#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z8r n PRO 2 N 0.00 -0.86 -3.02 1.61 -0.02 -1.26 -4.92 135.00 126.53 1z8r n PRO 2 Ca 0.00 -0.22 -0.41 0.00 -2.02 0.00 0.00 63.50 60.85 1z8r n PRO 2 Cb 0.00 -1.78 -0.06 0.00 -0.02 0.00 0.00 33.50 31.64 1z8r n PRO 2 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1z8r s TYR 3 N -2.32 3.28 0.00 6.00 2.02 -1.26 -4.85 117.35 120.21 1z8r s TYR 3 Ca 0.56 0.90 0.00 0.00 -0.37 0.00 0.00 57.07 58.16 1z8r s TYR 3 Cb -0.17 -2.96 0.00 0.00 -0.40 0.00 0.00 41.96 38.43 1z8r s TYR 3 CO 0.67 -0.39 0.00 0.41 -1.57 0.00 0.00 175.55 174.67 1z8r n GLY 4 N 4.05 -0.24 3.89 0.71 0.00 -1.26 -5.14 105.19 107.21 1z8r n GLY 4 Ca 0.02 -0.45 -0.23 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.27 2.22 -0.30 1.61 2.46 -1.26 -5.13 115.29 113.61 1z8r s HIS 5 Ca 0.00 -0.64 -0.07 0.00 0.47 0.00 0.00 55.06 54.82 1z8r s HIS 5 Cb 0.00 -2.08 0.18 0.00 -0.13 0.00 0.00 32.58 30.55 1z8r s HIS 5 CO 0.00 -0.32 0.79 -1.14 -2.47 0.00 0.00 174.74 171.60 1z8r s GLN 6 N -4.22 0.41 0.25 2.88 0.74 -1.26 -5.04 119.66 113.43 1z8r s GLN 6 Ca 0.44 0.79 -0.17 0.00 0.05 0.00 0.00 55.36 56.46 1z8r s GLN 6 Cb -0.03 0.44 0.01 0.00 1.10 0.00 0.00 33.01 34.54 1z8r s GLN 6 CO 0.26 -0.40 0.59 -1.54 -0.55 0.00 0.00 175.29 173.66 1z8r s SER 7 N 2.86 -0.20 0.00 6.67 1.04 -1.26 -5.07 113.70 117.73 1z8r s SER 7 Ca 0.09 -0.70 0.00 0.00 0.48 0.00 0.00 55.95 55.82 1z8r s SER 7 Cb -0.12 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.64 1z8r s SER 7 CO -0.17 -1.22 0.84 0.61 0.98 0.00 0.00 173.24 174.29 1z8r n GLY 8 N -0.41 0.60 3.48 7.32 0.00 -1.26 -4.64 105.19 110.28 1z8r n GLY 8 Ca -0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.73 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 0.00 0.74 -3.83 4.61 0.00 -1.26 -4.65 120.51 116.12 1z8r n ALA 9 Ca -0.20 -2.04 -0.29 0.00 0.00 0.00 0.00 53.44 50.91 1z8r n ALA 9 Cb 0.63 0.87 -0.16 0.00 0.00 0.00 0.00 19.45 20.79 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 -2.52 1.01 -0.33 0.00 1.01 -0.96 -4.82 120.40 113.78 1z8r s VAL 10 Ca 0.26 -0.88 -0.16 0.00 0.00 0.00 0.00 61.98 61.20 1z8r s VAL 10 Cb -0.02 -1.40 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 1z8r s VAL 10 CO 0.17 -0.16 0.41 -0.47 0.00 0.00 0.00 175.10 175.04 1z8r s TYR 11 N 1.63 3.21 -0.26 5.22 6.14 -1.26 -1.56 117.35 130.47 1z8r s TYR 11 Ca -0.03 0.12 0.03 0.00 0.64 0.00 0.00 57.07 57.82 1z8r s TYR 11 Cb -0.18 -2.72 0.06 0.00 0.42 0.00 0.00 41.96 39.54 1z8r s TYR 11 CO -0.07 -0.42 -0.08 0.08 0.64 0.00 0.00 175.55 175.69 1z8r s VAL 12 N 2.13 2.08 0.00 3.14 1.01 0.80 -4.05 120.40 125.51 1z8r s VAL 12 Ca 0.14 -1.65 0.00 0.00 0.00 0.00 0.00 61.98 60.48 1z8r s VAL 12 Cb -0.16 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 33.98 1z8r s VAL 12 CO 0.12 -0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.73 1z8r n GLY 13 N 4.45 3.24 0.84 4.51 0.00 -1.26 -0.27 105.19 116.71 1z8r n GLY 13 Ca -0.12 0.07 0.04 0.00 0.00 0.00 0.00 46.02 46.01 1z8r n GLY 13 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1z8r n ASN 14 N 4.29 2.39 -4.15 1.61 4.13 -1.26 -4.57 115.26 117.70 1z8r n ASN 14 Ca 0.00 -2.18 -0.19 0.00 1.68 0.00 0.00 54.58 53.88 1z8r n ASN 14 Cb 0.00 -0.38 -0.13 0.00 -1.54 0.00 0.00 39.78 37.73 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 -1.66 1.21 -0.12 3.10 2.02 0.63 -1.88 117.35 120.65 1z8r s TYR 15 Ca 0.24 -0.38 -0.03 0.00 -0.37 0.00 0.00 57.07 56.53 1z8r s TYR 15 Cb 0.15 -0.71 0.04 0.00 -0.40 0.00 0.00 41.96 41.05 1z8r s TYR 15 CO 0.12 0.04 0.05 0.21 -1.57 0.00 0.00 175.55 174.40 1z8r s LYS 16 N -1.30 0.30 -0.27 -0.62 2.20 0.10 -0.14 119.74 120.00 1z8r s LYS 16 Ca 0.00 0.00 -0.11 0.00 -0.36 0.00 0.00 55.97 55.50 1z8r s LYS 16 Cb -0.08 -1.36 -0.05 0.00 -1.51 0.00 0.00 37.83 34.83 1z8r s LYS 16 CO 0.01 -0.49 0.21 0.14 -0.36 0.00 0.00 175.35 174.87 1z8r s VAL 17 N 2.04 5.30 0.10 4.02 -7.23 -0.60 -1.66 120.40 122.38 1z8r s VAL 17 Ca 0.03 0.24 0.01 0.00 -1.81 0.00 0.00 61.98 60.45 1z8r s VAL 17 Cb -0.14 -3.55 -0.04 0.00 0.56 0.00 0.00 36.38 33.21 1z8r s VAL 17 CO -0.06 0.26 -0.04 0.54 -0.31 0.00 0.00 175.10 175.49 1z8r s VAL 18 N 1.59 0.56 0.41 1.32 0.11 -0.90 -2.28 120.40 121.22 1z8r s VAL 18 Ca 0.09 -1.92 -0.27 0.00 -2.93 0.00 0.00 61.98 56.95 1z8r s VAL 18 Cb -0.15 -1.75 -0.10 0.00 -1.53 0.00 0.00 36.38 32.85 1z8r s VAL 18 CO 0.09 -0.80 1.47 -3.20 -3.33 0.00 0.00 175.10 169.32 1z8r n ASN 19 N -0.05 3.60 -0.13 3.54 2.85 -1.26 -2.33 115.26 121.48 1z8r n ASN 19 Ca -0.11 1.18 -0.05 0.00 -0.11 0.00 0.00 54.58 55.49 1z8r n ASN 19 Cb 0.61 -1.62 0.03 0.00 1.24 0.00 0.00 39.78 40.05 1z8r n ASN 19 CO 0.00 0.00 0.00 0.03 -2.11 0.00 0.00 