#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zbx s LYS 3 N 0.00 0.54 0.07 0.00 1.02 -1.26 -5.17 119.74 114.95 1zbx s LYS 3 Ca 0.00 -1.07 0.01 0.00 0.02 0.00 0.00 55.97 54.92 1zbx s LYS 3 Cb 0.00 0.17 -0.04 0.00 -0.52 0.00 0.00 37.83 37.44 1zbx s LYS 3 CO 0.00 -0.09 -0.05 -0.08 -0.92 0.00 0.00 175.35 174.21 1zbx s THR 4 N -3.30 0.47 -0.22 2.17 -1.32 -1.26 -5.14 115.64 107.04 1zbx s THR 4 Ca 0.01 -1.82 -0.07 0.00 -1.21 0.00 0.00 61.69 58.61 1zbx s THR 4 Cb 0.03 -1.53 -0.03 0.00 -1.51 0.00 0.00 72.50 69.46 1zbx s THR 4 CO -0.08 -0.90 0.05 -0.76 -2.21 0.00 0.00 174.62 170.73 1zbx s LEU 5 N -2.89 3.46 0.03 9.08 1.43 -1.26 -5.09 118.68 123.46 1zbx s LEU 5 Ca 0.08 -0.15 0.04 0.00 -1.03 0.00 0.00 54.13 53.07 1zbx s LEU 5 Cb 0.05 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.33 1zbx s LEU 5 CO -0.07 0.03 -0.08 -0.75 0.23 0.00 0.00 176.35 175.71 1zbx s LYS 6 N 1.23 2.43 -0.04 1.70 2.20 -1.26 -5.10 119.74 120.91 1zbx s LYS 6 Ca 0.04 -0.81 -0.24 0.00 -0.36 0.00 0.00 55.97 54.60 1zbx s LYS 6 Cb -0.14 -2.44 -0.04 0.00 -1.51 0.00 0.00 37.83 33.69 1zbx s LYS 6 CO 0.03 0.57 0.73 0.34 -0.36 0.00 0.00 175.35 176.66 1zbx s ASP 7 N -1.65 7.06 -1.05 1.43 2.15 -1.26 -4.97 116.67 118.38 1zbx s ASP 7 Ca 0.18 1.27 -0.22 0.00 0.43 0.00 0.00 52.55 54.21 1zbx s ASP 7 Cb -0.11 -2.43 0.04 0.00 -0.30 0.00 0.00 42.92 40.11 1zbx s ASP 7 CO 0.09 -0.09 1.57 -0.76 -0.17 0.00 0.00 175.17 175.81 1zbx s LEU 8 N 0.61 3.49 0.24 -1.34 1.43 -1.26 -4.95 118.68 116.91 1zbx s LEU 8 Ca 0.39 -1.49 -0.31 0.00 -1.03 0.00 0.00 54.13 51.68 1zbx s LEU 8 Cb -0.19 -2.57 -0.13 0.00 0.03 0.00 0.00 46.19 43.33 1zbx s LEU 8 CO 0.20 -1.67 1.47 0.00 0.23 0.00 0.00 176.35 176.57 1zbx n GLN 9 N 8.80 2.20 0.00 1.70 6.02 -1.26 -2.36 117.38 132.48 1zbx n GLN 9 Ca 0.37 0.78 0.00 0.00 -0.01 0.00 0.00 57.00 58.14 1zbx n GLN 9 Cb 0.50 -2.48 0.00 0.00 1.02 0.00 0.00 30.24 29.28 1zbx n GLN 9 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1zbx n GLY 10 N 2.32 2.81 3.93 1.08 0.00 -1.26 -5.00 105.19 109.07 1zbx n GLY 10 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 1zbx n GLY 10 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1zbx s TRP 11 N -0.73 3.51 -0.13 1.61 0.52 -0.99 -0.98 118.94 121.75 1zbx s TRP 11 Ca 0.00 0.44 -0.08 0.00 0.02 0.00 0.00 56.10 56.48 1zbx s TRP 11 Cb 0.00 -1.97 0.05 0.00 -1.15 0.00 0.00 33.47 30.40 1zbx s TRP 11 CO 0.00 0.09 0.32 -2.00 0.02 0.00 0.00 176.95 175.38 1zbx s GLU 12 N -4.25 0.31 0.28 4.98 2.12 -0.09 -4.91 118.70 117.14 1zbx s GLU 12 Ca 0.41 0.61 -0.24 0.00 0.36 0.00 0.00 54.97 56.11 1zbx s GLU 12 Cb -0.10 -0.02 -0.09 0.00 0.26 0.00 0.00 34.13 34.18 1zbx s GLU 12 CO 0.36 -0.13 0.87 0.42 -0.54 0.00 0.00 175.26 176.24 1zbx s ILE 13 N 1.06 4.33 -0.06 -3.70 1.01 -1.26 -1.09 121.20 121.49 1zbx s ILE 13 Ca -0.07 1.66 0.03 0.00 0.00 0.00 0.00 60.65 62.26 1zbx s ILE 13 Cb -0.08 -3.98 0.01 0.00 0.01 0.00 0.00 42.46 38.42 1zbx s ILE 13 CO -0.08 0.19 -0.14 -0.63 0.00 0.00 0.00 174.94 174.28 1zbx s ILE 14 N -1.56 1.25 -0.10 2.92 1.01 -0.95 -4.95 121.20 118.81 1zbx s ILE 14 Ca 0.47 -0.56 -0.01 0.00 0.00 0.00 0.00 60.65 60.55 1zbx s ILE 14 Cb -0.18 -1.11 -0.03 0.00 0.01 0.00 0.00 42.46 41.14 1zbx s ILE 14 CO 0.23 0.38 -0.07 -0.89 0.00 0.00 0.00 174.94 174.59 1zbx s THR 15 N 0.49 3.70 0.00 2.92 2.01 -1.26 -2.52 115.64 120.98 1zbx s THR 15 Ca -0.12 -0.46 0.00 0.00 0.31 0.00 0.00 61.69 61.42 1zbx s THR 15 Cb -0.15 -2.55 0.00 0.00 0.01 0.00 0.00 72.50 69.81 1zbx s THR 15 CO 0.04 0.56 0.00 0.35 -0.69 0.00 0.00 174.62 174.88 1zbx n THR 16 N 2.74 0.00 0.00 -0.82 -2.24 -0.63 -3.28 114.28 110.05 1zbx n THR 16 Ca -0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 1zbx n THR 16 Cb 0.53 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 1zbx n THR 16 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1zbx n ASP 17 N 0.00 0.00 0.00 3.42 2.03 -1.26 -2.94 116.55 117.80 1zbx n ASP 17 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1zbx n ASP 17 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1zbx n ASP 17 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1zbx n GLU 18 N 0.00 0.27 -3.86 -0.67 -0.58 -1.26 -5.14 120.64 109.40 1zbx n GLU 18 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1zbx n GLU 18 Cb 0.00 -0.62 0.00 0.00 -0.57 0.00 0.00 31.44 30.25 1zbx n GLU 18 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 1zbx n GLN 19 N -1.51 -1.84 0.00 3.49 -0.06 -1.26 -5.20 117.38 111.00 1zbx n GLN 19 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1zbx n GLN 19 Cb 0.12 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.30 1zbx n GLN 19 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1zbx n GLY 20 N 0.00 3.26 2.02 1.69 0.00 -1.21 -4.50 105.19 106.46 1zbx n GLY 20 Ca 0.00 -1.77 -0.25 0.00 0.00 0.00 0.00 46.02 44.00 1zbx n GLY 20 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1zbx n ASN 21 N 0.00 5.41 -3.79 1.61 3.02 -1.26 -4.36 115.26 115.90 1zbx n ASN 21 Ca 0.00 -3.77 -0.22 0.00 -0.03 0.00 0.00 54.58 50.56 1zbx n ASN 21 Cb 0.00 -0.52 -0.17 0.00 -0.61 0.00 0.00 39.78 38.48 1zbx n ASN 21 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1zbx s THR 37 N -4.56 0.39 0.06 3.41 -4.23 -1.26 -5.02 115.64 104.43 1zbx s THR 37 Ca 0.54 0.09 0.08 0.00 -1.18 0.00 0.00 61.69 61.22 1zbx s THR 37 Cb 0.43 -0.53 -0.03 0.00 1.34 0.00 0.00 72.50 73.72 1zbx s THR 37 CO 0.02 0.25 -0.21 -1.61 -0.54 0.00 0.00 174.62 172.54 1zbx s GLU 38 N 1.82 1.33 0.08 3.99 0.41 -1.15 -5.00 118.70 120.17 1zbx s GLU 38 Ca 0.03 -1.01 -0.01 0.00 -0.41 0.00 0.00 54.97 53.57 1zbx s GLU 38 Cb -0.12 -1.49 -0.04 0.00 -1.78 0.00 0.00 34.13 30.70 1zbx s GLU 38 CO -0.05 0.37 0.01 -1.01 -0.49 0.00 0.00 175.26 174.09 1zbx s HIS 39 N -0.89 0.61 -0.30 1.61 3.76 -1.26 -1.60 115.29 117.22 1zbx s HIS 39 Ca 0.07 -1.10 -0.18 0.00 -0.15 0.00 0.00 55.06 53.70 1zbx s HIS 39 Cb -0.09 -0.40 0.20 0.00 1.11 0.00 0.00 32.58 33.39 1zbx s HIS 39 CO 0.02 -0.43 1.27 1.52 -0.85 0.00 0.00 174.74 176.27 1zbx s TYR 40 N -3.96 -0.12 0.34 1.40 -0.85 -1.05 -4.70 117.35 108.40 1zbx s TYR 40 Ca 0.12 0.25 -0.26 0.00 -0.52 0.00 0.00 57.07 56.67 1zbx s TYR 40 Cb 0.08 0.17 -0.10 0.00 0.38 0.00 0.00 41.96 42.49 1zbx s TYR 40 CO -0.06 -0.06 0.96 -0.51 -1.52 0.00 0.00 175.55 174.36 1zbx s LEU 41 N 0.84 4.31 -0.02 -3.49 1.43 0.46 -2.25 118.68 119.96 1zbx s LEU 41 Ca -0.05 1.87 0.03 0.00 -1.03 0.00 0.00 54.13 54.95 1zbx s LEU 41 Cb -0.03 -4.04 -0.00 0.00 0.03 0.00 0.00 46.19 42.15 1zbx s LEU 41 CO -0.11 -0.14 -0.09 -0.75 0.23 0.00 0.00 176.35 175.49 1zbx s LYS 42 N -2.13 0.89 -0.26 1.70 2.20 -0.25 -0.02 119.74 121.88 1zbx s LYS 42 Ca 0.51 -0.32 -0.13 0.00 -0.36 0.00 0.00 55.97 55.67 1zbx s LYS 42 Cb -0.19 -0.85 -0.04 0.00 -1.51 0.00 0.00 37.83 35.24 1zbx s