#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 -1.52 -0.08 1.61 -0.02 -1.26 -4.98 135.00 128.75 1z8r n PRO 2 Ca 0.00 -0.43 -0.22 0.00 -2.02 0.00 0.00 63.50 60.83 1z8r n PRO 2 Cb 0.00 -1.70 -0.12 0.00 -0.02 0.00 0.00 33.50 31.66 1z8r n PRO 2 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1z8r n TYR 3 N -4.38 0.58 0.00 6.00 9.36 -1.26 -5.05 117.16 122.42 1z8r n TYR 3 Ca 0.01 0.16 0.00 0.00 3.32 0.00 0.00 57.90 61.39 1z8r n TYR 3 Cb 0.62 -1.07 0.00 0.00 -0.63 0.00 0.00 39.34 38.26 1z8r n TYR 3 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1z8r n GLY 4 N 1.83 -1.68 0.14 2.98 0.00 -1.26 -5.04 105.19 102.16 1z8r n GLY 4 Ca -0.41 0.56 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 1z8r n GLY 4 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1z8r n HIS 5 N -0.69 0.00 -2.20 1.61 8.25 -1.26 -5.11 115.22 115.82 1z8r n HIS 5 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1z8r n HIS 5 Cb 0.00 -0.90 0.00 0.00 1.12 0.00 0.00 29.99 30.21 1z8r n HIS 5 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1z8r n GLN 6 N -4.28 -4.80 -1.55 -0.41 1.13 -1.26 -4.93 117.38 101.27 1z8r n GLN 6 Ca -0.47 3.52 0.00 0.00 -1.94 0.00 0.00 57.00 58.11 1z8r n GLN 6 Cb 0.82 -4.32 0.00 0.00 0.11 0.00 0.00 30.24 26.85 1z8r n GLN 6 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1z8r n SER 7 N 1.68 -8.23 -2.33 1.08 7.64 -1.26 -5.02 113.62 107.18 1z8r n SER 7 Ca 0.00 1.13 -0.03 0.00 1.01 0.00 0.00 58.87 60.99 1z8r n SER 7 Cb 0.00 -4.11 0.08 0.00 -1.01 0.00 0.00 64.21 59.17 1z8r n SER 7 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1z8r n GLY 8 N 0.18 1.70 1.61 0.23 0.00 -1.26 -5.14 105.19 102.51 1z8r n GLY 8 Ca 0.00 -0.25 -0.09 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.10 0.46 -3.83 4.61 0.00 -1.26 -4.70 120.51 114.69 1z8r n ALA 9 Ca -0.17 -0.89 -0.28 0.00 0.00 0.00 0.00 53.44 52.11 1z8r n ALA 9 Cb 0.85 0.29 -0.16 0.00 0.00 0.00 0.00 19.45 20.42 1z8r n ALA 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1z8r s VAL 10 N -0.73 0.88 -0.10 0.00 0.11 -0.98 -4.96 120.40 114.62 1z8r s VAL 10 Ca 0.21 -0.60 0.00 0.00 -2.93 0.00 0.00 61.98 58.65 1z8r s VAL 10 Cb -0.02 -1.19 -0.02 0.00 -1.53 0.00 0.00 36.38 33.62 1z8r s VAL 10 CO 0.13 -0.01 -0.10 -0.72 -3.33 0.00 0.00 175.10 171.08 1z8r s TYR 11 N 1.72 2.87 -0.12 1.54 1.13 -1.26 -1.45 117.35 121.77 1z8r s TYR 11 Ca -0.00 -0.30 0.03 0.00 -1.41 0.00 0.00 57.07 55.38 1z8r s TYR 11 Cb -0.16 -1.79 0.00 0.00 -1.10 0.00 0.00 41.96 38.91 1z8r s TYR 11 CO -0.07 0.04 -0.22 0.08 -2.51 0.00 0.00 175.55 172.87 1z8r s VAL 12 N -0.15 2.19 0.00 -3.49 1.01 0.30 -4.22 120.40 116.04 1z8r s VAL 12 Ca 0.01 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.03 1z8r s VAL 12 Cb -0.13 -1.86 0.00 0.00 0.00 0.00 0.00 36.38 34.39 1z8r s VAL 12 CO 0.03 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.29 1z8r n GLY 13 N 3.72 3.11 0.90 4.51 0.00 -1.26 -0.01 105.19 116.16 1z8r n GLY 13 Ca -0.19 0.06 0.05 0.00 0.00 0.00 0.00 46.02 45.94 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 3.76 2.56 -4.13 1.61 3.02 -1.26 -4.18 115.26 116.64 1z8r n ASN 14 Ca 0.00 -2.21 -0.22 0.00 -0.03 0.00 0.00 54.58 52.12 1z8r n ASN 14 Cb 0.00 -0.41 -0.15 0.00 -0.61 0.00 0.00 39.78 38.62 1z8r n ASN 14 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1z8r s TYR 15 N -1.68 1.31 -0.18 3.10 2.02 0.98 -2.08 117.35 120.82 1z8r s TYR 15 Ca 0.25 -0.27 0.00 0.00 -0.37 0.00 0.00 57.07 56.68 1z8r s TYR 15 Cb 0.16 -0.82 0.04 0.00 -0.40 0.00 0.00 41.96 40.94 1z8r s TYR 15 CO 0.12 -0.00 -0.07 0.21 -1.57 0.00 0.00 175.55 174.24 1z8r s LYS 16 N -0.55 1.66 -0.25 -0.62 2.20 0.30 0.11 119.74 122.59 1z8r s LYS 16 Ca 0.05 -0.65 -0.09 0.00 -0.36 0.00 0.00 55.97 54.91 1z8r s LYS 16 Cb -0.06 -2.18 -0.04 0.00 -1.51 0.00 0.00 37.83 34.04 1z8r s LYS 16 CO -0.00 -0.44 0.13 0.14 -0.36 0.00 0.00 175.35 174.83 1z8r s VAL 17 N 1.54 4.94 0.10 4.02 -7.23 -0.53 -1.16 120.40 122.08 1z8r s VAL 17 Ca -0.00 0.04 0.01 0.00 -1.81 0.00 0.00 61.98 60.22 1z8r s VAL 17 Cb -0.16 -3.32 -0.04 0.00 0.56 0.00 0.00 36.38 33.42 1z8r s VAL 17 CO -0.08 0.31 -0.05 0.54 -0.31 0.00 0.00 175.10 175.51 1z8r s VAL 18 N 1.47 0.62 0.42 1.32 0.11 -0.88 -2.31 120.40 121.15 1z8r s VAL 18 Ca 0.06 -1.92 -0.26 0.00 -2.93 0.00 0.00 61.98 56.93 1z8r s VAL 18 Cb -0.15 -1.71 -0.09 0.00 -1.53 0.00 0.00 36.38 32.90 1z8r s VAL 18 CO 0.07 -0.84 1.45 0.21 -3.33 0.00 0.00 175.10 172.66 1z8r s ASN 19 N -3.04 6.07 0.16 3.54 3.84 -1.26 -2.33 114.94 121.92 1z8r s ASN 19 Ca 0.13 2.98 -0.15 0.00 0.21 0.00 0.00 52.86 56.02 1z8r s ASN 19 Cb 0.06 -2.66 0.09 0.00 -0.55 0.00 0.00 41.25 38.19 1z8r s ASN 19 CO -0.04 -1.05 1.75 -0.09 -2.79 0.00 0.00 177.10 