#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bry s ASN 8 N 0.00 3.92 0.29 3.42 3.84 -1.26 -5.02 114.94 120.12 2bry s ASN 8 Ca 0.00 -1.53 0.03 0.00 0.21 0.00 0.00 52.86 51.57 2bry s ASN 8 Cb 0.00 -0.90 0.62 0.00 -0.55 0.00 0.00 41.25 40.42 2bry s ASN 8 CO 0.00 -0.39 1.81 -0.65 -2.79 0.00 0.00 177.10 175.09 2bry h PRO 9 N 8.07 0.88 -0.60 0.43 0.11 -1.99 -0.89 132.00 138.02 2bry h PRO 9 Ca -0.14 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.89 2bry h PRO 9 Cb 1.03 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.92 2bry h PRO 9 CO 0.45 0.58 0.27 0.00 -0.21 0.00 0.00 178.00 179.09 2bry h ALA 10 N 1.58 0.78 -0.50 -0.75 0.00 -1.90 -0.15 119.26 118.31 2bry h ALA 10 Ca 0.53 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 55.24 2bry h ALA 10 Cb 0.64 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2bry h ALA 10 CO -0.31 0.36 0.13 0.45 0.00 0.00 0.00 179.25 179.88 2bry h HIS 11 N 0.83 0.84 -0.17 0.00 3.86 -1.79 0.35 115.15 119.07 2bry h HIS 11 Ca 0.20 -0.10 0.02 0.00 -1.16 0.00 0.00 60.37 59.33 2bry h HIS 11 Cb 0.16 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.37 2bry h HIS 11 CO 0.00 0.75 0.05 -0.44 0.86 0.00 0.00 177.93 179.15 2bry h ASP 12 N 0.69 0.04 -0.32 2.45 3.32 -0.78 -0.72 116.42 121.11 2bry h ASP 12 Ca 0.16 0.02 -0.16 0.00 0.02 0.00 0.00 57.03 57.07 2bry h ASP 12 Cb 0.32 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 2bry h ASP 12 CO 0.00 0.05 -0.41 0.45 -1.72 0.00 0.00 179.24 177.61 2bry h HIS 13 N 0.12 1.06 -0.29 4.55 3.86 -0.94 -1.72 115.15 121.80 2bry h HIS 13 Ca 0.07 -0.33 0.02 0.00 -1.16 0.00 0.00 60.37 58.97 2bry h HIS 13 Cb 0.05 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 28.28 2bry h HIS 13 CO -0.12 1.14 0.15 0.35 0.86 0.00 0.00 177.93 180.31 2bry h PHE 14 N 0.72 0.27 -0.65 2.45 3.57 -0.78 -0.57 116.94 121.96 2bry h PHE 14 Ca 0.05 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.53 2bry h PHE 14 Cb 0.99 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.62 2bry h PHE 14 CO 0.06 0.15 0.25 0.93 -2.23 0.00 0.00 178.31 177.48 2bry h GLU 15 N 0.31 0.96 -0.58 1.11 5.08 -0.98 -0.91 114.58 119.56 2bry h GLU 15 Ca 0.12 -0.16 -0.09 0.00 -1.00 0.00 0.00 59.36 58.23 2bry h GLU 15 Cb 0.03 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 2bry h GLU 15 CO -0.07 0.79 0.02 1.79 -1.00 0.00 0.00 179.01 180.53 2bry h THR 16 N 0.94 1.26 -0.06 1.13 1.35 -1.11 -2.77 112.91 113.65 2bry h THR 16 Ca 0.22 -1.11 0.03 0.00 -0.55 0.00 0.00 66.41 64.99 2bry h THR 16 Cb 0.19 0.83 -0.03 0.00 -1.73 0.00 0.00 68.15 67.41 2bry h THR 16 CO -0.02 0.40 -0.09 0.15 -0.25 0.00 0.00 175.52 175.71 2bry h PHE 17 N 0.91 -0.24 -0.61 4.73 3.57 -0.64 -0.17 116.94 124.49 2bry h PHE 17 Ca 0.17 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.77 2bry h PHE 17 Cb 0.53 0.11 -0.07 0.00 2.79 0.00 0.00 35.95 39.31 2bry h PHE 17 CO 0.04 -0.15 0.24 0.28 -2.23 0.00 0.00 178.31 176.49 2bry h VAL 18 N -0.13 0.79 -0.00 1.41 2.07 -1.14 -2.72 116.25 116.52 2bry h VAL 18 Ca 0.06 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2bry h VAL 18 Cb 0.21 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 2bry h VAL 18 CO -0.14 0.08 -0.21 0.00 0.02 0.00 0.00 177.57 177.32 2bry n GLN 19 N -4.98 0.33 -1.79 1.57 10.64 -0.98 -4.76 117.38 117.41 2bry n GLN 19 Ca 0.09 -0.13 -0.41 0.00 -1.83 0.00 0.00 57.00 54.71 2bry n GLN 19 Cb 0.26 -1.50 -0.01 0.00 -0.86 0.00 0.00 30.24 28.13 2bry n GLN 19 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2bry s ALA 20 N -2.76 3.72 -0.44 2.61 0.00 -0.11 -4.90 121.76 119.88 2bry s ALA 20 Ca 0.20 1.57 0.04 0.00 0.00 0.00 0.00 51.96 53.76 2bry s ALA 20 Cb 0.19 -3.64 0.03 0.00 0.00 0.00 0.00 23.12 19.70 2bry s ALA 20 CO 0.56 -0.99 0.64 1.04 0.00 0.00 0.00 175.76 177.01 2bry n GLN 21 N 1.97 -0.29 -4.70 0.00 1.13 -1.26 -4.88 117.38 109.36 2bry n GLN 21 Ca 0.07 -0.77 -0.23 0.00 -1.94 0.00 0.00 57.00 54.13 2bry n GLN 21 Cb 0.38 -1.07 -0.15 0.00 0.11 0.00 0.00 30.24 29.51 2bry n GLN 21 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2bry s LEU 22 N -0.34 2.04 0.22 1.08 1.43 -1.26 -5.05 118.68 116.79 2bry s LEU 22 Ca 0.04 -0.29 -0.09 0.00 -1.03 0.00 0.00 54.13 52.76 2bry s LEU 22 Cb 0.03 -0.78 0.34 0.00 0.03 0.00 0.00 46.19 45.81 2bry s LEU 22 CO 0.04 0.18 1.67 0.00 0.23 0.00 0.00 176.35 178.47 2bry h GLN 24 N 0.15 0.35 -0.02 0.00 5.75 -1.97 -0.90 115.11 118.47 2bry h GLN 24 Ca 0.35 -0.04 -0.22 0.00 -0.15 0.00 0.00 58.65 58.59 2bry h GLN 24 Cb 0.57 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.06 2bry h GLN 24 CO -0.53 0.32 -0.90 -0.44 -2.65 0.00 0.00 178.83 174.63 2bry h ASP 25 N 0.35 0.53 -0.13 -0.69 3.32 -1.67 -1.46 116.42 116.67 2bry h ASP 25 Ca 0.09 -0.41 -0.00 0.00 0.02 0.00 0.00 57.03 56.73 2bry h ASP 25 Cb 0.13 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 2bry h ASP 25 CO -0.00 1.19 0.07 0.58 -1.72 0.00 0.00 179.24 179.36 2bry h VAL 26 N 0.24 1.09 -0.43 -1.35 2.07 -0.45 -1.82 116.25 115.60 2bry h VAL 26 Ca -0.07 -0.25 -0.05 0.00 0.82 0.00 0.00 66.70 67.16 2bry h VAL 26 Cb 1.52 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 32.30 2bry h VAL 26 CO 0.16 0.08 0.08 -0.07 0.02 0.00 0.00 177.57 177.83 2bry h LEU 27 N 0.11 0.68 -0.29 2.57 3.38 -1.13 -1.20 115.31 119.44 2bry h LEU 27 Ca 0.05 -0.26 -0.13 0.00 0.09 0.00 0.00 57.88 57.63 2bry h LEU 27 Cb 0.07 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 2bry h LEU 27 CO -0.01 0.76 -0.32 0.77 0.09 0.00 0.00 178.44 179.74 2bry h SER 28 N 0.57 0.78 -0.53 -0.43 4.64 -1.25 -1.45 113.55 115.88 2bry h SER 28 Ca 0.13 -0.48 -0.06 0.00 -0.47 0.00 0.00 61.79 60.91 2bry h SER 28 Cb 0.37 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.21 2bry h SER 28 CO 0.01 1.11 0.12 0.77 -0.87 0.00 0.00 176.83 177.96 2bry h SER 29 N 0.47 0.86 -0.64 4.97 4.64 -1.33 -1.76 113.55 120.76 2bry h SER 29 Ca 0.04 -0.17 -0.04 0.00 -0.47 0.00 0.00 61.79 61.15 2bry h SER 29 Cb 0.90 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.74 2bry h SER 29 CO 0.08 0.85 0.23 0.15 -0.87 0.00 0.00 176.83 177.27 2bry h PHE 30 N 0.87 1.00 -0.73 4.77 3.57 -1.04 0.45 116.94 125.82 2bry h PHE 30 Ca 0.18 -0.09 -0.04 0.00 3.53 0.00 0.00 57.97 61.56 2bry h PHE 30 Cb 0.34 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 38.76 2bry h PHE 30 CO 0.02 0.80 0.32 1.96 -2.23 0.00 0.00 178.31 179.18 2bry h GLN 31 N 0.91 1.08 -0.87 1.11 1.08 -1.03 0.52 115.11 117.92 2bry h GLN 31 Ca 0.21 -0.18 -0.02 0.00 -1.45 0.00 0.00 58.65 57.21 2bry h GLN 31 Cb 0.25 -0.18 -0.04 0.00 -0.05 0.00 0.00 27.48 27.46 2bry h GLN 31 CO -0.01 0.87 0.46 0.78 -0.95 0.00 0.00 178.83 179.99 2bry h GLY 32 N 1.05 1.30 0.94 3.46 0.00 -1.01 -0.06 103.07 108.75 2bry h GLY 32 Ca 0.25 -0.60 -0.03 0.00 0.00 0.00 0.00 47.33 46.96 2bry h GLY 32 CO -0.02 0.57 0.15 -2.00 0.00 0.00 0.00 176.54 175.24 2bry h LEU 33 N 1.21 0.56 -0.25 3.11 5.85 -0.25 -1.68 115.31 123.86 2bry h LEU 33 Ca 0.30 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 2bry h LEU 33 Cb 0.04 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 