LYS 42 CO 0.24 0.15 0.30 0.50 -0.36 0.00 0.00 175.35 176.18 1zbx s ARG 43 N 0.02 4.04 0.13 4.03 3.52 -0.39 -0.92 118.95 129.37 1zbx s ARG 43 Ca -0.00 -0.07 -0.31 0.00 -0.13 0.00 0.00 55.73 55.21 1zbx s ARG 43 Cb -0.07 -3.62 -0.09 0.00 -1.56 0.00 0.00 34.95 29.62 1zbx s ARG 43 CO 0.00 -0.15 1.57 0.77 -0.81 0.00 0.00 175.30 176.67 1zbx h SER 44 N 7.97 -1.54 0.00 -2.12 0.02 -1.40 0.73 113.55 117.21 1zbx h SER 44 Ca -0.34 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 1zbx h SER 44 Cb 1.17 0.61 0.00 0.00 0.14 0.00 0.00 62.40 64.32 1zbx h SER 44 CO 0.64 -0.46 0.00 -1.54 -1.14 0.00 0.00 176.83 174.33 1zbx n SER 45 N -5.44 0.00 0.14 3.07 3.41 -1.26 -3.63 113.62 109.92 1zbx n SER 45 Ca -0.05 0.63 0.12 0.00 -0.26 0.00 0.00 58.87 59.31 1zbx n SER 45 Cb 0.37 -0.13 0.06 0.00 -0.26 0.00 0.00 64.21 64.26 1zbx n SER 45 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1zbx h ASP 46 N 0.00 0.00 0.00 4.04 2.03 -1.98 -3.48 116.42 117.03 1zbx h ASP 46 Ca 0.00 -0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1zbx h ASP 46 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 1zbx h ASP 46 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.82 1zbx n GLY 47 N 1.16 0.68 3.62 7.15 0.00 0.25 -5.04 105.19 113.01 1zbx n GLY 47 Ca 0.01 -0.01 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1zbx n GLY 47 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1zbx n ILE 48 N -2.64 2.49 -4.57 -0.61 -5.35 -1.25 -4.53 119.36 102.89 1zbx n ILE 48 Ca 0.00 -0.33 -0.23 0.00 -0.27 0.00 0.00 62.75 61.92 1zbx n ILE 48 Cb 0.00 -1.09 -0.16 0.00 -1.74 0.00 0.00 39.64 36.65 1zbx n ILE 48 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1zbx s LYS 49 N -3.50 1.32 -0.10 6.28 1.02 -1.26 -1.27 119.74 122.22 1zbx s LYS 49 Ca 0.72 -0.43 0.02 0.00 0.02 0.00 0.00 55.97 56.31 1zbx s LYS 49 Cb -0.33 -1.18 0.01 0.00 -0.52 0.00 0.00 37.83 35.81 1zbx s LYS 49 CO 0.51 0.16 -0.18 -0.51 -0.92 0.00 0.00 175.35 174.41 1zbx s LEU 50 N 0.16 1.87 0.00 3.17 1.43 0.97 -4.99 118.68 121.29 1zbx s LEU 50 Ca -0.04 -0.47 -0.06 0.00 -1.03 0.00 0.00 54.13 52.53 1zbx s LEU 50 Cb -0.10 -1.18 0.02 0.00 0.03 0.00 0.00 46.19 44.96 1zbx s LEU 50 CO 0.01 0.07 0.44 0.61 0.23 0.00 0.00 176.35 177.71 1zbx n GLY 51 N 3.94 1.80 3.65 -3.19 0.00 -1.26 -0.40 105.19 109.73 1zbx n GLY 51 Ca -0.20 -1.34 -0.45 0.00 0.00 0.00 0.00 46.02 44.03 1zbx n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zbx n ARG 52 N -0.38 1.83 0.00 1.61 1.74 -1.26 -2.11 116.66 118.09 1zbx n ARG 52 Ca -0.03 0.65 0.00 0.00 -0.77 0.00 0.00 57.85 57.70 1zbx n ARG 52 Cb 0.40 -2.23 0.00 0.00 -1.02 0.00 0.00 32.46 29.61 1zbx n ARG 52 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1zbx n GLY 53 N 1.80 1.32 3.83 -0.13 0.00 0.16 -4.72 105.19 107.45 1zbx n GLY 53 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 1zbx n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1zbx s ASP 54 N -2.67 6.94 0.01 1.61 -0.00 -0.90 -4.82 116.67 116.84 1zbx s ASP 54 Ca 0.00 1.25 0.03 0.00 -0.00 0.00 0.00 52.55 53.83 1zbx s ASP 54 Cb 0.00 -2.36 -0.03 0.00 -0.00 0.00 0.00 42.92 40.53 1zbx s ASP 54 CO 0.00 0.06 -0.04 -0.44 -0.00 0.00 0.00 175.17 174.75 1zbx s SER 55 N -1.69 4.79 0.02 0.27 0.01 -1.26 0.42 113.70 116.26 1zbx s SER 55 Ca 0.41 -0.11 0.02 0.00 1.31 0.00 0.00 55.95 57.57 1zbx s SER 55 Cb -0.16 -1.16 -0.01 0.00 0.21 0.00 0.00 66.02 64.90 1zbx s SER 55 CO 0.20 0.27 -0.06 0.68 0.41 0.00 0.00 173.24 174.74 1zbx s VAL 56 N -1.05 0.42 -0.23 3.43 -7.23 0.25 0.45 120.40 116.43 1zbx s VAL 56 Ca 0.18 -0.64 -0.21 0.00 -1.81 0.00 0.00 61.98 59.51 1zbx s VAL 56 Cb -0.11 -0.44 -0.02 0.00 0.56 0.00 0.00 36.38 36.37 1zbx s VAL 56 CO 0.09 -0.16 0.63 -0.69 -0.31 0.00 0.00 175.10 174.67 1zbx s VAL 57 N -0.78 5.00 0.13 1.32 1.01 0.32 -1.51 120.40 125.90 1zbx s VAL 57 Ca -0.05 1.16 0.10 0.00 0.00 0.00 0.00 61.98 63.20 1zbx s VAL 57 Cb -0.06 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1zbx s VAL 57 CO 0.00 0.06 -0.24 -0.04 0.00 0.00 0.00 175.10 174.88 1zbx s MET 58 N 2.27 1.52 0.09 2.72 -1.94 0.54 -1.33 119.30 123.17 1zbx s MET 58 Ca 0.27 -1.32 -0.30 0.00 -1.71 0.00 0.00 55.69 52.63 1zbx s MET 58 Cb -0.16 -1.95 -0.06 0.00 2.01 0.00 0.00 34.83 34.68 1zbx s MET 58 CO 0.09 0.45 1.04 -1.58 -0.01 0.00 0.00 175.02 175.02 1zbx s HIS 59 N -1.14 3.66 -0.50 -0.03 5.65 0.14 -1.37 115.29 121.69 1zbx s HIS 59 Ca 0.16 1.64 0.03 0.00 0.25 0.00 0.00 55.06 57.14 1zbx s HIS 59 Cb -0.10 -3.19 0.14 0.00 -1.18 0.00 0.00 32.58 28.25 1zbx s HIS 59 CO 0.07 -0.30 0.28 1.21 -0.65 0.00 0.00 174.74 175.36 1zbx s ASN 60 N 0.41 4.00 0.18 9.88 3.84 -1.21 -4.86 114.94 127.17 1zbx s ASN 60 Ca 0.51 -2.96 -0.24 0.00 0.21 0.00 0.00 52.86 50.38 1zbx s ASN 60 Cb -0.25 -1.35 0.06 0.00 -0.55 0.00 0.00 41.25 39.16 1zbx s ASN 60 CO 0.30 -0.23 1.57 -0.08 -2.79 0.00 0.00 177.10 175.88 1zbx h GLU 61 N 6.43 -0.18 -0.52 0.43 4.57 -1.95 -0.65 114.58 122.71 1zbx h GLU 61 Ca -0.01 0.01 0.07 0.00 -1.18 0.00 0.00 59.36 58.25 1zbx h GLU 61 Cb 0.89 0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 29.46 1zbx h GLU 61 CO 0.60 -0.12 0.19 0.00 -1.18 0.00 0.00 179.01 178.50 1zbx h ALA 62 N 0.74 0.65 0.00 2.92 0.00 -1.95 -2.41 119.26 119.21 1zbx h ALA 62 Ca 0.20 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 1zbx h ALA 62 Cb 0.56 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1zbx h ALA 62 CO -0.73 -0.20 -0.24 0.00 0.00 0.00 0.00 179.25 178.08 1zbx h ALA 63 N 1.35 1.00 -0.61 0.00 0.00 -1.81 -3.47 119.26 115.72 1zbx h ALA 63 Ca 0.25 -0.22 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 1zbx h ALA 63 Cb 0.27 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1zbx h ALA 63 CO -0.25 0.30 -0.17 0.41 0.00 0.00 0.00 179.25 179.54 1zbx n GLY 64 N 0.25 0.75 3.64 0.00 0.00 -0.32 -4.97 105.19 104.54 1zbx n GLY 64 Ca 0.00 -0.63 -0.06 0.00 0.00 0.00 0.00 46.02 45.33 1zbx n GLY 64 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1zbx s THR 65 N -2.34 0.00 0.66 2.61 -1.32 -1.23 -5.05 115.64 108.96 1zbx s THR 65 Ca 0.00 -0.38 -0.13 0.00 -1.21 0.00 0.00 61.69 59.97 1zbx s THR 65 Cb 0.00 -1.54 -0.01 0.00 -1.51 0.00 0.00 72.50 69.45 1zbx s THR 65 CO 0.00 0.00 1.07 -0.72 -2.21 0.00 0.00 174.62 172.76 1zbx s TYR 66 N -3.30 2.97 0.06 9.09 -0.85 -1.26 -3.33 117.35 120.73 1zbx s TYR 66 Ca 0.09 1.48 0.07 0.00 -0.52 0.00 0.00 57.07 58.18 1zbx s TYR 66 Cb -0.01 -2.97 -0.03 0.00 0.38 0.00 0.00 41.96 39.33 1zbx s TYR 66 CO -0.03 -1.27 -0.18 -1.12 -1.52 0.00 0.00 175.55 171.43 1zbx s SER 67 N -3.23 2.15 0.01 -0.18 0.01 -0.47 -4.90 113.70 107.08 1zbx s SER 67 Ca 0.61 -0.56 0.05 0.00 1.31 0.00 0.00 55.95 57.37 1zbx s SER 67 Cb -0.16 -0.14 -0.03 0.00 0.21 0.00 0.00 66.02 65.90 1zbx s SER 67 CO 0.46 0.07 -0.14 -0.69 0.41 0.00 0.00 173.24 173.35 1zbx