#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cen s VAL 2 N 0.00 3.43 0.15 1.12 1.01 -1.26 -5.03 120.40 119.82 1cen s VAL 2 Ca 0.00 -0.56 0.08 0.00 0.00 0.00 0.00 61.98 61.50 1cen s VAL 2 Cb 0.00 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 1cen s VAL 2 CO 0.00 0.56 -0.17 -0.94 0.00 0.00 0.00 175.10 174.55 1cen s SER 3 N -0.35 2.51 -0.42 3.32 1.04 -1.26 -5.03 113.70 113.50 1cen s SER 3 Ca 0.04 -0.85 0.07 0.00 0.48 0.00 0.00 55.95 55.70 1cen s SER 3 Cb -0.12 -0.13 0.42 0.00 0.10 0.00 0.00 66.02 66.28 1cen s SER 3 CO 0.02 -0.06 1.08 0.49 0.98 0.00 0.00 173.24 175.75 1cen n PHE 4 N 0.37 3.07 -0.12 5.02 3.01 -1.26 -4.22 117.46 123.32 1cen n PHE 4 Ca -0.14 -3.09 -0.23 0.00 1.01 0.00 0.00 57.45 55.01 1cen n PHE 4 Cb 0.57 -0.14 -0.10 0.00 -0.01 0.00 0.00 39.48 39.81 1cen n PHE 4 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1cen n LYS 5 N -0.41 0.55 -3.94 -1.08 4.76 -1.26 -4.22 118.16 112.56 1cen n LYS 5 Ca 0.34 0.19 -0.30 0.00 -2.87 0.00 0.00 58.31 55.67 1cen n LYS 5 Cb 0.68 -1.42 -0.14 0.00 -1.84 0.00 0.00 35.03 32.30 1cen n LYS 5 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1cen s ALA 6 N -2.46 3.09 0.12 7.82 0.00 -1.26 -1.07 121.76 128.00 1cen s ALA 6 Ca -0.34 -3.04 0.00 0.00 0.00 0.00 0.00 51.96 48.59 1cen s ALA 6 Cb 0.11 -2.09 -0.00 0.00 0.00 0.00 0.00 23.12 21.15 1cen s ALA 6 CO 0.48 -1.95 0.00 0.41 0.00 0.00 0.00 175.76 174.70 1cen n GLY 7 N 3.41 4.04 3.24 0.00 0.00 -0.23 -1.18 105.19 114.48 1cen n GLY 7 Ca 0.05 -2.24 -0.13 0.00 0.00 0.00 0.00 46.02 43.69 1cen n GLY 7 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1cen s ILE 8 N -1.45 0.04 0.41 -0.61 2.07 -1.19 -2.38 121.20 118.09 1cen s ILE 8 Ca 0.00 -0.33 -0.14 0.00 -1.41 0.00 0.00 60.65 58.76 1cen s ILE 8 Cb 0.00 -0.58 -0.08 0.00 0.13 0.00 0.00 42.46 41.93 1cen s ILE 8 CO 0.00 -0.18 0.83 0.20 -1.91 0.00 0.00 174.94 173.88 1cen s ASN 9 N -0.89 6.67 -0.55 4.50 0.01 -0.17 -1.50 114.94 123.02 1cen s ASN 9 Ca -0.10 1.34 0.05 0.00 -0.71 0.00 0.00 52.86 53.44 1cen s ASN 9 Cb -0.04 -2.40 0.37 0.00 0.41 0.00 0.00 41.25 39.58 1cen s ASN 9 CO 0.03 -0.38 1.04 0.18 -1.51 0.00 0.00 177.10 176.46 1cen n LEU 10 N -1.00 4.67 -4.80 0.60 4.77 -0.28 -1.72 117.00 119.24 1cen n LEU 10 Ca 0.04 -5.51 -0.34 0.00 -0.03 0.00 0.00 56.01 50.17 1cen n LEU 10 Cb 0.54 -0.55 -0.05 0.00 -2.33 0.00 0.00 43.42 41.03 1cen n LEU 10 CO 0.44 2.31 0.68 -0.83 -1.33 0.00 0.00 177.39 178.66 1cen s GLY 11 N -3.43 2.52 0.00 -0.72 0.00 -1.26 -3.85 107.32 100.58 1cen s GLY 11 Ca 0.48 0.52 0.00 0.00 0.00 0.00 0.00 44.72 45.73 1cen s GLY 11 CO -0.16 0.85 0.00 0.61 0.00 0.00 0.00 173.10 174.40 1cen n GLY 12 N -0.25 0.86 0.00 0.20 0.00 -0.60 -4.80 105.19 100.60 1cen n GLY 12 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1cen n GLY 12 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1cen n TRP 13 N -2.00 0.00 -0.85 1.61 -0.00 -1.25 -4.22 117.44 110.73 1cen n TRP 13 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 57.50 57.58 1cen n TRP 13 Cb 0.00 0.00 0.30 0.00 -0.00 0.00 0.00 31.31 31.61 1cen n TRP 13 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 177.69 178.13 1cen n ILE 14 N -0.67 2.25 -3.86 5.87 -5.35 -1.26 -4.55 119.36 111.78 1cen n ILE 14 Ca 0.00 -1.58 -0.12 0.00 -0.27 0.00 0.00 62.75 60.78 1cen n ILE 14 Cb 0.00 -0.14 -0.12 0.00 -1.74 0.00 0.00 39.64 37.64 1cen n ILE 14 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1cen s SER 15 N -1.40 -0.03 -1.09 7.28 0.15 -1.24 -1.55 113.70 115.82 1cen s SER 15 Ca 0.45 0.02 -0.03 0.00 0.70 0.00 0.00 55.95 57.09 1cen s SER 15 Cb 0.34 0.19 0.02 0.00 -1.71 0.00 0.00 66.02 64.87 1cen s SER 15 CO 0.13 -0.14 0.17 0.00 1.20 0.00 0.00 173.24 174.60 1cen n GLN 16 N 2.49 -2.74 -2.24 5.44 6.02 -1.26 -1.55 117.38 123.54 1cen n GLN 16 Ca -0.16 0.54 -0.39 0.00 -0.01 0.00 0.00 57.00 56.98 1cen n GLN 16 Cb 0.58 -5.18 -0.02 0.00 1.02 0.00 0.00 30.24 26.64 1cen n GLN 16 CO 0.00 0.00 0.00 1.52 -1.01 0.00 0.00 177.06 177.57 1cen s TYR 17 N -2.70 3.06 0.08 1.08 -0.85 -1.26 -4.59 117.35 112.17 1cen s TYR 17 Ca 0.13 1.52 -0.35 0.00 -0.52 0.00 0.00 57.07 57.85 1cen s TYR 17 Cb -0.07 -3.47 -0.18 0.00 0.38 0.00 0.00 41.96 38.63 1cen s TYR 17 CO 0.17 -1.47 1.55 1.96 -1.52 0.00 0.00 175.55 176.24 1cen h GLN 18 N 2.81 -1.01 -4.60 -3.49 7.50 -1.91 -3.43 115.11 110.97 1cen h GLN 18 Ca -0.49 0.07 -0.36 0.00 0.50 0.00 0.00 58.65 58.37 1cen h GLN 18 Cb 1.23 0.23 -0.28 0.00 0.05 0.00 0.00 27.48 28.72 1cen h GLN 18 CO 0.63 -0.68 -0.77 0.08 -1.50 0.00 0.00 178.83 176.60 1cen s VAL 19 N -5.80 0.61 -0.64 -0.54 1.01 -1.26 -5.08 120.40 108.70 1cen s VAL 19 Ca -0.18 -0.44 -0.27 0.00 0.00 0.00 0.00 61.98 61.09 1cen s VAL 19 Cb 0.04 -0.54 -0.00 0.00 0.00 0.00 0.00 36.38 35.87 1cen s VAL 19 CO 0.59 0.10 1.67 0.12 0.00 0.00 0.00 175.10 177.58 1cen s PHE 20 N -0.34 1.87 -0.10 5.22 2.19 -1.26 -4.92 117.98 120.63 1cen s PHE 20 Ca 0.01 0.54 -0.10 0.00 0.33 0.00 0.00 56.93 57.71 1cen s PHE 20 Cb -0.04 -4.26 0.03 0.00 -1.31 0.00 0.00 43.02 37.44 1cen s PHE 20 CO -0.00 -2.24 0.28 -1.54 1.83 0.00 0.00 175.22 173.55 1cen s SER 21 N 6.65 -0.29 0.19 6.13 1.04 -1.26 -5.05 113.70 121.12 1cen s SER 21 Ca 0.58 0.56 -0.12 0.00 0.48 0.00 0.00 55.95 57.45 1cen s SER 21 Cb -0.11 0.57 0.19 0.00 0.10 0.00 0.00 66.02 66.77 1cen s SER 21 CO 0.20 -0.10 1.78 0.11 0.98 0.00 0.00 173.24 176.20 1cen h LYS 22 N 5.68 0.48 -0.54 4.02 1.57 -1.98 -1.16 116.57 124.63 1cen h LYS 22 Ca -0.26 -0.03 0.11 0.00 -1.87 0.00 0.00 60.65 58.60 1cen h LYS 22 Cb 1.19 -0.11 -0.09 0.00 0.08 0.00 0.00 32.23 33.30 1cen h LYS 22 CO 0.33 0.32 -0.00 1.49 -0.57 0.00 0.00 179.45 181.01 1cen h GLU 23 N 0.49 0.11 0.43 3.15 4.57 -1.98 0.37 114.58 121.72 1cen h GLU 23 Ca 0.26 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.41 1cen h GLU 23 Cb 0.21 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.78 1cen h GLU 23 CO -0.21 0.07 -0.21 1.25 -1.18 0.00 0.00 179.01 178.74 1cen h HIS 24 N 0.11 -0.53 -0.56 0.92 2.76 -1.72 -1.91 115.15 114.22 1cen h HIS 24 Ca 0.28 -0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.48 1cen h HIS 24 Cb 0.43 0.18 -0.03 0.00 1.55 0.00 0.00 27.41 29.53 1cen h HIS 24 CO -0.34 -0.30 0.37 0.74 -1.30 0.00 0.00 177.93 177.11 1cen h PHE 25 N -0.63 0.58 0.00 5.26 0.04 -0.52 -0.17 116.94 121.50 1cen h PHE 25 Ca -0.06 0.01 -0.04 0.00 2.80 0.00 0.00 57.97 60.68 1cen h PHE 25 Cb 0.47 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.42 1cen h PHE 25 CO -0.03 0.32 -0.46 -0.44 -0.60 0.00 0.00 178.31 177.10 1cen h ASP 26 N 0.59 0.00 0.00 2.17 3.32 -0.15 -3.40 116.42 118.94 1cen h ASP 26 Ca 0.23 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.20 1cen h ASP 26 Cb 0.19 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 1cen h ASP 26 CO -0.06 0.19 -1.54 0.35 -1.72 0.00 0.00 179.24 176.45 1cen n THR 27 N -3.03 0.33 -0.11 0.35 -2.24 -0.73 -4.70 114.28 104.14 1cen n THR 27 Ca 0.01 -0.31 -0.08 0.00 -2.27 0.00 0.00 64.05 61.41 1cen n THR 27 Cb 0.62 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 1cen n THR 27 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1cen h PHE 28 N 0.00 0.39 -3.19 4.78 3.57 -1.25 -3.39 116.94 117.85 1cen h PHE 28 Ca -0.13 0.01 -0.53 0.00 3.53 0.00 0.00 57.97 60.85 1cen h PHE 28 Cb 1.03 -0.12 -0.37 0.00 2.79 0.00 0.00 35.95 39.28 1cen h PHE 28 CO 0.00 0.22 -0.80 0.42 -2.23 0.00 0.00 178.31 175.92 1cen s ILE 29 N -6.16 1.06 0.45 1.41 -1.09 -1.26 -5.04 121.20 110.57 1cen s ILE 29 Ca -0.13 -0.34 0.03 0.00 -2.23 0.00 0.00 60.65 57.98 1cen s ILE 29 Cb 0.11 -1.09 -0.03 0.00 -1.58 0.00 0.00 42.46 39.87 1cen s ILE 29 CO 0.72 0.35 0.05 0.42 -1.23 0.00 0.00 174.94 175.24 1cen s THR 30 N 1.69 1.07 0.53 2.92 -4.23 -1.26 -4.87 115.64 111.49 1cen s THR 30 Ca 0.05 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 58.75 1cen s THR 30 Cb -0.13 -2.35 0.31 0.00 1.34 0.00 0.00 72.50 71.67 1cen s THR 30 CO -0.08 0.00 2.13 -0.08 -0.54 0.00 0.00 174.62 176.04 1cen h GLU 31 N 1.59 0.00 -0.17 3.99 4.81 -1.98 -1.79 114.58 121.03 1cen h GLU 31 Ca -0.41 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.82 1cen h GLU 31 Cb 1.29 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.66 1cen h GLU 31 CO 0.69 0.00 0.08 0.87 -0.73 0.00 0.00 179.01 179.92 1cen h LYS 32 N 0.00 0.23 0.00 1.92 1.57 -1.99 -0.66 116.57 117.64 1cen h LYS 32 Ca 0.05 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1cen h LYS 32 Cb 0.22 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1cen h LYS 32 CO -0.00 0.18 -0.00 -0.44 -0.57 0.00 0.00 179.45 178.62 1cen h ASP 33 N 0.23 -0.00 -0.58 0.86 3.32 -1.73 -1.56 116.42 116.96 1cen h ASP 33 Ca 0.06 -0.53 0.03 0.00 0.02 0.00 0.00 57.03 56.61 1cen h ASP 33 Cb 0.02 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 1cen h ASP 33 CO -0.01 0.53 0.38 0.40 -1.72 0.00 0.00 179.24 178.83 1cen h ILE 34 N -0.53 1.09 -0.26 0.35 1.08 -1.50 0.41 117.51 118.14 1cen h ILE 34 Ca -0.00 -0.24 -0.06 0.00 -0.39 0.00 0.00 64.86 64.17 1cen h ILE 34 Cb 0.53 0.33 -0.01 0.00 -3.07 0.00 0.00 36.82 34.61 1cen h ILE 34 CO 0.00 0.13 -0.09 -0.08 -0.69 0.00 0.00 178.15 177.42 1cen h GLU 35 N 0.69 0.52 -0.17 2.37 4.81 -1.05 -0.50 114.58 121.25 1cen h GLU 35 Ca 0.23 -0.21 0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1cen h GLU 35 Cb 0.05 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.38 1cen h GLU 35 CO -0.06 0.75 -0.01 1.15 -0.73 0.00 0.00 179.01 180.12 1cen h THR 36 N 0.26 0.87 -0.84 0.32 2.02 -0.16 0.17 112.91 115.55 1cen h THR 36 Ca 0.06 -0.02 0.04 0.00 0.77 0.00 0.00 66.41 67.27 1cen h THR 36 Cb 0.57 0.82 -0.05 0.00 -1.74 0.00 0.00 68.15 67.75 1cen h THR 36 CO 0.03 0.01 0.54 0.40 0.37 0.00 0.00 175.52 176.87 1cen h ILE 37 N 0.05 1.11 -0.36 3.11 2.04 -0.92 -0.80 117.51 121.75 1cen h ILE 37 Ca 0.08 -0.35 -0.06 0.00 1.00 0.00 0.00 64.86 65.53 1cen h ILE 37 Cb 0.10 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.16 1cen h ILE 37 CO -0.14 0.19 -0.00 0.00 0.00 0.00 0.00 178.15 178.19 1cen h ALA 38 N 1.36 0.48 -0.21 1.87 0.00 -0.36 -2.66 119.26 119.74 1cen h ALA 38 Ca 0.34 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1cen h ALA 38 Cb 0.04 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1cen h ALA 38 CO -0.13 0.26 -0.09 0.93 0.00 0.00 0.00 179.25 180.22 1cen h GLU 39 N 0.45 0.34 0.00 0.00 4.39 -0.28 -2.51 114.58 116.97 1cen h GLU 39 Ca 0.10 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.73 1cen h GLU 39 Cb 0.47 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 1cen h GLU 39 CO 0.02 0.44 0.00 0.00 -1.16 0.00 0.00 179.01 178.31 1cen h ALA 40 N 1.59 1.00 0.00 3.43 0.00 -0.80 -3.47 119.26 121.02 1cen h ALA 40 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1cen h ALA 40 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1cen h ALA 40 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 1cen n GLY 41 N -0.27 0.64 3.78 0.00 0.00 -0.94 -4.81 105.19 103.57 1cen n GLY 41 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1cen n GLY 41 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1cen s PHE 42 N -2.00 2.69 -1.85 1.61 0.08 -1.15 -4.86 117.98 112.50 1cen s PHE 42 Ca 0.00 1.55 0.19 0.00 0.12 0.00 0.00 56.93 58.78 1cen s PHE 42 Cb 0.00 -3.27 0.03 0.00 -0.57 0.00 0.00 43.02 39.21 1cen s PHE 42 CO 0.00 -1.54 0.98 -0.40 -0.10 0.00 0.00 175.22 174.16 1cen n ASP 43 N -1.38 1.96 -3.70 1.36 5.68 -0.32 -4.68 116.55 115.47 1cen n ASP 43 Ca 0.11 -1.48 -0.04 0.00 -0.50 0.00 0.00 54.79 52.89 1cen n ASP 43 Cb 0.51 0.38 -0.01 0.00 -1.14 0.00 0.00 41.12 40.86 1cen