#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bxr s LYS 3 N 0.00 3.20 0.81 9.51 1.02 -1.26 -5.04 119.74 127.98 1bxr s LYS 3 Ca 0.00 -0.63 -0.12 0.00 0.02 0.00 0.00 55.97 55.24 1bxr s LYS 3 Cb 0.00 -4.03 0.08 0.00 -0.52 0.00 0.00 37.83 33.36 1bxr s LYS 3 CO 0.00 -1.14 1.12 -1.12 -0.92 0.00 0.00 175.35 173.29 1bxr s SER 4 N 2.39 4.40 -0.03 2.83 0.01 -1.25 -0.95 113.70 121.09 1bxr s SER 4 Ca 0.19 1.08 -0.29 0.00 1.31 0.00 0.00 55.95 58.24 1bxr s SER 4 Cb -0.17 -1.73 0.10 0.00 0.21 0.00 0.00 66.02 64.43 1bxr s SER 4 CO 0.15 -2.00 0.85 0.00 0.41 0.00 0.00 173.24 172.65 1bxr s ALA 5 N -3.31 -1.82 -0.12 1.44 0.00 -1.24 -2.32 121.76 114.39 1bxr s ALA 5 Ca 0.61 1.14 -0.29 0.00 0.00 0.00 0.00 51.96 53.42 1bxr s ALA 5 Cb -0.13 0.13 0.07 0.00 0.00 0.00 0.00 23.12 23.19 1bxr s ALA 5 CO 0.52 -0.56 0.72 -1.17 0.00 0.00 0.00 175.76 175.27 1bxr s LEU 6 N -1.99 -0.66 -0.09 0.00 2.96 -0.65 -1.82 118.68 116.43 1bxr s LEU 6 Ca 0.01 0.90 0.03 0.00 -0.22 0.00 0.00 54.13 54.84 1bxr s LEU 6 Cb -0.01 2.47 -0.01 0.00 0.50 0.00 0.00 46.19 49.14 1bxr s LEU 6 CO -0.04 -0.49 -0.19 -0.22 -1.32 0.00 0.00 176.35 174.09 1bxr s LEU 7 N -0.74 2.42 -0.04 -0.68 2.96 0.11 -0.18 118.68 122.53 1bxr s LEU 7 Ca -0.07 -0.41 0.02 0.00 -0.22 0.00 0.00 54.13 53.45 1bxr s LEU 7 Cb -0.01 -1.50 0.01 0.00 0.50 0.00 0.00 46.19 45.19 1bxr s LEU 7 CO 0.07 0.21 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.53 1bxr s VAL 8 N 0.07 0.82 0.43 1.68 1.01 -0.60 0.89 120.40 124.71 1bxr s VAL 8 Ca -0.08 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.57 1bxr s VAL 8 Cb -0.15 -0.75 -0.00 0.00 0.00 0.00 0.00 36.38 35.47 1bxr s VAL 8 CO 0.05 0.27 0.62 -0.76 0.00 0.00 0.00 175.10 175.29 1bxr s LEU 9 N 0.42 3.71 0.18 3.92 1.43 0.84 -1.50 118.68 127.68 1bxr s LEU 9 Ca -0.07 0.13 -0.19 0.00 -1.03 0.00 0.00 54.13 52.97 1bxr s LEU 9 Cb -0.11 -3.03 0.12 0.00 0.03 0.00 0.00 46.19 43.20 1bxr s LEU 9 CO 0.01 -0.66 1.62 -0.33 0.23 0.00 0.00 176.35 177.22 1bxr h GLU 10 N 0.51 -0.12 0.00 1.70 5.08 -1.62 0.59 114.58 120.72 1bxr h GLU 10 Ca -0.46 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1bxr h GLU 10 Cb 1.26 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1bxr h GLU 10 CO 0.56 -0.08 0.02 -0.40 -1.00 0.00 0.00 179.01 178.11 1bxr n ASP 11 N -5.40 0.00 0.00 1.42 5.75 -1.26 -4.77 116.55 112.29 1bxr n ASP 11 Ca 0.03 0.47 0.00 0.00 -0.01 0.00 0.00 54.79 55.28 1bxr n ASP 11 Cb 0.31 -0.47 0.00 0.00 -1.03 0.00 0.00 41.12 39.93 1bxr n ASP 11 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1bxr n GLY 12 N -1.47 0.71 3.72 6.12 0.00 0.21 -5.03 105.19 109.45 1bxr n GLY 12 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1bxr n GLY 12 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bxr s THR 13 N -2.43 3.10 -0.03 2.61 2.01 -1.24 -4.68 115.64 114.99 1bxr s THR 13 Ca 0.00 0.83 0.02 0.00 0.31 0.00 0.00 61.69 62.85 1bxr s THR 13 Cb 0.00 -3.53 -0.03 0.00 0.01 0.00 0.00 72.50 68.95 1bxr s THR 13 CO 0.00 0.09 -0.05 -1.10 -0.69 0.00 0.00 174.62 172.86 1bxr s GLN 14 N 0.64 2.67 -0.12 4.92 -0.21 -1.26 -0.11 119.66 126.19 1bxr s GLN 14 Ca 0.63 -0.63 -0.00 0.00 0.02 0.00 0.00 55.36 55.37 1bxr s GLN 14 Cb -0.38 -2.57 0.03 0.00 1.00 0.00 0.00 33.01 31.08 1bxr s GLN 14 CO 0.34 0.63 -0.08 -0.06 -2.12 0.00 0.00 175.29 174.00 1bxr s PHE 15 N -0.94 1.57 -0.35 0.91 0.40 0.26 -4.98 117.98 114.85 1bxr s PHE 15 Ca 0.16 -0.83 -0.10 0.00 -0.60 0.00 0.00 56.93 55.55 1bxr s PHE 15 Cb -0.11 -1.27 0.01 0.00 0.51 0.00 0.00 43.02 42.16 1bxr s PHE 15 CO 0.05 -0.54 0.18 -1.01 0.70 0.00 0.00 175.22 174.60 1bxr s HIS 16 N 1.68 3.21 0.00 0.36 3.76 -1.26 0.10 115.29 123.14 1bxr s HIS 16 Ca 0.04 -0.84 0.00 0.00 -0.15 0.00 0.00 55.06 54.12 1bxr s HIS 16 Cb -0.13 -2.39 0.00 0.00 1.11 0.00 0.00 32.58 31.17 1bxr s HIS 16 CO -0.08 -0.58 0.00 0.41 -0.85 0.00 0.00 174.74 173.64 1bxr n GLY 17 N 4.98 4.32 3.04 -2.22 0.00 -0.75 -4.76 105.19 109.79 1bxr n GLY 17 Ca -0.13 -0.68 -0.14 0.00 0.00 0.00 0.00 46.02 45.08 1bxr n GLY 17 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bxr s ARG 18 N 4.34 0.50 -0.01 1.61 3.52 -0.73 -3.73 118.95 124.44 1bxr s ARG 18 Ca 0.00 -0.63 -0.24 0.00 -0.13 0.00 0.00 55.73 54.74 1bxr s ARG 18 Cb 0.00 -0.31 -0.05 0.00 -1.56 0.00 0.00 34.95 33.04 1bxr s ARG 18 CO 0.00 0.06 0.71 0.00 -0.81 0.00 0.00 175.30 175.27 1bxr s ALA 19 N -1.10 3.37 0.00 6.12 0.00 -0.13 -0.41 121.76 129.61 1bxr s ALA 19 Ca -0.07 0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.07 1bxr s ALA 19 Cb -0.08 -2.94 0.00 0.00 0.00 0.00 0.00 23.12 20.09 1bxr s ALA 19 CO 0.00 0.01 0.28 0.44 0.00 0.00 0.00 175.76 176.49 1bxr n ILE 20 N 3.20 0.00 -2.45 0.00 -5.35 -0.80 -4.89 119.36 109.06 1bxr n ILE 20 Ca -0.03 -0.33 0.00 0.00 -0.27 0.00 0.00 62.75 62.12 1bxr n ILE 20 Cb 0.51 1.28 0.00 0.00 -1.74 0.00 0.00 39.64 39.69 1bxr n ILE 20 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1bxr n GLY 21 N 0.11 6.12 3.70 3.28 0.00 -1.21 -4.53 105.19 112.67 1bxr n GLY 21 Ca 0.00 -1.79 -0.33 0.00 0.00 0.00 0.00 46.02 43.90 1bxr n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bxr s ALA 22 N -2.00 1.87 0.39 4.61 0.00 0.30 -4.74 121.76 122.19 1bxr s ALA 22 Ca 0.00 0.82 -0.17 0.00 0.00 0.00 0.00 51.96 52.61 1bxr s ALA 22 Cb 0.00 -3.48 -0.09 0.00 0.00 0.00 0.00 23.12 19.55 1bxr s ALA 22 CO 0.00 -2.24 0.84 0.99 0.00 0.00 0.00 175.76 175.35 1bxr s THR 23 N -2.17 4.58 -1.50 0.00 2.01 -1.26 -4.42 115.64 112.88 1bxr s THR 23 Ca 0.73 1.13 0.00 0.00 0.31 0.00 0.00 61.69 63.85 1bxr s THR 23 Cb -0.28 -3.63 0.00 0.00 0.01 0.00 0.00 72.50 68.60 1bxr s THR 23 CO 0.50 -0.32 0.00 0.61 -0.69 0.00 0.00 174.62 174.73 1bxr n GLY 24 N -0.67 0.47 3.20 4.40 0.00 0.13 -4.93 105.19 107.79 1bxr n GLY 24 Ca 0.05 -1.98 -0.21 0.00 0.00 0.00 0.00 46.02 43.88 1bxr n GLY 24 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bxr s SER 25 N -4.00 1.97 -0.01 1.61 1.04 -1.26 0.12 113.70 113.18 1bxr s SER 25 Ca 0.00 -0.60 0.01 0.00 0.48 0.00 0.00 55.95 55.83 1bxr s SER 25 Cb 0.00 -0.09 0.01 0.00 0.10 0.00 0.00 66.02 66.03 1bxr s SER 25 CO 0.00 -0.00 -0.02 0.00 0.98 0.00 0.00 173.24 174.19 1bxr s ALA 26 N -1.14 0.26 -0.01 5.32 0.00 -0.43 -4.96 121.76 120.80 1bxr s ALA 26 Ca 0.02 -0.05 0.01 0.00 0.00 0.00 0.00 51.96 51.94 1bxr s ALA 26 Cb -0.10 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 22.90 1bxr s ALA 26 CO 0.03 0.03 -0.03 0.08 0.00 0.00 0.00 175.76 175.86 1bxr s VAL 27 N 0.21 0.27 -0.96 0.00 1.01 -1.26 0.00 120.40 119.67 1bxr s VAL 27 Ca -0.02 -0.10 0.00 0.00 0.00 0.00 0.00 61.98 61.86 1bxr s VAL 27 Cb -0.04 -0.27 0.00 0.00 0.00 0.00 0.00 36.38 36.07 1bxr s VAL 27 CO -0.01 0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.81 1bxr n GLY 28 N 3.28 -1.08 3.79 4.51 0.00 -0.57 -4.78 105.19 110.34 1bxr n GLY 28 Ca -0.16 -0.83 -0.39 0.00 0.00 0.00 0.00 46.02 44.63 1bxr n GLY 28 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bxr s GLU 29 N -0.38 4.44 -0.24 1.61 2.12 -0.98 -0.00 118.70 125.26 1bxr s GLU 29 Ca 0.00 1.01 -0.14 0.00 0.36 0.00 0.00 54.97 56.20 1bxr s GLU 29 Cb 0.00 -3.25 -0.04 0.00 0.26 0.00 0.00 34.13 31.10 1bxr s GLU 29 CO 0.00 0.60 0.32 0.08 -0.54 0.00 0.00 175.26 175.72 1bxr s VAL 30 N -1.14 5.24 0.11 3.70 1.01 0.39 0.11 120.40 129.82 1bxr s VAL 30 Ca 0.33 0.51 0.10 0.00 0.00 0.00 0.00 61.98 62.92 1bxr s VAL 30 Cb -0.22 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 1bxr s VAL 30 CO 0.24 0.25 -0.24 0.68 0.00 0.00 0.00 175.10 176.02 1bxr s VAL 31 N 1.51 1.99 -0.10 2.92 -7.23 -0.05 -4.10 120.40 115.34 1bxr s VAL 31 Ca 0.14 -1.64 -0.01 0.00 -1.81 0.00 0.00 61.98 58.67 1bxr s VAL 31 Cb -0.15 -1.77 -0.03 0.00 0.56 0.00 0.00 36.38 34.99 1bxr s VAL 31 CO 0.08 0.03 -0.05 0.72 -0.31 0.00 0.00 175.10 175.57 1bxr s PHE 32 N -1.10 3.01 -0.08 2.82 -0.12 -1.26 0.61 117.98 121.87 1bxr s PHE 32 Ca 0.10 -0.03 0.03 0.00 -0.05 0.00 0.00 56.93 56.98 1bxr s PHE 32 Cb -0.10 -1.79 0.01 0.00 -0.63 0.00 0.00 43.02 40.51 1bxr s PHE 32 CO 0.05 0.26 -0.16 1.21 -0.05 0.00 0.00 175.22 176.54 1bxr s ASN 33 N -0.51 2.20 0.00 1.98 3.84 -0.38 -4.48 114.94 117.60 1bxr s ASN 33 Ca 0.08 -0.38 0.23 0.00 0.21 0.00 0.00 52.86 52.99 1bxr s ASN 33 Cb -0.12 -1.01 0.85 0.00 -0.55 0.00 0.00 41.25 40.42 1bxr s ASN 33 CO 0.02 0.06 1.61 0.35 -2.79 0.00 0.00 177.10 176.36 1bxr n THR 34 N 3.79 0.15 -1.82 -5.21 -2.24 -0.34 -2.06 114.28 106.55 1bxr n THR 34 Ca -0.21 -0.31 -0.42 0.00 -2.27 0.00 0.00 64.05 60.84 1bxr n THR 34 Cb 0.52 0.38 -0.03 0.00 -2.10 0.00 0.00 70.33 69.10 1bxr n THR 34 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1bxr s SER 35 N -1.69 6.54 0.00 3.42 0.01 -1.26 -4.72 113.70 116.00 1bxr s SER 35 Ca 0.34 2.52 0.27 0.00 1.31 0.00 0.00 55.95 60.38 1bxr s SER 35 Cb 0.18 -2.54 0.83 0.00 0.21 0.00 0.00 66.02 64.71 1bxr s SER 35 CO 0.28 -0.98 1.63 0.23 0.41 0.00 0.00 173.24 174.81 1bxr n MET 36 N 6.94 0.29 -4.08 12.44 2.81 -1.26 -4.53 117.12 129.73 1bxr n MET 36 Ca 0.18 -0.14 -0.09 0.00 -1.81 0.00 0.00 57.70 55.85 1bxr n MET 36 Cb 0.41 -1.50 -0.10 0.00 -0.71 0.00 0.00 33.22 31.32 1bxr n MET 36 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1bxr s THR 37 N -2.80 0.31 0.00 2.03 -4.23 -1.26 -4.98 115.64 104.70 1bxr s THR 37 Ca 0.18 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 59.13 1bxr s THR 37 Cb 0.19 -1.17 0.00 0.00 1.34 0.00 0.00 72.50 72.85 1bxr s THR 37 CO 0.59 -0.81 0.00 0.61 -0.54 0.00 0.00 174.62 174.47 1bxr n GLY 38 N 0.55 0.87 0.30 3.99 0.00 -1.26 -4.87 105.19 104.77 1bxr n GLY 38 Ca -0.17 -0.59 0.03 0.00 0.00 0.00 0.00 46.02 45.30 1bxr n GLY 38 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1bxr h TYR 39 N 0.00 0.50 -0.73 1.61 -0.00 -1.94 -1.78 116.97 114.64 1bxr h TYR 39 Ca 0.00 -0.00 -0.06 0.00 0.00 0.00 0.00 58.73 58.67 1bxr h TYR 39 Cb 0.40 -0.16 -0.03 0.00 0.00 0.00 0.00 36.73 36.94 1bxr h TYR 39 CO 0.00 0.36 0.22 0.37 -0.00 0.00 0.00 178.16 179.11 1bxr h GLN 40 N 0.52 1.14 -0.04 0.10 4.15 -1.90 -1.69 115.11 117.38 1bxr h GLN 40 Ca 0.13 -0.25 -0.13 0.00 0.77 0.00 0.00 58.65 59.18 1bxr h GLN 40 Cb 0.03 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.55 1bxr h GLN 40 CO -0.02 0.97 -0.56 0.93 -1.93 0.00 0.00 178.83 178.22 1bxr h GLU 41 N 1.09 0.12 -0.14 1.69 3.07 -1.45 -2.92 114.58 116.04 1bxr h GLU 41 Ca 0.23 -0.07 -0.08 0.00 -0.50 0.00 0.00 59.36 58.94 1bxr h GLU 41 Cb 0.32 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.24 1bxr h GLU 41 CO -0.01 0.64 -0.25 0.82 -1.40 0.00 0.00 179.01 178.82 1bxr h ILE 42 N 0.09 1.37 -0.07 3.13 2.04 -1.00 -3.13 117.51 119.94 1bxr h ILE 42 Ca -0.00 -1.50 0.02 0.00 1.00 0.00 0.00 64.86 64.38 1bxr h ILE 42 Cb 1.01 2.01 -0.00 0.00 -0.74 0.00 0.00 36.82 39.10 1bxr h ILE 42 CO 0.08 0.44 0.06 -0.07 0.00 0.00 0.00 178.15 178.66 1bxr h LEU 43 N 0.01 0.00 -2.83 1.44 3.38 -1.26 -2.38 115.31 113.66 1bxr h LEU 43 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1bxr h LEU 43 Cb 0.83 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1bxr h LEU 43 CO 0.06 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.94 1bxr n THR 44 N -4.43 1.13 -2.88 0.22 -2.24 -1.11 -0.86 114.28 104.12 1bxr n THR 44 Ca -0.01 -1.04 -0.42 0.00 -2.27 0.00 0.00 64.05 60.31 1bxr n THR 44 Cb 0.16 0.44 -0.04 0.00 -2.10 0.00 0.00 70.33 68.79 1bxr n THR 44 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1bxr s ASP 45 N -1.00 6.61 0.47 3.42 -1.08 -0.90 -2.80 116.67 121.38 1bxr s ASP 45 Ca 0.47 0.44 0.28 0.00 -0.52 0.00 0.00 52.55 53.21 1bxr s ASP 45 Cb 0.25 -2.43 1.34 0.00 -1.46 0.00 0.00 42.92 40.62 1bxr s ASP 45 CO 0.30 -0.81 1.77 -0.65 0.52 0.00 0.00 175.17 176.30 1bxr h PRO 46 N 8.52 0.18 0.00 4.34 0.11 -1.89 0.95 132.00 144.21 1bxr h PRO 46 Ca -0.24 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1bxr h PRO 46 Cb 1.09 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1bxr h PRO 46 CO 0.95 0.12 0.09 0.43 -0.21 0.00 0.00 178.00 179.38 1bxr n SER 47 N -4.43 0.00 -1.17 -2.05 7.64 -1.26 -1.47 113.62 110.89 1bxr n SER 47 Ca 0.26 0.28 0.10 0.00 1.01 0.00 0.00 58.87 60.52 1bxr n SER 47 Cb 1.09 -0.28 0.28 0.00 -1.01 0.00 0.00 64.21 64.29 1bxr n SER 47 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1bxr n TYR 48 N -1.25 0.91 -1.69 1.43 4.01 0.33 -4.37 117.16 116.53 1bxr n TYR 48 Ca 0.00 -0.53 -0.43 0.00 -0.16 0.00 0.00 57.90 56.78 1bxr n TYR 48 Cb 0.09 -0.06 -0.01 0.00 -0.31 0.00 0.00 39.34 39.05 1bxr n TYR 48 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1bxr n SER 49 N 1.17 2.75 -1.70 7.72 2.88 -0.54 -1.58 113.62 124.33 1bxr n SER 49 Ca 0.21 1.19 -0.19 0.00 -1.33 0.00 0.00 58.87 58.75 1bxr n SER 49 Cb 0.62 -1.47 -0.06 0.00 -0.75 0.00 0.00 64.21 62.55 1bxr n SER 49 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1bxr n ARG 50 N 1.04 -1.38 -4.31 -1.46 1.74 -1.25 -4.75 116.66 106.28 1bxr n ARG 50 Ca 0.07 1.08 -0.24 0.00 -0.77 0.00 0.00 57.85 57.99 1bxr n ARG 50 Cb 0.35 -5.47 -0.13 0.00 -1.02 0.00 0.00 32.46 26.19 1bxr n ARG 50 