#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 0.37 -1.41 1.61 -0.02 -1.26 -4.62 135.00 129.67 1z8r n PRO 2 Ca 0.00 -0.47 0.19 0.00 -2.02 0.00 0.00 63.50 61.20 1z8r n PRO 2 Cb 0.00 -2.66 -0.06 0.00 -0.02 0.00 0.00 33.50 30.76 1z8r n PRO 2 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1z8r n TYR 3 N 13.67 -3.61 -4.37 6.00 4.02 -1.26 -4.95 117.16 126.66 1z8r n TYR 3 Ca 0.54 1.85 0.00 0.00 -0.01 0.00 0.00 57.90 60.28 1z8r n TYR 3 Cb 0.32 -3.28 0.00 0.00 -0.02 0.00 0.00 39.34 36.36 1z8r n TYR 3 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1z8r n GLY 4 N -4.23 0.34 3.04 2.72 0.00 -1.26 -4.83 105.19 100.97 1z8r n GLY 4 Ca -0.02 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.33 -1.09 1.61 2.46 -1.26 -5.06 115.29 111.62 1z8r s HIS 5 Ca 0.00 0.79 -0.19 0.00 0.47 0.00 0.00 55.06 56.13 1z8r s HIS 5 Cb 0.00 0.02 -0.07 0.00 -0.13 0.00 0.00 32.58 32.41 1z8r s HIS 5 CO 0.00 -0.24 2.05 1.04 -2.47 0.00 0.00 174.74 175.12 1z8r n GLN 6 N 4.38 2.13 -3.93 2.88 6.02 -1.26 -4.86 117.38 122.73 1z8r n GLN 6 Ca -0.23 -2.22 -0.35 0.00 -0.01 0.00 0.00 57.00 54.19 1z8r n GLN 6 Cb 0.52 -3.12 -0.14 0.00 1.02 0.00 0.00 30.24 28.53 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 4.25 4.59 0.00 1.08 0.01 -1.26 -4.74 113.70 117.63 1z8r s SER 7 Ca 0.53 -1.01 0.00 0.00 1.31 0.00 0.00 55.95 56.78 1z8r s SER 7 Cb 0.14 -1.70 0.00 0.00 0.21 0.00 0.00 66.02 64.67 1z8r s SER 7 CO 0.03 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.11 1z8r n GLY 8 N 4.66 0.41 3.37 3.44 0.00 -1.26 -4.91 105.19 110.91 1z8r n GLY 8 Ca -0.15 0.06 -0.19 0.00 0.00 0.00 0.00 46.02 45.74 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 2.06 -0.25 4.61 0.00 -1.26 -4.77 121.76 122.14 1z8r s ALA 9 Ca 0.00 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.17 1z8r s ALA 9 Cb 0.00 0.23 0.07 0.00 0.00 0.00 0.00 23.12 23.42 1z8r s ALA 9 CO 0.00 -0.11 -0.00 0.54 0.00 0.00 0.00 175.76 176.19 1z8r s VAL 10 N -3.16 1.33 -0.18 0.00 0.11 -0.98 -4.97 120.40 112.55 1z8r s VAL 10 Ca 0.27 -1.26 -0.07 0.00 -2.93 0.00 0.00 61.98 57.99 1z8r s VAL 10 Cb 0.04 -1.74 -0.04 0.00 -1.53 0.00 0.00 36.38 33.11 1z8r s VAL 10 CO 0.09 -0.27 0.05 -0.72 -3.33 0.00 0.00 175.10 170.93 1z8r s TYR 11 N 1.46 3.22 -0.08 1.54 1.13 -1.26 -1.90 117.35 121.46 1z8r s TYR 11 Ca -0.01 0.01 0.05 0.00 -1.41 0.00 0.00 57.07 55.71 1z8r s TYR 11 Cb -0.18 -2.07 -0.01 0.00 -1.10 0.00 0.00 41.96 38.60 1z8r s TYR 11 CO -0.10 0.11 -0.23 0.08 -2.51 0.00 0.00 175.55 172.90 1z8r s VAL 12 N 0.43 2.18 0.00 -3.49 1.01 0.19 -4.16 120.40 116.56 1z8r s VAL 12 Ca 0.02 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 61.00 1z8r s VAL 12 Cb -0.13 -1.82 0.00 0.00 0.00 0.00 0.00 36.38 34.44 1z8r s VAL 12 CO 0.01 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.28 1z8r n GLY 13 N 3.17 3.11 1.15 4.51 0.00 -1.26 -0.12 105.19 115.74 1z8r n GLY 13 Ca -0.18 0.01 0.05 0.00 0.00 0.00 0.00 46.02 45.89 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 3.37 3.30 -4.17 1.61 4.13 -1.26 -4.33 115.26 117.90 1z8r n ASN 14 Ca 0.00 -2.38 -0.19 0.00 1.68 0.00 0.00 54.58 53.69 1z8r n ASN 14 Cb 0.00 -0.51 -0.12 0.00 -1.54 0.00 0.00 39.78 37.60 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 -1.84 1.27 -0.15 3.10 2.02 0.83 -2.05 117.35 120.52 1z8r s TYR 15 Ca 0.30 -0.42 -0.01 0.00 -0.37 0.00 0.00 57.07 56.57 1z8r s TYR 15 Cb 0.21 -0.73 0.04 0.00 -0.40 0.00 0.00 41.96 41.09 1z8r s TYR 15 CO 0.12 0.06 -0.01 0.21 -1.57 0.00 0.00 175.55 174.36 1z8r s LYS 16 N -1.54 1.00 -0.26 -0.62 2.20 0.28 0.56 119.74 121.36 1z8r s LYS 16 Ca 0.00 -0.35 -0.10 0.00 -0.36 0.00 0.00 55.97 55.17 1z8r s LYS 16 Cb -0.09 -1.80 -0.04 0.00 -1.51 0.00 0.00 37.83 34.38 1z8r s LYS 16 CO 0.02 -0.47 0.14 0.14 -0.36 0.00 0.00 175.35 174.83 1z8r s VAL 17 N 1.78 5.01 0.11 4.02 -7.23 -0.80 -1.22 120.40 122.07 1z8r s VAL 17 Ca 0.01 0.06 0.01 0.00 -1.81 0.00 0.00 61.98 60.25 1z8r s VAL 17 Cb -0.15 -3.36 -0.04 0.00 0.56 0.00 0.00 36.38 33.39 1z8r s VAL 17 CO -0.07 0.30 -0.03 0.54 -0.31 0.00 0.00 175.10 175.53 1z8r s VAL 18 N 1.52 0.53 0.42 1.32 0.11 -0.85 -2.32 120.40 121.14 1z8r s VAL 18 Ca 0.07 -1.92 -0.26 0.00 -2.93 0.00 0.00 61.98 56.94 1z8r s VAL 18 Cb -0.15 -1.77 -0.09 0.00 -1.53 0.00 0.00 36.38 32.83 1z8r s VAL 18 CO 0.07 -0.78 1.45 0.20 -3.33 0.00 0.00 175.10 172.71 1z8r s ASN 19 N -3.04 6.04 0.17 3.54 -0.87 -1.26 -2.35 114.94 117.16 1z8r s ASN 19 Ca 0.14 2.97 -0.14 0.00 -1.57 0.00 0.00 52.86 54.26 1z8r s ASN 19 Cb 0.06 -2.66 0.11 0.00 -0.02 0.00 0.00 41.25 38.74 1z8r s ASN 19 CO -0.03 -1.07 1.75 0.08 -2.57 0.00 0.00 177.10 175.26 1z8r h ARG 20 N 2.57 0.33 0.00 -0.60 0.11 -0.16 0.13 114.38 116.76 1z8r h