2bry h LEU 33 CO -0.05 0.59 0.14 0.00 -0.34 0.00 0.00 178.44 178.78 2bry h ARG 35 N 0.30 0.31 0.00 0.00 3.08 -0.91 -0.94 114.38 116.22 2bry h ARG 35 Ca 0.09 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 2bry h ARG 35 Cb 0.06 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2bry h ARG 35 CO -0.01 0.21 -0.28 0.00 -1.07 0.00 0.00 179.97 178.81 2bry h ALA 36 N 1.41 1.52 -0.14 0.04 0.00 -0.63 -3.05 119.26 118.42 2bry h ALA 36 Ca 0.29 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2bry h ALA 36 Cb 0.37 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2bry h ALA 36 CO -0.33 0.36 0.00 1.28 0.00 0.00 0.00 179.25 180.56 2bry n LEU 37 N -4.19 2.88 -0.50 0.00 4.77 -0.73 -4.84 117.00 114.41 2bry n LEU 37 Ca -0.02 -1.18 -0.05 0.00 -0.03 0.00 0.00 56.01 54.73 2bry n LEU 37 Cb 0.33 -0.08 -0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2bry n LEU 37 CO 0.38 0.55 -0.06 0.61 -1.33 0.00 0.00 177.39 177.54 2bry n GLY 38 N 1.19 0.24 3.26 -0.72 0.00 -0.48 -4.94 105.19 103.74 2bry n GLY 38 Ca 0.14 -0.72 -0.27 0.00 0.00 0.00 0.00 46.02 45.17 2bry n GLY 38 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2bry n VAL 39 N -3.89 0.00 -4.32 1.61 0.24 -0.51 -5.05 118.33 106.42 2bry n VAL 39 Ca -0.05 -2.22 -0.25 0.00 -2.04 0.00 0.00 64.34 59.79 2bry n VAL 39 Cb 0.50 0.60 -0.12 0.00 -1.47 0.00 0.00 33.84 33.35 2bry n VAL 39 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2bry s GLU 40 N -3.59 1.21 0.68 7.34 0.41 -1.26 -4.37 118.70 119.13 2bry s GLU 40 Ca 0.09 -1.25 -0.12 0.00 -0.41 0.00 0.00 54.97 53.28 2bry s GLU 40 Cb 0.00 -1.48 0.01 0.00 -1.78 0.00 0.00 34.13 30.88 2bry s GLU 40 CO 0.06 0.34 1.07 -1.54 -0.49 0.00 0.00 175.26 174.70 2bry s SER 41 N -2.08 5.30 -1.15 -0.19 1.04 -1.26 -3.97 113.70 111.38 2bry s SER 41 Ca 0.10 1.72 0.00 0.00 0.48 0.00 0.00 55.95 58.25 2bry s SER 41 Cb -0.09 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.52 2bry s SER 41 CO 0.05 -1.50 0.00 0.61 0.98 0.00 0.00 173.24 173.38 2bry n GLY 42 N -1.54 0.42 0.65 7.32 0.00 -1.25 -4.91 105.19 105.89 2bry n GLY 42 Ca 0.08 -0.40 0.07 0.00 0.00 0.00 0.00 46.02 45.77 2bry n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bry n GLY 43 N -1.19 3.62 7.00 -0.02 0.00 -1.04 -4.44 105.19 109.12 2bry n GLY 43 Ca -0.14 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.14 2bry n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bry n GLY 44 N -0.27 -1.90 0.27 -0.02 0.00 -0.59 -3.89 105.19 98.79 2bry n GLY 44 Ca 0.16 -1.36 0.16 0.00 0.00 0.00 0.00 46.02 44.98 2bry n GLY 44 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2bry h LEU 45 N 0.00 0.00 -0.91 0.99 3.38 -1.88 -2.35 115.31 114.55 2bry h LEU 45 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 2bry h LEU 45 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2bry h LEU 45 CO 0.00 0.04 0.07 0.77 0.09 0.00 0.00 178.44 179.41 2bry h SER 46 N 0.00 0.83 -0.26 -0.43 4.64 -1.93 -0.28 113.55 116.12 2bry h SER 46 Ca -0.00 -0.18 -0.16 0.00 -0.47 0.00 0.00 61.79 60.98 2bry h SER 46 Cb 0.50 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2bry h SER 46 CO 0.01 0.85 -0.47 1.56 -0.87 0.00 0.00 176.83 177.91 2bry h GLN 47 N 0.83 0.77 -0.66 4.77 1.08 -1.54 -2.53 115.11 117.83 2bry h GLN 47 Ca 0.17 -0.49 0.12 0.00 -1.45 0.00 0.00 58.65 57.00 2bry h GLN 47 Cb 0.40 0.06 -0.09 0.00 -0.05 0.00 0.00 27.48 27.79 2bry h GLN 47 CO 0.01 1.12 0.20 -0.92 -0.95 0.00 0.00 178.83 178.29 2bry h TYR 48 N 0.52 0.34 -0.77 2.96 3.20 -1.33 0.37 116.97 122.25 2bry h TYR 48 Ca 0.01 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.88 2bry h TYR 48 Cb 1.08 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 39.26 2bry h TYR 48 CO 0.08 0.02 0.32 0.45 -1.64 0.00 0.00 178.16 177.38 2bry h HIS 49 N 0.34 1.15 -0.09 -3.82 3.86 -0.89 -1.10 115.15 114.61 2bry h HIS 49 Ca 0.35 -0.08 -0.18 0.00 -1.16 0.00 0.00 60.37 59.30 2bry h HIS 49 Cb 0.52 -0.35 -0.00 0.00 1.06 0.00 0.00 27.41 28.64 2bry h HIS 49 CO -0.21 0.87 -0.71 0.87 0.86 0.00 0.00 177.93 179.61 2bry h LYS 50 N 1.11 0.42 0.11 2.45 1.57 -0.96 -2.18 116.57 119.10 2bry h LYS 50 Ca 0.26 -0.33 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2bry h LYS 50 Cb 0.19 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.57 2bry h LYS 50 CO -0.02 0.96 -0.05 0.82 -0.57 0.00 0.00 179.45 180.59 2bry h ILE 51 N 0.29 1.05 -0.16 1.86 2.04 -0.66 -3.09 117.51 118.83 2bry h ILE 51 Ca -0.03 -0.63 -0.10 0.00 1.00 0.00 0.00 64.86 65.11 2bry h ILE 51 Cb 1.28 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 38.79 2bry h ILE 51 CO 0.12 0.15 -0.32 0.07 0.00 0.00 0.00 178.15 178.17 2bry h LYS 52 N -0.44 0.33 -0.01 2.37 2.10 -1.21 -2.15 116.57 117.56 2bry h LYS 52 Ca -0.01 -0.13 -0.04 0.00 -2.00 0.00 0.00 60.65 58.46 2bry h LYS 52 Cb 0.36 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.67 2bry h LYS 52 CO 0.02 0.62 -0.18 0.00 -2.00 0.00 0.00 179.45 177.92 2bry h ALA 53 N 1.38 1.69 -0.02 0.07 0.00 -1.43 -2.22 119.26 118.74 2bry h ALA 53 Ca 0.04 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2bry h ALA 53 Cb 0.72 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2bry h ALA 53 CO 0.05 0.23 -0.12 1.04 0.00 0.00 0.00 179.25 180.45 2bry n GLN 54 N -4.32 1.51 -2.40 0.00 6.02 -0.84 -4.28 117.38 113.07 2bry n GLN 54 Ca -0.02 -1.02 -0.19 0.00 -0.01 0.00 0.00 57.00 55.75 2bry n GLN 54 Cb 0.24 -1.48 0.02 0.00 1.02 0.00 0.00 30.24 30.04 2bry n GLN 54 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2bry n LEU 55 N 0.15 3.84 -4.35 1.08 4.77 -0.83 -4.94 117.00 116.72 2bry n LEU 55 Ca 0.15 -4.52 -0.43 0.00 -0.03 0.00 0.00 56.01 51.18 2bry n LEU 55 Cb 0.41 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 2bry n LEU 55 CO 0.20 1.92 1.96 -3.20 -1.33 0.00 0.00 177.39 176.94 2bry n ASN 56 N -0.51 4.84 -3.64 -1.43 5.15 -1.24 -4.26 115.26 114.17 2bry n ASN 56 Ca 0.32 -2.94 -0.10 0.00 -0.60 0.00 0.00 54.58 51.26 2bry n ASN 56 Cb 0.81 -1.67 -0.04 0.00 -0.53 0.00 0.00 39.78 38.36 2bry n ASN 56 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 2bry s TYR 57 N 3.09 0.45 0.30 1.20 -0.85 -1.26 -4.98 117.35 115.30 2bry s TYR 57 Ca 0.49 -0.84 0.06 0.00 -0.52 0.00 0.00 57.07 56.26 2bry s TYR 57 Cb 0.05 0.27 0.79 0.00 0.38 0.00 0.00 41.96 43.44 2bry s TYR 57 CO 0.03 -1.14 1.70 0.11 -1.52 0.00 0.00 175.55 174.73 2bry h TRP 58 N 2.16 0.77 0.00 -3.49 5.08 -2.02 -1.12 115.95 117.33 2bry h TRP 58 Ca -0.27 0.04 -0.09 0.00 1.08 0.00 0.00 58.89 59.65 2bry h TRP 58 Cb 1.25 -0.19 -0.01 0.00 -3.00 0.00 0.00 29.16 27.20 2bry h TRP 58 CO 0.82 -0.02 -0.43 1.03 -1.28 0.00 0.00 178.44 178.55 2bry h SER 59 N 0.45 0.00 0.00 0.11 0.87 -1.97 -3.38 113.55 109.63 2bry h SER 59 Ca 0.59 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 61.15 2bry h SER 59 Cb 1.14 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.10 2bry h SER 59 CO -0.52 0.43 -1.08 0.00 -0.53 0.00 0.00 176.83 175.14 2bry n ALA 60 N -2.27 2.05 -0.22 6.23 0.00 -0.65 -4.80 120.51 120.85 2bry n ALA 60 Ca 0.01 -0.05 0.02 0.00 0.00 