#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 -1.65 -3.69 1.61 -0.02 -1.26 -5.06 135.00 124.93 1z8r n PRO 2 Ca 0.00 -0.59 -0.14 0.00 -2.02 0.00 0.00 63.50 60.75 1z8r n PRO 2 Cb 0.00 -1.02 -0.09 0.00 -0.02 0.00 0.00 33.50 32.38 1z8r n PRO 2 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1z8r s TYR 3 N -1.55 -0.53 -0.14 6.00 5.04 -1.26 -5.01 117.35 119.90 1z8r s TYR 3 Ca 0.27 1.25 -0.00 0.00 -2.44 0.00 0.00 57.07 56.15 1z8r s TYR 3 Cb -0.05 0.20 -0.00 0.00 0.35 0.00 0.00 41.96 42.46 1z8r s TYR 3 CO 0.23 -0.31 0.13 0.41 -1.34 0.00 0.00 175.55 174.66 1z8r n GLY 4 N 2.50 -0.16 3.10 8.97 0.00 -1.26 -5.09 105.19 113.26 1z8r n GLY 4 Ca -0.15 -0.10 -0.12 0.00 0.00 0.00 0.00 46.02 45.65 1z8r n GLY 4 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1z8r s HIS 5 N -3.02 -0.45 -0.28 1.61 -3.43 -1.26 -5.04 115.29 103.42 1z8r s HIS 5 Ca 0.02 1.00 0.17 0.00 -0.80 0.00 0.00 55.06 55.46 1z8r s HIS 5 Cb -0.00 0.09 0.49 0.00 -1.43 0.00 0.00 32.58 31.73 1z8r s HIS 5 CO 0.12 -0.31 1.13 0.94 -2.00 0.00 0.00 174.74 174.62 1z8r n GLN 6 N 4.65 2.34 -1.32 -0.38 -0.06 -1.26 -5.12 117.38 116.22 1z8r n GLN 6 Ca -0.18 -3.73 0.17 0.00 -2.00 0.00 0.00 57.00 51.26 1z8r n GLN 6 Cb 0.52 -1.82 -0.06 0.00 -4.06 0.00 0.00 30.24 24.82 1z8r n GLN 6 CO 0.00 0.00 0.00 0.43 -0.20 0.00 0.00 177.06 177.29 1z8r n SER 7 N -0.60 -7.95 0.00 1.69 7.64 -1.26 -5.02 113.62 108.12 1z8r n SER 7 Ca 0.20 0.91 0.00 0.00 1.01 0.00 0.00 58.87 60.99 1z8r n SER 7 Cb 0.85 -4.26 0.00 0.00 -1.01 0.00 0.00 64.21 59.79 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 -4.15 0.49 1.68 0.23 0.00 -1.26 -5.14 105.19 97.05 1z8r n GLY 8 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.98 1z8r n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z8r n ALA 9 N 0.00 -1.25 -3.10 4.61 0.00 -1.26 -4.83 120.51 114.69 1z8r n ALA 9 Ca 0.00 -0.43 -0.40 0.00 0.00 0.00 0.00 53.44 52.62 1z8r n ALA 9 Cb 0.00 0.21 -0.11 0.00 0.00 0.00 0.00 19.45 19.55 1z8r n ALA 9 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1z8r s VAL 10 N -2.30 4.22 -0.32 0.00 1.01 -0.95 -5.05 120.40 117.01 1z8r s VAL 10 Ca 0.11 -1.13 -0.14 0.00 0.00 0.00 0.00 61.98 60.82 1z8r s VAL 10 Cb -0.01 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.90 1z8r s VAL 10 CO 0.02 -0.32 0.31 -0.47 0.00 0.00 0.00 175.10 174.64 1z8r s TYR 11 N 1.46 3.22 -0.27 5.22 6.14 -1.26 -1.52 117.35 130.34 1z8r s TYR 11 Ca 0.01 -0.00 0.03 0.00 0.64 0.00 0.00 57.07 57.75 1z8r s TYR 11 Cb -0.21 -2.57 0.06 0.00 0.42 0.00 0.00 41.96 39.67 1z8r s TYR 11 CO 0.04 -0.35 -0.09 0.08 0.64 0.00 0.00 175.55 175.87 1z8r s VAL 12 N 1.91 2.12 0.00 3.14 1.01 0.17 -4.05 120.40 124.69 1z8r s VAL 12 Ca 0.10 -1.68 0.00 0.00 0.00 0.00 0.00 61.98 60.40 1z8r s VAL 12 Cb -0.17 -2.28 0.00 0.00 0.00 0.00 0.00 36.38 33.94 1z8r s VAL 12 CO 0.11 -0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.72 1z8r n GLY 13 N 4.43 3.23 0.83 4.51 0.00 -1.26 -0.45 105.19 116.48 1z8r n GLY 13 Ca -0.12 0.01 0.04 0.00 0.00 0.00 0.00 46.02 45.96 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 3.93 2.35 -3.97 1.61 5.03 -1.26 -4.50 115.26 118.45 1z8r n ASN 14 Ca 0.00 -2.18 -0.24 0.00 0.87 0.00 0.00 54.58 53.03 1z8r n ASN 14 Cb 0.00 -0.38 -0.17 0.00 -1.02 0.00 0.00 39.78 38.22 1z8r n ASN 14 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1z8r s TYR 15 N -1.66 1.28 -0.24 3.10 2.02 0.40 -1.77 117.35 120.48 1z8r s TYR 15 Ca 0.23 -0.48 0.00 0.00 -0.37 0.00 0.00 57.07 56.45 1z8r s TYR 15 Cb 0.15 -0.99 0.03 0.00 -0.40 0.00 0.00 41.96 40.75 1z8r s TYR 15 CO 0.12 -0.30 -0.10 0.21 -1.57 0.00 0.00 175.55 173.91 1z8r s LYS 16 N 0.93 2.70 -0.26 -0.62 2.36 0.14 -0.66 119.74 124.33 1z8r s LYS 16 Ca -0.10 -1.05 -0.12 0.00 -2.55 0.00 0.00 55.97 52.15 1z8r s LYS 16 Cb -0.15 -2.88 -0.05 0.00 -1.05 0.00 0.00 37.83 33.71 1z8r s LYS 16 CO 0.01 -0.41 0.21 0.14 1.55 0.00 0.00 175.35 176.85 1z8r s VAL 17 N 1.26 5.31 0.12 4.02 -7.23 -0.58 -1.58 120.40 121.72 1z8r s VAL 17 Ca -0.01 0.26 0.02 0.00 -1.81 0.00 0.00 61.98 60.43 1z8r s VAL 17 Cb -0.17 -3.55 -0.04 0.00 0.56 0.00 0.00 36.38 33.18 1z8r s VAL 17 CO -0.06 0.28 -0.04 0.54 -0.31 0.00 0.00 175.10 175.50 1z8r s VAL 18 N 1.47 0.70 0.42 1.32 0.11 -0.87 -2.23 120.40 121.31 1z8r s VAL 18 Ca 0.09 -1.96 -0.26 0.00 -2.93 0.00 0.00 61.98 56.92 1z8r s VAL 18 Cb -0.15 -1.83 -0.09 0.00 -1.53 0.00 0.00 36.38 32.77 1z8r s VAL 18 CO 0.08 -0.73 1.44 0.21 -3.33 0.00 0.00 175.10 172.77 1z8r s ASN 19 N -3.09 6.08 0.17 3.54 2.47 -1.26 -2.30 114.94 120.55 1z8r s ASN 19 Ca 0.16 2.95 -0.14 0.00 0.42 0.00 0.00 52.86 56.25 1z8r s ASN 19 Cb 0.05 -2.66 0.11 0.00 -1.45 0.00 0.00 41.25 37.31 1z8r s ASN 19 CO -0.02 -1.04 1.75 -0.09 -3.72 0.00 0.00 177.10 173.98 1z8r h ARG 