0.00 0.00 42.92 43.94 1z8r s ASP 51 CO 0.00 -0.65 -0.15 -0.89 0.21 0.00 0.00 175.17 173.70 1z8r s THR 52 N -3.32 1.51 0.28 -1.27 2.01 -1.26 -4.81 115.64 108.78 1z8r s THR 52 Ca 0.35 -0.63 -0.29 0.00 0.31 0.00 0.00 61.69 61.43 1z8r s THR 52 Cb 0.08 -1.40 -0.10 0.00 0.01 0.00 0.00 72.50 71.10 1z8r s THR 52 CO 0.15 0.44 1.15 -0.63 -0.69 0.00 0.00 174.62 175.05 1z8r s ILE 53 N 1.18 3.33 -0.20 1.82 1.01 -1.26 0.10 121.20 127.18 1z8r s ILE 53 Ca -0.02 1.32 -0.22 0.00 0.00 0.00 0.00 60.65 61.73 1z8r s ILE 53 Cb -0.14 -3.84 -0.02 0.00 0.01 0.00 0.00 42.46 38.47 1z8r s ILE 53 CO -0.05 0.31 0.68 0.00 0.00 0.00 0.00 174.94 175.88 1z8r s ALA 54 N -1.06 3.55 -0.33 9.38 0.00 0.13 -3.60 121.76 129.83 1z8r s ALA 54 Ca 0.46 -0.22 0.04 0.00 0.00 0.00 0.00 51.96 52.23 1z8r s ALA 54 Cb -0.34 -3.04 0.48 0.00 0.00 0.00 0.00 23.12 20.22 1z8r s ALA 54 CO 0.43 -0.62 1.62 -2.13 0.00 0.00 0.00 175.76 175.06 1z8r n ARG 55 N 5.21 2.08 -3.26 0.00 3.00 -1.26 -4.75 116.66 117.68 1z8r n ARG 55 Ca 0.00 -2.14 -0.18 0.00 -0.00 0.00 0.00 57.85 55.53 1z8r n ARG 55 Cb 0.49 -1.85 0.00 0.00 0.00 0.00 0.00 32.46 31.10 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 -1.74 1.67 -1.71 0.00 6.02 -1.26 -5.05 117.38 115.30 1z8r n GLN 57 Ca 0.03 -3.20 -0.43 0.00 -0.01 0.00 0.00 57.00 53.40 1z8r n GLN 57 Cb 0.58 -1.67 -0.03 0.00 1.02 0.00 0.00 30.24 30.14 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 3.45 0.00 -4.22 0.00 -1.04 -1.26 -4.71 114.28 106.49 1z8r n THR 59 Ca 0.15 -0.03 -0.27 0.00 -2.04 0.00 0.00 64.05 61.85 1z8r n THR 59 Cb 0.34 -0.36 -0.17 0.00 -1.82 0.00 0.00 70.33 68.33 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 -2.11 1.21 0.00 12.58 -4.23 -1.26 -2.03 115.64 119.81 1z8r s THR 60 Ca 0.43 -0.45 0.00 0.00 -1.18 0.00 0.00 61.69 60.49 1z8r s THR 60 Cb 0.22 -1.15 0.00 0.00 1.34 0.00 0.00 72.50 72.90 1z8r s THR 60 CO 0.39 0.39 0.00 0.61 -0.54 0.00 0.00 174.62 175.46 1z8r n GLY 61 N 4.45 3.90 2.81 3.99 0.00 -0.52 -4.85 105.19 114.96 1z8r n GLY 61 Ca -0.17 -1.57 -0.14 0.00 0.00 0.00 0.00 46.02 44.14 1z8r n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1z8r s VAL 62 N -2.04 -0.04 -0.08 1.61 0.11 -0.99 0.12 120.40 119.08 1z8r s VAL 62 Ca 0.00 0.16 0.05 0.00 -2.93 0.00 0.00 61.98 59.26 1z8r s VAL 62 Cb 0.00 -0.07 -0.00 0.00 -1.53 0.00 0.00 36.38 34.78 1z8r s VAL 62 CO 0.00 0.06 -0.24 -0.72 -3.33 0.00 0.00 175.10 170.87 1z8r s TYR 63 N 0.79 2.49 0.64 1.54 1.13 -0.96 -1.93 117.35 121.05 1z8r s TYR 63 Ca -0.07 -0.91 -0.14 0.00 -1.41 0.00 0.00 57.07 54.55 1z8r s TYR 63 Cb -0.09 -1.65 -0.01 0.00 -1.10 0.00 0.00 41.96 39.10 1z8r s TYR 63 CO -0.02 -0.34 1.06 0.12 -2.51 0.00 0.00 175.55 173.86 1z8r s PHE 64 N 0.15 2.97 -0.72 -3.49 2.19 -1.25 -2.30 117.98 115.52 1z8r s PHE 64 Ca -0.13 1.49 -0.04 0.00 0.33 0.00 0.00 56.93 58.58 1z8r s PHE 64 Cb -0.16 -2.98 -0.05 0.00 -1.31 0.00 0.00 43.02 38.52 1z8r s PHE 64 CO 0.07 -1.24 0.63 0.00 1.83 0.00 0.00 175.22 176.51 1z8r n ALA 66 N -2.64 0.93 0.00 0.00 0.00 -1.24 -4.47 120.51 113.10 1z8r n ALA 66 Ca -0.05 