#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bxt s SER 2 N 0.00 0.50 -0.01 6.43 1.04 -1.26 -4.71 113.70 115.68 1bxt s SER 2 Ca 0.00 -1.08 -0.23 0.00 0.48 0.00 0.00 55.95 55.12 1bxt s SER 2 Cb 0.00 0.22 -0.05 0.00 0.10 0.00 0.00 66.02 66.29 1bxt s SER 2 CO 0.00 -0.63 0.70 -1.58 0.98 0.00 0.00 173.24 172.71 1bxt s GLN 3 N -3.96 4.43 0.34 4.02 0.74 0.55 -4.92 119.66 120.86 1bxt s GLN 3 Ca 0.14 0.92 -0.29 0.00 0.05 0.00 0.00 55.36 56.18 1bxt s GLN 3 Cb 0.08 -3.39 -0.11 0.00 1.10 0.00 0.00 33.01 30.69 1bxt s GLN 3 CO -0.05 0.22 1.45 -2.14 -0.55 0.00 0.00 175.29 174.21 1bxt s PRO 4 N 0.23 4.20 0.84 1.67 0.02 -1.26 -4.63 135.00 136.08 1bxt s PRO 4 Ca 0.36 2.45 -0.13 0.00 0.02 0.00 0.00 61.00 63.70 1bxt s PRO 4 Cb -0.19 -3.02 0.08 0.00 0.02 0.00 0.00 34.50 31.39 1bxt s PRO 4 CO 0.20 -0.44 1.03 -0.25 -0.33 0.00 0.00 177.00 177.21 1bxt n ASP 5 N 1.00 0.28 -4.77 2.53 8.00 -1.26 -4.93 116.55 117.41 1bxt n ASP 5 Ca 0.02 0.52 -0.37 0.00 0.71 0.00 0.00 54.79 55.67 1bxt n ASP 5 Cb 0.40 -1.44 -0.01 0.00 -0.02 0.00 0.00 41.12 40.05 1bxt n ASP 5 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1bxt s PRO 6 N -4.05 3.77 0.19 -0.24 0.04 -1.26 -5.05 135.00 128.40 1bxt s PRO 6 Ca 0.69 1.78 -0.09 0.00 0.04 0.00 0.00 61.00 63.42 1bxt s PRO 6 Cb -0.27 -2.42 -0.07 0.00 0.04 0.00 0.00 34.50 31.78 1bxt s PRO 6 CO 0.55 -0.55 0.50 -0.08 0.04 0.00 0.00 177.00 177.46 1bxt s THR 7 N -1.54 4.99 0.55 1.26 -1.32 -1.26 -4.97 115.64 113.35 1bxt s THR 7 Ca 0.63 0.40 0.27 0.00 -1.21 0.00 0.00 61.69 61.79 1bxt s THR 7 Cb -0.29 -3.63 0.40 0.00 -1.51 0.00 0.00 72.50 67.47 1bxt s THR 7 CO 0.35 0.02 1.97 -0.65 -2.21 0.00 0.00 174.62 174.10 1bxt h PRO 8 N 2.81 0.00 0.00 7.08 0.10 -1.96 0.30 132.00 140.32 1bxt h PRO 8 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.63 1bxt h PRO 8 Cb 1.17 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.27 1bxt h PRO 8 CO 0.69 0.00 0.00 0.39 0.10 0.00 0.00 178.00 179.18 1bxt n GLU 9 N -4.19 0.50 0.00 1.05 4.71 -1.26 -3.16 120.64 118.29 1bxt n GLU 9 Ca 0.10 0.01 0.11 0.00 -0.01 0.00 0.00 57.16 57.37 1bxt n GLU 9 Cb 0.64 -1.50 0.01 0.00 -1.01 0.00 0.00 31.44 29.58 1bxt n GLU 9 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1bxt n GLN 10 N -1.24 1.37 -4.39 3.49 6.02 0.10 -4.96 117.38 117.78 1bxt n GLN 10 Ca 0.15 -1.14 -0.34 0.00 -0.01 0.00 0.00 57.00 55.66 1bxt n GLN 10 Cb 0.22 -1.48 -0.10 0.00 1.02 0.00 0.00 30.24 29.90 1bxt n GLN 10 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1bxt s LEU 11 N -2.41 3.53 0.34 1.08 1.43 -1.19 -4.89 118.68 116.56 1bxt s LEU 11 Ca 0.20 0.11 -0.29 0.00 -1.03 0.00 0.00 54.13 53.12 1bxt s LEU 11 Cb 0.18 -1.84 -0.10 0.00 0.03 0.00 0.00 46.19 44.46 1bxt s LEU 11 CO 0.53 0.36 1.31 0.20 0.23 0.00 0.00 176.35 178.99 1bxt s ASN 12 N -0.98 6.75 -0.28 2.29 0.01 -1.26 -5.01 114.94 116.46 1bxt s ASN 12 Ca 0.14 2.70 -0.11 0.00 -0.71 0.00 0.00 52.86 54.88 1bxt s ASN 12 Cb -0.11 -2.65 -0.05 0.00 0.41 0.00 0.00 41.25 38.85 1bxt s ASN 12 CO 0.03 -0.55 0.19 -0.54 -1.51 0.00 0.00 177.10 174.72 1bxt s LYS 13 N -1.82 3.95 0.42 -0.60 3.01 -1.26 -4.42 119.74 119.02 1bxt s LYS 13 Ca 0.49 -0.32 0.09 0.00 -1.01 0.00 0.00 55.97 55.22 1bxt s LYS 13 Cb -0.40 -3.64 0.90 0.00 -1.01 0.00 0.00 37.83 33.67 1bxt s LYS 13 CO 0.53 -0.17 2.03 0.66 0.51 0.00 0.00 175.35 178.91 1bxt h SER 14 N 8.33 0.34 0.19 2.83 4.64 -1.14 -0.90 113.55 127.83 1bxt h SER 14 Ca -0.35 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1bxt h SER 14 Cb 1.19 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1bxt h SER 14 CO 0.56 0.31 0.00 0.77 -0.87 0.00 0.00 176.83 177.59 1bxt h SER 15 N 0.38 0.00 -0.13 4.97 4.64 -1.87 -0.14 113.55 121.40 1bxt h SER 15 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1bxt h SER 15 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1bxt h SER 15 CO -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.95 1bxt n GLN 16 N -2.59 2.18 -3.80 4.77 6.02 -0.34 -4.80 117.38 118.81 1bxt n GLN 16 Ca -0.01 -1.74 -0.36 0.00 -0.01 0.00 0.00 57.00 54.88 1bxt n GLN 16 Cb 0.09 -1.47 -0.11 0.00 1.02 0.00 0.00 30.24 29.78 1bxt n GLN 16 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 1bxt s PHE 17 N -1.86 3.20 -1.72 1.08 5.36 -0.07 -1.57 117.98 122.41 1bxt s PHE 17 Ca 0.33 -0.06 0.15 0.00 -0.96 0.00 0.00 56.93 56.39 1bxt s PHE 17 Cb 0.21 -2.21 0.18 0.00 -0.34 0.00 0.00 43.02 40.85 1bxt s PHE 17 CO 0.31 -0.08 1.05 0.25 -1.46 0.00 0.00 175.22 175.28 1bxt n THR 18 N 4.36 0.21 -0.47 0.12 -2.24 0.14 -4.91 114.28 111.50 1bxt n THR 18 Ca -0.16 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 1bxt n THR 18 Cb 0.52 1.13 0.00 0.00 -2.10 0.00 0.00 70.33 69.88 1bxt n THR 18 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bxt n GLY 19 N 0.84 -0.45 3.47 3.38 0.00 -1.22 -4.84 105.19 106.37 1bxt n GLY 19 Ca 0.10 -1.69 -0.43 0.00 0.00 0.00 0.00 46.02 43.99 1bxt n GLY 19 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bxt s VAL 20 N 0.08 4.88 0.17 1.61 1.01 -1.26 -4.80 120.40 122.08 1bxt s VAL 20 Ca 0.00 -0.29 0.29 0.00 0.00 0.00 0.00 61.98 61.98 1bxt s VAL 20 Cb 0.00 -4.24 0.29 0.00 0.00 0.00 0.00 36.38 32.43 1bxt s VAL 20 CO 0.00 -0.71 1.88 -0.03 0.00 0.00 0.00 175.10 176.25 1bxt h MET 21 N 8.94 0.00 0.00 2.72 4.05 -0.56 -1.05 114.93 129.02 1bxt h MET 21 Ca -0.27 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.15 1bxt h MET 21 Cb 1.10 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.90 1bxt h MET 21 CO 0.92 0.00 -0.01 0.78 0.23 0.00 0.00 176.91 178.84 1bxt h GLY 22 N 0.00 0.00 2.00 1.39 0.00 -0.92 -0.31 103.07 105.22 1bxt h GLY 22 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1bxt h GLY 22 CO 0.00 0.00 -0.22 3.43 0.00 0.00 0.00 176.54 179.75 1bxt h ASN 23 N 0.00 0.00 0.14 0.19 2.35 -1.47 -1.69 115.58 115.09 1bxt h ASN 23 Ca -0.00 0.00 -0.36 0.00 -0.55 0.00 0.00 56.30 55.39 1bxt h ASN 23 Cb 0.14 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.47 1bxt h ASN 23 CO 0.00 0.22 -2.07 -0.11 -1.65 0.00 0.00 177.43 173.82 1bxt n LEU 24 N -3.32 2.42 -0.28 1.61 7.94 -0.38 -4.26 117.00 120.73 1bxt n LEU 24 Ca 0.01 0.16 -0.01 0.00 -1.11 0.00 0.00 56.01 55.06 1bxt n LEU 24 Cb 0.47 -0.88 0.12 0.00 0.53 0.00 0.00 43.42 43.65 1bxt n LEU 24 CO 0.34 0.81 1.17 -0.09 -1.11 0.00 0.00 177.39 178.50 1bxt h ARG 25 N 0.05 0.88 0.00 1.96 2.43 -1.01 -2.03 114.38 116.66 1bxt h ARG 25 Ca -0.44 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 1bxt h ARG 25 Cb 2.01 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 31.37 1bxt h ARG 25 CO 0.05 0.58 0.00 0.00 -1.51 0.00 0.00 179.97 179.09 1bxt n LEU 27 N -1.71 0.62 0.00 0.00 4.77 -0.76 -4.39 117.00 115.52 1bxt n LEU 27 Ca 0.01 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1bxt n LEU 27 Cb 0.09 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 1bxt n LEU 27 CO 0.08 -0.06 0.01 -1.22 -1.33 0.00 0.00 177.39 174.87 1bxt n TYR 28 N -2.00 0.00 1.12 -1.77 4.01 -0.50 -4.78 117.16 113.24 1bxt n TYR 28 Ca 0.05 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.83 1bxt n TYR 28 Cb 0.41 0.00 0.11 0.00 -0.31 0.00 0.00 39.34 39.55 1bxt n TYR 28 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1bxt n ASP 29 N -0.16 1.46 0.00 7.72 5.75 -0.19 -3.36 116.55 127.77 1bxt n ASP 29 Ca 0.00 -2.04 0.00 0.00 -0.01 0.00 0.00 54.79 52.74 1bxt n ASP 29 Cb 0.04 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 39.92 1bxt n ASP 29 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1bxt n ASN 30 N 0.22 2.00 -4.83 -1.12 2.85 -1.26 -5.00 115.26 108.11 