20 N 2.60 0.32 0.00 0.43 1.12 0.03 0.34 114.38 119.22 1z8r h ARG 20 Ca -0.51 -0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.34 1z8r h ARG 20 Cb 1.25 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 31.14 1z8r h ARG 20 CO 0.62 0.21 0.00 1.58 -3.11 0.00 0.00 179.97 179.27 1z8r n HIS 21 N -5.00 0.00 0.37 2.20 -0.00 -1.26 -2.31 115.22 109.21 1z8r n HIS 21 Ca 0.03 0.00 0.04 0.00 0.46 0.00 0.00 57.72 58.25 1z8r n HIS 21 Cb 0.16 -0.35 0.01 0.00 -0.12 0.00 0.00 29.99 29.69 1z8r n HIS 21 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 1z8r n LEU 22 N -1.35 1.23 -4.81 0.27 4.77 0.53 -5.02 117.00 112.63 1z8r n LEU 22 Ca 0.07 -0.82 -0.33 0.00 -0.03 0.00 0.00 56.01 54.90 1z8r n LEU 22 Cb 0.15 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.20 1z8r n LEU 22 CO 0.13 0.25 0.69 0.00 -1.33 0.00 0.00 177.39 177.13 1z8r s ALA 23 N -1.10 2.94 0.36 -1.18 0.00 0.89 -4.82 121.76 118.85 1z8r s ALA 23 Ca 0.08 0.47 0.07 0.00 0.00 0.00 0.00 51.96 52.58 1z8r s ALA 23 Cb 0.07 -3.20 -0.01 0.00 0.00 0.00 0.00 23.12 19.97 1z8r s ALA 23 CO 0.19 -0.21 0.42 -0.08 0.00 0.00 0.00 175.76 176.08 1z8r s THR 24 N -2.17 3.53 0.54 0.00 -1.32 -1.26 -4.95 115.64 110.00 1z8r s THR 24 Ca 0.64 -1.16 0.27 0.00 -1.21 0.00 0.00 61.69 60.23 1z8r s THR 24 Cb -0.13 -3.21 0.41 0.00 -1.51 0.00 0.00 72.50 68.05 1z8r s THR 24 CO 0.21 -0.11 1.98 -0.74 -2.21 0.00 0.00 174.62 173.74 1z8r h HIS 25 N 0.98 0.00 -0.03 9.09 2.76 -2.00 0.38 115.15 126.34 1z8r h HIS 25 Ca -0.44 0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 57.60 1z8r h HIS 25 Cb 1.26 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 30.21 1z8r h HIS 25 CO 0.47 0.00 -0.61 0.28 -1.30 0.00 0.00 177.93 176.77 1z8r h VAL 26 N 0.00 1.42 -0.32 5.26 2.07 -1.98 0.36 116.25 123.06 1z8r h VAL 26 Ca 0.27 -2.04 -0.07 0.00 0.82 0.00 0.00 66.70 65.68 1z8r h VAL 26 Cb 1.12 2.07 -0.01 0.00 -1.52 0.00 0.00 31.29 32.95 1z8r h VAL 26 CO -0.00 0.59 -0.08 0.44 0.02 0.00 0.00 177.57 178.54 1z8r h ASP 27 N 0.08 0.61 0.25 0.57 5.19 -0.61 -2.50 116.42 120.00 1z8r h ASP 27 Ca -0.01 -0.36 -0.19 0.00 -0.62 0.00 0.00 57.03 55.84 1z8r h ASP 27 Cb 1.09 -0.17 -0.00 0.00 0.18 0.00 0.00 39.33 40.43 1z8r h ASP 27 CO 0.09 0.84 -0.77 -0.50 -3.12 0.00 0.00 179.24 175.77 1z8r h TRP 28 N 0.38 0.59 -0.92 4.55 6.55 -1.41 0.29 115.95 125.99 1z8r h TRP 28 Ca 0.08 -0.27 0.08 0.00 0.95 0.00 0.00 58.89 59.73 1z8r h TRP 28 Cb 0.57 -0.09 -0.06 0.00 -0.86 0.00 0.00 29.16 28.72 1z8r h TRP 28 CO 0.05 1.04 0.59 1.96 -1.05 0.00 0.00 178.44 181.04 1z8r h GLN 29 N 0.28 0.95 -0.03 0.49 1.08 -0.81 -2.28 115.11 114.80 1z8r h GLN 29 Ca -0.04 -0.06 -0.01 0.00 -1.45 0.00 0.00 58.65 57.09 1z8r h GLN 29 Cb 1.36 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 28.57 1z8r h GLN 29 CO 0.13 0.63 -0.36 0.09 -0.95 0.00 0.00 178.83 178.38 1z8r n ASN 30 N -4.52 1.93 -4.67 1.46 4.13 -0.95 -5.03 115.26 107.61 1z8r n ASN 30 Ca 0.15 -3.72 -0.42 0.00 1.68 0.00 0.00 54.58 52.27 1z8r n ASN 30 Cb 0.25 -0.52 -0.03 0.00 -1.54 0.00 0.00 39.78 37.95 1z8r n ASN 30 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1z8r h VAL 32 N 5.22 0.87 -4.05 0.00 -1.51 0.65 -3.48 116.25 113.94 1z8r h VAL 32 Ca -0.33 -2.48 -0.16 0.00 -1.23 0.00 0.00 66.70 62.50 1z8r h VAL 32 Cb 1.14 2.70 -0.19 0.00 -2.13 0.00 0.00 31.29 32.82 1z8r h VAL 32 CO 0.93 0.87 -0.70 0.86 -1.23 0.00 0.00 177.57 178.30 1z8r s TRP 33 N -2.58 0.37 -0.26 5.19 -0.00 -1.05 -4.98 118.94 115.64 1z8r s TRP 33 Ca -0.17 -0.69 -0.09 0.00 -0.00 0.00 0.00 56.10 55.14 1z8r s TRP 33 Cb 0.06 -0.27 0.11 0.00 -0.00 0.00 0.00 33.47 33.37 1z8r s TRP 33 CO 0.83 -0.24 0.56 -2.00 -0.00 0.00 0.00 176.95 176.11 1z8r s GLU 34 N -2.23 0.49 -0.28 5.86 2.12 -1.26 0.58 118.70 123.97 1z8r s GLU 34 Ca -0.08 1.26 -0.07 0.00 0.36 0.00 0.00 54.97 56.43 1z8r s GLU 34 Cb -0.04 0.58 -0.01 0.00 0.26 0.00 0.00 34.13 34.92 1z8r s GLU 34 CO -0.04 -0.21 0.08 -0.51 -0.54 0.00 0.00 175.26 174.05 1z8r s ASP 35 N 2.63 5.17 0.23 -1.70 1.01 0.97 -4.98 116.67 120.01 1z8r s ASP 35 Ca -0.05 -0.50 -0.03 0.00 0.71 0.00 0.00 52.55 52.68 1z8r s ASP 35 Cb -0.11 -1.91 0.25 0.00 1.01 0.00 0.00 42.92 42.16 1z8r s ASP 35 CO -0.17 -0.13 1.67 0.10 0.21 0.00 0.00 175.17 176.85 1z8r h TYR 36 N 8.25 0.81 0.00 4.23 -0.00 -1.97 0.44 116.97 128.73 1z8r h TYR 36 Ca -0.34 -0.17 0.00 0.00 0.00 0.00 0.00 58.73 58.22 1z8r h TYR 36 Cb 1.15 -0.20 0.00 0.00 0.00 0.00 0.00 36.73 37.68 1z8r h TYR 36 CO 0.63 0.85 0.00 0.09 -0.00 0.00 0.00 178.16 179.74 1z8r n ASN 37 N -4.13 0.62 -0.13 0.10 3.02 -1.26 -2.70 115.26 110.77 1z8r n ASN 37 Ca 0.00 0.63 0.03 0.00 -0.03 0.00 0.00 54.58 55.21 1z8r n ASN 37 Cb 0.40 -0.77 0.00 0.00 -0.61 0.00 0.00 39.78 38.81 1z8r n ASN 37 