s VAL 68 N -0.97 3.08 0.23 3.43 1.01 -1.26 -0.34 120.40 125.59 1zbx s VAL 68 Ca 0.04 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 61.08 1zbx s VAL 68 Cb -0.09 -2.28 -0.05 0.00 0.00 0.00 0.00 36.38 33.96 1zbx s VAL 68 CO 0.02 0.42 0.09 -0.31 0.00 0.00 0.00 175.10 175.32 1zbx s TYR 69 N -0.89 1.42 -0.18 5.22 1.51 -0.57 -1.62 117.35 122.24 1zbx s TYR 69 Ca 0.14 -1.19 0.01 0.00 -1.01 0.00 0.00 57.07 55.03 1zbx s TYR 69 Cb -0.11 -0.81 0.03 0.00 -0.11 0.00 0.00 41.96 40.96 1zbx s TYR 69 CO 0.05 -0.36 -0.14 1.41 -1.11 0.00 0.00 175.55 175.39 1zbx s MET 70 N -4.03 2.39 -0.06 -0.62 1.75 -0.23 -0.58 119.30 117.91 1zbx s MET 70 Ca 0.36 -0.77 -0.33 0.00 -1.25 0.00 0.00 55.69 53.70 1zbx s MET 70 Cb 0.07 -2.37 -0.11 0.00 2.84 0.00 0.00 34.83 35.26 1zbx s MET 70 CO 0.12 -0.31 1.93 -0.89 -0.65 0.00 0.00 175.02 175.22 1zbx n ILE 71 N 4.68 0.63 -0.04 10.11 5.41 0.17 -0.68 119.36 139.64 1zbx n ILE 71 Ca -0.17 -0.13 -0.16 0.00 1.00 0.00 0.00 62.75 63.29 1zbx n ILE 71 Cb 0.48 -2.04 -0.14 0.00 -0.71 0.00 0.00 39.64 37.24 1zbx n ILE 71 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 1zbx n GLN 72 N 7.05 0.70 -3.54 0.38 -0.06 0.56 -0.67 117.38 121.80 1zbx n GLN 72 Ca 0.22 0.22 -0.11 0.00 -2.00 0.00 0.00 57.00 55.34 1zbx n GLN 72 Cb 0.33 -1.67 -0.04 0.00 -4.06 0.00 0.00 30.24 24.80 1zbx n GLN 72 CO 0.00 0.00 0.00 -2.00 -0.20 0.00 0.00 177.06 174.86 1zbx s GLU 73 N -2.55 0.73 -0.61 3.69 2.12 -0.92 -4.79 118.70 116.37 1zbx s GLU 73 Ca -0.19 0.00 0.03 0.00 0.36 0.00 0.00 54.97 55.17 1zbx s GLU 73 Cb 0.07 0.34 0.15 0.00 0.26 0.00 0.00 34.13 34.96 1zbx s GLU 73 CO 0.76 -0.26 0.39 -0.51 -0.54 0.00 0.00 175.26 175.09 1zbx s LEU 74 N -1.59 4.69 -0.21 2.70 1.43 -1.26 -1.96 118.68 122.48 1zbx s LEU 74 Ca -0.01 -3.26 -0.29 0.00 -1.03 0.00 0.00 54.13 49.54 1zbx s LEU 74 Cb -0.01 -1.70 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 1zbx s LEU 74 CO -0.01 -0.21 1.44 -0.13 0.23 0.00 0.00 176.35 177.66 1zbx s ARG 75 N -0.63 4.00 0.34 1.70 0.52 -0.91 -4.92 118.95 119.04 1zbx s ARG 75 Ca 0.20 1.62 0.09 0.00 -0.52 0.00 0.00 55.73 57.11 1zbx s ARG 75 Cb -0.18 -3.91 -0.05 0.00 0.52 0.00 0.00 34.95 31.32 1zbx s ARG 75 CO -0.06 -1.02 0.03 -1.17 0.02 0.00 0.00 175.30 173.09 1zbx s LEU 76 N 4.35 3.02 -0.14 2.53 2.96 -1.26 -1.76 118.68 128.38 1zbx s LEU 76 Ca 0.63 -0.95 -0.03 0.00 -0.22 0.00 0.00 54.13 53.56 1zbx s LEU 76 Cb -0.23 -1.42 -0.03 0.00 0.50 0.00 0.00 46.19 45.02 1zbx s LEU 76 CO 0.23 -0.23 -0.03 0.21 -1.32 0.00 0.00 176.35 175.21 1zbx s ASN 77 N -3.73 4.88 0.39 3.68 2.47 -1.12 -5.00 114.94 116.50 1zbx s ASN 77 Ca 0.35 -0.08 0.15 0.00 0.42 0.00 0.00 52.86 53.70 1zbx s ASN 77 Cb -0.01 -1.71 0.79 0.00 -1.45 0.00 0.00 41.25 38.87 1zbx s ASN 77 CO 0.20 0.21 1.84 0.71 -3.72 0.00 0.00 177.10 176.34 1zbx h THR 78 N 4.96 1.15 0.02 -5.21 1.35 -2.00 -3.35 112.91 109.82 1zbx h THR 78 Ca -0.35 -1.23 -0.00 0.00 -0.55 0.00 0.00 66.41 64.28 1zbx h THR 78 Cb 1.19 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 69.29 1zbx h THR 78 CO 0.62 0.34 -0.01 0.25 -0.25 0.00 0.00 175.52 176.47 1zbx h LEU 79 N 0.00 -0.02 -9.76 3.87 5.85 -2.00 -3.49 115.31 109.77 1zbx h LEU 79 Ca -0.00 0.00 -0.55 0.00 0.84 0.00 0.00 57.88 58.16 1zbx h LEU 79 Cb 0.65 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.61 1zbx h LEU 79 CO 0.05 0.12 -0.56 0.54 -0.34 0.00 0.00 178.44 178.25 1zbx s ASN 80 N -3.69 4.57 0.00 1.25 2.20 -1.26 -5.03 114.94 112.99 1zbx s ASN 80 Ca -0.00 -0.81 0.00 0.00 -0.94 0.00 0.00 52.86 51.10 1zbx s ASN 80 Cb 0.00 -0.69 0.00 0.00 -2.00 0.00 0.00 41.25 38.56 1zbx s ASN 80 CO 0.01 -0.28 0.96 0.59 -2.94 0.00 0.00 177.10 175.44 1zbx n ASN 81 N -1.10 2.76 -4.70 3.54 3.02 -1.26 -4.03 115.26 113.49 1zbx n ASN 81 Ca -0.03 -1.69 -0.42 0.00 -0.03 0.00 0.00 54.58 52.40 1zbx n ASN 81 Cb 0.61 -0.50 -0.03 0.00 -0.61 0.00 0.00 39.78 39.26 1zbx n ASN 81 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1zbx s VAL 82 N 0.26 4.21 0.07 2.41 1.01 -1.26 -4.94 120.40 122.16 1zbx s VAL 82 Ca 0.00 1.56 0.09 0.00 0.00 0.00 0.00 61.98 63.63 1zbx s VAL 82 Cb 0.00 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 1zbx s VAL 82 CO 0.00 0.04 -0.22 -0.69 0.00 0.00 0.00 175.10 174.23 1zbx s VAL 83 N 1.81 2.50 -0.10 2.92 1.01 -1.26 -2.79 120.40 124.49 1zbx s VAL 83 Ca 0.57 -1.42 0.00 0.00 0.00 0.00 0.00 61.98 61.13 1zbx s VAL 83 Cb -0.26 -2.06 0.02 0.00 0.00 0.00 0.00 36.38 34.08 1zbx s VAL 83 CO 0.25 0.25 -0.08 -1.61 0.00 0.00 0.00 175.10 173.91 1zbx s GLU 84 N -1.63 1.47 -0.31 2.72 2.02 -0.72 -5.04 118.70 117.21 1zbx s GLU 84 Ca 0.14 -0.26 -0.11 0.00 0.02 0.00 0.00 54.97 54.76 1zbx s GLU 84 Cb -0.10 -1.47 -0.02 0.00 0.10 0.00 0.00 34.13 32.64 1zbx s GLU 84 CO 0.05 -0.19 0.20 -1.17 0.02 0.00 0.00 175.26 174.17 1zbx s LEU 85 N 1.44 4.24 0.02 1.80 2.96 -1.26 -2.15 118.68 125.73 1zbx s LEU 85 Ca -0.00 -0.34 0.06 0.00 -0.22 0.00 0.00 54.13 53.62 1zbx s LEU 85 Cb -0.13 -2.09 -0.03 0.00 0.50 0.00 0.00 46.19 44.44 1zbx s LEU 85 CO -0.05 -0.17 -0.15 0.26 -1.32 0.00 0.00 176.35 174.92 1zbx s TRP 86 N 1.70 2.65 0.12 5.38 0.52 -0.83 0.72 118.94 129.21 1zbx s TRP 86 Ca 0.06 -0.19 -0.18 0.00 0.02 0.00 0.00 56.10 55.80 1zbx s TRP 86 Cb -0.17 -1.52 0.05 0.00 -1.15 0.00 0.00 33.47 30.68 1zbx s TRP 86 CO 0.09 0.27 0.46 0.00 0.02 0.00 0.00 176.95 177.79 1zbx s ALA 87 N -0.91 -1.13 0.29 0.98 0.00 -0.40 -0.33 121.76 120.26 1zbx s ALA 87 Ca 0.15 0.15 -0.28 0.00 0.00 0.00 0.00 51.96 51.98 1zbx s ALA 87 Cb -0.11 0.70 -0.09 0.00 0.00 0.00 0.00 23.12 23.62 1zbx s ALA 87 CO 0.05 -0.66 0.96 -0.51 0.00 0.00 0.00 175.76 175.61 1zbx s LEU 88 N -2.69 4.46 -0.11 0.00 1.43 0.14 -0.90 118.68 121.00 1zbx s LEU 88 Ca 0.01 1.92 -0.13 0.00 -1.03 0.00 0.00 54.13 54.91 1zbx s LEU 88 Cb 0.01 -3.85 -0.05 0.00 0.03 0.00 0.00 46.19 42.33 1zbx s LEU 88 CO -0.11 -0.02 0.31 -0.89 0.23 0.00 0.00 176.35 175.87 1zbx s THR 89 N -1.43 5.26 0.28 5.49 2.01 -0.53 -1.06 115.64 125.65 1zbx s THR 89 Ca 0.47 0.59 0.04 0.00 0.31 0.00 0.00 61.69 63.10 1zbx s THR 89 Cb -0.23 -3.62 -0.03 0.00 0.01 0.00 0.00 72.50 68.63 1zbx s THR 89 CO 0.28 0.48 0.42 -0.31 -0.69 0.00 0.00 174.62 174.80 1zbx s TYR 90 N -0.21 3.44 -0.03 4.92 1.51 -0.64 -2.52 117.35 123.81 1zbx s TYR 90 Ca 0.19 0.06 0.02 0.00 -1.01 0.00 0.00 57.07 56.33 1zbx s TYR 90 Cb -0.14 -1.69 -0.03 0.00 -0.11 0.00 0.00 41.96 39.99 1zbx s TYR 90 CO 0.07 0.32 -0.08 -0.51 -1.11 0.00 0.00 175.55 174.24 1zbx s LEU 91 N -4.08 3.10 0.33 -1.29 1.43 0.29 -4.65 118.68 113.80 1zbx s LEU 91 Ca 0.36 -0.11 0.03 0.00 -1.03 0.00 0.00 54.13 53.38 1zbx s LEU 91 Cb -0.09 -1.72 -0.02 0.00 0.03 0.00 0.00 46.19 44.38 1zbx s LEU 91 CO 0.31 0.32 0.50 -0.13 0.23 0.00 0.00 176.35 177.58 1zbx s ARG 92 N -1.10 3.36 0.24 1.70 0.52 -1.26 -1.29 118.95 121.13 1zbx s ARG 92 