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.73 1z8r n ALA 66 Cb 0.58 -0.48 0.00 0.00 0.00 0.00 0.00 19.45 19.55 1z8r n ALA 66 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1z8r n SER 67 N -3.94 0.00 -0.81 0.00 2.88 -1.26 -4.74 113.62 105.75 1z8r n SER 67 Ca -0.36 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.17 1z8r n SER 67 Cb 0.88 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 64.33 1z8r n SER 67 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1z8r n LYS 68 N 0.00 0.05 -2.69 -1.46 3.00 -1.26 -4.97 118.16 110.82 1z8r n LYS 68 Ca 0.00 -0.19 -0.10 0.00 -0.00 0.00 0.00 58.31 58.02 1z8r n LYS 68 Cb 0.00 0.42 -0.01 0.00 0.00 0.00 0.00 35.03 35.44 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 -0.06 -2.54 -4.21 3.14 2.88 -1.26 -4.89 113.62 106.69 1z8r n SER 69 Ca -0.05 0.18 -0.17 0.00 -1.33 0.00 0.00 58.87 57.49 1z8r n SER 69 Cb 0.38 -2.21 -0.10 0.00 -0.75 0.00 0.00 64.21 61.52 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 -5.26 1.48 0.16 -1.46 1.02 -1.26 -4.85 119.74 109.57 1z8r s LYS 70 Ca 0.09 -1.82 -0.26 0.00 0.02 0.00 0.00 55.97 54.01 1z8r s LYS 70 Cb -0.05 -0.21 -0.08 0.00 -0.52 0.00 0.00 37.83 36.97 1z8r s LYS 70 CO 0.12 -0.35 0.82 -3.38 -0.92 0.00 0.00 175.35 171.63 1z8r s HIS 71 N -3.71 3.90 -0.19 3.18 -3.43 -1.26 -1.90 115.29 111.88 1z8r s HIS 71 Ca 0.37 1.68 0.00 0.00 -0.80 0.00 0.00 55.06 56.31 1z8r s HIS 71 Cb 0.07 -2.83 0.04 0.00 -1.43 0.00 0.00 32.58 28.43 1z8r s HIS 71 CO 0.15 0.46 -0.08 0.71 -2.00 0.00 0.00 174.74 173.98 1z8r s TYR 72 N -0.96 2.17 -0.06 0.38 1.51 -0.97 -4.98 117.35 114.43 1z8r s TYR 72 Ca 0.38 -1.43 -0.30 0.00 -1.01 0.00 0.00 57.07 54.71 1z8r s TYR 72 Cb -0.23 -1.52 -0.05 0.00 -0.11 0.00 0.00 41.96 40.04 1z8r s TYR 72 CO 0.27 -0.70 1.58 -2.14 -1.11 0.00 0.00 175.55 173.45 1z8r s PRO 73 N 1.48 4.20 -0.00 -1.71 0.02 -1.26 -2.27 135.00 135.45 1z8r s PRO 73 Ca -0.01 2.10 -0.01 0.00 0.02 0.00 0.00 61.00 63.11 1z8r s PRO 73 Cb -0.16 -3.92 -0.00 0.00 0.02 0.00 0.00 34.50 30.44 1z8r s PRO 73 CO -0.08 -0.81 0.01 0.08 -0.33 0.00 0.00 177.00 175.87 1z8r s VAL 74 N 3.82 0.02 -0.09 3.83 1.01 0.32 -4.95 120.40 124.36 1z8r s VAL 74 Ca 0.70 -0.16 -0.16 0.00 0.00 0.00 0.00 61.98 62.35 1z8r s VAL 74 Cb -0.32 -0.08 -0.05 0.00 0.00 0.00 0.00 36.38 35.94 1z8r s VAL 74 CO 0.27 -0.09 0.42 -0.94 0.00 0.00 0.00 175.10 174.77 1z8r s SER 75 N -0.26 6.68 0.18 3.32 1.04 -1.26 -1.44 113.70 121.96 1z8r s SER 75 Ca -0.03 0.81 0.01 0.00 0.48 0.00 0.00 55.95 57.22 1z8r s SER 75 Cb -0.02 -2.26 -0.05 0.00 0.10 0.00 0.00 66.02 63.80 1z8r s SER 75 CO -0.00 0.12 0.04 0.72 0.98 0.00 0.00 173.24 175.10 1z8r s PHE 76 N 0.06 1.20 0.24 5.02 -0.12 -0.86 -4.52 117.98 119.00 1z8r s PHE 76 Ca 0.24 -1.13 0.09 0.00 -0.05 0.00 0.00 56.93 56.08 1z8r s PHE 76 Cb -0.15 -0.68 -0.04 0.00 -0.63 0.00 0.00 43.02 41.52 1z8r s PHE 76 CO 0.10 -0.34 0.02 -2.00 -0.05 0.00 0.00 175.22 172.95 1z8r s GLU 77 N -3.99 2.38 -0.95 1.99 2.56 -0.92 -4.73 118.70 115.04 1z8r s GLU 77 Ca 0.28 -1.29 -0.01 0.00 0.00 0.00 0.00 54.97 53.95 1z8r s GLU 77 Cb 0.07 -2.26 0.30 0.00 