n ASP 43 CO 0.00 0.00 0.00 -1.38 -1.33 0.00 0.00 177.20 174.49 1cen s HIS 44 N -2.03 -0.15 0.08 2.11 -3.43 -1.25 -1.09 115.29 109.53 1cen s HIS 44 Ca 0.17 -0.10 0.05 0.00 -0.80 0.00 0.00 55.06 54.38 1cen s HIS 44 Cb 0.15 0.61 -0.03 0.00 -1.43 0.00 0.00 32.58 31.88 1cen s HIS 44 CO 0.42 -0.70 -0.14 0.14 -2.00 0.00 0.00 174.74 172.46 1cen s VAL 45 N -3.14 1.12 -0.15 -5.38 -7.23 -0.66 -3.18 120.40 101.77 1cen s VAL 45 Ca 0.11 -1.40 -0.02 0.00 -1.81 0.00 0.00 61.98 58.86 1cen s VAL 45 Cb -0.01 -1.17 -0.02 0.00 0.56 0.00 0.00 36.38 35.75 1cen s VAL 45 CO -0.00 -0.30 -0.08 -0.60 -0.31 0.00 0.00 175.10 173.81 1cen s ARG 46 N -2.00 3.53 -0.38 4.82 3.52 -0.56 -1.26 118.95 126.62 1cen s ARG 46 Ca 0.00 -0.59 0.04 0.00 -0.13 0.00 0.00 55.73 55.05 1cen s ARG 46 Cb -0.08 -2.80 0.11 0.00 -1.56 0.00 0.00 34.95 30.61 1cen s ARG 46 CO 0.02 0.20 0.10 -1.17 -0.81 0.00 0.00 175.30 173.64 1cen s LEU 47 N 0.43 4.67 0.28 -0.88 2.96 0.10 -1.12 118.68 125.12 1cen s LEU 47 Ca -0.06 -2.34 -0.29 0.00 -0.22 0.00 0.00 54.13 51.21 1cen s LEU 47 Cb -0.15 -1.63 -0.09 0.00 0.50 0.00 0.00 46.19 44.81 1cen s LEU 47 CO 0.04 -0.35 1.08 -2.16 -1.32 0.00 0.00 176.35 173.64 1cen s PRO 48 N 0.64 4.64 0.02 0.98 0.04 -1.26 -0.63 135.00 139.43 1cen s PRO 48 Ca 0.12 1.76 0.01 0.00 0.04 0.00 0.00 61.00 62.94 1cen s PRO 48 Cb -0.21 -3.16 -0.01 0.00 0.04 0.00 0.00 34.50 31.16 1cen s PRO 48 CO -0.06 0.22 -0.05 -0.59 0.04 0.00 0.00 177.00 176.56 1cen s PHE 49 N -1.19 0.42 -0.12 0.56 -0.71 0.30 -3.72 117.98 113.51 1cen s PHE 49 Ca 0.45 -0.28 -0.10 0.00 -1.04 0.00 0.00 56.93 55.96 1cen s PHE 49 Cb -0.31 -0.26 -0.05 0.00 -1.21 0.00 0.00 43.02 41.19 1cen s PHE 49 CO 0.40 -0.06 0.22 -0.51 -1.34 0.00 0.00 175.22 173.92 1cen s ASP 50 N -0.78 6.44 0.38 1.98 1.01 -0.60 -0.57 116.67 124.53 1cen s ASP 50 Ca -0.05 0.52 0.21 0.00 0.71 0.00 0.00 52.55 53.94 1cen s ASP 50 Cb -0.06 -2.13 1.26 0.00 1.01 0.00 0.00 42.92 43.01 1cen s ASP 50 CO -0.00 0.28 1.63 0.10 0.21 0.00 0.00 175.17 177.39 1cen h TYR 51 N 5.62 0.77 0.00 4.23 -0.00 -1.58 -2.64 116.97 123.37 1cen h TYR 51 Ca -0.49 0.03 0.00 0.00 0.00 0.00 0.00 58.73 58.28 1cen h TYR 51 Cb 1.20 -0.19 0.00 0.00 0.00 0.00 0.00 36.73 37.73 1cen h TYR 51 CO 0.68 -0.26 0.00 -1.35 -0.00 0.00 0.00 178.16 177.23 1cen h PRO 52 N 0.16 0.00 0.00 0.10 0.11 -1.86 0.44 132.00 130.95 1cen h PRO 52 Ca 0.79 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.90 1cen h PRO 52 Cb 2.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 33.21 1cen h PRO 52 CO -0.59 0.00 0.00 -0.84 -0.21 0.00 0.00 178.00 176.36 1cen h ILE 53 N 0.00 0.00 0.00 4.15 3.07 -1.81 -3.32 117.51 119.61 1cen h ILE 53 Ca 0.00 -0.53 -0.27 0.00 1.55 0.00 0.00 64.86 65.61 1cen h ILE 53 Cb 0.11 1.46 -0.05 0.00 -0.27 0.00 0.00 36.82 38.07 1cen h ILE 53 CO 0.00 0.00 -2.01 -0.38 -1.05 0.00 0.00 178.15 174.71 1cen n ILE 54 N -2.76 1.02 -3.87 0.16 5.41 0.13 -3.61 119.36 115.84 1cen n ILE 54 Ca 0.02 -0.38 -0.12 0.00 1.00 0.00 0.00 62.75 63.26 1cen n ILE 54 Cb 0.35 -1.15 -0.14 0.00 -0.71 0.00 0.00 39.64 37.98 1cen n ILE 54 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 1cen s GLU 55 N -2.35 0.01 -0.03 0.38 2.12 0.00 -0.91 118.70 117.92 1cen s GLU 55 Ca -0.24 0.01 -0.06 0.00 0.36 0.00 0.00 54.97 55.04 1cen s GLU 55 Cb 0.06 -0.03 -0.04 0.00 0.26 0.00 0.00 34.13 34.38 1cen s GLU 55 CO 0.41 -0.01 0.21 0.45 -0.54 0.00 0.00 175.26 175.78 1cen s SER 56 N 0.08 6.44 0.67 -1.70 0.15 -1.26 -3.96 113.70 114.11 1cen s SER 56 Ca -0.01 0.48 0.41 0.00 0.70 0.00 0.00 55.95 57.53 1cen s SER 56 Cb -0.01 -2.06 2.22 0.00 -1.71 0.00 0.00 66.02 64.46 1cen s SER 56 CO -0.00 0.29 2.26 0.44 1.20 0.00 0.00 173.24 177.43 1cen h ASP 57 N 4.18 0.00 0.00 5.45 3.32 -1.99 -3.20 116.42 124.19 1cen h ASP 57 Ca -0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.54 1cen h ASP 57 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1cen h ASP 57 CO 0.65 0.00 0.00 0.47 -1.72 0.00 0.00 179.24 178.64 1cen n ASP 58 N -3.06 0.00 -3.49 6.45 8.00 -1.26 -4.28 116.55 118.91 1cen n ASP 58 Ca -0.03 0.20 -0.40 0.00 0.71 0.00 0.00 54.79 55.27 1cen n ASP 58 Cb 0.15 -0.09 -0.02 0.00 -0.02 0.00 0.00 41.12 41.15 1cen n ASP 58 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1cen n ASN 59 N -0.76 7.22 -4.68 -2.24 6.94 -1.24 -4.95 115.26 115.56 1cen n ASN 59 Ca 0.00 -2.79 -0.47 0.00 -0.02 0.00 0.00 54.58 51.30 1cen n ASN 59 Cb 0.00 -1.53 -0.04 0.00 -2.36 0.00 0.00 39.78 35.84 1cen n ASN 59 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 1cen n VAL 60 N 3.52 0.44 0.00 3.53 0.31 -1.21 -2.09 118.33 122.83 1cen n VAL 60 Ca 0.66 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.91 1cen n VAL 60 Cb 0.28 -1.84 0.00 0.00 -0.91 0.00 0.00 33.84 31.37 1cen n VAL 60 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1cen n GLY 61 N 4.17 2.03 3.52 2.92 0.00 -1.26 -5.06 105.19 111.50 1cen n GLY 61 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1cen n GLY 61 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1cen s GLU 62 N -0.08 3.33 -0.16 1.61 -6.30 -0.89 -5.03 118.70 111.18 1cen s GLU 62 Ca 0.00 -0.43 -0.22 0.00 -2.50 0.00 0.00 54.97 51.82 1cen s GLU 62 Cb 0.00 -3.91 -0.03 0.00 0.00 0.00 0.00 34.13 30.19 1cen s GLU 62 CO 0.00 -0.84 0.67 0.71 0.02 0.00 0.00 175.26 175.82 1cen s TYR 63 N 2.46 3.43 -0.29 5.30 2.02 -1.26 -4.55 117.35 124.45 1cen s TYR 63 Ca 0.18 1.05 -0.29 0.00 -0.37 0.00 0.00 57.07 57.64 1cen s TYR 63 Cb -0.15 -2.82 -0.02 0.00 -0.40 0.00 0.00 41.96 38.56 1cen s TYR 63 CO 0.15 -0.11 1.68 0.15 -1.57 0.00 0.00 175.55 175.86 1cen s LYS 64 N 1.64 3.55 0.55 -0.62 1.02 -0.08 -4.87 119.74 120.93 1cen s LYS 64 Ca 0.32 1.47 0.32 0.00 0.02 0.00 0.00 55.97 58.11 1cen s LYS 64 Cb -0.16 -4.11 1.54 0.00 -0.52 0.00 0.00 37.83 34.57 1cen s LYS 64 CO 0.12 -1.59 2.07 0.93 -0.92 0.00 0.00 175.35 175.96 1cen h GLU 65 N 11.75 0.00 -0.03 1.68 4.39 -1.91 -1.70 114.58 128.76 1cen h GLU 65 Ca -0.33 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.24 1cen h GLU 65 Cb 1.16 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.79 1cen h GLU 65 CO 1.02 0.07 -0.60 0.38 -1.16 0.00 0.00 179.01 178.72 1cen h ASP 66 N 0.00 0.11 0.18 1.42 3.04 -1.90 -2.06 116.42 117.21 1cen h ASP 66 Ca -0.00 -0.06 -0.27 0.00 -3.24 0.00 0.00 57.03 53.46 1cen h ASP 66 Cb 0.39 -0.03 0.02 0.00 -1.04 0.00 0.00 39.33 38.67 1cen h ASP 66 CO 0.01 0.68 -1.23 1.23 -2.04 0.00 0.00 179.24 177.89 1cen h GLY 67 N 1.67 0.44 1.91 7.15 0.00 -1.40 -3.30 103.07 109.54 1cen h GLY 67 Ca -0.01 -1.13 -0.01 0.00 0.00 0.00 0.00 47.33 46.18 1cen h GLY 67 CO 0.08 0.99 0.02 1.41 0.00 0.00 0.00 176.54 179.05 1cen h LEU 68 N -0.13 0.10 -1.82 3.11 3.38 -1.36 -2.47 115.31 116.12 1cen h LEU 68 Ca -0.23 -0.01 0.10 0.00 0.09 0.00 0.00 57.88 57.84 1cen h LEU 68 Cb 1.89 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 42.59 1cen h LEU 68 CO 0.18 0.11 0.33 0.77 0.09 0.00 0.00 178.44 179.92 1cen h SER 69 N 0.12 0.19 -0.38 -0.43 4.64 -1.45 0.04 113.55 116.28 1cen h SER 69 Ca 0.03 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.22 1cen h SER 69 Cb 0.05 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1cen h SER 69 CO -0.00 0.11 -0.30 1.88 -0.87 0.00 0.00 176.83 177.65 1cen h TYR 70 N 0.21 1.03 -0.30 4.77 0.05 -1.62 0.03 116.97 121.14 1cen h TYR 70 Ca 0.22 -0.29 -0.07 0.00 0.05 0.00 0.00 58.73 58.64 1cen h TYR 70 Cb 0.60 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 38.11 1cen h TYR 70 CO -0.00 1.09 -0.10 0.82 -1.05 0.00 0.00 178.16 178.92 1cen h ILE 71 N 0.67 1.29 0.26 -2.88 2.04 -1.37 -1.74 117.51 115.78 1cen h ILE 71 Ca 0.07 -1.16 0.00 0.00 1.00 0.00 0.00 64.86 64.77 1cen h ILE 71 Cb 0.89 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 38.37 1cen h ILE 71 CO 0.08 0.37 -0.24 0.44 0.00 0.00 0.00 178.15 178.80 1cen h ASP 72 N 0.36 -0.63 -0.95 1.72 3.32 -0.88 -0.61 116.42 118.74 1cen h ASP 72 Ca 0.07 0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.21 1cen h ASP 72 Cb 0.60 0.21 -0.05 0.00 0.22 0.00 0.00 39.33 40.31 1cen h ASP 72 CO 0.03 -0.35 0.62 0.08 -1.72 0.00 0.00 179.24 177.90 1cen h ARG 73 N -0.52 1.17 -0.63 3.56 0.11 -0.98 -0.77 114.38 116.32 1cen h ARG 73 Ca -0.01 -0.07 -0.04 0.00 0.10 0.00 0.00 59.98 59.96 1cen h ARG 73 Cb 0.48 -0.26 -0.03 0.00 1.11 0.00 0.00 29.97 31.26 1cen h ARG 73 CO -0.04 0.78 0.24 0.00 0.10 0.00 0.00 179.97 181.04 1cen h LEU 75 N 0.91 1.05 0.01 0.00 5.85 0.08 -0.56 115.31 122.66 1cen h LEU 75 Ca 0.21 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1cen h LEU 75 Cb 0.20 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.96 1cen h LEU 75 CO -0.02 0.93 -0.01 -0.33 -0.34 0.00 0.00 178.44 178.68 1cen h GLU 76 N 1.11 -0.02 -0.71 1.25 4.39 0.09 0.95 114.58 121.64 1cen h GLU 76 Ca 0.25 0.00 0.07 0.00 0.34 0.00 0.00 59.36 60.03 1cen h GLU 76 Cb 0.22 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.81 1cen h GLU 76 CO -0.02 0.16 0.38 -1.49 -1.16 0.00 0.00 179.01 176.88 1cen h TRP 77 N -0.19 0.70 -0.17 4.33 6.55 -0.59 0.43 115.95 127.00 1cen h TRP 77 Ca -0.00 0.03 -0.02 0.00 0.95 0.00 0.00 58.89 59.85 1cen h TRP 77 Cb 0.19 -0.21 -0.01 0.00 -0.86 0.00 0.00 29.16 28.27 1cen h TRP 77 CO -0.02 0.30 0.04 0.00 -1.05 0.00 0.00 178.44 177.71 1cen h LYS 79 N 0.07 1.04 -0.21 0.00 1.57 -0.25 0.24 116.57 119.04 1cen h LYS 79 Ca 0.05 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 1cen h LYS 79 Cb 0.27 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1cen h LYS 79 CO 0.00 0.69 -0.17 -0.22 -0.57 0.00 0.00 179.45 179.18 1cen h LYS 80 N 1.08 0.36 -0.51 3.15 3.64 -0.62 -2.90 116.57 120.76 1cen h LYS 80 Ca 0.46 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.73 1cen h LYS 80 Cb 0.31 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1cen h LYS 80 CO -0.22 0.53 0.00 0.66 -2.27 0.00 0.00 179.45 178.15 1cen n TYR 81 N -4.20 0.67 -3.46 1.91 4.01 -0.60 -4.97 117.16 110.53 1cen n TYR 81 Ca -0.00 -0.41 -0.20 0.00 -0.16 0.00 0.00 57.90 57.13 1cen n TYR 81 Cb 0.33 -0.01 0.08 0.00 -0.31 0.00 0.00 39.34 39.43 1cen n TYR 81 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1cen n ASN 82 N 1.28 -4.75 -4.71 7.72 5.15 0.68 -4.99 115.26 115.63 1cen n ASN 82 Ca 0.19 -0.53 -0.28 0.00 -0.60 0.00 0.00 54.58 53.36 1cen n ASN 82 Cb 0.55 -4.74 -0.07 0.00 -0.53 0.00 0.00 39.78 34.99 1cen n ASN 82 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1cen s LEU 83 N -6.59 3.53 0.57 1.20 1.43 -0.22 -4.83 118.68 113.77 1cen s LEU 83 Ca 0.37 -0.22 -0.02 0.00 -1.03 0.00 0.00 54.13 53.22 1cen s LEU 83 Cb -0.16 -2.20 0.03 0.00 0.03 0.00 0.00 46.19 43.89 1cen s LEU 83 CO 0.68 0.12 0.83 -0.83 0.23 0.00 0.00 176.35 177.37 1cen s GLY 84 N -2.72 1.70 -0.05 -3.19 0.00 -0.25 -4.31 107.32 98.49 1cen s GLY 84 Ca 0.28 -1.06 -0.02 0.00 0.00 0.00 0.00 44.72 43.92 1cen s GLY 84 CO 0.20 -0.78 0.10 -2.27 0.00 0.00 0.00 173.10 170.35 1cen s LEU 85 N -4.86 0.43 -0.40 0.66 0.20 0.12 -1.65 118.68 113.18 1cen s LEU 85 Ca 0.55 0.19 -0.11 0.00 0.69 0.00 0.00 54.13 55.46 1cen s LEU 85 Cb -0.10 0.11 0.05 0.00 -0.43 0.00 0.00 46.19 45.81 1cen s LEU 85 CO 0.41 -0.20 0.24 -0.69 -0.29 0.00 0.00 176.35 175.82 1cen s VAL 86 N 1.72 4.49 -0.20 1.68 1.01 -0.39 -0.62 120.40 128.08 1cen s VAL 86 Ca -0.02 -1.08 -0.28 0.00 0.00 0.00 0.00 61.98 60.60 1cen s VAL 86 Cb -0.12 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.65 1cen s VAL 86 CO -0.04 -0.36 0.99 -0.22 0.00 0.00 0.00 175.10 175.47 1cen s LEU 87 N 1.51 4.14 -0.14 3.92 2.96 0.15 -0.72 118.68 130.50 1cen s LEU 87 Ca 0.02 1.36 0.01 0.00 -0.22 0.00 0.00 