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1z8r n ARG 38 N -2.16 1.89 -4.18 3.52 1.74 -0.88 0.12 116.66 116.71 1z8r n ARG 38 Ca 0.03 -0.51 -0.34 0.00 -0.77 0.00 0.00 57.85 56.26 1z8r n ARG 38 Cb 0.27 -0.96 -0.03 0.00 -1.02 0.00 0.00 32.46 30.72 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 -0.23 -2.70 -4.08 0.55 9.92 0.15 -4.87 116.55 115.29 1z8r n ASP 39 Ca 0.02 -1.01 -0.12 0.00 -0.53 0.00 0.00 54.79 53.15 1z8r n ASP 39 Cb 0.11 -2.79 -0.11 0.00 -0.64 0.00 0.00 41.12 37.69 1z8r n ASP 39 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1z8r s LEU 40 N -7.22 2.32 0.00 0.64 2.96 -0.98 0.77 118.68 117.17 1z8r s LEU 40 Ca 0.59 -0.66 -0.11 0.00 -0.22 0.00 0.00 54.13 53.73 1z8r s LEU 40 Cb -0.32 -0.13 0.01 0.00 0.50 0.00 0.00 46.19 46.25 1z8r s LEU 40 CO 0.92 -0.27 0.23 -1.48 -1.32 0.00 0.00 176.35 174.43 1z8r s LEU 41 N -1.93 1.19 -0.15 -0.68 2.34 -0.97 -0.02 118.68 118.46 1z8r s LEU 41 Ca -0.05 -0.10 -0.01 0.00 0.06 0.00 0.00 54.13 54.03 1z8r s LEU 41 Cb -0.06 1.00 -0.01 0.00 -0.56 0.00 0.00 46.19 46.56 1z8r s LEU 41 CO -0.01 -0.44 -0.12 -0.69 -1.06 0.00 0.00 176.35 174.03 1z8r s VAL 42 N -1.56 2.97 0.23 1.48 1.01 0.19 -2.05 120.40 122.68 1z8r s VAL 42 Ca -0.13 -0.67 0.11 0.00 0.00 0.00 0.00 61.98 61.29 1z8r s VAL 42 Cb -0.05 -2.27 -0.05 0.00 0.00 0.00 0.00 36.38 34.01 1z8r s VAL 42 CO 0.02 0.51 -0.16 -0.94 0.00 0.00 0.00 175.10 174.52 1z8r s SER 43 N 0.69 3.82 -0.06 3.32 1.04 -0.61 0.12 113.70 122.01 1z8r s SER 43 Ca -0.06 -0.84 -0.09 0.00 0.48 0.00 0.00 55.95 55.44 1z8r s SER 43 Cb -0.15 -0.45 -0.05 0.00 0.10 0.00 0.00 66.02 65.47 1z8r s SER 43 CO 0.02 0.07 0.24 0.42 0.98 0.00 0.00 173.24 174.97 1z8r s THR 44 N -2.09 5.34 0.23 2.02 -4.23 -1.04 0.28 115.64 116.15 1z8r s THR 44 Ca 0.27 0.38 0.01 0.00 -1.18 0.00 0.00 61.69 61.16 1z8r s THR 44 Cb -0.07 -3.52 -0.05 0.00 1.34 0.00 0.00 72.50 70.21 1z8r s THR 44 CO 0.14 0.57 0.08 0.28 -0.54 0.00 0.00 174.62 175.15 1z8r s THR 45 N -1.09 0.50 -0.57 3.99 -1.32 -0.73 -4.94 115.64 111.47 1z8r s THR 45 Ca 0.20 -1.99 0.06 0.00 -1.21 0.00 0.00 61.69 58.74 1z8r s THR 45 Cb -0.14 -2.52 0.32 0.00 -1.51 0.00 0.00 72.50 68.66 1z8r s THR 45 CO 0.09 -0.09 0.89 0.35 -2.21 0.00 0.00 174.62 173.65 1z8r n THR 46 N -0.40 2.68 -4.11 5.08 -2.24 -1.26 -4.61 114.28 109.43 1z8r n THR 46 Ca -0.01 -5.43 -0.11 0.00 -2.27 0.00 0.00 64.05 56.23 1z8r n THR 46 Cb 0.66 -1.45 -0.08 0.00 -2.10 0.00 0.00 70.33 67.35 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 -3.20 0.53 -0.09 6.98 0.00 -1.26 -5.14 121.76 119.57 1z8r s ALA 47 Ca 0.47 -1.32 -0.23 0.00 0.00 0.00 0.00 51.96 50.87 1z8r s ALA 47 Cb 0.26 1.22 -0.03 0.00 0.00 0.00 0.00 23.12 24.57 1z8r s ALA 47 CO -0.11 -0.70 0.71 -1.01 0.00 0.00 0.00 175.76 174.65 1z8r s HIS 48 N -4.09 3.54 0.81 0.00 3.76 -1.26 -4.64 115.29 113.40 1z8r s HIS 48 Ca 0.31 1.22 -0.07 0.00 -0.15 0.00 0.00 55.06 56.37 1z8r s HIS 48 Cb 0.04 -2.83 0.17 0.00 1.11 0.00 0.00 32.58 31.07 1z8r s HIS 48 CO 0.10 0.02 1.10 0.41 -0.85 0.00 0.00 174.74 175.53 1z8r n GLY 49 N 3.22 -0.21 1.39 -2.22 0.00 -1.26 -4.99 105.19 101.11 1z8r n GLY 49 Ca -0.01 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.11 1z8r n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z8r s ASP 51 N -3.84 6.59 -0.15 0.00 1.01 -1.26 -5.01 116.67 114.01 1z8r s ASP 51 Ca 0.00 2.82 0.01 0.00 0.71 0.00 0.00 52.55 56.08 1z8r s ASP 51 Cb 0.00 -2.65 0.02 0.00 1.01 0.00 0.00 42.92 41.30 1z8r s ASP 51 CO 0.00 -0.69 -0.17 -0.89 0.21 0.00 0.00 175.17 173.63 1z8r s THR 52 N -0.88 1.77 0.27 -1.27 2.01 -1.26 -4.70 115.64 111.57 1z8r s THR 52 Ca 0.53 -0.77 -0.29 0.00 0.31 0.00 0.00 61.69 61.47 1z8r s THR 52 Cb -0.43 -1.62 -0.09 0.00 0.01 0.00 0.00 72.50 70.37 1z8r s THR 52 CO 0.54 0.49 1.11 -0.63 -0.69 0.00 0.00 174.62 175.44 1z8r s ILE 53 N 1.31 3.51 -0.23 1.82 1.01 -1.26 0.54 121.20 127.90 1z8r s ILE 53 Ca 0.03 1.49 -0.15 0.00 0.00 0.00 0.00 60.65 62.02 1z8r s ILE 53 Cb -0.13 -3.95 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 1z8r s ILE 53 CO -0.10 0.34 0.35 0.00 0.00 0.00 0.00 174.94 175.53 1z8r s ALA 54 N -1.02 3.57 -0.34 9.38 0.00 0.12 -3.67 121.76 129.80 1z8r s ALA 54 Ca 0.45 -0.67 -0.00 0.00 0.00 0.00 0.00 51.96 51.74 1z8r s ALA 54 Cb -0.32 -2.60 0.29 0.00 0.00 0.00 0.00 23.12 20.48 1z8r s ALA 54 CO 0.40 -0.39 1.88 -2.13 0.00 0.00 0.00 175.76 175.53 1z8r n ARG 55 N 4.70 1.88 -3.28 0.00 0.00 -0.84 -4.71 116.66 114.42 1z8r n ARG 55 Ca -0.09 -1.80 -0.18 0.00 -0.00 0.00 0.00 57.85 55.77 1z8r n ARG 55 Cb 0.51 -1.71 0.00 0.00 0.00 0.00 0.00 32.46 31.27 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 2.31 -1.91 0.00 10.64 -1.26 -5.06 117.38 120.37 1z8r n GLN 57 Ca 0.03 -3.59 -0.40 0.00 -1.83 0.00 0.00 57.00 51.21 1z8r n GLN 57 Cb 0.58 -1.87 0.00 0.00 -0.86 0.00 0.00 30.24 28.10 1z8r n GLN 57 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1z8r n THR 59 N 0.15 0.08 -4.47 0.00 -1.04 -1.26 -4.86 114.28 102.87 1z8r n THR 59 Ca 0.03 -0.17 -0.22 0.00 -2.04 0.00 0.00 64.05 61.64 1z8r n THR 59 Cb 0.42 0.06 -0.11 0.00 -1.82 0.00 0.00 70.33 68.88 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 -1.92 1.49 -0.03 12.58 -4.23 -1.26 -1.46 115.64 120.81 1z8r s THR 60 Ca 0.34 -2.05 -0.10 0.00 -1.18 0.00 0.00 61.69 58.70 1z8r s THR 60 Cb 0.17 -2.70 0.03 0.00 1.34 0.00 0.00 72.50 71.34 1z8r s THR 60 CO 0.27 -0.11 0.43 0.61 -0.54 0.00 0.00 174.62 175.28 1z8r n GLY 61 N -0.69 0.33 2.74 3.99 0.00 -0.56 -4.89 105.19 106.11 1z8r n GLY 61 Ca -0.04 -0.87 -0.17 0.00 0.00 0.00 0.00 46.02 44.94 1z8r n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1z8r s VAL 62 N -2.02 -0.08 -0.09 1.61 0.11 -0.63 0.12 120.40 119.41 1z8r s VAL 62 Ca 0.10 0.30 -0.01 0.00 -2.93 0.00 0.00 61.98 59.45 1z8r s VAL 62 Cb -0.00 -0.12 -0.03 0.00 -1.53 0.00 0.00 36.38 34.70 1z8r s VAL 62 CO -0.01 0.13 -0.04 -0.72 -3.33 0.00 0.00 175.10 171.13 1z8r s TYR 63 N 1.54 3.02 0.43 1.54 -0.85 0.02 -2.29 117.35 120.77 1z8r s TYR 63 Ca -0.03 0.01 -0.24 0.00 -0.52 0.00 0.00 57.07 56.29 1z8r s TYR 63 Cb -0.13 -1.78 -0.08 0.00 0.38 0.00 0.00 41.96 40.35 1z8r s TYR 63 CO -0.03 0.30 1.15 0.12 -1.52 0.00 0.00 175.55 175.56 1z8r s PHE 64 N -0.60 3.00 0.12 -3.49 2.19 -1.19 -1.89 117.98 116.12 1z8r s PHE 64 Ca 0.09 1.56 0.08 0.00 0.33 0.00 0.00 56.93 58.99 1z8r s PHE 64 Cb -0.12 -3.34 -0.04 0.00 -1.31 0.00 0.00 43.02 38.21 1z8r s PHE 64 CO 0.02 -1.30 -0.11 0.00 1.83 0.00 0.00 175.22 175.66 1z8r n ALA 66 N 0.57 0.92 -0.08 0.00 0.00 -1.26 -1.92 120.51 118.73 1z8r n ALA 66 Ca -0.13 -0.64 -0.14 0.00 0.00 0.00 0.00 53.44 52.52 1z8r n ALA 66 Cb 0.53 -0.50 -0.04 0.00 0.00 0.00 0.00 19.45 19.44 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 0.86 0.79 0.00 0.02 -1.93 -3.24 113.55 109.57 1z8r h SER 67 Ca -0.44 -0.51 -0.22 0.00 -0.84 0.00 0.00 61.79 59.78 1z8r h SER 67 Cb 1.68 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 63.94 1z8r h SER 67 CO -0.10 1.21 -1.31 0.11 -1.14 0.00 0.00 176.83 175.59 1z8r h LYS 68 N 0.54 0.00 -5.13 3.45 6.56 -1.99 -3.48 116.57 116.51 1z8r h LYS 68 Ca 0.03 0.00 -0.41 0.00 -1.06 0.00 0.00 60.65 59.21 1z8r h LYS 68 Cb 1.02 0.00 0.07 0.00 -0.57 0.00 0.00 32.23 32.75 1z8r h LYS 68 CO 0.10 0.59 -0.64 -1.13 -2.06 0.00 0.00 179.45 176.31 1z8r n SER 69 N -3.12 -5.99 -4.18 0.86 3.41 -0.81 -4.98 113.62 98.81 1z8r n SER 69 Ca -0.08 -0.41 -0.12 0.00 -0.26 0.00 0.00 58.87 57.99 1z8r n SER 69 Cb 0.94 -4.79 -0.10 0.00 -0.26 0.00 0.00 64.21 60.00 1z8r n SER 69 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1z8r s LYS 70 N -6.00 1.19 -0.24 4.33 -2.85 -1.25 -4.92 119.74 110.01 1z8r s LYS 70 Ca 0.43 -1.59 -0.25 0.00 -1.00 0.00 0.00 55.97 53.56 1z8r s LYS 70 Cb -0.20 0.28 -0.00 0.00 -2.06 0.00 0.00 37.83 35.85 1z8r s LYS 70 CO 0.54 -0.39 0.85 -1.01 0.10 0.00 0.00 175.35 175.43 1z8r s HIS 71 N -4.14 3.31 -0.30 1.78 3.76 -1.26 -2.05 115.29 116.38 1z8r s HIS 71 Ca 0.37 1.15 -0.07 0.00 -0.15 0.00 0.00 55.06 56.36 1z8r s HIS 71 Cb 0.07 -3.07 0.02 0.00 1.11 0.00 0.00 32.58 30.70 1z8r s HIS 71 CO 0.11 -0.41 0.08 0.71 -0.85 0.00 0.00 174.74 174.38 1z8r s TYR 72 N 2.88 3.17 -0.16 1.40 1.51 -0.79 -4.94 117.35 120.40 1z8r s TYR 72 Ca 0.35 -1.07 -0.29 0.00 -1.01 0.00 0.00 57.07 55.05 1z8r s TYR 72 Cb -0.15 -2.26 -0.01 0.00 -0.11 0.00 0.00 41.96 39.43 1z8r s TYR 72 CO 0.07 -0.61 1.20 -2.14 -1.11 0.00 0.00 175.55 172.97 1z8r s PRO 73 N 1.48 4.26 0.00 -1.71 0.02 -1.26 -0.80 135.00 137.00 1z8r s PRO 73 Ca 0.02 1.60 0.02 0.00 0.02 0.00 0.00 61.00 62.66 1z8r s PRO 73 Cb -0.18 -3.71 -0.01 0.00 0.02 0.00 0.00 34.50 30.63 1z8r s PRO 73 CO 0.02 -0.65 -0.07 0.08 -0.33 0.00 0.00 177.00 176.05 1z8r s VAL 74 N 3.25 0.55 -0.24 3.83 1.01 0.32 -4.94 120.40 124.18 1z8r s VAL 74 Ca 0.53 -0.44 -0.18 0.00 0.00 0.00 0.00 61.98 61.88 1z8r s VAL 74 Cb -0.21 -0.49 -0.03 0.00 0.00 0.00 0.00 36.38 35.65 1z8r s VAL 74 CO 0.14 0.06 0.53 -0.44 0.00 0.00 0.00 175.10 175.39 1z8r s SER 75 N -0.42 6.50 0.26 3.32 0.01 -1.26 -1.49 113.70 120.62 1z8r s SER 75 Ca 0.01 0.60 0.05 0.00 1.31 0.00 0.00 55.95 57.92 1z8r s SER 75 Cb -0.04 -2.29 -0.06 0.00 0.21 0.00 0.00 66.02 63.85 1z8r s SER 75 CO -0.00 -0.25 -0.03 0.72 0.41 0.00 0.00 173.24 174.08 1z8r s PHE 76 N 2.07 1.79 0.24 2.43 -0.12 -0.54 -4.53 117.98 119.32 1z8r s PHE 76 Ca 0.23 -0.79 0.09 0.00 -0.05 0.00 0.00 56.93 56.40 1z8r s PHE 76 Cb -0.16 -1.03 -0.04 0.00 -0.63 0.00 0.00 43.02 41.16 1z8r s PHE 76 CO 0.09 0.14 0.02 -1.21 -0.05 0.00 0.00 175.22 174.22 1z8r s GLU 77 N -3.79 2.39 -0.80 1.99 2.02 -0.97 -4.56 118.70 114.98 1z8r s GLU 77 Ca 0.29 -1.31 0.02 0.00 0.02 0.00 0.00 54.97 53.99 1z8r s GLU 77 Cb 0.05 -2.25 0.28 0.00 0.10 0.00 0.00 34.13 32.31 1z8r s GLU 77 CO 0.11 0.39 1.08 0.41 0.02 0.00 0.00 175.26 177.26 1z8r n GLY 78 N -0.76 5.09 3.77 -1.39 0.00 -1.26 -2.20 105.19 108.44 1z8r n GLY 78 Ca -0.07 -2.73 -0.40 0.00 0.00 0.00 0.00 46.02 42.82 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 -2.79 4.12 0.00 1.61 0.02 -0.99 -4.84 135.00 132.13 1z8r s PRO 79 Ca 0.38 2.09 0.00 0.00 0.02 0.00 0.00 61.00 63.49 1z8r s PRO 79 Cb 0.13 -2.85 0.00 0.00 0.02 0.00 0.00 34.50 31.80 1z8r s PRO 79 CO 0.01 -0.34 0.00 0.41 -0.33 0.00 0.00 177.00 176.75 1z8r n GLY 80 N 0.72 -2.20 3.61 0.52 0.00 -1.26 -2.43 105.19 104.15 1z8r n GLY 80 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 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 4.05 -0.14 0.99 1.98 -1.26 0.11 118.68 124.41 1z8r s LEU 81 Ca 0.00 0.37 0.01 0.00 -2.89 0.00 0.00 54.13 51.62 1z8r s LEU 81 Cb 0.00 -2.52 0.02 0.00 0.66 0.00 0.00 46.19 44.35 1z8r s LEU 81 CO 0.00 -0.23 -0.17 -0.69 -1.89 0.00 0.00 176.35 173.36 1z8r s VAL 82 N 2.17 1.76 -0.44 1.68 1.01 0.17 -4.95 120.40 121.79 1z8r s VAL 82 Ca 0.17 -0.78 -0.28 0.00 0.00 0.00 0.00 61.98 61.10 1z8r s VAL 82 Cb -0.16 -1.60 -0.00 0.00 0.00 0.00 0.00 36.38 34.62 1z8r s VAL 82 CO 0.10 0.49 1.59 -0.70 0.00 0.00 0.00 175.10 176.58 1z8r s GLU 83 N 1.16 3.32 -0.32 2.72 2.12 -1.26 -0.80 118.70 125.63 1z8r s GLU 83 Ca -0.01 0.94 -0.29 0.00 0.36 0.00 0.00 54.97 55.97 1z8r s GLU 83 Cb -0.14 -4.15 0.00 0.00 0.26 0.00 0.00 34.13 30.11 1z8r s GLU 83 CO -0.07 -1.89 1.31 0.08 -0.54 0.00 0.00 175.26 174.16 1z8r s VAL 84 N 6.49 4.11 0.52 3.70 1.01 0.24 -4.93 120.40 131.54 1z8r s VAL 84 Ca 0.66 1.24 -0.20 0.00 0.00 0.00 0.00 61.98 63.68 1z8r s VAL 84 Cb -0.16 -4.17 -0.07 0.00 0.00 0.00 0.00 36.38 31.99 1z8r s VAL 84 CO 0.30 -0.52 1.09 -1.58 0.00 0.00 0.00 175.10 174.39 1z8r s GLN 85 N 4.27 3.54 -0.55 2.72 0.74 -1.26 -0.96 119.66 128.15 1z8r s GLN 85 Ca 0.57 1.51 -0.27 0.00 0.05 0.00 0.00 55.36 57.22 1z8r s GLN 85 Cb -0.16 -2.04 -0.03 0.00 1.10 0.00 0.00 33.01 31.88 1z8r s GLN 85 CO 0.24 -0.68 1.95 -1.83 -0.55 0.00 0.00 175.29 174.42 1z8r s GLU 86 N -3.27 2.63 0.30 1.67 4.04 -1.26 -4.47 118.70 118.34 1z8r s GLU 86 Ca 0.71 0.86 -0.01 0.00 0.04 0.00 0.00 54.97 56.56 1z8r s GLU 86 Cb -0.21 -4.40 -0.02 0.00 0.02 0.00 0.00 34.13 29.53 1z8r s GLU 86 CO 0.24 -2.71 0.35 0.45 -1.84 0.00 0.00 175.26 171.75 1z8r s SER 87 N 8.55 0.82 0.00 0.83 0.15 -0.74 -4.87 113.70 118.43 1z8r s SER 87 Ca 0.74 -1.46 0.00 0.00 0.70 0.00 0.00 55.95 55.93 1z8r s SER 87 Cb -0.15 0.56 0.00 0.00 -1.71 0.00 0.00 66.02 64.73 1z8r s SER 87 CO 0.23 -1.12 0.00 1.21 1.20 0.00 0.00 173.24 174.77 1z8r n GLU 88 N -0.49 0.00 -0.76 5.44 4.07 -1.26 0.31 120.64 127.95 1z8r n GLU 88 Ca 0.03 0.00 -0.01 0.00 -0.06 0.00 0.00 57.16 57.12 1z8r n GLU 88 Cb 0.63 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 32.00 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 -5.14 4.31 0.18 -1.26 -5.11 117.16 110.14 1z8r n TYR 89 Ca 0.00 -0.18 -0.32 0.00 1.88 0.00 0.00 57.90 59.29 1z8r n TYR 89 Cb 0.00 0.14 -0.15 0.00 -0.38 0.00 0.00 39.34 38.95 1z8r n TYR 89 CO 0.00 0.00 0.00 0.71 -2.08 0.00 0.00 176.86 175.49 1z8r s TYR 90 N 0.00 2.50 0.42 -3.48 1.51 0.15 -5.12 117.35 113.32 1z8r s TYR 90 Ca 0.06 -0.44 -0.22 0.00 -1.01 0.00 0.00 57.07 55.45 1z8r s TYR 90 Cb 0.06 -1.58 -0.10 0.00 -0.11 0.00 0.00 41.96 40.23 1z8r s TYR 90 CO -0.03 -0.03 0.97 -1.25 -1.11 0.00 0.00 175.55 174.10 1z8r s PRO 91 N -0.47 4.22 -1.09 -1.71 0.04 -1.26 -1.79 135.00 132.94 1z8r s PRO 91 Ca 0.06 1.23 -0.27 0.00 0.04 0.00 0.00 61.00 62.06 1z8r s PRO 91 Cb -0.12 -2.31 -0.23 0.00 0.04 0.00 0.00 34.50 31.88 1z8r s PRO 91 CO 0.01 -0.05 2.10 1.17 0.04 0.00 0.00 177.00 180.27 1z8r n LYS 92 N -0.42 0.23 -4.66 4.56 3.00 -1.25 -4.48 118.16 115.15 1z8r n LYS 92 Ca 0.06 -1.77 -0.30 0.00 -0.00 0.00 0.00 58.31 56.30 1z8r n LYS 92 Cb 0.53 -3.93 -0.08 0.00 0.00 0.00 0.00 35.03 31.55 1z8r n LYS 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 1z8r s ARG 93 N 8.37 2.07 -0.07 1.64 3.52 -0.13 -4.86 118.95 129.48 1z8r s ARG 93 Ca 0.81 -2.29 -0.18 0.00 -0.13 0.00 0.00 55.73 53.93 1z8r s ARG 93 Cb -0.04 -1.20 -0.05 0.00 -1.56 0.00 0.00 34.95 32.09 1z8r s ARG 93 CO 0.19 -0.37 0.50 0.71 -0.81 0.00 0.00 175.30 175.51 1z8r s TYR 94 N -2.99 3.58 -0.17 5.12 1.51 -1.26 0.81 117.35 123.95 1z8r s TYR 94 Ca 0.15 0.98 0.00 0.00 -1.01 0.00 0.00 57.07 57.19 1z8r s TYR 94 Cb 0.03 -2.53 0.03 0.00 -0.11 0.00 0.00 41.96 39.38 1z8r s TYR 94 CO 0.08 0.28 -0.11 -1.14 -1.11 0.00 0.00 175.55 173.56 1z8r s GLN 95 N 0.19 1.99 0.30 -0.62 2.00 0.02 -4.61 119.66 