0.00 0.00 53.44 53.42 2bry n ALA 60 Cb 0.60 -0.01 0.12 0.00 0.00 0.00 0.00 19.45 20.15 2bry n ALA 60 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2bry h LYS 61 N 0.00 0.13 -0.18 0.00 3.64 -1.42 -1.28 116.57 117.45 2bry h LYS 61 Ca -0.01 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.28 2bry h LYS 61 Cb 0.23 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2bry h LYS 61 CO 0.00 0.09 -0.25 0.66 -2.27 0.00 0.00 179.45 177.68 2bry h SER 62 N 0.14 0.34 -0.28 4.20 4.64 -1.86 -2.54 113.55 118.19 2bry h SER 62 Ca 0.34 -0.11 -0.04 0.00 -0.47 0.00 0.00 61.79 61.51 2bry h SER 62 Cb 0.56 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 2bry h SER 62 CO -0.54 0.59 -0.00 0.25 -0.87 0.00 0.00 176.83 176.26 2bry h LEU 63 N 0.30 0.48 -1.01 5.97 5.85 -1.57 -2.40 115.31 122.94 2bry h LEU 63 Ca 0.05 -0.31 -0.04 0.00 0.84 0.00 0.00 57.88 58.41 2bry h LEU 63 Cb 0.61 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 2bry h LEU 63 CO 0.04 0.67 0.21 -0.50 -0.34 0.00 0.00 178.44 178.53 2bry h TRP 64 N 0.27 0.94 -0.35 1.25 -0.00 -1.31 -0.11 115.95 116.64 2bry h TRP 64 Ca 0.08 -0.07 0.05 0.00 -0.00 0.00 0.00 58.89 58.95 2bry h TRP 64 Cb 0.43 -0.28 -0.05 0.00 -0.00 0.00 0.00 29.16 29.26 2bry h TRP 64 CO 0.04 0.74 0.08 0.00 -0.00 0.00 0.00 178.44 179.30 2bry h ALA 65 N 1.33 0.38 0.27 1.49 0.00 -1.30 0.10 119.26 121.53 2bry h ALA 65 Ca 0.21 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2bry h ALA 65 Cb 0.23 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2bry h ALA 65 CO -0.01 -0.33 -0.13 0.87 0.00 0.00 0.00 179.25 179.65 2bry h LYS 66 N 0.20 -0.35 -0.89 0.00 1.57 -0.89 -2.00 116.57 114.21 2bry h LYS 66 Ca 0.16 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.95 2bry h LYS 66 Cb 0.18 0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 2bry h LYS 66 CO -0.21 -0.10 0.47 -0.07 -0.57 0.00 0.00 179.45 178.97 2bry h LEU 67 N -0.56 1.13 -0.97 2.94 3.38 -0.90 -2.18 115.31 118.16 2bry h LEU 67 Ca -0.04 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 2bry h LEU 67 Cb 0.41 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2bry h LEU 67 CO 0.06 0.92 -0.29 0.44 0.09 0.00 0.00 178.44 179.66 2bry h ASP 68 N 1.26 0.40 -0.05 -0.43 3.32 -0.82 -0.07 116.42 120.02 2bry h ASP 68 Ca 0.31 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 2bry h ASP 68 Cb 0.05 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.49 2bry h ASP 68 CO -0.05 0.69 0.03 0.50 -1.72 0.00 0.00 179.24 178.68 2bry h LYS 69 N 0.35 0.07 -0.38 3.56 3.64 -0.84 -1.34 116.57 121.62 2bry h LYS 69 Ca 0.05 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2bry h LYS 69 Cb 0.70 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.48 2bry h LYS 69 CO 0.05 0.13 0.23 -0.09 -2.27 0.00 0.00 179.45 177.50 2bry h ARG 70 N -0.01 0.53 0.00 1.90 2.43 -1.19 -2.97 114.38 115.05 2bry h ARG 70 Ca 0.02 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 2bry h ARG 70 Cb 0.08 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.52 2bry h ARG 70 CO -0.00 0.40 -0.08 0.00 -1.51 0.00 0.00 179.97 178.79 2bry h ALA 71 N 1.09 1.62 -0.00 2.80 0.00 -0.78 -1.63 119.26 122.36 2bry h ALA 71 Ca 0.14 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2bry h ALA 71 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2bry h ALA 71 CO -0.02 0.10 -0.03 0.43 0.00 0.00 0.00 179.25 179.72 2bry n SER 72 N -4.08 0.15 -4.77 0.00 7.64 -0.53 -4.49 113.62 107.55 2bry n SER 72 Ca -0.03 -0.40 -0.41 0.00 1.01 0.00 0.00 58.87 59.05 2bry n SER 72 Cb 0.16 -0.18 -0.01 0.00 -1.01 0.00 0.00 64.21 63.17 2bry n SER 72 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2bry s GLN 73 N -2.46 4.19 0.42 1.43 -0.21 -0.61 -4.87 119.66 117.53 2bry s GLN 73 Ca 0.31 2.46 0.16 0.00 0.02 0.00 0.00 55.36 58.32 2bry s GLN 73 Cb 0.20 -3.02 1.06 0.00 1.00 0.00 0.00 33.01 32.25 2bry s GLN 73 CO 0.45 -0.47 1.87 -1.35 -2.12 0.00 0.00 175.29 173.68 2bry h PRO 74 N 3.81 0.42 -0.47 2.91 0.11 -1.90 -1.99 132.00 134.88 2bry h PRO 74 Ca -0.49 -0.03 0.14 0.00 0.11 0.00 0.00 66.00 65.73 2bry h PRO 74 Cb 1.23 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 2bry h PRO 74 CO 0.70 0.28 0.35 -0.24 -0.21 0.00 0.00 178.00 178.87 2bry h VAL 75 N 0.43 0.74 0.00 3.15 3.04 -1.95 -1.49 116.25 120.16 2bry h VAL 75 Ca 0.44 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.13 2bry h VAL 75 Cb 1.06 0.76 0.00 0.00 -2.01 0.00 0.00 31.29 31.09 2bry h VAL 75 CO -0.16 0.00 -0.21 -1.22 -1.01 0.00 0.00 177.57 174.96 2bry n TYR 76 N -4.36 0.69 -3.92 3.17 4.01 -0.75 -4.86 117.16 111.14 2bry n TYR 76 Ca 0.08 0.20 -0.30 0.00 -0.16 0.00 0.00 57.90 57.73 2bry n TYR 76 Cb 0.56 -0.78 0.02 0.00 -0.31 0.00 0.00 39.34 38.83 2bry n TYR 76 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2bry n GLN 77 N -2.11 -5.19 -3.15 -0.72 6.02 -0.56 -1.46 117.38 110.20 2bry n GLN 77 Ca 0.05 0.57 -0.21 0.00 -0.01 0.00 0.00 57.00 57.40 2bry n GLN 77 Cb 0.42 -5.39 0.05 0.00 1.02 0.00 0.00 30.24 26.34 2bry n GLN 77 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2bry n GLN 78 N -4.61 -5.53 -0.96 -1.09 3.00 -1.26 -1.35 117.38 105.58 2bry n GLN 78 Ca -0.00 0.81 0.00 0.00 -0.01 0.00 0.00 57.00 57.80 2bry n GLN 78 Cb 0.54 -5.57 0.00 0.00 0.00 0.00 0.00 30.24 25.21 2bry n GLN 78 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2bry n GLY 79 N -1.62 0.49 0.58 1.08 0.00 -0.54 -4.92 105.19 100.26 2bry n GLY 79 Ca -0.06 -0.25 0.08 0.00 0.00 0.00 0.00 46.02 45.78 2bry n GLY 79 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2bry n GLN 80 N -2.96 1.32 -0.07 1.61 1.13 -0.46 -3.89 117.38 114.06 2bry n GLN 80 Ca 0.00 -1.31 -0.06 0.00 -1.94 0.00 0.00 57.00 53.69 2bry n GLN 80 Cb 0.00 -1.29 0.13 0.00 0.11 0.00 0.00 30.24 29.19 2bry n GLN 80 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2bry h ALA 81 N 3.02 0.98 -0.04 -1.58 0.00 -1.20 -3.25 119.26 117.19 2bry h ALA 81 Ca 0.00 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 2bry h ALA 81 Cb 0.63 -0.16 -0.17 0.00 0.00 0.00 0.00 17.79 18.10 2bry h ALA 81 CO 0.00 0.60 -0.72 0.00 0.00 0.00 0.00 179.25 179.13 2bry h THR 83 N 3.32 0.07 -0.54 0.00 1.03 -1.64 0.27 112.91 115.41 2bry h THR 83 Ca -0.07 -0.12 0.00 0.00 -0.01 0.00 0.00 66.41 66.20 2bry h THR 83 Cb 1.35 1.11 0.00 0.00 -1.07 0.00 0.00 68.15 69.54 2bry h THR 83 CO 0.07 0.01 0.00 0.59 -0.01 0.00 0.00 175.52 176.17 2bry n ASN 84 N -3.16 4.07 -4.81 0.00 5.03 -1.26 -4.78 115.26 110.34 2bry n ASN 84 Ca -0.02 -2.33 -0.37 0.00 0.87 0.00 0.00 54.58 52.73 2bry n ASN 84 Cb 0.12 -0.47 -0.06 0.00 -1.02 0.00 0.00 39.78 38.34 2bry n ASN 84 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2bry s THR 85 N -1.61 5.30 -0.12 3.41 2.01 0.08 -5.04 115.64 119.66 2bry s THR 85 Ca 0.43 0.50 0.03 0.00 0.31 0.00 0.00 61.69 62.96 2bry s THR 85 Cb 0.27 -3.57 -0.00 0.00 0.01 0.00 0.00 72.50 69.21 2bry s THR 85 CO 0.22 0.52 -0.21 -0.54 -0.69 0.00 0.00 174.62 173.92 2bry s LYS 86 N -0.49 3.10 0.09 4.92 1.02 -1.26 -1.07 119.74 126.06 2bry s LYS 86 Ca 0.18 -0.84 0.09 0.00 0.02 0.00 