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1bxr s GLN 51 N -4.07 1.15 -0.28 5.56 -0.21 -0.62 -2.33 119.66 118.87 1bxr s GLN 51 Ca 0.00 -1.17 -0.10 0.00 0.02 0.00 0.00 55.36 54.11 1bxr s GLN 51 Cb 0.00 -1.43 -0.04 0.00 1.00 0.00 0.00 33.01 32.54 1bxr s GLN 51 CO 0.00 0.33 0.16 0.42 -2.12 0.00 0.00 175.29 174.09 1bxr s ILE 52 N -1.14 5.02 -0.27 1.08 1.01 0.30 0.30 121.20 127.50 1bxr s ILE 52 Ca 0.07 0.03 -0.21 0.00 0.00 0.00 0.00 60.65 60.54 1bxr s ILE 52 Cb -0.10 -3.40 -0.01 0.00 0.01 0.00 0.00 42.46 38.95 1bxr s ILE 52 CO 0.04 0.25 0.66 -0.69 0.00 0.00 0.00 174.94 175.19 1bxr s VAL 53 N 1.71 4.95 -0.18 2.92 1.01 0.11 -0.87 120.40 130.05 1bxr s VAL 53 Ca 0.07 1.10 -0.09 0.00 0.00 0.00 0.00 61.98 63.06 1bxr s VAL 53 Cb -0.16 -3.98 -0.05 0.00 0.00 0.00 0.00 36.38 32.19 1bxr s VAL 53 CO 0.09 -0.04 0.10 -0.89 0.00 0.00 0.00 175.10 174.36 1bxr s THR 54 N 2.59 5.18 -0.18 3.92 2.01 0.20 0.85 115.64 130.21 1bxr s THR 54 Ca 0.27 0.10 -0.05 0.00 0.31 0.00 0.00 61.69 62.32 1bxr s THR 54 Cb -0.15 -3.34 -0.03 0.00 0.01 0.00 0.00 72.50 68.99 1bxr s THR 54 CO 0.09 0.47 0.00 -0.76 -0.69 0.00 0.00 174.62 173.74 1bxr s LEU 55 N 0.18 3.40 0.20 4.42 1.43 -0.12 -1.24 118.68 126.95 1bxr s LEU 55 Ca 0.07 -0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 1bxr s LEU 55 Cb -0.12 -1.85 0.14 0.00 0.03 0.00 0.00 46.19 44.39 1bxr s LEU 55 CO -0.01 0.13 1.49 0.71 0.23 0.00 0.00 176.35 178.91 1bxr h THR 56 N 5.17 1.37 -2.90 5.49 1.35 -1.73 -3.42 112.91 118.24 1bxr h THR 56 Ca -0.34 -2.00 -0.56 0.00 -0.55 0.00 0.00 66.41 62.96 1bxr h THR 56 Cb 1.18 1.99 -0.03 0.00 -1.73 0.00 0.00 68.15 69.57 1bxr h THR 56 CO 0.64 0.60 0.88 -0.47 -0.25 0.00 0.00 175.52 176.92 1bxr s TYR 57 N -3.76 2.78 0.21 4.73 5.04 -1.26 -4.94 117.35 120.15 1bxr s TYR 57 Ca -0.05 0.89 -0.10 0.00 -2.44 0.00 0.00 57.07 55.37 1bxr s TYR 57 Cb 0.11 -3.58 0.27 0.00 0.35 0.00 0.00 41.96 39.11 1bxr s TYR 57 CO 0.83 -2.08 1.74 -1.00 -1.34 0.00 0.00 175.55 173.69 1bxr h PRO 58 N 8.21 0.36 -5.46 4.97 0.13 -1.94 -3.40 132.00 134.87 1bxr h PRO 58 Ca -0.32 -0.02 -0.64 0.00 -0.87 0.00 0.00 66.00 64.15 1bxr h PRO 58 Cb 1.14 -0.08 -0.15 0.00 0.13 0.00 0.00 31.00 32.04 1bxr h PRO 58 CO 0.94 0.24 0.31 -1.01 -0.23 0.00 0.00 178.00 178.25 1bxr s HIS 59 N -6.10 2.93 -0.29 1.56 3.76 -1.26 -1.12 115.29 114.77 1bxr s HIS 59 Ca -0.13 -0.22 -0.05 0.00 -0.15 0.00 0.00 55.06 54.51 1bxr s HIS 59 Cb 0.17 -3.78 0.02 0.00 1.11 0.00 0.00 32.58 30.10 1bxr s HIS 59 CO 0.74 -1.16 0.05 0.42 -0.85 0.00 0.00 174.74 173.94 1bxr s ILE 60 N 3.29 3.66 0.00 0.60 -1.09 -0.23 -4.45 121.20 122.97 1bxr s ILE 60 Ca 0.24 -0.85 0.00 0.00 -2.23 0.00 0.00 60.65 57.81 1bxr s ILE 60 Cb -0.15 -2.91 0.00 0.00 -1.58 0.00 0.00 42.46 37.82 1bxr s ILE 60 CO 0.16 0.07 0.00 0.61 -1.23 0.00 0.00 174.94 174.55 1bxr n GLY 61 N 4.80 1.88 0.32 6.18 0.00 -1.26 -4.11 105.19 113.00 1bxr n GLY 61 Ca -0.15 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.02 1bxr n GLY 61 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1bxr h ASN 62 N 0.00 0.00 -0.20 1.61 2.35 -1.85 -2.33 115.58 115.16 1bxr h ASN 62 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1bxr h ASN 62 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1bxr h ASN 62 CO 0.00 0.00 0.00 1.33 -1.65 0.00 0.00 177.43 177.11 1bxr n VAL 63 N -4.23 1.48 -2.93 2.81 0.24 -1.26 -1.35 118.33 113.09 1bxr n VAL 63 Ca 0.02 -1.42 0.00 0.00 -2.04 0.00 0.00 64.34 60.89 1bxr n VAL 63 Cb 0.30 0.19 0.00 0.00 -1.47 0.00 0.00 33.84 32.85 1bxr n VAL 63 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1bxr n GLY 64 N -0.26 2.97 3.17 7.63 0.00 -0.88 -4.10 105.19 113.73 1bxr n GLY 64 Ca 0.13 -0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 1bxr n GLY 64 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bxr s THR 65 N 0.00 0.12 -0.08 2.61 -4.23 -0.54 -4.72 115.64 108.80 1bxr s THR 65 Ca 0.00 -1.01 -0.22 0.00 -1.18 0.00 0.00 61.69 59.28 1bxr s THR 65 Cb 0.00 -1.02 0.05 0.00 1.34 0.00 0.00 72.50 72.87 1bxr s THR 65 CO 0.00 -0.56 0.51 0.54 -0.54 0.00 0.00 174.62 174.57 1bxr s ASN 66 N -2.29 -0.47 0.30 3.99 2.20 -1.26 0.28 114.94 117.68 1bxr s ASN 66 Ca -0.02 0.60 -0.01 0.00 -0.94 0.00 0.00 52.86 52.48 1bxr s ASN 66 Cb 0.01 0.62 0.46 0.00 -2.00 0.00 0.00 41.25 40.33 1bxr s ASN 66 CO -0.06 -0.43 1.95 0.44 -2.94 0.00 0.00 177.10 176.05 1bxr h ASP 67 N 3.95 0.95 0.14 3.54 5.19 -1.98 -0.77 116.42 127.43 1bxr h ASP 67 Ca -0.28 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.11 1bxr h ASP 67 Cb 1.16 -0.23 0.00 0.00 0.18 0.00 0.00 39.33 40.45 1bxr h ASP 67 CO 0.33 0.66 0.00 0.00 -3.12 0.00 0.00 179.24 177.11 1bxr n ALA 68 N -2.40 1.37 0.18 3.45 0.00 -1.26 -1.98 120.51 119.87 1bxr n ALA 68 Ca 0.11 -0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.65 1bxr n ALA 68 Cb 0.08 -1.09 0.23 0.00 0.00 0.00 0.00 19.45 18.68 1bxr n ALA 68 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1bxr n ASP 69 N -1.37 3.58 -4.73 0.00 8.00 -0.29 -4.93 116.55 116.81 1bxr n ASP 69 Ca 0.02 -2.00 -0.37 0.00 0.71 0.00 0.00 54.79 53.15 1bxr n ASP 69 Cb 0.05 -0.29 -0.07 0.00 -0.02 0.00 0.00 41.12 40.79 1bxr n ASP 69 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1bxr s GLU 70 N -1.40 4.27 0.07 -1.24 2.02 -0.84 -3.31 118.70 118.27 1bxr s GLU 70 Ca 0.41 0.24 0.24 0.00 0.02 0.00 0.00 54.97 55.88 1bxr s GLU 70 Cb 0.23 -3.42 0.32 0.00 0.10 0.00 0.00 34.13 31.37 1bxr s GLU 70 CO 0.32 0.23 1.28 0.39 0.02 0.00 0.00 175.26 177.50 1bxr n GLU 71 N 3.53 0.22 -4.13 1.61 -0.58 -1.26 -4.87 120.64 115.16 1bxr n GLU 71 Ca -0.10 0.04 -0.16 0.00 -0.42 0.00 0.00 57.16 56.52 1bxr n GLU 71 Cb 0.52 -1.62 -0.05 0.00 -0.57 0.00 0.00 31.44 29.72 1bxr n GLU 71 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1bxr s SER 72 N -3.86 1.15 0.09 1.62 1.04 -1.12 0.01 113.70 112.63 1bxr s SER 72 Ca 0.07 -1.57 0.20 0.00 0.48 0.00 0.00 55.95 55.13 1bxr s SER 72 Cb 0.15 0.65 0.84 0.00 0.10 0.00 0.00 66.02 67.75 1bxr s SER 72 CO 0.73 -1.26 1.64 -1.54 0.98 0.00 0.00 173.24 173.78 1bxr n SER 73 N -1.51 0.27 -3.86 7.02 3.41 -1.26 -4.84 113.62 112.85 1bxr n SER 73 Ca 0.02 0.55 -0.07 0.00 -0.26 0.00 0.00 58.87 59.11 1bxr n SER 73 Cb 0.62 -0.62 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 1bxr n SER 73 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1bxr s GLN 74 N -3.10 1.74 -0.26 4.33 -2.07 -1.26 -5.12 119.66 113.92 1bxr s GLN 74 Ca 0.08 -1.00 -0.29 0.00 -1.82 0.00 0.00 55.36 52.32 1bxr s GLN 74 Cb 0.11 0.59 -0.00 0.00 -1.09 0.00 0.00 33.01 32.62 1bxr s GLN 74 CO 0.37 -0.79 1.26 0.08 -1.32 0.00 0.00 175.29 174.90 1bxr s VAL 75 N -3.93 4.23 -0.09 3.63 1.01 -1.26 -4.52 120.40 119.47 1bxr s VAL 75 Ca 0.12 1.43 0.10 0.00 0.00 0.00 0.00 61.98 63.63 1bxr s VAL 75 Cb -0.05 -4.13 -0.24 0.00 0.00 0.00 0.00 36.38 31.96 1bxr s VAL 75 CO 0.06 -0.36 0.47 1.41 0.00 0.00 0.00 175.10 176.68 1bxr n HIS 76 N 7.21 0.81 -1.67 5.22 -0.00 -0.04 -4.94 115.22 121.82 1bxr n HIS 76 Ca 0.14 0.27 -0.43 0.00 -0.00 0.00 0.00 57.72 57.70 1bxr n HIS 76 Cb 0.46 -1.14 -0.00 0.00 -0.00 0.00 0.00 29.99 29.30 1bxr n HIS 76 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1bxr n ALA 77 N -2.69 0.87 0.05 -1.41 0.00 -1.12 -3.77 120.51 112.46 1bxr n ALA 77 Ca -0.23 0.35 -0.08 0.00 0.00 0.00 0.00 53.44 53.48 1bxr n ALA 77 Cb 1.07 -2.19 0.07 0.00 0.00 0.00 0.00 19.45 18.40 1bxr n ALA 77 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1bxr h GLN 78 N 2.29 0.37 -2.76 0.00 5.75 0.44 -3.47 115.11 117.73 1bxr h GLN 78 Ca -0.45 -0.26 0.08 0.00 -0.15 0.00 0.00 58.65 57.87 1bxr h GLN 78 Cb 1.30 0.04 -0.08 0.00 1.07 0.00 0.00 27.48 29.81 1bxr h GLN 78 CO 0.61 0.88 0.32 0.20 -2.65 0.00 0.00 178.83 178.19 1bxr s GLY 79 N -4.27 -0.26 -0.04 2.39 0.00 -1.17 -4.54 107.32 99.43 1bxr s GLY 79 Ca -0.05 0.08 0.00 0.00 0.00 0.00 0.00 44.72 44.74 1bxr s GLY 79 CO 0.82 0.02 -0.02 -2.27 0.00 0.00 0.00 173.10 171.65 1bxr s LEU 80 N -2.85 1.10 -0.23 0.66 2.96 -1.08 0.08 118.68 119.32 1bxr s LEU 80 Ca 0.09 -0.08 -0.03 0.00 -0.22 0.00 0.00 54.13 53.89 1bxr s LEU 80 Cb -0.03 -0.37 0.01 0.00 0.50 0.00 0.00 46.19 46.30 1bxr s LEU 80 CO 0.01 -0.10 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.19 1bxr s VAL 81 N 1.19 3.17 0.19 1.68 1.01 0.25 -1.49 120.40 126.39 1bxr s VAL 81 Ca -0.07 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.22 1bxr s VAL 81 Cb -0.14 -2.50 -0.05 0.00 0.00 0.00 0.00 36.38 33.70 1bxr s VAL 81 CO -0.02 0.34 0.01 0.27 0.00 0.00 0.00 175.10 175.70 1bxr s ILE 82 N 1.42 0.68 -0.11 2.22 -4.36 -0.46 -0.94 121.20 119.65 1bxr s ILE 82 Ca 0.04 -1.99 -0.12 0.00 -0.26 0.00 0.00 60.65 58.32 1bxr s ILE 82 Cb -0.15 -2.20 -0.27 0.00 1.25 0.00 0.00 42.46 41.09 1bxr s ILE 82 CO -0.04 -0.40 0.47 -0.09 0.24 0.00 0.00 174.94 175.12 1bxr h ARG 83 N 2.64 0.25 -3.25 0.37 9.65 -1.75 -2.18 114.38 120.11 1bxr h ARG 83 Ca -0.37 -0.43 -0.23 0.00 -1.10 0.00 0.00 59.98 57.85 1bxr h ARG 83 Cb 1.21 0.16 -0.31 0.00 -1.39 0.00 0.00 29.97 29.65 1bxr h ARG 83 CO 0.62 1.21 -0.58 0.34 2.80 0.00 0.00 179.97 184.37 1bxr s ASP 84 N -7.07 -0.14 -0.32 -3.80 2.15 -0.28 -0.51 116.67 106.71 1bxr s ASP 84 Ca -0.21 0.33 -0.11 0.00 0.43 0.00 0.00 52.55 52.98 1bxr s ASP 84 Cb 0.05 0.23 -0.02 0.00 -0.30 0.00 0.00 42.92 42.89 1bxr s ASP 84 CO 0.76 -0.13 0.19 -0.22 -0.17 0.00 0.00 175.17 175.60 1bxr s LEU 85 N 1.00 4.27 0.42 -1.34 2.96 -1.26 -1.07 118.68 123.66 1bxr s LEU 85 Ca -0.08 -0.41 -0.26 0.00 -0.22 0.00 0.00 54.13 53.17 1bxr s LEU 85 Cb -0.10 -2.08 -0.10 0.00 0.50 0.00 0.00 46.19 44.42 1bxr s LEU 85 CO -0.05 -0.19 1.30 -0.81 -1.32 0.00 0.00 176.35 175.27 1bxr n PRO 86 N 5.05 2.00 -0.24 0.98 -0.04 -1.26 -4.90 135.00 136.58 1bxr n PRO 86 Ca -0.13 0.71 0.02 0.00 -0.04 0.00 0.00 63.50 64.06 1bxr n PRO 86 Cb 0.50 -2.42 0.15 0.00 -0.04 0.00 0.00 33.50 31.69 1bxr n PRO 86 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1bxr h LEU 87 N 2.16 0.38 -8.25 1.53 4.07 -1.96 -3.44 115.31 109.79 1bxr h LEU 87 Ca -0.48 0.08 -0.13 0.00 0.08 0.00 0.00 57.88 57.42 1bxr h LEU 87 Cb 1.29 0.02 -0.15 0.00 1.08 0.00 0.00 40.66 42.90 1bxr h LEU 87 CO 0.60 0.20 -0.63 0.27 -1.08 0.00 0.00 178.44 177.80 1bxr s ILE 88 N -6.05 0.18 -0.18 1.22 -4.36 -1.26 -5.14 121.20 105.61 1bxr s ILE 88 Ca -0.13 -1.77 -0.10 0.00 -0.26 0.00 0.00 60.65 58.39 1bxr s ILE 88 Cb 0.19 -1.65 -0.05 0.00 1.25 0.00 0.00 42.46 42.20 1bxr s ILE 88 CO 0.76 -0.81 0.16 0.00 0.24 0.00 0.00 174.94 175.29 1bxr s ALA 89 N -3.95 3.70 -0.50 2.27 0.00 -1.26 -4.75 121.76 117.27 1bxr s ALA 89 Ca 0.12 -0.64 0.03 0.00 0.00 0.00 0.00 51.96 51.47 1bxr s ALA 89 Cb 0.07 -2.18 0.14 0.00 0.00 0.00 0.00 23.12 21.15 1bxr s ALA 89 CO -0.07 0.21 0.29 0.45 0.00 0.00 0.00 175.76 176.65 1bxr s SER 90 N 0.17 3.89 -0.25 0.00 0.15 -0.46 -4.88 113.70 112.33 1bxr s SER 90 Ca 0.10 -2.96 -0.18 0.00 0.70 0.00 0.00 55.95 53.62 1bxr s SER 90 Cb -0.12 -1.27 0.07 0.00 -1.71 0.00 0.00 66.02 63.00 1bxr s SER 90 CO -0.00 -0.22 0.64 0.21 1.20 0.00 0.00 173.24 175.06 1bxr s ASN 91 N -0.14 -0.78 0.65 5.45 3.84 -1.26 -4.71 114.94 117.98 1bxr s ASN 91 Ca 0.19 1.35 0.38 0.00 0.21 0.00 0.00 52.86 55.00 1bxr s ASN 91 Cb -0.20 1.28 2.14 0.00 -0.55 0.00 0.00 41.25 43.92 1bxr s ASN 91 CO -0.04 -0.23 2.27 2.19 -2.79 0.00 0.00 177.10 178.50 1bxr h PHE 92 N 6.29 0.00 0.00 0.43 -0.00 -1.97 -1.56 116.94 120.13 1bxr h PHE 92 Ca -0.30 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.67 1bxr h PHE 92 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.15 1bxr h PHE 92 CO 0.21 0.00 -0.65 0.54 -0.00 0.00 0.00 178.31 178.41 1bxr n ARG 93 N -3.28 0.06 -2.10 6.09 1.74 -1.26 -4.96 116.66 112.95 1bxr n ARG 93 Ca -0.02 0.01 -0.41 0.00 -0.77 0.00 0.00 57.85 56.65 1bxr n ARG 93 Cb 0.14 -1.53 -0.02 0.00 -1.02 0.00 0.00 32.46 30.03 1bxr n ARG 93 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1bxr s ASN 94 N -3.21 6.75 -0.00 0.55 2.47 -0.59 -4.53 114.94 116.39 1bxr s ASN 94 Ca 0.09 2.64 0.03 0.00 0.42 0.00 0.00 52.86 56.04 1bxr s ASN 94 Cb 0.17 -2.63 -0.04 0.00 -1.45 0.00 0.00 41.25 37.30 1bxr s ASN 94 CO 0.74 -0.59 0.11 0.35 -3.72 0.00 0.00 177.10 173.99 1bxr n THR 95 N 1.59 0.00 -3.63 -5.21 -2.24 0.80 -4.89 114.28 100.70 1bxr n THR 95 Ca 0.03 -0.35 -0.02 0.00 -2.27 0.00 0.00 64.05 61.44 1bxr n THR 95 Cb 0.41 0.87 -0.06 0.00 -2.10 0.00 0.00 70.33 69.45 1bxr n THR 95 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1bxr s GLU 96 N -1.49 0.40 0.82 -0.78 2.12 -1.06 -4.96 118.70 113.75 1bxr s GLU 96 Ca 0.01 0.71 -0.14 0.00 0.36 0.00 0.00 54.97 55.90 1bxr s GLU 96 Cb 0.02 0.11 0.02 0.00 0.26 0.00 0.00 34.13 34.54 1bxr s GLU 96 CO 0.12 -0.09 0.67 -0.40 -0.54 0.00 0.00 175.26 175.02 1bxr n ASP 97 N 3.85 -0.89 -0.09 -1.70 5.75 -1.26 -1.46 116.55 120.74 1bxr n ASP 97 Ca -0.18 0.50 -0.08 0.00 -0.01 0.00 0.00 54.79 55.03 1bxr n ASP 97 Cb 0.57 -1.29 0.00 0.00 -1.03 0.00 0.00 41.12 39.37 1bxr n ASP 97 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1bxr h LEU 98 N -0.92 0.24 -0.02 -2.12 5.85 -1.84 -1.52 115.31 