174.87 1z8r h ARG 20 N 2.61 0.29 0.00 0.43 2.43 0.01 0.81 114.38 120.95 1z8r h ARG 20 Ca -0.51 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 1z8r h ARG 20 Cb 1.25 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1z8r h ARG 20 CO 0.62 0.19 0.00 1.58 -1.51 0.00 0.00 179.97 180.86 1z8r n HIS 21 N -5.01 0.00 0.44 2.20 -0.00 -1.26 -2.22 115.22 109.36 1z8r n HIS 21 Ca 0.02 0.00 0.05 0.00 0.46 0.00 0.00 57.72 58.26 1z8r n HIS 21 Cb 0.15 -0.45 -0.07 0.00 -0.12 0.00 0.00 29.99 29.50 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 -1.45 0.44 -4.78 0.27 7.94 0.56 -5.01 117.00 114.97 1z8r n LEU 22 Ca 0.04 -0.43 -0.35 0.00 -1.11 0.00 0.00 56.01 54.17 1z8r n LEU 22 Cb 0.16 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.11 1z8r n LEU 22 CO 0.13 0.11 0.76 0.00 -1.11 0.00 0.00 177.39 177.28 1z8r s ALA 23 N -2.15 2.71 0.40 1.96 0.00 0.25 -4.85 121.76 120.08 1z8r s ALA 23 Ca 0.03 0.74 0.08 0.00 0.00 0.00 0.00 51.96 52.81 1z8r s ALA 23 Cb 0.08 -3.33 -0.01 0.00 0.00 0.00 0.00 23.12 19.86 1z8r s ALA 23 CO 0.46 -0.74 0.42 0.95 0.00 0.00 0.00 175.76 176.85 1z8r s THR 24 N -1.89 2.91 0.53 0.00 -4.23 -1.26 -4.96 115.64 106.75 1z8r s THR 24 Ca 0.71 -1.24 0.25 0.00 -1.18 0.00 0.00 61.69 60.23 1z8r s THR 24 Cb -0.22 -3.04 0.39 0.00 1.34 0.00 0.00 72.50 70.98 1z8r s THR 24 CO 0.27 -0.03 2.00 -0.74 -0.54 0.00 0.00 174.62 175.58 1z8r h HIS 25 N 0.95 0.00 -0.01 3.99 2.76 -2.00 0.16 115.15 121.00 1z8r h HIS 25 Ca -0.42 0.00 -0.17 0.00 -2.20 0.00 0.00 60.37 57.59 1z8r h HIS 25 Cb 1.27 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.21 1z8r h HIS 25 CO 0.48 0.00 -0.76 0.28 -1.30 0.00 0.00 177.93 176.63 1z8r h VAL 26 N 0.00 1.49 -0.33 5.26 2.07 -1.98 -0.75 116.25 122.01 1z8r h VAL 26 Ca 0.24 -2.46 -0.07 0.00 0.82 0.00 0.00 66.70 65.24 1z8r h VAL 26 Cb 0.99 2.33 -0.01 0.00 -1.52 0.00 0.00 31.29 33.08 1z8r h VAL 26 CO -0.00 0.71 -0.06 0.44 0.02 0.00 0.00 177.57 178.68 1z8r h ASP 27 N 0.06 0.62 0.66 0.57 5.19 -1.07 -2.59 116.42 119.86 1z8r h ASP 27 Ca -0.02 -0.35 -0.16 0.00 -0.62 0.00 0.00 57.03 55.88 1z8r h ASP 27 Cb 1.33 -0.17 -0.02 0.00 0.18 0.00 0.00 39.33 40.66 1z8r h ASP 27 CO 0.11 0.83 -0.74 -0.50 -3.12 0.00 0.00 179.24 175.81 1z8r h TRP 28 N 0.40 0.08 -0.62 4.55 6.55 -1.47 -1.25 115.95 124.19 1z8r h TRP 28 Ca 0.08 -0.04 0.03 0.00 0.95 0.00 0.00 58.89 59.92 1z8r h TRP 28 Cb 0.55 -0.01 -0.04 0.00 -0.86 0.00 0.00 29.16 28.79 1z8r h TRP 28 CO 0.05 0.78 0.38 1.96 -1.05 0.00 0.00 178.44 180.55 1z8r h GLN 29 N 0.04 0.72 -0.54 0.49 1.08 -0.95 -2.67 115.11 113.27 1z8r h GLN 29 Ca -0.01 -0.04 -0.36 0.00 -1.45 0.00 0.00 58.65 56.78 1z8r h GLN 29 Cb 1.31 -0.16 -0.23 0.00 -0.05 0.00 0.00 27.48 28.34 1z8r h GLN 29 CO 0.10 0.48 -0.24 -1.71 -0.95 0.00 0.00 178.83 176.50 1z8r n ASN 30 N -4.73 3.94 -4.73 1.46 5.15 -0.99 -5.03 115.26 110.33 1z8r n ASN 30 Ca 0.06 -3.79 -0.41 0.00 -0.60 0.00 0.00 54.58 49.84 1z8r n ASN 30 Cb 0.09 -0.57 -0.04 0.00 -0.53 0.00 0.00 39.78 38.72 1z8r n ASN 30 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1z8r n VAL 32 N 2.80 1.52 -4.02 0.00 0.24 0.26 -4.95 118.33 114.17 1z8r n VAL 32 Ca 0.02 -0.60 -0.09 0.00 -2.04 0.00 0.00 64.34 61.64 1z8r n VAL 32 Cb 0.49 -1.40 -0.11 0.00 -1.47 0.00 0.00 33.84 31.36 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 -2.52 0.40 -0.30 6.34 -0.00 -1.05 -4.98 118.94 116.83 1z8r s TRP 33 Ca -0.32 -0.68 -0.11 0.00 -0.00 0.00 0.00 56.10 54.99 1z8r s TRP 33 Cb 0.09 -0.28 0.13 0.00 -0.00 0.00 0.00 33.47 33.41 1z8r s TRP 33 CO 0.63 -0.22 0.68 -2.00 -0.00 0.00 0.00 176.95 176.04 1z8r s GLU 34 N -2.19 0.56 -0.33 5.86 -6.30 -1.26 0.68 118.70 115.72 1z8r s GLU 34 Ca -0.08 1.39 -0.08 0.00 -2.50 0.00 0.00 54.97 53.69 1z8r s GLU 34 Cb -0.05 0.81 0.02 0.00 0.00 0.00 0.00 34.13 34.92 1z8r s GLU 34 CO -0.03 -0.19 0.14 -0.51 0.02 0.00 0.00 175.26 174.68 1z8r s ASP 35 N 2.81 5.42 0.18 -1.70 1.11 0.10 -4.97 116.67 119.62 1z8r s ASP 35 Ca -0.06 -0.91 -0.13 0.00 0.18 0.00 0.00 52.55 51.64 1z8r s ASP 35 Cb -0.11 -1.94 0.09 0.00 1.07 0.00 0.00 42.92 42.03 1z8r s ASP 35 CO -0.19 -0.29 1.80 0.22 1.18 0.00 0.00 175.17 177.89 1z8r h TYR 36 N 8.31 0.80 0.00 4.23 3.20 -1.96 0.89 116.97 132.44 1z8r h TYR 36 Ca -0.27 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.57 1z8r h TYR 36 Cb 1.11 -0.26 -0.00 0.00 1.54 0.00 0.00 36.73 39.11 1z8r h TYR 36 CO 0.60 0.57 -0.10 -0.91 -1.64 0.00 0.00 178.16 176.67 1z8r h ASN 37 N 0.81 0.00 -0.02 -2.11 4.21 -1.91 -2.12 115.58 114.43 1z8r h ASN 37 Ca 0.21 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.72 1z8r h ASN 37 Cb 0.02 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.22 1z8r h ASN 37 CO -0.04 0.10 -0.15 -1.14 -1.29 0.00 0.00 