177.26 175.18 1z8r h ARG 20 N 2.65 0.32 0.00 1.20 3.08 -0.18 0.24 114.38 121.69 1z8r h ARG 20 Ca -0.51 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.52 1z8r h ARG 20 Cb 1.25 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.23 1z8r h ARG 20 CO 0.63 0.21 0.00 0.72 -1.07 0.00 0.00 179.97 180.46 1z8r n HIS 21 N -4.99 0.00 0.25 3.04 8.25 -1.26 -2.00 115.22 118.50 1z8r n HIS 21 Ca 0.03 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.51 1z8r n HIS 21 Cb 0.14 -0.40 0.01 0.00 1.12 0.00 0.00 29.99 30.86 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 -1.40 1.19 -4.71 2.41 7.94 0.44 -5.00 117.00 117.87 1z8r n LEU 22 Ca 0.04 -0.88 -0.39 0.00 -1.11 0.00 0.00 56.01 53.67 1z8r n LEU 22 Cb 0.11 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.00 1z8r n LEU 22 CO 0.09 0.25 0.32 0.00 -1.11 0.00 0.00 177.39 176.95 1z8r s ALA 23 N -0.73 3.41 0.76 1.96 0.00 0.55 -4.85 121.76 122.86 1z8r s ALA 23 Ca 0.06 -0.03 -0.11 0.00 0.00 0.00 0.00 51.96 51.88 1z8r s ALA 23 Cb 0.05 -2.86 0.05 0.00 0.00 0.00 0.00 23.12 20.35 1z8r s ALA 23 CO 0.11 -0.14 1.08 0.95 0.00 0.00 0.00 175.76 177.76 1z8r s THR 24 N 0.91 3.42 0.54 0.00 -4.23 -1.26 -4.84 115.64 110.18 1z8r s THR 24 Ca 0.33 0.46 0.28 0.00 -1.18 0.00 0.00 61.69 61.57 1z8r s THR 24 Cb -0.17 -3.19 0.42 0.00 1.34 0.00 0.00 72.50 70.90 1z8r s THR 24 CO 0.14 -0.60 1.96 1.12 -0.54 0.00 0.00 174.62 176.70 1z8r h HIS 25 N -0.96 0.00 -0.07 3.99 2.07 -1.99 0.38 115.15 118.57 1z8r h HIS 25 Ca -0.46 0.00 -0.12 0.00 -2.85 0.00 0.00 60.37 56.95 1z8r h HIS 25 Cb 1.25 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.21 1z8r h HIS 25 CO 0.52 0.00 -0.48 0.28 -3.07 0.00 0.00 177.93 175.18 1z8r h VAL 26 N 0.00 1.34 -0.29 6.12 2.07 -1.98 0.22 116.25 123.73 1z8r h VAL 26 Ca 0.29 -1.68 -0.08 0.00 0.82 0.00 0.00 66.70 66.05 1z8r h VAL 26 Cb 1.21 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.80 1z8r h VAL 26 CO -0.00 0.50 -0.13 0.44 0.02 0.00 0.00 177.57 178.39 1z8r h ASP 27 N 0.14 0.63 0.08 0.57 5.19 -0.58 -2.56 116.42 119.90 1z8r h ASP 27 Ca 0.01 -0.40 -0.21 0.00 -0.62 0.00 0.00 57.03 55.81 1z8r h ASP 27 Cb 0.90 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 40.24 1z8r h ASP 27 CO 0.07 0.89 -0.77 -0.50 -3.12 0.00 0.00 179.24 175.81 1z8r h TRP 28 N 0.36 0.79 -0.66 4.55 4.06 -1.34 -1.36 115.95 122.34 1z8r h TRP 28 Ca 0.07 -0.35 0.07 0.00 2.06 0.00 0.00 58.89 60.73 1z8r h TRP 28 Cb 0.65 -0.12 -0.06 0.00 -1.00 0.00 0.00 29.16 28.63 1z8r h TRP 28 CO 0.06 1.15 0.35 1.96 -3.56 0.00 0.00 178.44 178.40 1z8r h GLN 29 N 0.39 0.63 -0.58 0.49 7.50 -0.50 -2.06 115.11 120.97 1z8r h GLN 29 Ca -0.05 -0.04 -0.34 0.00 0.50 0.00 0.00 58.65 58.73 1z8r h GLN 29 Cb 1.37 -0.14 -0.20 0.00 0.05 0.00 0.00 27.48 28.56 1z8r h GLN 29 CO 0.14 0.41 0.06 0.09 -1.50 0.00 0.00 178.83 178.04 1z8r n ASN 30 N -4.82 3.57 -4.82 1.46 3.02 -0.97 -5.02 115.26 107.69 1z8r n ASN 30 Ca 0.09 -3.76 -0.33 0.00 -0.03 0.00 0.00 54.58 50.54 1z8r n ASN 30 Cb 0.19 -0.68 -0.07 0.00 -0.61 0.00 0.00 39.78 38.62 1z8r n ASN 30 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1z8r n VAL 32 N -0.49 0.90 -4.00 0.00 0.24 0.22 -4.93 118.33 110.26 1z8r n VAL 32 Ca 0.06 -0.36 -0.09 0.00 -2.04 0.00 0.00 64.34 61.91 1z8r n VAL 32 Cb 0.54 -1.03 -0.11 0.00 -1.47 0.00 0.00 33.84 31.77 1z8r n VAL 32 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 1z8r s TRP 33 N -2.31 0.33 -0.14 6.34 -0.00 -1.05 -4.98 118.94 117.13 1z8r s TRP 33 Ca -0.20 -0.57 -0.05 0.00 -0.00 0.00 0.00 56.10 55.28 1z8r s TRP 33 Cb 0.05 -0.23 0.07 0.00 -0.00 0.00 0.00 33.47 33.36 1z8r s TRP 33 CO 0.37 -0.19 0.27 -1.21 -0.00 0.00 0.00 176.95 176.19 1z8r s GLU 34 N -1.69 0.16 -0.41 5.86 8.01 -1.26 0.08 118.70 129.45 1z8r s GLU 34 Ca -0.13 0.69 -0.09 0.00 0.01 0.00 0.00 54.97 55.45 1z8r s GLU 34 Cb -0.08 -0.17 0.07 0.00 -4.31 0.00 0.00 34.13 29.64 1z8r s GLU 34 CO -0.02 -0.34 0.24 0.34 0.01 0.00 0.00 175.26 175.49 1z8r s ASP 35 N 2.42 5.59 0.43 -0.19 2.15 0.18 -4.95 116.67 122.32 1z8r s ASP 35 Ca 0.02 -1.45 0.14 0.00 0.43 0.00 0.00 52.55 51.69 1z8r s ASP 35 Cb -0.13 -1.97 0.95 0.00 -0.30 0.00 0.00 42.92 41.48 1z8r s ASP 35 CO -0.09 -0.51 1.96 0.10 -0.17 0.00 0.00 175.17 176.46 1z8r h TYR 36 N 8.37 0.00 0.00 -5.34 -0.00 -1.96 0.39 116.97 118.43 1z8r h TYR 36 Ca -0.23 0.00 -0.07 0.00 -0.00 0.00 0.00 58.73 58.43 1z8r h TYR 36 Cb 1.08 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.80 1z8r h TYR 36 CO 0.61 0.22 -0.33 -0.91 -0.00 0.00 0.00 178.16 177.74 1z8r h ASN 37 N 0.00 0.00 -0.12 0.10 4.21 -1.92 -3.00 115.58 114.85 1z8r h ASN 37 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1z8r h ASN 37 Cb 0.39 