Ca 0.14 -0.57 -0.07 0.00 -0.52 0.00 0.00 55.73 54.71 1zbx s ARG 92 Cb -0.11 -2.73 0.39 0.00 0.52 0.00 0.00 34.95 33.02 1zbx s ARG 92 CO 0.04 0.16 1.37 -2.67 0.02 0.00 0.00 175.30 174.22 1zbx n TRP 93 N -1.70 0.30 0.53 -0.53 4.27 -1.26 -0.67 117.44 118.38 1zbx n TRP 93 Ca -0.05 1.07 0.05 0.00 -3.89 0.00 0.00 57.50 54.68 1zbx n TRP 93 Cb 0.57 -1.00 0.26 0.00 -1.36 0.00 0.00 31.31 29.78 1zbx n TRP 93 CO 0.00 0.00 0.00 1.97 -2.29 0.00 0.00 177.69 177.37 1zbx n PHE 94 N -5.42 0.00 0.20 -2.67 1.16 -1.26 -1.82 117.46 107.65 1zbx n PHE 94 Ca 0.14 0.00 0.08 0.00 -1.87 0.00 0.00 57.45 55.80 1zbx n PHE 94 Cb 0.43 -0.09 0.16 0.00 -1.61 0.00 0.00 39.48 38.37 1zbx n PHE 94 CO 0.00 0.00 0.00 0.39 -1.87 0.00 0.00 176.76 175.28 1zbx n GLU 95 N -1.09 2.11 -2.96 3.97 1.02 0.15 -4.95 120.64 118.89 1zbx n GLU 95 Ca 0.06 -1.94 -0.38 0.00 -0.02 0.00 0.00 57.16 54.88 1zbx n GLU 95 Cb 0.04 -1.37 -0.06 0.00 -0.02 0.00 0.00 31.44 30.03 1zbx n GLU 95 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1zbx s VAL 96 N -1.20 4.37 -0.30 2.62 1.01 -0.75 -4.20 120.40 121.95 1zbx s VAL 96 Ca 0.28 1.64 -0.29 0.00 0.00 0.00 0.00 61.98 63.61 1zbx s VAL 96 Cb 0.16 -4.06 -0.01 0.00 0.00 0.00 0.00 36.38 32.48 1zbx s VAL 96 CO 0.23 0.37 1.47 0.21 0.00 0.00 0.00 175.10 177.38 1zbx s ASN 97 N -1.37 6.43 0.28 3.32 3.84 -0.73 -4.89 114.94 121.82 1zbx s ASN 97 Ca 0.41 1.26 -0.02 0.00 0.21 0.00 0.00 52.86 54.72 1zbx s ASN 97 Cb -0.21 -2.54 0.44 0.00 -0.55 0.00 0.00 41.25 38.40 1zbx s ASN 97 CO 0.25 -1.28 1.92 1.55 -2.79 0.00 0.00 177.10 176.75 1zbx h PRO 98 N 10.41 1.11 0.01 0.43 0.13 -1.91 -1.01 132.00 141.16 1zbx h PRO 98 Ca -0.30 -0.07 -0.23 0.00 -0.87 0.00 0.00 66.00 64.54 1zbx h PRO 98 Cb 1.12 -0.25 0.00 0.00 0.13 0.00 0.00 31.00 32.01 1zbx h PRO 98 CO 1.03 0.73 -0.96 -0.07 -0.23 0.00 0.00 178.00 178.50 1zbx h LEU 99 N 1.14 0.50 -0.01 1.56 3.38 -1.91 -2.64 115.31 117.34 1zbx h LEU 99 Ca 0.38 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1zbx h LEU 99 Cb 0.06 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1zbx h LEU 99 CO -0.12 1.22 0.00 0.00 0.09 0.00 0.00 178.44 179.63 1zbx h ALA 100 N 0.74 0.01 -0.18 1.53 0.00 -1.79 -1.67 119.26 117.90 1zbx h ALA 100 Ca -0.08 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.77 1zbx h ALA 100 Cb 1.61 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.35 1zbx h ALA 100 CO 0.16 -0.39 -0.12 1.25 0.00 0.00 0.00 179.25 180.15 1zbx h HIS 101 N -0.19 -0.30 -0.60 0.00 -0.00 -1.25 -0.55 115.15 112.25 1zbx h HIS 101 Ca 0.00 0.02 0.05 0.00 -0.00 0.00 0.00 60.37 60.45 1zbx h HIS 101 Cb 0.20 0.16 -0.05 0.00 -0.00 0.00 0.00 27.41 27.73 1zbx h HIS 101 CO -0.01 -0.19 0.32 -0.92 -0.00 0.00 0.00 177.93 177.14 1zbx h TYR 102 N -0.12 0.58 0.00 5.26 3.20 -1.41 0.54 116.97 125.02 1zbx h TYR 102 Ca 0.11 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.97 1zbx h TYR 102 Cb 0.28 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.37 1zbx h TYR 102 CO -0.27 0.28 -0.14 0.00 -1.64 0.00 0.00 178.16 176.39 1zbx h ARG 103 N 0.60 0.00 0.00 1.82 2.47 -0.61 -1.05 114.38 117.60 1zbx h ARG 103 Ca 0.27 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.99 1zbx h ARG 103 Cb 0.17 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.49 1zbx h ARG 103 CO -0.18 0.14 -1.65 0.94 0.56 0.00 0.00 179.97 179.78 1zbx n GLN 104 N -3.49 0.59 0.00 0.04 7.27 -0.28 -4.67 117.38 116.84 1zbx n GLN 104 Ca -0.01 -0.13 0.00 0.00 0.07 0.00 0.00 57.00 56.93 1zbx n GLN 104 Cb 0.30 -1.46 0.00 0.00 2.41 0.00 0.00 30.24 31.48 1zbx n GLN 104 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 1zbx n PHE 105 N -2.00 0.00 -2.58 3.69 0.99 0.10 -5.03 117.46 112.64 1zbx n PHE 105 Ca -0.02 0.00 -0.39 0.00 -0.00 0.00 0.00 57.45 57.04 1zbx n PHE 105 Cb 0.47 0.00 -0.05 0.00 -1.00 0.00 0.00 39.48 38.90 1zbx n PHE 105 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.76 177.97 1zbx s ASN 106 N -2.00 7.30 0.15 4.37 3.84 -0.40 -4.97 114.94 123.22 1zbx s ASN 106 Ca 0.00 2.13 -0.14 0.00 0.21 0.00 0.00 52.86 55.05 1zbx s ASN 106 Cb 0.00 -2.61 0.02 0.00 -0.55 0.00 0.00 41.25 38.11 1zbx s ASN 106 CO 0.00 -0.11 1.68 1.55 -2.79 0.00 0.00 177.10 177.44 1zbx h PRO 107 N 3.67 0.72 -2.33 0.43 0.13 -1.96 -3.29 132.00 129.37 1zbx h PRO 107 Ca -0.46 -0.14 -0.68 0.00 -0.87 0.00 0.00 66.00 63.85 1zbx h PRO 107 Cb 1.21 -0.11 -0.36 0.00 0.13 0.00 0.00 31.00 31.86 1zbx h PRO 107 CO 0.66 0.67 -0.01 -0.25 -0.23 0.00 0.00 178.00 178.84 1zbx n ASP 108 N -4.55 5.37 0.17 1.44 8.00 -1.26 -4.85 116.55 120.87 1zbx n ASP 108 Ca 0.01 -3.62 0.13 0.00 0.71 0.00 0.00 54.79 52.03 1zbx n ASP 108 Cb 0.17 -0.83 0.49 0.00 -0.02 0.00 0.00 41.12 40.94 1zbx n ASP 108 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1zbx h ALA 109 N 3.81 1.00 -0.04 2.24 0.00 -1.84 -3.25 119.26 121.18 1zbx h ALA 109 Ca 0.26 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.18 1zbx h ALA 109 Cb 0.49 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1zbx h ALA 109 CO 0.98 0.00 0.05 -0.91 0.00 0.00 0.00 179.25 179.37 1zbx h ASN 110 N 0.00 0.00 -3.72 0.00 2.35 -1.92 -3.39 115.58 108.89 1zbx h ASN 110 Ca 0.00 0.00 -0.67 0.00 -0.55 0.00 0.00 56.30 55.08 1zbx h ASN 110 Cb 0.52 0.00 -0.18 0.00 0.05 0.00 0.00 38.32 38.70 1zbx h ASN 110 CO 0.00 0.00 -0.45 -0.63 -1.65 0.00 0.00 177.43 174.70 1zbx s ILE 111 N -4.63 5.27 -0.53 2.81 -1.09 -1.23 -4.96 121.20 116.85 1zbx s ILE 111 Ca -0.05 -0.14 0.07 0.00 -2.23 0.00 0.00 60.65 58.30 1zbx s ILE 111 Cb 0.15 -3.72 0.35 0.00 -1.58 0.00 0.00 42.46 37.66 1zbx s ILE 111 CO 0.54 -0.00 0.90 0.18 -1.23 0.00 0.00 174.94 175.34 1zbx n LEU 112 N 5.15 3.62 -0.09 2.97 4.77 -1.26 -4.93 117.00 127.23 1zbx n LEU 112 Ca -0.12 -5.51 -0.10 0.00 -0.03 0.00 0.00 56.01 50.25 1zbx n LEU 112 Cb 0.50 -0.25 -0.03 0.00 -2.33 0.00 0.00 43.42 41.30 1zbx n LEU 112 CO 0.37 2.33 0.83 0.78 -1.33 0.00 0.00 177.39 180.38 1zbx h ASN 113 N 2.98 0.41 -4.26 -1.43 2.35 -1.97 -3.47 115.58 110.19 1zbx h ASN 113 Ca 0.13 -0.23 -0.51 0.00 -0.55 0.00 0.00 56.30 55.14 1zbx h ASN 113 Cb 0.62 -0.11 0.09 0.00 0.05 0.00 0.00 38.32 38.98 1zbx h ASN 113 CO 0.74 0.53 0.36 -0.13 -1.65 0.00 0.00 177.43 177.28 1zbx s ARG 114 N -5.31 2.89 0.49 0.81 0.52 -1.26 -5.04 118.95 112.06 1zbx s ARG 114 Ca -0.14 1.18 -0.22 0.00 -0.52 0.00 0.00 55.73 56.03 1zbx s ARG 114 Cb 0.08 -1.98 -0.07 0.00 0.52 0.00 0.00 34.95 33.51 1zbx s ARG 114 CO 0.73 -1.15 1.21 -1.25 0.02 0.00 0.00 175.30 174.87 1zbx s PRO 115 N -4.49 3.57 0.38 3.54 0.04 -1.26 -4.90 135.00 131.87 1zbx s PRO 115 Ca 0.62 1.88 0.23 0.00 0.04 0.00 0.00 61.00 63.78 1zbx s PRO 115 Cb -0.17 -2.34 1.37 0.00 0.04 0.00 0.00 34.50 33.40 1zbx s PRO 115 CO 0.46 -0.74 1.57 -0.11 0.04 0.00 0.00 177.00 178.22 1zbx n LEU 116 N -0.68 0.32 0.16 -3.56 7.94 -1.26 -0.07 