2.00 0.00 0.00 34.13 34.24 1z8r s GLU 77 CO 0.06 0.39 1.38 0.41 -0.56 0.00 0.00 175.26 176.94 1z8r n GLY 78 N -0.70 5.33 3.74 -1.50 0.00 -1.26 -2.28 105.19 108.51 1z8r n GLY 78 Ca -0.08 -2.68 -0.41 0.00 0.00 0.00 0.00 46.02 42.85 1z8r n GLY 78 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1z8r s PRO 79 N -3.08 4.33 0.00 1.61 0.04 -1.08 -4.87 135.00 131.95 1z8r s PRO 79 Ca 0.35 2.17 0.00 0.00 0.04 0.00 0.00 61.00 63.56 1z8r s PRO 79 Cb 0.11 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.49 1z8r s PRO 79 CO 0.03 -0.34 0.34 0.41 0.04 0.00 0.00 177.00 177.47 1z8r n GLY 80 N 2.40 -2.73 3.47 0.56 0.00 -1.26 -2.40 105.19 105.23 1z8r n GLY 80 Ca 0.07 0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.85 3.54 -0.16 0.99 1.98 -1.26 0.12 118.68 123.04 1z8r s LEU 81 Ca 0.00 -0.17 0.01 0.00 -2.89 0.00 0.00 54.13 51.09 1z8r s LEU 81 Cb 0.00 -1.96 0.02 0.00 0.66 0.00 0.00 46.19 44.91 1z8r s LEU 81 CO 0.00 -0.03 -0.19 -0.69 -1.89 0.00 0.00 176.35 173.54 1z8r s VAL 82 N 1.62 1.94 -0.48 1.68 1.01 -0.24 -4.93 120.40 121.00 1z8r s VAL 82 Ca 0.06 -0.88 -0.28 0.00 0.00 0.00 0.00 61.98 60.88 1z8r s VAL 82 Cb -0.15 -1.75 0.01 0.00 0.00 0.00 0.00 36.38 34.49 1z8r s VAL 82 CO 0.05 0.52 1.37 -1.83 0.00 0.00 0.00 175.10 175.21 1z8r s GLU 83 N 1.13 3.49 -0.06 2.72 -1.05 -1.26 -0.93 118.70 122.74 1z8r s GLU 83 Ca -0.00 0.68 -0.30 0.00 -0.15 0.00 0.00 54.97 55.20 1z8r s GLU 83 Cb -0.14 -4.05 -0.04 0.00 -0.44 0.00 0.00 34.13 29.47 1z8r s GLU 83 CO -0.08 -1.69 1.28 0.14 0.95 0.00 0.00 175.26 175.86 1z8r s VAL 84 N 5.53 4.09 0.55 1.83 -7.23 0.26 -4.90 120.40 120.53 1z8r s VAL 84 Ca 0.55 1.41 -0.19 0.00 -1.81 0.00 0.00 61.98 61.94 1z8r s VAL 84 Cb -0.11 -3.91 -0.06 0.00 0.56 0.00 0.00 36.38 32.86 1z8r s VAL 84 CO 0.30 -0.03 1.13 0.00 -0.31 0.00 0.00 175.10 176.19 1z8r s GLN 85 N 2.55 3.33 -0.53 4.82 -2.07 -1.26 -1.79 119.66 124.71 1z8r s GLN 85 Ca 0.58 1.62 -0.27 0.00 -1.82 0.00 0.00 55.36 55.47 1z8r s GLN 85 Cb -0.26 -2.00 -0.03 0.00 -1.09 0.00 0.00 33.01 29.63 1z8r s GLN 85 CO 0.22 -0.87 1.93 -2.00 -1.32 0.00 0.00 175.29 173.25 1z8r s GLU 86 N -3.30 2.70 0.07 9.60 2.12 -1.25 -4.58 118.70 124.06 1z8r s GLU 86 Ca 0.73 0.90 -0.05 0.00 0.36 0.00 0.00 54.97 56.91 1z8r s GLU 86 Cb -0.24 -4.38 -0.02 0.00 0.26 0.00 0.00 34.13 29.76 1z8r s GLU 86 CO 0.27 -2.62 0.10 0.45 -0.54 0.00 0.00 175.26 172.92 1z8r s SER 87 N 8.25 0.27 0.00 -1.70 0.15 -0.77 -4.91 113.70 114.99 1z8r s SER 87 Ca 0.74 -0.80 0.00 0.00 0.70 0.00 0.00 55.95 56.59 1z8r s SER 87 Cb -0.15 0.28 0.00 0.00 -1.71 0.00 0.00 66.02 64.44 1z8r s SER 87 CO 0.24 -0.68 0.00 1.21 1.20 0.00 0.00 173.24 175.21 1z8r n GLU 88 N 0.01 0.00 -0.87 5.44 2.13 -1.26 -0.62 120.64 125.46 1z8r n GLU 88 Ca -0.14 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.65 1z8r n GLU 88 Cb 0.62 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.30 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 -4.49 4.31 0.18 -1.26 -5.10 117.16 110.80 1z8r n TYR 89 Ca 0.00 -0.31 -0.31 0.00 1.88 0.00 0.00 57.90 59.16 1z8r n TYR 89 Cb 0.00 0.29 -0.17 