54.13 55.30 1cen s LEU 87 Cb -0.21 -3.48 0.02 0.00 0.50 0.00 0.00 46.19 43.02 1cen s LEU 87 CO 0.05 -0.58 -0.15 -0.62 -1.32 0.00 0.00 176.35 173.73 1cen s ASP 88 N 1.19 2.68 -0.34 3.68 2.15 0.20 0.04 116.67 126.26 1cen s ASP 88 Ca 0.43 -0.49 -0.29 0.00 0.43 0.00 0.00 52.55 52.64 1cen s ASP 88 Cb -0.16 -1.19 0.01 0.00 -0.30 0.00 0.00 42.92 41.28 1cen s ASP 88 CO 0.09 -0.03 1.17 -0.32 -0.17 0.00 0.00 175.17 175.92 1cen s MET 89 N 1.33 3.94 -0.09 4.34 -2.45 -0.88 -0.54 119.30 124.94 1cen s MET 89 Ca 0.02 1.03 0.05 0.00 -1.25 0.00 0.00 55.69 55.54 1cen s MET 89 Cb -0.13 -3.83 -0.24 0.00 1.25 0.00 0.00 34.83 31.88 1cen s MET 89 CO -0.08 -1.09 0.47 1.58 1.05 0.00 0.00 175.02 176.95 1cen n HIS 90 N 7.37 1.01 -3.82 4.11 -0.00 0.27 -1.35 115.22 122.81 1cen n HIS 90 Ca 0.13 0.29 -0.29 0.00 0.46 0.00 0.00 57.72 58.31 1cen n HIS 90 Cb 0.47 -1.16 -0.16 0.00 -0.12 0.00 0.00 29.99 29.03 1cen n HIS 90 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 1cen s HIS 91 N -2.57 1.81 0.71 1.57 2.46 -1.23 -4.56 115.29 113.47 1cen s HIS 91 Ca -0.13 -1.50 -0.08 0.00 0.47 0.00 0.00 55.06 53.82 1cen s HIS 91 Cb 0.07 -1.48 0.05 0.00 -0.13 0.00 0.00 32.58 31.09 1cen s HIS 91 CO 0.79 -0.75 1.04 0.00 -2.47 0.00 0.00 174.74 173.35 1cen s ALA 92 N 1.59 3.06 0.02 1.58 0.00 -0.52 -1.44 121.76 126.06 1cen s ALA 92 Ca 0.01 -0.80 -0.32 0.00 0.00 0.00 0.00 51.96 50.85 1cen s ALA 92 Cb -0.18 -2.70 -0.11 0.00 0.00 0.00 0.00 23.12 20.13 1cen s ALA 92 CO -0.12 -1.29 1.88 -2.30 0.00 0.00 0.00 175.76 173.93 1cen n PRO 93 N -2.96 2.55 0.00 0.00 -0.02 -1.26 -2.37 135.00 130.94 1cen n PRO 93 Ca 0.07 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.48 1cen n PRO 93 Cb 0.60 -2.82 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 1cen n PRO 93 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1cen n GLY 94 N 4.33 2.43 3.20 -1.23 0.00 -1.26 -4.19 105.19 108.47 1cen n GLY 94 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 1cen n GLY 94 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1cen s TYR 95 N -1.11 3.30 0.00 1.61 5.04 -1.00 -0.76 117.35 124.44 1cen s TYR 95 Ca 0.00 -1.81 0.00 0.00 -2.44 0.00 0.00 57.07 52.82 1cen s TYR 95 Cb 0.00 -2.31 0.00 0.00 0.35 0.00 0.00 41.96 40.00 1cen s TYR 95 CO 0.00 -0.80 0.00 2.41 -1.34 0.00 0.00 175.55 175.82 1cen n THR 102 N 4.68 0.00 -3.75 4.34 -1.04 -1.26 -1.43 114.28 115.82 1cen n THR 102 Ca -0.11 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.52 1cen n THR 102 Cb 0.43 0.00 -0.12 0.00 -1.82 0.00 0.00 70.33 68.82 1cen n THR 102 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1cen s SER 103 N -2.52 5.31 0.00 8.00 1.04 -1.26 -4.96 113.70 119.31 1cen s SER 103 Ca 0.00 -1.10 0.27 0.00 0.48 0.00 0.00 55.95 55.60 1cen s SER 103 Cb 0.00 -1.87 0.96 0.00 0.10 0.00 0.00 66.02 65.21 1cen s SER 103 CO 0.00 -0.32 1.71 0.35 0.98 0.00 0.00 173.24 175.96 1cen n THR 104 N 4.82 0.00 -0.27 2.02 -2.24 0.06 -4.42 114.28 114.25 1cen n THR 104 Ca -0.13 -0.04 0.08 0.00 -2.27 0.00 0.00 64.05 61.70 1cen n THR 104 Cb 0.45 -0.03 0.20 0.00 -2.10 0.00 0.00 70.33 68.85 1cen n THR 104 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1cen h LEU 105 N 0.33 -0.23 -0.43 3.22 5.85 -1.72 0.44 115.31 122.77 1cen h LEU 105 Ca 0.00 0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.92 1cen h LEU 105 Cb 0.45 0.32 0.00 0.00 0.37 0.00 0.00 40.66 41.80 1cen h LEU 105 CO 0.00 -0.17 -0.06 0.49 -0.34 0.00 0.00 178.44 178.36 1cen n PHE 106 N -5.30 0.00 -0.10 1.25 3.72 -1.26 -3.84 117.46 111.92 1cen n PHE 106 Ca 0.16 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.40 1cen n PHE 106 Cb 0.54 -0.08 -0.09 0.00 -0.94 0.00 0.00 39.48 38.91 1cen n PHE 106 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1cen n GLU 107 N -0.59 0.50 -3.36 -1.08 4.07 0.39 -4.92 120.64 115.66 1cen n GLU 107 Ca 0.18 0.13 -0.44 0.00 -0.06 0.00 0.00 57.16 56.97 1cen n GLU 107 Cb 0.27 -1.39 -0.08 0.00 -0.06 0.00 0.00 31.44 30.18 1cen n GLU 107 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 1cen s ASP 108 N -6.13 6.16 0.62 4.31 2.15 0.13 -4.95 116.67 118.95 1cen s ASP 108 Ca -0.28 -1.04 0.32 0.00 0.43 0.00 0.00 52.55 51.98 1cen s ASP 108 Cb 0.08 -2.20 1.79 0.00 -0.30 0.00 0.00 42.92 42.29 1cen s ASP 108 CO 0.46 -0.63 2.10 1.55 -0.17 0.00 0.00 175.17 178.48 1cen h PRO 109 N 8.76 0.00 -0.33 4.34 0.13 -1.87 0.10 132.00 143.13 1cen h PRO 109 Ca -0.28 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.70 1cen h PRO 109 Cb 1.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 1cen h PRO 109 CO 0.84 0.00 -0.40 -0.91 -0.23 0.00 0.00 178.00 177.31 1cen h ASN 110 N 0.00 0.84 0.09 1.44 2.35 -1.92 0.14 115.58 118.52 1cen h ASN 110 Ca 0.06 -0.38 -0.13 0.00 -0.55 0.00 0.00 56.30 55.29 1cen h ASN 110 Cb 0.48 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 1cen h ASN 110 CO -0.00 1.13 -0.46 1.56 -1.65 0.00 0.00 177.43 178.01 1cen h GLN 111 N 0.64 0.44 -0.45 0.81 1.08 -1.11 -1.74 115.11 114.78 1cen h GLN 111 Ca 0.05 -0.24 -0.11 0.00 -1.45 0.00 0.00 58.65 56.91 1cen h GLN 111 Cb 0.95 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.38 1cen h GLN 111 CO 0.09 0.81 -0.14 1.96 -0.95 0.00 0.00 178.83 180.60 1cen h GLN 112 N 0.35 0.89 -0.19 1.46 4.20 -1.05 -1.65 115.11 119.12 1cen h GLN 112 Ca 0.02 -0.35 -0.01 0.00 0.06 0.00 0.00 58.65 58.36 1cen h GLN 112 Cb 0.95 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.68 1cen h GLN 112 CO 0.08 1.00 0.07 -0.22 -0.67 0.00 0.00 178.83 179.09 1cen h LYS 113 N 0.72 0.29 -0.93 1.46 1.63 -0.55 -2.08 116.57 117.11 1cen h LYS 113 Ca 0.11 -0.06 0.01 0.00 -0.85 0.00 0.00 60.65 59.86 1cen h LYS 113 Cb 0.69 -0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 32.23 1cen h LYS 113 CO 0.05 0.38 0.61 0.00 -3.45 0.00 0.00 179.45 177.04 1cen h ARG 114 N 0.14 1.23 0.26 1.90 3.08 -1.27 -0.81 114.38 118.90 1cen h ARG 114 Ca 0.06 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 1cen h ARG 114 Cb 0.21 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 1cen h ARG 114 CO -0.00 0.82 -0.21 0.35 -1.07 0.00 0.00 179.97 179.85 1cen h PHE 115 N 1.26 -0.56 -0.56 3.04 3.57 -1.08 -0.89 116.94 121.72 1cen h PHE 115 Ca 0.34 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.80 1cen h PHE 115 Cb -0.14 0.21 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 1cen h PHE 115 CO -0.01 -0.32 0.20 0.28 -2.23 0.00 0.00 178.31 176.24 1cen h VAL 116 N -0.48 1.21 -0.43 1.41 2.07 -1.13 -2.70 116.25 116.20 1cen h VAL 116 Ca -0.01 -0.69 -0.10 0.00 0.82 0.00 0.00 66.70 66.72 1cen h VAL 116 Cb 0.43 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 1cen h VAL 116 CO -0.02 0.27 -0.14 0.44 0.02 0.00 0.00 177.57 178.14 1cen h ASP 117 N 0.81 0.79 -0.51 0.57 3.32 -0.86 -0.26 116.42 120.29 1cen h ASP 117 Ca 0.19 -0.25 -0.07 0.00 0.02 0.00 0.00 57.03 56.91 1cen h ASP 117 Cb 0.19 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1cen h ASP 117 CO -0.01 0.94 0.05 0.40 -1.72 0.00 0.00 179.24 178.89 1cen h ILE 118 N 0.71 1.25 -0.10 0.35 2.04 -0.86 -0.17 117.51 120.73 1cen h ILE 118 Ca 0.11 -1.01 -0.16 0.00 1.00 0.00 0.00 64.86 64.80 1cen h ILE 118 Cb 0.63 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1cen h ILE 118 CO 0.04 0.37 -0.64 -0.50 0.00 0.00 0.00 178.15 177.42 1cen h TRP 119 N 0.86 0.47 -0.56 1.37 4.06 -1.17 -1.62 115.95 119.36 1cen h TRP 119 Ca 0.17 -0.19 -0.06 0.00 2.06 0.00 0.00 58.89 60.87 1cen h TRP 119 Cb 0.44 -0.08 -0.02 0.00 -1.00 0.00 0.00 29.16 28.50 1cen h TRP 119 CO 0.03 0.90 0.13 0.00 -3.56 0.00 0.00 178.44 175.94 1cen h ARG 120 N 0.26 0.89 -0.13 0.49 3.08 -0.79 -0.63 114.38 117.55 1cen h ARG 120 Ca -0.01 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 59.82 1cen h ARG 120 Cb 1.18 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 31.10 1cen h ARG 120 CO 0.11 0.84 0.06 0.35 -1.07 0.00 0.00 179.97 180.25 1cen h PHE 121 N 0.79 0.19 -0.55 3.04 3.57 -0.87 -2.41 116.94 120.69 1cen h PHE 121 Ca 0.17 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.60 1cen h PHE 121 Cb 0.35 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 1cen h PHE 121 CO 0.02 0.25 0.08 -0.07 -2.23 0.00 0.00 178.31 176.37 1cen h LEU 122 N 0.07 0.84 -0.61 0.59 3.38 -1.13 0.29 115.31 118.74 1cen h LEU 122 Ca 0.04 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1cen h LEU 122 Cb 0.14 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 1cen h LEU 122 CO -0.00 0.86 0.39 0.00 0.09 0.00 0.00 178.44 179.78 1cen h ALA 123 N 1.25 0.77 -0.12 1.53 0.00 -0.99 -1.78 119.26 119.91 1cen h ALA 123 Ca 0.17 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1cen h ALA 123 Cb 0.38 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1cen h ALA 123 CO 0.01 0.22 -0.02 0.87 0.00 0.00 0.00 179.25 180.33 1cen h LYS 124 N 0.83 0.23 -0.59 0.00 1.57 -0.97 -2.48 116.57 115.15 1cen h LYS 124 Ca 0.22 -0.08 0.11 0.00 -1.87 0.00 0.00 60.65 59.03 1cen h LYS 124 Cb -0.08 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.18 1cen h LYS 124 CO -0.05 0.51 0.40 -0.09 -0.57 0.00 0.00 179.45 179.65 1cen h ARG 125 N -0.07 0.36 -0.28 3.15 2.43 -0.69 -2.42 114.38 116.86 1cen h ARG 125 Ca 0.03 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1cen h ARG 125 Cb 0.42 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1cen h ARG 125 CO 0.01 0.24 0.00 0.66 -1.51 0.00 0.00 179.97 179.37 1cen n TYR 126 N -4.46 0.96 0.02 2.20 4.01 -0.69 -4.75 117.16 114.43 1cen n TYR 126 Ca 0.10 -0.85 0.22 0.00 -0.16 0.00 0.00 57.90 57.22 1cen n TYR 126 Cb 0.40 -0.30 0.69 0.00 -0.31 0.00 0.00 39.34 39.82 1cen n TYR 126 CO 0.00 0.00 0.00 0.97 -0.46 0.00 0.00 176.86 177.37 1cen h ILE 127 N 1.91 0.31 0.00 -0.72 6.09 -0.95 0.77 117.51 124.92 1cen h ILE 127 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1cen h ILE 127 Cb 1.42 0.52 0.00 0.00 0.47 0.00 0.00 36.82 39.23 1cen h ILE 127 CO 0.22 0.00 -0.65 0.59 -3.07 0.00 0.00 178.15 175.24 1cen n ASN 128 N -3.65 0.62 -4.46 2.19 3.02 -1.26 -4.74 115.26 106.98 1cen n ASN 128 Ca 0.11 -0.39 -0.43 0.00 -0.03 0.00 0.00 54.58 53.83 1cen n ASN 128 Cb 0.81 0.45 -0.05 0.00 -0.61 0.00 0.00 39.78 40.38 1cen n ASN 128 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1cen s GLU 129 N -3.02 3.18 -0.02 3.52 2.56 0.26 -4.90 118.70 120.28 1cen s GLU 129 Ca 0.10 -0.73 0.21 0.00 0.00 0.00 0.00 54.97 54.55 1cen s GLU 129 Cb 0.17 -4.13 -0.29 0.00 2.00 0.00 0.00 34.13 31.88 1cen s GLU 129 CO 0.74 -1.44 0.61 0.54 -0.56 0.00 0.00 175.26 175.15 1cen n ARG 130 N 6.86 0.49 -0.02 4.30 5.12 -1.26 -4.70 116.66 127.45 1cen n ARG 130 Ca -0.04 -0.12 -0.01 0.00 -1.93 0.00 0.00 57.85 55.75 1cen n ARG 130 Cb 0.46 -1.49 -0.04 0.00 -1.16 0.00 0.00 32.46 30.23 1cen n ARG 130 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1cen n GLU 131 N -1.97 2.42 0.00 5.56 1.02 -1.26 -4.82 120.64 121.59 1cen n GLU 131 Ca -0.01 -0.01 0.12 0.00 -0.02 0.00 0.00 57.16 57.23 1cen n GLU 131 Cb 0.47 -1.12 0.10 0.00 -0.02 0.00 0.00 31.44 30.86 1cen n GLU 131 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1cen n HIS 132 N -2.05 0.00 -4.21 -0.32 8.25 -1.26 -4.76 115.22 110.87 1cen n HIS 132 Ca -0.06 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.23 1cen n HIS 132 Cb 0.52 -0.01 -0.13 0.00 1.12 0.00 0.00 29.99 31.49 1cen n HIS 132 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 1cen s ILE 133 N -2.27 0.68 0.07 1.59 2.07 -1.26 0.15 121.20 122.24 1cen s ILE 133 Ca 0.24 -0.73 0.02 0.00 -1.41 0.00 0.00 60.65 58.77 1cen s ILE 133 Cb 0.19 -0.64 -0.04 0.00 0.13 0.00 0.00 42.46 42.10 1cen s ILE 133 CO 0.45 -0.06 -0.06 0.00 -1.91 0.00 0.00 174.94 173.36 1cen s ALA 134 N -0.73 0.77 -0.08 1.50 0.00 0.21 -4.71 121.76 118.72 1cen s ALA 134 Ca -0.02 -1.13 0.02 0.00 0.00 0.00 0.00 51.96 50.83 1cen s ALA 134 Cb -0.06 0.13 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 1cen s ALA 134 CO 0.00 -0.18 -0.12 -0.06 0.00 0.00 0.00 175.76 175.41 1cen s PHE 135 N -2.88 2.80 -0.30 0.00 0.08 -0.72 -0.67 117.98 116.28 1cen s PHE 135 Ca 0.04 -0.24 0.02 0.00 0.12 0.00 0.00 56.93 56.87 1cen s PHE 135 Cb 0.00 -1.72 0.07 0.00 -0.57 0.00 0.00 43.02 40.81 1cen s PHE 135 CO -0.04 0.11 -0.03 -2.00 -0.10 0.00 0.00 175.22 173.17 1cen s GLU 136 N -0.43 2.03 0.10 0.44 2.12 0.11 0.77 118.70 123.85 1cen s GLU 136 Ca 0.05 -1.52 -0.34 0.00 0.36 0.00 0.00 54.97 53.52 1cen s GLU 136 Cb -0.12 -3.07 -0.14 0.00 0.26 0.00 0.00 34.13 31.06 1cen s GLU 136 CO 0.02 -0.72 1.57 -0.07 -0.54 0.00 0.00 175.26 175.52 1cen h LEU 137 N 7.78 -1.47 -7.25 2.70 3.38 -1.81 -2.34 115.31 116.30 1cen h LEU 137 Ca -0.15 0.15 -0.24 0.00 0.09 0.00 0.00 57.88 57.74 1cen h LEU 137 Cb 1.04 0.53 -0.33 0.00 0.09 0.00 0.00 40.66 41.99 1cen h LEU 137 CO 0.50 -0.56 -0.56 -0.22 0.09 0.00 0.00 178.44 177.69 1cen s LEU 138 N -10.22 -0.09 -0.37 1.67 2.96 -1.26 -4.32 118.68 107.06 1cen s LEU 138 Ca -0.17 0.49 -0.28 0.00 -0.22 0.00 0.00 54.13 53.96 1cen s LEU 138 Cb 0.06 0.57 0.02 0.00 0.50 0.00 0.00 46.19 47.34 1cen s LEU 138 CO 0.61 -0.23 1.03 0.21 -1.32 0.00 0.00 176.35 176.66 1cen s ASN 139 N 2.16 6.78 0.06 3.68 2.47 -0.46 -4.62 114.94 125.01 1cen s ASN 139 Ca -0.00 0.76 0.00 0.00 0.42 0.00 0.00 52.86 54.04 1cen s ASN 139 Cb -0.12 -2.52 0.00 0.00 -1.45 0.00 0.00 41.25 37.17 1cen s ASN 139 CO -0.08 -0.95 0.00 0.00 -3.72 0.00 0.00 177.10 172.36 1cen n GLN 140 N 7.03 -4.02 -4.25 0.43 6.02 -1.26 -4.88 117.38 116.45 1cen n GLN 140 Ca 0.10 2.88 -0.31 0.00 -0.01 0.00 0.00 57.00 59.67 1cen n GLN 140 Cb 0.48 -3.58 -0.09 0.00 1.02 0.00 0.00 30.24 28.06 1cen n GLN 140 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1cen s VAL 141 N -0.43 3.72 -0.34 5.09 1.01 -1.26 -4.77 120.40 123.42 1cen s VAL 141 Ca 0.00 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 60.96 1cen s VAL 141 Cb 0.00 -2.72 0.12 0.00 0.00 0.00 0.00 36.38 33.78 1cen s VAL 141 CO 0.00 0.20 0.18 -0.69 0.00 0.00 0.00 175.10 174.78 1cen s VAL 142 N -1.19 0.40 0.15 2.92 1.01 -1.26 0.52 120.40 122.96 1cen s VAL 142 Ca 0.22 -1.56 0.06 0.00 0.00 0.00 0.00 61.98 60.70 1cen s VAL 142 Cb -0.11 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 1cen s VAL 142 CO 0.14 -0.86 -0.13 -1.61 0.00 0.00 0.00 175.10 172.63 1cen s GLU 143 N 1.29 1.13 0.26 2.72 0.41 -1.26 -4.93 118.70 118.32 1cen s GLU 143 Ca 0.14 -1.41 -0.02 0.00 -0.41 0.00 0.00 54.97 53.28 1cen s GLU 143 Cb -0.21 -0.90 0.54 0.00 -1.78 0.00 0.00 34.13 31.78 1cen s GLU 143 CO -0.12 0.15 1.71 -1.35 -0.49 0.00 0.00 175.26 175.16 1cen h PRO 144 N 3.01 0.40 -3.83 0.39 0.11 -2.04 -3.44 132.00 126.60 1cen h PRO 144 Ca -0.38 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.55 1cen h PRO 144 Cb 1.20 -0.09 -0.08 0.00 0.11 0.00 0.00 31.00 32.14 1cen h PRO 144 CO 0.58 0.27 -0.14 0.16 -0.21 0.00 0.00 178.00 178.66 1cen s ASP 145 N -5.29 0.35 0.00 -2.05 1.47 -1.26 -5.06 116.67 104.83 1cen s ASP 145 Ca -0.12 -1.21 0.27 0.00 1.18 0.00 0.00 52.55 52.67 1cen s ASP 145 Cb 0.22 0.63 1.39 0.00 -0.34 0.00 0.00 42.92 44.83 1cen s ASP 145 CO 0.77 -1.25 1.92 -1.20 0.68 0.00 0.00 175.17 176.09 1cen n SER 146 N -0.91 0.56 -0.21 2.11 7.64 -1.26 -4.45 113.62 117.10 1cen n SER 146 Ca -0.01 -1.30 -0.00 0.00 1.01 0.00 0.00 58.87 58.57 1cen n SER 146 Cb 0.62 -0.01 0.11 0.00 -1.01 0.00 0.00 64.21 63.92 1cen n SER 146 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1cen h THR 147 N 0.83 0.82 0.18 0.44 1.35 -1.97 -0.30 112.91 114.26 1cen h THR 147 Ca 0.00 -0.17 -0.31 0.00 -0.55 0.00 0.00 66.41 65.38 1cen h THR 147 Cb 0.18 0.29 0.03 0.00 -1.73 0.00 0.00 68.15 66.91 1cen h THR 147 CO 0.00 0.09 -1.34 0.03 -0.25 0.00 0.00 175.52 174.05 1cen h ARG 148 N 0.49 0.53 -0.55 4.72 3.08 -1.98 -2.96 114.38 117.71 1cen h ARG 148 Ca 0.31 -0.81 -0.05 0.00 0.07 0.00 0.00 59.98 59.51 1cen h ARG 148 Cb 0.34 0.29 -0.02 0.00 0.08 0.00 0.00 29.97 30.66 1cen h ARG 148 CO -0.27 1.37 0.14 2.35 -1.07 0.00 0.00 179.97 182.50 1cen h TRP 149 N 0.19 0.91 -0.85 3.04 -0.00 -1.81 -1.47 115.95 115.95 1cen h TRP 149 Ca -0.21 -0.10 0.08 0.00 -0.00 0.00 0.00 58.89 58.66 1cen h TRP 149 Cb 2.03 -0.26 -0.06 0.00 -0.00 0.00 0.00 29.16 30.87 1cen h TRP 149 CO 0.11 0.78 0.55 -0.91 -0.00 0.00 0.00 178.44 178.98 1cen h ASN 150 N 0.77 0.80 -0.17 2.65 2.35 -1.10 0.49 115.58 121.37 1cen h ASN 150 Ca 0.17 0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 55.87 1cen h ASN 150 Cb 0.32 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.53 1cen h ASN 150 CO -0.00 0.50 -0.14 0.50 -1.65 0.00 0.00 177.43 176.64 1cen h LYS 151 N 0.90 0.39 -0.51 0.81 3.64 -1.27 -1.67 116.57 118.86 1cen h LYS 151 Ca 0.38 -0.19 -0.10 0.00 -1.27 0.00 0.00 60.65 59.46 1cen h LYS 151 Cb 0.30 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 1cen h LYS 151 CO -0.15 0.74 -0.08 1.25 -2.27 0.00 0.00 179.45 178.94 1cen h LEU 152 N 0.05 0.92 -0.35 5.20 5.85 -0.26 -2.71 115.31 124.00 1cen h LEU 152 Ca 0.03 -0.28 -0.04 0.00 0.84 0.00 0.00 57.88 58.44 1cen h LEU 152 Cb 0.65 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 1cen h LEU 152 CO 0.04 1.02 0.08 -0.03 -0.34 0.00 0.00 178.44 179.20 1cen h MET 153 N 0.83 0.57 -0.73 1.25 4.05 -0.03 -1.20 114.93 119.68 1cen h MET 153 Ca 0.14 -0.14 -0.03 0.00 -0.28 0.00 0.00 59.70 59.38 1cen h MET 153 Cb 0.61 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 31.30 1cen h MET 153 CO 0.04 0.62 0.32 -0.07 0.23 0.00 0.00 176.91 178.05 1cen h LEU 154 N 0.42 0.97 -0.57 3.39 3.38 -1.24 -0.32 115.31 121.34 1cen h LEU 154 Ca 0.11 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 1cen h LEU 154 Cb 0.31 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1cen h LEU 154 CO 0.00 0.84 -0.09 -0.33 0.09 0.00 0.00 178.44 178.96 1cen h GLU 155 N 1.05 1.05 -0.46 1.13 5.08 -1.29 -1.71 114.58 119.42 1cen h GLU 155 Ca 0.25 -0.38 -0.10 0.00 -1.00 0.00 0.00 59.36 58.13 1cen h GLU 155 Cb 0.16 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1cen h GLU 155 CO -0.03 1.08 -0.12 0.00 -1.00 0.00 0.00 179.01 178.94 1cen h ILE 157 N 0.73 1.12 -0.29 0.00 1.08 -1.00 -1.76 117.51 117.38 1cen h ILE 157 Ca 0.12 -0.34 0.06 0.00 -0.39 0.00 0.00 64.86 64.31 1cen h ILE 157 Cb 0.67 1.22 -0.06 0.00 -3.07 0.00 0.00 36.82 35.57 1cen h ILE 157 CO 0.05 0.10 -0.11 0.50 -0.69 0.00 0.00 178.15 178.00 1cen h LYS 158 N -0.02 -0.05 -0.74 2.37 1.63 -1.22 0.15 116.57 118.69 1cen h LYS 158 Ca 0.02 0.00 0.03 0.00 -0.85 0.00 0.00 60.65 59.86 1cen h LYS 158 Cb 0.13 0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 31.73 1cen h LYS 158 CO -0.00 -0.04 0.46 0.00 -3.45 0.00 0.00 179.45 176.42 1cen h ALA 159 N 1.21 0.97 -0.27 5.00 0.00 -0.95 -2.61 119.26 122.60 1cen h ALA 159 Ca 0.15 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 1cen h ALA 159 Cb 0.28 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1cen h ALA 159 CO -0.33 0.24 -0.44 0.82 0.00 0.00 0.00 179.25 179.54 1cen h ILE 160 N 0.89 1.29 0.00 0.00 2.04 -0.79 -3.10 117.51 117.85 1cen h ILE 160 Ca 0.30 -1.63 -0.03 0.00 1.00 0.00 0.00 64.86 64.50 1cen h ILE 160 Cb 0.04 1.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1cen h ILE 160 CO -0.12 0.52 -0.13 0.03 0.00 0.00 0.00 178.15 178.45 1cen h ARG 161 N 0.55 0.00 -0.43 2.37 -0.00 -0.63 0.13 114.38 116.38 1cen h ARG 161 Ca 0.04 0.00 -0.08 0.00 -0.50 0.00 0.00 59.98 59.44 1cen h ARG 161 Cb 0.98 0.00 -0.02 0.00 0.00 0.00 0.00 29.97 30.93 1cen h ARG 161 CO 0.09 0.13 -0.05 0.93 0.00 0.00 0.00 179.97 181.08 1cen h GLU 162 N 0.00 0.72 0.08 0.04 5.08 -1.40 -3.30 114.58 115.80 1cen h GLU 162 Ca -0.00 -0.20 -0.31 0.00 -1.00 0.00 0.00 59.36 57.84 1cen h GLU 162 Cb 0.35 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1cen h GLU 162 CO 0.02 0.76 -1.70 0.82 -1.00 0.00 0.00 179.01 177.91 1cen h ILE 163 N 0.66 0.75 -3.03 3.13 2.04 -1.55 -3.46 117.51 116.06 1cen h ILE 163 Ca 0.13 -2.29 -0.51 0.00 1.00 0.00 0.00 64.86 63.19 1cen h ILE 163 Cb 0.48 2.42 -0.40 0.00 -0.74 0.00 0.00 36.82 38.57 1cen h ILE 163 CO 0.02 0.68 -0.76 -0.62 0.00 0.00 0.00 178.15 177.47 1cen s ASP 164 N -6.99 2.99 0.22 1.72 -1.08 0.41 -5.01 116.67 108.94 1cen s ASP 164 Ca -0.24 -0.96 0.26 0.00 -0.52 0.00 0.00 52.55 51.08 1cen s ASP 164 Cb 0.06 -0.41 0.84 0.00 -1.46 0.00 0.00 42.92 41.95 1cen s ASP 164 CO 0.71 -0.37 1.76 -1.54 0.52 0.00 0.00 175.17 176.25 1cen n SER 165 N 5.18 0.80 -0.05 -0.34 3.41 -1.25 -3.86 113.62 117.51 1cen n SER 165 Ca -0.07 0.60 0.01 0.00 -0.26 0.00 0.00 58.87 59.15 1cen n SER 165 Cb 0.46 -0.80 0.01 0.00 -0.26 0.00 0.00 64.21 63.62 1cen n SER 165 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1cen n THR 166 N -2.27 0.75 -1.96 6.66 -2.24 -1.26 -4.91 114.28 109.05 1cen n THR 166 Ca 0.05 -0.88 -0.42 0.00 -2.27 0.00 0.00 64.05 60.53 1cen n THR 166 Cb 0.39 0.63 -0.03 0.00 -2.10 0.00 0.00 70.33 69.22 1cen n THR 166 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1cen s MET 167 N -0.78 4.23 0.03 -0.78 1.75 -1.25 -4.94 119.30 117.56 1cen s MET 167 Ca 0.02 2.33 -0.30 0.00 -1.25 0.00 0.00 55.69 56.48 1cen s MET 167 Cb 0.01 -3.19 -0.05 0.00 2.84 0.00 0.00 34.83 34.44 1cen s MET 167 CO 0.01 -0.60 1.28 -1.58 -0.65 0.00 0.00 175.02 173.49 1cen s TRP 168 N 1.22 3.20 -0.09 4.11 0.52 -1.26 -4.85 118.94 121.79 1cen s TRP 168 Ca 0.70 1.10 0.03 0.00 0.02 0.00 0.00 56.10 57.94 1cen s TRP 168 Cb -0.43 -3.53 -0.02 0.00 -1.15 0.00 0.00 33.47 28.35 1cen s TRP 168 CO 0.31 -1.77 -0.16 -0.51 0.02 0.00 0.00 176.95 174.84 1cen s LEU 169 N 1.67 2.57 -0.31 2.99 1.43 -0.61 -1.76 118.68 124.66 1cen s LEU 169 Ca 0.60 -0.33 -0.09 0.00 -1.03 0.00 0.00 54.13 53.28 1cen s LEU 169 Cb -0.30 -1.54 -0.00 0.00 0.03 0.00 0.00 46.19 44.38 1cen s LEU 169 CO 0.27 0.24 0.15 -0.31 0.23 0.00 0.00 176.35 176.93 1cen s TYR 170 N -0.12 3.18 -0.14 0.29 1.51 0.23 -1.01 117.35 121.29 1cen s TYR 170 Ca -0.02 -0.67 0.01 0.00 -1.01 0.00 0.00 57.07 55.38 1cen s TYR 170 Cb -0.14 -2.35 -0.00 0.00 -0.11 0.00 0.00 41.96 39.36 1cen s TYR 170 CO 0.04 -0.49 -0.16 0.42 -1.11 0.00 0.00 175.55 174.25 1cen s ILE 171 N 1.59 2.70 0.35 2.71 1.01 -0.42 -2.95 121.20 126.19 1cen s ILE 171 Ca 0.04 -0.77 0.08 0.00 0.00 0.00 0.00 60.65 60.01 1cen s ILE 171 Cb -0.17 -2.13 -0.05 0.00 0.01 0.00 0.00 42.46 40.12 1cen s ILE 171 CO 0.06 0.52 0.11 -0.83 0.00 0.00 0.00 174.94 174.80 1cen s GLY 172 N 0.65 2.01 0.06 6.18 0.00 -1.26 -0.99 107.32 113.97 1cen s GLY 172 Ca -0.08 -1.88 0.01 0.00 0.00 0.00 0.00 44.72 42.76 1cen s GLY 172 CO 0.02 -1.81 0.08 0.61 0.00 0.00 0.00 173.10 172.01 1cen n GLY 173 N -1.11 1.67 3.71 0.20 0.00 -1.26 -4.94 105.19 103.47 1cen n GLY 173 Ca -0.03 -2.10 -0.30 0.00 0.00 0.00 0.00 46.02 43.58 1cen n GLY 173 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1cen s ASN 174 N -1.37 3.55 -1.10 1.61 2.47 -1.26 -2.04 114.94 116.80 1cen s ASN 174 Ca 0.06 1.80 -0.14 0.00 0.42 0.00 0.00 52.86 55.00 1cen s ASN 174 Cb -0.00 -2.42 -0.04 0.00 -1.45 0.00 0.00 41.25 37.34 1cen s ASN 174 CO 0.04 -2.64 0.85 0.59 -3.72 0.00 0.00 177.10 172.22 1cen n ASN 175 N -3.91 -5.87 -2.68 -4.21 3.02 0.19 -2.82 115.26 98.98 1cen n ASN 175 Ca 0.09 -0.88 -0.18 0.00 -0.03 0.00 0.00 54.58 53.58 1cen n ASN 175 Cb 0.53 -4.21 0.04 0.00 -0.61 0.00 0.00 39.78 35.54 1cen n ASN 175 