#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z8r s PRO 2 N 0.00 3.04 -0.19 1.61 0.04 -1.26 -4.96 135.00 133.28 1z8r s PRO 2 Ca 0.00 0.95 -0.29 0.00 0.04 0.00 0.00 61.00 61.70 1z8r s PRO 2 Cb 0.00 -4.26 0.00 0.00 0.04 0.00 0.00 34.50 30.28 1z8r s PRO 2 CO 0.00 -2.22 1.06 -0.47 0.04 0.00 0.00 177.00 175.41 1z8r s TYR 3 N 7.66 3.33 -0.14 0.56 5.04 -1.26 -5.02 117.35 127.51 1z8r s TYR 3 Ca 0.71 1.45 -0.03 0.00 -2.44 0.00 0.00 57.07 56.75 1z8r s TYR 3 Cb -0.16 -3.28 0.05 0.00 0.35 0.00 0.00 41.96 38.92 1z8r s TYR 3 CO 0.27 -0.56 0.05 0.20 -1.34 0.00 0.00 175.55 174.17 1z8r s GLY 4 N 1.26 0.46 -0.09 8.97 0.00 -1.26 -4.98 107.32 111.69 1z8r s GLY 4 Ca 0.46 -0.33 -0.07 0.00 0.00 0.00 0.00 44.72 44.78 1z8r s GLY 4 CO 0.10 1.49 -0.16 1.42 0.00 0.00 0.00 173.10 175.94 1z8r n HIS 5 N 5.19 0.00 0.00 1.90 8.25 -1.26 -5.00 115.22 124.29 1z8r n HIS 5 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1z8r n HIS 5 Cb 0.49 -0.36 0.00 0.00 1.12 0.00 0.00 29.99 31.23 1z8r n HIS 5 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1z8r n GLN 6 N -3.74 0.00 -3.71 -0.41 10.64 -1.26 -5.15 117.38 113.75 1z8r n GLN 6 Ca -0.17 0.00 -0.10 0.00 -1.83 0.00 0.00 57.00 54.90 1z8r n GLN 6 Cb 0.49 -0.13 -0.04 0.00 -0.86 0.00 0.00 30.24 29.70 1z8r n GLN 6 CO 0.00 0.00 0.00 -1.12 -1.83 0.00 0.00 177.06 174.11 1z8r s SER 7 N -4.49 -0.27 0.39 2.61 0.01 -1.26 -5.01 113.70 105.67 1z8r s SER 7 Ca 0.00 -0.44 -0.16 0.00 1.31 0.00 0.00 55.95 56.66 1z8r s SER 7 Cb 0.00 0.57 0.06 0.00 0.21 0.00 0.00 66.02 66.85 1z8r s SER 7 CO 0.00 -1.02 0.80 -0.83 0.41 0.00 0.00 173.24 172.59 1z8r s GLY 8 N -2.86 0.39 0.65 3.44 0.00 -1.26 -5.01 107.32 102.66 1z8r s GLY 8 Ca 0.08 -0.77 -0.11 0.00 0.00 0.00 0.00 44.72 43.93 1z8r s GLY 8 CO -0.04 -0.28 0.39 0.00 0.00 0.00 0.00 173.10 173.17 1z8r n ALA 9 N -0.54 -2.30 -3.18 3.20 0.00 -1.26 -4.71 120.51 111.72 1z8r n ALA 9 Ca -0.09 -0.68 -0.38 0.00 0.00 0.00 0.00 53.44 52.29 1z8r n ALA 9 Cb 0.60 -0.06 -0.12 0.00 0.00 0.00 0.00 19.45 19.87 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 -1.50 3.90 -0.33 0.00 1.01 -0.97 -5.04 120.40 117.47 1z8r s VAL 10 Ca 0.30 -1.04 -0.13 0.00 0.00 0.00 0.00 61.98 61.11 1z8r s VAL 10 Cb -0.05 -3.17 -0.02 0.00 0.00 0.00 0.00 36.38 33.13 1z8r s VAL 10 CO 0.25 -0.15 0.24 -0.47 0.00 0.00 0.00 175.10 174.97 1z8r s TYR 11 N 1.43 3.23 -0.24 5.22 6.14 -1.26 -1.55 117.35 130.32 1z8r s TYR 11 Ca -0.01 -0.12 0.02 0.00 0.64 0.00 0.00 57.07 57.60 1z8r s TYR 11 Cb -0.19 -2.47 0.05 0.00 0.42 0.00 0.00 41.96 39.77 1z8r s TYR 11 CO 0.03 -0.32 -0.12 0.08 0.64 0.00 0.00 175.55 175.86 1z8r s VAL 12 N 1.76 2.06 0.00 3.14 1.01 0.23 -3.90 120.40 124.69 1z8r s VAL 12 Ca 0.07 -1.46 0.00 0.00 0.00 0.00 0.00 61.98 60.59 1z8r s VAL 12 Cb -0.17 -2.14 0.00 0.00 0.00 0.00 0.00 36.38 34.07 1z8r s VAL 12 CO 0.11 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.87 1z8r n GLY 13 N 4.50 3.42 1.28 4.51 0.00 -1.26 -0.55 105.19 117.07 1z8r n GLY 13 Ca -0.15 0.07 0.05 0.00 0.00 0.00 0.00 46.02 45.99 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 4.98 3.67 -4.18 1.61 3.02 -1.26 -4.20 115.26 118.90 1z8r n ASN 14 Ca 0.00 -2.49 -0.19 0.00 -0.03 0.00 0.00 54.58 51.87 1z8r n ASN 14 Cb 0.00 -0.57 -0.12 0.00 -0.61 0.00 0.00 39.78 38.48 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 -1.98 1.25 -0.11 3.10 2.02 0.28 -2.11 117.35 119.80 1z8r s TYR 15 Ca 0.32 -0.46 -0.03 0.00 -0.37 0.00 0.00 57.07 56.54 1z8r s TYR 15 Cb 0.24 -0.70 0.05 0.00 -0.40 0.00 0.00 41.96 41.14 1z8r s TYR 15 CO 0.11 0.07 0.06 0.21 -1.57 0.00 0.00 175.55 174.43 1z8r s LYS 16 N -1.74 0.11 -0.27 -0.62 2.20 0.10 -0.60 119.74 118.93 1z8r s LYS 16 Ca -0.01 0.09 -0.11 0.00 -0.36 0.00 0.00 55.97 55.58 1z8r s LYS 16 Cb -0.10 -1.26 -0.05 0.00 -1.51 0.00 0.00 37.83 34.91 1z8r s LYS 16 CO 0.02 -0.50 0.17 0.14 -0.36 0.00 0.00 175.35 174.83 1z8r s VAL 17 N 2.11 5.28 0.09 4.02 -7.23 -0.59 -1.37 120.40 122.71 1z8r s VAL 17 Ca 0.03 0.16 0.01 0.00 -1.81 0.00 0.00 61.98 60.37 1z8r s VAL 17 Cb -0.14 -3.49 -0.04 0.00 0.56 0.00 0.00 36.38 33.26 1z8r s VAL 17 CO -0.06 0.29 -0.06 0.54 -0.31 0.00 0.00 175.10 175.50 1z8r s VAL 18 N 1.52 0.62 0.40 1.32 0.11 -0.73 -2.30 120.40 121.35 1z8r s VAL 18 Ca 0.07 -1.92 -0.27 0.00 -2.93 0.00 0.00 61.98 56.93 1z8r s VAL 18 Cb -0.15 -1.68 -0.09 0.00 -1.53 0.00 0.00 36.38 32.92 1z8r s VAL 18 CO 0.09 -0.87 1.41 0.21 -3.33 0.00 0.00 175.10 172.61 1z8r s ASN 19 N -3.03 6.22 0.19 3.54 2.47 -1.26 -1.97 114.94 121.09 1z8r s ASN 19 Ca 0.12 2.89 -0.12 0.00 0.42 0.00 0.00 52.86 56.17 1z8r s ASN 19 Cb 0.06 -2.66 0.18 0.00 -1.45 0.00 0.00 41.25 37.39 1z8r s ASN 19 CO -0.05 -0.94 1.78 -0.09 -3.72 0.00 0.00 177.10 174.08 1z8r