0.00 55.97 55.42 2bry s LYS 86 Cb -0.14 -2.40 -0.03 0.00 -0.52 0.00 0.00 37.83 34.74 2bry s LYS 86 CO 0.06 0.13 -0.23 0.00 -0.92 0.00 0.00 175.35 174.40 2bry s LEU 88 N -1.75 1.71 -0.13 0.00 2.96 0.00 -2.20 118.68 119.27 2bry s LEU 88 Ca 0.09 -0.43 -0.04 0.00 -0.22 0.00 0.00 54.13 53.52 2bry s LEU 88 Cb -0.10 -1.10 -0.04 0.00 0.50 0.00 0.00 46.19 45.46 2bry s LEU 88 CO 0.04 0.00 0.03 -0.69 -1.32 0.00 0.00 176.35 174.42 2bry s VAL 89 N 1.07 4.56 -0.27 1.68 1.01 0.79 -0.87 120.40 128.37 2bry s VAL 89 Ca -0.05 -0.14 -0.06 0.00 0.00 0.00 0.00 61.98 61.74 2bry s VAL 89 Cb -0.15 -2.98 -0.00 0.00 0.00 0.00 0.00 36.38 33.26 2bry s VAL 89 CO -0.03 0.55 0.04 -0.69 0.00 0.00 0.00 175.10 174.97 2bry s VAL 90 N -0.37 3.81 0.00 2.92 1.01 0.27 -0.87 120.40 127.18 2bry s VAL 90 Ca 0.08 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.49 2bry s VAL 90 Cb -0.12 -2.88 0.00 0.00 0.00 0.00 0.00 36.38 33.38 2bry s VAL 90 CO 0.02 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.95 2bry n GLY 91 N 4.85 2.15 2.17 4.51 0.00 0.10 -0.28 105.19 118.70 2bry n GLY 91 Ca -0.16 -1.28 -0.28 0.00 0.00 0.00 0.00 46.02 44.31 2bry n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bry n ALA 92 N 2.16 5.83 -1.30 4.61 0.00 -1.26 -4.04 120.51 126.52 2bry n ALA 92 Ca 0.00 -3.29 -0.30 0.00 0.00 0.00 0.00 53.44 49.85 2bry n ALA 92 Cb 0.00 -1.47 0.23 0.00 0.00 0.00 0.00 19.45 18.21 2bry n ALA 92 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2bry s GLY 93 N -1.86 1.64 0.25 0.00 0.00 -1.26 -4.73 107.32 101.36 2bry s GLY 93 Ca 0.60 -1.06 -0.03 0.00 0.00 0.00 0.00 44.72 44.22 2bry s GLY 93 CO 0.03 -0.18 1.77 -2.55 0.00 0.00 0.00 173.10 172.17 2bry h PRO 94 N -2.39 0.63 -0.14 2.90 0.11 -1.92 -1.40 132.00 129.78 2bry h PRO 94 Ca -0.44 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.53 2bry h PRO 94 Cb 1.27 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2bry h PRO 94 CO 0.33 0.41 -0.33 0.00 -0.21 0.00 0.00 178.00 178.21 2bry h GLY 96 N 0.07 0.82 0.86 0.00 0.00 -1.70 -0.82 103.07 102.29 2bry h GLY 96 Ca -0.00 -0.47 -0.06 0.00 0.00 0.00 0.00 47.33 46.80 2bry h GLY 96 CO 0.07 0.44 -0.07 1.41 0.00 0.00 0.00 176.54 178.39 2bry h LEU 97 N 0.74 0.51 -0.53 3.11 3.38 -1.22 -0.10 115.31 121.19 2bry h LEU 97 Ca 0.16 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.78 2bry h LEU 97 Cb 0.29 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2bry h LEU 97 CO -0.00 0.76 0.34 -0.09 0.09 0.00 0.00 178.44 179.54 2bry h ARG 98 N 0.25 0.67 -0.86 1.13 9.65 -0.90 -1.22 114.38 123.10 2bry h ARG 98 Ca 0.06 -0.04 0.08 0.00 -1.10 0.00 0.00 59.98 58.98 2bry h ARG 98 Cb 0.55 -0.15 -0.07 0.00 -1.39 0.00 0.00 29.97 28.91 2bry h ARG 98 CO 0.03 0.44 0.52 0.00 2.80 0.00 0.00 179.97 183.76 2bry h ALA 99 N 1.21 1.21 -0.34 2.80 0.00 -0.94 -2.64 119.26 120.56 2bry h ALA 99 Ca 0.20 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.98 2bry h ALA 99 Cb -0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2bry h ALA 99 CO -0.06 0.21 -0.36 0.00 0.00 0.00 0.00 179.25 179.04 2bry h ALA 100 N 1.43 0.73 -0.97 0.00 0.00 -0.53 -0.81 119.26 119.10 2bry h ALA 100 Ca 0.39 -0.43 0.06 0.00 0.00 0.00 0.00 54.91 54.93 2bry h ALA 100 Cb 0.26 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 2bry h ALA 100 CO -0.21 0.66 0.63 0.28 0.00 0.00 0.00 179.25 180.61 2bry h VAL 101 N 0.65 1.08 -0.10 0.00 2.07 -1.10 0.15 116.25 119.00 2bry h VAL 101 Ca 0.06 -0.39 -0.09 0.00 0.82 0.00 0.00 66.70 67.11 2bry h VAL 101 Cb 0.91 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2bry h VAL 101 CO 0.08 0.21 -0.28 -0.33 0.02 0.00 0.00 177.57 177.27 2bry h GLU 102 N 1.13 0.37 -0.97 1.57 4.39 -0.83 -1.41 114.58 118.83 2bry h GLU 102 Ca 0.42 -0.26 0.10 0.00 0.34 0.00 0.00 59.36 59.96 2bry h GLU 102 Cb 0.17 0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 28.79 2bry h GLU 102 CO -0.16 0.88 0.62 -0.07 -1.16 0.00 0.00 179.01 179.12 2bry h LEU 103 N -0.07 0.92 -0.40 1.33 3.38 -1.05 -1.46 115.31 117.95 2bry h LEU 103 Ca -0.01 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 2bry h LEU 103 Cb 0.89 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 2bry h LEU 103 CO 0.06 0.53 0.14 0.00 0.09 0.00 0.00 178.44 179.26 2bry h ALA 104 N 1.52 0.53 -0.10 1.53 0.00 -0.50 -2.16 119.26 120.08 2bry h ALA 104 Ca 0.46 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 2bry h ALA 104 Cb 0.39 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2bry h ALA 104 CO -0.21 0.16 -0.10 -0.07 0.00 0.00 0.00 179.25 179.02 2bry h LEU 105 N 0.51 0.14 0.00 0.00 3.38 -0.83 -1.77 115.31 116.74 2bry h LEU 105 Ca 0.13 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2bry h LEU 105 Cb 0.24 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2bry h LEU 105 CO -0.01 0.26 0.00 0.18 0.09 0.00 0.00 178.44 178.97 2bry n LEU 106 N -4.34 0.00 0.00 1.67 4.77 -0.59 -3.99 117.00 114.53 2bry n LEU 106 Ca -0.01 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 2bry n LEU 106 Cb 0.22 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 2bry n LEU 106 CO 0.37 -0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.87 2bry n GLY 107 N 0.48 0.79 3.81 -0.72 0.00 -0.66 -0.59 105.19 108.30 2bry n GLY 107 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 2bry n GLY 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bry s ALA 108 N -2.08 2.63 -0.15 4.61 0.00 -0.84 -3.74 121.76 122.19 2bry s ALA 108 Ca 0.00 0.14 -0.27 0.00 0.00 0.00 0.00 51.96 51.83 2bry s ALA 108 Cb 0.00 -3.19 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 2bry s ALA 108 CO 0.00 -1.26 0.92 0.50 0.00 0.00 0.00 175.76 175.91 2bry s ARG 109 N -4.94 4.34 -0.20 0.00 6.06 -0.23 -4.61 118.95 119.37 2bry s ARG 109 Ca 0.59 1.19 0.01 0.00 -2.50 0.00 0.00 55.73 55.02 2bry s ARG 109 Cb -0.15 -3.57 0.04 0.00 0.06 0.00 0.00 34.95 31.34 2bry s ARG 109 CO 0.53 -0.35 -0.12 0.08 -2.50 0.00 0.00 175.30 172.94 2bry s VAL 110 N 2.19 1.76 -0.02 7.11 1.01 -1.26 -0.73 120.40 130.46 2bry s VAL 110 Ca 0.43 -1.03 0.04 0.00 0.00 0.00 0.00 61.98 61.41 2bry s VAL 110 Cb -0.17 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.40 2bry s VAL 110 CO 0.14 0.23 -0.12 -0.69 0.00 0.00 0.00 175.10 174.67 2bry s VAL 111 N 1.35 3.29 -0.03 2.92 1.01 -0.94 -1.00 120.40 127.01 2bry s VAL 111 Ca -0.01 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.21 2bry s VAL 111 Cb -0.16 -2.36 0.01 0.00 0.00 0.00 0.00 36.38 33.88 2bry s VAL 111 CO -0.09 0.49 -0.06 -0.22 0.00 0.00 0.00 175.10 175.22 2bry s LEU 112 N -1.08 1.56 -0.09 3.92 0.20 0.38 -0.15 118.68 123.42 2bry s LEU 112 Ca 0.14 -0.14 0.01 0.00 0.69 0.00 0.00 54.13 54.83 2bry s LEU 112 Cb -0.11 -0.44 -0.02 0.00 -0.43 0.00 0.00 46.19 45.18 2bry s LEU 112 CO 0.04 -0.00 -0.10 0.68 -0.29 0.00 0.00 176.35 176.67 2bry s VAL 113 N 0.56 3.38 -0.04 1.68 -7.23 -0.05 -0.35 120.40 118.34 2bry s VAL 113 Ca -0.08 -0.58 0.01 0.00 -1.81 0.00 0.00 61.98 59.53 2bry s VAL 113 Cb -0.11 -2.39 0.02 0.00 0.56 0.00 0.00 36.38 34.46 2bry s VAL 113 CO 0.00 0.57 -0.06 -0.70 -0.31 