177.43 174.92 1z8r n ARG 38 N -3.48 1.51 -3.83 0.81 3.00 -0.65 0.10 116.66 114.12 1z8r n ARG 38 Ca -0.01 -1.22 -0.29 0.00 -0.00 0.00 0.00 57.85 56.32 1z8r n ARG 38 Cb 0.25 -1.31 -0.03 0.00 0.00 0.00 0.00 32.46 31.36 1z8r n ARG 38 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1z8r n ASP 39 N 0.50 -2.60 -4.02 6.15 2.03 0.30 -4.88 116.55 114.02 1z8r n ASP 39 Ca 0.09 -0.69 -0.17 0.00 0.52 0.00 0.00 54.79 54.53 1z8r n ASP 39 Cb 0.39 -2.20 -0.14 0.00 -0.72 0.00 0.00 41.12 38.45 1z8r n ASP 39 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1z8r s LEU 40 N -6.70 2.06 0.04 -2.67 2.96 -0.98 0.77 118.68 114.16 1z8r s LEU 40 Ca 0.57 -0.22 -0.00 0.00 -0.22 0.00 0.00 54.13 54.26 1z8r s LEU 40 Cb -0.32 -0.40 -0.03 0.00 0.50 0.00 0.00 46.19 45.94 1z8r s LEU 40 CO 0.70 0.06 -0.04 -1.48 -1.32 0.00 0.00 176.35 174.27 1z8r s LEU 41 N -0.44 2.39 -0.11 -0.68 -0.00 -0.98 0.02 118.68 118.88 1z8r s LEU 41 Ca 0.01 -0.80 0.03 0.00 -0.00 0.00 0.00 54.13 53.38 1z8r s LEU 41 Cb -0.04 0.11 -0.00 0.00 -0.00 0.00 0.00 46.19 46.25 1z8r s LEU 41 CO -0.00 -0.45 -0.22 -0.69 -0.00 0.00 0.00 176.35 174.99 1z8r s VAL 42 N -2.86 2.28 0.22 1.48 1.01 0.21 -2.07 120.40 120.67 1z8r s VAL 42 Ca -0.02 -0.94 0.11 0.00 0.00 0.00 0.00 61.98 61.13 1z8r s VAL 42 Cb 0.00 -1.89 -0.05 0.00 0.00 0.00 0.00 36.38 34.45 1z8r s VAL 42 CO -0.06 0.55 -0.20 -0.94 0.00 0.00 0.00 175.10 174.45 1z8r s SER 43 N 0.35 3.23 -0.23 3.32 1.04 -0.31 0.91 113.70 122.01 1z8r s SER 43 Ca -0.17 -0.94 -0.13 0.00 0.48 0.00 0.00 55.95 55.19 1z8r s SER 43 Cb -0.18 -0.24 -0.05 0.00 0.10 0.00 0.00 66.02 65.66 1z8r s SER 43 CO 0.08 0.03 0.26 0.42 0.98 0.00 0.00 173.24 175.01 1z8r s THR 44 N -2.20 5.29 0.31 2.02 -4.23 -0.77 0.11 115.64 116.16 1z8r s THR 44 Ca 0.23 0.39 0.09 0.00 -1.18 0.00 0.00 61.69 61.23 1z8r s THR 44 Cb -0.06 -3.60 -0.05 0.00 1.34 0.00 0.00 72.50 70.14 1z8r s THR 44 CO 0.11 0.29 0.04 0.28 -0.54 0.00 0.00 174.62 174.80 1z8r s THR 45 N 1.28 3.05 -0.46 3.99 -1.32 -0.88 -4.96 115.64 116.33 1z8r s THR 45 Ca 0.12 -1.88 0.03 0.00 -1.21 0.00 0.00 61.69 58.76 1z8r s THR 45 Cb -0.14 -2.86 0.48 0.00 -1.51 0.00 0.00 72.50 68.47 1z8r s THR 45 CO 0.07 -0.26 1.66 0.41 -2.21 0.00 0.00 174.62 174.28 1z8r n THR 46 N -0.98 3.06 -4.47 5.08 -1.04 -1.26 -4.63 114.28 110.03 1z8r n THR 46 Ca -0.05 -3.24 -0.22 0.00 -2.04 0.00 0.00 64.05 58.50 1z8r n THR 46 Cb 0.61 -0.95 -0.11 0.00 -1.82 0.00 0.00 70.33 68.06 1z8r n THR 46 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1z8r s ALA 47 N -3.61 2.47 0.19 2.41 0.00 -1.26 -5.14 121.76 116.82 1z8r s ALA 47 Ca 0.56 -2.08 -0.25 0.00 0.00 0.00 0.00 51.96 50.20 1z8r s ALA 47 Cb 0.46 0.54 -0.08 0.00 0.00 0.00 0.00 23.12 24.04 1z8r s ALA 47 CO 0.02 -0.26 0.79 -1.01 0.00 0.00 0.00 175.76 175.30 1z8r s HIS 48 N -3.19 3.85 0.26 0.00 0.09 -1.26 -4.60 115.29 110.45 1z8r s HIS 48 Ca 0.36 1.63 -0.08 0.00 -0.00 0.00 0.00 55.06 56.96 1z8r s HIS 48 Cb 0.08 -2.77 -0.06 0.00 -0.00 0.00 0.00 32.58 29.83 1z8r s HIS 48 CO 0.15 0.46 0.57 0.20 -0.00 0.00 0.00 174.74 176.12 1z8r s GLY 49 N -1.27 2.11 0.00 -2.22 0.00 -1.26 -4.90 107.32 99.78 1z8r s GLY 49 Ca 0.38 -0.37 0.00 0.00 0.00 0.00 0.00 44.72 44.73 1z8r s GLY 49 CO 0.26 -0.24 0.00 0.00 0.00 0.00 0.00 173.10 173.12 1z8r n ASP 51 N -2.83 3.89 -4.16 0.00 9.92 -1.26 -4.99 116.55 117.12 1z8r n ASP 51 Ca 0.00 1.16 -0.34 0.00 -0.53 0.00 0.00 54.79 55.08 1z8r n ASP 51 Cb 0.49 -1.60 -0.15 0.00 -0.64 0.00 0.00 41.12 39.22 1z8r n ASP 51 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1z8r s THR 52 N -0.18 2.54 0.18 -3.53 2.01 -1.26 -4.74 115.64 110.66 1z8r s THR 52 Ca 0.62 -1.08 -0.27 0.00 0.31 0.00 0.00 61.69 61.27 1z8r s THR 52 Cb -0.49 -2.25 -0.08 0.00 0.01 0.00 0.00 72.50 69.69 1z8r s THR 52 CO 0.51 0.27 0.84 -0.63 -0.69 0.00 0.00 174.62 174.92 1z8r s ILE 53 N 1.28 4.29 -0.15 1.82 1.01 -1.26 -0.10 121.20 128.10 1z8r s ILE 53 Ca 0.00 1.85 -0.14 0.00 0.00 0.00 0.00 60.65 62.36 1z8r s ILE 53 Cb -0.16 -4.21 -0.05 0.00 0.01 0.00 0.00 42.46 38.05 1z8r s ILE 53 CO -0.07 0.50 0.32 0.00 0.00 0.00 0.00 174.94 175.69 1z8r s ALA 54 N -1.03 3.58 -0.48 9.38 0.00 -0.60 -4.15 121.76 128.47 1z8r s ALA 54 Ca 0.38 -0.41 -0.02 0.00 0.00 0.00 0.00 51.96 51.91 1z8r s ALA 54 Cb -0.24 -2.42 0.26 0.00 0.00 0.00 0.00 23.12 20.72 1z8r s ALA 54 CO 0.28 0.10 2.16 -2.13 0.00 0.00 0.00 175.76 176.17 1z8r n ARG 55 N 3.52 2.22 -3.26 0.00 0.63 -1.24 -4.77 116.66 113.75 1z8r n ARG 55 Ca -0.11 -2.31 -0.18 0.00 -0.92 0.00 0.00 57.85 54.32 1z8r n ARG 55 Cb 0.52 -1.94 0.00 0.00 0.45 0.00 0.00 32.46 31.49 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 -1.74 1.69 -2.09 0.00 7.27 -1.26 -5.05 117.38 116.19 1z8r n GLN 57 Ca 0.03 -3.00 -0.38 0.00 0.07 0.00 0.00 57.00 53.73 1z8r n GLN 57 Cb 0.58 -1.64 0.00 0.00 2.41 0.00 0.00 30.24 31.60 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 -0.45 1.53 -4.07 0.00 -1.04 -1.26 -4.89 114.28 104.09 1z8r n THR 59 Ca 0.07 -1.17 -0.23 0.00 -2.04 0.00 0.00 64.05 60.68 1z8r n THR 59 Cb 0.46 0.25 -0.17 0.00 -1.82 0.00 0.00 70.33 69.06 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 -1.57 0.68 0.19 12.58 -4.23 -1.26 -1.87 115.64 120.15 1z8r s THR 60 Ca 0.45 -0.14 -0.12 0.00 -1.18 0.00 0.00 61.69 60.70 1z8r s THR 60 Cb 0.28 -0.72 0.00 0.00 1.34 0.00 0.00 72.50 73.40 1z8r s THR 60 CO 0.24 0.28 0.40 -0.83 -0.54 0.00 0.00 174.62 174.17 1z8r s GLY 61 N 1.30 0.29 -0.14 3.99 0.00 -0.41 -4.76 107.32 107.60 1z8r s GLY 61 Ca -0.04 -0.65 -0.05 0.00 0.00 0.00 0.00 44.72 43.97 1z8r s GLY 61 CO -0.02 -0.61 0.05 0.54 0.00 0.00 0.00 173.10 173.06 1z8r s VAL 62 N -3.94 4.69 0.27 1.40 0.11 -0.19 0.50 120.40 123.24 1z8r s VAL 62 Ca 0.15 -0.08 0.09 0.00 -2.93 0.00 0.00 61.98 59.20 1z8r s VAL 62 Cb 0.01 -3.05 -0.04 0.00 -1.53 0.00 0.00 36.38 31.77 1z8r s VAL 62 CO 0.00 0.54 0.06 -0.72 -3.33 0.00 0.00 175.10 171.65 1z8r s TYR 63 N -0.27 2.81 -0.06 1.54 -0.85 0.06 -1.94 117.35 118.64 1z8r s TYR 63 Ca 0.08 -0.21 -0.25 0.00 -0.52 0.00 0.00 57.07 56.17 1z8r s TYR 63 Cb -0.12 -1.29 -0.03 0.00 0.38 0.00 0.00 41.96 40.90 1z8r s TYR 63 CO 0.02 0.57 0.77 0.12 -1.52 0.00 0.00 175.55 175.50 1z8r s PHE 64 N -2.28 3.58 -0.07 -3.49 2.19 -1.26 -1.20 117.98 115.44 1z8r s PHE 64 Ca 0.32 1.34 -0.03 0.00 0.33 0.00 0.00 56.93 58.89 1z8r s PHE 64 Cb -0.06 -2.89 -0.04 0.00 -1.31 0.00 0.00 43.02 38.72 1z8r s PHE 64 CO 0.21 0.04 0.07 0.00 1.83 0.00 0.00 175.22 177.37 1z8r n ALA 66 N 1.78 0.93 0.14 0.00 0.00 -1.25 -1.84 120.51 120.25 1z8r n ALA 66 Ca -0.17 -0.65 -0.01 0.00 0.00 0.00 0.00 53.44 52.61 1z8r n ALA 66 Cb 0.54 -0.50 0.21 0.00 0.00 0.00 0.00 19.45 19.70 1z8r n ALA 66 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1z8r h SER 67 N -0.48 0.07 0.41 0.00 0.02 -1.95 -3.15 113.55 108.48 1z8r h SER 67 Ca -0.44 -0.04 -0.18 0.00 -0.84 0.00 0.00 61.79 60.29 1z8r h SER 67 Cb 1.69 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 64.18 1z8r h SER 67 CO -0.10 0.59 -1.74 0.29 -1.14 0.00 0.00 176.83 174.73 1z8r n LYS 68 N -3.91 0.64 -1.92 3.45 4.76 -1.26 -4.96 118.16 114.96 1z8r n LYS 68 Ca -0.02 0.09 -0.21 0.00 -2.87 0.00 0.00 58.31 55.31 1z8r n LYS 68 Cb 0.55 -1.69 -0.06 0.00 -1.84 0.00 0.00 35.03 31.99 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 -2.74 -5.68 -4.30 4.39 2.88 -0.77 -4.95 113.62 102.46 1z8r n SER 69 Ca -0.14 0.31 -0.16 0.00 -1.33 0.00 0.00 58.87 57.55 1z8r n SER 69 Cb 0.86 -4.89 -0.10 0.00 -0.75 0.00 0.00 64.21 59.33 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 -4.27 1.41 -0.14 -1.46 1.02 -1.24 -4.95 119.74 110.11 1z8r s LYS 70 Ca 0.00 -1.76 -0.25 0.00 0.02 0.00 0.00 55.97 53.97 1z8r s LYS 70 Cb 0.00 -0.22 -0.02 0.00 -0.52 0.00 0.00 37.83 37.07 1z8r s LYS 70 CO 0.00 -0.31 0.83 -1.01 -0.92 0.00 0.00 175.35 173.94 1z8r s HIS 71 N -3.77 3.47 -0.28 3.18 3.76 -1.26 -2.25 115.29 118.13 1z8r s HIS 71 Ca 0.38 1.30 -0.04 0.00 -0.15 0.00 0.00 55.06 56.54 1z8r s HIS 71 Cb 0.08 -2.99 0.02 0.00 1.11 0.00 0.00 32.58 30.79 1z8r s HIS 71 CO 0.14 -0.17 0.02 0.71 -0.85 0.00 0.00 174.74 174.59 1z8r s TYR 72 N 1.84 3.13 -0.15 1.40 1.51 -0.34 -4.94 117.35 119.80 1z8r s TYR 72 Ca 0.40 -1.28 -0.29 0.00 -1.01 0.00 0.00 57.07 54.88 1z8r s TYR 72 Cb -0.17 -2.17 -0.02 0.00 -0.11 0.00 0.00 41.96 39.49 1z8r s TYR 72 CO 0.15 -0.66 1.28 -2.14 -1.11 0.00 0.00 175.55 173.07 1z8r s PRO 73 N 1.41 4.24 -0.01 -1.71 0.02 -1.26 -0.76 135.00 136.93 1z8r s PRO 73 Ca 0.01 1.69 -0.04 0.00 0.02 0.00 0.00 61.00 62.69 1z8r s PRO 73 Cb -0.17 -3.75 0.00 0.00 0.02 0.00 0.00 34.50 30.60 1z8r s PRO 73 CO -0.00 -0.68 0.08 0.08 -0.33 0.00 0.00 177.00 176.14 1z8r s VAL 74 N 3.37 0.05 -0.05 3.83 1.01 0.18 -4.93 120.40 123.86 1z8r s VAL 74 Ca 0.56 -0.40 -0.16 0.00 0.00 0.00 0.00 61.98 61.98 1z8r s VAL 74 Cb -0.23 -0.25 -0.05 0.00 0.00 0.00 0.00 36.38 35.86 1z8r s VAL 74 CO 0.16 -0.22 0.44 -0.44 0.00 0.00 0.00 175.10 175.04 1z8r s SER 75 N -0.69 6.76 0.20 3.32 0.01 -1.26 -1.28 113.70 120.76 1z8r s SER 75 Ca -0.08 0.90 -0.02 0.00 1.31 0.00 0.00 55.95 58.06 1z8r s SER 75 Cb -0.05 -2.27 -0.04 0.00 0.21 0.00 0.00 66.02 63.88 1z8r s SER 75 CO 0.00 0.19 0.17 0.72 0.41 0.00 0.00 173.24 174.73 1z8r s PHE 76 N -0.38 1.04 0.24 2.43 -0.12 -0.78 -4.38 117.98 116.03 1z8r s PHE 76 Ca 0.24 -1.29 0.09 0.00 -0.05 0.00 0.00 56.93 55.92 1z8r s PHE 76 Cb -0.16 -0.46 -0.04 0.00 -0.63 0.00 0.00 43.02 41.73 1z8r s PHE 76 CO 0.12 -0.67 0.01 -1.21 -0.05 0.00 0.00 175.22 173.42 