117.00 119.85 1zbx n LEU 116 Ca 0.08 1.60 0.06 0.00 -1.11 0.00 0.00 56.01 56.64 1zbx n LEU 116 Cb 0.47 -0.78 0.54 0.00 0.53 0.00 0.00 43.42 44.19 1zbx n LEU 116 CO 0.49 -1.78 1.08 -0.55 -1.11 0.00 0.00 177.39 175.51 1zbx h ASN 117 N 0.00 0.17 -0.60 1.96 -1.07 -2.00 -1.97 115.58 112.07 1zbx h ASN 117 Ca 0.85 -0.01 -0.09 0.00 0.07 0.00 0.00 56.30 57.12 1zbx h ASN 117 Cb 2.35 -0.04 -0.02 0.00 -2.07 0.00 0.00 38.32 38.53 1zbx h ASN 117 CO -0.71 0.15 0.03 0.22 0.07 0.00 0.00 177.43 177.19 1zbx h TYR 118 N 0.20 1.14 0.00 4.14 3.20 -0.83 -1.59 116.97 123.23 1zbx h TYR 118 Ca 0.05 -0.18 -0.14 0.00 3.14 0.00 0.00 58.73 61.60 1zbx h TYR 118 Cb 0.03 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 37.97 1zbx h TYR 118 CO 0.00 0.99 -0.67 1.88 -1.64 0.00 0.00 178.16 178.73 1zbx h TYR 119 N 0.97 0.00 -0.43 -3.82 -1.99 -1.49 -0.95 116.97 109.27 1zbx h TYR 119 Ca 0.18 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.86 1zbx h TYR 119 Cb 0.52 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.24 1zbx h TYR 119 CO 0.04 0.67 0.06 -0.91 -0.00 0.00 0.00 178.16 178.01 1zbx h ASN 120 N 0.00 0.69 -0.18 3.88 2.35 -1.05 -2.42 115.58 118.85 1zbx h ASN 120 Ca -0.01 -0.27 -0.05 0.00 -0.55 0.00 0.00 56.30 55.42 1zbx h ASN 120 Cb 1.32 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 39.50 1zbx h ASN 120 CO 0.09 0.78 -0.10 0.50 -1.65 0.00 0.00 177.43 177.05 1zbx h LYS 121 N 0.57 0.39 0.25 0.81 3.64 -1.16 -1.73 116.57 119.33 1zbx h LYS 121 Ca 0.13 -0.17 0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1zbx h LYS 121 Cb 0.39 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.17 1zbx h LYS 121 CO 0.01 0.70 -0.38 1.25 -2.27 0.00 0.00 179.45 178.76 1zbx h LEU 122 N 0.07 -1.08 -0.14 5.20 5.85 -1.16 -0.18 115.31 123.85 1zbx h LEU 122 Ca 0.04 0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.88 1zbx h LEU 122 Cb 0.59 0.39 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 1zbx h LEU 122 CO 0.03 -0.49 0.03 0.15 -0.34 0.00 0.00 178.44 177.82 1zbx h PHE 123 N -0.70 0.06 -0.34 1.25 3.57 -1.48 -2.41 116.94 116.89 1zbx h PHE 123 Ca -0.00 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 1zbx h PHE 123 Cb 0.67 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.39 1zbx h PHE 123 CO -0.28 0.03 0.14 1.03 -2.23 0.00 0.00 178.31 177.00 1zbx h SER 124 N 0.10 0.43 -0.01 0.41 0.87 -1.17 0.01 113.55 114.18 1zbx h SER 124 Ca 0.06 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1zbx h SER 124 Cb 0.05 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 1zbx h SER 124 CO -0.08 0.39 -0.00 -0.62 -0.53 0.00 0.00 176.83 175.99 1zbx n GLU 125 N -4.40 1.73 0.00 2.24 1.02 -0.09 -4.11 120.64 117.02 1zbx n GLU 125 Ca 0.02 -1.06 0.00 0.00 -0.02 0.00 0.00 57.16 56.09 1zbx n GLU 125 Cb 0.13 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 1zbx n GLU 125 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1zbx n THR 126 N 0.29 0.00 -2.93 2.62 -2.24 -0.93 -5.06 114.28 106.03 1zbx n THR 126 Ca 0.18 -0.28 -0.32 0.00 -2.27 0.00 0.00 64.05 61.36 1zbx n THR 126 Cb 0.38 1.16 -0.06 0.00 -2.10 0.00 0.00 70.33 69.71 1zbx n THR 126 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1zbx s ALA 127 N -0.36 3.21 -0.65 6.98 0.00 -0.04 -4.98 121.76 125.91 1zbx s ALA 127 Ca 0.00 0.14 -0.26 0.00 0.00 0.00 0.00 51.96 51.85 1zbx s ALA 127 Cb 0.00 -2.92 0.04 0.00 0.00 0.00 0.00 23.12 20.24 1zbx s ALA 127 CO 0.00 0.17 1.13 1.21 0.00 0.00 0.00 175.76 178.27 1zbx s ASN 128 N -2.43 6.26 0.00 0.00 3.84 -1.26 -4.86 114.94 116.49 1zbx s ASN 128 Ca 0.57 -0.43 0.02 0.00 0.21 0.00 0.00 52.86 53.23 1zbx s ASN 128 Cb -0.10 -2.51 0.12 0.00 -0.55 0.00 0.00 41.25 38.21 1zbx s ASN 128 CO 0.19 -1.57 0.58 0.29 -2.79 0.00 0.00 177.10 173.80 1zbx n LYS 129 N 8.48 0.06 -0.09 0.43 5.02 -1.26 -0.44 118.16 130.37 1zbx n LYS 129 Ca 0.03 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.35 1zbx n LYS 129 Cb 0.48 -1.48 0.08 0.00 -0.02 0.00 0.00 35.03 34.09 1zbx n LYS 129 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1zbx n ASN 130 N -0.98 2.43 -4.64 4.39 4.13 -1.26 -4.72 115.26 114.61 1zbx n ASN 130 Ca 0.01 -2.13 -0.39 0.00 1.68 0.00 0.00 54.58 53.75 1zbx n ASN 130 Cb 0.01 -0.14 -0.07 0.00 -1.54 0.00 0.00 39.78 38.04 1zbx n ASN 130 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1zbx s GLU 131 N -1.23 4.13 0.51 3.52 2.12 0.41 -2.05 118.70 126.11 1zbx s GLU 131 Ca 0.12 0.36 0.07 0.00 0.36 0.00 0.00 54.97 55.89 1zbx s GLU 131 Cb 0.08 -3.60 0.05 0.00 0.26 0.00 0.00 34.13 30.92 1zbx s GLU 131 CO 0.06 -0.24 0.70 -0.51 -0.54 0.00 0.00 175.26 174.74 1zbx s LEU 132 N 1.93 3.37 -0.09 2.70 1.43 0.10 -4.02 118.68 124.11 1zbx s LEU 132 Ca 0.22 -0.52 -0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1zbx s LEU 132 Cb -0.15 -2.27 0.03 0.00 0.03 0.00 0.00 46.19 43.82 1zbx s LEU 132 CO 0.09 -1.09 -0.02 -0.31 0.23 0.00 0.00 176.35 175.25 1zbx s TYR 133 N -2.57 0.93 0.62 0.29 1.51 -0.41 -4.37 117.35 113.34 1zbx s TYR 133 Ca 0.59 -0.37 -0.17 0.00 -1.01 0.00 0.00 57.07 56.11 1zbx s TYR 133 Cb -0.08 -0.94 -0.02 0.00 -0.11 0.00 0.00 41.96 40.81 1zbx s TYR 133 CO 0.37 -0.40 1.12 -1.17 -1.11 0.00 0.00 175.55 174.36 1zbx s LEU 134 N 1.89 3.52 0.09 -1.29 2.96 -0.77 -0.55 118.68 124.53 1zbx s LEU 134 Ca 0.05 2.07 -0.08 0.00 -0.22 0.00 0.00 54.13 55.95 1zbx s LEU 134 Cb -0.13 -4.56 -0.01 0.00 0.50 0.00 0.00 46.19 42.00 1zbx s LEU 134 CO -0.06 -1.48 0.17 0.42 -1.32 0.00 0.00 176.35 174.07 1zbx s THR 135 N -2.13 0.15 -2.42 3.68 -4.23 -1.05 -0.42 115.64 109.23 1zbx s THR 135 Ca 0.69 -1.25 0.23 0.00 -1.18 0.00 0.00 61.69 60.18 1zbx s THR 135 Cb -0.22 -1.37 0.45 0.00 1.34 0.00 0.00 72.50 72.70 1zbx s THR 135 CO 0.36 -0.68 1.54 0.00 -0.54 0.00 0.00 174.62 175.30 1zbx n ALA 136 N -0.04 2.51 -2.25 3.99 0.00 -1.26 -4.09 120.51 119.37 1zbx n ALA 136 Ca -0.15 -0.60 -0.43 0.00 0.00 0.00 0.00 53.44 52.27 1zbx n ALA 136 Cb 0.62 -1.05 -0.02 0.00 0.00 0.00 0.00 19.45 19.00 1zbx n ALA 136 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1zbx s GLU 137 N -1.81 4.23 0.31 0.00 2.12 -1.26 -4.88 118.70 117.40 1zbx s GLU 137 Ca 0.34 1.90 -0.11 0.00 0.36 0.00 0.00 54.97 57.46 1zbx s GLU 137 Cb 0.19 -3.80 -0.07 0.00 0.26 0.00 0.00 34.13 30.71 1zbx s GLU 137 CO 0.29 -0.72 0.66 -0.51 -0.54 0.00 0.00 175.26 174.43 1zbx s LEU 138 N 3.45 4.05 -0.07 2.70 1.43 -1.26 -1.46 118.68 127.52 1zbx s LEU 138 Ca 0.63 1.05 -0.09 0.00 -1.03 0.00 0.00 54.13 54.70 1zbx s LEU 138 Cb -0.27 -3.86 0.02 0.00 0.03 0.00 0.00 46.19 42.10 1zbx s LEU 138 CO 0.22 -0.20 0.23 0.00 0.23 0.00 0.00 176.35 176.83 1zbx s ALA 139 N -2.03 -0.57 0.01 4.21 0.00 -0.08 -4.94 121.76 118.36 1zbx s ALA 139 Ca 0.50 0.53 -0.22 0.00 0.00 0.00 0.00 51.96 52.77 1zbx s ALA 139 Cb -0.11 -0.28 -0.05 0.00 0.00 0.00 0.00 23.12 