h ARG 20 N 2.74 0.48 0.00 0.43 2.43 -0.17 0.42 114.38 120.70 1z8r h ARG 20 Ca -0.50 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 1z8r h ARG 20 Cb 1.25 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1z8r h ARG 20 CO 0.63 0.32 0.00 1.58 -1.51 0.00 0.00 179.97 180.98 1z8r n HIS 21 N -4.91 0.27 0.37 2.20 -0.00 -1.26 -2.07 115.22 109.83 1z8r n HIS 21 Ca 0.06 0.12 0.06 0.00 0.46 0.00 0.00 57.72 58.41 1z8r n HIS 21 Cb 0.18 -0.69 -0.08 0.00 -0.12 0.00 0.00 29.99 29.28 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 -1.76 0.37 -4.77 0.27 7.94 0.50 -5.01 117.00 114.55 1z8r n LEU 22 Ca 0.02 -0.33 -0.35 0.00 -1.11 0.00 0.00 56.01 54.24 1z8r n LEU 22 Cb 0.13 0.00 0.02 0.00 0.53 0.00 0.00 43.42 44.10 1z8r n LEU 22 CO 0.12 0.09 0.79 0.00 -1.11 0.00 0.00 177.39 177.28 1z8r s ALA 23 N -2.38 2.63 0.40 1.96 0.00 0.12 -4.90 121.76 119.59 1z8r s ALA 23 Ca 0.01 0.83 0.08 0.00 0.00 0.00 0.00 51.96 52.88 1z8r s ALA 23 Cb 0.09 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.82 1z8r s ALA 23 CO 0.50 -0.93 0.42 0.95 0.00 0.00 0.00 175.76 176.70 1z8r s THR 24 N -1.81 2.97 0.53 0.00 -4.23 -1.26 -4.96 115.64 106.88 1z8r s THR 24 Ca 0.73 -1.24 0.25 0.00 -1.18 0.00 0.00 61.69 60.26 1z8r s THR 24 Cb -0.25 -3.05 0.39 0.00 1.34 0.00 0.00 72.50 70.93 1z8r s THR 24 CO 0.30 -0.04 2.00 1.12 -0.54 0.00 0.00 174.62 177.46 1z8r h HIS 25 N 0.96 0.00 -0.01 3.99 2.07 -2.00 0.16 115.15 120.32 1z8r h HIS 25 Ca -0.42 0.00 -0.17 0.00 -2.85 0.00 0.00 60.37 56.94 1z8r h HIS 25 Cb 1.27 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.23 1z8r h HIS 25 CO 0.48 0.00 -0.76 0.28 -3.07 0.00 0.00 177.93 174.86 1z8r h VAL 26 N 0.00 1.49 -0.33 6.12 2.07 -1.98 -0.92 116.25 122.70 1z8r h VAL 26 Ca 0.24 -2.46 -0.07 0.00 0.82 0.00 0.00 66.70 65.23 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 -0.78 0.02 0.00 0.00 177.57 177.45 1z8r h ASP 27 N 0.06 0.63 0.69 0.57 3.58 -1.06 -2.56 116.42 118.33 1z8r h ASP 27 Ca -0.02 -0.35 -0.15 0.00 0.42 0.00 0.00 57.03 56.92 1z8r h ASP 27 Cb 1.33 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 42.19 1z8r h ASP 27 CO 0.11 0.84 -0.72 -0.50 -2.88 0.00 0.00 179.24 176.08 1z8r h TRP 28 N 0.42 0.04 -0.82 0.28 6.55 -1.46 0.10 115.95 121.05 1z8r h TRP 28 Ca 0.09 -0.02 0.02 0.00 0.95 0.00 0.00 58.89 59.93 1z8r h TRP 28 Cb 0.55 -0.01 -0.05 0.00 -0.86 0.00 0.00 29.16 28.80 1z8r h TRP 28 CO 0.05 0.74 0.53 1.96 -1.05 0.00 0.00 178.44 180.67 1z8r h GLN 29 N 0.02 1.02 -0.33 0.49 4.20 -0.96 -2.69 115.11 116.86 1z8r h GLN 29 Ca -0.01 -0.06 -0.21 0.00 0.06 0.00 0.00 58.65 58.43 1z8r h GLN 29 Cb 1.28 -0.23 -0.14 0.00 0.30 0.00 0.00 27.48 28.68 1z8r h GLN 29 CO 0.10 0.67 -0.37 0.27 -0.67 0.00 0.00 178.83 178.84 1z8r n ASN 30 N -4.56 2.91 -4.72 1.46 0.23 -0.98 -5.03 115.26 104.57 1z8r n ASN 30 Ca 0.09 -3.83 -0.42 0.00 -0.53 0.00 0.00 54.58 49.89 1z8r n ASN 30 Cb 0.06 -0.55 -0.04 0.00 -2.08 0.00 0.00 39.78 37.18 1z8r n ASN 30 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1z8r n VAL 32 N 3.29 1.59 -4.02 0.00 0.24 0.28 -4.96 118.33 114.75 1z8r n VAL 32 Ca 0.05 -0.63 -0.09 0.00 -2.04 0.00 0.00 64.34 61.63 1z8r n VAL 32 Cb 0.48 -1.45 -0.11 0.00 -1.47 0.00 0.00 33.84 31.30 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 -0.24 6.34 -0.00 -1.05 -4.97 118.94 116.86 1z8r s TRP 33 Ca -0.27 -0.70 -0.08 0.00 -0.00 0.00 0.00 56.10 55.04 1z8r s TRP 33 Cb 0.08 -0.27 0.11 0.00 -0.00 0.00 0.00 33.47 33.38 1z8r s TRP 33 CO 0.69 -0.24 0.52 -2.00 -0.00 0.00 0.00 176.95 175.92 1z8r s GLU 34 N -2.27 0.44 -0.49 5.86 2.56 -1.26 0.50 118.70 124.04 1z8r s GLU 34 Ca -0.08 1.22 -0.09 0.00 0.00 0.00 0.00 54.97 56.02 1z8r s GLU 34 Cb -0.04 0.55 0.12 0.00 2.00 0.00 0.00 34.13 36.77 1z8r s GLU 34 CO -0.04 -0.22 0.36 -0.51 -0.56 0.00 0.00 175.26 174.29 1z8r s ASP 35 N 2.68 5.70 0.54 -1.70 1.01 0.19 -4.94 116.67 120.15 1z8r s ASP 35 Ca -0.04 -1.99 0.21 0.00 0.71 0.00 0.00 52.55 51.43 1z8r s ASP 35 Cb -0.12 -2.00 1.41 0.00 1.01 0.00 0.00 42.92 43.21 1z8r s ASP 35 CO -0.16 -0.67 2.14 0.10 0.21 0.00 0.00 175.17 176.79 1z8r h TYR 36 N 8.35 0.00 -0.89 4.23 -0.00 -1.95 0.82 116.97 127.53 1z8r h TYR 36 Ca -0.19 0.00 0.02 0.00 0.00 0.00 0.00 58.73 58.56 1z8r h TYR 36 Cb 1.06 0.00 -0.05 0.00 0.00 0.00 0.00 36.73 37.75 1z8r h TYR 36 CO 0.65 0.00 0.59 -0.91 -0.00 0.00 0.00 178.16 178.49 1z8r h ASN 37 N 0.00 1.00 -0.01 0.10 2.35 -1.92 -3.09 115.58 114.01 1z8r h ASN 37 Ca 0.05 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1z8r h ASN 37 Cb 0.20 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.32 1z8r h ASN 37 CO -0.00 0.72 0.00 -2.11 -1.65 0.00 0.00 177.43 174.39 1z8r n ARG 38 N -4.41 -0.29 -3.32 0.81 -4.01 -0.82 -2.01 116.66 