1z8r s GLU 77 N -4.13 2.37 -0.94 1.99 0.41 -0.97 -4.69 118.70 112.73 1z8r s GLU 77 Ca 0.36 -1.29 -0.01 0.00 -0.41 0.00 0.00 54.97 53.62 1z8r s GLU 77 Cb 0.06 -2.25 0.30 0.00 -1.78 0.00 0.00 34.13 30.46 1z8r s GLU 77 CO 0.11 0.40 1.33 0.41 -0.49 0.00 0.00 175.26 177.01 1z8r n GLY 78 N -0.67 5.24 3.74 -1.39 0.00 -1.26 -2.14 105.19 108.71 1z8r n GLY 78 Ca -0.08 -2.69 -0.41 0.00 0.00 0.00 0.00 46.02 42.84 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 -2.95 4.34 0.00 1.61 0.04 -1.07 -4.86 135.00 132.11 1z8r s PRO 79 Ca 0.35 2.18 0.00 0.00 0.04 0.00 0.00 61.00 63.57 1z8r s PRO 79 Cb 0.10 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.50 1z8r s PRO 79 CO 0.04 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.18 1z8r n GLY 80 N 2.08 -2.44 3.63 0.56 0.00 -1.26 -2.35 105.19 105.41 1z8r n GLY 80 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 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 0.00 4.07 -0.12 0.99 1.98 -1.26 0.11 118.68 124.46 1z8r s LEU 81 Ca 0.00 0.76 0.01 0.00 -2.89 0.00 0.00 54.13 52.01 1z8r s LEU 81 Cb 0.00 -2.95 0.02 0.00 0.66 0.00 0.00 46.19 43.92 1z8r s LEU 81 CO 0.00 -0.43 -0.12 -0.69 -1.89 0.00 0.00 176.35 173.22 1z8r s VAL 82 N 2.63 1.31 -0.45 1.68 1.01 0.17 -4.94 120.40 121.81 1z8r s VAL 82 Ca 0.29 -0.49 -0.28 0.00 0.00 0.00 0.00 61.98 61.49 1z8r s VAL 82 Cb -0.15 -1.24 -0.00 0.00 0.00 0.00 0.00 36.38 34.98 1z8r s VAL 82 CO 0.09 0.41 1.59 -1.83 0.00 0.00 0.00 175.10 175.35 1z8r s GLU 83 N 1.35 3.32 -0.08 2.72 -1.05 -1.26 -1.77 118.70 121.93 1z8r s GLU 83 Ca -0.00 0.93 -0.30 0.00 -0.15 0.00 0.00 54.97 55.45 1z8r s GLU 83 Cb -0.14 -4.15 -0.03 0.00 -0.44 0.00 0.00 34.13 29.38 1z8r s GLU 83 CO -0.06 -1.89 1.22 0.14 0.95 0.00 0.00 175.26 175.62 1z8r s VAL 84 N 6.48 4.24 0.56 1.83 -7.23 0.24 -4.90 120.40 121.62 1z8r s VAL 84 Ca 0.66 1.56 -0.19 0.00 -1.81 0.00 0.00 61.98 62.19 1z8r s VAL 84 Cb -0.15 -4.00 -0.05 0.00 0.56 0.00 0.00 36.38 32.73 1z8r s VAL 84 CO 0.30 -0.04 1.13 0.00 -0.31 0.00 0.00 175.10 176.18 1z8r s GLN 85 N 2.55 3.29 -0.52 4.82 -2.07 -1.26 -1.49 119.66 124.98 1z8r s GLN 85 Ca 0.56 1.61 -0.27 0.00 -1.82 0.00 0.00 55.36 55.44 1z8r s GLN 85 Cb -0.24 -2.00 -0.03 0.00 -1.09 0.00 0.00 33.01 29.66 1z8r s GLN 85 CO 0.20 -0.90 1.94 -1.83 -1.32 0.00 0.00 175.29 173.37 1z8r s GLU 86 N -3.35 2.73 0.10 9.60 -1.05 -1.25 -4.53 118.70 120.94 1z8r s GLU 86 Ca 0.73 0.96 -0.05 0.00 -0.15 0.00 0.00 54.97 56.46 1z8r s GLU 86 Cb -0.24 -4.37 -0.02 0.00 -0.44 0.00 0.00 34.13 29.06 1z8r s GLU 86 CO 0.28 -2.59 0.12 -1.12 0.95 0.00 0.00 175.26 172.90 1z8r s SER 87 N 8.23 0.25 0.00 0.83 0.01 -0.82 -4.89 113.70 117.32 1z8r s SER 87 Ca 0.76 -0.88 0.00 0.00 1.31 0.00 0.00 55.95 57.14 1z8r s SER 87 Cb -0.16 0.31 0.00 0.00 0.21 0.00 0.00 66.02 66.37 1z8r s SER 87 CO 0.25 -0.72 0.00 1.21 0.41 0.00 0.00 173.24 174.39 1z8r n GLU 88 N -0.04 0.00 -0.77 12.44 2.13 -1.26 -0.83 120.64 132.31 1z8r n GLU 88 Ca -0.12 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.66 1z8r n GLU 88 Cb 0.62 0.00 -0.04 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 -4.54 4.31 0.18 -1.26 -5.11 117.16 110.74 1z8r n TYR 89 Ca 0.00 -0.27 -0.29 0.00 1.88 0.00 0.00 57.90 59.22 1z8r n TYR 89 Cb 0.00 0.37 -0.17 0.00 -0.38 0.00 0.00 39.34 39.17 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 2.03 0.52 -3.48 5.04 -0.01 -5.13 117.35 116.32 1z8r s TYR 90 Ca 0.00 -0.94 -0.21 0.00 -2.44 0.00 0.00 57.07 53.49 1z8r s TYR 90 Cb 0.00 -1.45 -0.06 0.00 0.35 0.00 0.00 41.96 40.80 1z8r s TYR 90 CO -0.00 -0.47 1.14 -2.14 -1.34 0.00 0.00 175.55 172.74 1z8r s PRO 91 N 0.90 3.49 -0.82 4.97 0.02 -1.26 -1.94 135.00 140.36 1z8r s PRO 91 Ca -0.08 1.67 -0.22 0.00 0.02 0.00 0.00 61.00 62.39 1z8r s PRO 91 Cb -0.15 -2.14 -0.19 0.00 0.02 0.00 0.00 34.50 32.04 1z8r s PRO 91 CO -0.00 -0.75 2.37 1.17 -0.33 0.00 0.00 177.00 179.46 1z8r n LYS 92 N -1.02 0.44 -4.64 5.54 4.81 -1.25 -4.59 118.16 117.44 1z8r n LYS 92 Ca 0.10 -0.44 -0.29 0.00 -0.87 0.00 0.00 58.31 56.81 1z8r n LYS 92 Cb 0.50 -2.78 -0.08 0.00 0.02 0.00 0.00 35.03 32.68 1z8r n LYS 92 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 1z8r s ARG 93 N 8.33 2.04 -0.16 1.64 6.06 -0.56 -4.91 118.95 131.40 1z8r s ARG 93 Ca 1.07 -2.26 -0.11 0.00 -2.50 0.00 0.00 55.73 51.94 1z8r s ARG 93 Cb -0.41 -1.20 -0.05 0.00 0.06 0.00 0.00 34.95 33.35 1z8r s ARG 93 CO 0.27 -0.35 0.20 0.71 -2.50 0.00 0.00 175.30 173.64 1z8r s TYR 94 N -3.00 3.48 -0.04 5.12 1.51 -1.26 0.80 117.35 123.95 1z8r s TYR 94 Ca 0.17 0.49 0.02 0.00 -1.01 0.00 0.00 57.07 56.75 1z8r s TYR 94 Cb 0.04 -2.19 0.01 0.00 -0.11 0.00 0.00 41.96 39.70 1z8r s TYR 94 CO 0.09 0.37 -0.10 -0.65 -1.11 0.00 0.00 175.55 174.16 1z8r s