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.59 1z8r h ASN 37 CO 0.03 0.33 0.00 -1.14 -1.29 0.00 0.00 177.43 175.36 1z8r n ARG 38 N -3.80 1.62 -4.06 0.81 0.63 -0.81 0.12 116.66 111.17 1z8r n ARG 38 Ca -0.01 -1.43 -0.34 0.00 -0.92 0.00 0.00 57.85 55.15 1z8r n ARG 38 Cb 0.42 -1.15 -0.03 0.00 0.45 0.00 0.00 32.46 32.15 1z8r n ARG 38 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1z8r n ASP 39 N 0.23 -3.26 -4.20 6.15 9.92 0.13 -4.88 116.55 120.64 1z8r n ASP 39 Ca 0.06 -0.88 -0.20 0.00 -0.53 0.00 0.00 54.79 53.24 1z8r n ASP 39 Cb 0.27 -2.68 -0.12 0.00 -0.64 0.00 0.00 41.12 37.95 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 -7.08 2.28 0.04 0.64 2.96 -0.87 0.59 118.68 117.25 1z8r s LEU 40 Ca 0.68 -0.63 -0.07 0.00 -0.22 0.00 0.00 54.13 53.89 1z8r s LEU 40 Cb -0.37 -0.61 -0.01 0.00 0.50 0.00 0.00 46.19 45.71 1z8r s LEU 40 CO 0.84 -0.04 0.13 -1.48 -1.32 0.00 0.00 176.35 174.48 1z8r s LEU 41 N -1.79 1.65 -0.12 -0.68 -0.00 -0.98 0.51 118.68 117.27 1z8r s LEU 41 Ca 0.00 -0.51 0.01 0.00 -0.00 0.00 0.00 54.13 53.63 1z8r s LEU 41 Cb -0.10 0.75 -0.01 0.00 -0.00 0.00 0.00 46.19 46.83 1z8r s LEU 41 CO 0.03 -0.55 -0.16 -0.69 -0.00 0.00 0.00 176.35 174.97 1z8r s VAL 42 N -2.78 2.74 0.23 1.48 1.01 0.11 -2.11 120.40 121.09 1z8r s VAL 42 Ca -0.03 -0.77 0.11 0.00 0.00 0.00 0.00 61.98 61.28 1z8r s VAL 42 Cb -0.00 -2.12 -0.05 0.00 0.00 0.00 0.00 36.38 34.21 1z8r s VAL 42 CO -0.05 0.54 -0.21 -0.94 0.00 0.00 0.00 175.10 174.43 1z8r s SER 43 N 0.34 3.41 -0.17 3.32 1.04 -0.66 0.71 113.70 121.69 1z8r s SER 43 Ca -0.13 -0.95 -0.12 0.00 0.48 0.00 0.00 55.95 55.22 1z8r s SER 43 Cb -0.17 -0.26 -0.05 0.00 0.10 0.00 0.00 66.02 65.64 1z8r s SER 43 CO 0.07 0.06 0.24 0.42 0.98 0.00 0.00 173.24 175.00 1z8r s THR 44 N -2.16 5.34 0.21 2.02 -4.23 -1.00 0.01 115.64 115.83 1z8r s THR 44 Ca 0.25 0.43 0.08 0.00 -1.18 0.00 0.00 61.69 61.26 1z8r s THR 44 Cb -0.06 -3.57 -0.05 0.00 1.34 0.00 0.00 72.50 70.16 1z8r s THR 44 CO 0.12 0.42 -0.13 0.28 -0.54 0.00 0.00 174.62 174.76 1z8r s THR 45 N 0.34 1.72 -0.59 3.99 -1.32 -0.79 -4.98 115.64 114.02 1z8r s THR 45 Ca 0.14 -2.20 0.04 0.00 -1.21 0.00 0.00 61.69 58.46 1z8r s THR 45 Cb -0.12 -2.09 0.35 0.00 -1.51 0.00 0.00 72.50 69.13 1z8r s THR 45 CO 0.02 -0.56 1.06 0.41 -2.21 0.00 0.00 174.62 173.34 1z8r n THR 46 N -0.40 3.19 -4.15 5.08 -1.04 -1.26 -4.53 114.28 111.17 1z8r n THR 46 Ca -0.08 -5.48 -0.09 0.00 -2.04 0.00 0.00 64.05 56.37 1z8r n THR 46 Cb 0.61 -1.38 -0.03 0.00 -1.82 0.00 0.00 70.33 67.70 1z8r n THR 46 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1z8r n ALA 47 N -0.28 0.25 -2.71 2.41 0.00 -1.26 -5.14 120.51 113.77 1z8r n ALA 47 Ca 0.34 -0.77 -0.37 0.00 0.00 0.00 0.00 53.44 52.63 1z8r n ALA 47 Cb 0.43 0.57 -0.11 0.00 0.00 0.00 0.00 19.45 20.33 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 -2.31 3.20 0.04 0.00 5.65 -1.26 -4.82 115.29 115.78 1z8r s HIS 48 Ca 0.11 -0.00 -0.01 0.00 0.25 0.00 0.00 55.06 55.42 1z8r s HIS 48 Cb 0.01 -2.33 0.01 0.00 -1.18 0.00 0.00 32.58 29.08 1z8r s HIS 48 CO 0.08 -0.18 0.05 0.41 -0.65 0.00 0.00 174.74 174.45 1z8r n GLY 49 N 4.94 -1.12 1.25 1.59 0.00 -1.26 -5.04 105.19 105.54 1z8r n GLY 49 Ca -0.15 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.20 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 -2.22 6.30 -0.16 0.00 1.11 -1.26 -5.02 116.67 115.43 1z8r s ASP 51 Ca 0.00 2.76 0.00 0.00 0.18 0.00 0.00 52.55 55.49 1z8r s ASP 51 Cb 0.00 -2.65 0.03 0.00 1.07 0.00 0.00 42.92 41.37 1z8r s ASP 51 CO 0.00 -0.87 -0.12 -0.89 1.18 0.00 0.00 175.17 174.47 1z8r s THR 52 N -1.21 1.52 0.23 -1.27 2.01 -1.26 -4.74 115.64 110.91 1z8r s THR 52 Ca 0.56 -0.71 -0.30 0.00 0.31 0.00 0.00 61.69 61.55 1z8r s THR 52 Cb -0.40 -1.50 -0.09 0.00 0.01 0.00 0.00 72.50 70.52 1z8r s THR 52 CO 0.53 0.35 0.96 -0.63 -0.69 0.00 0.00 174.62 175.13 1z8r s ILE 53 N 1.49 4.05 -0.13 1.82 1.01 -1.26 0.94 121.20 129.11 1z8r s ILE 53 Ca 0.03 2.03 -0.10 0.00 0.00 0.00 0.00 60.65 62.61 1z8r s ILE 53 Cb -0.14 -4.29 -0.05 0.00 0.01 0.00 0.00 42.46 37.99 1z8r s ILE 53 CO -0.10 0.47 0.19 0.00 0.00 0.00 0.00 174.94 175.51 1z8r s ALA 54 N -1.08 3.76 -0.45 9.38 0.00 -0.59 -3.37 121.76 129.41 1z8r s ALA 54 Ca 0.42 -0.57 -0.02 0.00 0.00 0.00 0.00 51.96 51.79 1z8r s ALA 54 Cb -0.26 -2.14 0.23 0.00 0.00 0.00 0.00 23.12 20.95 1z8r s ALA 54 CO 0.33 0.40 2.20 -2.13 0.00 0.00 0.00 175.76 176.56 1z8r n ARG 55 N 2.61 2.17 -3.26 0.00 0.63 -1.22 -4.76 116.66 112.84 1z8r n ARG 55 Ca -0.17 -2.20 -0.18 0.00 -0.92 0.00 0.00 57.85 54.38 1z8r n ARG 55 Cb 0.53 -1.91 0.00 0.00 0.45 0.00 0.00 32.46 31.54 1z8r n ARG 55 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1z8r n GLN 57 N -1.75 1.42 -1.98 0.00 7.27 -1.26 -5.06 117.38 116.02 1z8r n GLN 57 Ca 0.03 -2.93 -0.41 0.00 0.07 0.00 0.00 57.00 53.77 1z8r n GLN 57 Cb 0.58 -1.55 -0.01 0.00 2.41 0.00 0.00 30.24 31.67 1z8r n GLN 57 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1z8r n THR 59 N 0.81 0.87 -4.37 0.00 -1.04 -1.26 -4.89 114.28 104.40 1z8r n THR 59 Ca 0.01 -0.64 -0.19 0.00 -2.04 0.00 0.00 64.05 61.19 1z8r n THR 59 Cb 0.41 0.09 -0.10 0.00 -1.82 0.00 0.00 70.33 68.90 1z8r n THR 59 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1z8r s THR 60 N -1.60 1.77 0.00 12.58 -4.23 -1.26 -1.57 115.64 121.32 1z8r s THR 60 Ca 0.29 -2.21 0.00 0.00 -1.18 0.00 0.00 61.69 58.59 1z8r s THR 60 Cb 0.17 -2.14 0.00 0.00 1.34 0.00 0.00 72.50 71.88 1z8r s THR 60 CO 0.16 -0.53 0.00 0.61 -0.54 0.00 0.00 174.62 174.32 1z8r n GLY 61 N -0.43 1.36 3.74 3.99 0.00 0.17 -4.83 105.19 109.19 1z8r n GLY 61 Ca -0.07 -0.43 -0.36 0.00 0.00 0.00 0.00 46.02 45.16 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 -2.00 4.85 0.04 1.61 0.11 -0.78 0.75 120.40 124.98 1z8r s VAL 62 Ca 0.00 -0.03 0.00 0.00 -2.93 0.00 0.00 61.98 59.02 1z8r s VAL 62 Cb 0.00 -3.10 -0.00 0.00 -1.53 0.00 0.00 36.38 31.75 1z8r s VAL 62 CO 0.00 0.58 0.01 0.00 -3.33 0.00 0.00 175.10 172.36 1z8r n TYR 63 N 2.38 0.02 0.00 1.54 0.18 0.44 -1.97 117.16 119.75 1z8r n TYR 63 Ca -0.19 -0.25 0.00 0.00 1.88 0.00 0.00 57.90 59.35 1z8r n TYR 63 Cb 0.54 -0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.50 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 -0.09 0.00 0.00 -3.48 3.01 -1.26 -2.10 117.46 113.54 1z8r n PHE 64 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 1z8r n PHE 64 Cb 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.53 1z8r n PHE 64 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1z8r h ALA 66 N 0.00 0.00 -0.15 0.00 0.00 -1.88 0.13 119.26 117.36 1z8r h ALA 66 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.10 1z8r h ALA 66 Cb 0.00 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1z8r h ALA 66 CO 0.00 0.49 0.00 -1.13 0.00 0.00 0.00 179.25 178.61 1z8r n SER 67 N -4.10 0.00 0.00 0.00 3.41 -1.24 -1.63 113.62 110.05 1z8r n SER 67 Ca -0.17 0.98 0.14 0.00 -0.26 0.00 0.00 58.87 59.56 1z8r n SER 67 Cb 0.82 -0.48 0.83 0.00 -0.26 0.00 0.00 64.21 65.12 1z8r n SER 67 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1z8r n LYS 68 N -2.47 0.78 -0.92 4.33 4.76 -1.26 -4.86 118.16 118.51 1z8r n LYS 68 Ca 0.00 0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.45 1z8r n LYS 68 Cb 0.00 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.69 1z8r n LYS 68 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1z8r n SER 69 N -1.08 -0.57 -4.16 4.39 2.88 -0.65 -4.97 113.62 109.48 1z8r n SER 69 Ca 0.20 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.62 1z8r n SER 69 Cb 0.13 -0.57 -0.09 0.00 -0.75 0.00 0.00 64.21 62.93 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 -0.22 1.20 -0.32 -1.46 3.01 0.39 -4.83 119.74 117.52 1z8r s LYS 70 Ca 0.00 -1.53 -0.25 0.00 -1.01 0.00 0.00 55.97 53.18 1z8r s LYS 70 Cb 0.00 0.30 0.01 0.00 -1.01 0.00 0.00 37.83 37.12 1z8r s LYS 70 CO 0.00 -0.40 0.85 -3.38 0.51 0.00 0.00 175.35 172.93 1z8r s HIS 71 N -4.12 3.18 -0.35 3.18 -3.43 -1.26 -0.93 115.29 111.56 1z8r s HIS 71 Ca 0.34 0.87 -0.12 0.00 -0.80 0.00 0.00 55.06 55.35 1z8r s HIS 71 Cb 0.06 -3.35 0.00 0.00 -1.43 0.00 0.00 32.58 27.87 1z8r s HIS 71 CO 0.09 -0.63 0.22 0.71 -2.00 0.00 0.00 174.74 173.13 1z8r s TYR 72 N 3.13 3.22 -0.21 0.38 1.51 -0.89 -4.94 117.35 119.56 1z8r s TYR 72 Ca 0.35 -0.58 -0.29 0.00 -1.01 0.00 0.00 57.07 55.55 1z8r s TYR 72 Cb -0.14 -2.45 0.00 0.00 -0.11 0.00 0.00 41.96 39.26 1z8r s TYR 72 CO 0.14 -0.51 1.01 -2.14 -1.11 0.00 0.00 175.55 172.94 1z8r s PRO 73 N 1.64 4.28 0.04 -1.71 0.02 -1.26 -0.42 135.00 137.59 1z8r s PRO 73 Ca 0.04 1.32 0.03 0.00 0.02 0.00 0.00 61.00 62.41 1z8r s PRO 73 Cb -0.18 -3.62 -0.02 0.00 0.02 0.00 0.00 34.50 30.70 1z8r s PRO 73 CO 0.08 -0.56 -0.09 0.08 -0.33 0.00 0.00 177.00 176.18 1z8r s VAL 74 N 2.93 0.70 -0.21 3.83 1.01 0.23 -4.92 120.40 123.96 1z8r s VAL 74 Ca 0.44 -0.95 -0.10 0.00 0.00 0.00 0.00 61.98 61.37 1z8r s VAL 74 Cb -0.16 -0.70 -0.05 0.00 0.00 0.00 0.00 36.38 35.48 1z8r s VAL 74 CO 0.08 -0.20 0.13 -0.44 0.00 0.00 0.00 175.10 174.67 1z8r s SER 75 N -1.27 6.09 0.27 3.32 0.01 -1.26 -0.66 113.70 120.21 1z8r s SER 75 Ca -0.05 0.17 0.02 0.00 1.31 0.00 0.00 55.95 57.41 1z8r s SER 75 Cb -0.08 -2.07 -0.05 0.00 0.21 0.00 0.00 66.02 64.02 1z8r s SER 75 CO 0.01 0.15 0.07 0.72 0.41 0.00 0.00 173.24 174.60 1z8r s PHE 76 N 0.55 1.63 0.24 2.43 -0.12 -0.61 -4.48 117.98 117.62 1z8r s PHE 76 Ca 0.07 -1.09 0.09 0.00 -0.05 0.00 0.00 56.93 55.95 1z8r s PHE 76 Cb -0.12 -0.99 -0.04 0.00 -0.63 0.00 0.00 43.02 41.24 1z8r s PHE 76 CO -0.00 -0.21 0.01 -2.00 -0.05 0.00 0.00 175.22 172.97 1z8r s GLU 77 N -3.97 2.37 -0.94 1.99 2.12 -0.77 -4.61 118.70 114.88 1z8r s GLU 77 Ca 0.36 -1.30 -0.01 0.00 0.36 0.00 0.00 54.97 54.38 1z8r s GLU 77 Cb 0.08 -2.24 0.31 0.00 0.26 0.00 0.00 34.13 32.53 1z8r s GLU 77 CO 0.13 0.39 1.41 0.41 -0.54 0.00 0.00 175.26 177.06 1z8r n GLY 78 N -0.69 5.46 3.74 -1.50 0.00 -1.26 -2.30 105.19 108.64 1z8r n GLY 78 Ca -0.08 -2.67 -0.41 0.00 0.00 0.00 0.00 46.02 42.86 1z8r n GLY 78 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1z8r s PRO 79 N -3.29 4.34 0.00 1.61 0.04 -1.12 -4.88 135.00 131.71 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 0.13 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.51 1z8r s PRO 79 CO -0.01 -0.32 0.11 0.41 0.04 0.00 0.00 177.00 177.23 1z8r n GLY 80 N 2.35 -2.52 3.61 0.56 0.00 -1.26 -2.44 105.19 105.49 1z8r n GLY 80 Ca 0.07 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 -0.24 4.05 -0.14 0.99 1.98 -1.26 0.12 118.68 124.18 1z8r s LEU 81 Ca 0.00 0.37 0.01 0.00 -2.89 0.00 0.00 54.13 51.62 1z8r s LEU 81 Cb 0.00 -2.52 0.02 0.00 0.66 0.00 0.00 46.19 44.34 1z8r s LEU 81 CO 0.00 -0.23 -0.17 -0.69 -1.89 0.00 0.00 176.35 173.36 1z8r s VAL 82 N 2.17 1.75 -0.44 1.68 1.01 0.18 -4.96 120.40 121.79 1z8r s VAL 82 Ca 0.18 -0.77 -0.28 0.00 0.00 0.00 0.00 61.98 61.10 1z8r s VAL 82 Cb -0.16 -1.59 -0.00 0.00 0.00 0.00 0.00 36.38 34.63 1z8r s VAL 82 CO 0.10 0.49 1.61 -0.70 0.00 0.00 0.00 175.10 176.60 1z8r s GLU 83 N 1.14 3.30 -0.28 2.72 2.12 -1.26 -1.19 118.70 125.24 1z8r s GLU 83 Ca -0.02 0.97 -0.29 0.00 0.36 0.00 0.00 54.97 55.99 1z8r s GLU 83 Cb -0.14 -4.15 -0.01 0.00 0.26 0.00 0.00 34.13 30.09 1z8r s GLU 83 CO -0.06 -1.90 1.40 0.08 -0.54 0.00 0.00 175.26 174.24 1z8r s VAL 84 N 6.58 3.99 0.51 3.70 1.01 0.27 -4.94 120.40 131.52 1z8r s VAL 84 Ca 0.67 1.11 -0.20 0.00 0.00 0.00 0.00 61.98 63.56 1z8r s VAL 84 Cb -0.16 -4.03 -0.07 0.00 0.00 0.00 0.00 36.38 32.12 1z8r s VAL 84 CO 0.30 -0.44 1.08 -1.10 0.00 0.00 0.00 175.10 174.93 1z8r s GLN 85 N 4.37 3.62 -0.56 2.72 -0.21 -1.26 -0.97 119.66 127.37 1z8r s GLN 85 Ca 0.61 1.46 -0.27 0.00 0.02 0.00 0.00 55.36 57.19 1z8r s GLN 85 Cb -0.19 -2.06 -0.03 0.00 1.00 0.00 0.00 33.01 31.73 1z8r s GLN 85 CO 0.25 -0.60 1.97 -2.00 -2.12 0.00 0.00 175.29 172.79 1z8r s GLU 86 N -3.26 2.58 0.21 2.91 2.12 -1.25 -4.48 118.70 117.54 1z8r s GLU 86 Ca 0.69 0.84 -0.06 0.00 0.36 0.00 0.00 54.97 56.81 1z8r s GLU 86 Cb -0.19 -4.41 -0.03 0.00 0.26 0.00 0.00 34.13 29.76 1z8r s GLU 86 CO 0.23 -2.77 0.26 -1.12 -0.54 0.00 0.00 175.26 171.33 1z8r s SER 87 N 8.74 0.06 0.00 -1.70 0.01 -0.93 -4.89 113.70 115.00 1z8r s SER 87 Ca 0.74 -1.19 0.00 0.00 1.31 0.00 0.00 55.95 56.82 1z8r s SER 87 Cb -0.14 0.46 0.00 0.00 0.21 0.00 0.00 66.02 66.54 1z8r s SER 87 CO 0.23 -0.95 0.00 1.21 0.41 0.00 0.00 173.24 174.14 1z8r n GLU 88 N -0.30 0.00 -0.81 12.44 2.13 -1.26 0.13 120.64 132.97 1z8r n GLU 88 Ca -0.00 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.80 1z8r n GLU 88 Cb 0.64 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 32.33 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 -4.03 4.31 0.18 -1.26 -5.09 117.16 111.27 1z8r n TYR 89 Ca 0.00 -0.24 -0.34 0.00 1.88 0.00 0.00 57.90 59.21 1z8r n TYR 89 Cb 0.00 0.23 -0.15 0.00 -0.38 0.00 0.00 39.34 39.04 1z8r n TYR 89 CO 0.00 0.00 0.00 0.71 -2.08 0.00 0.00 176.86 175.49 1z8r s TYR 90 N 0.00 2.99 0.59 -3.48 1.51 0.12 -5.11 117.35 113.97 1z8r s TYR 90 Ca 0.05 -1.66 -0.20 0.00 -1.01 0.00 0.00 57.07 54.25 1z8r s TYR 90 Cb 0.06 -1.99 -0.03 0.00 -0.11 0.00 0.00 41.96 39.88 1z8r s TYR 90 CO -0.02 -0.77 1.30 -2.14 -1.11 0.00 0.00 175.55 172.81 1z8r s PRO 91 N 1.29 2.88 -0.96 -1.71 0.02 -1.26 -2.19 135.00 133.07 1z8r s PRO 91 Ca 0.01 2.08 -0.26 0.00 0.02 0.00 0.00 61.00 62.85 1z8r s PRO 91 Cb -0.16 -2.03 -0.24 0.00 0.02 0.00 0.00 34.50 32.09 1z8r s PRO 91 CO -0.07 -1.35 2.03 1.17 -0.33 0.00 0.00 177.00 178.44 1z8r n LYS 92 N -1.48 0.08 -4.69 5.54 3.00 -1.25 -4.51 118.16 114.85 1z8r n LYS 92 Ca 0.13 -1.58 -0.31 0.00 -0.00 0.00 0.00 58.31 56.55 1z8r n LYS 92 Cb 0.47 -3.71 -0.07 0.00 0.00 0.00 0.00 35.03 31.72 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 8.29 2.15 -0.11 1.64 3.52 -0.14 -4.87 118.95 129.43 1z8r s ARG 93 Ca 0.77 -2.38 -0.16 0.00 -0.13 0.00 0.00 55.73 53.84 1z8r s ARG 93 Cb -0.03 -1.15 -0.05 0.00 -1.56 0.00 0.00 34.95 32.16 1z8r s ARG 93 CO 0.19 -0.47 0.39 0.71 -0.81 0.00 0.00 175.30 175.31 1z8r s TYR 94 N -3.01 3.55 -0.09 5.12 1.51 -1.26 0.94 117.35 124.10 1z8r s TYR 94 Ca 0.08 0.80 