1bxt n ASN 30 Ca 0.08 0.00 -0.33 0.00 -0.11 0.00 0.00 54.58 54.22 1bxt n ASN 30 Cb 0.25 0.00 -0.06 0.00 1.24 0.00 0.00 39.78 41.20 1bxt n ASN 30 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 1bxt s HIS 31 N 1.11 3.39 0.15 1.20 3.76 -1.26 -5.04 115.29 118.60 1bxt s HIS 31 Ca 0.00 1.39 0.10 0.00 -0.15 0.00 0.00 55.06 56.40 1bxt s HIS 31 Cb 0.00 -2.67 -0.04 0.00 1.11 0.00 0.00 32.58 30.98 1bxt s HIS 31 CO 0.00 0.05 -0.22 -0.06 -0.85 0.00 0.00 174.74 173.66 1bxt s PHE 32 N -2.00 2.04 0.38 1.40 0.08 -1.26 -4.92 117.98 113.70 1bxt s PHE 32 Ca 0.56 -0.41 -0.28 0.00 0.12 0.00 0.00 56.93 56.92 1bxt s PHE 32 Cb -0.11 -1.05 -0.11 0.00 -0.57 0.00 0.00 43.02 41.18 1bxt s PHE 32 CO 0.16 0.35 1.48 0.54 -0.10 0.00 0.00 175.22 177.66 1bxt s VAL 33 N -1.55 2.07 -0.13 -0.44 0.11 -0.61 -4.85 120.40 115.00 1bxt s VAL 33 Ca 0.15 0.07 -0.06 0.00 -2.93 0.00 0.00 61.98 59.21 1bxt s VAL 33 Cb -0.08 -3.04 0.06 0.00 -1.53 0.00 0.00 36.38 31.78 1bxt s VAL 33 CO 0.07 0.02 0.28 -1.61 -3.33 0.00 0.00 175.10 170.53 1bxt s GLU 34 N -2.10 0.22 0.01 1.54 2.02 -1.26 -2.60 118.70 116.54 1bxt s GLU 34 Ca 0.53 0.66 0.03 0.00 0.02 0.00 0.00 54.97 56.21 1bxt s GLU 34 Cb -0.46 -0.05 -0.01 0.00 0.10 0.00 0.00 34.13 33.70 1bxt s GLU 34 CO 0.63 -0.21 -0.09 0.20 0.02 0.00 0.00 175.26 175.82 1bxt s GLY 35 N 1.72 0.46 -0.14 -1.39 0.00 -0.38 -4.96 107.32 102.63 1bxt s GLY 35 Ca -0.06 -0.48 0.01 0.00 0.00 0.00 0.00 44.72 44.20 1bxt s GLY 35 CO -0.09 -0.45 -0.17 -1.59 0.00 0.00 0.00 173.10 170.79 1bxt s THR 36 N -0.49 1.73 -1.00 0.90 2.01 -1.26 -1.35 115.64 116.17 1bxt s THR 36 Ca 0.00 -0.76 -0.13 0.00 0.31 0.00 0.00 61.69 61.11 1bxt s THR 36 Cb -0.05 -1.58 -0.01 0.00 0.01 0.00 0.00 72.50 70.88 1bxt s THR 36 CO 0.00 0.49 0.75 -3.20 -0.69 0.00 0.00 174.62 171.96 1bxt n ASN 37 N 4.40 -5.76 -4.61 3.53 5.15 -0.75 -4.98 115.26 112.24 1bxt n ASN 37 Ca -0.19 -0.83 -0.24 0.00 -0.60 0.00 0.00 54.58 52.72 1bxt n ASN 37 Cb 0.51 -3.48 -0.09 0.00 -0.53 0.00 0.00 39.78 36.19 1bxt n ASN 37 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1bxt s VAL 38 N -3.29 2.77 -0.02 3.44 -7.23 -0.25 -4.81 120.40 111.02 1bxt s VAL 38 Ca 0.30 -2.04 0.06 0.00 -1.81 0.00 0.00 61.98 58.49 1bxt s VAL 38 Cb -0.11 -2.72 -0.01 0.00 0.56 0.00 0.00 36.38 34.10 1bxt s VAL 38 CO 0.84 -0.27 -0.19 -0.13 -0.31 0.00 0.00 175.10 175.04 1bxt s ARG 39 N -3.67 1.67 0.33 4.82 0.52 -1.26 -0.87 118.95 120.48 1bxt s ARG 39 Ca 0.33 -0.69 -0.29 0.00 -0.52 0.00 0.00 55.73 54.56 1bxt s ARG 39 Cb -0.02 -1.57 -0.12 0.00 0.52 0.00 0.00 34.95 33.76 1bxt s ARG 39 CO 0.19 0.39 1.46 0.45 0.02 0.00 0.00 175.30 177.81 1bxt n SER 40 N 2.72 3.46 -0.60 0.23 2.88 -1.26 -4.37 113.62 116.67 1bxt n SER 40 Ca -0.16 1.19 0.09 0.00 -1.33 0.00 0.00 58.87 58.66 1bxt n SER 40 Cb 0.53 -1.56 0.05 0.00 -0.75 0.00 0.00 64.21 62.48 1bxt n SER 40 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1bxt n THR 41 N 1.05 0.00 -3.77 2.46 -2.24 0.52 -4.98 114.28 107.32 1bxt n THR 41 Ca 0.05 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 1bxt n THR 41 Cb 0.37 1.31 0.00 0.00 -2.10 0.00 0.00 70.33 69.91 1bxt n THR 41 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bxt n GLY 42 N 1.06 -1.05 3.53 3.38 0.00 -1.22 -5.01 105.19 105.87 1bxt n GLY 42 Ca 0.09 -1.09 -0.08 0.00 0.00 0.00 0.00 46.02 44.95 1bxt n GLY 42 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1bxt s GLN 43 N -1.55 0.71 -0.21 1.61 -2.07 -1.26 -0.29 119.66 116.60 1bxt s GLN 43 Ca 0.00 -0.22 -0.16 0.00 -1.82 0.00 0.00 55.36 53.16 1bxt s GLN 43 Cb 0.00 0.33 -0.09 0.00 -1.09 0.00 0.00 33.01 32.16 1bxt s GLN 43 CO 0.00 -0.30 -0.28 -0.11 -1.32 0.00 0.00 175.29 173.28 1bxt n LEU 44 N -0.12 1.92 -4.58 2.60 7.94 -1.26 -4.99 117.00 118.52 1bxt n LEU 44 Ca -0.07 0.38 -0.27 0.00 -1.11 0.00 0.00 56.01 54.94 1bxt n LEU 44 Cb 0.61 -0.80 -0.11 0.00 0.53 0.00 0.00 43.42 43.64 1bxt n LEU 44 CO 0.11 0.03 -0.30 -0.76 -1.11 0.00 0.00 177.39 175.36 1bxt s LEU 45 N -7.82 2.75 0.00 -1.96 1.02 -1.26 -5.03 118.68 106.38 1bxt s LEU 45 Ca -0.30 -1.35 0.12 0.00 0.02 0.00 0.00 54.13 52.62 1bxt s LEU 45 Cb 0.08 -0.82 0.67 0.00 0.02 0.00 0.00 46.19 46.13 1bxt s LEU 45 CO 0.44 -0.45 1.21 0.00 0.02 0.00 0.00 176.35 177.57 1bxt n GLN 46 N -0.90 0.29 0.00 1.70 6.02 -1.26 -2.54 117.38 120.69 1bxt n GLN 46 Ca -0.05 0.07 0.07 0.00 -0.01 0.00 0.00 57.00 57.09 1bxt n GLN 46 Cb 0.66 -1.50 0.05 0.00 1.02 0.00 0.00 30.24 30.48 1bxt n GLN 46 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1bxt n HIS 47 N -1.12 0.00 -4.38 1.08 8.25 -1.26 -4.22 115.22 113.57 1bxt n HIS 47 Ca 0.08 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.34 1bxt n HIS 47 Cb 0.06 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.08 1bxt n HIS 47 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 1bxt s ASP 48 N -1.29 1.79 -0.04 0.41 1.47 -1.05 -0.96 116.67 117.00 1bxt s ASP 48 Ca 0.16 -1.48 -0.04 0.00 1.18 0.00 0.00 52.55 52.37 1bxt s ASP 48 Cb 0.12 0.24 0.01 0.00 -0.34 0.00 0.00 42.92 42.95 1bxt s ASP 48 CO 0.21 -0.79 0.12 -0.76 0.68 0.00 0.00 175.17 174.63 1bxt s LEU 49 N -3.41 1.56 -0.13 2.11 1.43 -0.73 -4.59 118.68 114.92 1bxt s LEU 49 Ca 0.35 0.19 -0.02 0.00 -1.03 0.00 0.00 54.13 53.61 1bxt s LEU 49 Cb 0.06 0.43 -0.03 0.00 0.03 0.00 0.00 46.19 46.68 1bxt s LEU 49 CO 0.15 -0.07 -0.04 -0.63 0.23 0.00 0.00 176.35 175.99 1bxt s ILE 50 N -0.08 3.94 -0.00 -0.59 1.01 0.60 -1.23 121.20 124.84 1bxt s ILE 50 Ca -0.02 -0.36 0.08 0.00 0.00 0.00 0.00 60.65 60.36 1bxt s ILE 50 Cb -0.02 -2.69 -0.02 0.00 0.01 0.00 0.00 42.46 39.74 1bxt s ILE 50 CO 0.00 0.53 -0.25 -0.36 0.00 0.00 0.00 174.94 174.86 1bxt s PHE 51 N -0.10 2.25 -0.79 3.97 0.08 0.18 -0.35 117.98 123.21 1bxt s PHE 51 Ca 0.02 -0.42 -0.07 0.00 0.12 0.00 0.00 56.93 56.58 1bxt s PHE 51 Cb -0.13 -1.42 -0.16 0.00 -0.57 0.00 0.00 43.02 40.74 1bxt s PHE 51 CO 0.02 0.00 3.07 -0.35 -0.10 0.00 0.00 175.22 177.87 1bxt n PRO 52 N 2.29 2.67 -3.16 0.24 -0.04 -1.26 -1.30 135.00 134.43 1bxt n PRO 52 Ca -0.16 -1.52 -0.42 0.00 -0.04 0.00 0.00 63.50 61.35 1bxt n PRO 52 Cb 0.52 -2.37 -0.07 0.00 -0.04 0.00 0.00 33.50 31.53 1bxt n PRO 52 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1bxt s ILE 53 N 1.82 4.91 0.23 0.52 1.01 -1.26 -4.88 121.20 123.56 1bxt s ILE 53 Ca 0.63 0.17 -0.04 0.00 0.00 0.00 0.00 60.65 61.41 1bxt s ILE 53 Cb 0.23 -4.12 -0.05 0.00 0.01 0.00 0.00 42.46 38.53 1bxt s ILE 53 CO -0.03 -0.46 0.48 -0.54 0.00 0.00 0.00 174.94 174.39 1bxt s LYS 54 N 2.63 3.62 -0.53 2.79 -0.14 -1.25 -2.62 119.74 124.24 1bxt s LYS 54 Ca 0.21 -0.07 -0.16 0.00 -1.36 0.00 0.00 55.97 54.59 1bxt s LYS 54 Cb -0.15 -2.74 0.12 0.00 -1.68 0.00 0.00 37.83 33.39 1bxt s LYS 54 CO 0.17 0.32 0.48 0.34 -0.76 0.00 0.00 175.35 175.90 1bxt s ASP 55 N -2.93 6.15 0.18 2.83 -1.08 -0.36 -4.86 116.67 116.60 1bxt s ASP 55 Ca 0.42 -1.76 0.03 0.00 -0.52 0.00 0.00 52.55 50.73 1bxt s ASP 55 Cb -0.11 -2.19 0.04 0.00 -1.46 0.00 0.00 42.92 39.20 1bxt s ASP 55 CO 0.28 -0.83 1.41 -0.07 0.52 0.00 0.00 175.17 176.48 1bxt h LEU 56 N 8.85 0.24 0.21 -1.34 -0.00 -1.96 -2.34 115.31 118.97 1bxt h LEU 56 Ca -0.29 -0.18 -0.01 0.00 -0.00 0.00 0.00 57.88 57.39 1bxt h LEU 56 Cb 1.10 -0.07 0.00 0.00 -0.00 0.00 0.00 40.66 41.69 1bxt h LEU 56 CO 1.01 0.96 -0.10 0.11 -0.00 0.00 0.00 178.44 180.42 1bxt h LYS 57 N 0.11 -0.28 -0.01 1.13 6.56 -2.00 -3.39 116.57 118.69 1bxt h LYS 57 Ca -0.04 0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 1bxt h LYS 57 Cb 1.43 0.06 0.00 0.00 -0.57 0.00 0.00 32.23 33.16 1bxt h LYS 57 CO 0.12 -0.18 -0.01 