102.60 1z8r n ARG 38 Ca 0.11 -0.76 -0.16 0.00 -1.04 0.00 0.00 57.85 55.99 1z8r n ARG 38 Cb 0.04 -1.06 0.08 0.00 -3.04 0.00 0.00 32.46 28.48 1z8r n ARG 38 CO 0.00 0.00 0.00 -0.25 -3.04 0.00 0.00 177.63 174.34 1z8r n ASP 39 N 0.15 -4.25 -3.87 2.89 9.92 0.28 -4.85 116.55 116.82 1z8r n ASP 39 Ca 0.02 -0.66 -0.16 0.00 -0.53 0.00 0.00 54.79 53.46 1z8r n ASP 39 Cb 0.10 -5.12 -0.15 0.00 -0.64 0.00 0.00 41.12 35.30 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 -5.85 1.51 0.12 0.64 2.96 -0.95 0.60 118.68 117.70 1z8r s LEU 40 Ca 0.22 -0.05 0.05 0.00 -0.22 0.00 0.00 54.13 54.12 1z8r s LEU 40 Cb -0.03 -0.24 -0.04 0.00 0.50 0.00 0.00 46.19 46.39 1z8r s LEU 40 CO 0.73 -0.04 -0.11 -1.48 -1.32 0.00 0.00 176.35 174.12 1z8r s LEU 41 N 0.59 2.43 -0.11 -0.68 -0.00 -0.83 0.53 118.68 120.60 1z8r s LEU 41 Ca -0.06 -0.85 0.02 0.00 -0.00 0.00 0.00 54.13 53.24 1z8r s LEU 41 Cb -0.09 -0.40 -0.01 0.00 -0.00 0.00 0.00 46.19 45.69 1z8r s LEU 41 CO -0.01 -0.23 -0.19 -0.69 -0.00 0.00 0.00 176.35 175.23 1z8r s VAL 42 N -2.50 2.53 0.23 1.48 1.01 0.18 -1.77 120.40 121.56 1z8r s VAL 42 Ca 0.09 -0.85 0.11 0.00 0.00 0.00 0.00 61.98 61.33 1z8r s VAL 42 Cb -0.03 -2.02 -0.05 0.00 0.00 0.00 0.00 36.38 34.29 1z8r s VAL 42 CO 0.01 0.54 -0.22 -0.94 0.00 0.00 0.00 175.10 174.50 1z8r s SER 43 N 0.33 3.44 -0.24 3.32 1.04 -0.47 0.98 113.70 122.10 1z8r s SER 43 Ca -0.15 -0.95 -0.13 0.00 0.48 0.00 0.00 55.95 55.20 1z8r s SER 43 Cb -0.17 -0.27 -0.04 0.00 0.10 0.00 0.00 66.02 65.64 1z8r s SER 43 CO 0.07 0.07 0.27 0.42 0.98 0.00 0.00 173.24 175.05 1z8r s THR 44 N -2.12 5.27 0.00 2.02 -4.23 -1.05 0.00 115.64 115.53 1z8r s THR 44 Ca 0.25 0.41 0.00 0.00 -1.18 0.00 0.00 61.69 61.16 1z8r s THR 44 Cb -0.06 -3.61 0.00 0.00 1.34 0.00 0.00 72.50 70.17 1z8r s THR 44 CO 0.12 0.27 0.00 0.35 -0.54 0.00 0.00 174.62 174.82 1z8r n THR 45 N 4.54 0.00 -2.76 3.99 -2.24 -0.90 -4.98 114.28 111.94 1z8r n THR 45 Ca -0.12 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.63 1z8r n THR 45 Cb 0.51 -1.09 0.04 0.00 -2.10 0.00 0.00 70.33 67.70 1z8r n THR 45 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1z8r n THR 46 N -0.54 1.28 -4.31 4.28 5.66 -1.26 -4.90 114.28 114.49 1z8r n THR 46 Ca 0.00 -3.03 -0.18 0.00 -3.05 0.00 0.00 64.05 57.79 1z8r n THR 46 Cb 0.00 1.03 -0.06 0.00 -1.55 0.00 0.00 70.33 69.74 1z8r n THR 46 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1z8r n ALA 47 N -0.48 0.54 -2.53 1.79 0.00 -1.26 -5.16 120.51 113.42 1z8r n ALA 47 Ca 0.09 -1.66 -0.33 0.00 0.00 0.00 0.00 53.44 51.55 1z8r n ALA 47 Cb 0.81 1.24 -0.05 0.00 0.00 0.00 0.00 19.45 21.45 1z8r n ALA 47 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1z8r s HIS 48 N -2.99 3.50 0.75 0.00 3.76 -1.26 -4.47 115.29 114.58 1z8r s HIS 48 Ca 0.26 0.78 -0.13 0.00 -0.15 0.00 0.00 55.06 55.83 1z8r s HIS 48 Cb 0.01 -2.17 0.05 0.00 1.11 0.00 0.00 32.58 31.58 1z8r s HIS 48 CO 0.19 0.40 1.13 0.20 -0.85 0.00 0.00 174.74 175.80 1z8r s GLY 49 N -2.15 1.95 0.00 -2.22 0.00 -1.26 -4.74 107.32 98.90 1z8r s GLY 49 Ca 0.41 0.52 0.00 0.00 0.00 0.00 0.00 44.72 45.65 1z8r s GLY 49 CO 0.21 0.89 0.00 0.00 0.00 0.00 0.00 173.10 174.20 1z8r s ASP 51 N -4.86 6.69 -0.19 0.00 1.11 -1.25 -5.08 116.67 113.09 1z8r s ASP 51 Ca 0.00 1.11 0.01 0.00 0.18 0.00 0.00 52.55 53.85 1z8r s ASP 51 Cb 0.00 -2.30 0.03 0.00 1.07 0.00 0.00 42.92 41.72 1z8r s ASP 51 CO 0.00 -0.17 -0.14 -0.89 1.18 0.00 0.00 175.17 175.15 1z8r s THR 52 N -1.96 1.76 0.27 -1.27 2.01 -1.26 -4.71 115.64 110.48 1z8r s THR 52 Ca 0.51 -0.94 -0.30 0.00 0.31 0.00 0.00 61.69 61.27 1z8r s THR 52 Cb -0.11 -1.73 -0.09 0.00 0.01 0.00 0.00 72.50 70.58 1z8r s THR 52 CO 0.20 0.32 1.09 -0.63 -0.69 0.00 0.00 174.62 174.92 1z8r s ILE 53 N 1.37 3.54 -0.22 1.82 1.01 -1.26 -0.45 121.20 127.01 1z8r s ILE 53 Ca 0.01 1.53 -0.21 0.00 0.00 0.00 0.00 60.65 61.98 1z8r s ILE 53 Cb -0.15 -3.97 -0.02 0.00 0.01 0.00 0.00 42.46 38.33 1z8r s ILE 53 CO -0.10 0.35 0.65 0.00 0.00 0.00 0.00 174.94 175.85 1z8r s ALA 54 N -1.06 3.58 -0.24 9.38 0.00 0.64 -3.74 121.76 130.31 1z8r s ALA 54 Ca 0.45 -0.30 0.02 0.00 0.00 0.00 0.00 51.96 52.13 1z8r s ALA 54 Cb -0.32 -3.03 0.29 0.00 0.00 0.00 0.00 23.12 20.07 1z8r s ALA 54 CO 0.40 -0.68 1.35 -2.13 0.00 0.00 0.00 175.76 174.71 1z8r n ARG 55 N 5.37 1.64 -3.66 0.00 3.00 -1.26 -4.73 116.66 117.03 1z8r n ARG 55 Ca -0.00 -1.28 -0.20 0.00 -0.00 0.00 0.00 57.85 56.37 1z8r n ARG 55 Cb 0.49 -1.53 -0.01 0.00 0.00 0.00 0.00 32.46 31.41 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 -1.55 0.00 -1.24 0.00 6.02 -1.26 -5.09 117.38 114.25 1z8r n GLN 57 Ca -0.03 0.16 0.12 0.00 -0.01 0.00 0.00 57.00 57.23 1z8r n GLN 57 Cb 0.58 -0.65 -0.07 0.00 1.02 0.00 0.00 30.24 