0.00 -0.38 0.00 0.00 39.34 39.09 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 2.36 0.44 -3.48 6.14 0.21 -5.13 117.35 117.89 1z8r s TYR 90 Ca 0.04 -1.19 -0.22 0.00 0.64 0.00 0.00 57.07 56.35 1z8r s TYR 90 Cb 0.05 -1.65 -0.09 0.00 0.42 0.00 0.00 41.96 40.69 1z8r s TYR 90 CO -0.02 -0.58 1.02 -1.25 0.64 0.00 0.00 175.55 175.35 1z8r s PRO 91 N 0.98 4.04 -0.90 4.97 0.04 -1.26 -1.85 135.00 141.02 1z8r s PRO 91 Ca -0.05 1.34 -0.14 0.00 0.04 0.00 0.00 61.00 62.20 1z8r s PRO 91 Cb -0.15 -2.27 -0.27 0.00 0.04 0.00 0.00 34.50 31.86 1z8r s PRO 91 CO -0.03 -0.23 2.18 1.63 0.04 0.00 0.00 177.00 180.59 1z8r n LYS 92 N -0.57 0.17 -4.60 4.56 4.76 -1.25 -4.65 118.16 116.57 1z8r n LYS 92 Ca 0.07 -0.28 -0.28 0.00 -2.87 0.00 0.00 58.31 54.95 1z8r n LYS 92 Cb 0.52 -1.85 -0.09 0.00 -1.84 0.00 0.00 35.03 31.77 1z8r n LYS 92 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1z8r s ARG 93 N 7.52 1.96 -0.18 1.97 1.81 -0.74 -4.94 118.95 126.35 1z8r s ARG 93 Ca 1.14 -2.17 -0.09 0.00 -1.72 0.00 0.00 55.73 52.89 1z8r s ARG 93 Cb -0.59 -1.21 -0.05 0.00 -0.45 0.00 0.00 34.95 32.66 1z8r s ARG 93 CO 0.40 -0.27 0.13 0.71 -0.68 0.00 0.00 175.30 175.58 1z8r s TYR 94 N -3.00 3.45 -0.21 -0.53 1.51 -1.26 0.92 117.35 118.22 1z8r s TYR 94 Ca 0.24 0.37 0.01 0.00 -1.01 0.00 0.00 57.07 56.68 1z8r s TYR 94 Cb 0.05 -2.10 0.03 0.00 -0.11 0.00 0.00 41.96 39.84 1z8r s TYR 94 CO 0.12 0.40 -0.15 -0.65 -1.11 0.00 0.00 175.55 174.17 1z8r s GLN 95 N -0.00 2.78 0.30 -0.62 -1.52 -0.11 -4.50 119.66 115.99 1z8r s GLN 95 Ca 0.10 -0.98 -0.21 0.00 -1.95 0.00 0.00 55.36 52.31 1z8r s GLN 95 Cb -0.11 -2.74 -0.09 0.00 -0.22 0.00 0.00 33.01 29.84 1z8r s GLN 95 CO -0.00 -0.34 0.83 0.45 -0.25 0.00 0.00 175.29 175.98 1z8r s SER 96 N 1.25 7.09 -0.93 5.90 0.15 -0.70 -1.07 113.70 125.39 1z8r s SER 96 Ca 0.01 1.57 -0.08 0.00 0.70 0.00 0.00 55.95 58.14 1z8r s SER 96 Cb -0.15 -2.48 -0.01 0.00 -1.71 0.00 0.00 66.02 61.67 1z8r s SER 96 CO -0.09 -0.09 0.73 1.57 1.20 0.00 0.00 173.24 176.56 1z8r n HIS 97 N 0.32 -2.36 -4.92 3.44 -0.00 0.31 -4.34 115.22 107.67 1z8r n HIS 97 Ca 0.01 0.81 -0.27 0.00 -0.00 0.00 0.00 57.72 58.27 1z8r n HIS 97 Cb 0.51 -3.59 -0.15 0.00 -0.00 0.00 0.00 29.99 26.77 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 -3.20 1.72 -0.07 3.57 0.11 -1.01 -2.37 120.40 119.16 1z8r s VAL 98 Ca 0.21 -1.04 -0.04 0.00 -2.93 0.00 0.00 61.98 58.19 1z8r s VAL 98 Cb -0.06 -1.45 -0.04 0.00 -1.53 0.00 0.00 36.38 33.30 1z8r s VAL 98 CO 0.82 0.39 0.11 -0.76 -3.33 0.00 0.00 175.10 172.33 1z8r s LEU 99 N -0.76 4.14 0.01 2.54 1.02 0.23 -2.63 118.68 123.23 1z8r s LEU 99 Ca 0.08 0.32 0.03 0.00 0.02 0.00 0.00 54.13 54.58 1z8r s LEU 99 Cb -0.09 -2.19 -0.01 0.00 0.02 0.00 0.00 46.19 43.93 1z8r s LEU 99 CO 0.00 0.34 -0.09 -0.76 0.02 0.00 0.00 176.35 175.86 1z8r s LEU 100 N -1.35 2.07 -0.08 1.79 1.43 -0.96 0.18 118.68 121.75 1z8r s LEU 100 Ca 0.19 -0.25 -0.17 0.00 -1.03 0.00 0.00 54.13 52.87 1z8r s LEU 100 Cb -0.12 -0.44 0.04 0.00 0.03 0.00 0.00 46.19 45.70 1z8r s LEU 100 CO 0.09 0.06 0.42 0.00 0.23 0.00 0.00 176.35 177.15 