1.28 -2.06 0.00 0.00 179.45 178.60 1bxt n LEU 58 N -2.89 1.63 -3.70 2.94 4.77 -1.26 -5.01 117.00 113.48 1bxt n LEU 58 Ca -0.04 -0.98 -0.24 0.00 -0.03 0.00 0.00 56.01 54.73 1bxt n LEU 58 Cb 0.11 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.25 1bxt n LEU 58 CO 0.09 0.33 0.07 0.29 -1.33 0.00 0.00 177.39 176.83 1bxt n LYS 59 N 0.39 -5.94 0.01 3.23 4.01 -0.88 -4.90 118.16 114.08 1bxt n LYS 59 Ca 0.05 0.69 0.11 0.00 -0.51 0.00 0.00 58.31 58.65 1bxt n LYS 59 Cb 0.20 -5.51 0.06 0.00 -0.51 0.00 0.00 35.03 29.27 1bxt n LYS 59 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1bxt n ASN 60 N -3.00 0.70 -3.55 4.39 5.03 -1.26 -4.96 115.26 112.60 1bxt n ASN 60 Ca -0.15 -0.50 -0.15 0.00 0.87 0.00 0.00 54.58 54.65 1bxt n ASN 60 Cb 0.61 0.67 -0.06 0.00 -1.02 0.00 0.00 39.78 39.99 1bxt n ASN 60 CO 0.00 0.00 0.00 -0.72 -1.83 0.00 0.00 177.26 174.71 1bxt s TYR 61 N -3.06 -0.59 -1.20 3.10 -0.85 -1.26 -4.40 117.35 109.09 1bxt s TYR 61 Ca 0.08 1.08 0.16 0.00 -0.52 0.00 0.00 57.07 57.88 1bxt s TYR 61 Cb 0.16 0.40 -0.08 0.00 0.38 0.00 0.00 41.96 42.83 1bxt s TYR 61 CO 0.79 -0.50 0.79 -0.25 -1.52 0.00 0.00 175.55 174.86 1bxt n ASP 62 N 1.10 1.28 -3.75 -0.18 8.00 -1.26 -1.23 116.55 120.51 1bxt n ASP 62 Ca -0.16 -1.14 -0.06 0.00 0.71 0.00 0.00 54.79 54.15 1bxt n ASP 62 Cb 0.57 0.69 -0.02 0.00 -0.02 0.00 0.00 41.12 42.35 1bxt n ASP 62 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1bxt s SER 63 N -2.18 -0.25 0.00 -2.24 1.04 -1.08 -3.96 113.70 105.04 1bxt s SER 63 Ca 0.10 -0.43 0.01 0.00 0.48 0.00 0.00 55.95 56.12 1bxt s SER 63 Cb 0.13 0.58 -0.01 0.00 0.10 0.00 0.00 66.02 66.82 1bxt s SER 63 CO 0.52 -1.06 -0.04 -0.69 0.98 0.00 0.00 173.24 172.95 1bxt s VAL 64 N -3.55 0.33 -0.17 5.02 1.01 -0.42 -3.62 120.40 119.00 1bxt s VAL 64 Ca 0.10 -0.27 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 1bxt s VAL 64 Cb -0.03 -0.30 -0.00 0.00 0.00 0.00 0.00 36.38 36.05 1bxt s VAL 64 CO 0.02 0.03 -0.12 -0.75 0.00 0.00 0.00 175.10 174.28 1bxt s LYS 65 N -0.27 3.27 -0.01 2.72 2.20 -0.84 -0.65 119.74 126.17 1bxt s LYS 65 Ca -0.00 -0.71 0.04 0.00 -0.36 0.00 0.00 55.97 54.94 1bxt s LYS 65 Cb -0.03 -2.72 -0.03 0.00 -1.51 0.00 0.00 37.83 33.54 1bxt s LYS 65 CO -0.00 -0.02 -0.12 -0.08 -0.36 0.00 0.00 175.35 174.77 1bxt s THR 66 N 0.93 3.23 0.05 3.43 -1.32 -0.37 -1.88 115.64 119.72 1bxt s THR 66 Ca -0.02 -0.85 0.06 0.00 -1.21 0.00 0.00 61.69 59.66 1bxt s THR 66 Cb -0.15 -2.35 -0.04 0.00 -1.51 0.00 0.00 72.50 68.46 1bxt s THR 66 CO -0.01 0.45 -0.13 -1.61 -2.21 0.00 0.00 174.62 171.12 1bxt s GLU 67 N -1.17 2.20 0.32 7.08 2.02 -1.14 -1.78 118.70 126.24 1bxt s GLU 67 Ca 0.14 -0.94 0.09 0.00 0.02 0.00 0.00 54.97 54.29 1bxt s GLU 67 Cb -0.11 -2.30 -0.06 0.00 0.10 0.00 0.00 34.13 31.76 1bxt s GLU 67 CO 0.04 0.54 -0.09 -0.06 0.02 0.00 0.00 175.26 175.71 1bxt s PHE 68 N -1.05 2.28 -2.07 1.61 0.08 -0.14 -1.37 117.98 117.33 1bxt s PHE 68 Ca 0.18 -0.54 0.18 0.00 0.12 0.00 0.00 56.93 56.87 1bxt s PHE 68 Cb -0.11 -1.29 0.97 0.00 -0.57 0.00 0.00 43.02 42.02 1bxt s PHE 68 CO 0.09 0.52 1.64 0.27 -0.10 0.00 0.00 175.22 177.64 1bxt n ASN 69 N -0.73 0.46 -3.52 1.36 0.23 0.39 -4.85 115.26 108.61 1bxt n ASN 69 Ca -0.05 -1.52 -0.14 0.00 -0.53 0.00 0.00 54.58 52.34 1bxt n ASN 69 Cb 0.63 -0.03 -0.04 0.00 -2.08 0.00 0.00 39.78 38.26 1bxt n ASN 69 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1bxt s SER 70 N -1.55 -0.52 0.31 0.53 1.04 -1.26 -5.02 113.70 107.23 1bxt s SER 70 Ca 0.28 0.23 0.07 0.00 0.48 0.00 0.00 55.95 57.00 1bxt s SER 70 Cb 0.14 0.53 0.51 0.00 0.10 0.00 0.00 66.02 67.30 1bxt s SER 70 CO 0.22 -0.78 1.74 0.11 0.98 0.00 0.00 173.24 175.52 1bxt h LYS 71 N 2.58 0.25 -0.51 4.02 1.57 -1.90 -3.03 116.57 119.55 1bxt h LYS 71 Ca -0.31 -0.10 0.05 0.00 -1.87 0.00 0.00 60.65 58.41 1bxt h LYS 71 Cb 1.23 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 33.48 1bxt h LYS 71 CO 0.40 0.57 0.25 -0.44 -0.57 0.00 0.00 179.45 179.66 1bxt h ASP 72 N 0.22 0.34 -0.71 0.86 3.32 -1.96 0.01 116.42 118.51 1bxt h ASP 72 Ca 0.03 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 1bxt h ASP 72 Cb 0.72 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 40.21 1bxt h ASP 72 CO 0.05 0.23 0.39 -0.07 -1.72 0.00 0.00 179.24 178.13 1bxt h LEU 73 N 0.48 0.88 -0.59 1.55 3.38 -1.92 -1.02 115.31 118.07 1bxt h LEU 73 Ca 0.23 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 1bxt h LEU 73 Cb 0.16 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1bxt h LEU 73 CO -0.17 0.71 -0.06 0.00 0.09 0.00 0.00 178.44 179.01 1bxt h ALA 74 N 1.20 0.80 -0.26 1.53 0.00 -1.44 -2.96 119.26 118.13 1bxt h ALA 74 Ca 0.25 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1bxt h ALA 74 Cb 0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1bxt h ALA 74 CO -0.04 0.67 -0.16 1.79 0.00 0.00 0.00 179.25 181.52 1bxt h THR 75 N 0.95 1.23 -0.45 0.00 1.35 -0.68 -1.31 112.91 114.00 1bxt h THR 75 Ca 0.15 -1.05 -0.05 0.00 -0.55 0.00 0.00 66.41 64.92 1bxt h THR 75 Cb 0.63 1.21 -0.02 0.00 -1.73 0.00 0.00 68.15 68.24 1bxt h THR 75 CO 0.04 0.34 0.08 0.50 -0.25 0.00 0.00 175.52 176.23 1bxt h LYS 76 N 0.41 0.73 -0.15 4.72 3.64 -1.04 -3.17 116.57 121.72 1bxt h LYS 76 Ca 0.07 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1bxt h LYS 76 Cb 0.52 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1bxt h LYS 76 CO 0.03 0.75 0.00 0.66 -2.27 0.00 0.00 179.45 178.63 1bxt n TYR 77 N -4.48 0.18 -0.12 1.91 4.01 -1.13 -4.64 117.16 112.88 1bxt n TYR 77 Ca 0.00 -0.10 -0.06 0.00 -0.16 0.00 0.00 57.90 57.58 1bxt n TYR 77 Cb 0.24 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.27 1bxt n TYR 77 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1bxt h LYS 78 N 4.10 -0.17 -0.31 -0.72 3.64 -1.20 -2.88 116.57 119.04 1bxt h LYS 78 Ca 0.00 0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 59.24 1bxt h LYS 78 Cb 0.90 0.04 -0.09 0.00 -0.41 0.00 0.00 32.23 32.66 1bxt h LYS 78 CO 0.00 -0.11 -0.11 0.09 -2.27 0.00 0.00 179.45 177.05 1bxt n ASN 79 N -5.40 2.49 -4.75 4.20 4.13 -1.26 -4.24 115.26 110.44 1bxt n ASN 79 Ca 0.02 -3.73 -0.25 0.00 1.68 0.00 0.00 54.58 52.29 1bxt n ASN 79 Cb 0.31 -0.62 -0.06 0.00 -1.54 0.00 0.00 39.78 37.87 1bxt n ASN 79 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1bxt s LYS 80 N -3.22 2.69 -0.23 3.52 1.02 -1.09 -5.06 119.74 117.38 1bxt s LYS 80 Ca 0.44 -1.03 -0.26 0.00 0.02 0.00 0.00 55.97 55.14 1bxt s LYS 80 Cb 0.40 -2.49 -0.00 0.00 -0.52 0.00 0.00 37.83 35.21 1bxt s LYS 80 CO -0.00 0.45 0.88 -0.51 -0.92 0.00 0.00 175.35 175.25 1bxt s ASP 81 N -3.24 6.92 0.30 2.83 1.01 -1.26 -4.51 116.67 118.73 1bxt s ASP 81 Ca 0.30 1.15 0.03 0.00 0.71 0.00 0.00 52.55 54.73 1bxt s ASP 81 Cb -0.09 -2.47 -0.06 0.00 1.01 0.00 0.00 42.92 41.32 1bxt s ASP 81 CO 0.22 -0.53 0.08 0.68 0.21 0.00 0.00 175.17 175.83 1bxt s VAL 82 N 2.81 0.84 0.06 -1.27 -7.23 -0.05 -1.39 120.40 114.16 1bxt s VAL 82 Ca 0.38 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.61 1bxt s VAL 82 Cb -0.15 -2.69 -0.04 0.00 0.56 0.00 0.00 36.38 34.06 1bxt s VAL 82 CO 0.08 0.00 -0.12 -1.81 -0.31 0.00 0.00 175.10 172.94 1bxt s ASP 83 N -3.41 4.25 -0.02 4.85 1.01 0.74 -1.09 116.67 123.00 1bxt s ASP 83 Ca 0.37 -0.34 0.03 0.00 0.71 0.00 0.00 52.55 53.32 1bxt s ASP 83 Cb 0.08 -0.82 -0.00 0.00 1.01 0.00 0.00 42.92 43.19 1bxt s ASP 83 CO 0.15 0.23 -0.12 -0.63 0.21 0.00 0.00 175.17 175.01 1bxt s ILE 84 N -1.06 0.97 -0.19 0.77 1.01 -0.46 -1.85 121.20 120.39 1bxt s ILE 84 Ca 0.18 -0.48 -0.08 0.00 0.00 0.00 0.00 60.65 60.27 1bxt s ILE 84 Cb -0.11 -0.84 0.08 0.00 0.01 0.00 0.00 42.46 41.60 1bxt s ILE 84 CO 0.09 0.29 0.43 0.12 0.00 0.00 0.00 174.94 175.87 1bxt s PHE 85 N 0.03 -0.72 -0.28 3.97 2.19 -0.44 -1.25 117.98 121.48 1bxt s PHE 85 Ca -0.01 1.44 0.00 0.00 0.33 0.00 0.00 56.93 58.69 1bxt s PHE 85 Cb -0.08 0.30 0.00 0.00 -1.31 0.00 0.00 43.02 41.93 1bxt s PHE 85 CO 0.01 -0.42 0.00 0.41 1.83 0.00 0.00 175.22 177.05 1bxt n GLY 86 N 4.81 -1.19 3.63 13.12 0.00 -1.07 -4.39 105.19 120.11 1bxt n GLY 86 Ca -0.16 -1.03 -0.38 0.00 0.00 0.00 0.00 46.02 44.45 1bxt n GLY 86 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1bxt s SER 87 N -0.01 6.22 0.31 1.61 0.15 -1.26 -1.57 113.70 119.15 1bxt s SER 87 Ca 0.00 0.24 0.07 0.00 0.70 0.00 0.00 55.95 56.97 1bxt s SER 87 Cb 0.00 -2.17 -0.03 0.00 -1.71 0.00 0.00 66.02 62.11 1bxt s SER 87 CO 0.00 -0.06 0.27 0.54 1.20 0.00 0.00 173.24 175.18 1bxt s ASN 88 N 1.35 5.38 0.05 5.45 4.22 -1.26 -4.53 114.94 125.60 1bxt s ASN 88 Ca 0.12 -0.41 -0.02 0.00 -2.14 0.00 0.00 52.86 50.42 1bxt s ASN 88 Cb -0.15 -1.12 -0.04 0.00 1.28 0.00 0.00 41.25 41.23 1bxt s ASN 88 CO 0.08 -0.25 -0.01 -0.72 -2.04 0.00 0.00 177.10 174.16 1bxt s TYR 89 N -2.25 0.47 0.00 1.54 -0.85 0.57 -4.94 117.35 111.90 1bxt s TYR 89 Ca 0.38 -0.99 0.00 0.00 -0.52 0.00 0.00 57.07 55.94 1bxt s TYR 89 Cb -0.07 -0.35 0.00 0.00 0.38 0.00 0.00 41.96 41.92 1bxt s TYR 89 CO 0.26 -0.38 0.00 0.66 -1.52 0.00 0.00 175.55 174.57 1bxt n TYR 90 N 0.19 0.00 -0.09 -3.49 4.01 -1.26 -1.01 117.16 115.51 1bxt n TYR 90 Ca -0.15 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.57 1bxt n TYR 90 Cb 0.61 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.62 1bxt n TYR 90 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1bxt n TYR 91 N -1.70 -0.09 -2.34 -0.72 4.02 -1.26 -1.44 117.16 113.63 1bxt n TYR 91 Ca 0.00 0.26 -0.36 0.00 -0.01 0.00 0.00 57.90 57.79 1bxt n TYR 91 Cb 0.21 -0.37 0.02 0.00 -0.02 0.00 0.00 39.34 39.17 1bxt n TYR 91 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1bxt n ASN 92 N -3.39 6.51 0.00 7.72 2.85 -1.26 -5.13 115.26 122.56 1bxt n ASN 92 Ca 0.00 -3.76 0.00 0.00 -0.11 0.00 0.00 54.58 50.71 1bxt n ASN 92 Cb 0.05 -0.90 0.00 0.00 1.24 0.00 0.00 39.78 40.18 1bxt n ASN 92 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1bxt n LYS 106 N 0.00 -0.50 -3.62 0.00 5.02 -1.25 -5.06 118.16 112.75 1bxt n LYS 106 Ca 0.00 0.56 -0.13 0.00 -2.02 0.00 0.00 58.31 56.72 1bxt n LYS 106 Cb 0.00 -0.39 -0.07 0.00 -0.02 0.00 0.00 35.03 34.56 1bxt n LYS 106 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1bxt s THR 107 N -0.63 0.00 0.43 -0.18 -1.32 -1.24 -4.83 115.64 107.87 1bxt s THR 107 Ca 0.00 0.00 0.07 0.00 -1.21 0.00 0.00 61.69 60.55 1bxt s THR 107 Cb 0.00 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 69.97 1bxt s THR 107 CO 0.00 0.00 0.36 0.00 -2.21 0.00 0.00 174.62 172.77 1bxt n MET 109 N -1.54 0.00 -3.78 0.00 0.00 -0.79 -0.31 117.12 110.70 1bxt n MET 109 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 57.70 57.60 1bxt n MET 109 Cb 0.62 0.00 -0.12 0.00 0.00 0.00 0.00 33.22 33.72 1bxt n MET 109 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 175.97 176.68 1bxt s TYR 110 N -4.88 -0.25 0.00 3.17 2.02 -1.26 -2.88 117.35 113.28 1bxt s TYR 110 Ca 0.00 0.60 0.00 0.00 -0.37 0.00 0.00 57.07 57.30 1bxt s TYR 110 Cb 0.00 0.06 0.00 0.00 -0.40 0.00 0.00 41.96 41.62 1bxt s TYR 110 CO 0.00 -0.14 0.00 0.41 -1.57 0.00 0.00 175.55 174.25 1bxt n GLY 111 N 3.27 3.02 2.28 0.71 0.00 -0.47 -4.60 105.19 109.41 1bxt n GLY 111 Ca -0.16 -0.16 -0.03 0.00 0.00 0.00 0.00 46.02 45.67 1bxt n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bxt n GLY 112 N 0.00 0.62 3.54 -0.02 0.00 -1.26 -4.83 105.19 103.24 1bxt n GLY 112 Ca 0.00 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.34 1bxt n GLY 112 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bxt s VAL 113 N -1.95 3.98 0.04 1.61 1.01 -1.26 -1.33 120.40 122.51 1bxt s VAL 113 Ca 0.00 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.66 1bxt s VAL 113 Cb 0.00 -2.73 -0.03 0.00 0.00 0.00 0.00 36.38 33.63 1bxt s VAL 113 CO 0.00 0.52 -0.07 0.42 0.00 0.00 0.00 175.10 175.97 1bxt s THR 114 N 0.09 0.46 0.17 3.92 -4.23 -0.77 -4.94 115.64 110.33 1bxt s THR 114 Ca 0.00 -1.14 -0.30 0.00 -1.18 0.00 0.00 61.69 59.07 1bxt s THR 114 Cb -0.13 -0.65 -0.08 0.00 1.34 0.00 0.00 72.50 72.97 1bxt s THR 114 CO 0.03 -0.46 1.32 -1.61 -0.54 0.00 0.00 174.62 173.35 1bxt s GLU 115 N -1.80 4.38 -0.05 3.99 2.02 -1.26 -0.18 118.70 125.80 1bxt s GLU 115 Ca -0.09 2.03 -0.25 0.00 0.02 0.00 0.00 54.97 56.68 1bxt s GLU 115 Cb -0.08 -3.22 -0.20 0.00 0.10 0.00 0.00 34.13 30.73 1bxt s GLU 115 CO -0.01 -0.29 1.10 1.25 0.02 0.00 0.00 175.26 177.33 1bxt h HIS 116 N 5.81 -0.06 -3.59 1.61 -0.00 -1.50 -3.40 115.15 114.02 1bxt h HIS 116 Ca -0.44 -0.00 -0.53 0.00 -0.00 0.00 0.00 60.37 59.40 1bxt h HIS 116 Cb 1.21 0.02 0.08 0.00 -0.00 0.00 0.00 27.41 28.72 1bxt h HIS 116 CO 0.63 0.50 0.77 -1.01 -0.00 0.00 0.00 177.93 178.82 1bxt s HIS 117 N -3.75 2.87 0.00 5.26 3.76 -1.26 -2.45 115.29 119.71 1bxt s HIS 117 Ca -0.16 1.08 0.00 0.00 -0.15 0.00 0.00 55.06 55.83 1bxt s HIS 117 Cb 0.01 -3.89 0.00 0.00 1.11 0.00 0.00 32.58 29.80 1bxt s HIS 117 CO 0.63 -2.79 0.00 0.54 -0.85 0.00 0.00 174.74 172.27 1bxt n ARG 118 N 1.59 0.00 0.00 1.40 1.74 -1.26 -4.80 116.66 115.33 1bxt n ARG 118 Ca 0.04 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.23 1bxt n ARG 118 Cb 0.40 -3.09 0.01 0.00 -1.02 0.00 0.00 32.46 28.75 1bxt n ARG 118 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1bxt n ASN 119 N 0.00 2.05 -4.71 0.55 5.15 -1.03 -4.93 115.26 112.34 1bxt n ASN 119 Ca 0.00 -1.53 -0.42 0.00 -0.60 0.00 0.00 54.58 52.03 1bxt n ASN 119 Cb 0.00 0.41 -0.03 0.00 -0.53 0.00 0.00 39.78 39.63 1bxt n ASN 119 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1bxt s GLN 120 N -2.23 4.50 0.03 1.20 -1.52 -1.25 -1.40 119.66 118.99 1bxt s GLN 120 Ca 0.18 1.55 -0.26 0.00 -1.95 0.00 0.00 55.36 54.88 1bxt s GLN 120 Cb 0.17 -3.43 -0.05 0.00 -0.22 0.00 0.00 33.01 29.48 1bxt s GLN 120 CO 0.48 -0.16 0.83 0.42 -0.25 0.00 0.00 175.29 176.62 1bxt s ILE 121 N 1.14 4.77 -0.12 1.08 1.01 -0.35 -4.88 121.20 123.87 1bxt s ILE 121 Ca 0.54 1.75 -0.02 0.00 0.00 0.00 0.00 60.65 62.93 1bxt s ILE 121 Cb -0.24 -4.18 -0.03 0.00 0.01 0.00 0.00 42.46 38.03 1bxt s ILE 121 CO 0.28 0.30 -0.04 -1.61 0.00 0.00 0.00 174.94 173.86 1bxt s GLU 122 N 0.30 3.26 1.88 2.79 2.02 -1.26 -4.99 118.70 122.70 1bxt s GLU 122 Ca 0.42 -0.51 0.00 0.00 0.02 0.00 0.00 54.97 54.90 1bxt s GLU 122 Cb -0.21 -2.78 0.00 0.00 0.10 0.00 0.00 34.13 31.24 1bxt s GLU 122 CO 0.24 0.45 0.00 0.41 0.02 0.00 0.00 175.26 176.39 1bxt n GLY 123 N 2.88 -0.14 3.71 -1.39 0.00 -1.26 -4.90 105.19 104.08 1bxt n GLY 123 Ca -0.18 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.05 1bxt n GLY 123 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bxt s LYS 124 N 0.00 4.18 0.45 1.61 2.20 -1.26 -4.99 119.74 121.93 1bxt s LYS 124 Ca 0.00 2.45 -0.21 0.00 -0.36 0.00 0.00 55.97 57.85 1bxt s LYS 124 Cb 0.00 -3.30 -0.09 0.00 -1.51 0.00 0.00 37.83 32.93 1bxt s LYS 124 CO 0.00 -0.71 1.02 -0.06 -0.36 0.00 0.00 175.35 175.24 1bxt s PHE 125 N 1.72 3.15 0.50 4.03 0.08 -1.26 -5.00 117.98 121.19 1bxt s PHE 125 Ca 0.74 1.61 -0.22 0.00 0.12 0.00 0.00 56.93 59.17 1bxt s PHE 125 Cb -0.45 -3.03 -0.06 0.00 -0.57 0.00 0.00 43.02 38.91 1bxt s PHE 125 CO 0.32 -0.60 1.21 -1.25 -0.10 0.00 0.00 175.22 174.80 1bxt s PRO 126 N -3.01 3.52 -0.37 0.24 0.04 -1.26 -4.99 135.00 129.16 1bxt