31.12 1z8r n GLN 57 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1z8r n THR 59 N -3.87 0.00 -4.03 0.00 -1.04 -1.26 -4.98 114.28 99.09 1z8r n THR 59 Ca -0.07 -0.45 -0.24 0.00 -2.04 0.00 0.00 64.05 61.26 1z8r n THR 59 Cb 0.50 1.02 -0.17 0.00 -1.82 0.00 0.00 70.33 69.86 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 -1.04 0.73 0.11 12.58 -4.23 -1.26 -1.76 115.64 120.76 1z8r s THR 60 Ca 0.02 -0.15 0.01 0.00 -1.18 0.00 0.00 61.69 60.38 1z8r s THR 60 Cb 0.02 -0.77 -0.04 0.00 1.34 0.00 0.00 72.50 73.05 1z8r s THR 60 CO 0.11 0.30 -0.03 -0.83 -0.54 0.00 0.00 174.62 173.62 1z8r s GLY 61 N 1.42 0.83 -0.16 3.99 0.00 0.13 -4.82 107.32 108.71 1z8r s GLY 61 Ca -0.02 -1.39 -0.07 0.00 0.00 0.00 0.00 44.72 43.24 1z8r s GLY 61 CO -0.03 -1.43 0.09 0.54 0.00 0.00 0.00 173.10 172.26 1z8r s VAL 62 N -3.75 5.01 -0.07 1.40 0.11 -0.79 0.72 120.40 123.03 1z8r s VAL 62 Ca 0.15 0.04 0.05 0.00 -2.93 0.00 0.00 61.98 59.29 1z8r s VAL 62 Cb 0.06 -3.24 -0.01 0.00 -1.53 0.00 0.00 36.38 31.67 1z8r s VAL 62 CO -0.03 0.50 -0.22 -0.72 -3.33 0.00 0.00 175.10 171.30 1z8r s TYR 63 N -0.03 2.54 0.18 1.54 -0.85 0.67 -2.20 117.35 119.19 1z8r s TYR 63 Ca 0.07 -0.73 -0.31 0.00 -0.52 0.00 0.00 57.07 55.59 1z8r s TYR 63 Cb -0.12 -1.66 -0.09 0.00 0.38 0.00 0.00 41.96 40.48 1z8r s TYR 63 CO 0.01 -0.22 1.37 0.12 -1.52 0.00 0.00 175.55 175.31 1z8r s PHE 64 N -0.05 3.20 0.32 -3.49 5.36 -1.26 -2.26 117.98 119.80 1z8r s PHE 64 Ca -0.06 1.06 -0.05 0.00 -0.96 0.00 0.00 56.93 56.92 1z8r s PHE 64 Cb -0.15 -3.69 -0.05 0.00 -0.34 0.00 0.00 43.02 38.80 1z8r s PHE 64 CO 0.05 -2.28 0.59 0.00 -1.46 0.00 0.00 175.22 172.12 1z8r n ALA 66 N -1.13 1.17 -0.09 0.00 0.00 -0.88 -3.48 120.51 116.10 1z8r n ALA 66 Ca -0.01 -0.75 -0.22 0.00 0.00 0.00 0.00 53.44 52.45 1z8r n ALA 66 Cb 0.54 -0.63 -0.12 0.00 0.00 0.00 0.00 19.45 19.24 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 -3.27 1.91 0.25 0.00 2.88 -1.25 -4.19 113.62 109.95 1z8r n SER 67 Ca -0.29 0.38 0.10 0.00 -1.33 0.00 0.00 58.87 57.73 1z8r n SER 67 Cb 1.05 -0.94 0.67 0.00 -0.75 0.00 0.00 64.21 64.24 1z8r n SER 67 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1z8r h LYS 68 N -0.82 0.00 -2.06 -1.46 1.79 -1.83 -3.46 116.57 108.72 1z8r h LYS 68 Ca -0.39 0.00 -0.36 0.00 -2.18 0.00 0.00 60.65 57.72 1z8r h LYS 68 Cb 1.45 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 32.01 1z8r h LYS 68 CO -0.18 0.12 -0.39 0.43 -1.08 0.00 0.00 179.45 178.35 1z8r n SER 69 N -3.97 -4.93 -4.33 0.86 7.64 -1.23 -4.94 113.62 102.73 1z8r n SER 69 Ca -0.02 0.28 -0.17 0.00 1.01 0.00 0.00 58.87 59.96 1z8r n SER 69 Cb 0.21 -4.29 -0.10 0.00 -1.01 0.00 0.00 64.21 59.01 1z8r n SER 69 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1z8r s LYS 70 N -4.17 1.44 -0.10 1.43 1.02 -1.26 -4.96 119.74 113.15 1z8r s LYS 70 Ca 0.00 -1.78 -0.26 0.00 0.02 0.00 0.00 55.97 53.95 1z8r s LYS 70 Cb 0.00 -0.34 -0.02 0.00 -0.52 0.00 0.00 37.83 36.95 1z8r s LYS 70 CO 0.00 -0.28 0.83 -3.38 -0.92 0.00 0.00 175.35 171.60 1z8r s HIS 71 N -3.70 3.52 -0.25 3.18 -3.43 -1.26 -2.29 115.29 111.05 1z8r s HIS 71 Ca 0.38 1.35 -0.01 0.00 -0.80 0.00 0.00 55.06 55.98 1z8r s HIS 71 Cb 0.08 -2.98 0.03 0.00 -1.43 0.00 0.00 32.58 28.28 1z8r s HIS 71 CO 0.14 -0.10 -0.07 0.71 -2.00 0.00 0.00 174.74 173.42 1z8r s TYR 72 N 1.53 3.11 -0.18 0.38 1.51 -0.96 -4.97 117.35 117.78 1z8r s TYR 72 Ca 0.41 -1.74 -0.29 0.00 -1.01 0.00 0.00 57.07 54.44 1z8r s TYR 72 Cb -0.18 -2.03 -0.01 0.00 -0.11 0.00 0.00 41.96 39.63 1z8r s TYR 72 CO 0.17 -0.77 1.16 -2.14 -1.11 0.00 0.00 175.55 172.86 1z8r s PRO 73 N 1.27 4.26 0.04 -1.71 0.02 -1.26 -0.24 135.00 137.39 1z8r s PRO 73 Ca -0.02 1.53 0.01 0.00 0.02 0.00 0.00 61.00 62.55 1z8r s PRO 73 Cb -0.17 -3.69 -0.02 0.00 0.02 0.00 0.00 34.50 30.63 1z8r s PRO 73 CO -0.05 -0.64 -0.06 0.08 -0.33 0.00 0.00 177.00 176.00 1z8r s VAL 74 N 3.21 0.40 -0.15 3.83 1.01 0.22 -4.93 120.40 123.99 1z8r s VAL 74 Ca 0.50 -1.11 -0.10 0.00 0.00 0.00 0.00 61.98 61.27 1z8r s VAL 74 Cb -0.19 -0.60 -0.05 0.00 0.00 0.00 0.00 36.38 35.54 1z8r s VAL 74 CO 0.12 -0.48 0.19 -0.44 0.00 0.00 0.00 175.10 174.49 1z8r s SER 75 N -1.70 6.36 0.28 3.32 0.01 -1.26 0.17 113.70 120.88 1z8r s SER 75 Ca -0.10 0.42 -0.03 0.00 1.31 0.00 0.00 55.95 57.55 1z8r s SER 75 Cb -0.08 -2.11 -0.02 0.00 0.21 0.00 0.00 66.02 64.02 1z8r s SER 75 CO -0.01 0.25 0.36 0.72 0.41 0.00 0.00 173.24 174.96 1z8r s PHE 76 N -0.16 1.00 0.24 2.43 -0.12 -0.72 -4.27 117.98 116.39 1z8r s PHE 76 Ca 0.13 -1.22 0.09 0.00 -0.05 0.00 0.00 56.93 55.88 1z8r s PHE 76 Cb -0.12 -0.23 -0.04 0.00 -0.63 0.00 0.00 43.02 42.00 1z8r s PHE 76 CO 0.02 -0.93 0.02 -2.00 -0.05 0.00 0.00 175.22 172.28 1z8r s GLU 77 N -3.65 2.38 -0.78 