118.93 1z8r s GLN 95 Ca 0.27 -0.66 -0.06 0.00 -2.00 0.00 0.00 55.36 52.91 1z8r s GLN 95 Cb -0.16 -2.19 -0.05 0.00 0.80 0.00 0.00 33.01 31.40 1z8r s GLN 95 CO 0.12 -0.35 0.58 0.45 -0.50 0.00 0.00 175.29 175.59 1z8r s SER 96 N 1.48 6.46 -1.02 6.67 0.15 0.32 0.41 113.70 128.17 1z8r s SER 96 Ca 0.02 0.77 -0.12 0.00 0.70 0.00 0.00 55.95 57.32 1z8r s SER 96 Cb -0.15 -2.17 -0.02 0.00 -1.71 0.00 0.00 66.02 61.97 1z8r s SER 96 CO -0.09 -0.21 0.80 1.41 1.20 0.00 0.00 173.24 176.35 1z8r n HIS 97 N -0.93 -2.26 -4.34 3.44 8.25 0.30 -4.48 115.22 115.21 1z8r n HIS 97 Ca -0.01 0.71 -0.25 0.00 -0.26 0.00 0.00 57.72 57.91 1z8r n HIS 97 Cb 0.54 -3.69 -0.12 0.00 1.12 0.00 0.00 29.99 27.83 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 -3.33 1.95 -0.03 1.59 0.11 -1.02 -2.30 120.40 117.37 1z8r s VAL 98 Ca 0.36 -1.78 0.05 0.00 -2.93 0.00 0.00 61.98 57.69 1z8r s VAL 98 Cb -0.10 -1.81 -0.02 0.00 -1.53 0.00 0.00 36.38 32.92 1z8r s VAL 98 CO 0.81 -0.12 -0.19 -0.76 -3.33 0.00 0.00 175.10 171.51 1z8r s LEU 99 N -2.29 2.47 0.01 2.54 1.02 0.27 -2.35 118.68 120.35 1z8r s LEU 99 Ca 0.13 -0.31 0.03 0.00 0.02 0.00 0.00 54.13 54.00 1z8r s LEU 99 Cb -0.08 -1.47 -0.01 0.00 0.02 0.00 0.00 46.19 44.64 1z8r s LEU 99 CO 0.06 0.33 -0.09 -0.76 0.02 0.00 0.00 176.35 175.91 1z8r s LEU 100 N -0.72 2.07 0.13 1.79 1.43 -0.93 0.04 118.68 122.48 1z8r s LEU 100 Ca 0.11 -0.25 -0.14 0.00 -1.03 0.00 0.00 54.13 52.82 1z8r s LEU 100 Cb -0.10 -0.43 0.02 0.00 0.03 0.00 0.00 46.19 45.71 1z8r s LEU 100 CO 0.00 0.06 0.36 0.00 0.23 0.00 0.00 176.35 177.00 1z8r s ALA 101 N -0.44 -0.70 -0.11 4.21 0.00 -0.96 -2.28 121.76 121.48 1z8r s ALA 101 Ca 0.01 -0.26 0.03 0.00 0.00 0.00 0.00 51.96 51.74 1z8r s ALA 101 Cb -0.05 0.69 -0.00 0.00 0.00 0.00 0.00 23.12 23.76 1z8r s ALA 101 CO 0.00 -0.64 -0.22 -0.08 0.00 0.00 0.00 175.76 174.83 1z8r s THR 102 N -3.84 2.24 0.00 0.00 -1.32 -1.26 0.15 115.64 111.61 1z8r s THR 102 Ca 0.05 -0.95 0.00 0.00 -1.21 0.00 0.00 61.69 59.58 1z8r s THR 102 Cb 0.02 -1.88 0.00 0.00 -1.51 0.00 0.00 72.50 69.14 1z8r s THR 102 CO -0.10 0.55 0.00 0.61 -2.21 0.00 0.00 174.62 173.48 1z8r n GLY 103 N 3.58 -1.22 1.19 6.08 0.00 -0.88 -4.91 105.19 109.03 1z8r n GLY 103 Ca -0.19 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.71 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 -1.15 -3.88 1.61 7.35 -1.26 -5.08 117.46 115.05 1z8r n PHE 104 Ca 0.00 0.00 -0.30 0.00 -0.76 0.00 0.00 57.45 56.39 1z8r n PHE 104 Cb 0.00 0.30 -0.16 0.00 0.35 0.00 0.00 39.48 39.97 1z8r n PHE 104 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 1z8r s SER 105 N -2.18 3.85 0.09 -2.13 1.04 -1.26 -5.00 113.70 108.12 1z8r s SER 105 Ca 0.00 -1.32 0.00 0.00 0.48 0.00 0.00 55.95 55.11 1z8r s SER 105 Cb 0.00 -1.09 0.00 0.00 0.10 0.00 0.00 66.02 65.03 1z8r s SER 105 CO 0.00 -0.29 0.00 1.21 0.98 0.00 0.00 173.24 175.14 1z8r n GLU 106 N 4.71 -5.01 -0.09 4.02 4.07 -1.26 -4.88 120.64 122.20 1z8r n GLU 106 Ca -0.08 3.63 -0.10 0.00 -0.06 0.00 0.00 57.16 60.55 1z8r n GLU 106 Cb 0.44 -4.24 0.04 0.00 -0.06 0.00 0.00 31.44 27.62 1z8r n GLU 106 CO 0.00 0.00 0.00 -1.00 -0.06 0.00 0.00 177.13 176.07 1z8r h PRO 107 N 3.99 0.81 0.00 5.31 0.13 -1.95 -3.49 132.00 136.79 1z8r h PRO 107 Ca 0.00 -0.38 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1z8r h PRO 107 Cb 0.00 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.12 1z8r h PRO 107 CO 0.00 1.01 0.00 0.41 -0.23 0.00 0.00 178.00 179.19 1z8r n GLY 108 N -0.04 2.36 0.04 1.56 0.00 -1.26 -4.94 105.19 102.91 1z8r n GLY 108 Ca -0.01 -1.93 -0.01 0.00 0.00 0.00 0.00 46.02 44.07 1z8r n GLY 108 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1z8r h ASP 109 N 0.00 -0.06 -4.25 1.61 3.58 -1.96 -3.48 116.42 111.86 1z8r h ASP 109 Ca 0.00 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.38 1z8r h ASP 109 Cb 0.00 0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.07 1z8r h ASP 109 CO 0.00 0.01 -0.01 0.00 -2.88 0.00 0.00 179.24 176.36 1z8r n ALA 110 N -2.13 0.16 0.00 -0.78 0.00 -1.26 -4.99 120.51 111.51 1z8r n ALA 110 Ca -0.01 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1z8r n ALA 110 Cb 0.03 0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.57 1z8r n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1z8r n GLY 111 N 4.05 0.00 5.36 0.00 0.00 -1.26 -4.23 105.19 109.11 1z8r n GLY 111 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1z8r n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1z8r n GLY 112 N 1.76 1.35 3.21 -0.02 0.00 -1.26 -3.14 105.19 107.08 1z8r n GLY 112 Ca 0.00 -0.72 -0.24 0.00 0.00 0.00 0.00 46.02 45.06 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 0.00 1.50 -0.37 -0.61 -4.36 -1.26 -0.58 121.20 115.51 1z8r s ILE 113 Ca 