ARG 20 Ca -0.51 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.55 1z8r h ARG 20 Cb 1.26 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 32.26 1z8r h ARG 20 CO 0.62 0.22 0.00 1.58 0.10 0.00 0.00 179.97 182.49 1z8r n HIS 21 N -4.99 0.00 0.24 4.08 -0.00 -1.26 -2.28 115.22 111.01 1z8r n HIS 21 Ca 0.03 0.00 0.03 0.00 0.46 0.00 0.00 57.72 58.24 1z8r n HIS 21 Cb 0.15 -0.32 0.02 0.00 -0.12 0.00 0.00 29.99 29.72 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 -1.32 1.31 -4.69 0.27 7.94 0.22 -5.00 117.00 115.74 1z8r n LEU 22 Ca 0.06 -0.93 -0.40 0.00 -1.11 0.00 0.00 56.01 53.63 1z8r n LEU 22 Cb 0.12 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.03 1z8r n LEU 22 CO 0.12 0.28 0.42 0.00 -1.11 0.00 0.00 177.39 177.09 1z8r s ALA 23 N -0.62 3.44 0.79 1.96 0.00 0.15 -4.85 121.76 122.64 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 -2.99 0.07 0.00 0.00 0.00 0.00 23.12 20.24 1z8r s ALA 23 CO 0.09 -0.34 1.09 -0.08 0.00 0.00 0.00 175.76 176.52 1z8r s THR 24 N 1.39 3.13 0.54 0.00 -1.32 -1.26 -4.83 115.64 113.28 1z8r s THR 24 Ca 0.34 0.37 0.27 0.00 -1.21 0.00 0.00 61.69 61.46 1z8r s THR 24 Cb -0.17 -3.10 0.42 0.00 -1.51 0.00 0.00 72.50 68.14 1z8r s THR 24 CO 0.14 -0.48 1.97 -0.74 -2.21 0.00 0.00 174.62 173.30 1z8r h HIS 25 N -1.07 0.00 -0.04 9.09 2.76 -1.99 0.28 115.15 124.18 1z8r h HIS 25 Ca -0.47 0.00 -0.13 0.00 -2.20 0.00 0.00 60.37 57.57 1z8r h HIS 25 Cb 1.26 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.21 1z8r h HIS 25 CO 0.48 0.00 -0.60 -0.24 -1.30 0.00 0.00 177.93 176.27 1z8r h VAL 26 N 0.00 1.41 -0.30 5.26 3.04 -1.98 0.81 116.25 124.48 1z8r h VAL 26 Ca 0.29 -2.00 -0.08 0.00 -1.01 0.00 0.00 66.70 63.90 1z8r h VAL 26 Cb 1.17 2.04 -0.01 0.00 -2.01 0.00 0.00 31.29 32.49 1z8r h VAL 26 CO -0.00 0.58 -0.11 0.44 -1.01 0.00 0.00 177.57 177.47 1z8r h ASP 27 N 0.09 0.62 0.42 3.17 5.19 -0.79 -2.53 116.42 122.58 1z8r h ASP 27 Ca -0.01 -0.39 -0.18 0.00 -0.62 0.00 0.00 57.03 55.84 1z8r h ASP 27 Cb 1.07 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 40.40 1z8r h ASP 27 CO 0.08 0.87 -0.75 -0.50 -3.12 0.00 0.00 179.24 175.83 1z8r h TRP 28 N 0.36 0.37 -0.67 4.55 4.06 -1.41 -0.83 115.95 122.39 1z8r h TRP 28 Ca 0.07 -0.17 0.06 0.00 2.06 0.00 0.00 58.89 60.91 1z8r h TRP 28 Cb 0.62 -0.05 -0.06 0.00 -1.00 0.00 0.00 29.16 28.67 1z8r h TRP 28 CO 0.06 0.92 0.37 0.37 -3.56 0.00 0.00 178.44 176.60 1z8r h GLN 29 N 0.18 0.66 -0.42 0.49 5.75 -0.71 -2.18 115.11 118.89 1z8r h GLN 29 Ca -0.03 -0.04 -0.22 0.00 -0.15 0.00 0.00 58.65 58.21 1z8r h GLN 29 Cb 1.32 -0.15 -0.13 0.00 1.07 0.00 0.00 27.48 29.59 1z8r h GLN 29 CO 0.12 0.44 -0.01 0.09 -2.65 0.00 0.00 178.83 176.82 1z8r n ASN 30 N -4.79 2.57 -4.72 -0.69 4.13 -0.97 -5.01 115.26 105.79 1z8r n ASN 30 Ca 0.09 -3.78 -0.42 0.00 1.68 0.00 0.00 54.58 52.15 1z8r n ASN 30 Cb 0.18 -0.66 -0.03 0.00 -1.54 0.00 0.00 39.78 37.72 1z8r n ASN 30 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1z8r n VAL 32 N 3.43 1.67 -4.02 0.00 0.24 0.29 -4.95 118.33 114.98 1z8r n VAL 32 Ca 0.06 -0.63 -0.09 0.00 -2.04 0.00 0.00 64.34 61.64 1z8r n VAL 32 Cb 0.48 -1.59 -0.11 0.00 -1.47 0.00 0.00 33.84 31.15 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 -2.54 0.38 -0.28 6.34 -0.00 -1.06 -4.98 118.94 116.80 1z8r s TRP 33 Ca -0.27 -0.71 -0.10 0.00 -0.00 0.00 0.00 56.10 55.03 1z8r s TRP 33 Cb 0.08 -0.27 0.12 0.00 -0.00 0.00 0.00 33.47 33.39 1z8r s TRP 33 CO 0.71 -0.24 0.61 -2.00 -0.00 0.00 0.00 176.95 176.02 1z8r s GLU 34 N -2.30 0.54 -0.28 5.86 -6.30 -1.26 0.76 118.70 115.72 1z8r s GLU 34 Ca -0.08 1.37 -0.07 0.00 -2.50 0.00 0.00 54.97 53.69 1z8r s GLU 34 Cb -0.04 0.74 -0.01 0.00 0.00 0.00 0.00 34.13 34.83 1z8r s GLU 34 CO -0.04 -0.21 0.09 -0.51 0.02 0.00 0.00 175.26 174.61 1z8r s ASP 35 N 2.78 5.17 0.39 -1.70 1.01 0.11 -4.97 116.67 119.46 1z8r s ASP 35 Ca -0.05 -0.49 0.13 0.00 0.71 0.00 0.00 52.55 52.84 1z8r s ASP 35 Cb -0.12 -1.91 0.80 0.00 1.01 0.00 0.00 42.92 42.70 1z8r s ASP 35 CO -0.18 -0.13 1.87 0.10 0.21 0.00 0.00 175.17 177.04 1z8r h TYR 36 N 8.25 0.00 0.00 4.23 -0.00 -1.96 0.65 116.97 128.15 1z8r h TYR 36 Ca -0.34 0.00 -0.04 0.00 0.00 0.00 0.00 58.73 58.35 1z8r h TYR 36 Cb 1.15 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.87 1z8r h TYR 36 CO 0.63 0.32 -0.19 -2.95 -0.00 0.00 0.00 178.16 175.97 1z8r h ASN 37 N 0.00 0.00 -0.00 0.10 7.08 -1.92 -2.98 115.58 117.86 1z8r h ASN 37 Ca -0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1z8r h ASN 37 Cb 0.57 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.81 1z8r h ASN 37 CO 0.04 0.19 -0.01 0.54 -2.08 0.00 0.00 177.43 176.11 1z8r n ARG 38 N -3.71 0.08 -3.68 4.14 1.74 -0.89 -0.27 116.66 114.06 