0.00 0.00 175.10 174.59 2bry s GLU 114 N -0.37 0.99 0.37 4.82 2.56 0.21 -0.72 118.70 126.56 2bry s GLU 114 Ca 0.05 -0.19 0.20 0.00 0.00 0.00 0.00 54.97 55.03 2bry s GLU 114 Cb -0.12 -0.93 0.51 0.00 2.00 0.00 0.00 34.13 35.58 2bry s GLU 114 CO 0.02 -0.03 1.65 1.57 -0.56 0.00 0.00 175.26 177.91 2bry h LYS 115 N 7.01 0.00 -7.06 4.30 2.10 -1.79 0.10 116.57 121.23 2bry h LYS 115 Ca -0.36 0.00 -0.47 0.00 -2.00 0.00 0.00 60.65 57.81 2bry h LYS 115 Cb 1.16 0.00 0.08 0.00 -0.90 0.00 0.00 32.23 32.57 2bry h LYS 115 CO 0.48 0.34 0.09 1.03 -2.00 0.00 0.00 179.45 179.39 2bry s ARG 116 N -3.34 1.68 0.00 0.07 0.52 -1.26 -3.56 118.95 113.05 2bry s ARG 116 Ca 0.02 -1.25 0.00 0.00 -0.52 0.00 0.00 55.73 53.98 2bry s ARG 116 Cb 0.09 -2.37 0.00 0.00 0.52 0.00 0.00 34.95 33.19 2bry s ARG 116 CO 0.69 -1.44 0.55 0.44 0.02 0.00 0.00 175.30 175.56 2bry n ILE 117 N -2.79 0.30 -4.08 1.52 -5.35 -1.26 -1.84 119.36 105.86 2bry n ILE 117 Ca 0.16 -0.47 -0.11 0.00 -0.27 0.00 0.00 62.75 62.07 2bry n ILE 117 Cb 0.61 1.04 -0.07 0.00 -1.74 0.00 0.00 39.64 39.48 2bry n ILE 117 CO 0.00 0.00 0.00 -1.59 -1.76 0.00 0.00 176.55 173.20 2bry s LYS 118 N -0.30 1.45 -0.45 6.28 -2.85 -1.26 -4.67 119.74 117.94 2bry s LYS 118 Ca 0.00 -1.43 -0.08 0.00 -1.00 0.00 0.00 55.97 53.47 2bry s LYS 118 Cb 0.00 0.40 0.11 0.00 -2.06 0.00 0.00 37.83 36.28 2bry s LYS 118 CO 0.00 -0.57 0.30 -0.06 0.10 0.00 0.00 175.35 175.13 2bry s PHE 119 N -4.00 3.45 -1.75 1.78 0.08 -1.26 -4.96 117.98 111.32 2bry s PHE 119 Ca 0.29 -1.95 0.18 0.00 0.12 0.00 0.00 56.93 55.57 2bry s PHE 119 Cb 0.02 -3.37 0.02 0.00 -0.57 0.00 0.00 43.02 39.12 2bry s PHE 119 CO 0.11 -0.97 0.95 -1.13 -0.10 0.00 0.00 175.22 174.07 2bry n SER 120 N 4.84 1.89 -4.77 1.36 3.41 -1.26 -4.87 113.62 114.21 2bry n SER 120 Ca -0.07 -1.44 -0.38 0.00 -0.26 0.00 0.00 58.87 56.72 2bry n SER 120 Cb 0.41 0.38 -0.06 0.00 -0.26 0.00 0.00 64.21 64.68 2bry n SER 120 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2bry s ARG 121 N -1.95 4.14 0.00 4.33 0.52 -1.26 -4.45 118.95 120.28 2bry s ARG 121 Ca 0.16 0.38 0.11 0.00 -0.52 0.00 0.00 55.73 55.86 2bry s ARG 121 Cb 0.14 -3.34 -0.04 0.00 0.52 0.00 0.00 34.95 32.23 2bry s ARG 121 CO 0.41 0.41 0.60 0.72 0.02 0.00 0.00 175.30 177.46 2bry n HIS 122 N 2.81 0.00 -1.31 -0.53 8.25 -1.26 -1.44 115.22 121.74 2bry n HIS 122 Ca -0.11 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.00 2bry n HIS 122 Cb 0.52 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.74 2bry n HIS 122 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2bry n ASN 123 N -0.59 1.26 -4.54 0.41 3.02 -1.26 -4.51 115.26 109.05 2bry n ASN 123 Ca 0.04 0.66 -0.34 0.00 -0.03 0.00 0.00 54.58 54.91 2bry n ASN 123 Cb 0.21 -1.51 -0.12 0.00 -0.61 0.00 0.00 39.78 37.76 2bry n ASN 123 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2bry s VAL 124 N -1.88 4.00 -0.15 2.41 1.01 -1.26 -0.42 120.40 124.10 2bry s VAL 124 Ca 0.76 -0.33 -0.05 0.00 0.00 0.00 0.00 61.98 62.36 2bry s VAL 124 Cb -0.32 -2.74 -0.04 0.00 0.00 0.00 0.00 36.38 33.29 2bry s VAL 124 CO 0.48 0.51 0.03 -0.76 0.00 0.00 0.00 175.10 175.36 2bry s LEU 125 N 0.11 3.64 0.38 3.92 1.43 0.56 -4.91 118.68 123.80 2bry s LEU 125 Ca -0.00 0.05 -0.26 0.00 -1.03 0.00 0.00 54.13 52.89 2bry s LEU 125 Cb -0.13 -1.89 -0.09 0.00 0.03 0.00 0.00 46.19 44.11 2bry s LEU 125 CO 0.03 0.22 1.16 -2.28 0.23 0.00 0.00 176.35 175.71 2bry s HIS 126 N 0.06 3.15 -0.09 0.29 5.65 -1.26 -1.36 115.29 121.71 2bry s HIS 126 Ca 0.04 1.57 0.03 0.00 0.25 0.00 0.00 55.06 56.95 2bry s HIS 126 Cb -0.13 -3.38 0.00 0.00 -1.18 0.00 0.00 32.58 27.90 2bry s HIS 126 CO 0.01 -1.21 -0.21 -0.51 -0.65 0.00 0.00 174.74 172.18 2bry s LEU 127 N -2.32 1.98 0.67 8.88 1.43 -0.08 -4.48 118.68 124.76 2bry s LEU 127 Ca 0.55 -0.50 -0.14 0.00 -1.03 0.00 0.00 54.13 53.01 2bry s LEU 127 Cb -0.31 -1.27 0.00 0.00 0.03 0.00 0.00 46.19 44.65 2bry s LEU 127 CO 0.39 0.12 1.09 0.26 0.23 0.00 0.00 176.35 178.44 2bry s TRP 128 N 0.46 2.77 0.30 0.29 0.52 -1.26 -4.76 118.94 117.26 2bry s TRP 128 Ca -0.17 1.53 0.06 0.00 0.02 0.00 0.00 56.10 57.54 2bry s TRP 128 Cb -0.17 -3.07 0.77 0.00 -1.15 0.00 0.00 33.47 29.85 2bry s TRP 128 CO 0.07 -1.50 1.74 -1.35 0.02 0.00 0.00 176.95 175.93 2bry h PRO 129 N -0.17 0.57 -0.30 4.98 0.11 -2.00 -1.06 132.00 134.13 2bry h PRO 129 Ca -0.46 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 2bry h PRO 129 Cb 1.23 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 2bry h PRO 129 CO 0.55 0.38 0.03 0.27 -0.21 0.00 0.00 178.00 179.01 2bry h PHE 130 N 0.59 0.46 0.01 0.65 -5.15 -1.93 -1.55 116.94 110.02 2bry h PHE 130 Ca 0.59 -0.03 -0.22 0.00 -0.20 0.00 0.00 57.97 58.11 2bry h PHE 130 Cb 1.04 -0.14 -0.00 0.00 0.22 0.00 0.00 35.95 37.07 2bry h PHE 130 CO -0.05 0.44 -0.94 1.15 -2.00 0.00 0.00 178.31 176.91 2bry h THR 131 N 0.44 1.45 0.18 0.88 2.02 -1.57 -0.02 112.91 116.29 2bry h THR 131 Ca 0.10 -2.58 -0.01 0.00 0.77 0.00 0.00 66.41 64.70 2bry h THR 131 Cb 0.25 2.49 0.00 0.00 -1.74 0.00 0.00 68.15 69.15 2bry h THR 131 CO 0.00 0.76 -0.09 0.40 0.37 0.00 0.00 175.52 176.96 2bry h ILE 132 N 0.17 0.87 -0.64 3.11 2.04 -1.18 -0.63 117.51 121.26 2bry h ILE 132 Ca -0.07 -0.23 0.07 0.00 1.00 0.00 0.00 64.86 65.63 2bry h ILE 132 Cb 1.59 1.01 -0.06 0.00 -0.74 0.00 0.00 36.82 38.62 2bry h ILE 132 CO 0.15 0.05 0.32 -0.74 0.00 0.00 0.00 178.15 177.94 2bry h HIS 133 N -0.36 0.58 -0.28 1.37 2.76 -1.21 -1.48 115.15 116.54 2bry h HIS 133 Ca -0.03 0.03 0.06 0.00 -2.20 0.00 0.00 60.37 58.23 2bry h HIS 133 Cb 0.28 -0.17 -0.06 0.00 1.55 0.00 0.00 27.41 29.02 2bry h HIS 133 CO -0.03 0.25 -0.09 0.22 -1.30 0.00 0.00 177.93 176.98 2bry h ASP 134 N 0.59 -0.31 -0.28 3.26 3.58 -0.71 -0.54 116.42 122.00 2bry h ASP 134 Ca 0.30 0.09 -0.13 0.00 0.42 0.00 0.00 57.03 57.71 2bry h ASP 134 Cb 0.25 0.20 -0.00 0.00 1.72 0.00 0.00 39.33 41.49 2bry h ASP 134 CO -0.22 -0.12 -0.34 -0.07 -2.88 0.00 0.00 179.24 175.62 2bry h LEU 135 N -0.03 0.79 -0.98 2.28 3.38 -0.91 -2.45 115.31 117.39 2bry h LEU 135 Ca 0.14 -0.49 0.11 0.00 0.09 0.00 0.00 57.88 57.73 2bry h LEU 135 Cb 0.24 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 40.69 2bry h LEU 135 CO -0.31 1.12 0.61 0.03 0.09 0.00 0.00 178.44 179.99 2bry h ARG 136 N 0.47 0.97 0.00 1.13 3.08 -0.99 -1.00 114.38 118.04 2bry h ARG 136 Ca 0.04 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2bry h ARG 136 Cb 0.92 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.75 2bry h ARG 136 CO 0.08 0.64 0.00 0.00 -1.07 0.00 0.00 179.97 179.62 2bry n ALA 137 N -2.35 1.75 0.06 0.04 0.00 -0.24 -1.60 120.51 118.17 2bry n ALA 137 Ca 0.18 -0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.71 2bry n ALA 137 Cb 0.32 -1.30 0.25 0.00 0.00 0.00 0.00 19.45 18.72 2bry n ALA 137 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2bry n LEU 138 N -1.68 3.63 0.00 0.00 4.77 -0.44 -4.46 117.00 118.82 2bry n LEU 138 Ca 0.04 -1.68 0.00 0.00 -0.03 0.00 0.00 56.01 54.33 2bry n LEU 138 Cb 0.21 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 