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1cen n TYR 176 N -3.76 -1.90 -3.51 3.10 4.01 0.52 -3.15 117.16 112.48 1cen n TYR 176 Ca -0.08 0.59 -0.20 0.00 -0.16 0.00 0.00 57.90 58.05 1cen n TYR 176 Cb 0.60 -3.99 0.06 0.00 -0.31 0.00 0.00 39.34 35.70 1cen n TYR 176 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1cen n ASN 177 N -1.85 -3.42 -4.76 7.72 5.03 -0.86 -4.32 115.26 112.80 1cen n ASN 177 Ca -0.05 -0.77 -0.39 0.00 0.87 0.00 0.00 54.58 54.24 1cen n ASN 177 Cb 0.58 -4.55 -0.04 0.00 -1.02 0.00 0.00 39.78 34.74 1cen n ASN 177 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1cen s SER 178 N -3.98 7.19 0.61 6.41 0.15 -1.13 -0.43 113.70 122.52 1cen s SER 178 Ca 0.19 2.19 0.36 0.00 0.70 0.00 0.00 55.95 59.38 1cen s SER 178 Cb -0.04 -2.62 1.96 0.00 -1.71 0.00 0.00 66.02 63.62 1cen s SER 178 CO 0.78 -0.19 2.25 1.55 1.20 0.00 0.00 173.24 178.83 1cen h PRO 179 N 3.56 0.00 -0.19 5.44 0.13 -1.90 -1.81 132.00 137.22 1cen h PRO 179 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1cen h PRO 179 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1cen h PRO 179 CO 0.66 0.02 0.00 -0.40 -0.23 0.00 0.00 178.00 178.05 1cen n ASP 180 N -3.44 2.37 -0.53 1.44 5.68 -1.26 -3.51 116.55 117.29 1cen n ASP 180 Ca -0.02 -1.81 0.11 0.00 -0.50 0.00 0.00 54.79 52.57 1cen n ASP 180 Cb 0.13 -0.12 0.05 0.00 -1.14 0.00 0.00 41.12 40.04 1cen n ASP 180 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1cen n GLU 181 N 0.80 1.32 -0.25 0.11 -0.58 -0.68 -4.18 120.64 117.18 1cen n GLU 181 Ca 0.17 -1.07 -0.01 0.00 -0.42 0.00 0.00 57.16 55.83 1cen n GLU 181 Cb 0.45 -1.48 0.18 0.00 -0.57 0.00 0.00 31.44 30.03 1cen n GLU 181 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1cen h LEU 182 N 2.61 0.95 -1.67 -4.62 3.38 -1.66 -1.30 115.31 113.00 1cen h LEU 182 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1cen h LEU 182 Cb 0.76 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1cen h LEU 182 CO 0.00 0.74 0.00 0.07 0.09 0.00 0.00 178.44 179.34 1cen h LYS 183 N 1.08 0.00 -0.16 1.13 2.10 -1.84 -2.21 116.57 116.67 1cen h LYS 183 Ca 0.28 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.93 1cen h LYS 183 Cb -0.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.31 1cen h LYS 183 CO -0.05 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.49 1cen n ASN 184 N -2.54 2.43 -4.83 7.07 3.02 -0.49 -4.95 115.26 114.97 1cen n ASN 184 Ca -0.01 -1.81 -0.33 0.00 -0.03 0.00 0.00 54.58 52.40 1cen n ASN 184 Cb 0.11 -0.10 -0.06 0.00 -0.61 0.00 0.00 39.78 39.12 1cen n ASN 184 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1cen s LEU 185 N -1.75 3.93 0.58 3.41 1.43 -0.83 -4.76 118.68 120.69 1cen s LEU 185 Ca 0.34 1.61 -0.18 0.00 -1.03 0.00 0.00 54.13 54.86 1cen s LEU 185 Cb 0.20 -4.46 -0.04 0.00 0.03 0.00 0.00 46.19 41.92 1cen s LEU 185 CO 0.30 -0.36 1.14 0.00 0.23 0.00 0.00 176.35 177.67 1cen s ALA 186 N -2.19 2.61 -0.28 4.21 0.00 -1.26 -4.92 121.76 119.92 1cen s ALA 186 Ca 0.60 0.82 -0.29 0.00 0.00 0.00 0.00 51.96 53.09 1cen s ALA 186 Cb -0.09 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.64 1cen s ALA 186 CO 0.16 -0.96 1.50 -0.51 0.00 0.00 0.00 175.76 175.95 1cen s ASP 187 N -1.88 6.42 -0.38 0.00 1.11 -1.26 -4.96 116.67 115.73 1cen s ASP 187 Ca 0.73 1.35 -0.15 0.00 0.18 0.00 0.00 52.55 54.66 1cen s ASP 187 Cb -0.25 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.21 1cen s ASP 187 CO 0.31 -1.26 0.33 -0.63 1.18 0.00 0.00 175.17 175.09 1cen s ILE 188 N 5.11 5.21 -0.87 0.77 1.01 -1.26 -5.00 121.20 126.18 1cen s ILE 188 Ca 0.66 -0.32 -0.21 0.00 0.00 0.00 0.00 60.65 60.78 1cen s ILE 188 Cb -0.20 -3.87 0.10 0.00 0.01 0.00 0.00 42.46 38.49 1cen s ILE 188 CO 0.28 -0.20 1.15 -0.62 0.00 0.00 0.00 174.94 175.55 1cen s ASP 189 N 1.73 6.47 -0.27 3.58 2.15 -1.26 -4.90 116.67 124.16 1cen s ASP 189 Ca 0.08 -1.59 -0.24 0.00 0.43 0.00 0.00 52.55 51.24 1cen s ASP 189 Cb -0.18 -2.44 0.07 0.00 -0.30 0.00 0.00 42.92 40.07 1cen s ASP 189 CO 0.11 -1.28 0.72 -0.62 -0.17 0.00 0.00 175.17 173.93 1cen s ASP 190 N 3.91 -0.77 0.00 -0.34 -1.08 -1.26 -5.05 116.67 112.08 1cen s ASP 190 Ca 0.33 1.44 0.27 0.00 -0.52 0.00 0.00 52.55 54.07 1cen s ASP 190 Cb -0.07 1.44 0.88 0.00 -1.46 0.00 0.00 42.92 43.71 1cen s ASP 190 CO -0.03 -0.25 1.64 0.47 0.52 0.00 0.00 175.17 177.52 1cen n ASP 191 N 2.94 0.86 -2.78 -0.34 9.92 -1.26 -4.29 116.55 121.59 1cen n ASP 191 Ca -0.15 -0.78 -0.28 0.00 -0.53 0.00 0.00 54.79 53.05 1cen n ASP 191 Cb 0.56 0.08 -0.02 0.00 -0.64 0.00 0.00 41.12 41.10 1cen n ASP 191 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1cen n TYR 192 N -0.76 3.67 -4.64 1.24 4.02 -1.26 -5.00 117.16 114.44 1cen n TYR 192 Ca 0.13 -3.47 -0.23 0.00 -0.01 0.00 0.00 57.90 54.31 1cen n TYR 192 Cb 0.33 -0.39 -0.16 0.00 -0.02 0.00 0.00 39.34 39.11 1cen n TYR 192 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1cen s ILE 193 N -4.95 1.13 -0.07 -0.72 -1.09 -1.26 -1.57 121.20 112.68 1cen s ILE 193 Ca 0.48 -0.57 0.04 0.00 -2.23 0.00 0.00 60.65 58.38 1cen s ILE 193 Cb 0.33 -0.98 -0.00 0.00 -1.58 0.00 0.00 42.46 40.24 1cen s ILE 193 CO -0.17 0.33 -0.20 -0.69 -1.23 0.00 0.00 174.94 172.98 1cen s VAL 194 N 0.01 1.68 -0.15 2.92 1.01 -0.18 -4.48 120.40 121.21 1cen s VAL 194 Ca -0.01 -0.83 -0.18 0.00 0.00 0.00 0.00 61.98 60.96 1cen s VAL 194 Cb -0.09 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 1cen s VAL 194 CO 0.01 0.47 0.48 -0.31 0.00 0.00 0.00 175.10 175.75 1cen s TYR 195 N 0.21 3.46 -0.03 5.22 1.51 0.20 -1.30 117.35 126.62 1cen s TYR 195 Ca -0.10 0.83 -0.01 0.00 -1.01 0.00 0.00 57.07 56.77 1cen s TYR 195 Cb -0.15 -2.58 -0.04 0.00 -0.11 0.00 0.00 41.96 39.09 1cen s TYR 195 CO 0.05 0.08 0.08 1.21 -1.11 0.00 0.00 175.55 175.86 1cen s ASN 196 N 0.80 5.74 -0.08 2.29 2.47 -0.16 -0.09 114.94 125.90 1cen s ASN 196 Ca 0.25 0.19 -0.15 0.00 0.42 0.00 0.00 52.86 53.57 1cen s ASN 196 Cb -0.15 -1.68 0.03 0.00 -1.45 0.00 0.00 41.25 38.00 1cen s ASN 196 CO 0.10 0.30 0.38 0.72 -3.72 0.00 0.00 177.10 174.88 1cen s PHE 197 N -1.14 -0.34 0.12 0.43 -0.71 -0.34 -4.16 117.98 111.84 1cen s PHE 197 Ca 0.21 0.73 -0.01 0.00 -1.04 0.00 0.00 56.93 56.81 1cen s PHE 197 Cb -0.12 0.14 -0.04 0.00 -1.21 0.00 0.00 43.02 41.79 1cen s PHE 197 CO 0.12 -0.31 0.30 -1.01 -1.34 0.00 0.00 175.22 172.97 1cen s HIS 198 N -0.53 3.50 -0.18 3.49 3.76 0.43 -2.85 115.29 122.90 1cen s HIS 198 Ca -0.06 0.34 -0.05 0.00 -0.15 0.00 0.00 55.06 55.13 1cen s HIS 198 Cb -0.04 -1.83 0.07 0.00 1.11 0.00 0.00 32.58 31.89 1cen s HIS 198 CO 0.03 0.50 0.11 0.12 -0.85 0.00 0.00 174.74 174.65 1cen s PHE 199 N -1.65 0.11 -0.11 1.40 2.19 0.01 -4.52 117.98 115.41 1cen s PHE 199 Ca 0.37 -0.24 0.17 0.00 0.33 0.00 0.00 56.93 57.57 1cen s PHE 199 Cb -0.12 -0.64 0.39 0.00 -1.31 0.00 0.00 43.02 41.34 1cen s PHE 199 CO 0.27 -0.53 1.18 0.66 1.83 0.00 0.00 175.22 178.63 1cen n TYR 200 N 5.29 0.00 -2.92 10.12 4.01 -1.26 -3.81 117.16 128.58 1cen n TYR 200 Ca -0.07 -0.99 -0.40 0.00 -0.16 0.00 0.00 57.90 56.28 1cen n TYR 200 Cb 0.49 -0.19 -0.06 0.00 -0.31 0.00 0.00 39.34 39.27 1cen n TYR 200 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 1cen s ASN 201 N -2.61 7.42 0.04 7.72 -0.87 -1.26 -2.62 114.94 122.76 1cen s ASN 201 Ca 0.34 1.68 -0.30 0.00 -1.57 0.00 0.00 52.86 53.01 1cen s ASN 201 Cb 0.35 -2.52 -0.05 0.00 -0.02 0.00 0.00 41.25 39.02 1cen s ASN 201 CO -0.10 0.15 1.13 -2.84 -2.57 0.00 0.00 177.10 172.87 1cen s PRO 202 N -0.87 4.47 0.34 -0.60 0.02 -1.26 -4.89 135.00 132.20 1cen s PRO 202 Ca 0.38 1.66 0.09 0.00 0.02 0.00 0.00 61.00 63.15 1cen s PRO 202 Cb -0.23 -3.39 0.82 0.00 0.02 0.00 0.00 34.50 31.71 1cen s PRO 202 CO 0.27 -0.20 1.81 0.35 -0.33 0.00 0.00 177.00 178.90 1cen h PHE 203 N 6.83 0.92 -0.00 6.54 3.57 -1.93 0.23 116.94 133.11 1cen h PHE 203 Ca -0.41 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.12 1cen h PHE 203 Cb 1.21 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.67 1cen h PHE 203 CO 0.67 0.24 -0.00 1.19 -2.23 0.00 0.00 178.31 178.18 1cen n PHE 204 N -4.66 0.00 -0.10 0.41 3.72 -1.26 -0.84 117.46 114.73 1cen n PHE 204 Ca 0.21 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.48 1cen n PHE 204 Cb 0.58 -0.33 -0.05 0.00 -0.94 0.00 0.00 39.48 38.73 1cen n PHE 204 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1cen n PHE 205 N -1.33 0.40 0.26 1.38 7.35 -0.09 -3.28 117.46 122.15 1cen n PHE 205 Ca 0.13 0.17 0.10 0.00 -0.76 0.00 0.00 57.45 57.10 1cen n PHE 205 Cb 0.26 -0.75 0.71 0.00 0.35 0.00 0.00 39.48 40.05 1cen n PHE 205 CO 0.00 0.00 0.00 1.79 -0.76 0.00 0.00 176.76 177.79 1cen h THR 206 N -1.00 0.80 -0.05 -2.13 1.35 -1.14 -2.84 112.91 107.91 1cen h THR 206 Ca -0.18 -0.24 -0.02 0.00 -0.55 0.00 0.00 66.41 65.42 1cen h THR 206 Cb 1.02 1.14 -0.01 0.00 -1.73 0.00 0.00 68.15 68.56 1cen h THR 206 CO -0.11 0.06 -0.32 1.41 -0.25 0.00 0.00 175.52 176.31 1cen n HIS 207 N -4.11 0.15 -1.68 4.73 8.25 -0.02 -1.12 115.22 121.42 1cen n HIS 207 Ca -0.03 -1.38 -0.45 0.00 -0.26 0.00 0.00 57.72 55.60 1cen n HIS 207 Cb 0.15 -0.26 -0.04 0.00 1.12 0.00 0.00 29.99 30.96 1cen n HIS 207 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1cen n GLN 208 N -1.17 2.38 -1.57 -0.41 10.64 -1.07 -1.07 117.38 125.10 1cen n GLN 208 Ca 0.20 0.86 -0.18 0.00 -1.83 0.00 0.00 57.00 56.05 1cen n GLN 208 Cb 0.72 -2.67 -0.07 0.00 -0.86 0.00 0.00 30.24 27.36 1cen n GLN 208 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1cen n LYS 209 N 4.17 -1.24 -1.66 2.61 5.02 -1.25 -4.90 118.16 120.91 1cen n LYS 209 Ca 0.17 1.10 -0.43 0.00 -2.02 0.00 0.00 58.31 57.14 1cen n LYS 209 Cb 0.31 -5.37 -0.03 0.00 -0.02 0.00 0.00 35.03 29.92 1cen n LYS 209 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1cen s ALA 210 N -2.67 3.08 0.60 7.82 0.00 -0.24 -4.82 121.76 125.53 1cen s ALA 210 Ca 0.00 0.96 0.30 0.00 0.00 0.00 0.00 51.96 53.23 1cen s ALA 210 Cb 0.00 -3.98 1.73 0.00 0.00 0.00 0.00 23.12 20.87 1cen s ALA 210 CO 0.00 -2.29 2.10 1.12 0.00 0.00 0.00 175.76 176.69 1cen h HIS 211 N 13.12 0.00 -0.02 0.00 2.07 -1.90 -0.42 115.15 128.00 1cen h HIS 211 Ca -0.44 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.08 1cen h HIS 211 Cb 1.23 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.21 1cen h HIS 211 CO 0.95 0.00 -0.03 -2.67 -3.07 0.00 0.00 177.93 173.10 1cen n TRP 212 N -3.64 0.00 -3.74 6.12 2.14 -1.26 -4.80 117.44 112.26 1cen n TRP 212 Ca 0.01 0.00 -0.38 0.00 2.07 0.00 0.00 57.50 59.20 1cen n TRP 212 Cb 0.31 -0.01 -0.12 0.00 -0.81 0.00 0.00 31.31 30.69 1cen n TRP 212 CO 0.00 0.00 0.00 0.45 2.07 0.00 0.00 177.69 180.21 1cen s SER 213 N -2.04 5.31 0.14 -0.67 0.15 -0.17 -4.99 113.70 111.44 1cen s SER 213 Ca 0.32 -1.05 -0.17 0.00 0.70 0.00 0.00 55.95 55.75 1cen s SER 213 Cb 0.20 -1.88 0.02 0.00 -1.71 0.00 0.00 66.02 62.65 1cen s SER 213 CO 0.34 -0.31 1.75 -0.08 1.20 0.00 0.00 173.24 176.14 1cen h GLU 214 N 8.24 0.24 -0.64 5.44 4.81 -1.87 0.50 114.58 131.29 1cen h GLU 214 Ca -0.25 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 58.90 1cen h GLU 214 Cb 1.09 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.39 1cen h GLU 214 CO 0.61 0.16 0.12 0.66 -0.73 0.00 0.00 179.01 179.83 1cen h SER 215 N 0.24 0.99 0.42 1.04 4.64 -1.94 0.84 113.55 119.78 1cen h SER 215 Ca 0.13 -0.22 -0.13 0.00 -0.47 0.00 0.00 61.79 61.10 1cen h SER 215 Cb 0.10 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 1cen h SER 215 CO -0.13 0.98 -0.57 0.00 -0.87 0.00 0.00 176.83 176.23 1cen h ALA 216 N 1.14 0.94 0.10 5.18 0.00 -1.72 -0.61 119.26 124.29 1cen h ALA 216 Ca 0.20 -0.52 -0.27 0.00 0.00 0.00 0.00 54.91 54.31 1cen h ALA 216 Cb 0.40 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.12 1cen h ALA 216 CO 0.01 0.71 -1.18 1.98 0.00 0.00 0.00 179.25 180.77 1cen h MET 217 N 0.12 0.44 -0.24 0.00 -1.53 0.20 -1.69 114.93 112.23 1cen h MET 217 Ca -0.00 -0.61 -0.03 0.00 -3.44 0.00 0.00 59.70 55.62 1cen h MET 217 Cb 1.04 0.21 -0.01 0.00 -0.55 0.00 0.00 31.60 32.29 1cen h MET 217 CO 0.08 1.26 0.03 0.00 0.14 0.00 0.00 176.91 178.42 1cen h ALA 218 N 0.50 0.33 -0.67 0.39 0.00 -0.70 -2.99 119.26 116.11 1cen h ALA 218 Ca -0.15 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 1cen h ALA 218 Cb 1.86 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.53 1cen h ALA 218 CO 0.21 0.02 0.34 -0.92 0.00 0.00 0.00 179.25 178.89 1cen h TYR 219 N 0.21 0.95 -6.89 0.00 3.20 -1.16 -3.47 116.97 109.81 1cen h TYR 219 Ca 0.07 -0.04 -0.56 0.00 3.14 0.00 0.00 58.73 61.35 1cen h TYR 219 Cb 0.35 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 1cen h TYR 219 CO 0.02 0.70 -1.06 -1.71 -1.64 0.00 0.00 178.16 174.48 1cen n ASN 220 N -4.48 -4.36 -3.88 -2.11 5.15 -0.64 -4.95 115.26 100.00 1cen n ASN 220 Ca 0.05 -1.17 -0.16 0.00 -0.60 0.00 0.00 54.58 52.70 1cen n ASN 220 Cb 0.12 -1.57 -0.15 0.00 -0.53 0.00 0.00 39.78 37.64 1cen n ASN 220 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1cen s ARG 221 N -6.40 0.36 0.39 1.20 6.06 -1.26 -5.01 118.95 114.29 1cen s ARG 221 Ca 0.28 -0.05 -0.24 0.00 -2.50 0.00 0.00 55.73 53.22 1cen s ARG 221 Cb -0.16 -0.43 -0.09 0.00 0.06 0.00 0.00 34.95 34.33 1cen s ARG 221 CO 0.94 -0.02 1.01 0.99 -2.50 0.00 0.00 175.30 175.71 1cen s THR 222 N 0.47 3.93 0.01 4.11 2.01 -1.26 -4.46 115.64 120.44 1cen s THR 222 Ca -0.05 1.45 0.00 0.00 0.31 0.00 0.00 61.69 63.41 1cen s THR 222 Cb -0.08 -3.74 -0.01 0.00 0.01 0.00 0.00 72.50 68.68 1cen s THR 222 CO -0.01 -0.01 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.20 1cen s VAL 223 N -1.73 0.12 0.38 3.82 1.01 -1.26 -4.94 120.40 117.81 1cen s VAL 223 Ca 0.57 -0.44 0.08 0.00 0.00 0.00 0.00 61.98 62.19 1cen s VAL 223 Cb -0.19 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.98 1cen s VAL 223 CO 0.24 -0.20 0.30 -0.54 0.00 0.00 0.00 175.10 174.90 1cen s LYS 224 N -0.67 2.52 -0.14 2.72 -0.14 -1.26 -4.77 119.74 118.00 1cen s LYS 224 Ca -0.06 -1.51 -0.06 0.00 -1.36 0.00 0.00 55.97 52.97 1cen s LYS 224 Cb -0.05 -2.33 0.06 0.00 -1.68 0.00 0.00 37.83 33.84 1cen s LYS 224 CO -0.00 -0.07 0.31 -0.47 -0.76 0.00 0.00 175.35 174.36 1cen s TYR 225 N -2.44 -0.48 0.94 3.18 6.14 -1.26 -3.89 117.35 119.54 1cen s TYR 225 Ca 0.44 1.06 -0.11 0.00 0.64 0.00 0.00 57.07 59.10 1cen s TYR 225 Cb -0.03 0.12 0.16 0.00 0.42 0.00 0.00 41.96 42.62 1cen s TYR 225 CO 0.26 -0.32 1.10 -2.14 0.64 0.00 0.00 175.55 175.09 1cen s PRO 226 N 1.75 0.86 0.00 4.97 0.02 -1.26 -4.36 135.00 136.98 1cen s PRO 226 Ca -0.06 1.18 0.00 0.00 0.02 0.00 0.00 61.00 62.14 1cen s PRO 226 Cb -0.10 -1.74 0.00 0.00 0.02 0.00 0.00 34.50 32.68 1cen s PRO 226 CO -0.10 -2.62 0.00 0.41 -0.33 0.00 0.00 177.00 174.36 1cen n GLY 227 N -0.20 -0.67 3.46 0.52 0.00 -0.35 -4.98 105.19 102.97 1cen n GLY 227 Ca 0.08 -0.39 -0.10 0.00 0.00 0.00 0.00 46.02 45.61 1cen n GLY 227 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1cen s GLN 228 N -1.21 1.05 0.15 1.61 -2.07 -1.26 0.08 119.66 118.01 1cen s GLN 228 Ca 0.00 -0.37 -0.30 0.00 -1.82 0.00 0.00 55.36 52.87 1cen s GLN 228 Cb 0.00 0.48 -0.07 0.00 -1.09 0.00 0.00 33.01 32.33 1cen s GLN 228 CO 0.00 -0.46 1.11 0.71 -1.32 0.00 0.00 175.29 175.33 1cen s TYR 229 N -3.38 3.57 0.19 9.60 2.02 -0.70 -4.76 117.35 123.88 1cen s TYR 229 Ca 0.03 1.56 0.10 0.00 -0.37 0.00 0.00 57.07 58.38 1cen s TYR 229 Cb -0.01 -3.29 -0.04 0.00 -0.40 0.00 0.00 41.96 38.21 1cen s TYR 229 CO -0.11 -0.69 -0.17 -1.21 -1.57 0.00 0.00 175.55 171.80 1cen s GLU 230 N -0.09 1.78 -1.81 -0.62 2.02 -1.26 -3.65 118.70 115.06 1cen s GLU 230 Ca 0.51 -1.41 0.00 0.00 0.02 0.00 0.00 54.97 54.09 1cen s GLU 230 Cb -0.29 -1.99 0.00 0.00 0.10 0.00 0.00 34.13 31.95 1cen s GLU 230 CO 0.34 0.41 0.00 0.41 0.02 0.00 0.00 175.26 176.44 1cen n GLY 231 N 0.14 1.65 0.16 -1.39 0.00 -1.26 -4.88 105.19 99.61 1cen n GLY 231 Ca -0.12 -0.07 -0.09 0.00 0.00 0.00 0.00 46.02 45.75 1cen n GLY 231 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1cen h ILE 232 N 0.00 1.10 -0.81 -0.61 1.08 -1.95 0.20 117.51 116.51 1cen h ILE 232 Ca -0.35 -0.19 0.01 0.00 -0.39 0.00 0.00 64.86 63.94 1cen h ILE 232 Cb 1.23 0.60 -0.04 0.00 -3.07 0.00 0.00 36.82 35.53 1cen h ILE 232 CO 0.51 0.10 0.54 -0.08 -0.69 0.00 0.00 178.15 178.52 1cen h GLU 233 N 0.47 1.08 -0.13 2.37 4.81 -1.94 0.65 114.58 121.88 1cen h GLU 233 Ca 0.13 -0.07 -0.16 0.00 -0.13 0.00 0.00 59.36 59.13 1cen h GLU 233 Cb -0.04 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.09 1cen h GLU 233 CO -0.03 0.72 -0.59 1.49 -0.73 0.00 0.00 179.01 179.87 1cen h GLU 234 N 1.11 0.44 -0.14 1.92 4.81 -1.90 -2.38 114.58 118.44 1cen h GLU 234 Ca 0.30 -0.29 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 1cen h GLU 234 Cb -0.12 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.29 1cen h GLU 234 CO -0.06 0.90 0.01 0.35 -0.73 0.00 0.00 179.01 179.47 1cen h PHE 235 N 0.33 0.25 -0.72 0.92 3.57 0.30 -2.89 116.94 118.70 1cen h PHE 235 Ca -0.00 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.43 1cen h PHE 235 Cb 1.12 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 1cen h PHE 235 CO 0.04 0.45 0.33 0.28 -2.23 0.00 0.00 178.31 177.18 1cen h VAL 236 N -0.02 1.23 -0.43 1.41 2.07 -0.88 0.94 116.25 120.57 1cen h VAL 236 Ca 0.04 -0.68 0.08 0.00 0.82 0.00 0.00 66.70 66.96 1cen h VAL 236 Cb 0.34 0.32 -0.07 0.00 -1.52 0.00 0.00 31.29 30.36 1cen h VAL 236 CO 0.01 0.28 0.01 0.50 0.02 0.00 0.00 177.57 178.38 1cen h LYS 237 N 1.03 0.11 -0.07 1.57 1.63 -1.38 -1.95 116.57 117.52 1cen h LYS 237 Ca 0.25 -0.01 -0.19 0.00 -0.85 0.00 0.00 60.65 59.85 1cen h LYS 237 Cb 0.13 -0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 31.73 1cen h LYS 237 CO -0.03 0.08 -0.77 -0.91 -3.45 0.00 0.00 179.45 174.37 1cen h ASN 238 N 0.12 0.50 -2.92 4.20 2.35 -1.21 -3.39 115.58 115.24 1cen h ASN 238 Ca 0.22 -0.34 -0.61 0.00 -0.55 0.00 0.00 56.30 55.01 1cen h ASN 238 Cb 0.31 -0.15 -0.41 0.00 0.05 0.00 0.00 38.32 38.12 1cen h ASN 238 CO -0.35 1.09 -0.67 0.20 -1.65 0.00 0.00 177.43 176.05 1cen s ASN 239 N -6.99 4.01 0.30 5.81 0.01 0.28 -4.94 114.94 113.42 1cen s ASN 239 Ca -0.06 -3.68 0.21 0.00 -0.71 0.00 0.00 52.86 48.62 1cen s ASN 239 Cb 0.10 -1.35 1.12 0.00 0.41 0.00 0.00 41.25 41.53 1cen s ASN 239 CO 0.85 -0.10 1.63 -0.81 -1.51 0.00 0.00 177.10 177.16 1cen n PRO 240 N 2.17 0.13 0.21 -0.60 -0.04 -0.89 -1.29 135.00 134.70 1cen n PRO 240 Ca 0.22 0.63 0.05 0.00 -0.04 0.00 0.00 63.50 64.36 1cen n PRO 240 Cb 0.38 -1.94 0.48 0.00 -0.04 0.00 0.00 33.50 32.38 1cen n PRO 240 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1cen h LYS 241 N 0.00 0.00 -0.90 0.54 1.57 -1.92 -2.27 116.57 113.58 1cen h LYS 241 Ca 0.00 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 58.17 1cen h LYS 241 Cb 0.01 0.00 -0.32 0.00 0.08 0.00 0.00 32.23 32.00 1cen h LYS 241 CO 0.00 0.25 0.37 0.66 -0.57 0.00 0.00 179.45 180.17 1cen n TYR 242 N -4.10 2.99 0.19 -1.35 4.01 -0.41 -4.66 117.16 113.83 1cen n TYR 242 Ca -0.02 -2.68 0.06 0.00 -0.16 0.00 0.00 57.90 55.10 1cen n TYR 242 Cb 0.31 -1.09 0.56 0.00 -0.31 0.00 0.00 39.34 38.81 1cen n TYR 242 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1cen h SER 243 N 1.93 0.11 -0.03 7.72 4.64 -1.55 -1.44 113.55 124.92 1cen h SER 243 Ca 0.53 -0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.85 1cen h SER 243 Cb 1.17 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1cen h SER 243 CO 1.29 0.13 0.11 2.19 -0.87 0.00 0.00 176.83 179.67 1cen h PHE 244 N 0.12 0.00 0.00 4.77 -5.15 -1.86 0.02 116.94 114.84 1cen h PHE 244 Ca 0.03 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.80 1cen h PHE 244 Cb 0.08 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.25 1cen h PHE 244 CO 0.00 0.00 0.00 -1.33 -2.00 0.00 0.00 178.31 174.98 1cen n MET 245 N -3.25 0.05 0.14 6.09 2.81 -0.54 -3.20 117.12 119.22 1cen n MET 245 Ca -0.02 0.25 0.13 0.00 -1.81 0.00 0.00 57.70 56.25 1cen n MET 245 Cb 0.18 -1.59 0.65 0.00 -0.71 0.00 0.00 33.22 31.75 1cen n MET 245 CO 0.00 0.00 0.00 1.98 1.51 0.00 0.00 175.97 179.46 1cen h MET 246 N 0.00 0.03 0.00 0.03 1.85 -1.16 0.56 114.93 116.24 1cen h MET 246 Ca 0.00 -0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 1cen h MET 246 Cb 0.33 -0.01 0.00 0.00 0.43 0.00 0.00 31.60 32.35 1cen h MET 246 CO 0.00 0.02 0.00 -0.85 -0.40 0.00 0.00 176.91 175.68 1cen n GLU 247 N -4.48 0.07 0.00 0.39 0.28 -1.19 -1.76 120.64 113.94 1cen n GLU 247 Ca 0.02 0.29 0.12 0.00 -0.16 0.00 0.00 57.16 57.43 1cen n GLU 247 Cb 0.29 -1.62 0.21 0.00 1.43 0.00 0.00 31.44 31.75 1cen n GLU 247 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1cen n LEU 248 N -1.74 1.92 -4.67 -1.84 4.77 0.19 -4.90 117.00 110.73 1cen n LEU 248 Ca 0.03 -0.65 -0.53 0.00 -0.03 0.00 0.00 56.01 54.83 1cen n LEU 248 Cb 0.20 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.20 1cen n LEU 248 CO 0.17 0.34 1.25 -3.20 -1.33 0.00 0.00 177.39 174.61 1cen n ASN 249 N 0.19 2.48 -0.74 -1.43 5.15 -0.72 -1.32 115.26 118.87 1cen n ASN 249 Ca 0.13 1.07 -0.10 0.00 -0.60 0.00 0.00 54.58 55.08 1cen n ASN 249 Cb 0.45 -1.22 -0.04 0.00 -0.53 0.00 0.00 39.78 38.44 1cen n ASN 249 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1cen n ASN 250 N 4.79 -5.63 -4.68 1.20 5.03 -1.24 -4.93 115.26 109.80 1cen n ASN 250 Ca 0.23 0.24 -0.45 0.00 0.87 0.00 0.00 54.58 55.47 1cen n ASN 250 Cb 0.19 -4.05 -0.03 0.00 -1.02 0.00 0.00 39.78 34.87 1cen n ASN 250 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 1cen n LEU 251 N -1.10 3.29 -4.68 3.41 7.94 -0.43 -4.65 117.00 120.78 1cen n LEU 251 Ca -0.10 1.12 -0.40 0.00 -1.11 0.00 0.00 56.01 55.53 1cen n LEU 251 Cb 0.57 -1.45 -0.06 0.00 0.53 0.00 0.00 43.42 43.01 1cen n LEU 251 CO 0.15 -0.31 0.33 -0.54 -1.11 0.00 0.00 177.39 175.90 1cen s LYS 252 N 0.10 4.26 -0.29 1.96 1.02 -1.26 -1.73 119.74 123.80 1cen s LYS 252 Ca 0.72 0.61 -0.13 0.00 0.02 0.00 0.00 55.97 57.19 1cen s LYS 252 Cb -0.63 -3.54 -0.04 0.00 -0.52 0.00 0.00 37.83 33.10 1cen s LYS 252 CO 0.45 -0.13 0.26 -0.51 -0.92 0.00 0.00 175.35 174.50 1cen s LEU 253 N 1.54 4.13 0.34 3.17 1.43 0.11 -4.85 118.68 124.55 1cen s LEU 253 Ca 0.29 -0.01 -0.18 0.00 -1.03 0.00 0.00 54.13 53.20 1cen s LEU 253 Cb -0.16 -2.22 0.05 0.00 0.03 0.00 0.00 46.19 43.90 1cen s LEU 253 CO 0.11 -0.13 0.82 0.54 0.23 0.00 0.00 176.35 177.92 1cen s ASN 254 N 1.72 -0.04 0.35 2.29 2.20 -1.26 -1.21 114.94 119.00 1cen s ASN 254 Ca 0.09 -0.99 0.03 0.00 -0.94 0.00 0.00 52.86 51.05 1cen s ASN 254 Cb -0.16 0.78 0.65 0.00 -2.00 0.00 0.00 41.25 40.52 1cen s ASN 254 CO 0.11 -1.53 2.00 0.50 -2.94 0.00 0.00 177.10 175.23 1cen h LYS 255 N 2.00 0.83 0.00 3.55 3.64 -1.98 -0.69 116.57 123.93 1cen h LYS 255 Ca -0.30 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.00 1cen h LYS 255 Cb 1.25 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1cen h LYS 255 CO 0.37 0.55 -0.16 0.93 -2.27 0.00 0.00 179.45 178.87 1cen h GLU 256 N 0.85 0.00 -0.07 1.90 3.07 -1.98 -0.50 114.58 117.86 1cen h GLU 256 Ca 0.25 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 59.08 1cen h GLU 256 Cb -0.03 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.88 1cen h GLU 256 CO -0.06 0.16 -0.07 1.25 -1.40 0.00 0.00 179.01 178.89 1cen h LEU 