1z8r n ARG 38 Ca -0.01 -0.62 -0.28 0.00 -0.77 0.00 0.00 57.85 56.17 1z8r n ARG 38 Cb 0.31 -1.02 0.01 0.00 -1.02 0.00 0.00 32.46 30.74 1z8r n ARG 38 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1z8r n ASP 39 N 0.05 -4.27 -4.30 0.55 8.00 0.22 -4.88 116.55 111.93 1z8r n ASP 39 Ca 0.02 -0.63 -0.23 0.00 0.71 0.00 0.00 54.79 54.67 1z8r n ASP 39 Cb 0.07 -3.46 -0.12 0.00 -0.02 0.00 0.00 41.12 37.59 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 -6.93 2.36 0.05 0.64 2.96 -0.96 0.62 118.68 117.42 1z8r s LEU 40 Ca 0.55 -0.76 -0.06 0.00 -0.22 0.00 0.00 54.13 53.64 1z8r s LEU 40 Cb -0.28 -0.84 -0.01 0.00 0.50 0.00 0.00 46.19 45.56 1z8r s LEU 40 CO 0.68 0.01 0.10 -1.48 -1.32 0.00 0.00 176.35 174.33 1z8r s LEU 41 N -2.24 1.80 -0.10 -0.68 -0.00 -0.99 0.03 118.68 116.51 1z8r s LEU 41 Ca 0.10 -0.59 0.04 0.00 -0.00 0.00 0.00 54.13 53.68 1z8r s LEU 41 Cb -0.08 0.63 0.00 0.00 -0.00 0.00 0.00 46.19 46.75 1z8r s LEU 41 CO 0.05 -0.55 -0.24 -0.69 -0.00 0.00 0.00 176.35 174.92 1z8r s VAL 42 N -2.91 2.04 0.23 1.48 1.01 0.23 -2.00 120.40 120.48 1z8r s VAL 42 Ca -0.02 -1.01 0.11 0.00 0.00 0.00 0.00 61.98 61.06 1z8r s VAL 42 Cb 0.01 -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 0.00 175.10 174.44 1z8r s SER 43 N 0.35 3.44 -0.24 3.32 1.04 -0.36 0.10 113.70 121.36 1z8r s SER 43 Ca -0.19 -0.95 -0.13 0.00 0.48 0.00 0.00 55.95 55.16 1z8r s SER 43 Cb -0.18 -0.27 -0.04 0.00 0.10 0.00 0.00 66.02 65.63 1z8r s SER 43 CO 0.09 0.06 0.28 0.42 0.98 0.00 0.00 173.24 175.07 1z8r s THR 44 N -2.15 5.27 -0.03 2.02 -4.23 -1.13 0.10 115.64 115.49 1z8r s THR 44 Ca 0.25 0.41 0.06 0.00 -1.18 0.00 0.00 61.69 61.24 1z8r s THR 44 Cb -0.06 -3.61 -0.02 0.00 1.34 0.00 0.00 72.50 70.14 1z8r s THR 44 CO 0.12 0.26 -0.21 0.28 -0.54 0.00 0.00 174.62 174.54 1z8r s THR 45 N 1.45 2.51 -0.59 3.99 -1.32 -0.87 -4.97 115.64 115.85 1z8r s THR 45 Ca 0.12 -0.94 -0.02 0.00 -1.21 0.00 0.00 61.69 59.63 1z8r s THR 45 Cb -0.15 -1.93 0.26 0.00 -1.51 0.00 0.00 72.50 69.17 1z8r s THR 45 CO 0.08 0.58 2.26 0.35 -2.21 0.00 0.00 174.62 175.67 1z8r n THR 46 N 2.35 3.37 -4.72 5.08 -2.24 -1.26 -4.50 114.28 112.36 1z8r n THR 46 Ca -0.17 -3.10 -0.32 0.00 -2.27 0.00 0.00 64.05 58.19 1z8r n THR 46 Cb 0.52 -1.35 -0.08 0.00 -2.10 0.00 0.00 70.33 67.31 1z8r n THR 46 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1z8r s ALA 47 N -2.87 3.87 -0.22 6.98 0.00 -1.26 -5.11 121.76 123.15 1z8r s ALA 47 Ca 0.53 -0.72 -0.22 0.00 0.00 0.00 0.00 51.96 51.56 1z8r s ALA 47 Cb 0.40 0.11 -0.02 0.00 0.00 0.00 0.00 23.12 23.62 1z8r s ALA 47 CO -0.19 -0.06 0.69 -1.01 0.00 0.00 0.00 175.76 175.19 1z8r s HIS 48 N -2.89 3.34 1.28 0.00 3.76 -1.26 -4.79 115.29 114.72 1z8r s HIS 48 Ca 0.11 0.97 -0.19 0.00 -0.15 0.00 0.00 55.06 55.80 1z8r s HIS 48 Cb 0.03 -2.89 0.31 0.00 1.11 0.00 0.00 32.58 31.14 1z8r s HIS 48 CO 0.06 -0.28 1.01 0.20 -0.85 0.00 0.00 174.74 174.88 1z8r s GLY 49 N 1.32 1.50 0.00 -2.22 0.00 -1.26 -5.00 107.32 101.66 1z8r s GLY 49 Ca 0.30 -0.68 0.00 0.00 0.00 0.00 0.00 44.72 44.35 1z8r s GLY 49 CO 0.09 0.21 0.00 0.00 0.00 0.00 0.00 173.10 173.40 1z8r s ASP 51 N -2.39 6.81 -0.18 0.00 1.11 -1.26 -5.04 116.67 115.72 1z8r s ASP 51 Ca 0.00 2.21 0.01 0.00 0.18 0.00 0.00 52.55 54.95 1z8r s ASP 51 Cb 0.00 -2.61 0.02 0.00 1.07 0.00 0.00 42.92 41.41 1z8r s ASP 51 CO 0.00 -0.47 -0.19 -0.89 1.18 0.00 0.00 175.17 174.80 1z8r s THR 52 N -1.45 2.01 0.28 -1.27 2.01 -1.26 -4.72 115.64 111.25 1z8r s THR 52 Ca 0.54 -0.93 -0.29 0.00 0.31 0.00 0.00 61.69 61.31 1z8r s THR 52 Cb -0.28 -1.84 -0.10 0.00 0.01 0.00 0.00 72.50 70.30 1z8r s THR 52 CO 0.35 0.51 1.16 -0.63 -0.69 0.00 0.00 174.62 175.32 1z8r s ILE 53 N 1.30 3.33 -0.05 1.82 -1.09 -1.26 0.89 121.20 126.13 1z8r s ILE 53 Ca 0.05 1.30 -0.25 0.00 -2.23 0.00 0.00 60.65 59.52 1z8r s ILE 53 Cb -0.13 -3.83 -0.23 0.00 -1.58 0.00 0.00 42.46 36.69 1z8r s ILE 53 CO -0.12 0.30 1.04 0.00 -1.23 0.00 0.00 174.94 174.93 1z8r h ALA 54 N 3.91 0.04 -0.21 9.38 0.00 0.11 -3.26 119.26 129.22 1z8r h ALA 54 Ca -0.47 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 53.90 1z8r h ALA 54 Cb 1.21 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.98 1z8r h ALA 54 CO 0.68 0.05 -0.08 -2.13 0.00 0.00 0.00 179.25 177.77 1z8r n ARG 55 N -4.54 -1.09 -3.29 0.00 0.00 -1.24 -0.98 116.66 105.52 1z8r n ARG 55 Ca -0.10 0.53 -0.18 0.00 -0.00 0.00 0.00 57.85 58.10 1z8r n ARG 55 Cb 0.48 -4.48 0.00 0.00 0.00 0.00 0.00 32.46 28.46 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 3.31 -1.17 0.00 7.27 -1.26 -5.01 117.38 118.80 1z8r n GLN 57 Ca 0.03 -4.05 -0.33 0.00 0.07 0.00 0.00 57.00 52.72 1z8r n GLN 57 Cb 0.58 -2.17 0.12 0.00 2.41 0.00 0.00 30.24 31.18 1z8r