22.68 1zbx s ALA 139 CO 0.23 -0.14 0.66 -2.00 0.00 0.00 0.00 175.76 174.52 1zbx s GLU 140 N -0.19 4.39 0.04 0.00 2.12 -1.26 -1.28 118.70 122.52 1zbx s GLU 140 Ca -0.03 0.86 0.02 0.00 0.36 0.00 0.00 54.97 56.18 1zbx s GLU 140 Cb -0.03 -3.36 -0.04 0.00 0.26 0.00 0.00 34.13 30.97 1zbx s GLU 140 CO 0.01 0.31 0.06 -0.51 -0.54 0.00 0.00 175.26 174.59 1zbx s LEU 141 N -0.07 3.75 -0.17 2.70 1.43 0.22 -4.98 118.68 121.56 1zbx s LEU 141 Ca 0.34 0.02 -0.04 0.00 -1.03 0.00 0.00 54.13 53.43 1zbx s LEU 141 Cb -0.19 -2.31 -0.02 0.00 0.03 0.00 0.00 46.19 43.70 1zbx s LEU 141 CO 0.19 0.22 -0.04 -1.58 0.23 0.00 0.00 176.35 175.37 1zbx s GLN 142 N -2.04 3.59 0.40 1.70 2.00 -1.26 -4.11 119.66 119.94 1zbx s GLN 142 Ca 0.25 -0.55 0.13 0.00 -2.00 0.00 0.00 55.36 53.19 1zbx s GLN 142 Cb -0.12 -2.93 0.97 0.00 0.80 0.00 0.00 33.01 31.73 1zbx s GLN 142 CO 0.17 0.13 1.91 -0.07 -0.50 0.00 0.00 175.29 176.93 1zbx h LEU 143 N 7.06 0.48 -0.53 3.68 3.38 -1.99 -1.39 115.31 126.00 1zbx h LEU 143 Ca -0.33 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1zbx h LEU 143 Cb 1.19 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1zbx h LEU 143 CO 0.61 0.25 0.00 2.22 0.09 0.00 0.00 178.44 181.61 1zbx n PHE 144 N -4.50 0.34 0.87 1.13 1.16 -1.26 -0.14 117.46 115.07 1zbx n PHE 144 Ca 0.15 0.16 0.12 0.00 -1.87 0.00 0.00 57.45 56.01 1zbx n PHE 144 Cb 0.49 -0.76 0.24 0.00 -1.61 0.00 0.00 39.48 37.84 1zbx n PHE 144 CO 0.00 0.00 0.00 0.09 -1.87 0.00 0.00 176.76 174.98 1zbx n ASN 145 N -1.84 2.76 -4.68 5.98 3.02 -0.52 -4.92 115.26 115.06 1zbx n ASN 145 Ca 0.01 -1.89 -0.42 0.00 -0.03 0.00 0.00 54.58 52.24 1zbx n ASN 145 Cb 0.08 -0.10 -0.03 0.00 -0.61 0.00 0.00 39.78 39.12 1zbx n ASN 145 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1zbx s PHE 146 N -1.80 2.75 -0.13 3.10 5.36 0.80 0.25 117.98 128.31 1zbx s PHE 146 Ca 0.34 0.81 -0.12 0.00 -0.96 0.00 0.00 56.93 57.00 1zbx s PHE 146 Cb 0.21 -3.64 -0.04 0.00 -0.34 0.00 0.00 43.02 39.21 1zbx s PHE 146 CO 0.31 -2.37 -0.23 -0.89 -1.46 0.00 0.00 175.22 170.58 1zbx n ILE 147 N 4.94 1.09 -3.64 3.12 5.41 -0.44 -4.91 119.36 124.93 1zbx n ILE 147 Ca 0.14 0.25 -0.08 0.00 1.00 0.00 0.00 62.75 64.05 1zbx n ILE 147 Cb 0.44 -2.13 -0.02 0.00 -0.71 0.00 0.00 39.64 37.22 1zbx n ILE 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1zbx s ARG 148 N -2.30 1.41 0.20 0.38 1.70 -1.15 -5.02 118.95 114.17 1zbx s ARG 148 Ca -0.19 -0.67 -0.30 0.00 -0.47 0.00 0.00 55.73 54.10 1zbx s ARG 148 Cb 0.03 0.55 -0.09 0.00 -0.57 0.00 0.00 34.95 34.87 1zbx s ARG 148 CO 0.28 -0.63 1.26 0.08 -1.08 0.00 0.00 175.30 175.21 1zbx s VAL 149 N -3.67 3.35 -0.08 4.99 1.01 -1.26 -0.52 120.40 124.21 1zbx s VAL 149 Ca 0.07 1.13 -0.09 0.00 0.00 0.00 0.00 61.98 63.10 1zbx s VAL 149 Cb -0.03 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1zbx s VAL 149 CO -0.03 0.18 0.21 0.00 0.00 0.00 0.00 175.10 175.47 1zbx s ALA 150 N -0.06 3.84 -0.53 5.51 0.00 0.17 -4.74 121.76 125.95 1zbx s ALA 150 Ca 0.54 -0.54 -0.14 0.00 0.00 0.00 0.00 51.96 51.82 1zbx s ALA 150 Cb -0.35 -2.07 0.13 0.00 0.00 0.00 0.00 23.12 20.83 1zbx s ALA 150 CO 0.38 0.59 0.47 -0.80 0.00 0.00 0.00 175.76 176.41 1zbx s ASN 151 N -1.10 6.08 -0.30 0.00 0.01 0.36 -4.14 114.94 115.85 1zbx s ASN 151 Ca 0.18 -1.86 -0.11 0.00 -0.71 0.00 0.00 52.86 50.36 1zbx s ASN 151 Cb -0.13 -2.16 -0.03 0.00 0.41 0.00 0.00 41.25 39.33 1zbx s ASN 151 CO 0.07 -0.81 0.19 -0.69 -1.51 0.00 0.00 177.10 174.36 1zbx s VAL 152 N 1.49 5.16 0.27 1.60 1.01 -1.26 0.50 120.40 129.17 1zbx s VAL 152 Ca 0.04 -0.02 0.03 0.00 0.00 0.00 0.00 61.98 62.03 1zbx s VAL 152 Cb -0.28 -3.53 -0.06 0.00 0.00 0.00 0.00 36.38 32.51 1zbx s VAL 152 CO 0.02 0.16 0.04 0.00 0.00 0.00 0.00 175.10 175.32 1zbx s MET 153 N 1.72 1.47 0.54 2.72 0.23 0.11 -4.94 119.30 121.15 1zbx s MET 153 Ca 0.06 -1.78 -0.17 0.00 -1.03 0.00 0.00 55.69 52.77 1zbx s MET 153 Cb -0.16 -0.65 -0.06 0.00 -1.53 0.00 0.00 34.83 32.42 1zbx s MET 153 CO 0.10 -0.16 1.03 0.34 -2.03 0.00 0.00 175.02 174.30 1zbx s ASP 154 N -3.37 6.16 0.42 -1.18 2.15 -1.26 -1.43 116.67 118.16 1zbx s ASP 154 Ca 0.33 1.80 0.16 0.00 0.43 0.00 0.00 52.55 55.27 1zbx s ASP 154 Cb 0.07 -2.54 1.05 0.00 -0.30 0.00 0.00 42.92 41.20 1zbx s ASP 154 CO 0.12 -0.91 1.90 1.23 -0.17 0.00 0.00 175.17 177.34 1zbx h GLY 155 N 0.93 0.77 0.89 2.66 0.00 -1.97 0.04 103.07 106.39 1zbx h GLY 155 Ca -0.48 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 46.66 1zbx h GLY 155 CO 0.59 0.05 0.07 1.76 0.00 0.00 0.00 176.54 179.00 1zbx h SER 156 N 0.43 0.21 -0.20 0.19 0.02 -1.99 -0.78 113.55 111.42 1zbx h SER 156 Ca 0.40 -0.15 -0.11 0.00 -0.84 0.00 0.00 61.79 61.09 1zbx h SER 156 Cb 0.93 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.40 1zbx h SER 156 CO -0.14 0.30 -0.24 0.50 -1.14 0.00 0.00 176.83 176.11 1zbx h LYS 157 N 0.10 0.66 -0.72 3.45 3.64 -1.74 -2.59 116.57 119.38 1zbx h LYS 157 Ca 0.05 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1zbx h LYS 157 Cb 0.15 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.91 1zbx h LYS 157 CO -0.01 0.84 0.47 2.35 -2.27 0.00 0.00 179.45 180.84 1zbx h TRP 158 N 0.58 0.91 -0.48 1.91 2.91 -0.65 -1.58 115.95 119.54 1zbx h TRP 158 Ca 0.08 0.02 -0.04 0.00 1.13 0.00 0.00 58.89 60.08 1zbx h TRP 158 Cb 0.72 -0.31 -0.02 0.00 -0.51 0.00 0.00 29.16 29.04 1zbx h TRP 158 CO 0.03 0.58 0.14 0.93 -1.03 0.00 0.00 178.44 179.09 1zbx h GLU 159 N 0.97 0.76 -0.07 2.65 4.39 -0.76 -2.55 114.58 119.97 1zbx h GLU 159 Ca 0.26 -0.17 -0.07 0.00 0.34 0.00 0.00 59.36 59.72 1zbx h GLU 159 Cb -0.10 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.43 1zbx h GLU 159 CO -0.06 0.72 -0.29 0.28 -1.16 0.00 0.00 179.01 178.50 1zbx h VAL 160 N 0.65 1.24 0.00 3.13 2.07 -1.26 -3.03 116.25 119.05 1zbx h VAL 160 Ca 0.16 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.54 1zbx h VAL 160 Cb 0.29 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1zbx h VAL 160 CO -0.00 0.33 0.00 0.25 0.02 0.00 0.00 177.57 178.17 1zbx h LEU 161 N 0.12 0.00 -9.62 2.57 5.85 -0.89 -3.47 115.31 109.87 1zbx h LEU 161 Ca 0.02 0.00 -0.56 0.00 0.84 0.00 0.00 57.88 58.18 1zbx h LEU 161 Cb 0.58 0.00 0.07 0.00 0.37 0.00 0.00 40.66 41.68 1zbx h LEU 161 CO 0.04 0.00 0.82 0.29 -0.34 0.00 0.00 178.44 179.25 1zbx n LYS 162 N -2.43 2.39 0.00 1.25 5.02 -1.09 -1.36 118.16 121.94 1zbx n LYS 162 Ca 0.03 0.86 0.00 0.00 -2.02 0.00 0.00 58.31 57.18 1zbx n LYS 162 Cb 0.34 -2.62 0.00 0.00 -0.02 0.00 0.00 35.03 32.73 1zbx n LYS 162 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1zbx n GLY 163 N 2.96 0.25 1.33 0.72 0.00 -1.26 -4.84 105.19 104.36 1zbx n GLY 163 Ca 0.14 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.18 1zbx n GLY 163 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1zbx n ASN 164 N 0.00 