0.00 -1.08 -0.23 0.00 -0.26 0.00 0.00 60.65 59.09 1z8r s ILE 113 Cb 0.00 -1.30 0.01 0.00 1.25 0.00 0.00 42.46 42.42 1z8r s ILE 113 CO 0.00 0.19 0.77 -0.22 0.24 0.00 0.00 174.94 175.92 1z8r s LEU 114 N -1.03 4.16 0.00 0.37 2.96 -0.75 -4.07 118.68 120.32 1z8r s LEU 114 Ca 0.06 0.29 0.05 0.00 -0.22 0.00 0.00 54.13 54.30 1z8r s LEU 114 Cb -0.08 -2.99 -0.03 0.00 0.50 0.00 0.00 46.19 43.59 1z8r s LEU 114 CO 0.01 -0.73 -0.14 -0.13 -1.32 0.00 0.00 176.35 174.04 1z8r s ARG 115 N 3.07 2.34 0.32 1.98 0.52 -0.97 0.62 118.95 126.84 1z8r s ARG 115 Ca 0.30 -0.82 0.08 0.00 -0.52 0.00 0.00 55.73 54.77 1z8r s ARG 115 Cb -0.13 -2.33 -0.03 0.00 0.52 0.00 0.00 34.95 32.97 1z8r s ARG 115 CO 0.17 0.58 0.23 0.00 0.02 0.00 0.00 175.30 176.31 1z8r h GLU 117 N 1.38 0.00 0.08 0.00 5.08 -1.98 -0.42 114.58 118.72 1z8r h GLU 117 Ca -0.45 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 57.58 1z8r h GLU 117 Cb 1.25 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 1z8r h GLU 117 CO 0.60 0.00 -1.84 0.45 -1.00 0.00 0.00 179.01 177.22 1z8r h HIS 118 N 0.00 0.30 0.00 4.33 3.86 -1.97 -3.51 115.15 118.17 1z8r h HIS 118 Ca 0.01 -0.22 0.00 0.00 -1.16 0.00 0.00 60.37 58.99 1z8r h HIS 118 Cb 0.40 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.86 1z8r h HIS 118 CO 0.00 1.45 0.00 0.41 0.86 0.00 0.00 177.93 180.65 1z8r n GLY 119 N 1.80 -0.85 3.73 2.45 0.00 -0.17 -4.64 105.19 107.52 1z8r n GLY 119 Ca -0.25 0.12 -0.35 0.00 0.00 0.00 0.00 46.02 45.54 1z8r n GLY 119 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1z8r s VAL 120 N -2.55 4.97 -0.00 1.61 1.01 0.19 0.12 120.40 125.75 1z8r s VAL 120 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 61.98 62.00 1z8r s VAL 120 Cb 0.00 -3.19 -0.00 0.00 0.00 0.00 0.00 36.38 33.19 1z8r s VAL 120 CO 0.00 0.54 -0.00 -0.38 0.00 0.00 0.00 175.10 175.26 1z8r n ILE 121 N 2.73 0.01 -2.46 2.22 2.08 0.20 0.14 119.36 124.29 1z8r n ILE 121 Ca -0.18 0.50 0.00 0.00 0.56 0.00 0.00 62.75 63.63 1z8r n ILE 121 Cb 0.53 -1.51 0.00 0.00 -0.75 0.00 0.00 39.64 37.92 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 1.63 3.99 3.51 7.39 0.00 -0.91 -0.48 105.19 120.32 1z8r n GLY 122 Ca -0.00 -1.06 -0.25 0.00 0.00 0.00 0.00 46.02 44.71 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 0.04 0.99 2.34 0.18 -1.81 118.68 123.08 1z8r s LEU 123 Ca 0.00 -1.18 -0.30 0.00 0.06 0.00 0.00 54.13 52.71 1z8r s LEU 123 Cb 0.00 -0.92 -0.08 0.00 -0.56 0.00 0.00 46.19 44.63 1z8r s LEU 123 CO 0.00 -0.22 1.84 0.54 -1.06 0.00 0.00 176.35 177.45 1z8r s VAL 124 N -2.70 3.06 0.00 1.48 0.11 0.25 0.11 120.40 122.72 1z8r s VAL 124 Ca 0.31 0.24 0.00 0.00 -2.93 0.00 0.00 61.98 59.60 1z8r s VAL 124 Cb 0.02 -3.15 0.00 0.00 -1.53 0.00 0.00 36.38 31.72 1z8r s VAL 124 CO 0.15 -0.01 0.00 0.41 -3.33 0.00 0.00 175.10 172.32 1z8r n THR 125 N 5.30 0.00 -3.17 5.04 -1.04 0.28 -4.70 114.28 115.99 1z8r n THR 125 Ca 0.18 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 61.95 1z8r n THR 125 Cb 0.41 -0.17 -0.01 0.00 -1.82 0.00 0.00 70.33 68.74 1z8r n THR 125 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 1z8r s MET 126 N 0.13 3.46 -0.39 -2.82 -1.94 0.10 -4.89 119.30 112.95 1z8r s MET 126 Ca 0.00 -0.22 0.04 0.00 -1.71 0.00 0.00 55.69 53.80 1z8r s MET 126 Cb 0.00 -2.58 0.16 0.00 2.01 0.00 0.00 34.83 34.42 1z8r s MET 126 CO 0.00 0.03 0.44 0.20 -0.01 0.00 0.00 175.02 175.67 1z8r s GLY 127 N -4.07 -0.19 0.70 -0.03 0.00 -1.26 0.11 107.32 102.58 1z8r s GLY 127 Ca 0.42 -0.90 -0.12 0.00 0.00 0.00 0.00 44.72 44.13 1z8r s GLY 127 CO 0.38 2.89 0.85 0.61 0.00 0.00 0.00 173.10 177.84 1z8r n GLY 128 N 4.05 -1.72 0.25 0.20 0.00 -0.49 -4.73 105.19 102.74 1z8r n GLY 128 Ca 0.13 -1.64 0.16 0.00 0.00 0.00 0.00 46.02 44.67 1z8r n GLY 128 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1z8r h GLU 129 N 0.00 0.00 0.00 1.61 -0.00 -2.01 -3.34 114.58 110.84 1z8r h GLU 129 Ca -0.29 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.07 1z8r h GLU 129 Cb 0.81 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.56 1z8r h GLU 129 CO 0.20 0.00 0.00 0.41 -0.00 0.00 0.00 179.01 179.62 1z8r n GLY 130 N 0.21 1.00 3.55 1.06 0.00 -1.26 -4.59 105.19 105.16 1z8r n GLY 130 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 1z8r n GLY 130 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1z8r s VAL 131 N 0.00 3.02 -0.19 1.61 1.01 -1.26 -2.07 120.40 122.52 1z8r s VAL 131 Ca 0.00 -1.93 0.01 0.00 0.00 0.00 0.00 61.98 60.06 1z8r s VAL 131 Cb 0.00 -2.55 0.02 0.00 0.00 0.00 0.00 36.38 33.86 1z8r s VAL 131 CO 0.00 -0.25 -0.18 0.68 0.00 0.00 0.00 175.10 175.35 1z8r s VAL 132 N -2.05 2.12 -0.27 2.92 -7.23 0.40 -1.40 120.40 114.88 1z8r s VAL 132 Ca 0.27 -1.02 -0.10 0.00 -1.81 0.00 0.00 61.98 59.32 1z8r