n GLN 57 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1z8r n THR 59 N -3.33 0.41 -4.38 0.00 -1.04 -1.26 -4.84 114.28 99.84 1z8r n THR 59 Ca 0.12 -0.53 -0.33 0.00 -2.04 0.00 0.00 64.05 61.27 1z8r n THR 59 Cb 0.51 -0.22 -0.15 0.00 -1.82 0.00 0.00 70.33 68.65 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 -3.41 2.66 0.00 12.58 -4.23 -1.26 -0.61 115.64 121.36 1z8r s THR 60 Ca -0.03 -0.76 0.00 0.00 -1.18 0.00 0.00 61.69 59.72 1z8r s THR 60 Cb 0.11 -2.14 0.00 0.00 1.34 0.00 0.00 72.50 71.81 1z8r s THR 60 CO 0.83 0.51 0.00 0.61 -0.54 0.00 0.00 174.62 176.03 1z8r n GLY 61 N 4.24 4.64 2.79 3.99 0.00 0.96 -4.81 105.19 117.01 1z8r n GLY 61 Ca -0.19 -1.49 -0.15 0.00 0.00 0.00 0.00 46.02 44.19 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 -1.46 -0.05 -0.18 1.61 0.11 -0.93 0.11 120.40 119.61 1z8r s VAL 62 Ca 0.00 0.20 -0.04 0.00 -2.93 0.00 0.00 61.98 59.21 1z8r s VAL 62 Cb 0.00 -0.09 -0.02 0.00 -1.53 0.00 0.00 36.38 34.73 1z8r s VAL 62 CO 0.00 0.08 -0.02 -0.72 -3.33 0.00 0.00 175.10 171.11 1z8r s TYR 63 N 1.01 3.02 0.11 1.54 -0.85 0.26 -2.28 117.35 120.16 1z8r s TYR 63 Ca -0.08 -0.46 0.08 0.00 -0.52 0.00 0.00 57.07 56.09 1z8r s TYR 63 Cb -0.12 -2.03 -0.04 0.00 0.38 0.00 0.00 41.96 40.15 1z8r s TYR 63 CO -0.03 -0.20 -0.16 -0.59 -1.52 0.00 0.00 175.55 173.05 1z8r s PHE 64 N 0.80 2.58 -2.00 -3.49 -0.71 -1.26 0.11 117.98 114.00 1z8r s PHE 64 Ca -0.01 -0.24 0.00 0.00 -1.04 0.00 0.00 56.93 55.64 1z8r s PHE 64 Cb -0.14 -1.37 0.00 0.00 -1.21 0.00 0.00 43.02 40.30 1z8r s PHE 64 CO 0.02 0.39 0.00 0.00 -1.34 0.00 0.00 175.22 174.29 1z8r n ALA 66 N 0.45 0.93 -0.02 0.00 0.00 -1.26 -3.79 120.51 116.82 1z8r n ALA 66 Ca -0.21 -0.65 -0.02 0.00 0.00 0.00 0.00 53.44 52.56 1z8r n ALA 66 Cb 0.66 -0.49 -0.02 0.00 0.00 0.00 0.00 19.45 19.60 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 -3.93 3.78 -1.58 0.00 2.88 -1.26 -4.24 113.62 109.27 1z8r n SER 67 Ca -0.36 -0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.16 1z8r n SER 67 Cb 0.88 -0.01 0.00 0.00 -0.75 0.00 0.00 64.21 64.33 1z8r n SER 67 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1z8r n LYS 68 N -2.56 1.63 -1.14 -1.46 4.76 -1.26 -4.85 118.16 113.28 1z8r n LYS 68 Ca -0.06 0.00 -0.25 0.00 -2.87 0.00 0.00 58.31 55.14 1z8r n LYS 68 Cb 0.57 0.00 0.13 0.00 -1.84 0.00 0.00 35.03 33.88 1z8r n LYS 68 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1z8r n SER 69 N -1.37 4.98 -4.04 4.39 3.41 -1.26 -3.40 113.62 116.34 1z8r n SER 69 Ca 0.00 -3.49 -0.12 0.00 -0.26 0.00 0.00 58.87 55.00 1z8r n SER 69 Cb 0.00 -0.87 -0.08 0.00 -0.26 0.00 0.00 64.21 63.00 1z8r n SER 69 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1z8r s LYS 70 N -3.07 1.38 0.15 4.33 3.01 -1.26 -4.87 119.74 119.40 1z8r s LYS 70 Ca 0.53 -1.54 -0.26 0.00 -1.01 0.00 0.00 55.97 53.69 1z8r s LYS 70 Cb 0.43 0.35 -0.08 0.00 -1.01 0.00 0.00 37.83 37.52 1z8r s LYS 70 CO 0.06 -0.51 0.79 -1.01 0.51 0.00 0.00 175.35 175.19 1z8r s HIS 71 N -4.02 3.89 -0.20 3.18 3.76 -1.26 -2.42 115.29 118.21 1z8r s HIS 71 Ca 0.33 1.63 0.01 0.00 -0.15 0.00 0.00 55.06 56.88 1z8r s HIS 71 Cb 0.04 -2.79 0.04 0.00 1.11 0.00 0.00 32.58 30.98 1z8r s HIS 71 CO 0.12 0.47 -0.09 0.71 -0.85 0.00 0.00 174.74 175.10 1z8r s TYR 72 N -0.95 2.34 -0.14 1.40 1.51 0.30 -4.92 117.35 116.89 1z8r s TYR 72 Ca 0.37 -1.55 -0.29 0.00 -1.01 0.00 0.00 57.07 54.58 1z8r s TYR 72 Cb -0.23 -1.60 -0.02 0.00 -0.11 0.00 0.00 41.96 40.00 1z8r s TYR 72 CO 0.26 -0.73 1.30 -2.14 -1.11 0.00 0.00 175.55 173.13 1z8r s PRO 73 N 1.42 4.24 0.05 -1.71 0.02 -1.26 0.92 135.00 138.68 1z8r s PRO 73 Ca -0.01 1.73 -0.01 0.00 0.02 0.00 0.00 61.00 62.73 1z8r s PRO 73 Cb -0.16 -3.76 -0.04 0.00 0.02 0.00 0.00 34.50 30.56 1z8r s PRO 73 CO -0.08 -0.69 -0.03 0.54 -0.33 0.00 0.00 177.00 176.41 1z8r s VAL 74 N 3.38 0.23 -0.24 3.83 0.11 0.30 -4.93 120.40 123.07 1z8r s VAL 74 Ca 0.57 -1.71 -0.09 0.00 -2.93 0.00 0.00 61.98 57.82 1z8r s VAL 74 Cb -0.24 -1.38 -0.04 0.00 -1.53 0.00 0.00 36.38 33.19 1z8r s VAL 74 CO 0.17 -0.93 0.13 -0.44 -3.33 0.00 0.00 175.10 170.70 1z8r s SER 75 N -2.75 5.79 0.25 3.54 0.01 -1.26 -0.03 113.70 119.25 1z8r s SER 75 Ca 0.05 0.01 0.08 0.00 1.31 0.00 0.00 55.95 57.40 1z8r s SER 75 Cb 0.06 -2.04 -0.05 0.00 0.21 0.00 0.00 66.02 64.19 1z8r s SER 75 CO -0.09 0.04 -0.12 0.72 0.41 0.00 0.00 173.24 174.20 1z8r s PHE 76 N 1.18 1.90 0.24 2.43 -0.12 0.21 -4.26 117.98 119.57 1z8r s PHE 76 Ca 0.06 -0.58 0.09 0.00 -0.05 0.00 0.00 56.93 56.45 1z8r s PHE 76 Cb -0.14 -0.95 -0.04 0.00 -0.63 0.00 0.00 43.02 41.26 1z8r s PHE 76 CO 0.05 0.39 0.02 -1.21 -0.05 0.00 0.00 175.22 174.42 1z8r s GLU 77 N -3.65 2.38 -0.96 1.99 2.02 -0.69 -4.61 118.70 