257 N 0.00 0.18 -0.50 1.33 5.85 -1.46 -2.29 115.31 118.42 1cen h LEU 257 Ca -0.00 -0.48 0.02 0.00 0.84 0.00 0.00 57.88 58.26 1cen h LEU 257 Cb 0.62 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 1cen h LEU 257 CO 0.02 0.62 0.30 -0.07 -0.34 0.00 0.00 178.44 178.97 1cen h LEU 258 N -0.25 0.48 -1.54 2.25 3.38 -1.03 -2.39 115.31 116.21 1cen h LEU 258 Ca 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1cen h LEU 258 Cb 0.57 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1cen h LEU 258 CO 0.02 0.34 0.12 -0.09 0.09 0.00 0.00 178.44 178.92 1cen h ARG 259 N 0.60 0.43 -0.51 1.13 2.43 -1.08 -2.36 114.38 115.02 1cen h ARG 259 Ca 0.20 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 59.21 1cen h ARG 259 Cb 0.01 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 1cen h ARG 259 CO -0.09 0.36 -0.11 -0.22 -1.51 0.00 0.00 179.97 178.40 1cen h LYS 260 N 0.43 0.97 0.00 0.20 3.64 -0.92 -2.46 116.57 118.43 1cen h LYS 260 Ca 0.11 -0.37 -0.04 0.00 -1.27 0.00 0.00 60.65 59.09 1cen h LYS 260 Cb 0.09 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1cen h LYS 260 CO -0.01 1.04 -0.17 -0.44 -2.27 0.00 0.00 179.45 177.59 1cen h ASP 261 N 0.83 0.00 1.28 4.20 3.32 -1.08 -2.99 116.42 121.98 1cen h ASP 261 Ca 0.13 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.11 1cen h ASP 261 Cb 0.67 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 1cen h ASP 261 CO 0.05 0.17 -0.75 0.25 -1.72 0.00 0.00 179.24 177.24 1cen h LEU 262 N 0.00 0.00 -0.85 1.55 5.85 -1.28 -3.39 115.31 117.20 1cen h LEU 262 Ca -0.00 0.00 0.22 0.00 0.84 0.00 0.00 57.88 58.94 1cen h LEU 262 Cb 0.70 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 41.59 1cen h LEU 262 CO 0.02 0.29 0.19 0.50 -0.34 0.00 0.00 178.44 179.11 1cen h LYS 263 N 0.00 0.19 -1.00 1.25 1.63 -1.29 -1.68 116.57 115.68 1cen h LYS 263 Ca -0.04 -0.01 0.16 0.00 -0.85 0.00 0.00 60.65 59.91 1cen h LYS 263 Cb 1.26 -0.04 -0.09 0.00 -0.60 0.00 0.00 32.23 32.75 1cen h LYS 263 CO 0.03 0.13 0.62 -1.35 -3.45 0.00 0.00 179.45 175.43 1cen h PRO 264 N 0.20 0.82 -0.20 1.90 0.11 -1.78 -0.28 132.00 132.76 1cen h PRO 264 Ca 0.52 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 66.49 1cen h PRO 264 Cb 1.01 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.93 1cen h PRO 264 CO -0.65 0.54 -0.21 0.00 -0.21 0.00 0.00 178.00 177.48 1cen h ALA 265 N 1.60 0.30 -0.83 -0.75 0.00 -1.35 -2.02 119.26 116.21 1cen h ALA 265 Ca 0.54 -0.36 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1cen h ALA 265 Cb 0.74 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1cen h ALA 265 CO -0.32 0.24 0.54 0.82 0.00 0.00 0.00 179.25 180.54 1cen h ILE 266 N 0.18 1.19 -0.39 0.00 1.08 -1.19 -1.77 117.51 116.61 1cen h ILE 266 Ca 0.03 -0.38 -0.09 0.00 -0.39 0.00 0.00 64.86 64.04 1cen h ILE 266 Cb 0.76 -0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.49 1cen h ILE 266 CO 0.05 0.20 -0.09 -0.33 -0.69 0.00 0.00 178.15 177.29 1cen h GLU 267 N 1.10 0.76 -0.95 2.37 5.08 -1.04 -2.48 114.58 119.41 1cen h GLU 267 Ca 0.31 -0.29 0.05 0.00 -1.00 0.00 0.00 59.36 58.43 1cen h GLU 267 Cb -0.09 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.06 1cen h GLU 267 CO -0.08 0.90 0.62 0.35 -1.00 0.00 0.00 179.01 179.79 1cen h PHE 268 N 0.57 1.15 -0.09 4.33 3.57 -1.05 -1.80 116.94 123.61 1cen h PHE 268 Ca 0.10 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.53 1cen h PHE 268 Cb 0.62 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 1cen h PHE 268 CO 0.05 0.64 -0.37 -0.09 -2.23 0.00 0.00 178.31 176.30 1cen h ARG 269 N 1.17 0.19 -0.39 1.11 2.43 -1.18 -1.56 114.38 116.16 1cen h ARG 269 Ca 0.39 -0.08 0.07 0.00 -0.81 0.00 0.00 59.98 59.55 1cen h ARG 269 Cb 0.06 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 29.54 1cen h ARG 269 CO -0.14 0.55 0.01 0.93 -1.51 0.00 0.00 179.97 179.80 1cen h GLU 270 N 0.17 0.11 -0.03 0.20 5.08 -0.86 0.71 114.58 119.95 1cen h GLU 270 Ca 0.02 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 1cen h GLU 270 Cb 0.74 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1cen h GLU 270 CO 0.06 0.07 -0.21 0.87 -1.00 0.00 0.00 179.01 178.80 1cen h LYS 271 N 0.11 0.20 0.00 2.33 1.57 -1.42 -3.33 116.57 116.03 1cen h LYS 271 Ca 0.19 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 1cen h LYS 271 Cb 0.26 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1cen h LYS 271 CO -0.31 0.84 -0.25 0.87 -0.57 0.00 0.00 179.45 180.02 1cen h LYS 272 N -0.38 0.00 -6.21 3.15 1.79 -1.20 -3.47 116.57 110.25 1cen h LYS 272 Ca -0.02 0.00 -0.46 0.00 -2.18 0.00 0.00 60.65 57.99 1cen h LYS 272 Cb 0.88 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.53 1cen h LYS 272 CO 0.04 0.25 -0.74 1.63 -1.08 0.00 0.00 179.45 179.55 1cen n LYS 273 N -3.16 -6.06 -2.44 3.15 5.02 0.25 -4.97 118.16 109.95 1cen n LYS 273 Ca 0.03 0.65 -0.14 0.00 -2.02 0.00 0.00 58.31 56.83 1cen n LYS 273 Cb 0.63 -5.58 0.04 0.00 -0.02 0.00 0.00 35.03 30.10 1cen n LYS 273 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1cen s LYS 275 N -3.69 3.69 0.21 0.00 1.02 -1.26 -4.97 119.74 114.73 1cen s LYS 275 Ca 0.37 -0.18 0.08 0.00 0.02 0.00 0.00 55.97 56.25 1cen s LYS 275 Cb -0.03 -3.25 -0.04 0.00 -0.52 0.00 0.00 37.83 33.99 1cen s LYS 275 CO 0.23 0.60 0.00 -0.51 -0.92 0.00 0.00 175.35 174.75 1cen s LEU 276 N -0.50 3.28 -0.16 3.17 1.43 -1.26 -0.62 118.68 124.02 1cen s LEU 276 Ca 0.12 -0.48 -0.15 0.00 -1.03 0.00 0.00 54.13 52.60 1cen s LEU 276 Cb -0.12 -1.89 0.04 0.00 0.03 0.00 0.00 46.19 44.25 1cen s LEU 276 CO 0.02 0.06 0.42 -0.47 0.23 0.00 0.00 176.35 176.60 1cen s TYR 277 N -1.92 -0.46 -0.47 0.29 5.04 0.87 -3.70 117.35 117.00 1cen s TYR 277 Ca 0.29 1.12 -0.03 0.00 -2.44 0.00 0.00 57.07 56.01 1cen s TYR 277 Cb -0.08 0.16 0.13 0.00 0.35 0.00 0.00 41.96 42.51 1cen s TYR 277 CO 0.19 -0.22 0.27 0.00 -1.34 0.00 0.00 175.55 174.45 1cen h GLY 279 N 7.71 0.00 -5.51 0.00 0.00 -1.79 -0.15 103.07 103.33 1cen h GLY 279 Ca -0.09 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.13 1cen h GLY 279 CO 0.70 0.00 -0.25 -0.54 0.00 0.00 0.00 176.54 176.45 1cen s GLU 280 N -3.42 0.44 -0.20 4.80 2.02 -1.19 -4.27 118.70 116.89 1cen s GLU 280 Ca 0.03 0.80 -0.27 0.00 0.02 0.00 0.00 54.97 55.55 1cen s GLU 280 Cb 0.09 0.04 0.09 0.00 0.10 0.00 0.00 34.13 34.45 1cen s GLU 280 CO 0.45 -0.14 0.80 -0.59 0.02 0.00 0.00 175.26 175.79 1cen s PHE 281 N 1.21 -0.65 0.00 1.61 -0.12 -1.23 -0.81 117.98 117.99 1cen s PHE 281 Ca -0.08 1.41 0.00 0.00 -0.05 0.00 0.00 56.93 58.21 1cen s PHE 281 Cb -0.07 0.35 0.00 0.00 -0.63 0.00 0.00 43.02 42.67 1cen s PHE 281 CO -0.11 -0.41 0.00 0.41 -0.05 0.00 0.00 175.22 175.06 1cen n GLY 282 N 1.88 -0.70 2.92 1.99 0.00 -1.25 -1.08 105.19 108.95 1cen n GLY 282 Ca -0.15 -1.08 -0.21 0.00 0.00 0.00 0.00 46.02 44.58 1cen n GLY 282 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cen s VAL 283 N -2.00 0.67 0.23 1.61 1.01 -1.26 -4.79 120.40 115.87 1cen s VAL 283 Ca 0.00 -0.20 -0.30 0.00 0.00 0.00 0.00 61.98 61.48 1cen s VAL 283 Cb 0.00 -0.67 -0.15 0.00 0.00 0.00 0.00 36.38 35.57 1cen s VAL 283 CO 0.00 0.25 1.11 0.00 0.00 0.00 0.00 175.10 176.46 1cen n ILE 284 N 4.01 1.41 0.28 2.22 3.06 -0.27 -4.75 119.36 125.33 1cen n ILE 284 Ca -0.24 -0.35 0.17 0.00 -2.50 0.00 0.00 62.75 59.83 1cen n ILE 284 Cb 0.51 -0.96 0.86 0.00 0.54 0.00 0.00 39.64 40.59 1cen n ILE 284 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1cen h ALA 285 N 2.79 1.00 -0.00 1.51 0.00 -0.61 -2.75 119.26 121.19 1cen h ALA 285 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1cen h ALA 285 Cb 1.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1cen h ALA 285 CO 0.66 0.00 -0.00 0.44 0.00 0.00 0.00 179.25 180.35 1cen n ILE 286 N -2.73 0.00 -2.42 0.00 -5.35 -1.26 -4.85 119.36 102.74 1cen n ILE 286 Ca -0.01 -0.06 -0.34 0.00 -0.27 0.00 0.00 62.75 62.08 1cen n ILE 286 Cb 0.12 -0.28 -0.02 0.00 -1.74 0.00 0.00 39.64 37.71 1cen n ILE 286 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1cen s ALA 287 N -2.00 2.85 0.31 -1.28 0.00 -1.04 -4.95 121.76 115.65 1cen s ALA 287 Ca 0.46 0.54 -0.29 0.00 0.00 0.00 0.00 51.96 52.66 1cen s ALA 287 Cb 0.22 -3.24 -0.12 0.00 0.00 0.00 0.00 23.12 19.97 1cen s ALA 287 CO 0.36 -0.43 1.44 -0.40 0.00 0.00 0.00 175.76 176.73 1cen n ASP 288 N -1.25 3.25 -0.22 0.00 5.75 -1.26 -4.74 116.55 118.07 1cen n ASP 288 Ca 0.09 1.18 -0.00 0.00 -0.01 0.00 0.00 54.79 56.04 1cen n ASP 288 Cb 0.53 -1.53 0.06 0.00 -1.03 0.00 0.00 41.12 39.16 1cen n ASP 288 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1cen h LEU 289 N 3.63 -0.64 -0.50 -2.12 5.85 -1.92 -1.18 115.31 118.44 1cen h LEU 289 Ca -0.47 0.20 0.05 0.00 0.84 0.00 0.00 57.88 58.50 1cen h LEU 289 Cb 1.26 0.42 -0.05 0.00 0.37 0.00 0.00 40.66 42.65 1cen h LEU 289 CO 0.71 -0.22 0.23 -0.08 -0.34 0.00 0.00 178.44 178.73 1cen h GLU 290 N -0.01 0.43 -0.20 1.25 4.81 -1.97 -0.27 114.58 118.62 1cen h GLU 290 Ca 0.31 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.50 1cen h GLU 290 Cb 0.48 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 1cen h GLU 290 CO -0.67 0.29 0.06 0.77 -0.73 0.00 0.00 179.01 178.72 1cen h SER 291 N 0.45 0.28 -0.57 1.04 0.02 -1.61 -1.33 113.55 111.83 1cen h SER 291 Ca 0.23 -0.20 0.07 0.00 -0.84 0.00 0.00 61.79 61.05 1cen h SER 291 Cb 0.18 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 62.59 1cen h SER 291 CO -0.19 0.41 0.26 -0.09 -1.14 0.00 0.00 176.83 176.08 1cen h ARG 292 N 0.14 0.47 -0.43 3.45 2.43 -0.85 0.19 114.38 119.79 1cen h ARG 292 Ca 0.06 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 1cen h ARG 292 Cb 0.22 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 1cen h ARG 292 CO -0.00 0.31 -0.14 0.82 -1.51 0.00 0.00 179.97 179.46 1cen h ILE 293 N 0.49 1.27 -0.82 1.20 2.04 -0.94 -2.92 117.51 117.84 1cen h ILE 293 Ca 0.27 -1.26 -0.03 0.00 1.00 0.00 0.00 64.86 64.84 1cen h ILE 293 Cb 0.24 1.19 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 1cen h ILE 293 CO -0.22 0.43 0.41 0.50 0.00 0.00 0.00 178.15 179.26 1cen h LYS 294 N 0.68 1.16 -0.01 2.37 3.11 -0.57 -0.96 116.57 122.35 1cen h LYS 294 Ca 0.11 -0.16 -0.00 0.00 -2.81 0.00 0.00 60.65 57.79 1cen h LYS 294 Cb 0.68 -0.22 -0.00 0.00 -1.00 0.00 0.00 32.23 31.69 1cen h LYS 294 CO 0.05 0.88 0.00 2.35 -2.81 0.00 0.00 179.45 179.92 1cen h TRP 295 N 1.16 0.02 -0.89 1.91 7.01 -0.90 -1.69 115.95 122.57 1cen h TRP 295 Ca 0.28 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.29 1cen h TRP 295 Cb 0.09 -0.01 -0.04 0.00 -2.10 0.00 0.00 29.16 27.10 1cen h TRP 295 CO 0.01 0.21 0.57 0.45 -2.79 0.00 0.00 178.44 176.89 1cen h HIS 296 N -0.18 1.14 -0.26 2.65 3.86 -1.31 0.81 115.15 121.87 1cen h HIS 296 Ca 0.00 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1cen h HIS 296 Cb 0.20 -0.38 -0.01 0.00 1.06 0.00 0.00 27.41 28.27 1cen h HIS 296 CO -0.01 0.73 0.13 1.49 0.86 0.00 0.00 177.93 181.14 1cen h GLU 297 N 1.22 0.37 -0.40 2.45 4.81 -1.12 0.28 114.58 122.19 1cen h GLU 297 Ca 0.32 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.47 1cen h GLU 297 Cb -0.11 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.19 1cen h GLU 297 CO -0.07 0.35 0.13 -0.44 -0.73 0.00 0.00 179.01 178.26 1cen h ASP 298 N 0.29 0.59 -0.01 1.04 3.32 -0.83 -1.21 116.42 119.61 1cen h ASP 298 Ca 0.09 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 1cen h ASP 298 Cb 0.10 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 1cen h ASP 298 CO -0.01 0.63 -0.00 0.22 -1.72 0.00 0.00 179.24 178.35 1cen h TYR 299 N 0.51 0.02 -0.90 4.55 3.20 -0.73 -2.66 116.97 120.96 