GLN 95 N 0.08 1.20 -0.06 -0.62 -0.21 -0.73 -4.77 119.66 114.55 1z8r s GLN 95 Ca 0.13 -0.32 -0.03 0.00 0.02 0.00 0.00 55.36 55.16 1z8r s GLN 95 Cb -0.12 -1.07 -0.04 0.00 1.00 0.00 0.00 33.01 32.78 1z8r s GLN 95 CO 0.02 0.06 0.10 0.45 -2.12 0.00 0.00 175.29 173.80 1z8r s SER 96 N 0.45 5.95 -0.24 5.90 0.15 0.28 0.43 113.70 126.63 1z8r s SER 96 Ca -0.08 0.28 -0.01 0.00 0.70 0.00 0.00 55.95 56.85 1z8r s SER 96 Cb -0.12 -1.81 -0.01 0.00 -1.71 0.00 0.00 66.02 62.37 1z8r s SER 96 CO 0.01 0.33 0.20 1.41 1.20 0.00 0.00 173.24 176.40 1z8r n HIS 97 N 1.56 -0.50 -5.06 3.44 -0.00 0.30 -4.06 115.22 110.90 1z8r n HIS 97 Ca -0.16 0.19 -0.28 0.00 -0.00 0.00 0.00 57.72 57.47 1z8r n HIS 97 Cb 0.54 -2.76 -0.16 0.00 -0.00 0.00 0.00 29.99 27.61 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 -3.08 1.70 -0.14 1.59 0.11 -0.99 -2.39 120.40 117.20 1z8r s VAL 98 Ca 0.05 -0.92 -0.05 0.00 -2.93 0.00 0.00 61.98 58.14 1z8r s VAL 98 Cb -0.01 -1.42 -0.04 0.00 -1.53 0.00 0.00 36.38 33.39 1z8r s VAL 98 CO 0.16 0.48 0.04 -0.76 -3.33 0.00 0.00 175.10 171.68 1z8r s LEU 99 N -0.45 3.72 -0.04 2.54 1.02 0.21 -2.59 118.68 123.09 1z8r s LEU 99 Ca 0.07 0.11 0.06 0.00 0.02 0.00 0.00 54.13 54.39 1z8r s LEU 99 Cb -0.09 -1.90 -0.02 0.00 0.02 0.00 0.00 46.19 44.20 1z8r s LEU 99 CO -0.00 0.26 -0.21 -0.76 0.02 0.00 0.00 176.35 175.66 1z8r s LEU 100 N -0.16 2.33 -0.12 1.79 1.43 -0.91 0.87 118.68 123.92 1z8r s LEU 100 Ca 0.06 -0.37 -0.01 0.00 -1.03 0.00 0.00 54.13 52.78 1z8r s LEU 100 Cb -0.12 -1.44 0.03 0.00 0.03 0.00 0.00 46.19 44.69 1z8r s LEU 100 CO 0.02 0.31 -0.07 0.00 0.23 0.00 0.00 176.35 176.84 1z8r s ALA 101 N -0.52 1.29 -0.42 4.21 0.00 0.14 -2.30 121.76 124.15 1z8r s ALA 101 Ca 0.07 -0.54 -0.25 0.00 0.00 0.00 0.00 51.96 51.24 1z8r s ALA 101 Cb -0.11 -0.92 0.02 0.00 0.00 0.00 0.00 23.12 22.11 1z8r s ALA 101 CO 0.01 -0.46 0.87 -0.08 0.00 0.00 0.00 175.76 176.10 1z8r s THR 102 N 1.72 4.58 0.00 0.00 -1.32 -1.26 0.19 115.64 119.56 1z8r s THR 102 Ca 0.05 0.79 0.00 0.00 -1.21 0.00 0.00 61.69 61.32 1z8r s THR 102 Cb -0.13 -4.35 0.00 0.00 -1.51 0.00 0.00 72.50 66.51 1z8r s THR 102 CO -0.08 -0.68 0.00 0.61 -2.21 0.00 0.00 174.62 172.26 1z8r n GLY 103 N 4.76 1.37 1.20 6.08 0.00 -0.67 -4.94 105.19 112.99 1z8r n GLY 103 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1z8r n GLY 103 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1z8r n PHE 104 N 0.00 -1.23 -2.71 1.61 7.35 -1.26 -5.07 117.46 116.15 1z8r n PHE 104 Ca 0.00 0.00 -0.03 0.00 -0.76 0.00 0.00 57.45 56.66 1z8r n PHE 104 Cb 0.00 0.30 0.03 0.00 0.35 0.00 0.00 39.48 40.16 1z8r n PHE 104 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 1z8r s SER 105 N -2.08 -0.61 -0.53 -2.13 0.15 -1.26 -4.94 113.70 102.30 1z8r s SER 105 Ca 0.00 -0.70 0.04 0.00 0.70 0.00 0.00 55.95 55.99 1z8r s SER 105 Cb 0.00 0.80 0.13 0.00 -1.71 0.00 0.00 66.02 65.24 1z8r s SER 105 CO 0.00 -0.02 0.27 -1.61 1.20 0.00 0.00 173.24 173.08 1z8r s GLU 106 N 1.02 1.99 0.10 5.44 8.01 -1.26 -4.99 118.70 129.01 1z8r s GLU 106 Ca 0.25 -2.65 -0.35 0.00 0.01 0.00 0.00 54.97 52.23 1z8r s GLU 106 Cb 0.09 -3.30 -0.15 0.00 -4.31 0.00 0.00 34.13 26.46 1z8r s GLU 106 CO -0.09 -1.12 1.56 -1.35 0.01 0.00 0.00 175.26 174.27 1z8r h PRO 107 N 6.44 -0.76 0.00 0.39 0.11 -1.85 -3.41 132.00 132.92 1z8r h PRO 107 Ca -0.07 0.05 -0.15 0.00 0.11 0.00 0.00 66.00 65.95 1z8r h PRO 107 Cb 0.88 0.17 0.02 0.00 0.11 0.00 0.00 31.00 32.18 1z8r h PRO 107 CO 0.69 -0.50 0.00 0.41 -0.21 0.00 0.00 178.00 178.39 1z8r n GLY 108 N -1.50 1.40 3.09 -0.55 0.00 -1.26 -4.84 105.19 101.53 1z8r n GLY 108 Ca -0.09 -2.08 -0.03 0.00 0.00 0.00 0.00 46.02 43.82 1z8r n GLY 108 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1z8r s ASP 109 N -2.18 -0.85 -0.58 1.61 -1.08 -1.26 -5.02 116.67 107.31 1z8r s ASP 109 Ca 0.20 -0.92 0.06 0.00 -0.52 0.00 0.00 52.55 51.36 1z8r s ASP 109 Cb -0.01 1.61 0.30 0.00 -1.46 0.00 0.00 42.92 43.35 1z8r s ASP 109 CO 0.13 -0.20 0.82 0.00 0.52 0.00 0.00 175.17 176.44 1z8r n ALA 110 N 4.44 4.14 -2.00 3.66 0.00 -1.26 -4.97 120.51 124.51 1z8r n ALA 110 Ca 0.11 -4.59 0.00 0.00 0.00 0.00 0.00 53.44 48.96 1z8r n ALA 110 Cb 0.54 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.17 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 0.36 0.04 0.00 0.00 0.00 -1.26 -3.97 105.19 100.35 1z8r n GLY 111 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.32 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 4.29 -2.13 3.23 -0.02 0.00 -1.26 -4.97 105.19 104.33 1z8r n GLY 112 Ca 0.00 0.81 -0.24 0.00 0.00 0.00 0.00 46.02 46.59 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 0.30 1.55 -0.39 -0.61 -4.36 -1.26 -1.09 121.20 115.34 1z8r s ILE 113 