115.18 1z8r s GLU 77 Ca 0.26 -1.31 -0.01 0.00 0.02 0.00 0.00 54.97 53.93 1z8r s GLU 77 Cb 0.00 -2.25 0.30 0.00 0.10 0.00 0.00 34.13 32.29 1z8r s GLU 77 CO 0.10 0.39 1.40 0.41 0.02 0.00 0.00 175.26 177.58 1z8r n GLY 78 N -0.75 5.36 3.74 -1.39 0.00 -1.26 -2.29 105.19 108.60 1z8r n GLY 78 Ca -0.07 -2.68 -0.41 0.00 0.00 0.00 0.00 46.02 42.86 1z8r n GLY 78 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1z8r s PRO 79 N -3.13 4.34 0.00 1.61 0.04 -1.05 -4.88 135.00 131.93 1z8r s PRO 79 Ca 0.35 2.16 0.00 0.00 0.04 0.00 0.00 61.00 63.56 1z8r s PRO 79 Cb 0.11 -3.15 0.00 0.00 0.04 0.00 0.00 34.50 31.51 1z8r s PRO 79 CO 0.02 -0.30 0.15 0.41 0.04 0.00 0.00 177.00 177.33 1z8r n GLY 80 N 2.08 -2.47 3.61 0.56 0.00 -1.26 -2.43 105.19 105.27 1z8r n GLY 80 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.32 4.05 -0.13 0.99 1.98 -1.26 0.11 118.68 124.10 1z8r s LEU 81 Ca 0.00 0.35 0.01 0.00 -2.89 0.00 0.00 54.13 51.60 1z8r s LEU 81 Cb 0.00 -2.50 0.02 0.00 0.66 0.00 0.00 46.19 44.37 1z8r s LEU 81 CO 0.00 -0.22 -0.15 -0.69 -1.89 0.00 0.00 176.35 173.39 1z8r s VAL 82 N 2.15 1.56 -0.43 1.68 1.01 0.19 -4.97 120.40 121.59 1z8r s VAL 82 Ca 0.17 -0.66 -0.28 0.00 0.00 0.00 0.00 61.98 61.21 1z8r s VAL 82 Cb -0.16 -1.44 -0.00 0.00 0.00 0.00 0.00 36.38 34.78 1z8r s VAL 82 CO 0.10 0.45 1.60 -1.61 0.00 0.00 0.00 175.10 175.64 1z8r s GLU 83 N 1.17 3.32 -0.28 2.72 2.02 -1.26 -1.18 118.70 125.22 1z8r s GLU 83 Ca -0.02 0.98 -0.29 0.00 0.02 0.00 0.00 54.97 55.66 1z8r s GLU 83 Cb -0.14 -4.15 -0.01 0.00 0.10 0.00 0.00 34.13 29.93 1z8r s GLU 83 CO -0.05 -1.88 1.44 0.54 0.02 0.00 0.00 175.26 175.33 1z8r s VAL 84 N 6.51 3.94 0.48 2.63 0.11 0.19 -4.92 120.40 129.33 1z8r s VAL 84 Ca 0.67 1.05 -0.20 0.00 -2.93 0.00 0.00 61.98 60.57 1z8r s VAL 84 Cb -0.16 -3.98 -0.09 0.00 -1.53 0.00 0.00 36.38 30.62 1z8r s VAL 84 CO 0.30 -0.43 1.02 -1.58 -3.33 0.00 0.00 175.10 171.08 1z8r s GLN 85 N 4.46 3.89 -0.56 1.54 0.74 -1.26 -1.04 119.66 127.43 1z8r s GLN 85 Ca 0.63 1.29 -0.27 0.00 0.05 0.00 0.00 55.36 57.06 1z8r s GLN 85 Cb -0.20 -2.11 -0.03 0.00 1.10 0.00 0.00 33.01 31.77 1z8r s GLN 85 CO 0.26 -0.34 1.95 -2.00 -0.55 0.00 0.00 175.29 174.61 1z8r s GLU 86 N -3.26 2.61 -0.04 1.67 2.12 -1.22 -4.52 118.70 116.05 1z8r s GLU 86 Ca 0.66 0.83 -0.06 0.00 0.36 0.00 0.00 54.97 56.75 1z8r s GLU 86 Cb -0.14 -4.40 0.01 0.00 0.26 0.00 0.00 34.13 29.86 1z8r s GLU 86 CO 0.19 -2.74 0.16 -1.12 -0.54 0.00 0.00 175.26 171.21 1z8r s SER 87 N 8.58 -0.11 0.00 -1.70 0.01 -0.90 -4.92 113.70 114.65 1z8r s SER 87 Ca 0.74 0.17 0.00 0.00 1.31 0.00 0.00 55.95 58.17 1z8r s SER 87 Cb -0.14 0.30 0.00 0.00 0.21 0.00 0.00 66.02 66.39 1z8r s SER 87 CO 0.23 -0.15 0.00 1.21 0.41 0.00 0.00 173.24 174.94 1z8r n GLU 88 N 2.52 0.00 -0.65 12.44 4.07 -1.26 -0.72 120.64 137.03 1z8r n GLU 88 Ca -0.16 0.00 -0.01 0.00 -0.06 0.00 0.00 57.16 56.94 1z8r n GLU 88 Cb 0.58 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 31.95 1z8r n GLU 88 CO 0.00 0.00 0.00 2.48 -0.06 0.00 0.00 177.13 179.55 1z8r n TYR 89 N 0.00 0.00 -3.82 4.31 0.18 -1.26 -5.08 117.16 111.49 1z8r n TYR 89 Ca 0.00 -0.11 -0.36 0.00 1.88 0.00 0.00 57.90 59.31 1z8r n TYR 89 Cb 0.00 0.16 -0.13 0.00 -0.38 0.00 0.00 39.34 38.99 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 3.13 0.59 -3.48 2.02 0.10 -4.90 117.35 114.81 1z8r s TYR 90 Ca 0.03 -1.18 -0.20 0.00 -0.37 0.00 0.00 57.07 55.35 1z8r s TYR 90 Cb 0.03 -2.19 -0.03 0.00 -0.40 0.00 0.00 41.96 39.37 1z8r s TYR 90 CO -0.01 -0.63 1.32 -2.14 -1.57 0.00 0.00 175.55 172.51 1z8r s PRO 91 N 1.44 2.88 -0.66 -1.71 0.02 -1.26 -2.12 135.00 133.59 1z8r s PRO 91 Ca 0.01 2.12 -0.24 0.00 0.02 0.00 0.00 61.00 62.91 1z8r s PRO 91 Cb -0.17 -2.05 -0.20 0.00 0.02 0.00 0.00 34.50 32.10 1z8r s PRO 91 CO 0.00 -1.36 1.86 1.17 -0.33 0.00 0.00 177.00 178.34 1z8r n LYS 92 N -1.45 1.14 -3.23 5.54 3.00 -1.24 -4.39 118.16 117.52 1z8r n LYS 92 Ca 0.13 -1.73 -0.14 0.00 -0.00 0.00 0.00 58.31 56.57 1z8r n LYS 92 Cb 0.47 -2.95 -0.03 0.00 0.00 0.00 0.00 35.03 32.51 1z8r n LYS 92 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 1z8r n ARG 93 N 7.41 1.20 -3.58 1.64 0.63 -0.21 -4.88 116.66 118.86 1z8r n ARG 93 Ca 0.48 -1.72 -0.37 0.00 -0.92 0.00 0.00 57.85 55.33 1z8r n ARG 93 Cb 0.42 0.61 -0.07 0.00 0.45 0.00 0.00 32.46 33.87 1z8r n ARG 93 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1z8r s TYR 94 N -2.01 3.51 -0.07 -0.14 1.51 -1.26 0.56 117.35 119.45 1z8r s TYR 94 Ca 0.03 0.62 0.01 0.00 -1.01 0.00 0.00 57.07 56.72 1z8r s TYR 94 Cb 0.00 -2.28 0.02 0.00 -0.11 0.00 0.00 41.96 39.59 1z8r s TYR 94 CO 0.02 0.35 -0.08 -0.65 -1.11 0.00 0.00 175.55 174.08 1z8r s GLN 95 N 0.10 1.32 0.27 -0.62 -1.52 -0.32 -4.67 119.66 114.22 1z8r s GLN 95 Ca 0.17 -0.24 0.06 0.00 -1.95 0.00 0.00 55.36 53.39 1z8r s GLN 95 Cb -0.13 -1.25 -0.03 0.00 -0.22 0.00 0.00 33.01 31.38 1z8r s GLN 95 CO 0.05 -0.10 0.35 -1.54 -0.25 0.00 0.00 175.29 173.79 1z8r s SER 96 N 1.10 6.02 -1.00 5.90 1.04 0.62 0.58 113.70 127.96 1z8r s SER 96 Ca -0.07 -0.09 -0.04 0.00 0.48 0.00 0.00 55.95 56.23 1z8r s SER 96 Cb -0.14 -1.58 -0.05 0.00 0.10 0.00 0.00 66.02 64.35 1z8r s SER 96 CO -0.01 -0.16 0.86 1.41 0.98 0.00 0.00 173.24 176.32 1z8r n HIS 97 N -1.41 -2.21 -4.80 5.02 8.25 0.30 -4.33 115.22 116.03 1z8r n HIS 97 Ca -0.06 0.81 -0.27 0.00 -0.26 0.00 0.00 57.72 57.93 1z8r n HIS 97 Cb 0.58 -4.20 -0.15 0.00 1.12 0.00 0.00 29.99 27.34 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 -3.35 1.75 -0.03 1.59 0.11 -1.02 -2.34 120.40 117.11 1z8r s VAL 98 Ca 0.32 -1.15 0.00 0.00 -2.93 0.00 0.00 61.98 58.22 1z8r s VAL 98 Cb -0.04 -1.50 -0.04 0.00 -1.53 0.00 0.00 36.38 33.27 1z8r s VAL 98 CO 0.68 0.31 0.01 -0.76 -3.33 0.00 0.00 175.10 172.00 1z8r s LEU 99 N -1.00 3.56 -0.01 2.54 1.02 0.21 -2.52 118.68 122.49 1z8r s LEU 99 Ca 0.08 0.05 0.03 0.00 0.02 0.00 0.00 54.13 54.31 1z8r s LEU 99 Cb -0.09 -1.98 -0.01 0.00 0.02 0.00 0.00 46.19 44.14 1z8r s LEU 99 CO 0.01 0.31 -0.09 -0.76 0.02 0.00 0.00 176.35 175.84 1z8r s LEU 100 N -1.36 1.98 -0.01 1.79 1.43 -0.97 0.16 118.68 121.70 1z8r s LEU 100 Ca 0.18 -0.16 -0.05 0.00 -1.03 0.00 0.00 54.13 53.06 1z8r s LEU 100 Cb -0.11 -0.47 0.00 0.00 0.03 0.00 0.00 46.19 45.64 1z8r s LEU 100 CO 0.08 0.10 0.11 0.00 0.23 0.00 0.00 176.35 176.88 1z8r s ALA 101 N -0.15 -0.26 -0.17 4.21 0.00 -0.71 -1.70 121.76 122.97 1z8r s ALA 101 Ca 0.03 -0.03 -0.06 0.00 0.00 0.00 0.00 51.96 51.89 1z8r s ALA 101 Cb -0.04 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 1z8r s ALA 101 CO -0.00 -0.15 0.05 -0.08 0.00 0.00 0.00 175.76 175.57 1z8r s THR 102 N -0.91 4.66 -0.44 0.00 -1.32 -1.26 0.20 115.64 116.56 1z8r s THR 102 Ca -0.10 -0.09 0.09 0.00 -1.21 0.00 0.00 61.69 60.38 1z8r s THR 102 Cb -0.06 -3.08 0.31 0.00 -1.51 0.00 0.00 72.50 68.17 1z8r s THR 102 CO 0.01 0.49 0.72 0.61 -2.21 0.00 0.00 174.62 174.24 1z8r n GLY 103 N 3.32 3.94 3.55 6.08 0.00 -0.92 -4.79 105.19 116.36 1z8r n GLY 103 Ca -0.17 -1.98 -0.26 0.00 0.00 0.00 0.00 46.02 43.60 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 0.51 1.23 0.00 1.61 3.01 -1.26 -4.11 117.46 118.45 1z8r n PHE 104 Ca 0.26 0.07 0.00 0.00 1.01 0.00 0.00 57.45 58.79 1z8r n PHE 104 Cb 0.55 -2.54 0.00 0.00 -0.01 0.00 0.00 39.48 37.48 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 16.45 0.00 -3.74 4.37 7.64 -1.26 -5.15 113.62 131.92 1z8r n SER 105 Ca 0.44 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 60.20 1z8r n SER 105 Cb 0.46 0.23 -0.07 0.00 -1.01 0.00 0.00 64.21 63.82 1z8r n SER 105 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1z8r s GLU 106 N -1.65 0.82 0.33 1.43 8.01 -1.26 -5.14 118.70 121.24 1z8r s GLU 106 Ca 0.00 -0.48 -0.27 0.00 0.01 0.00 0.00 54.97 54.23 1z8r s GLU 106 Cb 0.00 0.36 -0.13 0.00 -4.31 0.00 0.00 34.13 30.05 1z8r s GLU 106 CO 0.00 -0.26 1.07 -2.30 0.01 0.00 0.00 175.26 173.77 1z8r n PRO 107 N 0.59 1.52 -4.29 0.39 -0.02 -1.26 -4.95 135.00 126.99 1z8r n PRO 107 Ca -0.19 0.54 -0.15 0.00 -2.02 0.00 0.00 63.50 61.68 1z8r n PRO 107 Cb 0.59 -1.99 -0.10 0.00 -0.02 0.00 0.00 33.50 31.98 1z8r n PRO 107 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1z8r s GLY 108 N -0.55 1.50 0.18 -1.23 0.00 -1.26 -4.69 107.32 101.26 1z8r s GLY 108 Ca 0.59 -1.74 0.00 0.00 0.00 0.00 0.00 44.72 43.57 1z8r s GLY 108 CO 0.60 -1.57 0.00 1.34 0.00 0.00 0.00 173.10 173.46 1z8r n ASP 109 N -0.36 -1.60 -4.14 1.64 2.03 -1.26 -4.99 116.55 107.86 1z8r n ASP 109 Ca -0.03 0.55 -0.18 0.00 0.52 0.00 0.00 54.79 55.64 1z8r n ASP 109 Cb 0.65 1.73 -0.12 0.00 -0.72 0.00 0.00 41.12 42.66 1z8r n ASP 109 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1z8r s ALA 110 N -2.00 1.06 0.00 -1.67 0.00 -1.26 -4.49 121.76 113.40 1z8r s ALA 110 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 51.96 51.05 1z8r s ALA 110 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.03 1z8r s ALA 110 CO 0.00 0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.32 1z8r n GLY 111 N 1.47 4.75 0.00 0.00 0.00 -1.26 -4.52 105.19 105.63 1z8r n GLY 111 Ca -0.21 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.76 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 0.00 0.87 3.23 -0.02 0.00 -1.25 -4.67 105.19 103.36 1z8r n GLY 112 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 1.85 1.54 -0.21 -0.61 -4.36 -1.26 -0.65 121.20 117.50 1z8r s ILE 113 Ca 0.00 -1.25 -0.22 0.00 -0.26 0.00 0.00 60.65 