s PRO 126 Ca 0.63 1.86 -0.13 0.00 0.04 0.00 0.00 61.00 63.40 1bxt s PRO 126 Cb -0.16 -2.29 0.01 0.00 0.04 0.00 0.00 34.50 32.09 1bxt s PRO 126 CO 0.20 -0.77 0.25 -0.80 0.04 0.00 0.00 177.00 175.92 1bxt s ASN 127 N -1.34 5.97 -0.33 6.66 0.02 -1.26 -4.33 114.94 120.34 1bxt s ASN 127 Ca 0.67 -0.75 -0.13 0.00 -1.02 0.00 0.00 52.86 51.64 1bxt s ASN 127 Cb -0.31 -2.11 -0.02 0.00 0.02 0.00 0.00 41.25 38.82 1bxt s ASN 127 CO 0.36 -0.35 0.24 -0.63 0.02 0.00 0.00 177.10 176.74 1bxt s ILE 128 N 1.66 5.29 0.03 0.60 1.01 -0.36 -4.95 121.20 124.48 1bxt s ILE 128 Ca 0.05 -0.11 -0.25 0.00 0.00 0.00 0.00 60.65 60.33 1bxt s ILE 128 Cb -0.18 -3.68 -0.05 0.00 0.01 0.00 0.00 42.46 38.56 1bxt s ILE 128 CO 0.09 0.04 0.78 -0.89 0.00 0.00 0.00 174.94 174.97 1bxt s THR 129 N 1.75 4.78 -0.22 2.92 2.01 -1.26 -0.96 115.64 124.66 1bxt s THR 129 Ca 0.07 1.65 -0.03 0.00 0.31 0.00 0.00 61.69 63.69 1bxt s THR 129 Cb -0.17 -4.13 0.00 0.00 0.01 0.00 0.00 72.50 68.22 1bxt s THR 129 CO 0.11 0.33 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.61 1bxt s VAL 130 N 0.17 3.10 -0.25 3.82 1.01 0.11 -2.66 120.40 125.70 1bxt s VAL 130 Ca 0.40 -0.68 -0.12 0.00 0.00 0.00 0.00 61.98 61.59 1bxt s VAL 130 Cb -0.20 -2.44 -0.05 0.00 0.00 0.00 0.00 36.38 33.69 1bxt s VAL 130 CO 0.23 0.38 0.21 -0.54 0.00 0.00 0.00 175.10 175.38 1bxt s LYS 131 N 1.42 4.06 -0.20 2.72 1.02 -0.50 -1.63 119.74 126.63 1bxt s LYS 131 Ca 0.04 -0.20 -0.08 0.00 0.02 0.00 0.00 55.97 55.76 1bxt s LYS 131 Cb -0.15 -3.57 -0.04 0.00 -0.52 0.00 0.00 37.83 33.55 1bxt s LYS 131 CO -0.05 -0.02 0.07 0.08 -0.92 0.00 0.00 175.35 174.51 1bxt s VAL 132 N 1.29 4.70 -0.06 3.17 1.01 0.23 -0.21 120.40 130.54 1bxt s VAL 132 Ca 0.09 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.05 1bxt s VAL 132 Cb -0.14 -3.14 -0.02 0.00 0.00 0.00 0.00 36.38 33.07 1bxt s VAL 132 CO 0.07 0.42 -0.16 -0.31 0.00 0.00 0.00 175.10 175.12 1bxt s TYR 133 N 0.70 2.66 -0.22 5.22 1.51 0.18 -0.82 117.35 126.58 1bxt s TYR 133 Ca 0.04 -0.31 0.01 0.00 -1.01 0.00 0.00 57.07 55.80 1bxt s TYR 133 Cb -0.13 -1.65 0.05 0.00 -0.11 0.00 0.00 41.96 40.12 1bxt s TYR 133 CO 0.02 0.07 -0.09 -1.21 -1.11 0.00 0.00 175.55 173.23 1bxt s GLU 134 N -0.50 1.95 -1.35 -0.62 2.02 -0.18 -0.55 118.70 119.46 1bxt s GLU 134 Ca 0.07 -0.95 -0.05 0.00 0.02 0.00 0.00 54.97 54.05 1bxt s GLU 134 Cb -0.12 -2.53 0.02 0.00 0.10 0.00 0.00 34.13 31.60 1bxt s GLU 134 CO 0.01 -0.49 0.90 -0.25 0.02 0.00 0.00 175.26 175.45 1bxt n ASP 135 N 4.64 -3.01 -0.82 -0.19 8.00 0.55 -1.82 116.55 123.91 1bxt n ASP 135 Ca -0.14 -0.73 -0.11 0.00 0.71 0.00 0.00 54.79 54.52 1bxt n ASP 135 Cb 0.45 -4.34 -0.05 0.00 -0.02 0.00 0.00 41.12 37.16 1bxt n ASP 135 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1bxt n ASN 136 N -3.01 -4.49 -4.23 -2.24 5.15 -1.26 -5.01 115.26 100.17 1bxt n ASN 136 Ca -0.17 0.26 -0.34 0.00 -0.60 0.00 0.00 54.58 53.74 1bxt n ASN 136 Cb 0.62 -2.93 -0.15 0.00 -0.53 0.00 0.00 39.78 36.79 1bxt n ASN 136 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1bxt s GLU 137 N -2.80 3.19 -0.65 1.20 2.02 -0.75 -5.04 118.70 115.86 1bxt s GLU 137 Ca 0.00 -0.74 -0.26 0.00 0.02 0.00 0.00 54.97 53.99 1bxt s GLU 137 Cb 0.00 -2.73 -0.04 0.00 0.10 0.00 0.00 34.13 31.46 1bxt s GLU 137 CO 0.00 -0.13 2.01 1.21 0.02 0.00 0.00 175.26 178.36 1bxt s ASN 138 N 1.20 5.02 0.04 -0.19 2.47 -1.26 -1.01 114.94 121.20 1bxt s ASN 138 Ca 0.02 0.28 0.22 0.00 0.42 0.00 0.00 52.86 53.80 1bxt s ASN 138 Cb -0.14 -2.53 -0.20 0.00 -1.45 0.00 0.00 41.25 36.93 1bxt s ASN 138 CO -0.06 -2.62 0.72 -0.38 -3.72 0.00 0.00 177.10 171.05 1bxt n ILE 139 N 7.55 0.17 -3.55 -5.21 -0.00 -0.00 -4.99 119.36 113.34 1bxt n ILE 139 Ca 0.28 -0.44 -0.16 0.00 -0.00 0.00 0.00 62.75 62.43 1bxt n ILE 139 Cb 0.51 0.02 -0.06 0.00 -0.00 0.00 0.00 39.64 40.11 1bxt n ILE 139 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.55 176.33 1bxt s LEU 140 N -4.53 -0.62 -0.05 1.39 2.96 -1.15 -5.03 118.68 111.66 1bxt s LEU 140 Ca -0.03 0.77 -0.04 0.00 -0.22 0.00 0.00 54.13 54.61 1bxt s LEU 140 Cb 0.13 2.40 0.02 0.00 0.50 0.00 0.00 46.19 49.24 1bxt s LEU 140 CO 0.86 -0.50 0.12 -0.44 -1.32 0.00 0.00 176.35 175.07 1bxt s SER 141 N -0.92 -0.11 0.10 3.68 0.01 -1.26 0.75 113.70 115.95 1bxt s SER 141 Ca -0.08 0.24 -0.14 0.00 1.31 0.00 0.00 55.95 57.28 1bxt s SER 141 Cb -0.01 0.21 0.02 0.00 0.21 0.00 0.00 66.02 66.46 1bxt s SER 141 CO 0.07 -0.07 0.34 0.72 0.41 0.00 0.00 173.24 174.71 1bxt s PHE 142 N 0.40 -0.12 0.05 2.43 -0.12 -0.64 -4.98 117.98 114.99 1bxt s PHE 142 Ca -0.03 -0.17 0.04 0.00 -0.05 0.00 0.00 56.93 56.71 1bxt s PHE 142 Cb -0.04 0.16 -0.04 0.00 -0.63 0.00 0.00 43.02 42.47 1bxt s PHE 142 CO -0.02 -0.63 -0.01 -0.51 -0.05 0.00 0.00 175.22 174.01 1bxt s ASP 143 N -2.64 4.99 0.28 1.98 1.01 -1.26 0.09 116.67 121.13 1bxt s ASP 143 Ca 0.02 -0.12 0.07 0.00 0.71 0.00 0.00 52.55 53.23 1bxt s ASP 143 Cb 0.02 -1.22 -0.06 0.00 1.01 0.00 0.00 42.92 42.67 1bxt s ASP 143 CO -0.10 0.23 -0.08 0.27 0.21 0.00 0.00 175.17 175.70 1bxt s ILE 144 N -1.19 1.80 0.35 0.77 -4.36 -0.13 -4.94 121.20 113.50 1bxt s ILE 144 Ca 0.22 -2.16 0.04 0.00 -0.26 0.00 0.00 60.65 58.49 1bxt s ILE 144 Cb -0.12 -2.44 -0.03 0.00 1.25 0.00 0.00 42.46 41.12 1bxt s ILE 144 CO 0.14 -0.31 0.16 0.42 0.24 0.00 0.00 174.94 175.59 1bxt s THR 145 N -2.91 0.41 0.15 8.37 -4.23 -1.26 -1.22 115.64 114.95 1bxt s THR 145 Ca 0.29 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.59 1bxt s THR 145 Cb 0.03 -2.46 0.06 0.00 1.34 0.00 0.00 72.50 71.47 1bxt s THR 145 CO 0.12 0.00 0.55 0.28 -0.54 0.00 0.00 174.62 175.03 1bxt s THR 146 N -3.41 0.02 -2.01 3.99 -1.32 -1.26 -5.02 115.64 106.63 1bxt s THR 146 Ca 0.32 -0.15 0.18 0.00 -1.21 0.00 0.00 61.69 60.83 1bxt s THR 146 Cb 0.04 -1.04 0.29 0.00 -1.51 0.00 0.00 72.50 70.28 1bxt s THR 146 CO 0.18 -0.08 1.22 -0.46 -2.21 0.00 0.00 174.62 173.27 1bxt n ASN 147 N -0.33 2.94 -4.66 8.08 6.94 -1.26 -4.30 115.26 122.67 1bxt n ASN 147 Ca -0.17 -1.86 -0.35 0.00 -0.02 0.00 0.00 54.58 52.18 1bxt n ASN 147 Cb 0.65 -0.15 -0.10 0.00 -2.36 0.00 0.00 39.78 37.81 1bxt n ASN 147 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1bxt s LYS 148 N -1.33 3.02 0.03 -3.83 1.02 -1.26 -1.21 119.74 116.19 1bxt s LYS 148 Ca 0.28 -0.43 -0.22 0.00 0.02 0.00 0.00 55.97 55.63 1bxt s LYS 148 Cb 0.17 -2.78 -0.15 0.00 -0.52 0.00 0.00 37.83 34.55 1bxt s LYS 148 CO 0.24 0.66 1.39 0.87 -0.92 0.00 0.00 175.35 177.59 1bxt h LYS 149 N 5.30 0.24 -4.85 1.68 1.57 -1.57 -3.39 116.57 115.55 1bxt h LYS 149 Ca -0.49 -0.11 -0.67 0.00 -1.87 0.00 0.00 60.65 57.51 1bxt h LYS 149 Cb 1.19 -0.01 -0.29 0.00 0.08 0.00 0.00 32.23 33.20 1bxt h LYS 149 CO 0.55 0.58 -0.68 -0.65 -0.57 0.00 0.00 179.45 178.68 1bxt s GLN 150 N -4.57 2.95 0.12 3.15 -1.52 -1.26 -0.92 119.66 117.60 1bxt s GLN 150 Ca -0.14 -0.93 0.10 0.00 -1.95 0.00 0.00 55.36 52.44 1bxt s GLN 150 Cb 0.05 -3.18 -0.04 0.00 -0.22 0.00 0.00 33.01 29.62 1bxt s GLN 150 CO 0.72 -0.43 -0.22 0.54 -0.25 0.00 0.00 175.29 175.65 1bxt s VAL 151 N 1.41 2.56 0.46 1.09 0.11 -0.21 -4.89 120.40 120.93 1bxt s VAL 151 Ca 0.01 -1.59 -0.23 0.00 -2.93 0.00 0.00 61.98 57.24 1bxt s VAL 151 Cb -0.17 -2.15 -0.07 0.00 -1.53 0.00 0.00 36.38 32.46 1bxt s VAL 151 CO -0.01 0.12 1.16 0.42 -3.33 0.00 0.00 175.10 173.45 1bxt s THR 152 N -1.08 3.15 0.39 5.04 -4.23 -1.26 -0.89 115.64 116.75 1bxt s THR 152 Ca 0.16 0.85 0.09 0.00 -1.18 0.00 0.00 61.69 61.61 1bxt s THR 152 Cb -0.10 -3.42 0.17 0.00 1.34 0.00 0.00 72.50 70.49 1bxt s THR 152 CO 0.08 -0.02 1.93 0.58 -0.54 0.00 0.00 