Ca 0.00 -1.23 -0.23 0.00 -0.26 0.00 0.00 60.65 58.93 1z8r s ILE 113 Cb 0.00 -1.37 0.01 0.00 1.25 0.00 0.00 42.46 42.35 1z8r s ILE 113 CO 0.00 0.10 0.78 -0.22 0.24 0.00 0.00 174.94 175.84 1z8r s LEU 114 N -1.33 4.16 0.08 0.37 2.96 0.28 -4.23 118.68 120.97 1z8r s LEU 114 Ca 0.06 0.21 0.10 0.00 -0.22 0.00 0.00 54.13 54.28 1z8r s LEU 114 Cb -0.09 -3.01 -0.03 0.00 0.50 0.00 0.00 46.19 43.56 1z8r s LEU 114 CO 0.02 -0.79 -0.26 -0.13 -1.32 0.00 0.00 176.35 173.87 1z8r s ARG 115 N 3.17 1.66 0.50 1.98 0.52 -0.82 0.78 118.95 126.75 1z8r s ARG 115 Ca 0.31 -1.20 0.02 0.00 -0.52 0.00 0.00 55.73 54.34 1z8r s ARG 115 Cb -0.13 -1.97 -0.02 0.00 0.52 0.00 0.00 34.95 33.36 1z8r s ARG 115 CO 0.19 0.49 0.04 0.00 0.02 0.00 0.00 175.30 176.04 1z8r h GLU 117 N 1.34 0.00 0.02 0.00 4.11 -1.97 -1.07 114.58 117.01 1z8r h GLU 117 Ca -0.43 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 58.67 1z8r h GLU 117 Cb 1.31 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.51 1z8r h GLU 117 CO 0.73 0.00 -1.98 0.72 0.07 0.00 0.00 179.01 178.55 1z8r n HIS 118 N -2.79 0.73 0.00 2.06 8.25 -1.26 -5.09 115.22 117.12 1z8r n HIS 118 Ca -0.02 0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.67 1z8r n HIS 118 Cb 0.20 -1.12 0.00 0.00 1.12 0.00 0.00 29.99 30.19 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 1.74 -0.58 3.60 -1.41 0.00 -0.41 -4.53 105.19 103.60 1z8r n GLY 119 Ca -0.26 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.32 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 -1.43 4.14 -0.18 1.61 1.01 0.86 0.11 120.40 126.51 1z8r s VAL 120 Ca 0.00 -0.29 -0.11 0.00 0.00 0.00 0.00 61.98 61.57 1z8r s VAL 120 Cb 0.00 -2.77 -0.08 0.00 0.00 0.00 0.00 36.38 33.53 1z8r s VAL 120 CO 0.00 0.55 -0.26 -0.38 0.00 0.00 0.00 175.10 175.01 1z8r n ILE 121 N 2.75 1.21 -2.76 2.22 -0.00 0.23 -1.55 119.36 121.46 1z8r n ILE 121 Ca -0.18 -0.15 0.00 0.00 -0.00 0.00 0.00 62.75 62.42 1z8r n ILE 121 Cb 0.53 -1.88 0.00 0.00 -0.00 0.00 0.00 39.64 38.28 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 1.79 2.19 3.45 7.39 0.00 -1.01 0.55 105.19 119.55 1z8r n GLY 122 Ca -0.32 -0.93 -0.22 0.00 0.00 0.00 0.00 46.02 44.55 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 2.54 -0.17 0.99 2.34 0.37 0.99 118.68 125.74 1z8r s LEU 123 Ca 0.00 -1.17 -0.31 0.00 0.06 0.00 0.00 54.13 52.71 1z8r s LEU 123 Cb 0.00 -0.73 -0.09 0.00 -0.56 0.00 0.00 46.19 44.81 1z8r s LEU 123 CO 0.00 -0.28 2.10 1.33 -1.06 0.00 0.00 176.35 178.43 1z8r n VAL 124 N -0.61 0.44 0.00 1.48 0.24 -0.25 0.61 118.33 120.25 1z8r n VAL 124 Ca -0.06 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 61.96 1z8r n VAL 124 Cb 0.63 -2.19 0.00 0.00 -1.47 0.00 0.00 33.84 30.81 1z8r n VAL 124 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1z8r n THR 125 N 6.66 0.00 -4.26 3.34 -1.04 -0.05 -4.77 114.28 114.16 1z8r n THR 125 Ca 0.29 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 62.15 1z8r n THR 125 Cb 0.36 -0.42 -0.10 0.00 -1.82 0.00 0.00 70.33 68.35 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 0.00 1.12 0.15 -2.82 1.75 -0.91 -4.98 119.30 113.61 1z8r s MET 126 Ca 0.00 -1.51 0.03 0.00 -1.25 0.00 0.00 55.69 52.96 1z8r s MET 126 Cb 0.00 -0.54 -0.04 0.00 2.84 0.00 0.00 34.83 37.09 1z8r s MET 126 CO 0.00 -0.01 -0.06 0.20 -0.65 0.00 0.00 175.02 174.50 1z8r s GLY 127 N -3.19 1.07 0.00 2.11 0.00 -1.26 0.10 107.32 106.15 1z8r s GLY 127 Ca 0.20 -1.50 0.00 0.00 0.00 0.00 0.00 44.72 43.42 1z8r s GLY 127 CO 0.03 -1.55 0.00 0.61 0.00 0.00 0.00 173.10 172.18 1z8r n GLY 128 N -0.19 6.18 0.24 0.20 0.00 -0.98 -4.80 105.19 105.84 1z8r n GLY 128 Ca -0.09 -1.91 0.16 0.00 0.00 0.00 0.00 46.02 44.17 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 4.39 -1.89 -3.38 114.58 115.31 1z8r h GLU 129 Ca 0.00 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.63 1z8r h GLU 129 Cb 0.00 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.58 1z8r h GLU 129 CO 0.00 0.00 -0.17 0.41 -1.16 0.00 0.00 179.01 178.09 1z8r n GLY 130 N 0.24 0.10 3.21 -3.84 0.00 -1.26 -4.21 105.19 99.43 1z8r n GLY 130 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.89 1z8r n GLY 130 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1z8r s VAL 131 N 0.00 1.06 -0.23 1.61 1.01 -1.26 -1.67 120.40 120.91 1z8r s VAL 131 Ca 0.00 -1.81 -0.03 0.00 0.00 0.00 0.00 61.98 60.14 1z8r s VAL 131 Cb 0.00 -1.57 0.01 0.00 0.00 0.00 0.00 36.38 34.82 1z8r s VAL 131 CO 0.00 -0.62 -0.06 -0.69 0.00 0.00 0.00 175.10 173.73 1z8r s VAL 132 N -2.77 3.09 -0.25 2.92 1.01 0.52 -2.32 120.40 122.60 1z8r s VAL 132 Ca 0.10 -0.74 -0.09 0.00 0.00 0.00 0.00 61.98 61.24 1z8r s VAL 132 Cb -0.01 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 