58.92 1z8r s ILE 113 Cb 0.00 -1.37 -0.02 0.00 1.25 0.00 0.00 42.46 42.32 1z8r s ILE 113 CO 0.00 0.08 0.71 -0.22 0.24 0.00 0.00 174.94 175.75 1z8r s LEU 114 N -1.37 4.12 -0.04 0.37 2.96 0.24 -4.32 118.68 120.65 1z8r s LEU 114 Ca 0.06 0.92 0.06 0.00 -0.22 0.00 0.00 54.13 54.95 1z8r s LEU 114 Cb -0.09 -3.01 -0.02 0.00 0.50 0.00 0.00 46.19 43.57 1z8r s LEU 114 CO 0.02 -0.36 -0.22 -0.13 -1.32 0.00 0.00 176.35 174.34 1z8r s ARG 115 N 2.25 2.34 0.36 1.98 0.52 -0.97 -0.58 118.95 124.85 1z8r s ARG 115 Ca 0.31 -0.86 0.07 0.00 -0.52 0.00 0.00 55.73 54.74 1z8r s ARG 115 Cb -0.16 -2.17 -0.02 0.00 0.52 0.00 0.00 34.95 33.12 1z8r s ARG 115 CO 0.10 0.53 0.33 0.00 0.02 0.00 0.00 175.30 176.28 1z8r h GLU 117 N 1.16 0.00 0.08 0.00 5.08 -1.97 -0.58 114.58 118.35 1z8r h GLU 117 Ca -0.44 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 57.59 1z8r h GLU 117 Cb 1.26 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.48 1z8r h GLU 117 CO 0.58 0.00 -1.85 0.45 -1.00 0.00 0.00 179.01 177.19 1z8r h HIS 118 N 0.00 0.31 0.00 4.33 3.86 -1.93 -3.51 115.15 118.20 1z8r h HIS 118 Ca 0.00 -0.22 0.00 0.00 -1.16 0.00 0.00 60.37 58.99 1z8r h HIS 118 Cb 0.42 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.87 1z8r h HIS 118 CO 0.00 1.46 0.00 0.41 0.86 0.00 0.00 177.93 180.66 1z8r n GLY 119 N 1.80 -0.74 3.77 2.45 0.00 -0.23 -4.49 105.19 107.75 1z8r n GLY 119 Ca -0.25 -0.27 -0.39 0.00 0.00 0.00 0.00 46.02 45.11 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 4.94 -0.16 1.61 1.01 0.26 0.12 120.40 124.18 1z8r s VAL 120 Ca 0.00 1.16 -0.10 0.00 0.00 0.00 0.00 61.98 63.04 1z8r s VAL 120 Cb 0.00 -3.89 -0.07 0.00 0.00 0.00 0.00 36.38 32.42 1z8r s VAL 120 CO 0.00 0.43 -0.24 -0.38 0.00 0.00 0.00 175.10 174.91 1z8r n ILE 121 N 2.68 1.15 -3.43 2.22 5.41 0.25 0.71 119.36 128.35 1z8r n ILE 121 Ca -0.08 -0.13 -0.04 0.00 1.00 0.00 0.00 62.75 63.50 1z8r n ILE 121 Cb 0.51 -1.86 0.01 0.00 -0.71 0.00 0.00 39.64 37.60 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 1.89 1.40 3.51 7.39 0.00 -0.99 0.43 105.19 118.82 1z8r n GLY 122 Ca -0.30 -1.11 -0.25 0.00 0.00 0.00 0.00 46.02 44.37 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 2.66 0.09 0.99 -0.00 -0.38 0.79 118.68 122.84 1z8r s LEU 123 Ca 0.08 -1.17 -0.34 0.00 -0.00 0.00 0.00 54.13 52.71 1z8r s LEU 123 Cb -0.02 -0.94 -0.13 0.00 -0.00 0.00 0.00 46.19 45.09 1z8r s LEU 123 CO 0.05 -0.19 1.67 0.55 -0.00 0.00 0.00 176.35 178.43 1z8r n VAL 124 N -0.72 0.17 0.00 1.48 3.14 0.18 0.66 118.33 123.24 1z8r n VAL 124 Ca -0.05 -0.03 0.00 0.00 -2.96 0.00 0.00 64.34 61.30 1z8r n VAL 124 Cb 0.63 -1.65 0.00 0.00 -1.06 0.00 0.00 33.84 31.76 1z8r n VAL 124 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 1z8r n THR 125 N 3.94 0.00 -4.63 1.55 -1.04 0.31 -4.72 114.28 109.68 1z8r n THR 125 Ca 0.19 0.00 -0.30 0.00 -2.04 0.00 0.00 64.05 61.89 1z8r n THR 125 Cb 0.29 0.00 -0.17 0.00 -1.82 0.00 0.00 70.33 68.64 1z8r n THR 125 CO 0.00 0.00 0.00 -0.32 -0.64 0.00 0.00 175.07 174.11 1z8r s MET 126 N 0.04 2.62 -0.16 -2.82 1.75 -0.73 -4.95 119.30 115.04 1z8r s MET 126 Ca 0.00 -0.71 -0.03 0.00 -1.25 0.00 0.00 55.69 53.70 1z8r s MET 126 Cb 0.00 -2.14 -0.02 0.00 2.84 0.00 0.00 34.83 35.51 1z8r s MET 126 CO 0.00 -0.01 -0.05 0.20 -0.65 0.00 0.00 175.02 174.50 1z8r s GLY 127 N 0.84 1.67 0.00 2.11 0.00 -1.26 -0.24 107.32 110.43 1z8r s GLY 127 Ca -0.08 -0.88 0.00 0.00 0.00 0.00 0.00 44.72 43.75 1z8r s GLY 127 CO -0.00 -0.02 0.00 0.61 0.00 0.00 0.00 173.10 173.69 1z8r n GLY 128 N 3.72 -0.21 0.25 0.20 0.00 -0.60 -4.92 105.19 103.63 1z8r n GLY 128 Ca -0.18 -1.71 0.16 0.00 0.00 0.00 0.00 46.02 44.29 1z8r n GLY 128 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1z8r h GLU 129 N 0.00 0.00 0.00 1.61 5.08 -1.99 -3.36 114.58 115.92 1z8r h GLU 129 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1z8r h GLU 129 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1z8r h GLU 129 CO 0.00 0.00 -0.05 0.41 -1.00 0.00 0.00 179.01 178.37 1z8r n GLY 130 N 0.22 0.95 3.27 -3.84 0.00 -1.26 -4.80 105.19 99.73 1z8r n GLY 130 Ca 0.01 -0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.86 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 1.39 -0.22 1.61 1.01 -1.26 -2.16 120.40 120.78 1z8r s VAL 131 Ca 0.00 -1.91 -0.02 0.00 0.00 0.00 0.00 61.98 60.05 1z8r s VAL 131 Cb 0.00 -1.73 0.01 0.00 0.00 0.00 0.00 36.38 34.67 1z8r s VAL 131 CO -0.00 -0.53 -0.09 0.68 0.00 0.00 0.00 175.10 175.16 1z8r s VAL 132 N -2.60 2.85 -0.41 2.92 -7.23 0.53 -1.56 120.40 114.90 1z8r s VAL 132 Ca 0.14 -0.79 -0.14 0.00 -1.81 0.00 0.00 61.98 59.37 1z8r s VAL 132 Cb -0.02 -2.33 0.03 0.00 0.56 0.00 0.00 36.38 34.61 1z8r s VAL 132 CO 0.03 