174.62 176.65 1bxt h VAL 153 N 1.84 1.16 -0.42 2.29 2.07 -1.29 -2.60 116.25 119.30 1bxt h VAL 153 Ca -0.49 -0.70 0.05 0.00 0.82 0.00 0.00 66.70 66.38 1bxt h VAL 153 Cb 1.25 1.12 -0.05 0.00 -1.52 0.00 0.00 31.29 32.09 1bxt h VAL 153 CO 0.60 0.22 0.16 -0.61 0.02 0.00 0.00 177.57 177.96 1bxt h GLN 154 N 0.27 0.32 -0.85 1.57 4.15 -1.90 0.24 115.11 118.90 1bxt h GLN 154 Ca 0.06 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.46 1bxt h GLN 154 Cb 0.32 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 27.89 1bxt h GLN 154 CO 0.02 0.21 0.54 1.49 -1.93 0.00 0.00 178.83 179.15 1bxt h GLU 155 N 0.32 1.14 -0.35 1.69 4.81 -1.69 0.17 114.58 120.66 1bxt h GLU 155 Ca 0.19 -0.09 -0.16 0.00 -0.13 0.00 0.00 59.36 59.17 1bxt h GLU 155 Cb 0.17 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 29.30 1bxt h GLU 155 CO -0.19 0.77 -0.42 -0.07 -0.73 0.00 0.00 179.01 178.38 1bxt h LEU 156 N 1.16 0.98 0.19 1.64 3.38 -1.22 -2.23 115.31 119.21 1bxt h LEU 156 Ca 0.31 -0.49 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 1bxt h LEU 156 Cb -0.09 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.39 1bxt h LEU 156 CO -0.06 1.27 -0.09 -0.78 0.09 0.00 0.00 178.44 178.86 1bxt h ASP 157 N 0.71 -0.21 -0.33 -0.43 3.58 -0.03 -1.58 116.42 118.12 1bxt h ASP 157 Ca 0.05 -0.08 0.07 0.00 0.42 0.00 0.00 57.03 57.48 1bxt h ASP 157 Cb 1.02 0.06 -0.07 0.00 1.72 0.00 0.00 39.33 42.05 1bxt h ASP 157 CO 0.10 -0.05 -0.13 0.00 -2.88 0.00 0.00 179.24 176.28 1bxt h LYS 159 N -0.07 0.45 -0.11 0.00 1.57 -1.34 -1.69 116.57 115.37 1bxt h LYS 159 Ca 0.17 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.78 1bxt h LYS 159 Cb 0.32 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1bxt h LYS 159 CO -0.38 0.51 -0.21 1.15 -0.57 0.00 0.00 179.45 179.96 1bxt h THR 160 N 0.43 1.38 -0.33 -0.16 2.02 -0.42 -3.09 112.91 112.73 1bxt h THR 160 Ca 0.09 -1.47 -0.07 0.00 0.77 0.00 0.00 66.41 65.73 1bxt h THR 160 Cb 0.35 2.07 -0.02 0.00 -1.74 0.00 0.00 68.15 68.81 1bxt h THR 160 CO 0.01 0.43 -0.07 0.03 0.37 0.00 0.00 175.52 176.29 1bxt h ARG 161 N -0.09 0.55 -0.60 6.66 3.08 -0.88 -1.28 114.38 121.83 1bxt h ARG 161 Ca 0.01 -0.15 0.02 0.00 0.07 0.00 0.00 59.98 59.93 1bxt h ARG 161 Cb 0.78 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.74 1bxt h ARG 161 CO 0.05 0.63 0.38 -0.22 -1.07 0.00 0.00 179.97 179.74 1bxt h LYS 162 N 0.52 0.75 -0.37 0.04 3.64 -1.31 0.31 116.57 120.14 1bxt h LYS 162 Ca 0.10 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.31 1bxt h LYS 162 Cb 0.44 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1bxt h LYS 162 CO 0.02 0.49 -0.27 0.82 -2.27 0.00 0.00 179.45 178.24 1bxt h ILE 163 N 0.77 1.28 -0.07 2.00 1.08 -1.38 -1.75 117.51 119.43 1bxt h ILE 163 Ca 0.23 -1.41 -0.06 0.00 -0.39 0.00 0.00 64.86 63.23 1bxt h ILE 163 Cb -0.04 1.28 -0.01 0.00 -3.07 0.00 0.00 36.82 34.98 1bxt h ILE 163 CO -0.07 0.47 -0.24 -0.07 -0.69 0.00 0.00 178.15 177.55 1bxt h LEU 164 N 0.67 0.11 -0.01 1.44 3.38 -0.55 0.28 115.31 120.63 1bxt h LEU 164 Ca 0.08 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 1bxt h LEU 164 Cb 0.80 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.53 1bxt h LEU 164 CO 0.07 0.36 -0.34 0.58 0.09 0.00 0.00 178.44 179.20 1bxt h VAL 165 N 0.11 1.51 -0.16 1.22 2.07 -0.77 0.48 116.25 120.71 1bxt h VAL 165 Ca 0.02 -1.96 -0.09 0.00 0.82 0.00 0.00 66.70 65.48 1bxt h VAL 165 Cb 0.49 2.70 -0.01 0.00 -1.52 0.00 0.00 31.29 32.94 1bxt h VAL 165 CO 0.03 0.55 -0.30 0.28 0.02 0.00 0.00 177.57 178.15 1bxt h SER 166 N -0.39 0.31 0.00 0.57 0.02 -1.08 -2.69 113.55 110.30 1bxt h SER 166 Ca -0.04 -0.11 -0.27 0.00 -0.84 0.00 0.00 61.79 60.53 1bxt h SER 166 Cb 1.08 -0.08 -0.05 0.00 0.14 0.00 0.00 62.40 63.48 1bxt h SER 166 CO 0.07 0.61 -2.03 0.54 -1.14 0.00 0.00 176.83 174.87 1bxt n ARG 167 N -4.11 1.28 -0.03 3.45 1.74 0.96 -4.72 116.66 115.22 1bxt n ARG 167 Ca -0.01 0.02 0.04 0.00 -0.77 0.00 0.00 57.85 57.14 1bxt n ARG 167 Cb 0.41 -1.38 0.06 0.00 -1.02 0.00 0.00 32.46 30.53 1bxt n ARG 167 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1bxt n LYS 168 N -2.69 2.25 -3.48 5.56 4.76 0.08 -4.99 118.16 119.66 1bxt n LYS 168 Ca -0.27 -1.98 -0.25 0.00 -2.87 0.00 0.00 58.31 52.95 1bxt n LYS 168 Cb 0.95 -1.22 -0.00 0.00 -1.84 0.00 0.00 35.03 32.91 1bxt n LYS 168 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1bxt n ASN 169 N -0.91 -3.76 -0.29 4.39 4.13 -0.89 -4.80 115.26 113.13 1bxt n ASN 169 Ca 0.07 -0.48 0.08 0.00 1.68 0.00 0.00 54.58 55.93 1bxt n ASN 169 Cb 0.42 -3.10 0.20 0.00 -1.54 0.00 0.00 39.78 35.76 1bxt n ASN 169 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 1bxt h LEU 170 N -1.10 -0.43 -8.25 3.41 5.85 -1.52 -3.38 115.31 109.90 1bxt h LEU 170 Ca -0.46 0.23 -0.60 0.00 0.84 0.00 0.00 57.88 57.90 1bxt h LEU 170 Cb 1.30 0.41 -0.32 0.00 0.37 0.00 0.00 40.66 42.42 1bxt h LEU 170 CO 0.57 -0.24 -0.85 -0.31 -0.34 0.00 0.00 178.44 177.27 1bxt s TYR 171 N -6.09 1.94 0.50 1.25 2.02 -1.26 -4.48 117.35 111.23 1bxt s TYR 171 Ca -0.13 -0.64 0.04 0.00 -0.37 0.00 0.00 57.07 55.97 1bxt s TYR 171 Cb 0.25 -1.32 -0.00 0.00 -0.40 0.00 0.00 41.96 40.49 1bxt s TYR 171 CO 0.76 -0.24 0.21 -1.21 -1.57 0.00 0.00 175.55 173.50 1bxt s GLU 172 N 0.17 2.22 0.21 -0.62 2.02 0.03 -4.95 118.70 117.78 1bxt s GLU 172 Ca -0.09 -2.11 -0.08 0.00 0.02 0.00 0.00 54.97 52.72 1bxt s GLU 172 Cb -0.14 -1.87 0.15 0.00 0.10 0.00 0.00 34.13 32.37 1bxt s GLU 172 CO 0.04 -0.39 1.78 0.35 0.02 0.00 0.00 175.26 177.05 1bxt h PHE 173 N 1.14 1.18 0.00 1.61 3.57 -1.95 -3.16 116.94 119.33 1bxt h PHE 173 Ca -0.41 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.00 1bxt h PHE 173 Cb 1.29 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 39.68 1bxt h PHE 173 CO 1.07 0.89 -0.11 -0.91 -2.23 0.00 0.00 178.31 177.02 1bxt h ASN 174 N 1.13 0.00 0.00 0.41 2.35 -1.91 0.24 115.58 117.79 1bxt h ASN 174 Ca 0.26 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.01 1bxt h ASN 174 Cb 0.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1bxt h ASN 174 CO -0.02 0.28 0.00 -3.20 -1.65 0.00 0.00 177.43 172.83 1bxt n ASN 175 N -3.26 0.21 -3.85 5.81 2.85 -1.26 -1.20 115.26 114.55 1bxt n ASN 175 Ca -0.02 0.00 -0.12 0.00 -0.11 0.00 0.00 54.58 54.34 1bxt n ASN 175 Cb 0.06 0.00 -0.12 0.00 1.24 0.00 0.00 39.78 40.95 1bxt n ASN 175 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1bxt s SER 176 N 1.04 -0.06 0.43 1.20 0.15 -1.26 -0.79 113.70 114.41 1bxt s SER 176 Ca 0.00 0.10 0.29 0.00 0.70 0.00 0.00 55.95 57.04 1bxt s SER 176 Cb 0.00 0.21 1.57 0.00 -1.71 0.00 0.00 66.02 66.08 1bxt s SER 176 CO 0.00 -0.11 1.89 1.55 1.20 0.00 0.00 173.24 177.78 1bxt h PRO 177 N 5.63 0.00 -5.90 5.44 0.14 -1.78 -3.42 132.00 132.10 1bxt h PRO 177 Ca -0.26 0.00 -0.67 0.00 0.14 0.00 0.00 66.00 65.21 1bxt h PRO 177 Cb 1.20 0.00 -0.18 0.00 0.14 0.00 0.00 31.00 32.17 1bxt h PRO 177 CO 0.43 0.00 -0.65 0.71 0.14 0.00 0.00 178.00 178.63 1bxt s TYR 178 N -3.73 3.06 -0.08 1.56 2.02 -1.26 -2.31 117.35 116.60 1bxt s TYR 178 Ca -0.03 0.04 -0.25 0.00 -0.37 0.00 0.00 57.07 56.46 1bxt s TYR 178 Cb 0.08 -1.80 -0.21 0.00 -0.40 0.00 0.00 41.96 39.64 1bxt s TYR 178 CO 0.27 0.33 0.94 1.49 -1.57 0.00 0.00 175.55 177.01 1bxt h GLU 179 N 5.49 -0.04 -5.55 -0.62 4.57 -1.18 -3.41 114.58 113.83 1bxt h GLU 179 Ca -0.46 0.00 -0.46 0.00 -1.18 0.00 0.00 59.36 57.26 1bxt h GLU 179 Cb 1.18 0.01 -0.14 0.00 -0.16 0.00 0.00 28.75 29.64 1bxt h GLU 179 CO 0.55 0.62 -0.72 0.95 -1.18 0.00 0.00 179.01 179.23 1bxt s THR 180 N -3.17 1.72 -0.29 0.32 -4.23 -1.25 -0.67 115.64 108.07 1bxt s THR 180 Ca -0.16 -2.19 -0.18 0.00 -1.18 0.00 0.00 61.69 57.98 1bxt s THR 180 Cb -0.01 -2.14 0.15 0.00 1.34 0.00 0.00 72.50 71.84 1bxt s THR 180 CO 0.62 -0.52 1.03 -0.83 -0.54 0.00 0.00 174.62 174.37 1bxt s GLY 181 N -3.35 0.05 0.03 3.99 0.00 -1.26 -1.86 107.32 104.92 1bxt s GLY 181 Ca 0.24 3.14 -0.02 0.00 0.00 0.00 0.00 44.72 48.09 1bxt s GLY 181 CO 0.08 2.45 0.01 -2.52 0.00 0.00 0.00 173.10 173.11 1bxt s TYR 182 N 1.06 0.27 -0.15 1.90 1.13 -0.56 -0.40 117.35 120.61 1bxt s TYR 182 Ca -0.06 -0.58 -0.01 0.00 -1.41 0.00 0.00 57.07 55.01 1bxt s TYR 182 Cb -0.04 -0.20 -0.01 0.00 -1.10 0.00 0.00 41.96 40.61 1bxt s TYR 182 CO -0.13 -0.26 -0.12 -1.50 -2.51 0.00 0.00 175.55 171.03 1bxt s ILE 183 N -2.07 3.02 -0.09 -3.49 2.07 -0.81 -0.92 121.20 118.90 1bxt s ILE 183 Ca -0.10 -0.66 0.01 0.00 -1.41 0.00 0.00 60.65 58.49 1bxt s ILE 183 Cb -0.05 -2.29 -0.02 0.00 0.13 0.00 0.00 42.46 40.23 1bxt s ILE 183 CO -0.03 0.51 -0.12 -0.75 -1.91 0.00 0.00 174.94 172.64 1bxt s LYS 184 N 0.65 3.01 -0.10 3.50 2.20 0.13 -1.30 119.74 127.82 1bxt s LYS 184 Ca -0.07 -0.66 0.01 0.00 -0.36 0.00 0.00 55.97 54.89 1bxt s LYS 184 Cb -0.15 -2.55 -0.02 0.00 -1.51 0.00 0.00 37.83 33.59 1bxt s LYS 184 CO 0.03 0.42 -0.12 -0.06 -0.36 0.00 0.00 175.35 175.25 1bxt s PHE 185 N -0.18 2.80 -0.11 4.03 0.40 -0.04 -0.95 117.98 123.93 1bxt s PHE 185 Ca 0.00 -0.41 0.01 0.00 -0.60 0.00 0.00 56.93 55.94 1bxt s PHE 185 Cb -0.13 -1.77 0.02 0.00 0.51 0.00 0.00 43.02 41.64 1bxt s PHE 185 CO 0.03 -0.03 -0.13 0.42 0.70 0.00 0.00 175.22 176.22 1bxt s ILE 186 N -0.09 1.35 0.55 0.64 1.09 -0.48 -2.02 121.20 122.24 1bxt s ILE 186 Ca -0.01 -0.53 -0.03 0.00 -1.10 0.00 0.00 60.65 58.98 1bxt s ILE 186 Cb -0.14 -1.26 0.01 0.00 -1.06 0.00 0.00 42.46 40.01 1bxt s ILE 186 CO 0.03 0.41 0.81 -1.61 -0.10 0.00 0.00 174.94 174.49 1bxt s GLU 187 N 1.21 2.85 0.44 2.79 2.02 0.15 -1.43 118.70 126.73 1bxt s GLU 187 Ca -0.03 -0.31 0.24 0.00 0.02 0.00 0.00 54.97 54.89 1bxt s GLU 187 Cb -0.14 -2.40 1.25 0.00 0.10 0.00 0.00 34.13 32.94 1bxt s GLU 187 CO -0.04 -0.60 1.79 0.66 0.02 0.00 0.00 175.26 177.09 1bxt h SER 188 N 0.03 0.30 0.56 -0.19 4.64 -1.86 0.30 113.55 117.33 1bxt h SER 188 Ca -0.45 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1bxt h SER 188 Cb 1.27 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1bxt h SER 188 CO 0.58 0.06 0.00 -1.54 -0.87 0.00 0.00 176.83 175.06 1bxt n SER 189 N -4.49 0.00 0.00 4.97 3.41 -1.26 -4.84 113.62 111.40 1bxt n SER 189 Ca 0.25 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 59.28 1bxt n SER 189 Cb 0.98 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 1bxt n SER 189 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bxt n GLY 190 N 0.31 2.14 3.75 5.00 0.00 0.11 -5.04 105.19 111.46 1bxt n GLY 190 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 1bxt n GLY 190 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bxt s ASP 191 N -1.46 6.38 0.14 1.61 1.01 -1.25 -4.69 116.67 118.41 1bxt s ASP 191 Ca 0.00 2.96 -0.01 0.00 0.71 0.00 0.00 52.55 56.21 1bxt s ASP 191 Cb 0.00 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.25 1bxt s ASP 191 CO 0.00 -0.90 0.06 -0.94 0.21 0.00 0.00 175.17 173.60 1bxt s SER 192 N 0.38 0.40 0.16 0.27 1.04 -1.26 -0.68 113.70 114.01 1bxt s SER 192 Ca 0.61 -1.23 -0.19 0.00 0.48 0.00 0.00 55.95 55.63 1bxt s SER 192 Cb -0.47 0.28 0.04 0.00 0.10 0.00 0.00 66.02 65.97 1bxt s SER 192 CO 0.50 -0.72 0.52 0.72 0.98 0.00 0.00 173.24 175.24 1bxt s PHE 193 N -4.02 -0.29 0.08 5.02 -0.71 -0.85 -0.33 117.98 116.88 1bxt s PHE 193 Ca 0.26 -0.01 -0.04 0.00 -1.04 0.00 0.00 56.93 56.09 1bxt s PHE 193 Cb 0.07 0.42 -0.02 0.00 -1.21 0.00 0.00 43.02 42.28 1bxt s PHE 193 CO 0.03 -0.84 0.08 1.67 -1.34 0.00 0.00 175.22 174.82 1bxt s TRP 194 N -3.81 0.39 -0.01 3.49 1.48 -1.26 -0.86 118.94 118.35 1bxt s TRP 194 Ca 0.05 -0.87 0.07 0.00 -1.06 0.00 0.00 56.10 54.29 1bxt s TRP 194 Cb -0.00 -0.25 -0.02 0.00 -1.16 0.00 0.00 33.47 32.04 1bxt s TRP 194 CO -0.09 -0.47 -0.22 0.71 -4.06 0.00 0.00 176.95 172.82 1bxt s TYR 195 N -3.91 1.98 -0.13 1.66 2.02 -0.42 -4.96 117.35 113.59 1bxt s TYR 195 Ca 0.08 -0.37 -0.29 0.00 -0.37 0.00 0.00 57.07 56.11 1bxt s TYR 195 Cb 0.06 -1.26 -0.01 0.00 -0.40 0.00 0.00 41.96 40.35 1bxt s TYR 195 CO -0.09 -0.02 1.05 0.34 -1.57 0.00 0.00 175.55 175.26 1bxt s ASP 196 N -0.59 7.18 0.00 2.29 -1.08 -1.26 -1.93 116.67 121.28 1bxt s ASP 196 Ca 0.09 1.53 0.26 0.00 -0.52 0.00 0.00 52.55 53.91 1bxt s ASP 196 Cb -0.09 -2.55 0.78 0.00 -1.46 0.00 0.00 42.92 39.61 1bxt s ASP 196 CO -0.01 -0.53 1.59 0.23 0.52 0.00 0.00 175.17 176.97 1bxt n MET 197 N 5.42 0.49 -3.86 4.34 2.81 0.47 -4.90 117.12 121.90 1bxt n MET 197 Ca 0.10 -0.26 -0.32 0.00 -1.81 0.00 0.00 57.70 55.41 1bxt n MET 197 Cb 0.48 -1.49 -0.04 0.00 -0.71 0.00 0.00 33.22 31.45 1bxt n MET 197 CO 0.00 0.00 0.00 -1.64 1.51 0.00 0.00 175.97 175.84 1bxt s MET 198 N -2.69 3.48 0.66 0.03 -1.94 -1.25 -4.98 119.30 112.61 1bxt s MET 198 Ca 0.20 -0.31 -0.13 0.00 -1.71 0.00 0.00 55.69 53.74 1bxt s MET 198 Cb 0.19 -3.04 -0.01 0.00 2.01 0.00 0.00 34.83 33.99 1bxt s MET 198 CO 0.57 0.61 1.07 -1.25 -0.01 0.00 0.00 175.02 176.01 1bxt s PRO 199 N -2.26 3.01 0.67 2.03 0.04 -1.26 -4.79 135.00 132.45 1bxt s PRO 199 Ca 0.33 1.13 -0.16 0.00 0.04 0.00 0.00 61.00 62.34 1bxt s PRO 199 Cb -0.13 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.43 1bxt s PRO 199 CO 0.23 -1.05 1.17 0.00 0.04 0.00 0.00 177.00 177.39 1bxt s ALA 200 N -2.70 2.34 0.82 8.56 0.00 -1.26 -4.61 121.76 124.90 1bxt s ALA 200 Ca 0.62 0.77 -0.12 0.00 0.00 0.00 0.00 51.96 53.23 1bxt s ALA 200 Cb -0.16 -3.41 0.09 0.00 0.00 0.00 0.00 23.12 19.65 1bxt s ALA 200 CO 0.46 -1.49 1.17 -1.25 0.00 0.00 0.00 175.76 174.65 1bxt s PRO 201 N -3.86 1.59 0.00 0.00 0.04 -1.26 -4.69 135.00 126.82 1bxt s PRO 201 Ca 0.72 1.61 0.00 0.00 0.04 0.00 0.00 61.00 63.37 1bxt s PRO 201 Cb -0.26 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.50 1bxt s PRO 201 CO 0.41 -2.22 0.00 0.41 0.04 0.00 0.00 177.00 175.64 1bxt n GLY 202 N 0.17 -0.02 0.54 0.56 0.00 -0.61 -4.81 105.19 101.02 1bxt n GLY 202 Ca 0.12 -2.28 0.11 0.00 0.00 0.00 0.00 46.02 43.97 1bxt n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bxt n ALA 203 N -0.76 3.41 -2.78 4.61 0.00 -1.26 0.25 120.51 123.97 1bxt n ALA 203 Ca 0.00 -0.64 -0.33 0.00 0.00 0.00 0.00 53.44 52.47 1bxt n ALA 203 Cb 0.00 -0.77 -0.14 0.00 0.00 0.00 0.00 19.45 18.54 1bxt n ALA 203 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1bxt s ILE 204 N -2.37 3.02 -0.25 0.00 2.07 -1.26 -3.39 121.20 119.00 1bxt s ILE 204 Ca 0.19 -0.71 -0.01 0.00 -1.41 0.00 0.00 60.65 58.71 1bxt s ILE 204 Cb 0.18 -2.22 0.03 0.00 0.13 0.00 0.00 42.46 40.58 1bxt s ILE 204 CO 0.53 0.56 -0.07 0.12 -1.91 0.00 0.00 174.94 174.17 1bxt s PHE 205 N -0.19 3.10 -0.53 3.50 5.36 -1.26 -4.90 117.98 123.06 1bxt s PHE 205 Ca -0.00 -1.70 -0.20 0.00 -0.96 0.00 0.00 56.93 54.07 1bxt s PHE 205 Cb -0.13 -2.04 0.07 0.00 -0.34 0.00 0.00 43.02 40.57 1bxt s PHE 205 CO 0.03 -0.76 0.68 0.34 -1.46 0.00 0.00 175.22 174.05 1bxt s ASP 206 N 1.28 6.22 0.08 6.13 -1.08 -1.26 -4.94 116.67 123.11 1bxt s ASP 206 Ca -0.02 -0.96 -0.22 0.00 -0.52 0.00 0.00 52.55 50.83 1bxt s ASP 206 Cb -0.17 -2.31 -0.12 0.00 -1.46 0.00 0.00 42.92 38.85 1bxt s ASP 206 CO -0.04 -0.98 1.67 1.56 0.52 0.00 0.00 175.17 177.89 1bxt h GLN 207 N 9.08 0.13 -0.07 4.34 4.20 -1.97 -0.26 115.11 130.55 1bxt h GLN 207 Ca -0.28 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.44 1bxt