0.00 0.00 -1.01 0.00 0.00 57.07 56.94 1z8r s TYR 94 Cb 0.00 -2.40 0.02 0.00 -0.11 0.00 0.00 41.96 39.48 1z8r s TYR 94 CO 0.06 0.32 -0.07 -1.14 -1.11 0.00 0.00 175.55 173.60 1z8r s GLN 95 N 0.14 1.38 0.31 -0.62 0.74 -0.33 -4.77 119.66 116.51 1z8r s GLN 95 Ca 0.22 -0.23 0.04 0.00 0.05 0.00 0.00 55.36 55.43 1z8r s GLN 95 Cb -0.15 -1.40 -0.02 0.00 1.10 0.00 0.00 33.01 32.54 1z8r s GLN 95 CO 0.08 -0.19 0.47 0.45 -0.55 0.00 0.00 175.29 175.55 1z8r s SER 96 N 1.43 6.19 -1.16 6.67 0.15 0.31 0.50 113.70 127.81 1z8r s SER 96 Ca -0.01 0.15 -0.08 0.00 0.70 0.00 0.00 55.95 56.71 1z8r s SER 96 Cb -0.13 -1.75 -0.03 0.00 -1.71 0.00 0.00 66.02 62.40 1z8r s SER 96 CO -0.04 -0.27 0.84 1.41 1.20 0.00 0.00 173.24 176.37 1z8r n HIS 97 N -1.63 -2.14 -5.04 3.44 8.25 0.32 -4.21 115.22 114.20 1z8r n HIS 97 Ca -0.05 0.75 -0.28 0.00 -0.26 0.00 0.00 57.72 57.89 1z8r n HIS 97 Cb 0.57 -4.12 -0.16 0.00 1.12 0.00 0.00 29.99 27.41 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 -3.48 1.68 -0.11 1.59 0.11 -1.02 -2.31 120.40 116.86 1z8r s VAL 98 Ca 0.30 -0.90 -0.05 0.00 -2.93 0.00 0.00 61.98 58.39 1z8r s VAL 98 Cb -0.07 -1.39 -0.04 0.00 -1.53 0.00 0.00 36.38 33.35 1z8r s VAL 98 CO 0.79 0.47 0.10 -0.76 -3.33 0.00 0.00 175.10 172.38 1z8r s LEU 99 N -0.46 4.16 0.01 2.54 1.02 0.23 -2.78 118.68 123.39 1z8r s LEU 99 Ca 0.07 0.37 0.03 0.00 0.02 0.00 0.00 54.13 54.62 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 -0.01 0.40 -0.09 -0.76 0.02 0.00 0.00 176.35 175.91 1z8r s LEU 100 N -1.03 2.07 -0.06 1.79 1.43 -0.97 -0.26 118.68 121.65 1z8r s LEU 100 Ca 0.15 -0.26 -0.18 0.00 -1.03 0.00 0.00 54.13 52.81 1z8r s LEU 100 Cb -0.12 -0.43 0.04 0.00 0.03 0.00 0.00 46.19 45.71 1z8r s LEU 100 CO 0.04 0.05 0.41 0.00 0.23 0.00 0.00 176.35 177.08 1z8r s ALA 101 N -0.46 -1.04 -0.30 4.21 0.00 -1.05 -1.84 121.76 121.27 1z8r s ALA 101 Ca 0.01 0.76 -0.11 0.00 0.00 0.00 0.00 51.96 52.62 1z8r s ALA 101 Cb -0.05 -0.16 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 1z8r s ALA 101 CO 0.00 -0.26 0.20 -0.08 0.00 0.00 0.00 175.76 175.62 1z8r s THR 102 N -0.86 5.23 -1.53 0.00 -1.32 -1.26 0.17 115.64 116.08 1z8r s THR 102 Ca -0.09 0.00 0.28 0.00 -1.21 0.00 0.00 61.69 60.67 1z8r s THR 102 Cb -0.04 -3.57 0.33 0.00 -1.51 0.00 0.00 72.50 67.71 1z8r s THR 102 CO 0.04 0.16 1.73 0.61 -2.21 0.00 0.00 174.62 174.95 1z8r n GLY 103 N 5.07 -0.95 5.00 6.08 0.00 -0.71 -4.94 105.19 114.74 1z8r n GLY 103 Ca -0.14 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.00 0.00 -3.58 1.61 3.72 -1.25 -4.46 117.46 112.50 1z8r n PHE 104 Ca 0.12 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.12 1z8r n PHE 104 Cb 0.31 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.78 1z8r n PHE 104 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1z8r s SER 105 N 0.00 5.83 0.03 4.37 0.15 -1.26 -4.94 113.70 117.88 1z8r s SER 105 Ca 0.00 -2.94 0.08 0.00 0.70 0.00 0.00 55.95 53.79 1z8r s SER 105 Cb 0.00 -1.98 -0.03 0.00 -1.71 0.00 0.00 66.02 62.30 1z8r s SER 105 CO 0.00 -0.40 -0.23 -1.61 1.20 0.00 0.00 173.24 172.20 1z8r s GLU 106 N -0.20 1.97 0.05 5.44 2.02 -1.26 -5.07 118.70 121.65 1z8r s GLU 106 Ca 0.19 -1.02 -0.26 0.00 0.02 0.00 0.00 54.97 53.89 1z8r s GLU 106 Cb -0.15 -2.08 -0.13 0.00 0.10 0.00 0.00 34.13 31.86 1z8r s GLU 106 CO -0.06 0.53 1.40 -1.35 0.02 0.00 0.00 175.26 175.81 1z8r h PRO 107 N 4.82 -0.79 0.00 0.39 0.11 -1.97 -3.48 132.00 131.08 1z8r h PRO 107 Ca -0.46 0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1z8r h PRO 107 Cb 1.14 0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1z8r h PRO 107 CO 0.46 -0.53 0.00 0.41 -0.21 0.00 0.00 178.00 178.13 1z8r n GLY 108 N -1.43 1.06 3.80 -0.55 0.00 -1.26 -5.13 105.19 101.68 1z8r n GLY 108 Ca -0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 1z8r n GLY 108 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1z8r s ASP 109 N 0.00 5.94 0.10 1.61 -4.77 -1.26 -5.07 116.67 113.22 1z8r s ASP 109 Ca 0.00 0.33 -0.02 0.00 -3.30 0.00 0.00 52.55 49.56 1z8r s ASP 109 Cb 0.00 -1.83 -0.04 0.00 -1.09 0.00 0.00 42.92 39.97 1z8r s ASP 109 CO 0.00 0.39 0.04 0.00 0.70 0.00 0.00 175.17 176.30 1z8r s ALA 110 N -1.00 0.63 0.00 2.11 0.00 -1.26 -4.90 121.76 117.34 1z8r s ALA 110 Ca 0.15 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 50.81 1z8r s ALA 110 Cb -0.12 0.63 0.00 0.00 0.00 0.00 0.00 23.12 23.63 1z8r s ALA 110 CO 0.05 -0.45 0.00 0.41 0.00 0.00 0.00 175.76 175.76 1z8r n GLY 111 N -0.02 -1.83 3.82 0.00 0.00 -1.26 -5.10 105.19 100.80 1z8r n GLY 111 Ca -0.09 0.79 -0.08 0.00 0.00 0.00 0.00 46.02 46.63 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 0.25 0.04 -0.02 0.00 -1.26 -4.53 107.32 101.80 