2bry n LEU 138 CO 0.17 0.83 0.00 0.61 -1.33 0.00 0.00 177.39 177.67 2bry n GLY 139 N 1.54 0.92 0.31 -0.72 0.00 -0.62 -4.88 105.19 101.73 2bry n GLY 139 Ca 0.21 -0.48 0.07 0.00 0.00 0.00 0.00 46.02 45.82 2bry n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bry h ALA 140 N 0.00 1.30 -0.80 4.61 0.00 -1.47 -1.79 119.26 121.11 2bry h ALA 140 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2bry h ALA 140 Cb 0.19 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2bry h ALA 140 CO 0.00 -0.03 0.50 -0.22 0.00 0.00 0.00 179.25 179.50 2bry h LYS 141 N 0.69 1.07 -0.75 0.00 1.63 -1.84 0.31 116.57 117.68 2bry h LYS 141 Ca 0.46 -0.08 -0.03 0.00 -0.85 0.00 0.00 60.65 60.15 2bry h LYS 141 Cb 0.60 -0.23 -0.03 0.00 -0.60 0.00 0.00 32.23 31.96 2bry h LYS 141 CO -0.33 0.73 0.34 -0.22 -3.45 0.00 0.00 179.45 176.52 2bry h LYS 142 N 1.09 1.10 0.00 1.90 1.63 -1.72 -3.19 116.57 117.38 2bry h LYS 142 Ca 0.29 -0.17 -0.04 0.00 -0.85 0.00 0.00 60.65 59.88 2bry h LYS 142 Cb -0.08 -0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 31.35 2bry h LYS 142 CO -0.06 0.87 -0.88 0.74 -3.45 0.00 0.00 179.45 176.68 2bry h PHE 143 N 1.06 0.00 -2.32 1.91 0.04 -1.15 -3.44 116.94 113.05 2bry h PHE 143 Ca 0.26 0.00 -0.38 0.00 2.80 0.00 0.00 57.97 60.64 2bry h PHE 143 Cb 0.15 0.00 -0.35 0.00 2.20 0.00 0.00 35.95 37.95 2bry h PHE 143 CO 0.01 0.15 -0.68 -0.47 -0.60 0.00 0.00 178.31 176.72 2bry s TYR 144 N -3.22 -0.25 -0.05 -0.55 5.04 0.10 -4.88 117.35 113.53 2bry s TYR 144 Ca 0.01 -0.37 0.30 0.00 -2.44 0.00 0.00 57.07 54.56 2bry s TYR 144 Cb 0.08 -0.58 1.38 0.00 0.35 0.00 0.00 41.96 43.19 2bry s TYR 144 CO 0.77 -0.90 1.91 0.78 -1.34 0.00 0.00 175.55 176.77 2bry h GLY 145 N 8.28 0.00 -2.48 8.97 0.00 -1.81 -1.93 103.07 114.09 2bry h GLY 145 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.18 2bry h GLY 145 CO 0.36 0.00 0.00 -2.13 0.00 0.00 0.00 176.54 174.77 2bry n ARG 146 N -2.68 2.58 -2.11 4.80 0.63 -1.26 -4.97 116.66 113.64 2bry n ARG 146 Ca 0.00 -2.42 -0.42 0.00 -0.92 0.00 0.00 57.85 54.09 2bry n ARG 146 Cb 0.21 -1.53 -0.03 0.00 0.45 0.00 0.00 32.46 31.56 2bry n ARG 146 CO 0.00 0.00 0.00 0.12 -2.51 0.00 0.00 177.63 175.24 2bry s PHE 147 N -1.12 2.56 -0.76 -0.14 5.36 -0.73 -3.59 117.98 119.57 2bry s PHE 147 Ca 0.45 0.57 -0.08 0.00 -0.96 0.00 0.00 56.93 56.91 2bry s PHE 147 Cb 0.24 -3.79 0.01 0.00 -0.34 0.00 0.00 43.02 39.14 2bry s PHE 147 CO 0.30 -3.07 0.15 0.00 -1.46 0.00 0.00 175.22 171.14 2bry s THR 149 N -3.94 4.33 0.00 0.00 -1.32 -1.24 -4.61 115.64 108.87 2bry s THR 149 Ca 0.11 1.62 0.00 0.00 -1.21 0.00 0.00 61.69 62.21 2bry s THR 149 Cb -0.06 -3.85 0.00 0.00 -1.51 0.00 0.00 72.50 67.08 2bry s THR 149 CO 0.53 -0.01 0.00 0.61 -2.21 0.00 0.00 174.62 173.54 2bry n GLY 150 N 0.16 2.09 0.95 6.08 0.00 -1.26 -1.61 105.19 111.59 2bry n GLY 150 Ca 0.03 -0.48 0.09 0.00 0.00 0.00 0.00 46.02 45.66 2bry n GLY 150 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2bry n THR 151 N 0.00 0.66 -2.35 2.61 -2.24 -1.26 -4.95 114.28 106.75 2bry n THR 151 Ca 0.00 -0.68 -0.41 0.00 -2.27 0.00 0.00 64.05 60.69 2bry n THR 151 Cb 0.00 0.38 -0.03 0.00 -2.10 0.00 0.00 70.33 68.57 2bry n THR 151 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2bry s LEU 152 N -1.05 4.46 -0.35 3.22 1.43 -0.63 -4.95 118.68 120.80 2bry s LEU 152 Ca 0.35 2.30 0.15 0.00 -1.03 0.00 0.00 54.13 55.90 2bry s LEU 152 Cb 0.18 -3.61 0.44 0.00 0.03 0.00 0.00 46.19 43.23 2bry s LEU 152 CO 0.24 -0.37 0.94 -0.90 0.23 0.00 0.00 176.35 176.50 2bry n ASP 153 N 2.19 1.93 -3.68 2.29 5.75 -1.26 -4.31 116.55 119.46 2bry n ASP 153 Ca 0.03 -2.93 -0.10 0.00 -0.01 0.00 0.00 54.79 51.79 2bry n ASP 153 Cb 0.44 -0.53 -0.04 0.00 -1.03 0.00 0.00 41.12 39.96 2bry n ASP 153 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 2bry s HIS 154 N -3.10 -0.16 -0.14 2.11 -3.43 -1.26 -0.90 115.29 108.40 2bry s HIS 154 Ca 0.32 -0.16 -0.21 0.00 -0.80 0.00 0.00 55.06 54.21 2bry s HIS 154 Cb 0.43 0.33 0.05 0.00 -1.43 0.00 0.00 32.58 31.97 2bry s HIS 154 CO -0.01 -0.82 0.54 -1.50 -2.00 0.00 0.00 174.74 170.95 2bry s ILE 155 N -3.84 0.01 0.51 -5.38 2.07 -0.47 -4.53 121.20 109.58 2bry s ILE 155 Ca 0.06 -0.08 -0.21 0.00 -1.41 0.00 0.00 60.65 59.02 2bry s ILE 155 Cb 0.00 -0.80 -0.06 0.00 0.13 0.00 0.00 42.46 41.73 2bry s ILE 155 CO -0.07 -0.04 1.17 -0.94 -1.91 0.00 0.00 174.94 173.15 2bry s SER 156 N -0.28 5.85 0.14 4.50 1.04 -1.26 -0.33 113.70 123.36 2bry s SER 156 Ca -0.04 2.31 -0.22 0.00 0.48 0.00 0.00 55.95 58.47 2bry s SER 156 Cb -0.03 -2.60 -0.01 0.00 0.10 0.00 0.00 66.02 63.48 2bry s SER 156 CO 0.03 -1.14 1.66 0.40 0.98 0.00 0.00 173.24 175.18 2bry h ILE 157 N 1.51 0.56 -0.29 -1.02 2.04 -0.89 -2.03 117.51 117.40 2bry h ILE 157 Ca -0.50 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.31 2bry h ILE 157 Cb 1.26 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.89 2bry h ILE 157 CO 0.58 0.00 -0.07 0.08 0.00 0.00 0.00 178.15 178.75 2bry h ARG 158 N -0.19 0.46 -0.48 2.37 0.11 -1.53 -1.27 114.38 113.87 2bry h ARG 158 Ca 0.11 -0.11 -0.07 0.00 0.10 0.00 0.00 59.98 60.00 2bry h ARG 158 Cb 0.34 -0.06 -0.02 0.00 1.11 0.00 0.00 29.97 31.34 2bry h ARG 158 CO -0.27 0.54 -0.01 1.96 0.10 0.00 0.00 179.97 182.29 2bry h GLN 159 N 0.44 0.79 -0.27 0.08 1.08 -1.72 -0.19 115.11 115.33 2bry h GLN 159 Ca 0.09 -0.22 -0.02 0.00 -1.45 0.00 0.00 58.65 57.05 2bry h GLN 159 Cb 0.39 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.72 2bry h GLN 159 CO 0.02 0.81 0.07 1.25 -0.95 0.00 0.00 178.83 180.03 2bry h LEU 160 N 0.74 0.40 -0.85 1.46 5.85 -0.94 -2.34 115.31 119.62 2bry h LEU 160 Ca 0.14 -0.22 0.06 0.00 0.84 0.00 0.00 57.88 58.71 2bry h LEU 160 Cb 0.46 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.33 2bry h LEU 160 CO 0.02 0.51 0.53 1.56 -0.34 0.00 0.00 178.44 180.72 2bry h GLN 161 N 0.26 0.93 -0.33 1.25 4.20 -1.09 -1.88 115.11 118.45 2bry h GLN 161 Ca 0.08 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 2bry h GLN 161 Cb 0.26 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 2bry h GLN 161 CO -0.00 0.61 0.07 -0.07 -0.67 0.00 0.00 178.83 178.78 2bry h LEU 162 N 0.96 0.51 -0.30 1.46 3.38 -0.78 0.18 115.31 120.71 2bry h LEU 162 Ca 0.37 -0.24 -0.19 0.00 0.09 0.00 0.00 57.88 57.91 2bry h LEU 162 Cb 0.18 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2bry h LEU 162 CO -0.18 0.62 -0.60 0.17 0.09 0.00 0.00 178.44 178.54 2bry h LEU 163 N 0.38 0.92 -0.96 1.67 8.10 -1.31 -1.59 115.31 122.51 2bry h LEU 163 Ca 0.10 -0.52 -0.08 0.00 0.11 0.00 0.00 57.88 57.49 2bry h LEU 163 Cb 0.31 -0.27 -0.02 0.00 -0.44 0.00 0.00 40.66 40.25 2bry h LEU 163 CO 0.00 1.31 -0.15 -0.07 -4.11 0.00 0.00 178.44 175.43 2bry h LEU 164 N 0.61 0.58 -0.26 0.17 3.38 -1.22 -2.45 115.31 116.12 2bry h LEU 164 Ca -0.00 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2bry h LEU 164 Cb 1.21 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 2bry h LEU 164 CO 0.13 0.75 0.17 0.25 0.09 0.00 0.00 178.44 179.83 2bry h LEU 165 N 0.54 0.30 -0.73 1.67 5.85 -0.46 0.32 