114.98 1bxr h LEU 98 Ca -0.45 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.30 1bxr h LEU 98 Cb 1.31 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.29 1bxr h LEU 98 CO 0.41 0.18 -0.08 -1.28 -0.34 0.00 0.00 178.44 177.32 1bxr h SER 99 N 0.34 -0.25 -0.91 1.25 0.87 -1.91 -0.85 113.55 112.09 1bxr h SER 99 Ca 0.14 0.04 0.08 0.00 -1.23 0.00 0.00 61.79 60.82 1bxr h SER 99 Cb 0.05 0.11 -0.06 0.00 -0.44 0.00 0.00 62.40 62.06 1bxr h SER 99 CO -0.10 -0.12 0.59 0.28 -0.53 0.00 0.00 176.83 176.95 1bxr h SER 100 N -0.14 0.88 -0.40 6.23 0.02 -1.83 0.78 113.55 119.09 1bxr h SER 100 Ca 0.04 0.01 -0.13 0.00 -0.84 0.00 0.00 61.79 60.87 1bxr h SER 100 Cb 0.19 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1bxr h SER 100 CO -0.10 0.54 -0.24 0.22 -1.14 0.00 0.00 176.83 176.12 1bxr h TYR 101 N 0.99 1.05 -0.31 3.45 3.20 -0.87 0.99 116.97 125.47 1bxr h TYR 101 Ca 0.41 -0.26 -0.08 0.00 3.14 0.00 0.00 58.73 61.94 1bxr h TYR 101 Cb 0.28 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 1bxr h TYR 101 CO -0.00 1.05 -0.10 -0.07 -1.64 0.00 0.00 178.16 177.40 1bxr h LEU 102 N 0.78 0.62 0.44 2.82 3.38 -0.20 -1.42 115.31 121.74 1bxr h LEU 102 Ca 0.10 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 1bxr h LEU 102 Cb 0.80 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1bxr h LEU 102 CO 0.07 0.86 -0.27 0.11 0.09 0.00 0.00 178.44 179.30 1bxr h LYS 103 N 0.38 -0.66 -0.65 1.13 1.57 -0.79 0.20 116.57 117.75 1bxr h LYS 103 Ca 0.08 0.04 0.13 0.00 -1.87 0.00 0.00 60.65 59.03 1bxr h LYS 103 Cb 0.60 0.15 -0.12 0.00 0.08 0.00 0.00 32.23 32.94 1bxr h LYS 103 CO 0.04 -0.44 -0.14 -0.09 -0.57 0.00 0.00 179.45 178.25 1bxr h ARG 104 N -0.68 0.02 0.00 3.15 2.43 -0.75 0.47 114.38 119.01 1bxr h ARG 104 Ca -0.05 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1bxr h ARG 104 Cb 0.56 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 1bxr h ARG 104 CO 0.05 0.01 0.00 0.72 -1.51 0.00 0.00 179.97 179.24 1bxr n HIS 105 N -5.42 0.00 -3.21 2.20 8.25 -0.54 -4.91 115.22 111.60 1bxr n HIS 105 Ca 0.08 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.40 1bxr n HIS 105 Cb 0.35 -0.35 0.08 0.00 1.12 0.00 0.00 29.99 31.18 1bxr n HIS 105 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1bxr n ASN 106 N -1.35 -2.68 -4.68 0.41 3.02 0.16 -4.97 115.26 105.17 1bxr n ASN 106 Ca 0.09 -0.55 -0.35 0.00 -0.03 0.00 0.00 54.58 53.74 1bxr n ASN 106 Cb 0.21 -4.54 -0.09 0.00 -0.61 0.00 0.00 39.78 34.75 1bxr n ASN 106 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1bxr s ILE 107 N -3.32 4.50 -0.20 2.41 -1.09 0.45 -4.86 121.20 119.09 1bxr s ILE 107 Ca 0.06 -0.17 -0.24 0.00 -2.23 0.00 0.00 60.65 58.08 1bxr s ILE 107 Cb -0.01 -2.93 -0.01 0.00 -1.58 0.00 0.00 42.46 37.92 1bxr s ILE 107 CO 0.64 0.57 0.78 -0.69 -1.23 0.00 0.00 174.94 175.01 1bxr s VAL 108 N -0.55 4.90 0.03 2.92 1.01 -1.26 0.11 120.40 127.57 1bxr s VAL 108 Ca 0.10 1.50 -0.04 0.00 0.00 0.00 0.00 61.98 63.53 1bxr s VAL 108 Cb -0.12 -4.08 -0.01 0.00 0.00 0.00 0.00 36.38 32.17 1bxr s VAL 108 CO 0.02 0.02 0.07 0.00 0.00 0.00 0.00 175.10 175.21 1bxr s ALA 109 N 2.31 -0.01 -0.02 5.51 0.00 -1.26 -2.64 121.76 125.65 1bxr s ALA 109 Ca 0.35 -0.59 0.02 0.00 0.00 0.00 0.00 51.96 51.74 1bxr s ALA 109 Cb -0.16 0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.19 1bxr s ALA 109 CO 0.10 -0.29 -0.06 -1.50 0.00 0.00 0.00 175.76 174.01 1bxr s ILE 110 N -2.48 0.50 0.49 0.00 2.07 -0.56 -1.91 121.20 119.31 1bxr s ILE 110 Ca -0.06 -0.22 0.05 0.00 -1.41 0.00 0.00 60.65 59.01 1bxr s ILE 110 Cb -0.02 -0.46 -0.01 0.00 0.13 0.00 0.00 42.46 42.10 1bxr s ILE 110 CO -0.04 0.17 0.21 0.00 -1.91 0.00 0.00 174.94 173.37 1bxr s ALA 111 N 0.17 4.04 -0.81 1.50 0.00 0.45 -1.36 121.76 125.75 1bxr s ALA 111 Ca -0.02 -1.33 -0.02 0.00 0.00 0.00 0.00 51.96 50.59 1bxr s ALA 111 Cb -0.06 -0.40 0.00 0.00 0.00 0.00 0.00 23.12 22.67 1bxr s ALA 111 CO -0.00 -0.23 0.26 -0.25 0.00 0.00 0.00 175.76 175.54 1bxr n ASP 112 N -1.44 -3.80 -4.46 0.00 8.00 0.33 -1.78 116.55 113.40 1bxr n ASP 112 Ca -0.06 -0.12 -0.23 0.00 0.71 0.00 0.00 54.79 55.08 1bxr n ASP 112 Cb 0.65 -2.75 -0.10 0.00 -0.02 0.00 0.00 41.12 38.90 1bxr n ASP 112 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1bxr s ILE 113 N -2.80 2.25 -1.26 0.53 -5.25 -1.22 -4.62 121.20 108.83 1bxr s ILE 113 Ca 0.13 -2.32 -0.19 0.00 -0.99 0.00 0.00 60.65 57.28 1bxr s ILE 113 Cb -0.06 -2.32 0.01 0.00 2.95 0.00 0.00 42.46 43.05 1bxr s ILE 113 CO 0.16 -0.40 1.89 -0.67 -1.79 0.00 0.00 174.94 174.13 1bxr n ASP 114 N -0.60 4.13 0.32 4.36 -0.08 -1.26 -4.33 116.55 119.09 1bxr n ASP 114 Ca -0.06 -2.84 0.20 0.00 -1.51 0.00 0.00 54.79 50.59 1bxr n ASP 114 Cb 0.61 -1.68 1.09 0.00 2.34 0.00 0.00 41.12 43.48 1bxr n ASP 114 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 1bxr h THR 115 N 5.33 0.13 0.05 5.18 1.35 -1.92 -1.03 112.91 121.99 1bxr h THR 115 Ca 0.42 0.00 -0.28 0.00 -0.55 0.00 0.00 66.41 66.00 1bxr h THR 115 Cb 0.83 0.94 0.02 0.00 -1.73 0.00 0.00 68.15 68.21 1bxr h THR 115 CO 1.53 0.00 -1.12 -0.09 -0.25 0.00 0.00 175.52 175.59 1bxr h ARG 116 N 0.00 0.65 -0.10 4.72 2.43 -1.93 0.17 114.38 120.32 1bxr h ARG 116 Ca 0.01 -0.76 -0.00 0.00 -0.81 0.00 0.00 59.98 58.42 1bxr h ARG 116 Cb 0.14 0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.91 1bxr h ARG 116 CO -0.00 1.33 0.05 -0.22 -1.51 0.00 0.00 179.97 179.62 1bxr h LYS 117 N 0.34 0.13 -0.11 0.20 3.64 -1.64 -2.04 116.57 117.09 1bxr h LYS 117 Ca -0.15 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.24 1bxr h LYS 117 Cb 1.77 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 33.54 1bxr h LYS 117 CO 0.21 0.17 -0.05 1.25 -2.27 0.00 0.00 179.45 178.76 1bxr h LEU 118 N 0.06 -0.17 -0.84 5.20 5.85 -1.23 -2.53 115.31 121.66 1bxr h LEU 118 Ca 0.03 0.04 0.11 0.00 0.84 0.00 0.00 57.88 58.90 1bxr h LEU 118 Cb 0.08 0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.13 1bxr h LEU 118 CO -0.01 -0.07 0.47 0.74 -0.34 0.00 0.00 178.44 179.24 1bxr h THR 119 N -0.04 0.87 -0.57 1.05 2.02 -0.47 -1.64 112.91 114.14 1bxr h THR 119 Ca 0.06 -0.26 -0.06 0.00 0.77 0.00 0.00 66.41 66.92 1bxr h THR 119 Cb 0.13 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.56 1bxr h THR 119 CO -0.14 0.14 0.10 0.03 0.37 0.00 0.00 175.52 176.02 1bxr h ARG 120 N 0.76 0.90 -0.13 6.66 3.08 -1.14 -1.19 114.38 123.32 1bxr h ARG 120 Ca 0.42 -0.21 -0.22 0.00 0.07 0.00 0.00 59.98 60.04 1bxr h ARG 120 Cb 0.43 -0.12 0.01 0.00 0.08 0.00 0.00 29.97 30.37 1bxr h ARG 120 CO -0.27 0.83 -0.80 1.25 -1.07 0.00 0.00 179.97 179.90 1bxr h LEU 121 N 0.85 0.87 -0.85 3.04 5.85 -0.97 0.17 115.31 124.27 1bxr h LEU 121 Ca 0.18 -0.58 -0.12 0.00 0.84 0.00 0.00 57.88 58.20 1bxr h LEU 121 Cb 0.36 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1bxr h LEU 121 CO 0.01 1.37 -0.47 -0.07 -0.34 0.00 0.00 178.44 178.94 1bxr h LEU 122 N 0.48 0.25 -0.28 2.25 3.38 -1.18 0.60 115.31 120.82 1bxr h LEU 122 Ca -0.06 -0.12 -0.20 0.00 0.09 0.00 0.00 57.88 57.60 1bxr h LEU 122 Cb 1.43 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 42.09 1bxr h LEU 122 CO 0.16 0.69 -0.88 -0.09 0.09 0.00 0.00 178.44 178.41 1bxr h ARG 123 N 0.19 0.22 0.08 1.13 2.43 -1.14 0.71 114.38 118.01 1bxr h ARG 123 Ca 0.01 -0.24 -0.15 0.00 -0.81 0.00 0.00 59.98 58.79 1bxr h ARG 123 Cb 0.91 0.07 0.02 0.00 -0.42 0.00 0.00 29.97 30.54 1bxr h ARG 123 CO 0.07 0.97 -0.62 0.93 -1.51 0.00 0.00 179.97 179.81 1bxr h GLU 124 N 0.13 0.27 0.00 0.20 4.39 -0.41 -3.39 114.58 115.77 1bxr h GLU 124 Ca -0.05 -0.40 -0.13 0.00 0.34 0.00 0.00 59.36 59.12 1bxr h GLU 124 Cb 1.50 0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 30.27 1bxr h GLU 124 CO 0.14 1.16 -2.08 1.63 -1.16 0.00 0.00 179.01 178.69 1bxr n LYS 125 N -4.24 0.71 0.00 2.33 5.02 0.21 -5.05 118.16 117.14 1bxr n LYS 125 Ca -0.12 -0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.04 1bxr n LYS 125 Cb 0.72 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.24 1bxr n LYS 125 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bxr n GLY 126 N 1.50 1.62 3.65 0.72 0.00 0.24 -5.01 105.19 107.91 1bxr n GLY 126 Ca -0.14 -2.09 -0.43 0.00 0.00 0.00 0.00 46.02 43.36 1bxr n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bxr n ALA 127 N 0.63 0.60 -2.59 4.61 0.00 -0.18 -4.52 120.51 119.06 1bxr n ALA 127 Ca 0.00 0.34 -0.12 0.00 0.00 0.00 0.00 53.44 53.66 1bxr n ALA 127 Cb 0.00 -2.15 -0.11 0.00 0.00 0.00 0.00 19.45 17.19 1bxr n ALA 127 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1bxr s GLN 128 N -1.82 0.62 0.17 0.00 -0.21 -1.26 -5.00 119.66 112.15 1bxr s GLN 128 Ca 0.58 -0.97 -0.04 0.00 0.02 0.00 0.00 55.36 54.95 1bxr s GLN 128 Cb -0.61 -0.20 -0.05 0.00 1.00 0.00 0.00 33.01 33.15 1bxr s GLN 128 CO 0.60 0.01 0.40 -0.80 -2.12 0.00 0.00 175.29 173.38 1bxr s ASN 129 N -2.14 6.47 0.36 5.90 0.01 -1.26 0.15 114.94 124.42 1bxr s ASN 129 Ca -0.02 0.56 -0.12 0.00 -0.71 0.00 0.00 52.86 52.57 1bxr s ASN 129 Cb -0.04 -2.08 0.03 0.00 0.41 0.00 0.00 41.25 39.58 1bxr s ASN 129 CO -0.02 0.01 0.67 -0.83 -1.51 0.00 0.00 177.10 175.42 1bxr s GLY 130 N -2.66 0.68 -0.02 0.66 0.00 1.00 -1.59 107.32 105.39 1bxr s GLY 130 Ca 0.41 -0.95 -0.01 0.00 0.00 0.00 0.00 44.72 44.16 1bxr s GLY 130 CO 0.26 -0.52 0.04 0.00 0.00 0.00 0.00 173.10 172.89 1bxr s ILE 132 N 0.14 3.73 -0.15 0.00 1.01 0.10 -1.55 121.20 124.48 1bxr s ILE 132 Ca -0.01 -0.46 -0.00 0.00 0.00 0.00 0.00 60.65 60.18 1bxr s ILE 132 Cb -0.02 -2.55 0.03 0.00 0.01 0.00 0.00 42.46 39.94 1bxr s ILE 132 CO -0.00 0.58 -0.08 -0.63 0.00 0.00 0.00 174.94 174.81 1bxr s ILE 133 N -0.58 1.22 -0.31 2.92 1.01 0.75 -1.32 121.20 124.90 1bxr s ILE 133 Ca 0.09 -0.59 -0.07 0.00 0.00 0.00 0.00 60.65 60.08 1bxr s ILE 133 Cb -0.12 -1.30 0.02 0.00 0.01 0.00 0.00 42.46 41.07 1bxr s ILE 133 CO 0.02 0.24 0.09 0.00 0.00 0.00 0.00 174.94 175.29 1bxr s ALA 134 N 1.60 3.08 -0.07 9.38 0.00 0.33 -1.63 121.76 134.45 1bxr s ALA 134 Ca 0.02 -1.54 -0.22 0.00 0.00 0.00 0.00 51.96 50.22 1bxr s ALA 134 Cb -0.14 -2.21 0.07 0.00 0.00 0.00 0.00 23.12 20.84 1bxr s ALA 134 CO -0.08 -1.05 0.98 0.41 0.00 0.00 0.00 175.76 176.02 1bxr n GLY 135 N 4.86 0.17 0.26 0.00 0.00 -0.98 0.22 105.19 109.72 1bxr n GLY 135 Ca -0.14 -0.95 -0.09 0.00 0.00 0.00 0.00 46.02 44.85 1bxr n GLY 135 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1bxr h ASP 136 N 1.42 -0.73 -2.03 1.61 3.32 -1.96 -3.35 116.42 114.71 1bxr h ASP 136 Ca -0.14 0.13 -0.56 0.00 0.02 0.00 0.00 57.03 56.48 1bxr h ASP 136 Cb 0.83 0.34 -0.39 0.00 0.22 0.00 0.00 39.33 40.34 1bxr h ASP 136 CO 0.21 -0.27 -1.09 0.59 -1.72 0.00 0.00 179.24 176.96 1bxr n ASN 137 N -5.37 0.07 -4.58 6.45 4.13 -1.26 -4.73 115.26 109.97 1bxr n ASN 137 Ca -0.01 -2.66 -0.47 0.00 1.68 0.00 0.00 54.58 53.12 1bxr n ASN 137 Cb 0.28 -0.61 -0.03 0.00 -1.54 0.00 0.00 39.78 37.88 1bxr n ASN 137 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1bxr n PRO 138 N 1.59 1.25 -3.35 3.52 -0.05 -1.26 -4.93 135.00 131.77 1bxr n PRO 138 Ca 0.22 0.44 -0.41 0.00 -0.05 0.00 0.00 63.50 63.70 1bxr n PRO 138 Cb 0.52 -1.89 -0.09 0.00 -0.05 0.00 0.00 33.50 31.99 1bxr n PRO 138 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 175.50 175.79 1bxr s ASP 139 N -0.20 6.22 0.17 3.54 -1.08 -1.26 -5.00 116.67 119.06 1bxr s ASP 139 Ca 0.68 -0.24 -0.13 0.00 -0.52 0.00 0.00 52.55 52.33 1bxr s ASP 139 Cb -0.79 -2.22 0.06 0.00 -1.46 0.00 0.00 42.92 38.51 1bxr s ASP 139 CO 0.55 -0.41 1.76 0.00 0.52 0.00 0.00 175.17 177.59 1bxr h ALA 140 N 8.50 0.70 -0.17 3.66 0.00 -1.99 -1.19 119.26 128.76 1bxr h ALA 140 Ca -0.29 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.40 1bxr h ALA 140 Cb 1.13 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1bxr h ALA 140 CO 0.73 0.24 -0.37 0.00 0.00 0.00 0.00 179.25 179.85 1bxr h ALA 141 N 1.11 1.05 -0.35 0.00 0.00 -1.99 -1.55 119.26 117.54 1bxr h ALA 141 Ca 0.19 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 1bxr h ALA 141 Cb 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1bxr h ALA 141 CO -0.03 0.59 0.04 1.25 0.00 0.00 0.00 179.25 181.10 1bxr h LEU 142 N 0.32 0.58 -0.73 0.00 5.85 -1.93 0.32 115.31 119.71 1bxr h LEU 142 Ca 0.03 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.48 1bxr h LEU 142 Cb 0.80 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.63 1bxr h LEU 142 CO 0.06 0.71 0.47 0.00 -0.34 0.00 0.00 178.44 179.35 1bxr h ALA 143 N 0.89 0.93 -0.23 1.25 0.00 -1.01 0.48 119.26 121.57 1bxr h ALA 143 Ca 0.10 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1bxr h ALA 143 Cb 0.40 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1bxr h ALA 143 CO 0.01 0.36 0.11 1.25 0.00 0.00 0.00 179.25 180.98 1bxr h LEU 144 N 0.99 0.30 0.19 0.00 5.85 -1.05 0.54 115.31 122.12 1bxr h LEU 144 Ca 0.27 -0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.87 1bxr h LEU 144 Cb -0.09 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 40.82 1bxr h LEU 144 CO -0.06 0.34 -0.34 -0.08 -0.34 0.00 0.00 178.44 177.97 1bxr h