1.99 2.56 -1.00 -4.69 118.70 115.51 1z8r s GLU 77 Ca 0.32 -1.32 0.03 0.00 0.00 0.00 0.00 54.97 54.00 1z8r s GLU 77 Cb 0.02 -2.24 0.29 0.00 2.00 0.00 0.00 34.13 34.20 1z8r s GLU 77 CO 0.16 0.39 1.10 0.41 -0.56 0.00 0.00 175.26 176.76 1z8r n GLY 78 N -0.76 5.24 3.77 -1.50 0.00 -1.26 -2.05 105.19 108.62 1z8r n GLY 78 Ca -0.07 -2.73 -0.41 0.00 0.00 0.00 0.00 46.02 42.81 1z8r n GLY 78 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1z8r s PRO 79 N -2.99 4.38 0.00 1.61 0.02 -1.17 -4.86 135.00 131.98 1z8r s PRO 79 Ca 0.40 2.19 0.00 0.00 0.02 0.00 0.00 61.00 63.60 1z8r s PRO 79 Cb 0.16 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.60 1z8r s PRO 79 CO -0.02 -0.16 0.00 0.41 -0.33 0.00 0.00 177.00 176.90 1z8r n GLY 80 N 0.84 -2.19 3.60 0.52 0.00 -1.26 -2.29 105.19 104.42 1z8r n GLY 80 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 4.04 -0.13 0.99 1.98 -1.26 0.11 118.68 124.41 1z8r s LEU 81 Ca 0.00 0.28 0.01 0.00 -2.89 0.00 0.00 54.13 51.53 1z8r s LEU 81 Cb 0.00 -2.43 0.02 0.00 0.66 0.00 0.00 46.19 44.44 1z8r s LEU 81 CO 0.00 -0.19 -0.15 -0.69 -1.89 0.00 0.00 176.35 173.43 1z8r s VAL 82 N 2.07 1.61 -0.44 1.68 1.01 -0.86 -4.96 120.40 120.51 1z8r s VAL 82 Ca 0.15 -0.68 -0.28 0.00 0.00 0.00 0.00 61.98 61.17 1z8r s VAL 82 Cb -0.16 -1.48 -0.00 0.00 0.00 0.00 0.00 36.38 34.74 1z8r s VAL 82 CO 0.10 0.46 1.58 -1.83 0.00 0.00 0.00 175.10 175.41 1z8r s GLU 83 N 1.24 3.34 -0.05 2.72 -1.05 -1.26 -2.20 118.70 121.43 1z8r s GLU 83 Ca -0.00 0.95 -0.30 0.00 -0.15 0.00 0.00 54.97 55.47 1z8r s GLU 83 Cb -0.14 -4.14 -0.04 0.00 -0.44 0.00 0.00 34.13 29.38 1z8r s GLU 83 CO -0.07 -1.86 1.33 0.14 0.95 0.00 0.00 175.26 175.76 1z8r s VAL 84 N 6.40 3.98 0.55 1.83 -7.23 0.28 -4.89 120.40 121.32 1z8r s VAL 84 Ca 0.66 1.30 -0.19 0.00 -1.81 0.00 0.00 61.98 61.94 1z8r s VAL 84 Cb -0.16 -3.84 -0.05 0.00 0.56 0.00 0.00 36.38 32.89 1z8r s VAL 84 CO 0.30 -0.03 1.14 -1.58 -0.31 0.00 0.00 175.10 174.61 1z8r s GLN 85 N 2.70 3.29 -0.53 4.82 0.74 -1.26 -1.79 119.66 127.63 1z8r s GLN 85 Ca 0.60 1.62 -0.27 0.00 0.05 0.00 0.00 55.36 57.37 1z8r s GLN 85 Cb -0.28 -1.99 -0.03 0.00 1.10 0.00 0.00 33.01 31.81 1z8r s GLN 85 CO 0.23 -0.90 1.95 -2.00 -0.55 0.00 0.00 175.29 174.02 1z8r s GLU 86 N -3.33 2.67 0.13 1.67 2.12 -1.25 -4.58 118.70 116.13 1z8r s GLU 86 Ca 0.73 0.93 -0.06 0.00 0.36 0.00 0.00 54.97 56.93 1z8r s GLU 86 Cb -0.24 -4.39 -0.02 0.00 0.26 0.00 0.00 34.13 29.74 1z8r s GLU 86 CO 0.28 -2.66 0.17 -1.12 -0.54 0.00 0.00 175.26 171.39 1z8r s SER 87 N 8.46 0.18 0.00 -1.70 0.01 -0.73 -4.92 113.70 115.00 1z8r s SER 87 Ca 0.75 -0.96 0.00 0.00 1.31 0.00 0.00 55.95 57.05 1z8r s SER 87 Cb -0.15 0.36 0.00 0.00 0.21 0.00 0.00 66.02 66.43 1z8r s SER 87 CO 0.24 -0.79 0.00 1.21 0.41 0.00 0.00 173.24 174.31 1z8r n GLU 88 N -0.12 0.00 -0.74 12.44 4.07 -1.26 -0.62 120.64 134.40 1z8r n GLU 88 Ca -0.08 0.00 -0.02 0.00 -0.06 0.00 0.00 57.16 56.99 1z8r n GLU 88 Cb 0.63 0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.99 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 -5.04 4.31 0.18 -1.26 -5.11 117.16 110.24 1z8r n TYR 89 Ca 0.00 -0.21 -0.30 0.00 1.88 0.00 0.00 57.90 59.28 1z8r n TYR 89 Cb 0.00 0.29 -0.17 0.00 -0.38 0.00 0.00 39.34 39.08 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 2.19 0.37 -3.48 6.14 0.21 -5.13 117.35 117.64 1z8r s TYR 90 Ca 0.02 -0.81 -0.20 0.00 0.64 0.00 0.00 57.07 56.72 1z8r s TYR 90 Cb 0.03 -1.48 -0.10 0.00 0.42 0.00 0.00 41.96 40.83 1z8r s TYR 90 CO -0.01 -0.32 0.87 -1.25 0.64 0.00 0.00 175.55 175.48 1z8r s PRO 91 N 0.28 4.22 -0.89 4.97 0.04 -1.26 -1.78 135.00 140.58 1z8r s PRO 91 Ca -0.13 1.01 -0.10 0.00 0.04 0.00 0.00 61.00 61.81 1z8r s PRO 91 Cb -0.16 -2.38 -0.29 0.00 0.04 0.00 0.00 34.50 31.71 1z8r s PRO 91 CO 0.06 0.09 2.08 1.63 0.04 0.00 0.00 177.00 180.90 1z8r n LYS 92 N -0.31 0.07 -4.55 4.56 4.76 -1.25 -4.66 118.16 116.77 1z8r n LYS 92 Ca 0.05 -0.12 -0.26 0.00 -2.87 0.00 0.00 58.31 55.11 1z8r n LYS 92 Cb 0.53 -1.36 -0.10 0.00 -1.84 0.00 0.00 35.03 32.26 1z8r n LYS 92 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1z8r s ARG 93 N 7.07 1.85 -0.16 1.97 3.52 -0.74 -4.93 118.95 127.53 1z8r s ARG 93 Ca 1.15 -2.05 -0.10 0.00 -0.13 0.00 0.00 55.73 54.59 1z8r s ARG 93 Cb -0.68 -1.25 -0.05 0.00 -1.56 0.00 0.00 34.95 31.41 1z8r s ARG 93 CO 0.46 -0.15 0.18 0.71 -0.81 0.00 0.00 175.30 175.68 1z8r s TYR 94 N -3.00 3.48 -0.18 5.12 1.51 -1.26 1.00 117.35 124.02 1z8r s TYR 94 Ca 0.33 0.46 0.00 0.00 -1.01 0.00 0.00 57.07 56.85 1z8r s TYR 94 Cb 0.08 -2.15 0.04 0.00 -0.11 0.00 0.00 41.96 39.82 1z8r s TYR 94 CO 0.16 0.40 -0.08 -1.14 -1.11 0.00 0.00 175.55 173.78 1z8r s GLN 95 N -0.01 1.77 0.31 -0.62 2.00 -0.93 -4.39 119.66 117.79 1z8r s GLN 95 Ca 0.12 -0.70 -0.26 0.00 -2.00 0.00 0.00 55.36 52.52 1z8r s GLN 95 Cb -0.12 -2.24 -0.10 0.00 0.80 0.00 0.00 33.01 31.36 1z8r s GLN 95 CO 0.01 -0.43 0.94 -1.54 -0.50 0.00 0.00 175.29 173.78 1z8r s SER 96 N 1.50 7.36 -0.92 6.67 1.04 -0.85 -2.03 113.70 126.47 1z8r s SER 96 Ca -0.00 1.84 -0.05 0.00 0.48 0.00 0.00 55.95 58.22 1z8r s SER 96 Cb -0.16 -2.58 -0.06 0.00 0.10 0.00 0.00 66.02 63.32 1z8r s SER 96 CO -0.08 -0.05 0.81 1.41 0.98 0.00 0.00 173.24 176.32 1z8r n HIS 97 N 0.64 -2.27 -4.93 5.02 8.25 0.31 -4.53 115.22 117.72 1z8r n HIS 97 Ca 0.02 0.80 -0.28 0.00 -0.26 0.00 0.00 57.72 57.99 1z8r n HIS 97 Cb 0.50 -3.96 -0.17 0.00 1.12 0.00 0.00 29.99 27.48 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 -3.32 1.62 0.05 1.59 0.11 -0.97 -1.92 120.40 117.56 1z8r s VAL 98 Ca 0.38 -0.77 0.00 0.00 -2.93 0.00 0.00 61.98 58.66 1z8r s VAL 98 Cb -0.05 -1.42 -0.04 0.00 -1.53 0.00 0.00 36.38 33.34 1z8r s VAL 98 CO 0.67 0.46 0.16 -0.76 -3.33 0.00 0.00 175.10 172.30 1z8r s LEU 99 N 0.39 4.18 -0.03 2.54 1.02 0.28 -3.05 118.68 124.01 1z8r s LEU 99 Ca -0.14 0.20 0.04 0.00 0.02 0.00 0.00 54.13 54.24 1z8r s LEU 99 Cb -0.16 -2.74 -0.00 0.00 0.02 0.00 0.00 46.19 43.31 1z8r s LEU 99 CO 0.06 0.19 -0.14 -0.76 0.02 0.00 0.00 176.35 175.72 1z8r s LEU 100 N -2.35 1.89 -0.11 1.79 1.43 -0.87 0.35 118.68 120.81 1z8r s LEU 100 Ca 0.32 -0.28 0.01 0.00 -1.03 0.00 0.00 54.13 53.15 1z8r s LEU 100 Cb -0.13 -0.78 0.02 0.00 0.03 0.00 0.00 46.19 45.33 1z8r s LEU 100 CO 0.24 0.13 -0.14 0.00 0.23 0.00 0.00 176.35 176.81 1z8r s ALA 101 N 0.02 1.66 -0.39 4.21 0.00 -0.08 -2.38 121.76 124.80 1z8r s ALA 101 Ca -0.02 -0.73 -0.17 0.00 0.00 0.00 0.00 51.96 51.05 1z8r s ALA 101 Cb -0.09 -0.86 0.01 0.00 0.00 0.00 0.00 23.12 22.17 1z8r s ALA 101 CO 0.01 -0.15 0.41 -0.08 0.00 0.00 0.00 175.76 175.96 1z8r s THR 102 N 1.11 5.11 0.57 0.00 -1.32 -1.26 0.16 115.64 120.02 1z8r s THR 102 Ca -0.04 -0.19 -0.18 0.00 -1.21 0.00 0.00 61.69 60.07 1z8r s THR 102 Cb -0.14 -3.96 -0.09 0.00 -1.51 0.00 0.00 72.50 66.80 1z8r s THR 102 CO -0.03 -0.30 0.50 0.61 -2.21 0.00 0.00 174.62 173.18 1z8r n GLY 103 N 5.05 -1.56 0.00 6.08 0.00 -0.73 -4.93 105.19 109.09 1z8r n GLY 103 Ca -0.08 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.70 0.00 -3.89 1.61 3.72 -1.26 -4.95 117.46 111.00 1z8r n PHE 104 Ca 0.11 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.40 1z8r n PHE 104 Cb 0.48 -0.46 -0.12 0.00 -0.94 0.00 0.00 39.48 38.43 1z8r n PHE 104 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1z8r s SER 105 N -2.43 0.03 -0.44 4.37 0.01 -1.26 -4.98 113.70 108.99 1z8r s SER 105 Ca 0.00 -0.08 -0.15 0.00 1.31 0.00 0.00 55.95 57.03 1z8r s SER 105 Cb 0.00 0.12 0.02 0.00 0.21 0.00 0.00 66.02 66.37 1z8r s SER 105 CO 0.00 -0.13 0.60 1.21 0.41 0.00 0.00 173.24 175.34 1z8r n GLU 106 N 2.52 -2.33 -1.29 12.44 0.00 -1.26 -4.99 120.64 125.73 1z8r n GLU 106 Ca -0.16 2.09 -0.30 0.00 0.00 0.00 0.00 57.16 58.79 1z8r n GLU 106 Cb 0.58 -5.68 0.11 0.00 0.00 0.00 0.00 31.44 26.45 1z8r n GLU 106 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.13 175.88 1z8r s PRO 107 N -2.63 1.77 0.28 5.31 0.04 -1.26 -5.08 135.00 133.44 1z8r s PRO 107 Ca 0.24 0.91 -0.03 0.00 0.04 0.00 0.00 61.00 62.15 1z8r s PRO 107 Cb -0.07 -1.86 0.01 0.00 0.04 0.00 0.00 34.50 32.63 1z8r s PRO 107 CO 0.77 -1.91 0.43 0.41 0.04 0.00 0.00 177.00 176.74 1z8r n GLY 108 N -1.34 2.09 3.70 0.56 0.00 -1.26 -5.14 105.19 103.81 1z8r n GLY 108 Ca 0.08 -1.49 -0.30 0.00 0.00 0.00 0.00 46.02 44.30 1z8r n GLY 108 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1z8r s ASP 109 N -2.70 3.40 -0.23 1.61 1.11 -1.26 -4.94 116.67 113.65 1z8r s ASP 109 Ca 0.21 1.68 -0.18 0.00 0.18 0.00 0.00 52.55 54.44 1z8r s ASP 109 Cb -0.01 -2.33 0.06 0.00 1.07 0.00 0.00 42.92 41.71 1z8r s ASP 109 CO 0.15 -2.72 0.60 0.00 1.18 0.00 0.00 175.17 174.39 1z8r s ALA 110 N -2.84 -1.54 -0.30 5.23 0.00 -1.26 -2.08 121.76 118.98 1z8r s ALA 110 Ca 0.64 1.87 -0.08 0.00 0.00 0.00 0.00 51.96 54.39 1z8r s ALA 110 Cb -0.19 -1.10 0.18 0.00 0.00 0.00 0.00 23.12 22.01 1z8r s ALA 110 CO 0.58 -0.31 0.84 0.20 0.00 0.00 0.00 175.76 177.07 1z8r s GLY 111 N 0.81 -0.62 0.00 0.00 0.00 -1.25 -4.72 107.32 101.54 1z8r s GLY 111 Ca -0.04 2.39 0.00 0.00 0.00 0.00 0.00 44.72 47.07 1z8r s GLY 111 CO -0.06 3.55 0.00 0.61 0.00 0.00 0.00 173.10 177.19 1z8r n GLY 112 N 5.41 -0.48 3.30 0.20 0.00 -1.26 -4.72 105.19 107.64 1z8r n GLY 112 Ca -0.05 -0.44 -0.27 0.00 0.00 0.00 0.00 46.02 45.26 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 -4.00 1.89 -0.23 -0.61 -4.36 -1.26 -1.32 121.20 111.31 1z8r s ILE 113 Ca 0.00 -1.33 -0.22 0.00 -0.26 0.00 0.00 60.65 