1cen h TYR 299 Ca 0.13 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.10 1cen h TYR 299 Cb 0.25 -0.00 -0.07 0.00 1.54 0.00 0.00 36.73 38.45 1cen h TYR 299 CO 0.01 0.45 0.58 0.82 -1.64 0.00 0.00 178.16 178.38 1cen h ILE 300 N -0.42 0.94 -0.68 1.81 1.08 -0.46 -0.45 117.51 119.34 1cen h ILE 300 Ca 0.00 -0.29 0.05 0.00 -0.39 0.00 0.00 64.86 64.23 1cen h ILE 300 Cb 0.45 0.01 -0.05 0.00 -3.07 0.00 0.00 36.82 34.16 1cen h ILE 300 CO 0.00 0.16 0.40 -1.28 -0.69 0.00 0.00 178.15 176.73 1cen h SER 301 N 0.86 0.61 -0.47 1.72 0.87 -1.08 -0.41 113.55 115.65 1cen h SER 301 Ca 0.42 0.02 -0.11 0.00 -1.23 0.00 0.00 61.79 60.89 1cen h SER 301 Cb 0.47 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 1cen h SER 301 CO -0.19 0.41 -0.15 -0.07 -0.53 0.00 0.00 176.83 176.30 1cen h LEU 302 N 0.75 0.95 -0.96 2.23 3.38 -0.75 -1.09 115.31 119.81 1cen h LEU 302 Ca 0.29 -0.38 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1cen h LEU 302 Cb 0.13 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1cen h LEU 302 CO -0.15 1.11 0.13 -0.07 0.09 0.00 0.00 178.44 179.54 1cen h LEU 303 N 0.78 0.83 -0.23 1.67 3.38 -0.94 -0.61 115.31 120.19 1cen h LEU 303 Ca 0.11 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1cen h LEU 303 Cb 0.72 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1cen h LEU 303 CO 0.05 0.82 0.02 -0.33 0.09 0.00 0.00 178.44 179.09 1cen h GLU 304 N 0.85 0.39 -0.81 1.13 4.39 -0.98 0.16 114.58 119.71 1cen h GLU 304 Ca 0.18 -0.11 0.04 0.00 0.34 0.00 0.00 59.36 59.81 1cen h GLU 304 Cb 0.32 -0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 28.88 1cen h GLU 304 CO 0.00 0.55 0.51 1.49 -1.16 0.00 0.00 179.01 180.40 1cen h GLU 305 N 0.18 0.95 -0.74 2.33 4.81 -0.70 -2.68 114.58 118.73 1cen h GLU 305 Ca 0.07 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1cen h GLU 305 Cb 0.36 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.53 1cen h GLU 305 CO 0.01 0.63 0.00 0.66 -0.73 0.00 0.00 179.01 179.58 1cen n TYR 306 N -4.60 0.99 -3.56 0.92 4.01 -0.28 -4.99 117.16 109.65 1cen n TYR 306 Ca 0.10 -0.49 -0.26 0.00 -0.16 0.00 0.00 57.90 57.09 1cen n TYR 306 Cb 0.11 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.19 1cen n TYR 306 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1cen n ASP 307 N 1.67 -5.22 -4.28 7.72 2.03 -0.15 -5.01 116.55 113.30 1cen n ASP 307 Ca 0.25 -0.91 -0.32 0.00 0.52 0.00 0.00 54.79 54.33 1cen n ASP 307 Cb 0.62 -3.99 -0.16 0.00 -0.72 0.00 0.00 41.12 36.88 1cen n ASP 307 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1cen s ILE 308 N -3.47 2.25 0.46 5.18 1.01 0.37 -4.83 121.20 122.18 1cen s ILE 308 Ca 0.42 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 60.09 1cen s ILE 308 Cb -0.12 -1.85 0.00 0.00 0.01 0.00 0.00 42.46 40.51 1cen s ILE 308 CO 0.82 0.56 0.68 -0.83 0.00 0.00 0.00 174.94 176.18 1cen s GLY 309 N -0.02 1.62 0.07 6.18 0.00 -1.24 -4.53 107.32 109.40 1cen s GLY 309 Ca -0.07 -1.13 -0.16 0.00 0.00 0.00 0.00 44.72 43.36 1cen s GLY 309 CO 0.05 -0.94 0.74 0.61 0.00 0.00 0.00 173.10 173.56 1cen n GLY 310 N -2.11 0.67 2.81 0.20 0.00 -0.23 -0.84 105.19 105.69 1cen n GLY 310 Ca 0.03 -1.04 -0.17 0.00 0.00 0.00 0.00 46.02 44.84 1cen n GLY 310 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cen s ALA 311 N -1.67 -0.08 0.27 4.61 0.00 -0.07 -1.06 121.76 123.75 1cen s ALA 311 Ca 0.17 0.49 -0.29 0.00 0.00 0.00 0.00 51.96 52.32 1cen s ALA 311 Cb -0.01 -0.68 -0.09 0.00 0.00 0.00 0.00 23.12 22.34 1cen s ALA 311 CO 0.02 -0.45 1.04 0.54 0.00 0.00 0.00 175.76 176.91 1cen s VAL 312 N 1.99 3.71 -0.22 0.00 0.11 -1.00 -3.17 120.40 121.83 1cen s VAL 312 Ca 0.01 1.69 -0.13 0.00 -2.93 0.00 0.00 61.98 60.62 1cen s VAL 312 Cb -0.12 -4.06 -0.05 0.00 -1.53 0.00 0.00 36.38 30.62 1cen s VAL 312 CO -0.05 0.38 0.27 0.86 -3.33 0.00 0.00 175.10 173.23 1cen s TRP 313 N -1.21 3.36 0.06 1.54 -0.11 -0.24 -0.99 118.94 121.34 1cen s TRP 313 Ca 0.44 0.42 -0.04 0.00 1.22 0.00 0.00 56.10 58.15 1cen s TRP 313 Cb -0.29 -2.38 -0.02 0.00 -1.50 0.00 0.00 33.47 29.28 1cen s TRP 313 CO 0.37 0.06 0.05 1.21 -4.62 0.00 0.00 176.95 174.02 1cen s ASN 314 N 0.97 0.34 0.06 5.86 2.47 -0.73 -4.48 114.94 119.43 1cen s ASN 314 Ca 0.13 -0.82 -0.26 0.00 0.42 0.00 0.00 52.86 52.33 1cen s ASN 314 Cb -0.14 0.24 -0.12 0.00 -1.45 0.00 0.00 41.25 39.78 1cen s ASN 314 CO 0.06 -0.61 1.40 0.22 -3.72 0.00 0.00 177.10 174.44 1cen h TYR 315 N 3.16 -1.01 -3.51 0.43 3.20 -1.57 -1.76 116.97 115.90 1cen h TYR 315 Ca -0.34 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.39 1cen h TYR 315 Cb 1.17 0.39 -0.21 0.00 1.54 0.00 0.00 36.73 39.62 1cen h TYR 315 CO 0.51 -0.49 -0.50 -1.59 -1.64 0.00 0.00 178.16 174.45 1cen s LYS 316 N -5.03 0.45 3.00 1.82 -2.85 -1.26 -1.05 119.74 114.81 1cen s LYS 316 Ca -0.13 -0.34 0.00 0.00 -1.00 0.00 0.00 55.97 54.50 1cen s LYS 316 Cb 0.03 0.19 0.00 0.00 -2.06 0.00 0.00 37.83 35.99 1cen s LYS 316 CO 0.43 -0.10 0.00 1.63 0.10 0.00 0.00 175.35 177.41 1cen n LYS 317 N 1.62 0.00 -2.10 1.78 4.76 -1.26 -4.85 118.16 118.11 1cen n LYS 317 Ca -0.22 0.00 -0.19 0.00 -2.87 0.00 0.00 58.31 55.03 1cen n LYS 317 Cb 0.56 0.00 -0.04 0.00 -1.84 0.00 0.00 35.03 33.71 1cen n LYS 317 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1cen n MET 318 N 0.00 -1.65 -0.46 1.97 2.81 -1.26 -3.13 117.12 115.40 1cen n MET 318 Ca 0.00 1.02 0.00 0.00 -1.81 0.00 0.00 57.70 56.91 1cen n MET 318 Cb 0.00 -5.57 0.00 0.00 -0.71 0.00 0.00 33.22 26.94 1cen n MET 318 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1cen n ASP 319 N -1.70 0.00 -0.39 7.83 8.00 -1.26 -4.67 116.55 124.36 1cen n ASP 319 Ca -0.22 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.35 1cen n ASP 319 Cb 0.66 -2.35 0.14 0.00 -0.02 0.00 0.00 41.12 39.55 1cen n ASP 319 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1cen n PHE 320 N -2.00 0.00 -1.61 1.24 3.01 -1.20 0.13 117.46 117.02 1cen n PHE 320 Ca 0.00 -1.01 -0.45 0.00 1.01 0.00 0.00 57.45 56.99 1cen n PHE 320 Cb 0.00 -0.17 -0.02 0.00 -0.01 0.00 0.00 39.48 39.28 1cen n PHE 320 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 1cen n GLU 321 N -1.04 1.50 -0.05 -1.08 0.00 -1.18 -1.77 120.64 117.01 1cen n GLU 321 Ca 0.14 0.53 -0.02 0.00 0.00 0.00 0.00 57.16 57.81 1cen n GLU 321 Cb 0.70 -2.00 -0.12 0.00 0.00 0.00 0.00 31.44 30.02 1cen n GLU 321 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 1cen n ILE 322 N 0.81 0.68 -4.35 3.84 2.08 -0.66 -4.84 119.36 116.91 1cen n ILE 322 Ca 0.11 -0.53 -0.26 0.00 0.56 0.00 0.00 62.75 62.63 1cen n ILE 322 Cb 0.31 -0.37 -0.13 0.00 -0.75 0.00 0.00 39.64 38.70 1cen n ILE 322 CO 0.00 0.00 0.00 -0.31 0.56 0.00 0.00 176.55 176.80 1cen s TYR 323 N -2.58 1.96 0.86 1.39 1.51 -0.21 -0.95 117.35 119.32 1cen s TYR 323 Ca -0.07 -0.40 -0.12 0.00 -1.01 0.00 0.00 57.07 55.47 1cen s TYR 323 Cb 0.06 -1.08 0.11 0.00 -0.11 0.00 0.00 41.96 40.94 1cen s TYR 323 CO 0.61 0.24 1.17 -0.80 -1.11 0.00 0.00 175.55 175.66 1cen s ASN 324 N -1.91 4.05 0.45 2.29 0.01 0.75 -4.49 114.94 116.09 1cen s ASN 324 Ca 0.09 0.81 0.31 0.00 -0.71 0.00 0.00 52.86 53.36 1cen s ASN 324 Cb -0.10 -1.31 1.39 0.00 0.41 0.00 0.00 41.25 41.64 1cen s ASN 324 CO 0.05 -2.19 1.92 -0.08 -1.51 0.00 0.00 177.10 175.28 1cen h GLU 325 N -1.26 0.00 -0.78 -0.60 4.22 -1.97 -2.10 114.58 112.09 1cen h GLU 325 Ca -0.47 0.00 -0.05 0.00 0.08 0.00 0.00 59.36 58.92 1cen h GLU 325 Cb 1.33 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.55 1cen h GLU 325 CO 0.63 0.00 0.06 -0.40 -2.18 0.00 0.00 179.01 177.12 1cen n ASP 326 N -2.71 3.84 -1.72 1.04 5.68 -1.26 -4.89 116.55 116.53 1cen n ASP 326 Ca 0.00 -2.64 -0.19 0.00 -0.50 0.00 0.00 54.79 51.46 1cen n ASP 326 Cb 0.21 -0.63 -0.06 0.00 -1.14 0.00 0.00 41.12 39.50 1cen n ASP 326 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1cen n ARG 327 N 0.24 -1.40 -4.22 0.11 1.74 -0.79 -5.00 116.66 107.35 1cen n ARG 327 Ca 0.20 1.09 -0.35 0.00 -0.77 0.00 0.00 57.85 58.02 1cen n ARG 327 Cb 0.89 -5.49 -0.10 0.00 -1.02 0.00 0.00 32.46 26.75 1cen n ARG 327 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1cen s LYS 328 N -4.09 3.43 0.57 5.56 -0.14 -1.26 -4.89 119.74 118.93 1cen s LYS 328 Ca 0.00 -0.38 -0.19 0.00 -1.36 0.00 0.00 55.97 54.04 1cen s LYS 328 Cb 0.00 -2.98 -0.05 0.00 -1.68 0.00 0.00 37.83 33.13 1cen s LYS 328 CO 0.00 0.51 1.18 -1.25 -0.76 0.00 0.00 175.35 175.04 1cen s PRO 329 N -0.34 3.16 0.28 -1.68 0.04 -1.26 -0.18 135.00 135.02 1cen s PRO 329 Ca 0.08 1.76 -0.00 0.00 0.04 0.00 0.00 61.00 62.88 1cen s PRO 329 Cb -0.12 -1.99 0.41 0.00 0.04 0.00 0.00 34.50 32.83 1cen s PRO 329 CO 0.02 -1.04 1.79 0.28 0.04 0.00 0.00 177.00 178.09 1cen h VAL 330 N 1.07 1.23 -2.77 -0.36 2.07 -1.37 -3.43 116.25 112.70 1cen h VAL 330 Ca -0.50 -0.96 -0.16 0.00 0.82 0.00 0.00 66.70 65.90 1cen h VAL 330 Cb 1.28 0.92 -0.29 0.00 -1.52 0.00 0.00 31.29 31.68 1cen h VAL 330 CO 0.56 0.33 -0.42 -0.55 0.02 0.00 0.00 177.57 177.52 1cen s SER 331 N -6.67 -0.18 0.14 0.57 0.15 -1.26 -5.05 113.70 101.40 1cen s SER 331 Ca -0.09 0.75 -0.11 0.00 0.70 0.00 0.00 55.95 57.20 1cen s SER 331 Cb 0.15 0.78 -0.04 0.00 -1.71 0.00 0.00 66.02 65.20 1cen s SER 331 CO 0.80 -0.21 1.49 -0.61 1.20 0.00 0.00 173.24 175.91 1cen h GLN 332 N 7.65 0.94 -0.78 5.44 5.75 -1.96 -2.64 115.11 129.51 1cen h GLN 332 Ca -0.28 -0.48 0.03 0.00 -0.15 0.00 0.00 58.65 57.78 1cen h GLN 332 Cb 1.14 0.01 -0.04 0.00 1.07 0.00 0.00 27.48 29.66 1cen h GLN 332 CO 0.24 1.14 0.52 1.49 -2.65 0.00 0.00 178.83 179.56 1cen h GLU 333 N 0.77 0.94 -0.15 1.69 4.81 -1.99 -0.53 114.58 120.12 1cen h GLU 333 Ca 0.07 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1cen h GLU 333 Cb 0.94 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 1cen h GLU 333 CO 0.09 0.62 0.08 1.25 -0.73 0.00 0.00 179.01 180.32 1cen h LEU 334 N 0.97 0.19 -0.98 1.64 5.85 -1.93 -1.58 115.31 119.46 1cen h LEU 334 Ca 0.31 -0.10 0.01 0.00 0.84 0.00 0.00 57.88 58.94 1cen h LEU 334 Cb 0.03 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1cen h LEU 334 CO -0.09 0.24 0.65 0.58 -0.34 0.00 0.00 178.44 179.48 1cen h VAL 335 N 0.13 1.25 -0.62 1.05 2.07 -0.91 -1.24 116.25 117.99 1cen h VAL 335 Ca 0.05 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 1cen h VAL 335 Cb 0.09 -0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 29.63 1cen h VAL 335 CO -0.01 0.24 0.35 0.78 0.02 0.00 0.00 177.57 178.95 1cen h ASN 336 N 1.33 0.77 -0.63 0.57 2.35 -0.83 -0.79 115.58 118.35 1cen h ASN 336 Ca 0.36 -0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 55.99 1cen h ASN 336 Cb -0.15 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.00 1cen h ASN 336 CO -0.08 0.64 0.26 0.40 -1.65 0.00 0.00 177.43 177.00 1cen h ILE 337 N 0.84 1.23 0.00 2.81 2.04 -0.75 -3.15 117.51 120.53 1cen h ILE 337 Ca 0.22 -0.71 -0.07 0.00 1.00 0.00 0.00 64.86 65.30 1cen h ILE 337 Cb 0.03 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 1cen h ILE 337 CO -0.04 0.28 -0.32 -0.07 0.00 0.00 0.00 178.15 178.01 1cen h LEU 338 N 0.89 0.00 -0.31 1.44 3.38 -0.64 -3.01 115.31 117.05 1cen h LEU 338 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1cen h LEU 338 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1cen h LEU 338 CO -0.02 0.32 -0.12 0.00 0.09 0.00 0.00 178.44 178.71 1cen n ALA 339 N -2.26 2.79 -0.22 1.53 0.00 -0.36 -4.63 120.51 117.36 1cen n ALA 339 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1cen n ALA 339 Cb 0.49 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.64 1cen n ALA 339 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04