1z8r s GLY 112 Ca 0.00 -0.64 -0.05 0.00 0.00 0.00 0.00 44.72 44.03 1z8r s GLY 112 CO 0.00 -0.24 0.28 -0.26 0.00 0.00 0.00 173.10 172.88 1z8r s ILE 113 N -2.71 5.29 -0.39 0.90 -5.25 -1.26 -1.14 121.20 116.65 1z8r s ILE 113 Ca 0.14 0.05 -0.23 0.00 -0.99 0.00 0.00 60.65 59.62 1z8r s ILE 113 Cb -0.05 -3.58 0.01 0.00 2.95 0.00 0.00 42.46 41.79 1z8r s ILE 113 CO 0.10 0.27 0.79 -0.22 -1.79 0.00 0.00 174.94 174.09 1z8r s LEU 114 N -2.03 4.15 -0.04 0.37 2.96 0.28 -4.59 118.68 119.78 1z8r s LEU 114 Ca 0.31 0.23 0.07 0.00 -0.22 0.00 0.00 54.13 54.52 1z8r s LEU 114 Cb -0.13 -3.02 -0.02 0.00 0.50 0.00 0.00 46.19 43.53 1z8r s LEU 114 CO 0.19 -0.79 -0.24 0.00 -1.32 0.00 0.00 176.35 174.19 1z8r s ARG 115 N 3.17 2.33 0.52 1.98 1.70 -0.83 0.34 118.95 128.16 1z8r s ARG 115 Ca 0.31 -0.90 0.05 0.00 -0.47 0.00 0.00 55.73 54.73 1z8r s ARG 115 Cb -0.13 -2.13 0.02 0.00 -0.57 0.00 0.00 34.95 32.14 1z8r s ARG 115 CO 0.19 0.49 0.32 0.00 -1.08 0.00 0.00 175.30 175.22 1z8r h GLU 117 N 0.93 0.00 0.04 0.00 4.39 -1.97 -1.04 114.58 116.93 1z8r h GLU 117 Ca -0.39 0.00 -0.32 0.00 0.34 0.00 0.00 59.36 58.99 1z8r h GLU 117 Cb 1.30 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.91 1z8r h GLU 117 CO 0.61 0.00 -1.85 0.72 -1.16 0.00 0.00 179.01 177.33 1z8r n HIS 118 N -2.97 1.04 -0.26 4.33 8.25 -1.26 -5.09 115.22 119.25 1z8r n HIS 118 Ca -0.02 0.31 0.00 0.00 -0.26 0.00 0.00 57.72 57.74 1z8r n HIS 118 Cb 0.23 -1.17 0.00 0.00 1.12 0.00 0.00 29.99 30.17 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 1.73 -0.48 3.75 -1.41 0.00 -0.40 -4.51 105.19 103.87 1z8r n GLY 119 Ca -0.23 -0.81 -0.40 0.00 0.00 0.00 0.00 46.02 44.58 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 -3.93 4.62 -0.15 1.61 1.01 0.27 0.10 120.40 123.93 1z8r s VAL 120 Ca 0.00 1.72 -0.06 0.00 0.00 0.00 0.00 61.98 63.64 1z8r s VAL 120 Cb 0.00 -4.15 -0.07 0.00 0.00 0.00 0.00 36.38 32.16 1z8r s VAL 120 CO 0.00 0.39 -0.18 -0.38 0.00 0.00 0.00 175.10 174.93 1z8r n ILE 121 N 2.57 0.81 -3.52 2.22 -0.00 0.15 -1.55 119.36 120.05 1z8r n ILE 121 Ca -0.02 -0.23 -0.01 0.00 -0.00 0.00 0.00 62.75 62.49 1z8r n ILE 121 Cb 0.50 -1.56 0.00 0.00 -0.00 0.00 0.00 39.64 38.58 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 2.22 1.17 3.56 7.39 0.00 -1.02 0.56 105.19 119.08 1z8r n GLY 122 Ca -0.28 -0.97 -0.25 0.00 0.00 0.00 0.00 46.02 44.52 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 2.79 0.05 0.99 2.34 0.28 0.10 118.68 125.24 1z8r s LEU 123 Ca 0.04 -1.11 -0.30 0.00 0.06 0.00 0.00 54.13 52.83 1z8r s LEU 123 Cb -0.01 -1.13 -0.09 0.00 -0.56 0.00 0.00 46.19 44.41 1z8r s LEU 123 CO 0.01 -0.17 1.91 0.54 -1.06 0.00 0.00 176.35 177.58 1z8r s VAL 124 N -2.56 2.93 0.00 1.48 0.11 -0.29 0.72 120.40 122.79 1z8r s VAL 124 Ca 0.33 0.07 0.00 0.00 -2.93 0.00 0.00 61.98 59.45 1z8r s VAL 124 Cb 0.01 -3.05 0.00 0.00 -1.53 0.00 0.00 36.38 31.81 1z8r s VAL 124 CO 0.17 -0.00 0.00 0.41 -3.33 0.00 0.00 175.10 172.35 1z8r n THR 125 N 5.34 0.00 -2.55 5.04 -1.04 0.20 -4.73 114.28 116.54 1z8r n THR 125 Ca 0.19 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.93 1z8r n THR 125 Cb 0.40 -0.02 0.01 0.00 -1.82 0.00 0.00 70.33 68.91 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 0.85 3.31 -0.34 -2.82 -1.94 -0.46 -4.89 119.30 113.01 1z8r s MET 126 Ca 0.00 0.11 0.01 0.00 -1.71 0.00 0.00 55.69 54.10 1z8r s MET 126 Cb 0.00 -2.34 0.15 0.00 2.01 0.00 0.00 34.83 34.64 1z8r s MET 126 CO 0.00 -0.39 0.33 0.20 -0.01 0.00 0.00 175.02 175.15 1z8r s GLY 127 N -4.18 0.05 0.90 -0.03 0.00 -1.26 0.12 107.32 102.91 1z8r s GLY 127 Ca 0.50 -0.88 -0.15 0.00 0.00 0.00 0.00 44.72 44.19 1z8r s GLY 127 CO 0.45 2.62 0.99 0.61 0.00 0.00 0.00 173.10 177.76 1z8r n GLY 128 N 4.58 -2.07 0.25 0.20 0.00 -0.47 -4.86 105.19 102.83 1z8r n GLY 128 Ca 0.07 -1.60 0.16 0.00 0.00 0.00 0.00 46.02 44.65 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 -2.01 -3.35 114.58 115.91 1z8r h GLU 129 Ca -0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 1z8r h GLU 129 Cb 0.99 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1z8r h GLU 129 CO 0.23 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.65 1z8r n GLY 130 N 0.23 1.00 3.55 -3.84 0.00 -1.26 -4.87 105.19 100.00 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 3.01 -0.23 1.61 1.01 -1.26 -1.73 120.40 122.81 1z8r s VAL 131 Ca 0.00 -1.93 -0.03 0.00 0.00 0.00 0.00 61.98 60.02 1z8r s VAL 131 Cb 0.00 -2.54 0.00 0.00 0.00 0.00 0.00 36.38 33.84 1z8r s VAL 131 CO 0.00 -0.24 -0.06 0.68 0.00 0.00 0.00 175.10 175.48 1z8r s VAL 132 N -2.04 3.14 -0.28 2.92 -7.23 0.45 -1.37 120.40 116.00 1z8r s VAL 132 Ca 0.27 -0.69 -0.15 0.00 -1.81 0.00 0.00 61.98 59.60 1z8r s