0.63 -4.70 1.61 3.02 -0.46 -5.09 115.26 110.28 1zbx n ASN 164 Ca 0.00 -1.99 -0.42 0.00 -0.03 0.00 0.00 54.58 52.15 1zbx n ASN 164 Cb 0.00 -0.21 -0.03 0.00 -0.61 0.00 0.00 39.78 38.93 1zbx n ASN 164 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1zbx s VAL 165 N 0.00 4.88 -0.72 2.41 1.01 -1.19 -5.01 120.40 121.79 1zbx s VAL 165 Ca 0.26 1.87 -0.12 0.00 0.00 0.00 0.00 61.98 63.99 1zbx s VAL 165 Cb 0.30 -4.24 0.19 0.00 0.00 0.00 0.00 36.38 32.63 1zbx s VAL 165 CO -0.13 0.11 0.64 -0.62 0.00 0.00 0.00 175.10 175.09 1zbx s ASP 166 N 1.02 6.36 0.03 3.32 3.68 -1.26 -4.93 116.67 124.90 1zbx s ASP 166 Ca 0.46 -2.48 0.01 0.00 2.13 0.00 0.00 52.55 52.67 1zbx s ASP 166 Cb -0.19 -2.15 0.06 0.00 -1.45 0.00 0.00 42.92 39.19 1zbx s ASP 166 CO 0.20 -0.61 0.81 -0.81 0.13 0.00 0.00 175.17 174.90 1zbx n PRO 167 N 4.23 0.01 0.12 4.34 -0.04 -1.26 -0.81 135.00 141.58 1zbx n PRO 167 Ca 0.06 0.30 0.05 0.00 -0.04 0.00 0.00 63.50 63.87 1zbx n PRO 167 Cb 0.44 -1.76 0.02 0.00 -0.04 0.00 0.00 33.50 32.16 1zbx n PRO 167 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1zbx h GLU 168 N 0.00 0.00 0.00 0.54 5.08 -2.02 -3.41 114.58 114.77 1zbx h GLU 168 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1zbx h GLU 168 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1zbx h GLU 168 CO 0.00 0.28 -0.01 2.89 -1.00 0.00 0.00 179.01 181.17 1zbx n ARG 169 N -3.03 1.16 -3.60 2.33 1.85 0.01 -4.98 116.66 110.39 1zbx n ARG 169 Ca -0.01 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.46 1zbx n ARG 169 Cb 0.70 -0.09 -0.10 0.00 -1.05 0.00 0.00 32.46 31.91 1zbx n ARG 169 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1zbx s ASP 170 N -0.14 6.06 0.10 2.89 -0.00 -0.23 0.14 116.67 125.49 1zbx s ASP 170 Ca 0.00 0.04 0.02 0.00 -0.00 0.00 0.00 52.55 52.61 1zbx s ASP 170 Cb 0.00 -2.12 -0.04 0.00 -0.00 0.00 0.00 42.92 40.76 1zbx s ASP 170 CO 0.00 -0.02 -0.07 -0.36 -0.00 0.00 0.00 175.17 174.72 1zbx s PHE 171 N 1.55 0.90 -0.00 4.23 0.40 0.18 -4.72 117.98 120.52 1zbx s PHE 171 Ca 0.07 -0.84 0.04 0.00 -0.60 0.00 0.00 56.93 55.60 1zbx s PHE 171 Cb -0.15 -0.52 -0.01 0.00 0.51 0.00 0.00 43.02 42.85 1zbx s PHE 171 CO 0.09 -0.12 -0.12 -0.08 0.70 0.00 0.00 175.22 175.70 1zbx s THR 172 N -3.28 0.93 -0.09 0.64 -1.32 -0.87 0.04 115.64 111.68 1zbx s THR 172 Ca 0.09 -0.57 0.01 0.00 -1.21 0.00 0.00 61.69 60.02 1zbx s THR 172 Cb 0.03 -0.79 0.02 0.00 -1.51 0.00 0.00 72.50 70.25 1zbx s THR 172 CO -0.04 0.21 -0.10 -0.69 -2.21 0.00 0.00 174.62 171.80 1zbx s VAL 173 N -0.36 1.07 0.00 5.08 1.01 -0.51 -0.72 120.40 125.97 1zbx s VAL 173 Ca 0.04 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.64 1zbx s VAL 173 Cb -0.05 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.30 1zbx s VAL 173 CO -0.00 0.36 0.00 -2.11 0.00 0.00 0.00 175.10 173.35 1zbx n ARG 174 N 4.39 4.80 -4.32 2.72 1.85 -1.26 -4.40 116.66 120.45 1zbx n ARG 174 Ca -0.18 0.00 -0.16 0.00 -1.00 0.00 0.00 57.85 56.51 1zbx n ARG 174 Cb 0.51 -0.58 -0.10 0.00 -1.05 0.00 0.00 32.46 31.23 1zbx n ARG 174 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 1zbx s TYR 175 N -1.14 1.52 0.09 2.89 1.51 -1.26 -1.88 117.35 119.08 1zbx s TYR 175 Ca 0.00 -1.13 0.06 0.00 -1.01 0.00 0.00 57.07 54.99 1zbx s TYR 175 Cb 0.00 -0.90 -0.03 0.00 -0.11 0.00 0.00 41.96 40.92 1zbx s TYR 175 CO 0.00 -0.28 -0.16 -1.50 -1.11 0.00 0.00 175.55 172.51 1zbx s ILE 176 N -3.69 1.27 0.31 2.71 2.07 -0.21 -1.85 121.20 121.81 1zbx s ILE 176 Ca 0.35 -1.42 -0.10 0.00 -1.41 0.00 0.00 60.65 58.07 1zbx s ILE 176 Cb 0.07 -1.24 0.04 0.00 0.13 0.00 0.00 42.46 41.47 1zbx s ILE 176 CO 0.12 -0.22 0.59 0.00 -1.91 0.00 0.00 174.94 173.52 1zbx s GLU 178 N -2.18 4.20 0.64 0.00 0.41 -0.51 -4.44 118.70 116.83 1zbx s GLU 178 Ca 0.15 1.33 0.23 0.00 -0.41 0.00 0.00 54.97 56.27 1zbx s GLU 178 Cb -0.03 -2.40 1.18 0.00 -1.78 0.00 0.00 34.13 31.10 1zbx s GLU 178 CO 0.11 -0.08 1.66 -1.35 -0.49 0.00 0.00 175.26 175.11 1zbx h PRO 179 N 2.28 0.00 -0.00 0.39 0.11 -1.95 0.50 132.00 133.33 1zbx h PRO 179 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1zbx h PRO 179 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1zbx h PRO 179 CO 0.62 0.00 -0.16 0.25 -0.21 0.00 0.00 178.00 178.49 1zbx n THR 180 N -3.06 0.00 -1.35 -1.15 -2.24 -1.26 -4.93 114.28 100.29 1zbx n THR 180 Ca 0.04 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1zbx n THR 180 Cb 0.71 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 1zbx n THR 180 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1zbx n GLY 181 N 1.47 0.90 3.22 3.38 0.00 0.17 -4.13 105.19 110.20 1zbx n GLY 181 Ca 0.08 -0.36 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 1zbx n GLY 181 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1zbx s GLU 182 N -2.63 1.25 -0.68 1.61 2.02 -1.24 -1.77 118.70 117.25 1zbx s GLU 182 Ca 0.00 -1.67 -0.04 0.00 0.02 0.00 0.00 54.97 53.29 1zbx s GLU 182 Cb 0.00 0.21 0.00 0.00 0.10 0.00 0.00 34.13 34.44 1zbx s GLU 182 CO 0.00 -0.39 0.67 1.63 0.02 0.00 0.00 175.26 177.19 1zbx n LYS 183 N -0.31 -1.55 -2.84 1.61 5.02 -1.26 -1.42 118.16 117.41 1zbx n LYS 183 Ca 0.02 1.58 -0.42 0.00 -2.02 0.00 0.00 58.31 57.47 1zbx n LYS 183 Cb 0.66 -5.49 -0.04 0.00 -0.02 0.00 0.00 35.03 30.15 1zbx n LYS 183 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1zbx s PHE 184 N -2.90 3.47 -0.05 2.13 0.40 -1.26 -4.19 117.98 115.58 1zbx s PHE 184 Ca 0.05 1.37 0.05 0.00 -0.60 0.00 0.00 56.93 57.81 1zbx s PHE 184 Cb -0.01 -3.05 -0.01 0.00 0.51 0.00 0.00 43.02 40.46 1zbx s PHE 184 CO 0.76 -0.20 -0.21 0.08 0.70 0.00 0.00 175.22 176.36 1zbx s VAL 185 N 1.95 1.73 0.45 -0.44 1.01 -0.62 -4.96 120.40 119.52 1zbx s VAL 185 Ca 0.42 -0.89 -0.24 0.00 0.00 0.00 0.00 61.98 61.27 1zbx s VAL 185 Cb -0.17 -1.47 -0.07 0.00 0.00 0.00 0.00 36.38 34.67 1zbx s VAL 185 CO 0.15 0.49 1.25 -1.81 0.00 0.00 0.00 175.10 175.18 1zbx s ASP 186 N -0.11 6.08 0.09 3.32 1.11 -1.26 -1.04 116.67 124.86 1zbx s ASP 186 Ca -0.02 2.52 -0.15 0.00 0.18 0.00 0.00 52.55 55.07 1zbx s ASP 186 Cb -0.12 -2.62 0.03 0.00 1.07 0.00 0.00 42.92 41.28 1zbx s ASP 186 CO 0.02 -1.00 0.37 0.27 1.18 0.00 0.00 175.17 176.01 1zbx s ILE 187 N -1.39 0.08 -0.67 0.77 -4.36 -0.78 -4.84 121.20 110.01 1zbx s ILE 187 Ca 0.62 -0.64 -0.08 0.00 -0.26 0.00 0.00 60.65 60.30 1zbx s ILE 187 Cb -0.34 -1.12 0.17 0.00 1.25 0.00 0.00 42.46 42.42 1zbx s ILE 187 CO 0.43 -0.35 0.53 0.20 0.24 0.00 0.00 174.94 175.99 1zbx s ASN 188 N -2.55 5.84 0.40 4.36 0.01 -1.26 -4.64 114.94 117.09 1zbx s ASN 188 Ca 0.00 -2.63 0.25 0.00 -0.71 0.00 0.00 52.86 49.78 1zbx s ASN 188 Cb 0.01 -2.00 1.35 0.00 0.41 0.00 0.00 41.25 41.02 1zbx s ASN 188 CO -0.09 -0.50 1.61 -0.29 -1.51 0.00 0.00 177.10 176.33 1zbx h ILE 189 N 5.27 0.11 -0.62 0.60 6.09 -1.93 0.98 117.51 128.00 1zbx h ILE 