h GLN 207 Cb 1.09 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.84 1bxt h GLN 207 CO 1.01 0.18 0.05 0.66 -0.67 0.00 0.00 178.83 180.06 1bxt h SER 208 N 0.04 0.00 0.26 1.46 4.64 -1.99 -1.07 113.55 116.90 1bxt h SER 208 Ca 0.03 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.01 1bxt h SER 208 Cb 0.09 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.21 1bxt h SER 208 CO -0.00 0.00 -1.56 0.50 -0.87 0.00 0.00 176.83 174.90 1bxt h LYS 209 N 0.00 0.48 -0.15 4.77 3.64 -1.88 -3.32 116.57 120.12 1bxt h LYS 209 Ca 0.03 -0.82 -0.02 0.00 -1.27 0.00 0.00 60.65 58.57 1bxt h LYS 209 Cb 0.14 0.31 -0.01 0.00 -0.41 0.00 0.00 32.23 32.26 1bxt h LYS 209 CO -0.00 1.39 0.01 -0.92 -2.27 0.00 0.00 179.45 177.66 1bxt h TYR 210 N 0.13 0.28 0.00 1.91 3.20 -0.34 -2.99 116.97 119.16 1bxt h TYR 210 Ca -0.28 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.55 1bxt h TYR 210 Cb 2.14 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 40.34 1bxt h TYR 210 CO 0.12 0.46 0.00 1.28 -1.64 0.00 0.00 178.16 178.38 1bxt n LEU 211 N -4.77 0.00 0.29 2.82 4.77 -0.47 -2.84 117.00 116.79 1bxt n LEU 211 Ca -0.05 0.29 0.16 0.00 -0.03 0.00 0.00 56.01 56.38 1bxt n LEU 211 Cb 0.20 -0.29 0.91 0.00 -2.33 0.00 0.00 43.42 41.91 1bxt n LEU 211 CO 0.36 -0.20 1.08 0.24 -1.33 0.00 0.00 177.39 177.54 1bxt h MET 212 N 0.00 0.00 0.00 3.23 2.86 -1.62 -1.36 114.93 118.04 1bxt h MET 212 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1bxt h MET 212 Cb 0.09 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.75 1bxt h MET 212 CO 0.00 0.04 0.13 1.37 1.06 0.00 0.00 176.91 179.51 1bxt h LEU 213 N 0.00 0.00 -1.85 1.22 -0.00 -1.75 -0.82 115.31 112.10 1bxt h LEU 213 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1bxt h LEU 213 Cb 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.81 1bxt h LEU 213 CO 0.01 0.00 0.00 -1.22 -0.00 0.00 0.00 178.44 177.23 1bxt n TYR 214 N -2.80 0.36 1.60 0.17 4.01 -0.51 -4.41 117.16 115.59 1bxt n TYR 214 Ca -0.02 -0.18 0.13 0.00 -0.16 0.00 0.00 57.90 57.67 1bxt n TYR 214 Cb 0.18 0.00 0.77 0.00 -0.31 0.00 0.00 39.34 39.98 1bxt n TYR 214 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1bxt n ASN 215 N 1.06 0.00 -0.15 7.72 6.94 -0.32 -2.25 115.26 128.27 1bxt n ASN 215 Ca 0.18 -0.76 0.13 0.00 -0.02 0.00 0.00 54.58 54.11 1bxt n ASN 215 Cb 0.51 -0.02 0.39 0.00 -2.36 0.00 0.00 39.78 38.29 1bxt n ASN 215 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1bxt n ASP 216 N -1.02 0.77 -2.96 0.53 5.75 -1.26 -0.46 116.55 117.90 1bxt n ASP 216 Ca 0.19 -0.62 -0.20 0.00 -0.01 0.00 0.00 54.79 54.15 1bxt n ASP 216 Cb 0.10 0.11 0.01 0.00 -1.03 0.00 0.00 41.12 40.31 1bxt n ASP 216 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1bxt n ASN 217 N -0.95 -4.63 -4.72 -1.12 5.15 -0.95 -4.87 115.26 103.16 1bxt n ASN 217 Ca 0.11 -0.18 -0.43 0.00 -0.60 0.00 0.00 54.58 53.48 1bxt n ASN 217 Cb 0.33 -3.82 -0.03 0.00 -0.53 0.00 0.00 39.78 35.73 1bxt n ASN 217 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1bxt n LYS 218 N -3.53 2.64 -4.27 1.20 3.00 -1.26 -4.90 118.16 111.04 1bxt n LYS 218 Ca -0.09 0.95 -0.17 0.00 -0.00 0.00 0.00 58.31 58.99 1bxt n LYS 218 Cb 0.59 -2.75 -0.11 0.00 0.00 0.00 0.00 35.03 32.76 1bxt n LYS 218 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1bxt s THR 219 N 0.66 1.38 0.22 3.15 -4.23 -1.26 -0.76 115.64 114.80 1bxt s THR 219 Ca 0.71 -1.93 -0.03 0.00 -1.18 0.00 0.00 61.69 59.26 1bxt s THR 219 Cb -0.53 -1.74 -0.03 0.00 1.34 0.00 0.00 72.50 71.53 1bxt s THR 219 CO 0.39 -0.56 0.21 0.68 -0.54 0.00 0.00 174.62 174.81 1bxt s VAL 220 N -2.69 0.00 -0.05 2.29 -7.23 -0.07 -4.88 120.40 107.77 1bxt s VAL 220 Ca 0.14 -1.88 -0.30 0.00 -1.81 0.00 0.00 61.98 58.13 1bxt s VAL 220 Cb -0.02 -2.45 -0.02 0.00 0.56 0.00 0.00 36.38 34.45 1bxt s VAL 220 CO 0.03 0.00 1.04 -0.55 -0.31 0.00 0.00 175.10 175.31 1bxt s SER 221 N -3.15 7.25 0.31 4.85 0.15 -1.26 -1.05 113.70 120.80 1bxt s SER 221 Ca 0.36 1.64 0.25 0.00 0.70 0.00 0.00 55.95 58.90 1bxt s SER 221 Cb 0.05 -2.56 1.08 0.00 -1.71 0.00 0.00 66.02 62.88 1bxt s SER 221 CO 0.13 -0.41 1.76 0.77 1.20 0.00 0.00 173.24 176.68 1bxt h SER 222 N 7.03 0.00 -0.42 5.45 4.64 -1.24 -2.37 113.55 126.64 1bxt h SER 222 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 1bxt h SER 222 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1bxt h SER 222 CO 0.82 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.24 1bxt n SER 223 N -2.37 3.27 -2.67 4.97 3.41 -1.26 -4.50 113.62 114.46 1bxt n SER 223 Ca 0.01 -1.94 -0.08 0.00 -0.26 0.00 0.00 58.87 56.61 1bxt n SER 223 Cb 0.22 -0.27 0.04 0.00 -0.26 0.00 0.00 64.21 63.94 1bxt n SER 223 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bxt n ALA 224 N 1.19 3.14 -2.90 7.33 0.00 -0.90 -5.09 120.51 123.28 1bxt n ALA 224 Ca 0.17 -2.90 -0.12 0.00 0.00 0.00 0.00 53.44 50.59 1bxt n ALA 224 Cb 0.53 -0.94 -0.14 0.00 0.00 0.00 0.00 19.45 18.89 1bxt n ALA 224 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1bxt s ILE 225 N -2.77 -0.00 0.07 0.00 1.10 -1.21 -3.08 121.20 115.30 1bxt s ILE 225 Ca 0.26 0.01 0.09 0.00 -0.51 0.00 0.00 60.65 60.50 1bxt s ILE 225 Cb 0.45 -0.01 -0.03 0.00 0.15 0.00 0.00 42.46 43.01 1bxt s ILE 225 CO 0.02 0.00 -0.25 0.00 -2.11 0.00 0.00 174.94 172.61 1bxt s ALA 226 N 0.04 2.15 -0.03 1.50 0.00 -0.51 -4.64 121.76 120.27 1bxt s ALA 226 Ca -0.00 -1.27 0.04 0.00 0.00 0.00 0.00 51.96 50.73 1bxt s ALA 226 Cb -0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 23.12 22.70 1bxt s ALA 226 CO -0.00 0.49 -0.16 0.42 0.00 0.00 0.00 175.76 176.51 1bxt s ILE 227 N -0.88 1.30 -0.05 0.00 1.01 -1.09 -1.38 121.20 120.11 1bxt s ILE 227 Ca 0.11 -0.67 0.02 0.00 0.00 0.00 0.00 60.65 60.10 1bxt s ILE 227 Cb -0.10 -1.10 0.02 0.00 0.01 0.00 0.00 42.46 41.29 1bxt s ILE 227 CO 0.03 0.37 -0.08 -1.61 0.00 0.00 0.00 174.94 173.66 1bxt s GLU 228 N -0.15 1.10 -0.19 2.79 2.02 -0.13 -1.41 118.70 122.73 1bxt s GLU 228 Ca 0.01 -0.23 -0.03 0.00 0.02 0.00 0.00 54.97 54.74 1bxt s GLU 228 Cb -0.09 -1.00 -0.02 0.00 0.10 0.00 0.00 34.13 33.12 1bxt s GLU 228 CO 0.01 -0.01 -0.05 0.08 0.02 0.00 0.00 175.26 175.31 1bxt s VAL 229 N 0.68 3.49 -0.23 2.63 1.01 0.71 0.17 120.40 128.86 1bxt s VAL 229 Ca -0.11 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.40 1bxt s VAL 229 Cb -0.14 -2.55 0.03 0.00 0.00 0.00 0.00 36.38 33.72 1bxt s VAL 229 CO 0.01 0.46 -0.12 -1.00 0.00 0.00 0.00 175.10 174.45 1bxt s HIS 230 N 0.97 3.03 0.19 5.22 3.76 -0.10 0.51 115.29 128.86 1bxt s HIS 230 Ca -0.00 -1.77 0.10 0.00 -0.15 0.00 0.00 55.06 53.23 1bxt s HIS 230 Cb -0.15 -1.98 -0.04 0.00 1.11 0.00 0.00 32.58 31.52 1bxt s HIS 230 CO 0.01 -0.79 -0.20 -0.51 -0.85 0.00 0.00 174.74 172.39 1bxt s LEU 231 N 1.26 2.45 -0.08 0.89 1.43 0.28 -1.49 118.68 123.43 1bxt s LEU 231 Ca -0.01 -0.88 0.05 0.00 -1.03 0.00 0.00 54.13 52.26 1bxt s LEU 231 Cb -0.16 -0.97 -0.00 0.00 0.03 0.00 0.00 46.19 45.08 1bxt s LEU 231 CO -0.07 0.03 -0.24 0.42 0.23 0.00 0.00 176.35 176.72 1bxt s THR 232 N -1.96 2.00 0.33 5.49 -4.23 -0.78 -0.33 115.64 116.16 1bxt s THR 232 Ca 0.19 -1.01 -0.22 0.00 -1.18 0.00 0.00 61.69 59.46 1bxt s THR 232 Cb -0.06 -1.71 -0.10 0.00 1.34 0.00 0.00 72.50 71.97 1bxt s THR 232 CO 0.08 0.55 0.88 -0.54 -0.54 0.00 0.00 174.62 175.06 1bxt s LYS 233 N 0.10 4.37 0.00 3.99 1.02 -1.26 -0.71 119.74 127.24 1bxt s LYS 233 Ca -0.11 1.12 0.31 0.00 0.02 0.00 0.00 55.97 57.31 1bxt s LYS 233 Cb -0.16 -2.62 1.60 0.00 -0.52 0.00 0.00 37.83 36.13 1bxt s LYS 233 CO 0.06 0.21 2.06 1.63 -0.92 0.00 0.00 175.35 178.39