GLU 145 N 0.23 -0.59 -0.23 1.25 4.81 0.17 -0.09 114.58 120.14 1bxr h GLU 145 Ca 0.08 0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.40 1bxr h GLU 145 Cb 0.13 0.13 -0.05 0.00 0.63 0.00 0.00 28.75 29.59 1bxr h GLU 145 CO -0.01 -0.39 -0.11 0.87 -0.73 0.00 0.00 179.01 178.63 1bxr h LYS 146 N -0.61 -0.08 -0.04 1.92 1.57 0.36 -2.02 116.57 117.66 1bxr h LYS 146 Ca 0.01 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.82 1bxr h LYS 146 Cb 0.61 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.88 1bxr h LYS 146 CO -0.16 -0.06 -0.54 0.00 -0.57 0.00 0.00 179.45 178.12 1bxr h ALA 147 N 1.11 -0.94 -0.92 3.86 0.00 0.43 -2.72 119.26 120.09 1bxr h ALA 147 Ca 0.13 -0.08 0.12 0.00 0.00 0.00 0.00 54.91 55.08 1bxr h ALA 147 Cb 0.27 0.98 -0.07 0.00 0.00 0.00 0.00 17.79 18.97 1bxr h ALA 147 CO -0.29 -1.11 0.59 0.00 0.00 0.00 0.00 179.25 178.44 1bxr h ARG 148 N -0.65 0.81 0.00 0.00 3.08 -0.87 -2.60 114.38 114.16 1bxr h ARG 148 Ca 0.02 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 1bxr h ARG 148 Cb 0.71 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 1bxr h ARG 148 CO -0.39 0.54 -0.18 0.00 -1.07 0.00 0.00 179.97 178.87 1bxr h ALA 149 N 1.57 1.34 -2.12 0.04 0.00 -1.09 -3.46 119.26 115.55 1bxr h ALA 149 Ca 0.44 -0.16 -0.61 0.00 0.00 0.00 0.00 54.91 54.58 1bxr h ALA 149 Cb 0.54 -0.03 0.06 0.00 0.00 0.00 0.00 17.79 18.36 1bxr h ALA 149 CO -0.21 0.22 0.68 0.34 0.00 0.00 0.00 179.25 180.28 1bxr n PHE 150 N -3.80 2.05 -0.11 0.00 7.35 -0.98 -4.90 117.46 117.07 1bxr n PHE 150 Ca -0.02 0.39 -0.05 0.00 -0.76 0.00 0.00 57.45 57.01 1bxr n PHE 150 Cb 0.28 -2.47 0.15 0.00 0.35 0.00 0.00 39.48 37.79 1bxr n PHE 150 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 1bxr h PRO 151 N 5.33 0.81 0.00 -7.13 0.11 -1.90 -3.49 132.00 125.72 1bxr h PRO 151 Ca -0.46 -0.22 0.00 0.00 0.11 0.00 0.00 66.00 65.43 1bxr h PRO 151 Cb 1.28 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1bxr h PRO 151 CO 0.84 0.82 0.00 0.41 -0.21 0.00 0.00 178.00 179.86 1bxr n GLY 152 N -0.61 2.30 0.19 -0.55 0.00 -1.26 -4.83 105.19 100.42 1bxr n GLY 152 Ca 0.02 -1.56 0.03 0.00 0.00 0.00 0.00 46.02 44.52 1bxr n GLY 152 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1bxr h LEU 153 N 0.00 0.00 -9.38 0.99 3.38 -1.95 -3.38 115.31 104.97 1bxr h LEU 153 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 1bxr h LEU 153 Cb 0.00 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.78 1bxr h LEU 153 CO 0.00 0.36 1.13 -3.20 0.09 0.00 0.00 178.44 176.82 1bxr n ASN 154 N -4.10 3.81 0.00 -0.43 4.05 -1.26 -0.18 115.26 117.15 1bxr n ASN 154 Ca -0.02 0.96 0.00 0.00 0.45 0.00 0.00 54.58 55.97 1bxr n ASN 154 Cb 0.40 -1.47 0.00 0.00 1.23 0.00 0.00 39.78 39.94 1bxr n ASN 154 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1bxr n GLY 155 N 4.34 1.95 3.68 8.20 0.00 -1.26 -5.02 105.19 117.08 1bxr n GLY 155 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1bxr n GLY 155 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1bxr s MET 156 N -0.36 4.35 -0.40 1.61 0.00 0.75 -4.76 119.30 120.49 1bxr s MET 156 Ca 0.00 1.16 -0.24 0.00 0.00 0.00 0.00 55.69 56.62 1bxr s MET 156 Cb 0.00 -3.56 0.02 0.00 0.00 0.00 0.00 34.83 31.29 1bxr s MET 156 CO 0.00 -0.32 0.82 0.34 0.00 0.00 0.00 175.02 175.86 1bxr s ASP 157 N 1.12 6.52 -0.10 1.11 -1.08 -1.26 0.83 116.67 123.81 1bxr s ASP 157 Ca 0.42 0.23 0.12 0.00 -0.52 0.00 0.00 52.55 52.81 1bxr s ASP 157 Cb -0.17 -2.41 -0.18 0.00 -1.46 0.00 0.00 42.92 38.70 1bxr s ASP 157 CO 0.14 -0.84 0.12 0.18 0.52 0.00 0.00 175.17 175.29 1bxr n LEU 158 N 6.65 0.00 -0.34 -1.34 4.77 -1.26 -4.55 117.00 120.94 1bxr n LEU 158 Ca 0.04 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.11 1bxr n LEU 158 Cb 0.48 0.24 0.29 0.00 -2.33 0.00 0.00 43.42 42.10 1bxr n LEU 158 CO 0.57 0.24 1.23 0.00 -1.33 0.00 0.00 177.39 178.10 1bxr h ALA 159 N 0.83 1.62 0.00 -1.18 0.00 -1.78 0.13 119.26 118.88 1bxr h ALA 159 Ca -0.27 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1bxr h ALA 159 Cb 1.51 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1bxr h ALA 159 CO 0.01 0.11 0.00 0.36 0.00 0.00 0.00 179.25 179.73 1bxr n LYS 160 N -4.63 0.09 -0.00 0.00 2.85 -1.26 -1.47 118.16 113.73 1bxr n LYS 160 Ca 0.19 0.36 -0.06 0.00 -1.05 0.00 0.00 58.31 57.76 1bxr n LYS 160 Cb 0.42 -1.68 -0.12 0.00 -0.65 0.00 0.00 35.03 33.00 1bxr n LYS 160 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1bxr n GLU 161 N -1.85 0.63 -0.01 -1.58 -0.58 0.43 -4.30 120.64 113.38 1bxr n GLU 161 Ca 0.02 0.27 0.06 0.00 -0.42 0.00 0.00 57.16 57.09 1bxr n GLU 161 Cb 0.17 -1.80 0.05 0.00 -0.57 0.00 0.00 31.44 29.30 1bxr n GLU 161 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1bxr n VAL 162 N -2.99 0.05 -1.25 2.62 0.24 -1.04 -5.02 118.33 110.94 1bxr n VAL 162 Ca -0.15 -0.52 -0.29 0.00 -2.04 0.00 0.00 64.34 61.34 1bxr n VAL 162 Cb 0.98 1.20 0.14 0.00 -1.47 0.00 0.00 33.84 34.69 1bxr n VAL 162 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1bxr s THR 163 N -0.92 2.54 0.31 3.34 -1.32 -0.54 -4.50 115.64 114.54 1bxr s THR 163 Ca 0.13 0.17 -0.28 0.00 -1.21 0.00 0.00 61.69 60.50 1bxr s THR 163 Cb 0.09 -2.70 -0.09 0.00 -1.51 0.00 0.00 72.50 68.29 1bxr s THR 163 CO 0.14 -0.23 1.12 0.28 -2.21 0.00 0.00 174.62 173.72 1bxr s THR 164 N -2.98 3.40 0.02 5.08 -1.32 -1.26 -4.98 115.64 113.59 1bxr s THR 164 Ca 0.64 1.36 -0.26 0.00 -1.21 0.00 0.00 61.69 62.21 1bxr s THR 164 Cb -0.18 -3.84 -0.16 0.00 -1.51 0.00 0.00 72.50 66.81 1bxr s THR 164 CO 0.57 0.28 1.22 0.00 -2.21 0.00 0.00 174.62 174.48 1bxr h ALA 165 N 3.55 -0.68 -2.88 11.08 0.00 -2.00 -3.39 119.26 124.94 1bxr h ALA 165 Ca -0.47 -0.19 -0.60 0.00 0.00 0.00 0.00 54.91 53.65 1bxr h ALA 165 Cb 1.22 0.26 -0.09 0.00 0.00 0.00 0.00 17.79 19.18 1bxr h ALA 165 CO 0.66 -0.74 -0.60 -1.21 0.00 0.00 0.00 179.25 177.36 1bxr s GLU 166 N -4.82 2.73 0.69 0.00 2.02 -1.26 -4.82 118.70 113.24 1bxr s GLU 166 Ca -0.14 -0.90 -0.11 0.00 0.02 0.00 0.00 54.97 53.83 1bxr s GLU 166 Cb 0.02 -2.57 0.00 0.00 0.10 0.00 0.00 34.13 31.68 1bxr s GLU 166 CO 0.50 0.49 1.07 0.00 0.02 0.00 0.00 175.26 177.34 1bxr s ALA 167 N -1.65 2.83 0.39 5.21 0.00 -1.26 -4.70 121.76 122.58 1bxr s ALA 167 Ca 0.29 -0.15 -0.15 0.00 0.00 0.00 0.00 51.96 51.95 1bxr s ALA 167 Cb -0.10 -3.08 0.06 0.00 0.00 0.00 0.00 23.12 19.99 1bxr s ALA 167 CO 0.21 -1.08 0.80 2.48 0.00 0.00 0.00 175.76 178.17 1bxr n TYR 168 N -3.00 -2.34 -4.79 0.00 4.11 -0.20 -4.95 117.16 105.98 1bxr n TYR 168 Ca 0.07 -1.84 -0.33 0.00 -0.00 0.00 0.00 57.90 55.80 1bxr n TYR 168 Cb 0.55 0.92 -0.12 0.00 -0.00 0.00 0.00 39.34 40.69 1bxr n TYR 168 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 1bxr s SER 169 N -3.08 4.24 -0.15 9.48 0.15 -1.26 0.53 113.70 123.61 1bxr s SER 169 Ca 0.16 -0.14 -0.02 0.00 0.70 0.00 0.00 55.95 56.65 1bxr s SER 169 Cb -0.05 -0.95 0.05 0.00 -1.71 0.00 0.00 66.02 63.35 1bxr s SER 169 CO 0.12 0.35 0.01 0.86 1.20 0.00 0.00 173.24 175.78 1bxr s TRP 170 N -0.76 1.00 -0.01 3.44 -0.11 -0.10 -4.99 118.94 117.42 1bxr s TRP 170 Ca 0.12 -0.67 0.01 0.00 1.22 0.00 0.00 56.10 56.78 1bxr s TRP 170 Cb -0.11 -1.00 0.01 0.00 -1.50 0.00 0.00 33.47 30.88 1bxr s TRP 170 CO 0.01 -0.52 1.00 0.25 -4.62 0.00 0.00 176.95 173.07 1bxr n THR 171 N 5.06 1.03 -2.78 5.86 -2.24 -1.26 -2.86 114.28 117.09 1bxr n THR 171 Ca -0.09 -1.04 -0.39 0.00 -2.27 0.00 0.00 64.05 60.26 1bxr n THR 171 Cb 0.48 0.47 -0.06 0.00 -2.10 0.00 0.00 70.33 69.12 1bxr n THR 171 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1bxr s GLN 172 N -1.07 4.73 0.42 -0.78 0.74 -1.26 -2.45 119.66 119.99 1bxr s GLN 172 Ca 0.01 1.40 0.00 0.00 0.05 0.00 0.00 55.36 56.83 1bxr s GLN 172 Cb 0.01 -3.07 0.08 0.00 1.10 0.00 0.00 33.01 31.13 1bxr s GLN 172 CO 0.00 0.42 0.58 0.41 -0.55 0.00 0.00 175.29 176.15 1bxr n GLY 173 N 1.10 0.75 3.82 2.59 0.00 -1.26 -4.06 105.19 108.13 1bxr n GLY 173 Ca -0.01 -2.01 -0.32 0.00 0.00 0.00 0.00 46.02 43.69 1bxr n GLY 173 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bxr s SER 174 N -3.37 5.66 0.35 1.61 0.01 -1.25 -4.57 113.70 112.13 1bxr s SER 174 Ca 0.39 1.66 -0.26 0.00 1.31 0.00 0.00 55.95 59.04 1bxr s SER 174 Cb -0.02 -2.51 -0.09 0.00 0.21 0.00 0.00 66.02 63.61 1bxr s SER 174 CO 0.26 -1.25 1.06 0.86 0.41 0.00 0.00 173.24 174.57 1bxr s TRP 175 N -2.85 3.43 0.25 2.43 -0.00 -1.26 -4.31 118.94 116.62 1bxr s TRP 175 Ca 0.59 1.68 0.11 0.00 -0.00 0.00 0.00 56.10 58.49 1bxr s TRP 175 Cb -0.14 -3.16 -0.05 0.00 -0.00 0.00 0.00 33.47 30.12 1bxr s TRP 175 CO 0.48 -0.51 -0.16 0.95 -0.00 0.00 0.00 176.95 177.71 1bxr s THR 176 N -1.47 2.71 0.01 5.86 -4.23 -0.90 -4.84 115.64 112.78 1bxr s THR 176 Ca 0.52 -2.15 -0.24 0.00 -1.18 0.00 0.00 61.69 58.64 1bxr s THR 176 Cb -0.25 -2.39 -0.18 0.00 1.34 0.00 0.00 72.50 71.02 1bxr s THR 176 CO 0.32 -0.30 1.35 0.25 -0.54 0.00 0.00 174.62 175.71 1bxr h LEU 177 N 2.49 0.11 0.24 4.79 5.85 -1.98 2.27 115.31 129.09 1bxr h LEU 177 Ca -0.43 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 57.86 1bxr h LEU 177 Cb 1.24 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1bxr h LEU 177 CO 0.57 0.51 -0.12 0.74 -0.34 0.00 0.00 178.44 179.79 1bxr h THR 178 N -0.29 0.81 0.13 1.05 2.02 -2.04 -3.34 112.91 111.25 1bxr h THR 178 Ca 0.01 -0.40 -0.33 0.00 0.77 0.00 0.00 66.41 66.46 1bxr h THR 178 Cb 0.47 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.91 1bxr h THR 178 CO 0.01 0.09 -1.72 1.23 0.37 0.00 0.00 175.52 175.50 1bxr h GLY 179 N -0.54 0.30 0.00 2.16 0.00 -1.97 -3.51 103.07 99.52 1bxr h GLY 179 Ca -0.03 -0.78 0.00 0.00 0.00 0.00 0.00 47.33 46.52 1bxr h GLY 179 CO 0.06 0.68 0.00 0.61 0.00 0.00 0.00 176.54 177.89 1bxr n GLY 180 N 1.78 -1.50 3.59 4.60 0.00 0.77 -4.63 105.19 109.81 1bxr n GLY 180 Ca -0.22 -1.30 -0.42 0.00 0.00 0.00 0.00 46.02 44.08 1bxr n GLY 180 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bxr s LEU 181 N 0.00 3.47 0.75 0.99 1.43 -1.26 -2.11 118.68 121.95 1bxr s LEU 181 Ca 0.00 1.33 -0.13 0.00 -1.03 0.00 0.00 54.13 54.29 1bxr s LEU 181 Cb 0.00 -3.38 0.05 0.00 0.03 0.00 0.00 46.19 42.89 1bxr s LEU 181 CO 0.00 -1.87 1.15 -2.16 0.23 0.00 0.00 176.35 173.69 1bxr s PRO 182 N 6.04 2.16 0.90 1.29 0.04 -1.26 -4.99 135.00 139.18 1bxr s PRO 182 Ca 0.84 1.51 -0.11 0.00 0.04 0.00 0.00 61.00 63.27 1bxr s PRO 182 Cb -0.23 -1.86 0.14 0.00 0.04 0.00 0.00 34.50 32.58 1bxr s PRO 182 CO 0.32 -1.77 1.10 -0.65 0.04 0.00 0.00 177.00 176.04 1bxr s GLN 183 N -4.27 1.16 -0.55 4.56 -0.21 -1.26 -4.61 119.66 114.47 1bxr s GLN 183 Ca 0.68 1.06 -0.26 0.00 0.02 0.00 0.00 55.36 56.86 1bxr s GLN 183 Cb -0.23 -1.78 0.03 0.00 1.00 0.00 0.00 33.01 32.03 1bxr s GLN 183 CO 0.48 -2.37 1.07 0.00 -2.12 0.00 0.00 175.29 172.34 1bxr s ALA 184 N -2.81 3.09 0.19 6.09 0.00 -1.26 -4.46 121.76 122.60 1bxr s ALA 184 Ca 0.64 -0.97 -0.21 0.00 0.00 0.00 0.00 51.96 51.42 1bxr s ALA 184 Cb -0.20 -3.88 -0.13 0.00 0.00 0.00 0.00 23.12 18.92 1bxr s ALA 184 CO 0.58 -2.48 0.33 1.63 0.00 0.00 0.00 175.76 175.82 1bxr n LYS 185 N 7.91 0.00 -2.72 0.00 5.02 -1.02 -4.86 118.16 122.49 1bxr n LYS 185 Ca 0.06 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.94 1bxr n LYS 185 Cb 0.48 -0.77 -0.04 0.00 -0.02 0.00 0.00 35.03 34.68 1bxr n LYS 185 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1bxr s LYS 186 N -0.77 4.68 0.26 1.97 2.47 -1.26 -4.65 119.74 122.44 1bxr s LYS 186 Ca 0.49 1.45 -0.09 0.00 -1.56 0.00 0.00 55.97 56.26 1bxr s LYS 186 Cb -0.67 -3.39 0.42 0.00 -1.46 0.00 0.00 37.83 32.73 1bxr s LYS 186 CO 0.44 0.18 1.50 0.39 0.16 0.00 0.00 175.35 178.03 1bxr n GLU 187 N 2.92 -0.10 0.00 4.03 1.02 -1.26 0.98 120.64 128.22 1bxr n GLU 187 Ca 0.03 1.50 0.09 0.00 -0.02 0.00 0.00 57.16 58.76 1bxr n GLU 187 Cb 0.49 -2.24 0.43 0.00 -0.02 0.00 0.00 31.44 30.10 1bxr n GLU 187 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1bxr n ASP 188 N -5.55 0.00 0.13 1.62 5.68 -1.26 -2.25 116.55 114.92 1bxr n ASP 188 Ca 0.15 0.06 0.07 0.00 -0.50 0.00 0.00 54.79 54.57 1bxr n ASP 188 Cb 0.47 -0.30 0.04 0.00 -1.14 0.00 0.00 41.12 40.19 1bxr n ASP 188 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1bxr h GLU 189 N 0.00 0.00 -4.36 0.11 5.08 0.25 -3.44 114.58 112.22 1bxr h GLU 189 Ca 0.00 0.00 -0.73 0.00 -1.00 0.00 0.00 59.36 57.63 1bxr h GLU 189 Cb 0.17 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 29.18 1bxr h GLU 189 CO 0.00 0.19 -0.37 -0.51 -1.00 0.00 0.00 179.01 177.32 1bxr s LEU 190 N -5.98 5.46 0.24 1.33 1.43 -0.95 -4.97 118.68 115.24 1bxr s LEU 190 Ca 0.02 -1.36 -0.05 0.00 -1.03 0.00 0.00 54.13 51.71 1bxr s LEU 190 Cb 0.08 -2.12 0.43 0.00 0.03 0.00 0.00 46.19 44.60 1bxr s LEU 190 CO 0.75 -0.61 1.71 1.55 0.23 0.00 0.00 176.35 179.98 1bxr h PRO 191 N 8.65 0.34 -6.32 1.29 0.13 -1.83 -3.41 132.00 130.85 1bxr h PRO 191 Ca -0.27 -0.02 -0.52 0.00 -0.87 0.00 0.00 66.00 64.33 1bxr h PRO 191 Cb 1.10 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.14 1bxr h PRO 191 CO 0.84 0.22 -0.28 -0.06 -0.23 0.00 0.00 178.00 178.49 