1z8r s ALA 101 N -0.44 -1.05 -0.21 4.21 0.00 -0.83 -2.17 121.76 121.28 1z8r s ALA 101 Ca 0.02 0.83 -0.10 0.00 0.00 0.00 0.00 51.96 52.71 1z8r s ALA 101 Cb -0.05 -0.25 -0.05 0.00 0.00 0.00 0.00 23.12 22.78 1z8r s ALA 101 CO 0.00 -0.26 0.14 -0.08 0.00 0.00 0.00 175.76 175.56 1z8r s THR 102 N -0.70 5.40 0.00 0.00 -1.32 -1.26 0.21 115.64 117.98 1z8r s THR 102 Ca -0.08 0.20 0.00 0.00 -1.21 0.00 0.00 61.69 60.60 1z8r s THR 102 Cb -0.04 -3.48 0.00 0.00 -1.51 0.00 0.00 72.50 67.48 1z8r s THR 102 CO 0.04 0.43 0.00 0.61 -2.21 0.00 0.00 174.62 173.48 1z8r n GLY 103 N 3.63 0.96 1.31 6.08 0.00 -0.88 -4.94 105.19 111.34 1z8r n GLY 103 Ca -0.16 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.25 1.61 3.01 -1.26 -5.04 117.46 113.52 1z8r n PHE 104 Ca 0.00 -0.51 0.00 0.00 1.01 0.00 0.00 57.45 57.95 1z8r n PHE 104 Cb 0.00 0.12 0.00 0.00 -0.01 0.00 0.00 39.48 39.59 1z8r n PHE 104 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1z8r n SER 105 N 0.29 0.00 0.11 4.37 7.64 -1.26 -5.09 113.62 119.67 1z8r n SER 105 Ca -0.08 -0.36 0.00 0.00 1.01 0.00 0.00 58.87 59.44 1z8r n SER 105 Cb 0.97 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.17 1z8r n SER 105 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1z8r n GLU 106 N -0.36 0.00 -0.10 1.43 1.02 -1.25 -4.65 120.64 116.72 1z8r n GLU 106 Ca 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 57.00 1z8r n GLU 106 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.39 1z8r n GLU 106 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1z8r h PRO 107 N 0.00 0.85 0.00 3.49 0.13 -1.90 -3.42 132.00 131.15 1z8r h PRO 107 Ca 0.00 -0.47 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1z8r h PRO 107 Cb 0.00 0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.16 1z8r h PRO 107 CO 0.00 1.11 0.00 0.41 -0.23 0.00 0.00 178.00 179.29 1z8r n GLY 108 N 0.19 0.43 0.04 1.56 0.00 -1.26 -5.02 105.19 101.13 1z8r n GLY 108 Ca -0.03 -1.41 -0.05 0.00 0.00 0.00 0.00 46.02 44.53 1z8r n GLY 108 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1z8r n ASP 109 N -0.28 3.36 -1.38 1.61 -0.08 -1.26 -5.13 116.55 113.38 1z8r n ASP 109 Ca 0.00 -0.03 0.18 0.00 -1.51 0.00 0.00 54.79 53.43 1z8r n ASP 109 Cb 0.00 0.12 -0.06 0.00 2.34 0.00 0.00 41.12 43.52 1z8r n ASP 109 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1z8r n ALA 110 N -2.58 -3.59 -0.55 -1.67 0.00 -1.26 -5.06 120.51 105.80 1z8r n ALA 110 Ca -0.14 0.61 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1z8r n ALA 110 Cb 0.68 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.78 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 -4.20 -1.08 0.00 0.00 0.00 -1.26 -4.98 105.19 93.67 1z8r n GLY 111 Ca -0.02 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.23 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 1.32 4.48 3.65 -0.02 0.00 -1.26 -4.52 105.19 108.84 1z8r n GLY 112 Ca 0.00 -1.42 -0.32 0.00 0.00 0.00 0.00 46.02 44.28 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 -2.00 3.92 -0.31 -0.61 -4.36 -1.26 -1.52 121.20 115.06 1z8r s ILE 113 Ca 0.00 -0.76 -0.22 0.00 -0.26 0.00 0.00 60.65 59.41 1z8r s ILE 113 Cb 0.00 -2.76 -0.00 0.00 1.25 0.00 0.00 42.46 40.95 1z8r s ILE 113 CO 0.00 0.33 0.74 -0.22 0.24 0.00 0.00 174.94 176.03 1z8r s LEU 114 N -1.67 4.11 0.06 0.37 2.96 0.19 -3.95 118.68 120.76 1z8r s LEU 114 Ca 0.20 0.57 0.09 0.00 -0.22 0.00 0.00 54.13 54.77 1z8r s LEU 114 Cb -0.11 -2.99 -0.03 0.00 0.50 0.00 0.00 46.19 43.55 1z8r s LEU 114 CO 0.11 -0.58 -0.23 -0.13 -1.32 0.00 0.00 176.35 174.19 1z8r s ARG 115 N 2.86 1.83 0.34 1.98 0.52 -0.81 0.12 118.95 125.79 1z8r s ARG 115 Ca 0.30 -1.11 0.08 0.00 -0.52 0.00 0.00 55.73 54.48 1z8r s ARG 115 Cb -0.14 -2.04 -0.03 0.00 0.52 0.00 0.00 34.95 33.25 1z8r s ARG 115 CO 0.13 0.51 0.25 0.00 0.02 0.00 0.00 175.30 176.20 1z8r h GLU 117 N 1.34 0.00 0.05 0.00 5.08 -1.98 -0.38 114.58 118.70 1z8r h GLU 117 Ca -0.44 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 57.56 1z8r h GLU 117 Cb 1.25 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.46 1z8r h GLU 117 CO 0.60 0.00 -2.08 0.72 -1.00 0.00 0.00 179.01 177.25 1z8r n HIS 118 N -2.56 0.77 0.00 4.33 8.25 -1.26 -5.08 115.22 119.68 1z8r n HIS 118 Ca -0.02 0.20 0.00 0.00 -0.26 0.00 0.00 57.72 57.64 1z8r n HIS 118 Cb 0.23 -1.11 0.00 0.00 1.12 0.00 0.00 29.99 30.22 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 1.91 -0.91 3.68 -1.41 0.00 -0.15 -4.65 105.19 103.66 1z8r n GLY 119 Ca -0.31 0.14 -0.35 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.77 4.60 -0.19 1.61 1.01 0.28 0.11 120.40 125.05 1z8r s VAL 120 Ca 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 61.98 61.83 1z8r s VAL 120 Cb 0.00 -2.99 -0.21 0.00 0.00 0.00 0.00 36.38 33.17 1z8r s VAL 120 CO 0.00 0.56 0.05 -0.38 0.00 0.00 0.00 175.10 175.32 1z8r n ILE 121 N 2.63 1.63 -2.64 2.22 -0.00 0.33 0.20 119.36 123.73 1z8r n ILE 121 Ca -0.18 -0.61 0.00 0.00 -0.00 0.00 0.00 62.75 61.96 1z8r n ILE 121 Cb 0.53 -1.57 0.00 0.00 -0.00 0.00 0.00 39.64 38.60 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 2.13 -0.51 3.60 7.39 0.00 -0.95 0.95 105.19 117.81 1z8r n GLY 122 Ca -0.39 -0.96 -0.25 0.00 0.00 0.00 0.00 46.02 44.42 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 0.15 0.99 2.34 -0.67 -0.63 118.68 123.78 1z8r s LEU 123 Ca 0.00 -1.00 -0.31 0.00 0.06 0.00 0.00 54.13 52.88 1z8r s LEU 123 Cb 0.00 -1.30 -0.09 0.00 -0.56 0.00 0.00 46.19 44.24 1z8r s LEU 123 CO 0.00 -0.19 1.39 0.54 -1.06 0.00 0.00 176.35 177.03 1z8r s VAL 124 N -2.52 3.15 0.00 1.48 0.11 -0.57 0.11 120.40 122.15 1z8r s VAL 124 Ca 0.34 0.86 0.00 0.00 -2.93 0.00 0.00 61.98 60.25 1z8r s VAL 124 Cb -0.01 -3.55 0.00 0.00 -1.53 0.00 0.00 36.38 31.29 1z8r s VAL 124 CO 0.19 0.09 0.00 0.41 -3.33 0.00 0.00 175.10 172.46 1z8r n THR 125 N 3.45 0.00 -4.28 5.04 -1.04 0.14 -4.68 114.28 112.92 1z8r n THR 125 Ca 0.10 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.96 1z8r n THR 125 Cb 0.42 -0.55 -0.10 0.00 -1.82 0.00 0.00 70.33 68.28 1z8r n THR 125 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 1z8r s MET 126 N 0.00 1.16 0.06 -2.82 -1.94 -0.97 -4.97 119.30 109.82 1z8r s MET 126 Ca 