s VAL 132 Cb -0.07 -1.94 -0.05 0.00 0.56 0.00 0.00 36.38 34.88 1z8r s VAL 132 CO 0.16 0.46 0.17 -0.83 -0.31 0.00 0.00 175.10 174.75 1z8r s GLY 133 N 1.27 1.90 -0.04 2.32 0.00 0.30 -2.27 107.32 110.80 1z8r s GLY 133 Ca 0.03 -1.09 0.05 0.00 0.00 0.00 0.00 44.72 43.71 1z8r s GLY 133 CO -0.12 0.63 -0.19 -1.36 0.00 0.00 0.00 173.10 172.07 1z8r s PHE 134 N 1.73 1.79 -0.37 1.90 0.08 0.11 0.98 117.98 124.20 1z8r s PHE 134 Ca 0.07 -0.46 -0.22 0.00 0.12 0.00 0.00 56.93 56.43 1z8r s PHE 134 Cb -0.16 -1.19 0.01 0.00 -0.57 0.00 0.00 43.02 41.11 1z8r s PHE 134 CO 0.10 -0.13 0.72 0.00 -0.10 0.00 0.00 175.22 175.81 1z8r s ALA 135 N -0.13 3.43 0.35 5.36 0.00 0.31 0.98 121.76 132.06 1z8r s ALA 135 Ca -0.00 -0.76 -0.28 0.00 0.00 0.00 0.00 51.96 50.92 1z8r s ALA 135 Cb -0.10 -3.29 -0.10 0.00 0.00 0.00 0.00 23.12 19.63 1z8r s ALA 135 CO 0.01 -1.45 1.27 0.34 0.00 0.00 0.00 175.76 175.93 1z8r s ASP 136 N 1.84 6.68 0.00 0.00 -1.08 -0.97 0.47 116.67 123.60 1z8r s ASP 136 Ca 0.28 2.60 0.11 0.00 -0.52 0.00 0.00 52.55 55.02 1z8r s ASP 136 Cb -0.14 -2.64 0.33 0.00 -1.46 0.00 0.00 42.92 39.01 1z8r s ASP 136 CO 0.16 -0.59 1.27 0.52 0.52 0.00 0.00 175.17 177.05 1z8r n VAL 137 N 0.58 0.45 0.72 1.11 0.31 0.37 -4.05 118.33 117.82 1z8r n VAL 137 Ca 0.01 -0.46 0.08 0.00 -0.01 0.00 0.00 64.34 63.96 1z8r n VAL 137 Cb 0.43 0.24 0.39 0.00 -0.91 0.00 0.00 33.84 33.99 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 0.51 0.18 -0.35 5.55 5.12 -1.26 -2.26 116.66 124.14 1z8r n ARG 138 Ca 0.12 0.15 0.09 0.00 -1.93 0.00 0.00 57.85 56.28 1z8r n ARG 138 Cb 0.29 -1.50 0.27 0.00 -1.16 0.00 0.00 32.46 30.36 1z8r n ARG 138 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1z8r n ASP 139 N -1.33 3.36 -2.66 0.55 2.03 -1.26 -4.49 116.55 112.75 1z8r n ASP 139 Ca 0.07 -2.08 -0.03 0.00 0.52 0.00 0.00 54.79 53.27 1z8r n ASP 139 Cb 0.14 -0.42 0.08 0.00 -0.72 0.00 0.00 41.12 40.20 1z8r n ASP 139 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1z8r n LEU 140 N 1.17 -1.12 0.12 -2.67 -0.00 -0.96 -5.00 117.00 108.53 1z8r n LEU 140 Ca 0.20 -1.72 0.13 0.00 -0.00 0.00 0.00 56.01 54.62 1z8r n LEU 140 Cb 0.56 0.97 0.45 0.00 -0.00 0.00 0.00 43.42 45.40 1z8r n LEU 140 CO 0.15 1.43 0.87 -0.11 -0.00 0.00 0.00 177.39 179.73 1z8r n LEU 141 N 0.21 0.76 -4.49 1.47 -0.00 -1.13 -4.65 117.00 109.18 1z8r n LEU 141 Ca -0.13 0.63 -0.12 0.00 -0.00 0.00 0.00 56.01 56.39 1z8r n LEU 141 Cb 0.73 -0.45 -0.10 0.00 -0.00 0.00 0.00 43.42 43.60 1z8r n LEU 141 CO -0.11 -0.38 1.14 -2.67 -0.00 0.00 0.00 177.39 175.37 1z8r n TRP 142 N -2.27 0.78 0.00 1.96 4.27 -1.26 -3.66 117.44 117.26 1z8r n TRP 142 Ca 0.04 -0.10 0.00 0.00 -3.89 0.00 0.00 57.50 53.55 1z8r n TRP 142 Cb 0.33 -2.20 0.00 0.00 -1.36 0.00 0.00 31.31 28.08 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 16.76 0.00 0.00 5.67 4.32 -1.26 -4.99 117.00 137.50 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 0.45 0.14 0.00 0.00 -1.62 0.00 0.00 43.42 42.38 1z8r n LEU 143 CO 0.59 -0.28 0.00 -0.62 -1.22 0.00 0.00 177.39 175.86 1z8r n GLU 144 N -2.07 0.00 -1.75 3.23 -0.58 -1.24 -4.53 120.64 113.70 1z8r n GLU 144 Ca 0.00 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.33 1z8r n GLU 144 Cb 0.00 0.00 0.01 0.00 -0.57 0.00 0.00 31.44 30.88 1z8r n GLU 144 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1z8r n ASP 145 N -1.16 3.39 -4.92 1.62 -0.08 -1.26 -5.00 116.55 109.14 1z8r n ASP 145 Ca 0.00 1.18 -0.28 0.00 -1.51 0.00 0.00 54.79 54.18 1z8r n ASP 145 Cb 0.00 -1.58 -0.03 0.00 2.34 0.00 0.00 41.12 41.84 1z8r n ASP 145 CO 0.00 0.00 0.00 1.51 0.12 0.00 0.00 177.20 178.83 1z8r s ASP 146 N -0.29 6.42 -0.22 1.67 1.47 -1.26 -4.66 116.67 119.80 1z8r s ASP 146 Ca 0.56 0.54 -0.12 0.00 1.18 0.00 0.00 52.55 54.71 1z8r s ASP 146 Cb -0.48 -2.07 -0.05 0.00 -0.34 0.00 0.00 42.92 39.98 1z8r s ASP 146 CO 0.61 -0.09 0.22 0.00 0.68 0.00 0.00 175.17 176.60 1z8r s ALA 147 N -1.92 3.61 0.39 2.11 0.00 -1.24 -4.85 121.76 119.86 1z8r s ALA 147 Ca 0.41 -0.74 0.05 0.00 0.00 0.00 0.00 51.96 51.67 1z8r s ALA 147 Cb -0.11 -2.38 -0.02 0.00 0.00 0.00 0.00 23.12 20.61 1z8r s ALA 147 CO 0.29 -0.15 0.17 0.00 0.00 0.00 0.00 175.76 176.07 1z8r n MET 148 N 4.17 0.54 -4.28 0.00 0.00 -1.26 -1.98 117.12 114.31 1z8r n MET 148 Ca -0.13 -3.43 -0.15 0.00 0.00 0.00 0.00 57.70 53.98 1z8r n MET 148 Cb 0.52 2.04 -0.10 0.00 0.00 0.00 0.00 33.22 35.67 1z8r n MET 148 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 175.97 174.14 1z8r s GLU 149 N -3.52 1.34 0.00 3.17 -1.05 -1.26 -5.05 118.70 112.33 1z8r s GLU 149 Ca 0.24 -1.72 0.00 0.00 -0.15 0.00 0.00 54.97 53.34 1z8r s GLU 149 Cb 0.01 -0.13 0.00 0.00 -0.44 0.00 0.00 34.13 33.57 1z8r s GLU 149 CO 0.17 -0.31 0.03 1.04 0.95 0.00 0.00 175.26 177.14