1bxr s PHE 192 N -6.04 3.48 -0.11 1.56 0.08 0.27 -4.98 117.98 112.25 1bxr s PHE 192 Ca -0.13 0.37 -0.01 0.00 0.12 0.00 0.00 56.93 57.29 1bxr s PHE 192 Cb 0.20 -1.88 0.03 0.00 -0.57 0.00 0.00 43.02 40.80 1bxr s PHE 192 CO 0.76 0.30 -0.06 -1.58 -0.10 0.00 0.00 175.22 174.53 1bxr s HIS 193 N -1.99 1.37 0.07 0.36 5.65 -1.25 0.11 115.29 119.60 1bxr s HIS 193 Ca 0.39 -0.66 0.09 0.00 0.25 0.00 0.00 55.06 55.14 1bxr s HIS 193 Cb -0.11 -1.17 -0.03 0.00 -1.18 0.00 0.00 32.58 30.09 1bxr s HIS 193 CO 0.30 -0.49 -0.25 0.08 -0.65 0.00 0.00 174.74 173.74 1bxr s VAL 194 N 1.75 2.32 -0.22 0.89 1.01 0.38 -1.40 120.40 125.13 1bxr s VAL 194 Ca 0.05 -1.48 -0.07 0.00 0.00 0.00 0.00 61.98 60.48 1bxr s VAL 194 Cb -0.13 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 1bxr s VAL 194 CO -0.08 0.26 0.07 -0.69 0.00 0.00 0.00 175.10 174.66 1bxr s VAL 195 N -0.92 4.56 -0.11 2.92 1.01 -0.98 -1.31 120.40 125.57 1bxr s VAL 195 Ca 0.13 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.03 1bxr s VAL 195 Cb -0.10 -3.10 0.01 0.00 0.00 0.00 0.00 36.38 33.19 1bxr s VAL 195 CO 0.04 0.39 -0.17 0.00 0.00 0.00 0.00 175.10 175.36 1bxr s ALA 196 N 1.03 1.79 -0.53 5.51 0.00 0.69 0.15 121.76 130.41 1bxr s ALA 196 Ca 0.04 -0.78 -0.29 0.00 0.00 0.00 0.00 51.96 50.93 1bxr s ALA 196 Cb -0.14 -0.83 0.03 0.00 0.00 0.00 0.00 23.12 22.18 1bxr s ALA 196 CO 0.03 -0.01 1.19 0.71 0.00 0.00 0.00 175.76 177.68 1bxr s TYR 197 N 0.86 2.67 -0.85 0.00 2.02 0.08 0.37 117.35 122.49 1bxr s TYR 197 Ca -0.09 0.56 -0.25 0.00 -0.37 0.00 0.00 57.07 56.93 1bxr s TYR 197 Cb -0.15 -4.47 -0.00 0.00 -0.40 0.00 0.00 41.96 36.94 1bxr s TYR 197 CO -0.00 -1.49 1.67 0.34 -1.57 0.00 0.00 175.55 174.50 1bxr s ASP 198 N 2.87 5.74 -0.11 2.29 2.15 -0.08 -3.13 116.67 126.41 1bxr s ASP 198 Ca 0.47 -0.68 0.12 0.00 0.43 0.00 0.00 52.55 52.89 1bxr s ASP 198 Cb -0.08 -2.56 0.53 0.00 -0.30 0.00 0.00 42.92 40.51 1bxr s ASP 198 CO 0.29 -2.15 1.36 0.49 -0.17 0.00 0.00 175.17 174.99 1bxr n PHE 199 N 11.45 1.19 0.00 -5.34 3.72 -1.25 -3.85 117.46 123.38 1bxr n PHE 199 Ca 0.28 -0.45 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 1bxr n PHE 199 Cb 0.49 -0.26 0.00 0.00 -0.94 0.00 0.00 39.48 38.78 1bxr n PHE 199 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bxr n GLY 200 N 0.72 1.38 3.78 1.37 0.00 -1.19 -3.88 105.19 107.37 1bxr n GLY 200 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1bxr n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bxr s ALA 201 N -2.00 3.50 0.12 4.61 0.00 -1.22 -4.29 121.76 122.48 1bxr s ALA 201 Ca 0.00 1.50 -0.26 0.00 0.00 0.00 0.00 51.96 53.20 1bxr s ALA 201 Cb 0.00 -3.58 -0.07 0.00 0.00 0.00 0.00 23.12 19.47 1bxr s ALA 201 CO 0.00 -1.01 0.80 0.15 0.00 0.00 0.00 175.76 175.70 1bxr s LYS 202 N -2.12 4.57 0.30 0.00 1.02 -1.26 -4.89 119.74 117.36 1bxr s LYS 202 Ca 0.54 1.18 0.05 0.00 0.02 0.00 0.00 55.97 57.75 1bxr s LYS 202 Cb -0.45 -3.32 0.70 0.00 -0.52 0.00 0.00 37.83 34.25 1bxr s LYS 202 CO 0.60 0.42 1.79 0.00 -0.92 0.00 0.00 175.35 177.24 1bxr h ARG 203 N 4.98 0.79 -0.98 1.68 3.08 -0.75 -2.47 114.38 120.72 1bxr h ARG 203 Ca -0.45 -0.05 0.12 0.00 0.07 0.00 0.00 59.98 59.67 1bxr h ARG 203 Cb 1.21 -0.18 -0.08 0.00 0.08 0.00 0.00 29.97 31.00 1bxr h ARG 203 CO 0.69 0.53 0.62 -0.97 -1.07 0.00 0.00 179.97 179.76 1bxr h ASN 204 N 0.82 0.87 -0.98 7.04 -1.24 -1.92 -0.16 115.58 120.01 1bxr h ASN 204 Ca 0.56 0.04 0.03 0.00 0.71 0.00 0.00 56.30 57.65 1bxr h ASN 204 Cb 0.81 -0.13 -0.06 0.00 0.73 0.00 0.00 38.32 39.67 1bxr h ASN 204 CO -0.36 0.47 0.65 0.40 -1.29 0.00 0.00 177.43 177.29 1bxr h ILE 205 N 0.94 1.18 0.12 2.57 2.04 -1.75 0.49 117.51 123.09 1bxr h ILE 205 Ca 0.48 -0.43 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 1bxr h ILE 205 Cb 0.52 -0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 1bxr h ILE 205 CO -0.25 0.23 -0.06 -0.07 0.00 0.00 0.00 178.15 178.01 1bxr h LEU 206 N 1.26 -0.13 -0.64 1.44 3.38 -1.25 -1.66 115.31 117.69 1bxr h LEU 206 Ca 0.39 -0.21 0.07 0.00 0.09 0.00 0.00 57.88 58.22 1bxr h LEU 206 Cb -0.02 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 1bxr h LEU 206 CO -0.12 0.14 0.32 0.03 0.09 0.00 0.00 178.44 178.91 1bxr h ARG 207 N -0.41 0.57 0.00 1.13 3.08 -0.62 0.12 114.38 118.25 1bxr h ARG 207 Ca -0.02 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 1bxr h ARG 207 Cb 0.34 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 1bxr h ARG 207 CO 0.03 0.38 -0.02 0.52 -1.07 0.00 0.00 179.97 179.80 1bxr h MET 208 N 0.58 0.00 0.02 0.04 2.86 0.11 -1.36 114.93 117.18 1bxr h MET 208 Ca 0.30 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.94 1bxr h MET 208 Cb 0.27 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.93 1bxr h MET 208 CO -0.22 0.02 -0.01 -0.07 1.06 0.00 0.00 176.91 177.69 1bxr h LEU 209 N 0.00 -0.02 -2.00 1.22 3.38 -0.11 -2.97 115.31 114.82 1bxr h LEU 209 Ca -0.00 -0.64 0.01 0.00 0.09 0.00 0.00 57.88 57.35 1bxr h LEU 209 Cb 0.68 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 1bxr h LEU 209 CO 0.00 0.64 0.04 0.58 0.09 0.00 0.00 178.44 179.79 1bxr h VAL 210 N -0.69 0.98 0.00 1.22 2.07 -0.72 0.36 116.25 119.48 1bxr h VAL 210 Ca -0.00 -0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1bxr h VAL 210 Cb 0.65 0.97 -0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1bxr h VAL 210 CO 0.00 0.00 -0.09 0.44 0.02 0.00 0.00 177.57 177.94 1bxr h ASP 211 N 0.00 0.00 -0.14 0.57 3.32 -1.16 -1.38 116.42 117.63 1bxr h ASP 211 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1bxr h ASP 211 Cb 0.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.64 1bxr h ASP 211 CO -0.00 0.09 0.00 0.54 -1.72 0.00 0.00 179.24 178.15 1bxr n ARG 212 N -3.56 1.77 -0.13 3.56 1.74 0.13 -4.92 116.66 115.26 1bxr n ARG 212 Ca -0.02 -1.15 0.00 0.00 -0.77 0.00 0.00 57.85 55.91 1bxr n ARG 212 Cb 0.22 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.24 1bxr n ARG 212 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1bxr n GLY 213 N 1.17 0.92 3.62 -0.13 0.00 -0.52 -4.96 105.19 105.30 1bxr n GLY 213 Ca 0.17 -0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 1bxr n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bxr s ARG 215 N 0.64 4.26 -0.00 0.00 1.70 0.30 -3.85 118.95 122.00 1bxr s ARG 215 Ca 0.04 0.41 0.08 0.00 -0.47 0.00 0.00 55.73 55.80 1bxr s ARG 215 Cb -0.13 -3.39 -0.02 0.00 -0.57 0.00 0.00 34.95 30.84 1bxr s ARG 215 CO 0.01 0.27 -0.26 -0.51 -1.08 0.00 0.00 175.30 173.74 1bxr s LEU 216 N 0.27 2.10 -0.22 -1.89 1.43 -1.13 0.14 118.68 119.37 1bxr s LEU 216 Ca 0.25 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.87 1bxr s LEU 216 Cb -0.15 -1.33 0.03 0.00 0.03 0.00 0.00 46.19 44.77 1bxr s LEU 216 CO 0.10 0.31 -0.14 -0.89 0.23 0.00 0.00 176.35 175.96 1bxr s THR 217 N -0.66 2.27 -0.20 5.49 2.01 -0.43 -0.92 115.64 123.20 1bxr s THR 217 Ca 0.10 -1.18 -0.17 0.00 0.31 0.00 0.00 61.69 60.75 1bxr s THR 217 Cb -0.10 -2.12 -0.04 0.00 0.01 0.00 0.00 72.50 70.25 1bxr s THR 217 CO -0.00 0.29 0.46 -0.63 -0.69 0.00 0.00 174.62 174.04 1bxr s ILE 218 N 1.24 5.15 0.06 1.82 -1.09 0.19 -0.22 121.20 128.34 1bxr s ILE 218 Ca -0.01 0.83 0.09 0.00 -2.23 0.00 0.00 60.65 59.34 1bxr s ILE 218 Cb -0.16 -3.79 -0.03 0.00 -1.58 0.00 0.00 42.46 36.90 1bxr s ILE 218 CO -0.09 0.22 -0.26 0.68 -1.23 0.00 0.00 174.94 174.26 1bxr s VAL 219 N 1.46 2.22 0.82 2.92 -7.23 0.16 -1.03 120.40 119.72 1bxr s VAL 219 Ca 0.22 -1.43 -0.16 0.00 -1.81 0.00 0.00 61.98 58.79 1bxr s VAL 219 Cb -0.15 -1.89 -0.08 0.00 0.56 0.00 0.00 36.38 34.82 1bxr s VAL 219 CO 0.09 0.32 -0.03 -2.65 -0.31 0.00 0.00 175.10 172.52 1bxr n PRO 220 N 1.61 0.04 -0.19 4.82 -0.02 -1.26 -0.90 135.00 139.09 1bxr n PRO 220 Ca -0.17 0.04 -0.05 0.00 -2.02 0.00 0.00 63.50 61.30 1bxr n PRO 220 Cb 0.52 -1.43 0.05 0.00 -0.02 0.00 0.00 33.50 32.63 1bxr n PRO 220 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bxr h ALA 221 N -0.74 0.74 -0.10 3.55 0.00 -1.83 -2.79 119.26 118.09 1bxr h ALA 221 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1bxr h ALA 221 Cb 1.34 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1bxr h ALA 221 CO 0.35 0.05 0.00 1.04 0.00 0.00 0.00 179.25 180.68 1bxr n GLN 222 N -4.78 1.33 -1.77 0.00 6.02 -1.26 -4.59 117.38 112.33 1bxr n GLN 222 Ca 0.05 -0.40 -0.40 0.00 -0.01 0.00 0.00 57.00 56.23 1bxr n GLN 222 Cb 0.09 -1.22 0.01 0.00 1.02 0.00 0.00 30.24 30.15 1bxr n GLN 222 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1bxr n THR 223 N -0.12 2.46 -2.72 5.09 -1.04 -1.05 -4.95 114.28 111.95 1bxr n THR 223 Ca 0.04 -0.50 -0.38 0.00 -2.04 0.00 0.00 64.05 61.16 1bxr n THR 223 Cb 0.17 -1.91 -0.06 0.00 -1.82 0.00 0.00 70.33 66.71 1bxr n THR 223 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1bxr s SER 224 N -0.32 7.40 0.40 8.00 1.04 -1.26 -4.91 113.70 124.05 1bxr s SER 224 Ca 0.58 1.93 0.09 0.00 0.48 0.00 0.00 55.95 59.03 1bxr s SER 224 Cb -0.46 -2.60 0.88 0.00 0.10 0.00 0.00 66.02 63.95 1bxr s SER 224 CO 0.60 -0.02 1.98 0.00 0.98 0.00 0.00 173.24 176.78 1bxr h ALA 225 N 3.54 1.83 0.66 5.32 0.00 -1.93 -2.04 119.26 126.65 1bxr h ALA 225 Ca -0.46 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 1bxr h ALA 225 Cb 1.20 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1bxr h ALA 225 CO 0.66 0.06 -0.41 0.93 0.00 0.00 0.00 179.25 180.49 1bxr h GLU 226 N 0.58 -0.96 -0.88 0.00 3.07 -1.95 0.37 114.58 114.80 1bxr h GLU 226 Ca 0.27 0.07 0.25 0.00 -0.50 0.00 0.00 59.36 59.45 1bxr h GLU 226 Cb 0.33 0.22 -0.04 0.00 -0.84 0.00 0.00 28.75 28.42 1bxr h GLU 226 CO -0.08 -0.64 0.63 -0.44 -1.40 0.00 0.00 179.01 177.08 1bxr h ASP 227 N -1.00 0.03 0.29 1.42 3.32 -1.83 -2.58 116.42 116.08 1bxr h ASP 227 Ca -0.09 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 1bxr h ASP 227 Cb 0.80 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.35 1bxr h ASP 227 CO 0.09 0.01 -0.14 0.58 -1.72 0.00 0.00 179.24 178.06 1bxr h VAL 228 N 0.03 0.34 0.00 -1.35 2.07 -0.58 -3.09 116.25 113.67 1bxr h VAL 228 Ca 0.42 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 67.12 1bxr h VAL 228 Cb 1.64 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.98 1bxr h VAL 228 CO -0.02 0.09 0.38 -0.07 0.02 0.00 0.00 177.57 177.97 1bxr h LEU 229 N -1.02 0.00 0.00 2.57 3.38 -0.05 0.76 115.31 120.95 1bxr h LEU 229 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1bxr h LEU 229 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1bxr h LEU 229 CO 0.07 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.89 1bxr n LYS 230 N -2.68 0.93 0.00 1.13 5.02 -1.00 -2.50 118.16 119.06 1bxr n LYS 230 Ca -0.02 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.30 1bxr n LYS 230 Cb 0.42 -1.20 -0.01 0.00 -0.02 0.00 0.00 35.03 34.22 1bxr n LYS 230 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1bxr n MET 231 N -0.70 3.82 -3.14 1.97 0.00 0.26 -5.01 117.12 114.32 1bxr n MET 231 Ca 0.09 -0.23 -0.09 0.00 0.00 0.00 0.00 57.70 57.47 1bxr n MET 231 Cb 0.04 -0.84 0.01 0.00 0.00 0.00 0.00 33.22 32.43 1bxr n MET 231 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1bxr n ASN 232 N -0.72 -7.24 -4.78 7.83 5.03 -1.04 -4.93 115.26 109.40 1bxr n ASN 232 Ca 0.02 -0.03 -0.37 0.00 0.87 0.00 0.00 54.58 55.07 1bxr n ASN 232 Cb 0.09 -4.52 -0.04 0.00 -1.02 0.00 0.00 39.78 34.30 1bxr n ASN 232 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1bxr s PRO 233 N -3.12 4.18 0.19 3.52 0.04 -1.26 -4.96 135.00 133.60 1bxr s PRO 233 Ca 0.11 1.57 0.14 0.00 0.04 0.00 0.00 61.00 62.86 1bxr s PRO 233 Cb -0.02 -2.61 -0.03 0.00 0.04 0.00 0.00 34.50 31.88 1bxr s PRO 233 CO 0.79 -0.14 1.24 -0.44 0.04 0.00 0.00 177.00 178.49 1bxr h ASP 234 N 2.62 0.00 -4.67 6.66 3.32 -1.59 -3.48 116.42 119.27 1bxr h ASP 234 Ca -0.48 0.00 0.26 0.00 0.02 0.00 0.00 57.03 56.82 1bxr h ASP 234 Cb 1.22 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.60 1bxr h ASP 234 CO 0.63 0.60 0.78 -0.83 -1.72 0.00 0.00 179.24 178.69 1bxr s GLY 235 N -4.60 -0.33 -0.01 2.75 0.00 -1.25 -4.44 107.32 99.44 1bxr s GLY 235 Ca 0.02 1.28 0.08 0.00 0.00 0.00 0.00 44.72 46.09 1bxr s GLY 235 CO 0.77 0.40 -0.24 -0.42 0.00 0.00 0.00 173.10 173.61 1bxr s ILE 236 N -2.51 2.21 -0.05 0.90 1.01 0.21 -2.33 121.20 120.64 1bxr s ILE 236 Ca 0.10 -1.11 0.06 0.00 0.00 0.00 0.00 60.65 59.70 1bxr s ILE 236 Cb 0.00 -1.80 -0.01 0.00 0.01 0.00 0.00 42.46 40.67 1bxr s ILE 236 CO -0.05 0.54 -0.23 0.12 0.00 0.00 0.00 174.94 175.33 1bxr s PHE 237 N -0.67 2.19 -0.33 3.97 5.36 0.40 -1.96 117.98 126.95 1bxr s PHE 237 Ca 0.11 -0.63 -0.03 0.00 -0.96 0.00 0.00 56.93 55.42 1bxr s PHE 237 Cb -0.10 -1.44 0.06 0.00 -0.34 0.00 0.00 43.02 41.20 1bxr s PHE 237 CO -0.00 -0.19 0.06 -0.51 -1.46 0.00 0.00 175.22 173.13 1bxr s LEU 238 N -0.14 4.27 1.04 6.12 1.43 0.42 -0.75 118.68 131.07 1bxr s LEU 238 Ca -0.03 -1.40 -0.12 0.00 -1.03 0.00 0.00 54.13 51.55 1bxr s LEU 238 Cb -0.13 -1.77 0.21 0.00 0.03 0.00 0.00 46.19 44.54 1bxr s LEU 238 CO 0.03 -0.33 1.07 -0.94 0.23 0.00 0.00 176.35 176.41 1bxr s SER 