115.31 122.79 2bry h LEU 165 Ca 0.09 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.81 2bry h LEU 165 Cb 0.57 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 2bry h LEU 165 CO 0.04 0.22 0.48 0.11 -0.34 0.00 0.00 178.44 178.95 2bry h LYS 166 N 0.35 0.95 -0.13 1.25 1.57 -1.02 -0.09 116.57 119.45 2bry h LYS 166 Ca 0.09 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 2bry h LYS 166 Cb -0.03 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 2bry h LYS 166 CO -0.02 0.63 0.03 0.28 -0.57 0.00 0.00 179.45 179.80 2bry h VAL 167 N 0.98 1.20 -0.48 0.50 2.07 -1.19 -1.67 116.25 117.65 2bry h VAL 167 Ca 0.27 -0.61 0.06 0.00 0.82 0.00 0.00 66.70 67.23 2bry h VAL 167 Cb -0.11 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 30.98 2bry h VAL 167 CO -0.06 0.18 0.20 0.00 0.02 0.00 0.00 177.57 177.91 2bry h ALA 168 N 0.83 0.60 -0.31 1.67 0.00 -0.64 -0.51 119.26 120.90 2bry h ALA 168 Ca 0.04 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2bry h ALA 168 Cb 0.25 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2bry h ALA 168 CO 0.00 -0.17 0.16 -0.07 0.00 0.00 0.00 179.25 179.17 2bry h LEU 169 N 0.40 0.40 -1.40 0.00 3.38 -0.94 -2.00 115.31 115.15 2bry h LEU 169 Ca 0.22 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2bry h LEU 169 Cb 0.19 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 2bry h LEU 169 CO -0.20 0.39 0.31 -0.07 0.09 0.00 0.00 178.44 178.96 2bry h LEU 170 N 0.38 0.64 -0.14 1.67 3.38 -0.80 -1.59 115.31 118.84 2bry h LEU 170 Ca 0.11 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2bry h LEU 170 Cb 0.08 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2bry h LEU 170 CO -0.02 0.50 0.00 0.18 0.09 0.00 0.00 178.44 179.19 2bry n LEU 171 N -4.42 0.22 0.00 1.67 4.77 -0.24 -3.95 117.00 115.04 2bry n LEU 171 Ca 0.05 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 2bry n LEU 171 Cb 0.08 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2bry n LEU 171 CO 0.36 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 2bry n GLY 172 N 0.97 0.82 3.73 -0.72 0.00 -0.60 -3.93 105.19 105.47 2bry n GLY 172 Ca 0.21 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2bry n GLY 172 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bry s VAL 173 N -2.00 2.06 -0.43 1.61 1.01 -0.80 -1.55 120.40 120.31 2bry s VAL 173 Ca 0.00 0.05 -0.20 0.00 0.00 0.00 0.00 61.98 61.83 2bry s VAL 173 Cb 0.00 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.37 2bry s VAL 173 CO 0.00 0.01 0.61 -0.70 0.00 0.00 0.00 175.10 175.01 2bry s GLU 174 N 0.45 3.28 -0.13 2.72 2.12 -0.17 -3.76 118.70 123.21 2bry s GLU 174 Ca 0.70 -0.41 -0.02 0.00 0.36 0.00 0.00 54.97 55.60 2bry s GLU 174 Cb -0.49 -3.94 -0.02 0.00 0.26 0.00 0.00 34.13 29.93 2bry s GLU 174 CO 0.39 -0.97 -0.07 0.42 -0.54 0.00 0.00 175.26 174.49 2bry s ILE 175 N 2.71 3.60 -0.09 -3.70 1.01 -1.26 -0.47 121.20 123.00 2bry s ILE 175 Ca 0.21 -0.48 0.04 0.00 0.00 0.00 0.00 60.65 60.42 2bry s ILE 175 Cb -0.15 -2.54 -0.01 0.00 0.01 0.00 0.00 42.46 39.78 2bry s ILE 175 CO 0.18 0.53 -0.21 -1.00 0.00 0.00 0.00 174.94 174.44 2bry s HIS 176 N 0.07 2.59 0.17 3.97 3.76 0.52 -4.97 115.29 121.41 2bry s HIS 176 Ca -0.02 -0.78 0.07 0.00 -0.15 0.00 0.00 55.06 54.18 2bry s HIS 176 Cb -0.14 -1.70 -0.04 0.00 1.11 0.00 0.00 32.58 31.81 2bry s HIS 176 CO 0.03 -0.26 0.00 -1.58 -0.85 0.00 0.00 174.74 172.08 2bry s TRP 177 N 0.10 2.85 -1.34 1.40 0.52 -1.26 -0.62 118.94 120.59 2bry s TRP 177 Ca -0.10 -0.13 0.00 0.00 0.02 0.00 0.00 56.10 55.89 2bry s TRP 177 Cb -0.16 -1.38 0.00 0.00 -1.15 0.00 0.00 33.47 30.78 2bry s TRP 177 CO 0.06 0.52 0.00 0.41 0.02 0.00 0.00 176.95 177.96 2bry n GLY 178 N -0.11 -0.03 2.98 0.98 0.00 0.24 -4.93 105.19 104.33 2bry n GLY 178 Ca -0.10 -0.25 -0.23 0.00 0.00 0.00 0.00 46.02 45.43 2bry n GLY 178 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bry s VAL 179 N -2.73 0.97 -0.24 1.61 -7.23 -0.56 -4.48 120.40 107.74 2bry s VAL 179 Ca 0.00 -0.37 -0.08 0.00 -1.81 0.00 0.00 61.98 59.72 2bry s VAL 179 Cb 0.00 -0.91 -0.04 0.00 0.56 0.00 0.00 36.38 35.99 2bry s VAL 179 CO 0.00 0.32 0.09 -0.75 -0.31 0.00 0.00 175.10 174.45 2bry s LYS 180 N 0.79 3.77 -0.01 4.82 2.20 0.61 -2.48 119.74 129.43 2bry s LYS 180 Ca -0.13 -0.42 -0.30 0.00 -0.36 0.00 0.00 55.97 54.76 2bry s LYS 180 Cb -0.15 -3.36 -0.06 0.00 -1.51 0.00 0.00 37.83 32.75 2bry s LYS 180 CO 0.02 -0.09 1.47 0.12 -0.36 0.00 0.00 175.35 176.51 2bry s PHE 181 N 1.38 2.63 -0.02 4.03 5.36 -1.26 -1.11 117.98 128.99 2bry s PHE 181 Ca 0.06 0.65 0.00 0.00 -0.96 0.00 0.00 56.93 56.67 2bry s PHE 181 Cb -0.15 -3.74 0.00 0.00 -0.34 0.00 0.00 43.02 38.79 2bry s PHE 181 CO 0.04 -2.85 0.59 0.25 -1.46 0.00 0.00 175.22 171.80 2bry n THR 182 N 4.88 0.18 -1.64 0.12 -2.24 0.45 -4.98 114.28 111.05 2bry n THR 182 Ca 0.14 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 2bry n THR 182 Cb 0.43 0.91 0.00 0.00 -2.10 0.00 0.00 70.33 69.58 2bry n THR 182 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bry n GLY 183 N -0.08 0.19 3.33 3.38 0.00 -1.21 -4.93 105.19 105.87 2bry n GLY 183 Ca 0.00 -1.60 -0.30 0.00 0.00 0.00 0.00 46.02 44.12 2bry n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bry s LEU 184 N 0.00 2.15 -0.48 0.99 1.43 -1.26 -0.27 118.68 121.24 2bry s LEU 184 Ca 0.00 -0.57 -0.17 0.00 -1.03 0.00 0.00 54.13 52.37 2bry s LEU 184 Cb 0.00 -1.25 0.07 0.00 0.03 0.00 0.00 46.19 45.03 2bry s LEU 184 CO 0.00 0.25 0.47 -1.10 0.23 0.00 0.00 176.35 176.20 2bry s GLN 185 N -1.15 3.02 0.62 1.70 -0.21 0.11 -4.70 119.66 119.05 2bry s GLN 185 Ca 0.11 -1.20 -0.18 0.00 0.02 0.00 0.00 55.36 54.11 2bry s GLN 185 Cb -0.10 -4.12 -0.03 0.00 1.00 0.00 0.00 33.01 29.77 2bry s GLN 185 CO 0.02 -1.08 1.25 -1.25 -2.12 0.00 0.00 175.29 172.10 2bry s PRO 186 N 1.96 2.79 -0.01 2.91 0.04 -1.26 -2.31 135.00 139.11 2bry s PRO 186 Ca 0.08 1.94 -0.35 0.00 0.04 0.00 0.00 61.00 62.71 2bry s PRO 186 Cb -0.23 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.29 2bry s PRO 186 CO 0.08 -1.38 1.74 -2.30 0.04 0.00 0.00 177.00 175.18 2bry n PRO 187 N -1.72 2.03 0.22 0.56 -0.02 -1.26 -4.87 135.00 129.94 2bry n PRO 187 Ca 0.15 0.74 0.08 0.00 -2.02 0.00 0.00 63.50 62.44 2bry n PRO 187 Cb 0.49 -2.53 0.49 0.00 -0.02 0.00 0.00 33.50 31.93 2bry n PRO 187 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2bry h PRO 188 N 7.70 0.00 -2.57 0.52 0.11 -1.90 -3.46 132.00 132.40 2bry h PRO 188 Ca -0.47 0.00 0.13 0.00 0.11 0.00 0.00 66.00 65.77 2bry h PRO 188 Cb 1.27 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.31 2bry h PRO 188 CO 0.92 0.27 0.39 -0.98 -0.21 0.00 0.00 178.00 178.39 2bry s ARG 189 N -4.00 1.36 0.22 1.05 1.70 -1.26 -5.08 118.95 112.93 2bry s ARG 189 Ca -0.02 -0.73 -0.32 0.00 -0.47 0.00 0.00 55.73 54.19 2bry s ARG 189 Cb 0.13 0.48 -0.14 0.00 -0.57 0.00 0.00 34.95 34.84 2bry s ARG 189 CO 0.66 -0.62 1.32 1.17 -1.08 0.00 0.00 175.30 176.74 2bry n LYS 190 N -0.45 1.72 0.00 3.89 3.00 -1.26 -1.07 118.16 123.99 2bry n LYS 190 Ca -0.06 0.61 0.00 0.00 -0.00 0.00 0.00 58.31 