58.84 1z8r s ILE 113 Cb 0.00 -1.64 -0.02 0.00 1.25 0.00 0.00 42.46 42.05 1z8r s ILE 113 CO 0.00 0.24 0.70 -0.22 0.24 0.00 0.00 174.94 175.91 1z8r s LEU 114 N -1.30 4.10 0.12 0.37 2.96 -0.36 -4.15 118.68 120.41 1z8r s LEU 114 Ca 0.10 0.87 0.10 0.00 -0.22 0.00 0.00 54.13 54.97 1z8r s LEU 114 Cb -0.09 -2.99 -0.04 0.00 0.50 0.00 0.00 46.19 43.57 1z8r s LEU 114 CO 0.02 -0.39 -0.23 0.00 -1.32 0.00 0.00 176.35 174.44 1z8r s ARG 115 N 2.41 1.60 0.32 1.98 1.70 -0.94 0.03 118.95 126.06 1z8r s ARG 115 Ca 0.30 -1.25 0.08 0.00 -0.47 0.00 0.00 55.73 54.39 1z8r s ARG 115 Cb -0.16 -2.00 -0.04 0.00 -0.57 0.00 0.00 34.95 32.18 1z8r s ARG 115 CO 0.09 0.47 0.11 0.00 -1.08 0.00 0.00 175.30 174.89 1z8r h GLU 117 N 1.62 0.00 0.00 0.00 5.08 -1.96 -1.13 114.58 118.20 1z8r h GLU 117 Ca -0.44 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 57.58 1z8r h GLU 117 Cb 1.25 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.44 1z8r h GLU 117 CO 0.62 0.00 -2.10 0.72 -1.00 0.00 0.00 179.01 177.25 1z8r n HIS 118 N -2.61 0.45 0.00 4.33 8.25 -1.26 -5.09 115.22 119.30 1z8r n HIS 118 Ca -0.02 0.16 0.00 0.00 -0.26 0.00 0.00 57.72 57.60 1z8r n HIS 118 Cb 0.11 -1.08 0.00 0.00 1.12 0.00 0.00 29.99 30.14 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 1.70 -0.92 3.81 -1.41 0.00 -0.43 -4.62 105.19 103.31 1z8r n GLY 119 Ca -0.27 -0.10 -0.36 0.00 0.00 0.00 0.00 46.02 45.29 1z8r n GLY 119 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1z8r s VAL 120 N -4.00 5.41 -0.06 1.61 1.01 0.41 0.11 120.40 124.88 1z8r s VAL 120 Ca 0.00 0.30 -0.04 0.00 0.00 0.00 0.00 61.98 62.24 1z8r s VAL 120 Cb 0.00 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 32.89 1z8r s VAL 120 CO 0.00 0.53 -0.08 -0.38 0.00 0.00 0.00 175.10 175.16 1z8r n ILE 121 N 2.69 0.55 -1.97 2.22 2.08 0.10 -0.26 119.36 124.78 1z8r n ILE 121 Ca -0.17 0.38 0.00 0.00 0.56 0.00 0.00 62.75 63.52 1z8r n ILE 121 Cb 0.53 -1.84 0.00 0.00 -0.75 0.00 0.00 39.64 37.58 1z8r n ILE 121 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1z8r n GLY 122 N 1.65 2.33 3.60 7.39 0.00 -0.84 0.21 105.19 119.53 1z8r n GLY 122 Ca -0.03 -0.58 -0.25 0.00 0.00 0.00 0.00 46.02 45.16 1z8r n GLY 122 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1z8r s LEU 123 N 0.00 2.92 0.13 0.99 2.34 0.31 -1.22 118.68 124.15 1z8r s LEU 123 Ca 0.00 -1.01 -0.31 0.00 0.06 0.00 0.00 54.13 52.86 1z8r s LEU 123 Cb 0.00 -1.29 -0.09 0.00 -0.56 0.00 0.00 46.19 44.25 1z8r s LEU 123 CO 0.00 -0.19 1.49 0.54 -1.06 0.00 0.00 176.35 177.13 1z8r s VAL 124 N -2.52 2.96 0.00 1.48 0.11 -0.43 0.96 120.40 122.95 1z8r s VAL 124 Ca 0.34 0.67 0.00 0.00 -2.93 0.00 0.00 61.98 60.06 1z8r s VAL 124 Cb -0.00 -3.43 0.00 0.00 -1.53 0.00 0.00 36.38 31.42 1z8r s VAL 124 CO 0.18 0.05 0.00 0.41 -3.33 0.00 0.00 175.10 172.41 1z8r n THR 125 N 4.03 0.00 -4.14 5.04 -1.04 0.20 -4.73 114.28 113.65 1z8r n THR 125 Ca 0.13 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.81 1z8r n THR 125 Cb 0.40 -0.38 -0.07 0.00 -1.82 0.00 0.00 70.33 68.46 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 3.05 -0.42 -2.82 1.75 -1.06 -4.95 119.30 114.84 1z8r s MET 126 Ca 0.00 -0.47 0.03 0.00 -1.25 0.00 0.00 55.69 54.00 1z8r s MET 126 Cb 0.00 -2.85 0.11 0.00 2.84 0.00 0.00 34.83 34.93 1z8r s MET 126 CO 0.00 0.66 0.16 0.20 -0.65 0.00 0.00 175.02 175.39 1z8r s GLY 127 N -1.57 2.14 0.95 2.11 0.00 -1.26 0.11 107.32 109.80 1z8r s GLY 127 Ca 0.21 -2.82 -0.15 0.00 0.00 0.00 0.00 44.72 41.96 1z8r s GLY 127 CO 0.12 0.98 1.22 -0.32 0.00 0.00 0.00 173.10 175.10 1z8r s GLY 128 N 0.60 1.67 0.50 0.20 0.00 -0.62 -4.92 107.32 104.74 1z8r s GLY 128 Ca 0.13 -0.90 0.31 0.00 0.00 0.00 0.00 44.72 44.26 1z8r s GLY 128 CO -0.05 -0.22 1.90 0.83 0.00 0.00 0.00 173.10 175.56 1z8r h GLU 129 N -1.62 0.00 0.00 2.90 5.08 -1.99 -3.33 114.58 115.61 1z8r h GLU 129 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1z8r h GLU 129 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1z8r h GLU 129 CO 0.49 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.91 1z8r n GLY 130 N 0.23 -0.41 3.28 -3.84 0.00 -1.26 -4.89 105.19 98.29 1z8r n GLY 130 Ca 0.01 0.00 -0.18 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 1.45 -0.23 1.61 1.01 -1.25 -1.78 120.40 121.21 1z8r s VAL 131 Ca 0.00 -1.93 -0.02 0.00 0.00 0.00 0.00 61.98 60.03 1z8r s VAL 131 Cb 0.00 -1.75 0.01 0.00 0.00 0.00 0.00 36.38 34.64 1z8r s VAL 131 CO 0.00 -0.51 -0.08 -0.69 0.00 0.00 0.00 175.10 173.82 1z8r s VAL 132 N -2.56 2.91 -0.29 2.92 1.01 0.43 -1.59 120.40 123.22 1z8r s VAL 132 Ca 0.14 -0.82 -0.15 0.00 0.00 0.00 0.00 61.98 61.16 1z8r s VAL 132 Cb -0.03 -2.38 -0.03 0.00 0.00 0.00 0.00 36.38 33.95 1z8r s VAL 132 CO 0.04 0.34 0.37 -0.83 0.00 0.00 0.00 175.10 175.02 1z8r s GLY 133 N 1.37 1.88 -0.06 4.51 0.00 0.30 -0.90 107.32 114.43 1z8r s GLY 133 Ca 0.03 -0.95 0.04 0.00 0.00 0.00 0.00 44.72 43.84 1z8r s GLY 133 CO -0.06 0.98 -0.18 -1.36 0.00 0.00 0.00 173.10 172.49 1z8r s PHE 134 N 2.06 1.86 -0.47 1.90 0.08 0.16 0.63 117.98 124.19 1z8r s PHE 134 Ca 0.14 -0.62 -0.19 0.00 0.12 0.00 0.00 56.93 56.38 1z8r s PHE 134 Cb -0.16 -1.27 0.04 0.00 -0.57 0.00 0.00 43.02 41.06 1z8r s PHE 134 CO 0.11 -0.24 0.61 0.00 -0.10 0.00 0.00 175.22 175.59 1z8r s ALA 135 N 0.23 3.37 0.61 5.36 0.00 0.27 0.98 121.76 132.58 1z8r s ALA 135 Ca -0.09 -1.51 -0.18 0.00 0.00 0.00 0.00 51.96 50.18 1z8r s ALA 135 Cb -0.14 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 1z8r s ALA 135 CO 0.04 -1.88 1.15 0.16 0.00 0.00 0.00 175.76 175.24 1z8r s ASP 136 N 2.32 5.24 -0.06 0.00 1.47 -0.81 -0.53 116.67 124.29 1z8r s ASP 136 Ca 0.17 2.21 0.13 0.00 1.18 0.00 0.00 52.55 56.24 1z8r s ASP 136 Cb -0.17 -2.58 0.49 0.00 -0.34 0.00 0.00 42.92 40.32 1z8r s ASP 136 CO 0.15 -1.55 1.37 0.52 0.68 0.00 0.00 175.17 176.33 1z8r n VAL 137 N -1.84 1.13 0.69 2.11 0.31 0.13 -4.24 118.33 116.62 1z8r n VAL 137 Ca 0.12 -0.78 0.08 0.00 -0.01 0.00 0.00 64.34 63.74 1z8r n VAL 137 Cb 0.51 0.08 0.38 0.00 -0.91 0.00 0.00 33.84 33.90 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 0.78 0.16 -0.37 5.55 1.74 -1.26 -2.24 116.66 121.02 1z8r n ARG 138 Ca 0.18 0.16 0.10 0.00 -0.77 0.00 0.00 57.85 57.52 1z8r n ARG 138 Cb 0.60 -1.50 0.28 0.00 -1.02 0.00 0.00 32.46 30.83 1z8r n ARG 138 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1z8r n ASP 139 N -1.35 3.53 0.00 0.55 5.75 -1.26 -4.53 116.55 119.24 1z8r n ASP 139 Ca 0.06 -2.09 0.00 0.00 -0.01 0.00 0.00 54.79 52.76 1z8r n ASP 139 Cb 0.14 -0.44 0.00 0.00 -1.03 0.00 0.00 41.12 39.79 1z8r n ASP 139 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1z8r n LEU 140 N 1.24 0.00 0.12 -2.12 -0.00 -0.95 -5.01 117.00 110.28 1z8r n LEU 140 Ca 0.21 0.00 0.12 0.00 -0.00 0.00 0.00 56.01 56.35 1z8r n LEU 140 Cb 0.59 0.00 0.45 0.00 -0.00 0.00 0.00 43.42 44.46 1z8r n LEU 140 CO 0.16 0.00 0.87 -0.11 -0.00 0.00 0.00 177.39 178.31 1z8r n LEU 141 N 0.00 0.75 -4.47 1.47 -0.00 -1.08 -4.65 117.00 109.02 1z8r n LEU 141 Ca 0.00 0.63 -0.12 0.00 -0.00 0.00 0.00 56.01 56.52 1z8r n LEU 141 Cb 0.00 -0.46 -0.10 0.00 -0.00 0.00 0.00 43.42 42.87 1z8r n LEU 141 CO 0.00 -0.39 1.11 -2.67 -0.00 0.00 0.00 177.39 175.44 1z8r n TRP 142 N -2.26 0.73 0.00 1.96 4.27 -1.26 -3.67 117.44 117.21 1z8r n TRP 142 Ca 0.04 -0.11 0.00 0.00 -3.89 0.00 0.00 57.50 53.54 1z8r n TRP 142 Cb 0.32 -2.14 0.00 0.00 -1.36 0.00 0.00 31.31 28.13 1z8r n TRP 142 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1z8r n LEU 143 N 16.47 0.00 0.00 5.67 4.32 -1.26 -5.02 117.00 137.19 1z8r n LEU 143 Ca 0.35 0.00 -0.04 0.00 -0.02 0.00 0.00 56.01 56.30 1z8r n LEU 143 Cb 0.46 0.10 -0.00 0.00 -1.62 0.00 0.00 43.42 42.36 1z8r n LEU 143 CO 0.59 -0.29 0.11 -0.62 -1.22 0.00 0.00 177.39 175.95 1z8r n GLU 144 N -2.08 0.30 -1.71 3.23 1.02 -1.24 -4.55 120.64 115.61 1z8r n GLU 144 Ca 0.00 -0.91 -0.43 0.00 -0.02 0.00 0.00 57.16 55.80 1z8r n GLU 144 Cb 0.00 0.96 -0.03 0.00 -0.02 0.00 0.00 31.44 32.35 1z8r n GLU 144 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1z8r n ASP 145 N -1.66 3.79 -4.86 1.62 9.92 -1.26 -4.98 116.55 119.11 1z8r n ASP 145 Ca -0.01 1.07 -0.31 0.00 -0.53 0.00 0.00 54.79 55.01 1z8r n ASP 145 Cb 0.21 -1.54 -0.04 0.00 -0.64 0.00 0.00 41.12 39.11 1z8r n ASP 145 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1z8r s ASP 146 N 1.05 6.59 0.05 -2.24 1.01 -1.26 -4.72 116.67 117.15 1z8r s ASP 146 Ca 0.75 1.32 -0.30 0.00 0.71 0.00 0.00 52.55 55.02 1z8r s ASP 146 Cb -0.54 -2.40 -0.05 0.00 1.01 0.00 0.00 42.92 40.94 1z8r s ASP 146 CO 0.35 -0.45 1.08 0.00 0.21 0.00 0.00 175.17 176.35 1z8r s ALA 147 N -2.43 3.28 0.31 5.23 0.00 -1.25 -4.88 121.76 122.01 1z8r s ALA 147 Ca 0.54 0.69 0.07 0.00 0.00 0.00 0.00 51.96 53.26 1z8r s ALA 147 Cb -0.10 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.62 1z8r s ALA 147 CO 0.30 -0.29 0.34 -1.64 0.00 0.00 0.00 175.76 174.47 1z8r s MET 148 N 0.83 2.98 0.15 0.00 1.00 -1.26 -3.99 119.30 119.00 1z8r s MET 148 Ca 0.54 -1.09 0.00 0.00 0.00 0.00 0.00 55.69 55.14 1z8r s MET 148 Cb -0.25 -2.66 0.00 0.00 0.00 0.00 0.00 34.83 31.92 1z8r s MET 148 CO 0.29 0.18 0.00 -1.91 0.00 0.00 0.00 175.02 173.58 1z8r n GLU 149 N -1.43 0.00 -0.48 2.03 0.00 -1.26 -5.06 120.64 114.44 1z8r n GLU 149 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.13 1z8r n GLU 149 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.03 1z8r n GLU 149 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17