239 N 1.40 2.13 1.03 2.29 1.04 -1.18 -0.79 113.70 119.61 1bxr s SER 239 Ca -0.02 1.44 -0.16 0.00 0.48 0.00 0.00 55.95 57.69 1bxr s SER 239 Cb -0.20 -2.14 0.22 0.00 0.10 0.00 0.00 66.02 64.00 1bxr s SER 239 CO -0.01 -3.48 1.23 0.54 0.98 0.00 0.00 173.24 172.50 1bxr s ASN 240 N -3.03 2.51 0.00 7.02 4.22 -1.14 -1.32 114.94 123.21 1bxr s ASN 240 Ca 0.66 0.48 0.00 0.00 -2.14 0.00 0.00 52.86 51.86 1bxr s ASN 240 Cb -0.21 -0.66 0.00 0.00 1.28 0.00 0.00 41.25 41.66 1bxr s ASN 240 CO 0.60 -3.12 0.00 0.61 -2.04 0.00 0.00 177.10 173.15 1bxr n GLY 241 N -2.69 1.85 3.48 0.45 0.00 -1.25 -3.14 105.19 103.90 1bxr n GLY 241 Ca 0.13 -1.00 -0.26 0.00 0.00 0.00 0.00 46.02 44.90 1bxr n GLY 241 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1bxr n PRO 242 N -0.77 -1.08 -0.40 1.61 -0.04 -1.26 -4.65 135.00 128.41 1bxr n PRO 242 Ca 0.00 -1.90 0.05 0.00 -0.04 0.00 0.00 63.50 61.61 1bxr n PRO 242 Cb 0.00 -1.19 -0.01 0.00 -0.04 0.00 0.00 33.50 32.26 1bxr n PRO 242 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1bxr n GLY 243 N -2.77 -1.05 3.74 0.55 0.00 -1.26 -3.80 105.19 100.60 1bxr n GLY 243 Ca 0.15 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.88 1bxr n GLY 243 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bxr s ASP 244 N -4.74 7.23 0.07 1.61 -1.08 0.24 -4.80 116.67 115.20 1bxr s ASP 244 Ca 0.00 2.12 -0.01 0.00 -0.52 0.00 0.00 52.55 54.13 1bxr s ASP 244 Cb 0.00 -2.60 -0.27 0.00 -1.46 0.00 0.00 42.92 38.59 1bxr s ASP 244 CO 0.00 -0.25 1.09 1.55 0.52 0.00 0.00 175.17 178.08 1bxr h PRO 245 N 5.15 0.21 -1.23 4.34 0.13 -1.86 -3.37 132.00 135.36 1bxr h PRO 245 Ca -0.44 -0.35 0.37 0.00 -0.87 0.00 0.00 66.00 64.71 1bxr h PRO 245 Cb 1.21 0.13 -0.11 0.00 0.13 0.00 0.00 31.00 32.36 1bxr h PRO 245 CO 0.73 1.13 0.80 0.00 -0.23 0.00 0.00 178.00 180.43 1bxr h ALA 246 N 0.66 2.61 -0.19 -0.56 0.00 -1.94 -0.61 119.26 119.23 1bxr h ALA 246 Ca -0.14 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1bxr h ALA 246 Cb 1.94 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.87 1bxr h ALA 246 CO 0.18 -1.14 0.00 -2.30 0.00 0.00 0.00 179.25 175.98 1bxr n PRO 247 N -4.62 1.52 -2.00 0.00 -0.01 -1.26 -4.46 135.00 124.17 1bxr n PRO 247 Ca 0.33 -0.81 -0.38 0.00 -0.01 0.00 0.00 63.50 62.63 1bxr n PRO 247 Cb 1.24 -1.25 -0.01 0.00 -0.01 0.00 0.00 33.50 33.47 1bxr n PRO 247 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 1bxr n ASP 249 N 1.14 -0.58 -0.31 0.00 5.68 -1.26 -1.71 116.55 119.52 1bxr n ASP 249 Ca 0.57 1.21 0.10 0.00 -0.50 0.00 0.00 54.79 56.17 1bxr n ASP 249 Cb 0.31 -0.25 0.22 0.00 -1.14 0.00 0.00 41.12 40.26 1bxr n ASP 249 CO 0.00 0.00 0.00 0.10 -1.33 0.00 0.00 177.20 175.97 1bxr h TYR 250 N 0.00 -0.11 0.02 2.11 -0.00 -1.96 -0.16 116.97 116.87 1bxr h TYR 250 Ca 0.09 0.07 -0.21 0.00 0.00 0.00 0.00 58.73 58.68 1bxr h TYR 250 Cb 0.22 0.19 -0.02 0.00 0.00 0.00 0.00 36.73 37.13 1bxr h TYR 250 CO -0.79 -0.35 -0.96 0.00 -0.00 0.00 0.00 178.16 176.06 1bxr h ALA 251 N 1.87 0.43 -0.47 0.10 0.00 -1.58 -2.69 119.26 116.93 1bxr h ALA 251 Ca 0.51 -0.82 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 1bxr h ALA 251 Cb 0.96 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1bxr h ALA 251 CO -0.83 1.07 0.14 0.82 0.00 0.00 0.00 179.25 180.44 1bxr h ILE 252 N 0.04 1.23 -0.02 0.00 2.04 -0.67 -1.63 117.51 118.50 1bxr h ILE 252 Ca -0.04 -0.77 0.02 0.00 1.00 0.00 0.00 64.86 65.07 1bxr h ILE 252 Cb 1.65 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 38.54 1bxr h ILE 252 CO 0.14 0.28 -0.13 0.74 0.00 0.00 0.00 178.15 179.17 1bxr h THR 253 N 0.62 0.67 0.12 -0.27 2.02 -1.20 -1.48 112.91 113.38 1bxr h THR 253 Ca 0.15 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.34 1bxr h THR 253 Cb 0.29 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.33 1bxr h THR 253 CO -0.00 0.00 -0.39 0.00 0.37 0.00 0.00 175.52 175.50 1bxr h ALA 254 N 0.76 -0.90 -0.92 6.16 0.00 -1.32 -1.81 119.26 121.23 1bxr h ALA 254 Ca 0.05 -0.09 0.27 0.00 0.00 0.00 0.00 54.91 55.14 1bxr h ALA 254 Cb 0.28 0.76 -0.15 0.00 0.00 0.00 0.00 17.79 18.68 1bxr h ALA 254 CO -0.14 -0.99 0.28 0.82 0.00 0.00 0.00 179.25 179.22 1bxr h ILE 255 N -0.57 0.24 -1.01 0.00 2.04 -1.17 1.52 117.51 118.57 1bxr h ILE 255 Ca -0.01 -0.06 0.09 0.00 1.00 0.00 0.00 64.86 65.88 1bxr h ILE 255 Cb 0.57 0.05 -0.08 0.00 -0.74 0.00 0.00 36.82 36.62 1bxr h ILE 255 CO -0.19 0.03 0.64 1.56 0.00 0.00 0.00 178.15 180.19 1bxr h GLN 256 N 0.18 1.05 0.38 2.37 4.20 -0.45 0.38 115.11 123.22 1bxr h GLN 256 Ca 0.61 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 59.24 1bxr h GLN 256 Cb 1.31 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.85 1bxr h GLN 256 CO -0.70 0.70 -0.18 0.87 -0.67 0.00 0.00 178.83 178.85 1bxr h LYS 257 N 1.08 -0.49 -0.92 1.46 1.57 0.27 -2.50 116.57 117.05 1bxr h LYS 257 Ca 0.47 0.03 0.19 0.00 -1.87 0.00 0.00 60.65 59.47 1bxr h LYS 257 Cb 0.34 0.11 -0.07 0.00 0.08 0.00 0.00 32.23 32.69 1bxr h LYS 257 CO -0.22 -0.23 0.59 0.74 -0.57 0.00 0.00 179.45 179.76 1bxr h PHE 258 N -0.69 0.68 0.00 -1.35 0.04 -0.56 0.46 116.94 115.52 1bxr h PHE 258 Ca -0.05 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.74 1bxr h PHE 258 Cb 0.49 -0.21 0.00 0.00 2.20 0.00 0.00 35.95 38.43 1bxr h PHE 258 CO -0.01 0.19 0.00 1.28 -0.60 0.00 0.00 178.31 179.17 1bxr n LEU 259 N -4.56 0.00 -0.01 1.54 4.77 0.13 -1.64 117.00 117.23 1bxr n LEU 259 Ca 0.19 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.25 1bxr n LEU 259 Cb 0.63 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.61 1bxr n LEU 259 CO 0.29 0.00 -0.55 -0.62 -1.33 0.00 0.00 177.39 175.17 1bxr n GLU 260 N -0.63 0.78 -0.74 3.23 1.02 0.16 -4.98 120.64 119.48 1bxr n GLU 260 Ca 0.04 -0.11 -0.05 0.00 -0.02 0.00 0.00 57.16 57.02 1bxr n GLU 260 Cb 0.02 -1.33 0.03 0.00 -0.02 0.00 0.00 31.44 30.14 1bxr n GLU 260 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1bxr n THR 261 N -1.90 0.00 0.06 2.62 -2.24 -0.65 -5.02 114.28 107.15 1bxr n THR 261 Ca -0.02 -0.27 0.06 0.00 -2.27 0.00 0.00 64.05 61.56 1bxr n THR 261 Cb 0.36 -1.55 0.13 0.00 -2.10 0.00 0.00 70.33 67.18 1bxr n THR 261 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1bxr n ASP 262 N -3.07 2.72 -4.77 3.42 9.92 -1.26 -4.97 116.55 118.54 1bxr n ASP 262 Ca 0.03 -1.83 -0.40 0.00 -0.53 0.00 0.00 54.79 52.06 1bxr n ASP 262 Cb 0.12 -0.17 0.01 0.00 -0.64 0.00 0.00 41.12 40.44 1bxr n ASP 262 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1bxr s ILE 263 N -1.03 2.12 0.14 0.53 1.01 -1.26 -4.81 121.20 117.89 1bxr s ILE 263 Ca 0.23 0.11 -0.30 0.00 0.00 0.00 0.00 60.65 60.68 1bxr s ILE 263 Cb 0.13 -3.06 -0.07 0.00 0.01 0.00 0.00 42.46 39.47 1bxr s ILE 263 CO 0.18 0.02 1.02 -2.84 0.00 0.00 0.00 174.94 173.31 1bxr s PRO 264 N -2.33 4.66 -0.07 2.79 0.02 -1.26 -4.66 135.00 134.15 1bxr s PRO 264 Ca 0.58 1.56 0.03 0.00 0.02 0.00 0.00 61.00 63.19 1bxr s PRO 264 Cb -0.44 -3.34 0.01 0.00 0.02 0.00 0.00 34.50 30.75 1bxr s PRO 264 CO 0.57 0.16 -0.14 0.08 -0.33 0.00 0.00 177.00 177.35 1bxr s VAL 265 N -0.10 1.27 -0.06 3.83 1.01 0.19 0.63 120.40 127.17 1bxr s VAL 265 Ca 0.48 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.90 1bxr s VAL 265 Cb -0.26 -1.14 0.02 0.00 0.00 0.00 0.00 36.38 35.00 1bxr s VAL 265 CO 0.32 0.38 -0.05 0.12 0.00 0.00 0.00 175.10 175.87 1bxr s PHE 266 N 0.57 0.93 0.05 5.22 5.36 -0.83 -1.05 117.98 128.23 1bxr s PHE 266 Ca -0.14 -0.32 0.08 0.00 -0.96 0.00 0.00 56.93 55.59 1bxr s PHE 266 Cb -0.16 -0.83 -0.03 0.00 -0.34 0.00 0.00 43.02 41.67 1bxr s PHE 266 CO 0.04 -0.27 -0.23 0.20 -1.46 0.00 0.00 175.22 173.50 1bxr s GLY 267 N 1.20 1.24 -0.13 13.12 0.00 -0.56 -0.44 107.32 121.75 1bxr s GLY 267 Ca -0.06 -1.15 0.02 0.00 0.00 0.00 0.00 44.72 43.53 1bxr s GLY 267 CO -0.02 -1.06 -0.18 -0.42 0.00 0.00 0.00 173.10 171.42 1bxr s ILE 268 N -0.82 1.73 0.00 0.90 1.01 0.03 -1.33 121.20 122.72 1bxr s ILE 268 Ca 0.09 -0.78 0.00 0.00 0.00 0.00 0.00 60.65 59.97 1bxr s ILE 268 Cb -0.09 -1.56 0.00 0.00 0.01 0.00 0.00 42.46 40.81 1bxr s ILE 268 CO 0.02 0.49 0.00 0.00 0.00 0.00 0.00 174.94 175.45 1bxr h LEU 270 N 0.00 -1.17 -1.99 0.00 5.85 -1.83 -1.06 115.31 115.11 1bxr h LEU 270 Ca 0.00 0.08 0.34 0.00 0.84 0.00 0.00 57.88 59.14 1bxr h LEU 270 Cb 0.00 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 41.35 1bxr h LEU 270 CO 0.00 -0.64 0.83 1.23 -0.34 0.00 0.00 178.44 179.52 1bxr h GLY 271 N -0.99 0.02 0.97 3.75 0.00 -0.51 0.95 103.07 107.25 1bxr h GLY 271 Ca -0.07 -0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.18 1bxr h GLY 271 CO 0.01 -0.00 -0.05 0.84 0.00 0.00 0.00 176.54 177.33 1bxr h HIS 272 N 0.00 0.83 -0.06 5.60 -0.00 -1.32 -1.11 115.15 119.10 1bxr h HIS 272 Ca 0.55 -0.16 -0.01 0.00 -0.00 0.00 0.00 60.37 60.75 1bxr h HIS 272 Cb 2.21 -0.21 -0.00 0.00 -0.00 0.00 0.00 27.41 29.41 1bxr h HIS 272 CO -0.00 0.86 0.00 1.96 -0.00 0.00 0.00 177.93 180.75 1bxr h GLN 273 N 0.57 0.11 0.28 5.26 4.20 0.15 -2.33 115.11 123.35 1bxr h GLN 273 Ca 0.11 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1bxr h GLN 273 Cb 0.56 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.30 1bxr h GLN 273 CO 0.03 0.37 -0.40 -0.07 -0.67 0.00 0.00 178.83 178.10 1bxr h LEU 274 N -0.17 -1.11 -1.90 1.46 3.38 -0.96 0.85 115.31 116.85 1bxr h LEU 274 Ca 0.02 0.11 0.28 0.00 0.09 0.00 0.00 57.88 58.38 1bxr h LEU 274 Cb 0.32 0.39 -0.04 0.00 0.09 0.00 0.00 40.66 41.43 1bxr h LEU 274 CO 0.00 -0.51 0.78 0.25 0.09 0.00 0.00 178.44 179.05 1bxr h LEU 275 N -0.74 0.00 0.00 1.67 5.85 -1.21 0.71 115.31 121.60 1bxr h LEU 275 Ca -0.01 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.61 1bxr h LEU 275 Cb 0.70 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 1bxr h LEU 275 CO -0.13 0.00 -0.82 0.00 -0.34 0.00 0.00 178.44 177.15 1bxr h ALA 276 N 1.35 0.68 0.03 1.25 0.00 -0.43 -2.98 119.26 119.16 1bxr h ALA 276 Ca 0.46 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1bxr h ALA 276 Cb 2.01 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.86 1bxr h ALA 276 CO -0.00 0.57 -0.01 -0.07 0.00 0.00 0.00 179.25 179.73 1bxr h LEU 277 N 0.00 -0.03 -2.04 0.00 3.38 0.26 0.51 115.31 117.38 1bxr h LEU 277 Ca -0.06 -0.67 0.07 0.00 0.09 0.00 0.00 57.88 57.31 1bxr h LEU 277 Cb 1.36 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.11 1bxr h LEU 277 CO 0.04 0.75 0.36 0.00 0.09 0.00 0.00 178.44 179.68 1bxr h ALA 278 N -0.14 1.79 -0.00 1.53 0.00 -1.14 2.59 119.26 123.89 1bxr h ALA 278 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1bxr h ALA 278 Cb 0.70 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1bxr h ALA 278 CO 0.01 -0.48 -0.22 0.43 0.00 0.00 0.00 179.25 178.98 1bxr n SER 279 N -3.45 0.69 0.00 0.00 7.64 -1.12 -4.75 113.62 112.62 1bxr n SER 279 Ca 0.03 -0.60 0.00 0.00 1.01 0.00 0.00 58.87 59.31 1bxr n SER 279 Cb 0.48 0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 1bxr n SER 279 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bxr n GLY 280 N 1.35 0.40 3.73 0.23 0.00 0.87 -4.73 105.19 107.04 1bxr n GLY 280 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 1bxr n GLY 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bxr s ALA 281 N -2.00 1.63 -0.03 4.61 0.00 0.18 -4.90 121.76 121.25 1bxr s ALA 281 Ca 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 51.96 51.81 1bxr s ALA 281 Cb 0.00 -3.16 -0.04 0.00 0.00 0.00 0.00 23.12 19.92 1bxr s ALA 281 CO 0.00 -2.28 0.06 0.15 0.00 0.00 0.00 175.76 173.69 1bxr s LYS 282 N -4.99 3.04 -0.03 0.00 -0.14 -1.26 -4.24 119.74 112.12 1bxr s LYS 282 Ca 0.63 -0.46 0.03 0.00 -1.36 0.00 0.00 55.97 54.81 1bxr s LYS 282 Cb -0.17 -2.85 -0.03 0.00 -1.68 0.00 0.00 37.83 33.10 1bxr s LYS 282 CO 0.56 0.67 -0.10 0.95 -0.76 0.00 0.00 175.35 176.67 1bxr s THR 283 N -1.10 3.44 0.33 2.17 -4.23 -1.26 -1.24 115.64 113.74 1bxr s THR 283 Ca 0.20 -0.70 0.08 0.00 -1.18 0.00 0.00 61.69 60.09 1bxr s THR 283 Cb -0.12 -2.42 -0.06 0.00 1.34 0.00 0.00 72.50 71.23 1bxr s THR 283 CO 0.10 0.51 -0.06 0.68 -0.54 0.00 0.00 174.62 175.31 1bxr s VAL 284 N -0.86 1.92 -0.24 2.29 -7.23 -0.10 -4.95 120.40 111.23 1bxr s VAL 284 Ca 0.14 -2.14 -0.06 0.00 -1.81 0.00 0.00 61.98 58.11 1bxr s VAL 284 Cb -0.11 -2.62 -0.02 0.00 0.56 0.00 0.00 36.38 34.19 1bxr s VAL 284 CO 0.03 -0.20 0.04 -0.75 -0.31 0.00 0.00 175.10 173.91 1bxr s LYS 285 N -3.68 3.58 0.75 4.82 2.20 -1.26 0.31 119.74 126.46 1bxr s LYS 285 Ca 0.32 -0.52 -0.13 0.00 -0.36 0.00 0.00 55.97 55.29 1bxr s LYS 285 Cb 0.04 -3.23 0.05 0.00 -1.51 0.00 0.00 37.83 33.18 1bxr s LYS 285 CO 0.15 -0.18 1.13 -1.64 -0.36 0.00 0.00 175.35 174.45 1bxr s MET 286 N 1.55 2.19 0.11 4.03 -1.94 0.48 -4.91 119.30 120.81 1bxr s MET 286 Ca 0.06 1.43 -0.27 0.00 -1.71 0.00 0.00 55.69 55.20 1bxr s MET 286 Cb -0.15 -1.87 -0.08 0.00 2.01 0.00 0.00 34.83 34.74 1bxr s MET 286 CO 0.02 -1.73 1.63 -0.22 -0.01 0.00 0.00 175.02 174.71 1bxr h LYS 287 N -0.71 -0.47 0.00 2.03 3.64 -1.99 -3.40 116.57 115.67 1bxr h LYS 287 Ca -0.45 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 