0.38 0.30 -0.83 -0.31 0.00 0.00 175.10 174.67 1z8r s GLY 133 N 1.38 2.00 -0.07 2.32 0.00 0.66 -1.74 107.32 111.87 1z8r s GLY 133 Ca 0.04 -1.76 0.01 0.00 0.00 0.00 0.00 44.72 43.01 1z8r s GLY 133 CO -0.06 0.92 -0.08 -1.36 0.00 0.00 0.00 173.10 172.52 1z8r s PHE 134 N 1.66 2.89 -0.24 1.90 0.08 0.12 0.11 117.98 124.50 1z8r s PHE 134 Ca 0.04 -0.02 -0.21 0.00 0.12 0.00 0.00 56.93 56.86 1z8r s PHE 134 Cb -0.20 -1.70 -0.02 0.00 -0.57 0.00 0.00 43.02 40.54 1z8r s PHE 134 CO 0.09 0.30 0.67 0.00 -0.10 0.00 0.00 175.22 176.18 1z8r s ALA 135 N -0.77 3.61 0.27 5.36 0.00 0.21 0.65 121.76 131.09 1z8r s ALA 135 Ca 0.12 -0.34 -0.29 0.00 0.00 0.00 0.00 51.96 51.44 1z8r s ALA 135 Cb -0.11 -3.08 -0.10 0.00 0.00 0.00 0.00 23.12 19.84 1z8r s ALA 135 CO 0.01 -0.79 1.34 0.34 0.00 0.00 0.00 175.76 176.66 1z8r s ASP 136 N 1.40 6.78 0.00 0.00 -1.08 -0.99 -1.25 116.67 121.54 1z8r s ASP 136 Ca 0.28 2.60 0.15 0.00 -0.52 0.00 0.00 52.55 55.07 1z8r s ASP 136 Cb -0.16 -2.63 0.49 0.00 -1.46 0.00 0.00 42.92 39.16 1z8r s ASP 136 CO 0.09 -0.57 1.38 0.52 0.52 0.00 0.00 175.17 177.11 1z8r n VAL 137 N 1.73 0.41 0.71 1.11 0.31 0.17 -4.09 118.33 118.69 1z8r n VAL 137 Ca 0.03 -0.47 0.08 0.00 -0.01 0.00 0.00 64.34 63.97 1z8r n VAL 137 Cb 0.42 0.33 0.39 0.00 -0.91 0.00 0.00 33.84 34.06 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 0.56 0.19 -0.41 5.55 1.74 -1.26 -2.30 116.66 120.73 1z8r n ARG 138 Ca 0.14 0.15 0.11 0.00 -0.77 0.00 0.00 57.85 57.48 1z8r n ARG 138 Cb 0.34 -1.50 0.32 0.00 -1.02 0.00 0.00 32.46 30.60 1z8r n ARG 138 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1z8r n ASP 139 N -1.32 3.92 -2.57 0.55 9.92 -1.26 -4.47 116.55 121.33 1z8r n ASP 139 Ca 0.07 -2.10 -0.04 0.00 -0.53 0.00 0.00 54.79 52.19 1z8r n ASP 139 Cb 0.14 -0.49 0.02 0.00 -0.64 0.00 0.00 41.12 40.14 1z8r n ASP 139 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1z8r n LEU 140 N 1.42 -1.20 0.15 0.64 -0.00 -0.97 -4.99 117.00 112.04 1z8r n LEU 140 Ca 0.24 -2.12 0.12 0.00 -0.00 0.00 0.00 56.01 54.25 1z8r n LEU 140 Cb 0.65 0.67 0.53 0.00 -0.00 0.00 0.00 43.42 45.27 1z8r n LEU 140 CO 0.18 1.30 0.86 -0.11 -0.00 0.00 0.00 177.39 179.61 1z8r n LEU 141 N -0.53 0.68 -4.50 1.47 -0.00 -1.09 -4.59 117.00 108.44 1z8r n LEU 141 Ca -0.20 0.70 -0.12 0.00 -0.00 0.00 0.00 56.01 56.39 1z8r n LEU 141 Cb 0.68 -0.64 -0.10 0.00 -0.00 0.00 0.00 43.42 43.36 1z8r n LEU 141 CO -0.10 -0.67 1.11 -2.67 -0.00 0.00 0.00 177.39 175.06 1z8r n TRP 142 N -2.28 0.80 0.00 1.96 4.27 -1.26 -3.59 117.44 117.33 1z8r n TRP 142 Ca 0.01 -0.11 0.00 0.00 -3.89 0.00 0.00 57.50 53.51 1z8r n TRP 142 Cb 0.19 -2.27 0.00 0.00 -1.36 0.00 0.00 31.31 27.87 1z8r n TRP 142 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1z8r n LEU 143 N 17.33 0.00 0.00 5.67 4.32 -1.26 -4.97 117.00 138.09 1z8r n LEU 143 Ca 0.38 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.37 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 0.59 -0.36 0.00 -0.62 -1.22 0.00 0.00 177.39 175.77 1z8r n GLU 144 N -2.23 0.00 -1.75 3.23 1.02 -1.24 -4.40 120.64 115.27 1z8r n GLU 144 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 1z8r n GLU 144 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.41 1z8r n GLU 144 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1z8r n ASP 145 N -1.04 3.59 -4.81 1.62 5.68 -1.26 -5.00 116.55 115.32 1z8r n ASP 145 Ca 0.00 1.21 -0.27 0.00 -0.50 0.00 0.00 54.79 55.23 1z8r n ASP 145 Cb 0.00 -1.59 -0.05 0.00 -1.14 0.00 0.00 41.12 38.34 1z8r n ASP 145 CO 0.00 0.00 0.00 1.51 -1.33 0.00 0.00 177.20 177.38 1z8r s ASP 146 N -0.04 5.61 0.09 -1.12 -4.77 -1.26 -4.57 116.67 110.62 1z8r s ASP 146 Ca 0.56 -0.08 0.01 0.00 -3.30 0.00 0.00 52.55 49.74 1z8r s ASP 146 Cb -0.50 -1.50 -0.04 0.00 -1.09 0.00 0.00 42.92 39.79 1z8r s ASP 146 CO 0.60 0.08 0.23 0.00 0.70 0.00 0.00 175.17 176.79 1z8r s ALA 147 N -1.69 3.98 0.36 2.11 0.00 -0.16 -4.97 121.76 121.39 1z8r s ALA 147 Ca 0.31 -0.91 0.00 0.00 0.00 0.00 0.00 51.96 51.36 1z8r s ALA 147 Cb -0.10 -1.80 0.00 0.00 0.00 0.00 0.00 23.12 21.21 1z8r s ALA 147 CO 0.24 0.73 0.00 -0.12 0.00 0.00 0.00 175.76 176.61 1z8r n MET 148 N 0.01 0.00 -0.54 0.00 0.00 -1.26 -3.97 117.12 111.36 1z8r n MET 148 Ca -0.06 0.00 -0.28 0.00 0.00 0.00 0.00 57.70 57.36 1z8r n MET 148 Cb 0.52 0.00 0.26 0.00 0.00 0.00 0.00 33.22 34.00 1z8r n MET 148 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 175.97 174.76 1z8r s GLU 149 N -2.00 -1.27 0.00 2.12 2.02 -1.26 -5.01 118.70 113.30 1z8r s GLU 149 Ca 0.00 0.69 0.01 0.00 0.02 0.00 0.00 54.97 55.70 1z8r s GLU 149 Cb 0.00 -1.52 0.01 0.00 0.10 0.00 0.00 34.13 32.72 1z8r s GLU 149 CO 0.00 -3.92 0.54 0.94 0.02 0.00 0.00 175.26 172.84