VAL 132 Cb -0.07 -2.48 -0.03 0.00 0.56 0.00 0.00 36.38 34.36 1z8r s VAL 132 CO 0.16 0.36 0.38 -0.83 -0.31 0.00 0.00 175.10 174.85 1z8r s GLY 133 N 1.42 1.88 0.03 2.32 0.00 0.31 -2.53 107.32 110.76 1z8r s GLY 133 Ca 0.04 -0.87 0.07 0.00 0.00 0.00 0.00 44.72 43.96 1z8r s GLY 133 CO -0.04 0.99 -0.20 -1.36 0.00 0.00 0.00 173.10 172.49 1z8r s PHE 134 N 2.08 1.76 -0.37 1.90 0.08 0.64 0.59 117.98 124.66 1z8r s PHE 134 Ca 0.15 -0.37 -0.19 0.00 0.12 0.00 0.00 56.93 56.64 1z8r s PHE 134 Cb -0.16 -1.07 0.00 0.00 -0.57 0.00 0.00 43.02 41.23 1z8r s PHE 134 CO 0.10 0.07 0.55 0.00 -0.10 0.00 0.00 175.22 175.84 1z8r s ALA 135 N -0.74 3.45 0.20 5.36 0.00 0.22 0.74 121.76 130.99 1z8r s ALA 135 Ca 0.07 -1.06 -0.30 0.00 0.00 0.00 0.00 51.96 50.67 1z8r s ALA 135 Cb -0.09 -3.10 -0.09 0.00 0.00 0.00 0.00 23.12 19.85 1z8r s ALA 135 CO 0.01 -1.37 1.37 0.34 0.00 0.00 0.00 175.76 176.12 1z8r s ASP 136 N 1.81 6.80 0.00 0.00 -1.08 -0.98 -0.56 116.67 122.67 1z8r s ASP 136 Ca 0.20 2.48 0.24 0.00 -0.52 0.00 0.00 52.55 54.95 1z8r s ASP 136 Cb -0.15 -2.61 0.47 0.00 -1.46 0.00 0.00 42.92 39.16 1z8r s ASP 136 CO 0.15 -0.61 1.42 0.52 0.52 0.00 0.00 175.17 177.16 1z8r n VAL 137 N 2.79 0.20 0.88 1.11 0.31 0.19 -4.16 118.33 119.65 1z8r n VAL 137 Ca 0.07 -0.53 0.09 0.00 -0.01 0.00 0.00 64.34 63.97 1z8r n VAL 137 Cb 0.42 1.03 0.47 0.00 -0.91 0.00 0.00 33.84 34.85 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 1.10 0.24 -0.10 5.55 1.74 -1.25 -2.34 116.66 121.60 1z8r n ARG 138 Ca 0.17 0.11 0.11 0.00 -0.77 0.00 0.00 57.85 57.48 1z8r n ARG 138 Cb 0.53 -1.50 0.29 0.00 -1.02 0.00 0.00 32.46 30.77 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 -1.31 2.49 -2.71 0.55 -0.08 -1.26 -4.42 116.55 109.81 1z8r n ASP 139 Ca 0.09 -1.84 -0.07 0.00 -1.51 0.00 0.00 54.79 51.46 1z8r n ASP 139 Cb 0.16 -0.14 0.09 0.00 2.34 0.00 0.00 41.12 43.58 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 0.88 -2.00 0.12 -2.67 -0.00 -0.99 -4.98 117.00 107.36 1z8r n LEU 140 Ca 0.17 -3.24 0.12 0.00 -0.00 0.00 0.00 56.01 53.07 1z8r n LEU 140 Cb 0.47 0.75 0.47 0.00 -0.00 0.00 0.00 43.42 45.10 1z8r n LEU 140 CO 0.15 1.90 0.86 -0.11 -0.00 0.00 0.00 177.39 180.19 1z8r n LEU 141 N 0.12 0.68 -4.39 1.47 -0.00 -1.18 -4.66 117.00 109.04 1z8r n LEU 141 Ca 0.00 0.64 -0.10 0.00 -0.00 0.00 0.00 56.01 56.55 1z8r n LEU 141 Cb 0.74 -0.51 -0.08 0.00 -0.00 0.00 0.00 43.42 43.57 1z8r n LEU 141 CO -0.02 -0.45 1.09 -2.67 -0.00 0.00 0.00 177.39 175.35 1z8r n TRP 142 N -2.22 0.60 0.00 1.96 4.27 -1.26 -3.43 117.44 117.36 1z8r n TRP 142 Ca 0.03 -0.09 0.00 0.00 -3.89 0.00 0.00 57.50 53.55 1z8r n TRP 142 Cb 0.28 -1.86 0.00 0.00 -1.36 0.00 0.00 31.31 28.37 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 14.51 0.00 0.00 5.67 4.32 -1.26 -4.99 117.00 135.24 1z8r n LEU 143 Ca 0.30 0.00 -0.00 0.00 -0.02 0.00 0.00 56.01 56.28 1z8r n LEU 143 Cb 0.46 0.16 0.00 0.00 -1.62 0.00 0.00 43.42 42.42 1z8r n LEU 143 CO 0.58 -0.29 0.01 -0.62 -1.22 0.00 0.00 177.39 175.85 1z8r n GLU 144 N -2.08 0.02 -1.74 3.23 -0.58 -1.22 -4.42 120.64 113.85 1z8r n GLU 144 Ca 0.00 -0.05 -0.39 0.00 -0.42 0.00 0.00 57.16 56.30 1z8r n GLU 144 Cb 0.00 0.05 0.03 0.00 -0.57 0.00 0.00 31.44 30.96 1z8r n GLU 144 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1z8r n ASP 145 N -1.26 2.82 -4.86 1.62 8.00 -1.26 -5.01 116.55 116.59 1z8r n ASP 145 Ca -0.00 1.03 -0.27 0.00 0.71 0.00 0.00 54.79 56.26 1z8r n ASP 145 Cb 0.01 -1.57 -0.04 0.00 -0.02 0.00 0.00 41.12 39.49 1z8r n ASP 145 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1z8r s ASP 146 N -0.76 5.89 0.07 -2.24 1.01 -1.26 -4.67 116.67 114.71 1z8r s ASP 146 Ca 0.68 0.02 -0.31 0.00 0.71 0.00 0.00 52.55 53.65 1z8r s ASP 146 Cb -0.43 -1.66 -0.06 0.00 1.01 0.00 0.00 42.92 41.78 1z8r s ASP 146 CO 0.52 0.07 1.23 0.00 0.21 0.00 0.00 175.17 177.20 1z8r s ALA 147 N -1.71 3.42 0.20 5.23 0.00 -1.22 -4.80 121.76 122.89 1z8r s ALA 147 Ca 0.32 0.89 0.04 0.00 0.00 0.00 0.00 51.96 53.21 1z8r s ALA 147 Cb -0.11 -3.46 -0.01 0.00 0.00 0.00 0.00 23.12 19.54 1z8r s ALA 147 CO 0.26 -0.46 0.19 -1.33 0.00 0.00 0.00 175.76 174.42 1z8r n MET 148 N 3.92 0.27 0.00 0.00 2.81 -1.26 -3.38 117.12 119.48 1z8r n MET 148 Ca 0.09 -2.00 0.00 0.00 -1.81 0.00 0.00 57.70 53.98 1z8r n MET 148 Cb 0.46 1.67 0.00 0.00 -0.71 0.00 0.00 33.22 34.64 1z8r n MET 148 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1z8r n GLU 149 N -0.38 0.00 -0.56 0.03 2.13 -1.26 -5.12 120.64 115.48 1z8r n GLU 149 Ca 0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.86 1z8r n GLU 149 Cb 0.37 -0.07 0.00 0.00 0.27 0.00 0.00 31.44 32.01 1z8r n GLU 149 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76