1bxr h LYS 287 Cb 1.26 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.18 1bxr h LYS 287 CO 0.50 -0.31 -0.54 1.97 -2.27 0.00 0.00 179.45 178.80 1bxr n PHE 288 N -5.39 0.00 -0.74 1.91 1.16 -1.26 -1.01 117.46 112.13 1bxr n PHE 288 Ca -0.07 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.51 1bxr n PHE 288 Cb 0.30 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.17 1bxr n PHE 288 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1bxr n GLY 289 N 1.56 -1.84 2.99 4.97 0.00 -1.26 -4.82 105.19 106.78 1bxr n GLY 289 Ca 0.00 -1.94 -0.31 0.00 0.00 0.00 0.00 46.02 43.77 1bxr n GLY 289 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1bxr s HIS 290 N -0.04 2.92 -0.26 1.61 0.09 -0.32 -5.01 115.29 114.27 1bxr s HIS 290 Ca 0.00 -2.18 -0.04 0.00 -0.00 0.00 0.00 55.06 52.84 1bxr s HIS 290 Cb 0.00 -1.95 0.09 0.00 -0.00 0.00 0.00 32.58 30.72 1bxr s HIS 290 CO 0.00 -0.85 0.11 -1.01 -0.00 0.00 0.00 174.74 172.99 1bxr s HIS 291 N 1.21 0.48 -2.58 1.40 3.76 -1.25 -1.68 115.29 116.63 1bxr s HIS 291 Ca -0.03 -0.86 0.00 0.00 -0.15 0.00 0.00 55.06 54.02 1bxr s HIS 291 Cb -0.19 -0.95 0.00 0.00 1.11 0.00 0.00 32.58 32.54 1bxr s HIS 291 CO -0.07 -0.76 0.00 0.41 -0.85 0.00 0.00 174.74 173.46 1bxr n GLY 292 N 5.20 -0.77 1.24 -2.22 0.00 -0.71 -1.20 105.19 106.73 1bxr n GLY 292 Ca -0.06 -0.91 0.02 0.00 0.00 0.00 0.00 46.02 45.07 1bxr n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bxr n GLY 293 N 0.00 0.85 0.00 -0.02 0.00 -1.26 -0.81 105.19 103.96 1bxr n GLY 293 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1bxr n GLY 293 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1bxr n ASN 294 N 0.34 1.27 -4.62 1.61 6.94 -1.21 -4.49 115.26 115.09 1bxr n ASN 294 Ca 0.01 -1.38 -0.43 0.00 -0.02 0.00 0.00 54.58 52.76 1bxr n ASN 294 Cb 1.00 0.00 -0.03 0.00 -2.36 0.00 0.00 39.78 38.39 1bxr n ASN 294 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 1bxr s HIS 295 N -0.38 1.38 0.05 -2.53 2.46 -1.15 -4.70 115.29 110.42 1bxr s HIS 295 Ca 0.00 0.22 -0.30 0.00 0.47 0.00 0.00 55.06 55.45 1bxr s HIS 295 Cb 0.00 -4.05 -0.05 0.00 -0.13 0.00 0.00 32.58 28.36 1bxr s HIS 295 CO 0.00 -4.33 1.06 -1.25 -2.47 0.00 0.00 174.74 167.75 1bxr s PRO 296 N 5.45 4.54 -0.03 2.88 0.04 -1.26 -0.35 135.00 146.27 1bxr s PRO 296 Ca 0.91 1.57 0.03 0.00 0.04 0.00 0.00 61.00 63.54 1bxr s PRO 296 Cb -0.34 -3.40 0.00 0.00 0.04 0.00 0.00 34.50 30.80 1bxr s PRO 296 CO 0.36 -0.08 -0.10 0.08 0.04 0.00 0.00 177.00 177.30 1bxr s VAL 297 N 0.80 0.86 -0.13 -0.36 1.01 -0.03 -0.49 120.40 122.07 1bxr s VAL 297 Ca 0.53 -0.40 -0.06 0.00 0.00 0.00 0.00 61.98 62.05 1bxr s VAL 297 Cb -0.25 -0.76 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 1bxr s VAL 297 CO 0.29 0.27 0.08 -0.75 0.00 0.00 0.00 175.10 174.99 1bxr s LYS 298 N 0.18 3.44 -1.14 2.72 2.20 -0.33 -1.05 119.74 125.76 1bxr s LYS 298 Ca -0.03 -0.26 -0.13 0.00 -0.36 0.00 0.00 55.97 55.18 1bxr s LYS 298 Cb -0.09 -3.08 0.20 0.00 -1.51 0.00 0.00 37.83 33.35 1bxr s LYS 298 CO 0.01 0.63 1.30 0.34 -0.36 0.00 0.00 175.35 177.27 1bxr s ASP 299 N -0.64 7.08 0.56 1.43 -1.08 0.12 -1.90 116.67 122.25 1bxr s ASP 299 Ca 0.12 -3.05 0.38 0.00 -0.52 0.00 0.00 52.55 49.48 1bxr s ASP 299 Cb -0.12 -2.35 1.52 0.00 -1.46 0.00 0.00 42.92 40.51 1bxr s ASP 299 CO 0.02 -0.65 1.70 -0.37 0.52 0.00 0.00 175.17 176.39 1bxr h VAL 300 N 4.52 0.25 0.34 1.11 -1.51 -1.79 0.89 116.25 120.07 1bxr h VAL 300 Ca 0.26 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.71 1bxr h VAL 300 Cb 0.89 0.28 0.00 0.00 -2.13 0.00 0.00 31.29 30.33 1bxr h VAL 300 CO 1.16 0.00 -0.19 -0.33 -1.23 0.00 0.00 177.57 176.97 1bxr h GLU 301 N 0.00 -0.47 0.00 5.19 5.08 -1.89 -3.21 114.58 119.28 1bxr h GLU 301 Ca 0.61 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 59.00 1bxr h GLU 301 Cb 2.61 0.11 0.00 0.00 0.50 0.00 0.00 28.75 31.97 1bxr h GLU 301 CO -0.01 -0.32 0.00 0.87 -1.00 0.00 0.00 179.01 178.56 1bxr h LYS 302 N -0.49 0.00 -3.99 2.33 1.57 -1.57 -3.47 116.57 110.95 1bxr h LYS 302 Ca -0.05 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.55 1bxr h LYS 302 Cb 0.39 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.79 1bxr h LYS 302 CO 0.06 0.00 -0.42 -1.71 -0.57 0.00 0.00 179.45 176.81 1bxr n ASN 303 N -2.67 -2.28 -4.29 0.86 5.15 0.29 -5.04 115.26 107.28 1bxr n ASN 303 Ca 0.04 -0.34 -0.20 0.00 -0.60 0.00 0.00 54.58 53.48 1bxr n ASN 303 Cb 0.42 -3.07 -0.11 0.00 -0.53 0.00 0.00 39.78 36.49 1bxr n ASN 303 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1bxr s VAL 304 N -3.20 1.60 0.07 3.44 -7.23 -1.13 -4.94 120.40 109.01 1bxr s VAL 304 Ca 0.03 -1.84 0.07 0.00 -1.81 0.00 0.00 61.98 58.43 1bxr s VAL 304 Cb -0.02 -1.72 -0.04 0.00 0.56 0.00 0.00 36.38 35.17 1bxr s VAL 304 CO 0.41 -0.37 -0.14 -0.69 -0.31 0.00 0.00 175.10 174.00 1bxr s VAL 305 N -2.12 3.09 0.05 1.32 1.01 -1.26 0.14 120.40 122.63 1bxr s VAL 305 Ca 0.13 -1.22 0.01 0.00 0.00 0.00 0.00 61.98 60.90 1bxr s VAL 305 Cb -0.05 -2.38 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 1bxr s VAL 305 CO 0.05 0.23 -0.06 0.00 0.00 0.00 0.00 175.10 175.31 1bxr s MET 306 N -1.81 0.57 -0.21 2.72 0.23 -0.21 -4.95 119.30 115.63 1bxr s MET 306 Ca 0.18 -0.90 -0.11 0.00 -1.03 0.00 0.00 55.69 53.82 1bxr s MET 306 Cb -0.11 -0.17 -0.05 0.00 -1.53 0.00 0.00 34.83 32.98 1bxr s MET 306 CO 0.09 0.01 0.20 0.42 -2.03 0.00 0.00 175.02 173.70 1bxr s ILE 307 N -2.09 5.35 0.21 3.16 -1.09 -1.26 -0.85 121.20 124.63 1bxr s ILE 307 Ca -0.05 0.29 0.08 0.00 -2.23 0.00 0.00 60.65 58.74 1bxr s ILE 307 Cb -0.05 -3.54 -0.05 0.00 -1.58 0.00 0.00 42.46 37.24 1bxr s ILE 307 CO -0.02 0.37 -0.13 0.42 -1.23 0.00 0.00 174.94 174.35 1bxr s THR 308 N 0.80 1.72 -0.26 2.92 -4.23 0.53 -4.23 115.64 112.88 1bxr s THR 308 Ca 0.10 -2.20 -0.21 0.00 -1.18 0.00 0.00 61.69 58.20 1bxr s THR 308 Cb -0.13 -2.10 -0.01 0.00 1.34 0.00 0.00 72.50 71.60 1bxr s THR 308 CO 0.03 -0.55 0.68 0.00 -0.54 0.00 0.00 174.62 174.23 1bxr s ALA 309 N -2.98 3.61 -0.05 3.99 0.00 -1.26 -2.92 121.76 122.14 1bxr s ALA 309 Ca 0.23 -0.39 0.04 0.00 0.00 0.00 0.00 51.96 51.85 1bxr s ALA 309 Cb -0.00 -3.10 -0.02 0.00 0.00 0.00 0.00 23.12 20.00 1bxr s ALA 309 CO 0.08 -0.87 -0.18 -0.65 0.00 0.00 0.00 175.76 174.14 1bxr s GLN 310 N 2.60 2.53 -0.38 0.00 -1.52 0.01 -1.82 119.66 121.09 1bxr s GLN 310 Ca 0.28 -0.77 0.06 0.00 -1.95 0.00 0.00 55.36 52.98 1bxr s GLN 310 Cb -0.15 -2.31 0.17 0.00 -0.22 0.00 0.00 33.01 30.49 1bxr s GLN 310 CO 0.09 0.54 0.52 1.21 -0.25 0.00 0.00 175.29 177.40 1bxr s ASN 311 N -0.52 -0.49 -0.20 5.90 2.47 -0.94 -1.73 114.94 119.43 1bxr s ASN 311 Ca 0.07 -0.93 -0.27 0.00 0.42 0.00 0.00 52.86 52.14 1bxr s ASN 311 Cb -0.11 1.44 0.09 0.00 -1.45 0.00 0.00 41.25 41.21 1bxr s ASN 311 CO 0.01 -0.23 0.84 -1.38 -3.72 0.00 0.00 177.10 172.62 1bxr s HIS 312 N 1.85 -0.61 -0.03 0.43 -3.43 -0.67 -4.98 115.29 107.85 1bxr s HIS 312 Ca 0.15 1.32 0.15 0.00 -0.80 0.00 0.00 55.06 55.89 1bxr s HIS 312 Cb -0.09 0.36 -0.23 0.00 -1.43 0.00 0.00 32.58 31.19 1bxr s HIS 312 CO -0.09 -0.39 0.31 0.41 -2.00 0.00 0.00 174.74 172.98 1bxr n GLY 313 N 1.81 -0.70 3.57 -1.38 0.00 -1.26 -1.18 105.19 106.05 1bxr n GLY 313 Ca -0.14 -0.35 -0.24 0.00 0.00 0.00 0.00 46.02 45.29 1bxr n GLY 313 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bxr s PHE 314 N -3.00 2.51 0.30 1.61 0.40 -1.26 0.18 117.98 118.73 1bxr s PHE 314 Ca -0.06 -0.29 0.03 0.00 -0.60 0.00 0.00 56.93 56.02 1bxr s PHE 314 Cb 0.09 -1.13 -0.04 0.00 0.51 0.00 0.00 43.02 42.45 1bxr s PHE 314 CO 0.63 0.65 0.16 0.00 0.70 0.00 0.00 175.22 177.37 1bxr s ALA 315 N -2.42 1.96 -0.25 5.36 0.00 0.15 -4.79 121.76 121.77 1bxr s ALA 315 Ca 0.31 -1.76 -0.05 0.00 0.00 0.00 0.00 51.96 50.46 1bxr s ALA 315 Cb -0.05 1.16 -0.01 0.00 0.00 0.00 0.00 23.12 24.22 1bxr s ALA 315 CO 0.18 -0.51 0.01 0.08 0.00 0.00 0.00 175.76 175.52 1bxr s VAL 316 N -3.60 3.72 -0.22 0.00 1.01 -1.26 -0.93 120.40 119.11 1bxr s VAL 316 Ca 0.36 -0.49 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 1bxr s VAL 316 Cb 0.05 -2.77 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 1bxr s VAL 316 CO 0.18 0.31 1.82 -0.62 0.00 0.00 0.00 175.10 176.78 1bxr s ASP 317 N 1.51 6.07 0.14 3.32 2.15 -0.37 -4.48 116.67 125.01 1bxr s ASP 317 Ca 0.05 1.69 -0.20 0.00 0.43 0.00 0.00 52.55 54.51 1bxr s ASP 317 Cb -0.15 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.94 1bxr s ASP 317 CO -0.00 -1.50 1.68 -0.08 -0.17 0.00 0.00 175.17 175.10 1bxr h GLU 318 N 12.14 -0.08 -1.40 4.34 4.81 -1.97 -2.70 114.58 129.73 1bxr h GLU 318 Ca -0.37 0.01 0.40 0.00 -0.13 0.00 0.00 59.36 59.27 1bxr h GLU 318 Cb 1.18 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.53 1bxr h GLU 318 CO 1.00 -0.05 1.03 0.00 -0.73 0.00 0.00 179.01 180.25 1bxr h ALA 319 N 1.09 3.32 -0.78 2.92 0.00 -1.98 0.03 119.26 123.85 1bxr h ALA 319 Ca 0.12 -0.05 -0.54 0.00 0.00 0.00 0.00 54.91 54.44 1bxr h ALA 319 Cb 0.26 0.10 -0.33 0.00 0.00 0.00 0.00 17.79 17.83 1bxr h ALA 319 CO -0.27 -1.75 -0.06 0.25 0.00 0.00 0.00 179.25 177.42 1bxr n THR 320 N -4.05 2.95 -3.00 0.00 -2.24 -1.02 -4.99 114.28 101.93 1bxr n THR 320 Ca 0.31 -3.48 -0.40 0.00 -2.27 0.00 0.00 64.05 58.21 1bxr n THR 320 Cb 1.47 -1.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.66 1bxr n THR 320 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1bxr s LEU 321 N -3.62 4.31 0.84 3.22 1.02 -0.01 -4.16 118.68 120.28 1bxr s LEU 321 Ca 0.55 1.23 -0.10 0.00 0.02 0.00 0.00 54.13 55.83 1bxr s LEU 321 Cb 0.45 -3.14 0.10 0.00 0.02 0.00 0.00 46.19 43.62 1bxr s LEU 321 CO 0.02 -0.15 1.11 -2.84 0.02 0.00 0.00 176.35 174.51 1bxr s PRO 322 N 0.90 1.69 0.51 1.29 0.02 -1.26 -4.90 135.00 133.25 1bxr s PRO 322 Ca 0.39 1.26 0.31 0.00 0.02 0.00 0.00 61.00 62.99 1bxr s PRO 322 Cb -0.18 -1.83 1.18 0.00 0.02 0.00 0.00 34.50 33.70 1bxr s PRO 322 CO 0.19 -2.07 1.91 0.00 -0.33 0.00 0.00 177.00 176.70 1bxr h ALA 323 N -1.45 1.00 -0.06 -1.55 0.00 -1.95 -2.15 119.26 113.10 1bxr h ALA 323 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1bxr h ALA 323 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1bxr h ALA 323 CO 0.48 0.00 0.00 0.27 0.00 0.00 0.00 179.25 180.00 1bxr n ASN 324 N -3.03 0.80 -4.17 0.00 2.04 -1.26 -4.66 115.26 104.98 1bxr n ASN 324 Ca 0.01 -1.48 -0.34 0.00 -0.44 0.00 0.00 54.58 52.33 1bxr n ASN 324 Cb 0.34 -0.04 -0.14 0.00 -2.53 0.00 0.00 39.78 37.41 1bxr n ASN 324 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 1bxr s LEU 325 N -1.69 3.63 -0.05 -4.53 1.43 -0.81 0.99 118.68 117.65 1bxr s LEU 325 Ca 0.34 -1.17 -0.03 0.00 -1.03 0.00 0.00 54.13 52.23 1bxr s LEU 325 Cb 0.17 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.67 1bxr s LEU 325 CO 0.27 -0.21 0.11 0.00 0.23 0.00 0.00 176.35 176.75 1bxr s ARG 326 N 1.25 3.26 -0.27 1.70 1.70 -0.03 -4.69 118.95 121.88 1bxr s ARG 326 Ca -0.04 -0.32 -0.29 0.00 -0.47 0.00 0.00 55.73 54.61 1bxr s ARG 326 Cb -0.19 -3.01 -0.00 0.00 -0.57 0.00 0.00 34.95 31.17 1bxr s ARG 326 CO -0.03 0.70 1.35 0.08 -1.08 0.00 0.00 175.30 176.33 1bxr s VAL 327 N -1.13 4.08 -0.21 4.99 1.01 -1.26 -0.56 120.40 127.33 1bxr s VAL 327 Ca 0.20 1.24 0.10 0.00 0.00 0.00 0.00 61.98 63.52 1bxr s VAL 327 Cb -0.12 -4.07 -0.22 0.00 0.00 0.00 0.00 36.38 31.98 1bxr s VAL 327 CO 0.10 -0.41 0.01 0.35 0.00 0.00 0.00 175.10 175.15 1bxr n THR 328 N 6.14 1.46 -3.84 3.92 -2.24 0.42 -4.87 114.28 115.27 1bxr n THR 328 Ca 0.15 -0.73 -0.11 0.00 -2.27 0.00 0.00 64.05 61.09 1bxr n THR 328 Cb 0.46 -0.94 -0.09 0.00 -2.10 0.00 0.00 70.33 67.67 1bxr n THR 328 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1bxr s HIS 329 N -2.51 0.03 0.01 4.78 3.76 -1.08 -2.88 115.29 117.39 1bxr s HIS 329 Ca -0.20 -0.19 -0.03 0.00 -0.15 0.00 0.00 55.06 54.49 1bxr s HIS 329 Cb 0.07 -0.02 -0.01 0.00 1.11 0.00 0.00 32.58 33.73 1bxr s HIS 329 CO 0.74 -0.40 0.04 0.15 -0.85 0.00 0.00 174.74 174.42 1bxr s LYS 330 N -2.19 0.30 0.16 1.40 1.02 -0.80 0.47 119.74 120.10 1bxr s LYS 330 Ca -0.08 -0.39 -0.31 0.00 0.02 0.00 0.00 55.97 55.22 1bxr s LYS 330 Cb -0.03 0.12 -0.08 0.00 -0.52 0.00 0.00 37.83 37.32 1bxr s LYS 330 CO -0.02 -0.06 1.34 0.45 -0.92 0.00 0.00 175.35 176.14 1bxr s SER 331 N -1.09 6.87 0.06 2.83 0.15 0.73 -1.19 113.70 122.06 1bxr s SER 331 Ca -0.12 2.36 0.27 0.00 0.70 0.00 0.00 55.95 59.16 1bxr s SER 331 Cb -0.07 -2.60 0.94 0.00 -1.71 0.00 0.00 66.02 62.58 1bxr s SER 331 CO -0.00 -0.58 1.76 0.18 1.20 0.00 0.00 173.24 175.79 1bxr n LEU 332 N 3.25 0.34 -0.02 3.45 4.32 0.36 0.11 117.00 128.80 1bxr n LEU 332 Ca 0.09 0.42 -0.16 0.00 -0.02 0.00 0.00 56.01 56.33 1bxr n LEU 332 Cb 0.43 -0.39 -0.13 0.00 -1.62 0.00 0.00 43.42 41.71 1bxr n LEU 332 CO 0.58 -0.03 0.27 -0.26 -1.22 0.00 0.00 177.39 176.73 1bxr h PHE 333 N 0.00 0.24 0.00 -1.77 0.04 -1.91 -3.41 116.94 110.13 1bxr h PHE 333 Ca 0.00 -0.17 0.00 0.00 2.80 0.00 0.00 57.97 60.60 1bxr h PHE 333 Cb 0.58 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.72 1bxr h PHE 333 CO 0.00 1.09 -0.03 -0.40 -0.60 0.00 0.00 178.31 178.37 1bxr n ASP 334 N -4.42 0.50 -0.57 2.17 5.68 -1.24 -5.03 116.55 113.64 1bxr n ASP 334 Ca -0.11 -1.32 -0.07 0.00 -0.50 0.00 0.00 54.79 52.78 1bxr n ASP 334 Cb 0.60 -0.02 -0.03 0.00 -1.14 0.00 0.00 41.12 40.53 1bxr n ASP 334 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1bxr n GLY 335 N -0.14 0.86 3.81 6.12 0.00 0.30 -4.97 105.19 111.18 1bxr n GLY 335 Ca 0.00 -0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 1bxr n GLY 335 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bxr s THR 336 N -1.98 3.97 0.19 2.61 -4.23 -1.24 -4.58 115.64 110.38 1bxr s THR 336 Ca 0.00 0.76 -0.32 0.00 -1.18 0.00 0.00 61.69 60.95 1bxr s THR 336 Cb 0.00 -3.41 -0.11 0.00 1.34 0.00 0.00 72.50 70.33 1bxr s THR 336 CO 0.00 -0.72 1.61 -0.22 -0.54 0.00 0.00 174.62 174.75 1bxr s LEU 337 N -5.09 4.37 -0.05 4.79 2.96 -1.26 -0.19 118.68 124.21 1bxr s LEU 337 Ca 0.60 2.72 0.02 0.00 -0.22 0.00 0.00 54.13 57.25 1bxr s LEU 337 Cb -0.15 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.90 1bxr s LEU 337 CO 0.47 -0.87 -0.01 0.00 -1.32 0.00 0.00 176.35 174.62 1bxr n GLN 338 N 3.80 2.07 -3.63 1.98 1.13 0.18 -4.74 117.38 118.17 1bxr n GLN 338 Ca 0.14 0.01 -0.14 0.00 -1.94 0.00 0.00 57.00 55.06 1bxr n GLN 338 Cb 0.37 -1.11 -0.07 0.00 0.11 0.00 0.00 30.24 29.55 1bxr n GLN 338 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1bxr s GLY 339 N -3.90 -0.35 0.08 1.08 0.00 -0.64 0.19 107.32 103.77 1bxr s GLY 339 Ca -0.04 0.64 0.02 0.00 0.00 0.00 0.00 44.72 45.33 1bxr s GLY 339 CO 0.15 0.36 -0.07 -0.26 0.00 0.00 0.00 173.10 173.28 1bxr s ILE 340 N -1.83 0.64 -0.04 0.90 -4.36 -0.39 0.16 121.20 116.27 1bxr s ILE 340 Ca -0.09 -1.70 0.00 0.00 -0.26 0.00 0.00 60.65 58.60 1bxr s ILE 340 Cb -0.02 -1.39 0.03 0.00 1.25 0.00 0.00 42.46 42.33 1bxr s ILE 340 CO 0.03 -0.75 -0.01 -2.28 0.24 0.00 0.00 174.94 172.17 1bxr s HIS 341 N -3.04 0.50 0.00 1.37 2.46 0.28 -1.01 115.29 115.86 1bxr s HIS 341 Ca 0.06 -0.09 -0.30 0.00 0.47 0.00 0.00 55.06 55.20 1bxr s HIS 341 Cb 0.01 -0.55 -0.06 0.00 -0.13 0.00 0.00 32.58 31.85 1bxr s HIS 341 CO -0.04 -0.18 1.48 1.03 -2.47 0.00 0.00 174.74 174.56 1bxr s ARG 342 N 1.13 4.25 0.41 2.88 1.81 0.10 -0.85 118.95 128.69 1bxr s ARG 342 Ca -0.08 2.06 0.18 0.00 -1.72 0.00 0.00 55.73 56.17 1bxr s ARG 342 Cb -0.14 -3.63 0.90 0.00 -0.45 0.00 0.00 34.95 31.63 1bxr s ARG 342 CO -0.02 -0.64 1.86 1.79 -0.68 0.00 0.00 175.30 177.61 1bxr h THR 343 N 4.98 0.96 0.00 0.02 1.35 0.32 -3.17 112.91 117.37 1bxr h THR 343 Ca -0.39 -1.16 -0.26 0.00 -0.55 0.00 0.00 66.41 64.05 1bxr h THR 343 Cb 1.18 1.67 -0.05 0.00 -1.73 0.00 0.00 68.15 69.23 1bxr h THR 343 CO 0.92 0.30 -2.24 -0.90 -0.25 0.00 0.00 175.52 173.35 1bxr n ASP 344 N -3.80 0.05 -4.57 5.36 5.68 -1.26 -5.04 116.55 112.97 1bxr n ASP 344 Ca -0.01 0.02 -0.26 0.00 -0.50 0.00 0.00 54.79 54.04 1bxr n ASP 344 Cb 0.39 1.22 -0.11 0.00 -1.14 0.00 0.00 41.12 41.48 1bxr n ASP 344 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1bxr s LYS 345 N -2.78 1.87 -0.52 0.11 -0.14 -1.20 -5.02 119.74 112.06 1bxr s LYS 345 Ca -0.09 -2.04 -0.06 0.00 -1.36 0.00 0.00 55.97 52.42 1bxr s LYS 345 Cb 0.08 -1.47 -0.07 0.00 -1.68 0.00 0.00 37.83 34.69 1bxr s LYS 345 CO 0.85 -0.06 3.07 -0.35 -0.76 0.00 0.00 175.35 178.10 1bxr n PRO 346 N -0.88 2.66 -4.80 -1.68 -0.04 -1.26 -4.37 135.00 124.63 1bxr n PRO 346 Ca -0.04 -1.96 -0.26 0.00 -0.04 0.00 0.00 63.50 61.20 1bxr n PRO 346 Cb 0.66 -2.22 -0.16 0.00 -0.04 0.00 0.00 33.50 31.75 1bxr n PRO 346 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bxr s ALA 347 N -0.20 1.47 0.03 0.55 0.00 -1.25 0.52 121.76 122.87 1bxr s ALA 347 Ca 0.63 -0.66 -0.23 0.00 0.00 0.00 0.00 51.96 51.70 1bxr s ALA 347 Cb 0.31 -0.48 0.05 0.00 0.00 0.00 0.00 23.12 23.00 1bxr s ALA 347 CO -0.11 0.27 0.52 -0.59 0.00 0.00 0.00 175.76 175.85 1bxr s PHE 348 N 0.04 -0.42 0.12 0.00 -0.71 -0.21 0.01 117.98 116.79 1bxr s PHE 348 Ca -0.03 0.53 -0.17 0.00 -1.04 0.00 0.00 56.93 56.22 1bxr s PHE 348 Cb -0.11 0.32 0.04 0.00 -1.21 0.00 0.00 43.02 42.06 1bxr s PHE 348 CO 0.02 -0.61 0.41 -1.54 -1.34 0.00 0.00 175.22 172.17 1bxr s SER 349 N -1.79 -0.26 -0.04 1.98 1.04 -0.18 -1.50 113.70 112.95 1bxr s SER 349 Ca -0.07 -0.25 0.02 0.00 0.48 0.00 0.00 55.95 56.13 1bxr s SER 349 Cb -0.01 0.47 0.01 0.00 0.10 0.00 0.00 66.02 66.60 1bxr s SER 349 CO 0.01 -0.83 -0.09 0.12 0.98 0.00 0.00 173.24 173.42 1bxr s PHE 350 N -3.61 1.08 0.31 5.02 5.36 -0.44 -1.26 117.98 124.43 1bxr s PHE 350 Ca 0.02 -0.33 0.08 0.00 -0.96 0.00 0.00 56.93 55.73 1bxr s PHE 350 Cb 0.01 -0.81 0.51 0.00 -0.34 0.00 0.00 43.02 42.39 1bxr s PHE 350 CO -0.11 -0.18 1.73 0.37 -1.46 0.00 0.00 175.22 175.57 1bxr h GLN 351 N 6.79 0.19 0.00 10.12 5.75 0.17 0.29 115.11 138.43 1bxr h GLN 351 Ca -0.34 -0.09 0.00 0.00 -0.15 0.00 0.00 58.65 58.07 1bxr h GLN 351 Cb 1.17 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.72 1bxr h GLN 351 CO 0.48 0.56 0.00 0.41 -2.65 0.00 0.00 178.83 177.63 1bxr n GLY 352 N -0.26 -0.57 3.07 2.39 0.00 -1.26 -3.72 105.19 104.84 1bxr n GLY 352 Ca -0.01 -1.75 -0.34 0.00 0.00 0.00 0.00 46.02 43.91 1bxr n GLY 352 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1bxr s HIS 353 N -0.61 3.47 0.43 1.61 3.76 -0.75 -3.78 115.29 119.41 1bxr s HIS 353 Ca 0.00 -2.75 0.23 0.00 -0.15 0.00 0.00 55.06 52.39 1bxr s HIS 353 Cb 0.00 -3.10 1.29 0.00 1.11 0.00 0.00 32.58 31.88 1bxr s HIS 353 CO 0.00 -0.88 2.04 -1.35 -0.85 0.00 0.00 174.74 173.70 1bxr h PRO 354 N 7.30 0.00 -0.01 8.40 0.11 -1.88 0.15 132.00 146.07 1bxr h PRO 354 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1bxr h PRO 354 Cb 0.98 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1bxr h PRO 354 CO 0.68 0.15 -0.03 -0.85 -0.21 0.00 0.00 178.00 177.74 1bxr n GLU 355 N -3.87 1.26 0.00 1.05 0.00 -1.26 -3.46 120.64 114.36 1bxr n GLU 355 Ca -0.02 -0.52 0.00 0.00 0.00 0.00 0.00 57.16 56.62 1bxr n GLU 355 Cb 0.24 -1.49 0.00 0.00 0.00 0.00 0.00 31.44 30.20 1bxr n GLU 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1bxr n ALA 356 N -0.41 0.00 -3.17 -1.84 0.00 0.04 -4.81 120.51 110.32 1bxr n ALA 356 Ca 0.20 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.49 1bxr n ALA 356 Cb 0.26 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.73 1bxr n ALA 356 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1bxr n SER 357 N 1.79 -7.01 -4.98 0.00 2.88 -1.26 -4.78 113.62 100.27 1bxr n SER 357 Ca 0.00 0.02 -0.20 0.00 -1.33 0.00 0.00 58.87 57.37 1bxr n SER 357 Cb 0.00 -4.13 0.03 0.00 -0.75 0.00 0.00 64.21 59.36 1bxr n SER 357 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1bxr s PRO 358 N -3.02 2.61 0.00 -1.46 0.04 -1.26 -4.83 135.00 127.07 1bxr s PRO 358 Ca 0.17 -1.01 0.00 0.00 0.04 0.00 0.00 61.00 60.20 1bxr s PRO 358 Cb -0.03 -2.59 0.00 0.00 0.04 0.00 0.00 34.50 31.91 1bxr s PRO 358 CO 0.80 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 177.67 1bxr n GLY 359 N -2.17 1.87 3.65 0.56 0.00 -1.26 -4.78 105.19 103.06 1bxr n GLY 359 Ca 0.09 -2.21 -0.41 0.00 0.00 0.00 0.00 46.02 43.49 1bxr n GLY 359 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1bxr n PRO 360 N -0.84 1.55 -0.07 1.61 -0.04 -1.26 -4.81 135.00 131.13 1bxr n PRO 360 Ca 0.00 0.56 0.11 0.00 -0.04 0.00 0.00 63.50 64.13 1bxr n PRO 360 Cb 0.00 -2.22 0.39 0.00 -0.04 0.00 0.00 33.50 31.64 1bxr n PRO 360 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1bxr n HIS 361 N -0.54 0.18 -0.26 0.54 8.25 -1.26 -4.32 115.22 117.81 1bxr n HIS 361 Ca 0.09 -0.09 0.24 0.00 -0.26 0.00 0.00 57.72 57.69 1bxr n HIS 361 Cb 0.40 0.00 0.58 0.00 1.12 0.00 0.00 29.99 32.09 1bxr n HIS 361 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 1bxr h ASP 362 N 2.28 0.29 -0.36 0.41 5.19 -1.92 -1.50 116.42 120.83 1bxr h ASP 362 Ca 0.00 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.45 1bxr h ASP 362 Cb 0.50 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.00 1bxr h ASP 362 CO 0.00 0.09 0.00 0.00 -3.12 0.00 0.00 179.24 176.21 1bxr n ALA 363 N -2.57 2.45 -0.22 3.45 0.00 -1.26 -4.48 120.51 117.88 1bxr n ALA 363 Ca 0.21 -0.73 0.06 0.00 0.00 0.00 0.00 53.44 52.98 1bxr n ALA 363 Cb 0.86 -0.99 0.31 0.00 0.00 0.00 0.00 19.45 19.63 1bxr n ALA 363 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bxr h ALA 364 N 3.97 1.64 -0.10 0.00 0.00 -1.30 -3.06 119.26 120.41 1bxr h ALA 364 Ca 0.00 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1bxr h ALA 364 Cb 0.61 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1bxr h ALA 364 CO 0.00 0.24 0.30 -1.00 0.00 0.00 0.00 179.25 178.79 1bxr h PRO 365 N 0.85 0.00 -0.18 0.00 0.13 -1.83 -1.45 132.00 129.53 1bxr h PRO 365 Ca 0.34 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.52 1bxr h PRO 365 Cb 0.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.36 1bxr h PRO 365 CO -0.12 0.00 0.19 -0.07 -0.23 0.00 0.00 178.00 177.77 1bxr h LEU 366 N 0.00 0.00 -0.51 1.56 4.07 -1.89 0.63 115.31 119.16 1bxr h LEU 366 Ca 0.05 0.00 -0.15 0.00 0.08 0.00 0.00 57.88 57.85 1bxr h LEU 366 Cb 0.65 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.36 1bxr h LEU 366 CO -0.00 0.00 -0.74 -0.26 -1.08 0.00 0.00 178.44 176.36 1bxr h PHE 367 N 0.00 0.00 0.00 1.13 0.04 -1.50 -3.14 116.94 113.47 1bxr h PHE 367 Ca 0.09 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.80 1bxr h PHE 367 Cb 0.46 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.60 1bxr h PHE 367 CO 0.00 0.74 -0.24 -0.44 -0.60 0.00 0.00 178.31 177.76 1bxr h ASP 368 N 0.00 0.00 0.33 2.17 3.32 0.11 -2.85 116.42 119.50 1bxr h ASP 368 Ca -0.01 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.82 1bxr h ASP 368 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 1bxr h ASP 368 CO 0.10 0.24 -0.93 -0.74 -1.72 0.00 0.00 179.24 176.19 1bxr h HIS 369 N 0.00 0.61 0.74 4.55 2.76 -1.45 -2.55 115.15 119.81 1bxr h HIS 369 Ca -0.00 -0.33 -0.04 0.00 -2.20 0.00 0.00 60.37 57.80 1bxr h HIS 369 Cb 0.72 -0.07 0.01 0.00 1.55 0.00 0.00 27.41 29.62 1bxr h HIS 369 CO 0.00 1.15 -0.36 0.35 -1.30 0.00 0.00 177.93 177.77 1bxr h PHE 370 N 0.23 -0.92 -0.99 5.26 3.57 -1.54 -2.67 116.94 119.87 1bxr h PHE 370 Ca -0.08 -0.02 0.26 0.00 3.53 0.00 0.00 57.97 61.66 1bxr h PHE 370 Cb 1.57 0.31 -0.13 0.00 2.79 0.00 0.00 35.95 40.49 1bxr h PHE 370 CO 0.06 -0.56 0.57 0.82 -2.23 0.00 0.00 178.31 176.97 1bxr h ILE 371 N -1.07 0.49 0.28 1.41 1.08 -1.53 0.99 117.51 119.17 1bxr h ILE 371 Ca -0.10 -0.18 -0.00 0.00 -0.39 0.00 0.00 64.86 64.19 1bxr h ILE 371 Cb 0.78 -0.08 -0.03 0.00 -3.07 0.00 0.00 36.82 34.42 1bxr h ILE 371 CO 0.17 0.10 -0.50 -0.33 -0.69 0.00 0.00 178.15 176.89 1bxr h GLU 372 N 0.52 -0.81 -0.72 2.37 5.08 -1.22 0.32 114.58 120.13 1bxr h GLU 372 Ca 0.65 0.05 0.16 0.00 -1.00 0.00 0.00 59.36 59.22 1bxr h GLU 372 Cb 1.28 0.18 -0.13 0.00 0.50 0.00 0.00 28.75 30.59 1bxr h GLU 372 CO -0.50 -0.54 -0.04 -0.07 -1.00 0.00 0.00 179.01 176.86 1bxr h LEU 373 N -0.84 -0.41 0.67 1.33 3.38 -0.57 -0.69 115.31 118.19 1bxr h LEU 373 Ca -0.03 0.19 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 1bxr h LEU 373 Cb 0.78 0.35 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1bxr h LEU 373 CO -0.18 -0.18 -0.45 0.40 0.09 0.00 0.00 178.44 178.12 1bxr h ILE 374 N 0.08 0.10 -0.54 1.22 2.04 0.10 -0.84 117.51 119.66 1bxr h ILE 374 Ca 0.38 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.40 1bxr h ILE 374 Cb 0.64 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 1bxr h ILE 374 CO -0.65 0.00 0.49 -0.33 0.00 0.00 0.00 178.15 177.66 1bxr h GLU 375 N -1.07 0.00 0.13 2.37 5.08 0.39 -0.68 114.58 120.80 1bxr h GLU 375 Ca -0.08 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.00 1bxr h GLU 375 Cb 0.87 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.13 1bxr h GLU 375 CO 0.06 0.00 -1.26 0.37 -1.00 0.00 0.00 179.01 177.18 1bxr h GLN 376 N 0.00 0.27 0.00 2.33 4.15 -0.55 -2.61 115.11 118.70 1bxr h GLN 376 Ca 0.26 -0.46 0.00 0.00 0.77 0.00 0.00 58.65 59.22 1bxr h GLN 376 Cb 1.24 0.17 0.00 0.00 0.21 0.00 0.00 27.48 29.10 1bxr h GLN 376 CO -0.00 1.21 0.00 -0.92 -1.93 0.00 0.00 178.83 177.19 1bxr h TYR 377 N 0.07 0.00 0.00 3.99 3.20 0.27 -2.87 116.97 121.63 1bxr h TYR 377 Ca -0.14 0.00 -0.23 0.00 3.14 0.00 0.00 58.73 61.50 1bxr h TYR 377 Cb 1.97 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 40.21 1bxr h TYR 377 CO 0.06 0.00 -1.20 0.00 -1.64 0.00 0.00 178.16 175.38 1bxr h ARG 378 N 0.00 0.00 0.00 1.82 3.08 -1.32 -3.27 114.38 114.68 1bxr h ARG 378 Ca 0.00 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.95 1bxr h ARG 378 Cb 0.65 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 1bxr h ARG 378 CO 0.00 0.81 -0.48 -0.22 -1.07 0.00 0.00 179.97 179.01 1bxr h LYS 379 N 0.00 0.00 -0.01 0.04 3.64 -1.24 -3.51 116.57 115.49 1bxr h LYS 379 Ca -0.10 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1bxr h LYS 379 Cb 1.82 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.64 1bxr h LYS 379 CO 0.11 0.48 0.00 2.41 -2.27 0.00 0.00 179.45 180.18