189 Ca -0.01 -0.03 -0.06 0.00 -1.37 0.00 0.00 64.86 63.39 1zbx h ILE 189 Cb 1.00 0.00 -0.03 0.00 0.47 0.00 0.00 36.82 38.27 1zbx h ILE 189 CO 0.75 0.02 0.16 -0.33 -3.07 0.00 0.00 178.15 175.68 1zbx h GLU 190 N 0.10 1.00 -0.21 2.19 4.39 -1.92 0.17 114.58 120.30 1zbx h GLU 190 Ca 0.82 -0.23 -0.08 0.00 0.34 0.00 0.00 59.36 60.20 1zbx h GLU 190 Cb 2.35 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 30.85 1zbx h GLU 190 CO -0.55 0.90 -0.23 -0.44 -1.16 0.00 0.00 179.01 177.53 1zbx h ASP 191 N 0.91 0.37 -0.12 1.42 3.45 0.51 -0.51 116.42 122.46 1zbx h ASP 191 Ca 0.20 -0.11 -0.06 0.00 0.43 0.00 0.00 57.03 57.48 1zbx h ASP 191 Cb 0.34 -0.10 -0.00 0.00 -0.56 0.00 0.00 39.33 39.01 1zbx h ASP 191 CO 0.00 0.61 -0.17 0.58 -1.57 0.00 0.00 179.24 178.69 1zbx h VAL 192 N 0.34 1.37 0.13 -1.35 2.07 -0.57 0.14 116.25 118.38 1zbx h VAL 192 Ca 0.06 -1.40 0.00 0.00 0.82 0.00 0.00 66.70 66.18 1zbx h VAL 192 Cb 0.59 2.01 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 1zbx h VAL 192 CO 0.04 0.40 -0.12 0.11 0.02 0.00 0.00 177.57 178.02 1zbx h LYS 193 N -0.09 -0.26 -0.50 1.57 1.57 -0.50 0.23 116.57 118.58 1zbx h LYS 193 Ca 0.01 0.02 0.08 0.00 -1.87 0.00 0.00 60.65 58.89 1zbx h LYS 193 Cb 0.73 0.06 -0.07 0.00 0.08 0.00 0.00 32.23 33.03 1zbx h LYS 193 CO 0.04 -0.18 0.13 0.00 -0.57 0.00 0.00 179.45 178.87 1zbx h ALA 194 N 0.58 0.58 0.26 3.86 0.00 -1.10 -2.29 119.26 121.15 1zbx h ALA 194 Ca 0.00 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1zbx h ALA 194 Cb 0.26 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1zbx h ALA 194 CO -0.03 -0.28 -0.13 -0.92 0.00 0.00 0.00 179.25 177.90 1zbx h TYR 195 N 0.28 -0.32 -1.00 0.00 3.20 -0.45 -2.99 116.97 115.69 1zbx h TYR 195 Ca 0.25 -0.01 0.18 0.00 3.14 0.00 0.00 58.73 62.29 1zbx h TYR 195 Cb 0.31 0.11 -0.10 0.00 1.54 0.00 0.00 36.73 38.59 1zbx h TYR 195 CO -0.20 -0.16 0.62 0.82 -1.64 0.00 0.00 178.16 177.59 1zbx h ILE 196 N -0.41 0.73 -0.25 1.81 1.08 -0.20 0.22 117.51 120.49 1zbx h ILE 196 Ca -0.04 -0.26 0.00 0.00 -0.39 0.00 0.00 64.86 64.17 1zbx h ILE 196 Cb 0.31 -0.10 0.00 0.00 -3.07 0.00 0.00 36.82 33.96 1zbx h ILE 196 CO 0.06 0.14 0.00 2.29 -0.69 0.00 0.00 178.15 179.95 1zbx n LYS 197 N -4.73 1.73 -0.02 2.37 2.85 -0.89 -4.24 118.16 115.24 1zbx n LYS 197 Ca 0.23 -0.97 -0.03 0.00 -1.05 0.00 0.00 58.31 56.49 1zbx n LYS 197 Cb 0.56 -1.30 -0.01 0.00 -0.65 0.00 0.00 35.03 33.63 1zbx n LYS 197 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 1zbx n LYS 198 N 0.26 0.16 0.00 -1.58 4.81 0.75 -5.07 118.16 117.49 1zbx n LYS 198 Ca 0.09 0.07 0.00 0.00 -0.87 0.00 0.00 58.31 57.59 1zbx n LYS 198 Cb 0.28 -0.69 0.00 0.00 0.02 0.00 0.00 35.03 34.64 1zbx n LYS 198 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 1zbx n VAL 199 N -3.33 0.00 -3.66 3.15 0.24 -0.94 -5.04 118.33 108.75 1zbx n VAL 199 Ca -0.04 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 61.89 1zbx n VAL 199 Cb 0.16 -1.33 -0.07 0.00 -1.47 0.00 0.00 33.84 31.13 1zbx n VAL 199 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1zbx s GLU 200 N -2.64 3.90 0.01 7.34 0.41 -1.26 -4.95 118.70 121.50 1zbx s GLU 200 Ca 0.00 0.08 -0.01 0.00 -0.41 0.00 0.00 54.97 54.63 1zbx s GLU 200 Cb 0.00 -3.29 -0.00 0.00 -1.78 0.00 0.00 34.13 29.05 1zbx s GLU 200 CO 0.00 0.54 0.35 -2.30 -0.49 0.00 0.00 175.26 173.36 1zbx n PRO 201 N 2.59 -0.02 -0.33 0.39 -0.02 -1.26 -0.25 135.00 136.10 1zbx n PRO 201 Ca -0.15 0.35 0.15 0.00 -2.02 0.00 0.00 63.50 61.82 1zbx n PRO 201 Cb 0.53 -0.52 0.37 0.00 -0.02 0.00 0.00 33.50 33.86 1zbx n PRO 201 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1zbx h ARG 202 N 0.00 0.66 0.58 -0.52 3.08 -1.96 -0.98 114.38 115.24 1zbx h ARG 202 Ca 0.01 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.99 1zbx h ARG 202 Cb 0.02 -0.15 0.01 0.00 0.08 0.00 0.00 29.97 29.92 1zbx h ARG 202 CO -0.04 0.43 -0.28 0.93 -1.07 0.00 0.00 179.97 179.95 1zbx h GLU 203 N 0.68 -0.75 -0.77 0.04 5.08 -1.02 -1.33 114.58 116.51 1zbx h GLU 203 Ca 0.55 0.05 0.06 0.00 -1.00 0.00 0.00 59.36 59.03 1zbx h GLU 203 Cb 0.98 0.17 -0.06 0.00 0.50 0.00 0.00 28.75 30.34 1zbx h GLU 203 CO -0.33 -0.46 0.46 0.00 -1.00 0.00 0.00 179.01 177.68 1zbx h ALA 204 N -0.51 1.06 -0.17 3.43 0.00 -0.96 -1.54 119.26 120.57 1zbx h ALA 204 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1zbx h ALA 204 Cb 0.63 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1zbx h ALA 204 CO 0.13 0.17 -0.34 0.37 0.00 0.00 0.00 179.25 179.59 1zbx h GLN 205 N 0.84 0.35 -0.22 0.00 -0.00 -1.15 -0.72 115.11 114.20 1zbx h GLN 205 Ca 0.34 -0.15 -0.07 0.00 -0.00 0.00 0.00 58.65 58.77 1zbx h GLN 205 Cb 0.18 -0.01 -0.01 0.00 0.00 0.00 0.00 27.48 27.65 1zbx h GLN 205 CO -0.18 0.65 -0.15 0.93 0.00 0.00 0.00 178.83 180.09 1zbx h GLU 206 N 0.30 0.49 -0.16 1.69 4.39 -0.59 -2.82 114.58 117.89 1zbx h GLU 206 Ca 0.04 -0.23 -0.02 0.00 0.34 0.00 0.00 59.36 59.49 1zbx h GLU 206 Cb 0.74 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.38 1zbx h GLU 206 CO 0.06 0.79 0.04 -0.92 -1.16 0.00 0.00 179.01 177.81 1zbx h TYR 207 N 0.19 0.27 -0.46 4.33 3.20 -1.17 -2.90 116.97 120.43 1zbx h TYR 207 Ca 0.05 -0.03 0.10 0.00 3.14 0.00 0.00 58.73 61.98 1zbx h TYR 207 Cb 0.66 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.83 1zbx h TYR 207 CO 0.07 0.41 0.32 -0.07 -1.64 0.00 0.00 178.16 177.24 1zbx h LEU 208 N 0.06 0.15 0.00 2.82 3.38 -1.17 -1.52 115.31 119.03 1zbx h LEU 208 Ca 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1zbx h LEU 208 Cb 0.27 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1zbx h LEU 208 CO 0.00 0.09 -0.13 0.50 0.09 0.00 0.00 178.44 178.99 1zbx h LYS 209 N 0.16 0.00 -0.13 1.13 3.64 -1.31 -3.30 116.57 116.78 1zbx h LYS 209 Ca 0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1zbx h LYS 209 Cb 0.64 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1zbx h LYS 209 CO -0.03 0.07 0.00 -0.25 -2.27 0.00 0.00 179.45 176.97 1zbx n ASP 210 N -3.09 1.82 0.15 4.20 8.00 -0.58 -4.00 116.55 123.05 1zbx n ASP 210 Ca 0.03 -1.68 0.13 0.00 0.71 0.00 0.00 54.79 53.99 1zbx n ASP 210 Cb 0.56 -0.08 0.35 0.00 -0.02 0.00 0.00 41.12 41.94 1zbx n ASP 210 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1zbx h LEU 211 N 2.56 0.00 -3.04 0.64 3.38 -1.63 -3.28 115.31 113.94 1zbx h LEU 211 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1zbx h LEU 211 Cb 0.56 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.26 1zbx h LEU 211 CO 0.00 0.00 -0.55 0.35 0.09 0.00 0.00 178.44 178.33 1zbx n THR 212 N -2.54 2.10 0.63 0.22 -2.24 -1.26 -4.91 114.28 106.27 1zbx n THR 212 Ca 0.05 -3.17 0.08 0.00 -2.27 0.00 0.00 64.05 58.74 1zbx n THR 212 Cb 0.44 -0.21 0.06 0.00 -2.10 0.00 0.00 70.33 68.53 1zbx n THR 212 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68