0.00 -1.53 0.04 0.00 -1.71 0.00 0.00 55.69 52.48 1z8r s MET 126 Cb 0.00 -0.62 -0.03 0.00 2.01 0.00 0.00 34.83 36.19 1z8r s MET 126 CO 0.00 0.01 -0.11 0.20 -0.01 0.00 0.00 175.02 175.12 1z8r s GLY 127 N -3.22 0.70 0.00 -0.03 0.00 -1.26 0.12 107.32 103.63 1z8r s GLY 127 Ca 0.21 -0.93 0.00 0.00 0.00 0.00 0.00 44.72 44.00 1z8r s GLY 127 CO 0.04 -0.97 0.00 0.61 0.00 0.00 0.00 173.10 172.77 1z8r n GLY 128 N 1.24 2.73 0.26 0.20 0.00 -0.84 -4.89 105.19 103.89 1z8r n GLY 128 Ca -0.21 -1.93 0.16 0.00 0.00 0.00 0.00 46.02 44.04 1z8r n GLY 128 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1z8r h GLU 129 N 0.00 0.00 0.00 1.61 -0.00 -1.97 -3.38 114.58 110.84 1z8r h GLU 129 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1z8r h GLU 129 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 1z8r h GLU 129 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 179.01 179.42 1z8r n GLY 130 N 0.22 0.80 3.44 1.06 0.00 -1.26 -3.94 105.19 105.51 1z8r n GLY 130 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 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 2.39 -0.22 1.61 1.01 -1.26 -2.07 120.40 121.86 1z8r s VAL 131 Ca 0.00 -2.22 -0.01 0.00 0.00 0.00 0.00 61.98 59.74 1z8r s VAL 131 Cb 0.00 -2.20 0.01 0.00 0.00 0.00 0.00 36.38 34.19 1z8r s VAL 131 CO 0.00 -0.27 -0.10 0.68 0.00 0.00 0.00 175.10 175.40 1z8r s VAL 132 N -2.13 2.75 -0.25 2.92 -7.23 0.57 -1.98 120.40 115.05 1z8r s VAL 132 Ca 0.25 -0.83 -0.11 0.00 -1.81 0.00 0.00 61.98 59.49 1z8r s VAL 132 Cb -0.06 -2.27 -0.05 0.00 0.56 0.00 0.00 36.38 34.56 1z8r s VAL 132 CO 0.12 0.39 0.17 -0.83 -0.31 0.00 0.00 175.10 174.64 1z8r s GLY 133 N 1.36 1.96 -0.01 2.32 0.00 0.33 -1.96 107.32 111.31 1z8r s GLY 133 Ca 0.04 -0.96 0.06 0.00 0.00 0.00 0.00 44.72 43.85 1z8r s GLY 133 CO -0.07 0.48 -0.20 -1.36 0.00 0.00 0.00 173.10 171.96 1z8r s PHE 134 N 1.31 1.77 -0.36 1.90 0.08 0.13 0.25 117.98 123.05 1z8r s PHE 134 Ca 0.07 -0.33 -0.22 0.00 0.12 0.00 0.00 56.93 56.57 1z8r s PHE 134 Cb -0.14 -1.14 0.01 0.00 -0.57 0.00 0.00 43.02 41.18 1z8r s PHE 134 CO 0.07 -0.03 0.73 0.00 -0.10 0.00 0.00 175.22 175.89 1z8r s ALA 135 N -0.47 3.44 0.43 5.36 0.00 0.29 0.75 121.76 131.56 1z8r s ALA 135 Ca 0.08 -0.74 -0.23 0.00 0.00 0.00 0.00 51.96 51.06 1z8r s ALA 135 Cb -0.08 -3.29 -0.08 0.00 0.00 0.00 0.00 23.12 19.67 1z8r s ALA 135 CO -0.01 -1.44 1.09 0.34 0.00 0.00 0.00 175.76 175.74 1z8r s ASP 136 N 1.83 6.49 0.00 0.00 -1.08 -1.00 -1.68 116.67 121.24 1z8r s ASP 136 Ca 0.29 2.13 0.18 0.00 -0.52 0.00 0.00 52.55 54.62 1z8r s ASP 136 Cb -0.14 -2.59 0.35 0.00 -1.46 0.00 0.00 42.92 39.08 1z8r s ASP 136 CO 0.16 -0.68 1.27 0.52 0.52 0.00 0.00 175.17 176.96 1z8r n VAL 137 N -0.32 0.59 0.82 1.11 0.31 0.27 -4.39 118.33 116.72 1z8r n VAL 137 Ca 0.06 -0.79 0.09 0.00 -0.01 0.00 0.00 64.34 63.69 1z8r n VAL 137 Cb 0.49 0.86 0.45 0.00 -0.91 0.00 0.00 33.84 34.73 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 1.09 0.21 -0.20 5.55 1.74 -1.26 -2.30 116.66 121.49 1z8r n ARG 138 Ca 0.15 0.13 0.10 0.00 -0.77 0.00 0.00 57.85 57.46 1z8r n ARG 138 Cb 0.50 -1.50 0.26 0.00 -1.02 0.00 0.00 32.46 30.71 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 -1.33 2.73 -2.69 0.55 2.03 -1.26 -4.44 116.55 112.14 1z8r n ASP 139 Ca 0.08 -1.93 -0.06 0.00 0.52 0.00 0.00 54.79 53.40 1z8r n ASP 139 Cb 0.16 -0.27 0.10 0.00 -0.72 0.00 0.00 41.12 40.39 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 1.00 -1.70 0.12 -2.67 -0.00 -0.97 -5.00 117.00 107.79 1z8r n LEU 140 Ca 0.18 -2.65 0.12 0.00 -0.00 0.00 0.00 56.01 53.67 1z8r n LEU 140 Cb 0.46 0.96 0.46 0.00 -0.00 0.00 0.00 43.42 45.30 1z8r n LEU 140 CO 0.13 1.79 0.87 -0.11 -0.00 0.00 0.00 177.39 180.08 1z8r n LEU 141 N 0.41 0.76 -4.44 1.47 -0.00 -1.19 -4.66 117.00 109.34 1z8r n LEU 141 Ca -0.01 0.63 -0.11 0.00 -0.00 0.00 0.00 56.01 56.52 1z8r n LEU 141 Cb 0.73 -0.47 -0.09 0.00 -0.00 0.00 0.00 43.42 43.59 1z8r n LEU 141 CO -0.04 -0.42 1.10 -2.67 -0.00 0.00 0.00 177.39 175.37 1z8r n TRP 142 N -2.28 0.69 0.00 1.96 4.27 -1.26 -3.51 117.44 117.32 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 0.31 -2.06 0.00 0.00 -1.36 0.00 0.00 31.31 28.20 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 15.90 0.00 0.00 5.67 4.32 -1.26 -4.99 117.00 136.64 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 0.18 -0.00 0.00 -1.62 0.00 0.00 43.42 42.44 1z8r n LEU 143 CO 0.58 -0.36 0.00 -0.62 -1.22 0.00 0.00 177.39 175.77 1z8r n GLU 144 N -2.22 0.00 -1.76 3.23 -0.58 -1.23 -4.54 120.64 113.54 1z8r n GLU 144 Ca 0.00 -0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.32 1z8r n GLU 144 Cb 0.00 0.00 -0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1z8r n GLU 144 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1z8r n ASP 145 N -1.59 3.60 -4.91 1.62 2.03 -1.26 -5.00 116.55 111.04 1z8r n ASP 145 Ca -0.00 1.22 -0.29 0.00 0.52 0.00 0.00 54.79 56.24 1z8r n ASP 145 Cb 0.00 -1.59 -0.03 0.00 -0.72 0.00 0.00 41.12 38.77 1z8r n ASP 145 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1z8r s ASP 146 N -0.14 6.45 0.42 1.67 1.11 -1.26 -4.69 116.67 120.22 1z8r s ASP 146 Ca 0.54 0.67 -0.22 0.00 0.18 0.00 0.00 52.55 53.73 1z8r s ASP 146 Cb -0.50 -2.13 -0.10 0.00 1.07 0.00 0.00 42.92 41.27 1z8r s ASP 146 CO 0.63 -0.16 0.97 0.00 1.18 0.00 0.00 175.17 177.79 1z8r s ALA 147 N -2.02 3.04 0.00 5.23 0.00 -1.24 -4.81 121.76 121.96 1z8r s ALA 147 Ca 0.43 0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.85 1z8r s ALA 147 Cb -0.11 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.84 1z8r s ALA 147 CO 0.29 0.06 0.00 0.00 0.00 0.00 0.00 175.76 176.11 1z8r n MET 148 N -0.49 0.00 -1.26 0.00 0.00 -1.26 -3.99 117.12 110.12 1z8r n MET 148 Ca 0.07 0.00 0.03 0.00 0.00 0.00 0.00 57.70 57.80 1z8r n MET 148 Cb 0.53 0.00 0.09 0.00 0.00 0.00 0.00 33.22 33.84 1z8r n MET 148 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 1z8r n GLU 149 N -0.45 0.87 0.00 3.17 2.13 -1.26 -5.14 120.64 119.96 1z8r n GLU 149 Ca 0.00 -2.69 0.14 0.00 0.66 0.00 0.00 57.16 55.28 1z8r n GLU 149 Cb 0.00 -0.81 0.62 0.00 0.27 0.00 0.00 31.44 31.51 1z8r n GLU 149 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76