1z8r s VAL 132 CO 0.00 0.33 0.14 -0.83 0.00 0.00 0.00 175.10 174.74 1z8r s GLY 133 N 1.41 1.90 0.03 4.51 0.00 0.28 0.25 107.32 115.70 1z8r s GLY 133 Ca 0.04 -1.01 0.07 0.00 0.00 0.00 0.00 44.72 43.81 1z8r s GLY 133 CO -0.04 0.49 -0.20 -1.36 0.00 0.00 0.00 173.10 171.99 1z8r s PHE 134 N 1.40 1.77 -0.37 1.90 0.08 0.25 -0.87 117.98 122.14 1z8r s PHE 134 Ca 0.06 -0.37 -0.22 0.00 0.12 0.00 0.00 56.93 56.53 1z8r s PHE 134 Cb -0.15 -1.07 0.01 0.00 -0.57 0.00 0.00 43.02 41.24 1z8r s PHE 134 CO 0.06 0.06 0.72 0.00 -0.10 0.00 0.00 175.22 175.97 1z8r s ALA 135 N -0.74 3.43 0.28 5.36 0.00 0.20 0.67 121.76 130.96 1z8r s ALA 135 Ca 0.07 -0.76 -0.29 0.00 0.00 0.00 0.00 51.96 50.98 1z8r s ALA 135 Cb -0.09 -3.29 -0.10 0.00 0.00 0.00 0.00 23.12 19.64 1z8r s ALA 135 CO 0.01 -1.45 1.33 0.34 0.00 0.00 0.00 175.76 175.99 1z8r s ASP 136 N 1.84 6.80 0.00 0.00 -1.08 -1.01 -0.48 116.67 122.74 1z8r s ASP 136 Ca 0.28 2.60 0.24 0.00 -0.52 0.00 0.00 52.55 55.15 1z8r s ASP 136 Cb -0.14 -2.63 0.39 0.00 -1.46 0.00 0.00 42.92 39.08 1z8r s ASP 136 CO 0.16 -0.55 1.38 0.52 0.52 0.00 0.00 175.17 177.20 1z8r n VAL 137 N 1.58 0.36 0.86 1.11 0.31 0.19 -4.24 118.33 118.49 1z8r n VAL 137 Ca 0.03 -0.66 0.09 0.00 -0.01 0.00 0.00 64.34 63.79 1z8r n VAL 137 Cb 0.42 1.09 0.47 0.00 -0.91 0.00 0.00 33.84 34.91 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 1.41 0.23 -0.10 5.55 5.12 -1.25 -2.34 116.66 125.28 1z8r n ARG 138 Ca 0.18 0.12 0.12 0.00 -1.93 0.00 0.00 57.85 56.33 1z8r n ARG 138 Cb 0.60 -1.50 0.28 0.00 -1.16 0.00 0.00 32.46 30.68 1z8r n ARG 138 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 1z8r n ASP 139 N -1.31 2.55 -2.70 0.55 5.68 -1.26 -4.39 116.55 115.67 1z8r n ASP 139 Ca 0.08 -1.84 -0.07 0.00 -0.50 0.00 0.00 54.79 52.46 1z8r n ASP 139 Cb 0.16 -0.13 0.10 0.00 -1.14 0.00 0.00 41.12 40.11 1z8r n ASP 139 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1z8r n LEU 140 N 0.93 -1.88 0.13 -2.12 -0.00 -0.99 -4.97 117.00 108.10 1z8r n LEU 140 Ca 0.17 -3.29 0.12 0.00 -0.00 0.00 0.00 56.01 53.01 1z8r n LEU 140 Cb 0.48 0.27 0.50 0.00 -0.00 0.00 0.00 43.42 44.68 1z8r n LEU 140 CO 0.15 1.84 0.85 -0.11 -0.00 0.00 0.00 177.39 180.12 1z8r n LEU 141 N -0.42 0.65 -4.43 1.47 -0.00 -1.15 -4.61 117.00 108.51 1z8r n LEU 141 Ca -0.04 0.68 -0.11 0.00 -0.00 0.00 0.00 56.01 56.54 1z8r n LEU 141 Cb 0.80 -0.61 -0.09 0.00 -0.00 0.00 0.00 43.42 43.52 1z8r n LEU 141 CO -0.07 -0.61 1.13 -2.67 -0.00 0.00 0.00 177.39 175.17 1z8r n TRP 142 N -2.23 0.66 0.00 1.96 4.27 -1.26 -3.44 117.44 117.40 1z8r n TRP 142 Ca 0.02 -0.09 0.00 0.00 -3.89 0.00 0.00 57.50 53.53 1z8r n TRP 142 Cb 0.20 -1.97 0.00 0.00 -1.36 0.00 0.00 31.31 28.18 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 15.22 0.00 0.00 5.67 4.32 -1.26 -4.98 117.00 135.97 1z8r n LEU 143 Ca 0.33 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.32 1z8r n LEU 143 Cb 0.45 0.13 0.00 0.00 -1.62 0.00 0.00 43.42 42.39 1z8r n LEU 143 CO 0.59 -0.24 0.00 1.21 -1.22 0.00 0.00 177.39 177.73 1z8r n GLU 144 N -1.98 0.00 -2.70 3.23 4.07 -1.22 -4.50 120.64 117.54 1z8r n GLU 144 Ca 0.00 0.00 -0.34 0.00 -0.06 0.00 0.00 57.16 56.76 1z8r n GLU 144 Cb 0.00 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 31.33 1z8r n GLU 144 CO 0.00 0.00 0.00 0.16 -0.06 0.00 0.00 177.13 177.23 1z8r s ASP 145 N 1.33 6.77 0.42 4.31 -4.77 -1.26 -5.05 116.67 118.41 1z8r s ASP 145 Ca 0.00 1.82 -0.12 0.00 -3.30 0.00 0.00 52.55 50.95 1z8r s ASP 145 Cb 0.00 -2.56 -0.07 0.00 -1.09 0.00 0.00 42.92 39.21 1z8r s ASP 145 CO 0.00 -0.48 0.81 -1.81 0.70 0.00 0.00 175.17 174.39 1z8r s ASP 146 N -2.00 6.57 -0.02 2.11 1.01 -1.26 -4.84 116.67 118.24 1z8r s ASP 146 Ca 0.62 1.24 -0.18 0.00 0.71 0.00 0.00 52.55 54.95 1z8r s ASP 146 Cb -0.14 -2.37 -0.05 0.00 1.01 0.00 0.00 42.92 41.37 1z8r s ASP 146 CO 0.18 -0.42 0.49 0.00 0.21 0.00 0.00 175.17 175.63 1z8r s ALA 147 N -2.38 3.58 1.23 5.23 0.00 -1.26 -4.87 121.76 123.29 1z8r s ALA 147 Ca 0.53 -0.12 -0.13 0.00 0.00 0.00 0.00 51.96 52.24 1z8r s ALA 147 Cb -0.10 -2.56 0.21 0.00 0.00 0.00 0.00 23.12 20.66 1z8r s ALA 147 CO 0.30 0.28 0.57 -1.33 0.00 0.00 0.00 175.76 175.58 1z8r n MET 148 N 2.45 -3.07 -4.40 0.00 2.81 -1.26 -3.66 117.12 109.99 1z8r n MET 148 Ca -0.10 -0.94 -0.31 0.00 -1.81 0.00 0.00 57.70 54.54 1z8r n MET 148 Cb 0.52 -1.05 -0.11 0.00 -0.71 0.00 0.00 33.22 31.87 1z8r n MET 148 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1z8r s GLU 149 N -4.34 2.26 0.00 0.03 2.12 -1.26 -4.65 118.70 112.86 1z8r s GLU 149 Ca 0.41 -0.91 0.00 0.00 0.36 0.00 0.00 54.97 54.82 1z8r s GLU 149 Cb -0.06 -2.35 0.00 0.00 0.26 0.00 0.00 34.13 31.99 1z8r s GLU 149 CO 0.33 0.55 0.35 1.04 -0.54 0.00 0.00 175.26 176.98