58.86 2bry n LYS 190 Cb 0.60 -2.21 0.00 0.00 0.00 0.00 0.00 35.03 33.42 2bry n LYS 190 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2bry n GLY 191 N 2.09 2.36 3.88 3.14 0.00 -1.26 -5.06 105.19 110.33 2bry n GLY 191 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 2bry n GLY 191 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bry s SER 192 N -1.63 6.52 0.52 1.61 0.01 -0.23 -5.11 113.70 115.39 2bry s SER 192 Ca 0.00 1.11 0.05 0.00 1.31 0.00 0.00 55.95 58.42 2bry s SER 192 Cb 0.00 -2.31 0.02 0.00 0.21 0.00 0.00 66.02 63.93 2bry s SER 192 CO 0.00 -0.38 0.29 -0.83 0.41 0.00 0.00 173.24 172.73 2bry s GLY 193 N -3.14 2.52 0.26 3.44 0.00 -1.26 -4.65 107.32 104.49 2bry s GLY 193 Ca 0.51 -1.14 -0.30 0.00 0.00 0.00 0.00 44.72 43.79 2bry s GLY 193 CO 0.31 -1.99 1.01 -0.98 0.00 0.00 0.00 173.10 171.44 2bry s TRP 194 N -2.77 3.80 0.29 1.90 0.52 -1.26 -3.98 118.94 117.44 2bry s TRP 194 Ca 0.28 1.82 0.03 0.00 0.02 0.00 0.00 56.10 58.26 2bry s TRP 194 Cb -0.01 -3.10 -0.06 0.00 -1.15 0.00 0.00 33.47 29.15 2bry s TRP 194 CO 0.17 0.03 0.05 1.03 0.02 0.00 0.00 176.95 178.25 2bry s ARG 195 N -1.34 1.54 0.03 4.98 0.52 -0.98 -1.99 118.95 121.72 2bry s ARG 195 Ca 0.43 -1.83 0.00 0.00 -0.52 0.00 0.00 55.73 53.81 2bry s ARG 195 Cb -0.28 -0.70 -0.04 0.00 0.52 0.00 0.00 34.95 34.45 2bry s ARG 195 CO 0.35 -0.19 0.13 0.00 0.02 0.00 0.00 175.30 175.62 2bry s ALA 196 N -3.41 3.74 -0.17 2.13 0.00 -1.26 0.06 121.76 122.86 2bry s ALA 196 Ca 0.35 -0.88 -0.22 0.00 0.00 0.00 0.00 51.96 51.21 2bry s ALA 196 Cb 0.08 -1.65 -0.03 0.00 0.00 0.00 0.00 23.12 21.52 2bry s ALA 196 CO 0.14 0.75 0.67 -0.65 0.00 0.00 0.00 175.76 176.67 2bry s GLN 197 N -2.14 4.27 0.02 0.00 -0.21 0.63 -4.63 119.66 117.60 2bry s GLN 197 Ca 0.28 0.72 0.04 0.00 0.02 0.00 0.00 55.36 56.42 2bry s GLN 197 Cb -0.12 -3.55 -0.02 0.00 1.00 0.00 0.00 33.01 30.32 2bry s GLN 197 CO 0.20 -0.19 -0.11 -0.51 -2.12 0.00 0.00 175.29 172.56 2bry s LEU 198 N 1.73 2.12 -0.05 2.90 1.43 -1.26 -0.41 118.68 125.13 2bry s LEU 198 Ca 0.32 -0.36 0.02 0.00 -1.03 0.00 0.00 54.13 53.08 2bry s LEU 198 Cb -0.16 -0.49 0.01 0.00 0.03 0.00 0.00 46.19 45.58 2bry s LEU 198 CO 0.12 0.03 -0.11 -1.10 0.23 0.00 0.00 176.35 175.52 2bry s GLN 199 N -0.85 1.46 0.45 1.70 -0.21 -0.27 -4.21 119.66 117.74 2bry s GLN 199 Ca 0.01 -0.36 -0.07 0.00 0.02 0.00 0.00 55.36 54.95 2bry s GLN 199 Cb -0.06 -1.25 0.10 0.00 1.00 0.00 0.00 33.01 32.80 2bry s GLN 199 CO 0.01 0.04 0.61 -0.35 -2.12 0.00 0.00 175.29 173.47 2bry n PRO 200 N 3.73 -0.56 -1.62 2.91 -0.04 -1.26 -0.28 135.00 137.88 2bry n PRO 200 Ca -0.22 -0.97 -0.51 0.00 -0.04 0.00 0.00 63.50 61.75 2bry n PRO 200 Cb 0.52 -0.62 -0.06 0.00 -0.04 0.00 0.00 33.50 33.30 2bry n PRO 200 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2bry n ASN 201 N -3.38 2.79 -4.91 3.54 3.02 -1.26 -4.91 115.26 110.15 2bry n ASN 201 Ca 0.08 0.82 -0.27 0.00 -0.03 0.00 0.00 54.58 55.17 2bry n ASN 201 Cb 0.27 -1.28 0.04 0.00 -0.61 0.00 0.00 39.78 38.19 2bry n ASN 201 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2bry s PRO 202 N 4.63 2.84 0.78 3.52 0.04 -1.26 -5.07 135.00 140.47 2bry s PRO 202 Ca 0.99 0.05 -0.14 0.00 0.04 0.00 0.00 61.00 61.94 2bry s PRO 202 Cb -0.83 -2.22 0.07 0.00 0.04 0.00 0.00 34.50 31.56 2bry s PRO 202 CO 0.54 -0.81 1.20 -2.14 0.04 0.00 0.00 177.00 175.84 2bry s PRO 203 N -5.08 1.81 0.27 0.56 0.02 -1.26 -4.42 135.00 126.90 2bry s PRO 203 Ca 0.55 1.74 -0.09 0.00 0.02 0.00 0.00 61.00 63.22 2bry s PRO 203 Cb -0.11 -1.80 0.42 0.00 0.02 0.00 0.00 34.50 33.04 2bry s PRO 203 CO 0.46 -2.08 1.52 0.00 -0.33 0.00 0.00 177.00 176.57 2bry n ALA 204 N -3.12 0.19 -0.15 -1.55 0.00 -1.26 -0.66 120.51 113.96 2bry n ALA 204 Ca 0.13 1.06 -0.06 0.00 0.00 0.00 0.00 53.44 54.57 2bry n ALA 204 Cb 0.50 -0.62 0.03 0.00 0.00 0.00 0.00 19.45 19.36 2bry n ALA 204 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2bry h GLN 205 N 0.00 0.52 -0.07 0.00 -0.00 -1.96 -0.45 115.11 113.15 2bry h GLN 205 Ca 0.45 -0.03 -0.10 0.00 -0.00 0.00 0.00 58.65 58.97 2bry h GLN 205 Cb 0.70 -0.12 0.00 0.00 0.00 0.00 0.00 27.48 28.06 2bry h GLN 205 CO -1.00 0.34 -0.36 1.25 0.00 0.00 0.00 178.83 179.06 2bry h LEU 206 N 0.53 0.43 -1.45 -2.39 5.85 -1.23 -1.14 115.31 115.92 2bry h LEU 206 Ca 0.18 -0.66 0.10 0.00 0.84 0.00 0.00 57.88 58.35 2bry h LEU 206 Cb 0.03 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 40.88 2bry h LEU 206 CO -0.09 1.02 0.49 0.00 -0.34 0.00 0.00 178.44 179.52 2bry h ALA 207 N 0.42 1.87 -0.32 1.25 0.00 -0.84 -2.07 119.26 119.57 2bry h ALA 207 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2bry h ALA 207 Cb 1.02 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2bry h ALA 207 CO 0.07 -0.03 0.00 -1.13 0.00 0.00 0.00 179.25 178.16 2bry n SER 208 N -4.50 3.32 -4.66 0.00 3.41 -0.19 -4.75 113.62 106.26 2bry n SER 208 Ca 0.13 -1.97 -0.42 0.00 -0.26 0.00 0.00 58.87 56.35 2bry n SER 208 Cb 0.37 -0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 64.08 2bry n SER 208 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2bry s TYR 209 N -1.50 1.43 -0.09 7.33 5.04 -0.43 -4.98 117.35 124.15 2bry s TYR 209 Ca 0.35 -0.27 -0.04 0.00 -2.44 0.00 0.00 57.07 54.68 2bry s TYR 209 Cb 0.21 -4.16 -0.04 0.00 0.35 0.00 0.00 41.96 38.33 2bry s TYR 209 CO 0.30 -5.11 0.05 -1.21 -1.34 0.00 0.00 175.55 168.24 2bry s GLU 210 N 4.45 3.14 0.02 4.97 2.02 -1.26 -4.39 118.70 127.66 2bry s GLU 210 Ca 0.85 -0.32 -0.04 0.00 0.02 0.00 0.00 54.97 55.49 2bry s GLU 210 Cb -0.40 -2.93 -0.01 0.00 0.10 0.00 0.00 34.13 30.89 2bry s GLU 210 CO 0.39 0.73 0.06 -0.59 0.02 0.00 0.00 175.26 175.87 2bry s PHE 211 N -0.94 0.19 -1.51 1.61 -0.12 -0.84 -4.84 117.98 111.53 2bry s PHE 211 Ca 0.14 -0.44 0.13 0.00 -0.05 0.00 0.00 56.93 56.72 2bry s PHE 211 Cb -0.12 -0.14 0.06 0.00 -0.63 0.00 0.00 43.02 42.19 2bry s PHE 211 CO 0.03 -0.29 0.86 -0.40 -0.05 0.00 0.00 175.22 175.36 2bry n ASP 212 N 1.15 1.85 -3.83 1.98 5.75 -0.22 -4.11 116.55 119.13 2bry n ASP 212 Ca -0.21 -1.43 -0.20 0.00 -0.01 0.00 0.00 54.79 52.94 2bry n ASP 212 Cb 0.57 0.18 -0.17 0.00 -1.03 0.00 0.00 41.12 40.68 2bry n ASP 212 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2bry s VAL 213 N -1.33 0.37 -0.20 2.12 1.01 -0.90 -0.86 120.40 120.60 2bry s VAL 213 Ca 0.14 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.13 2bry s VAL 213 Cb 0.11 -0.46 0.01 0.00 0.00 0.00 0.00 36.38 36.04 2bry s VAL 213 CO 0.23 0.21 -0.13 -0.22 0.00 0.00 0.00 175.10 175.19 2bry s LEU 214 N 1.26 2.55 -0.28 3.92 2.96 0.25 -0.82 118.68 128.52 2bry s LEU 214 Ca -0.06 -0.61 -0.06 0.00 -0.22 0.00 0.00 54.13 53.17 2bry s LEU 214 Cb -0.13 -1.59 0.00 0.00 0.50 0.00 0.00 46.19 44.97 2bry s LEU 214 CO -0.02 -0.03 0.07 -0.63 -1.32 0.00 0.00 176.35 174.42 2bry s ILE 215 N 1.35 3.93 -0.36 6.68 -1.09 -0.05 -0.75 121.20 130.90 2bry s ILE 215 Ca 0.04 -0.64 -0.16 0.00 -2.23 0.00 0.00 60.65 57.67 2bry s ILE 215 Cb -0.14 -2.99 -0.00 0.00 -1.58 0.00 0.00 42.46 37.75 2bry s ILE 215 CO -0.09 0.13 0.38 -0.44 -1.23 0.00 0.00 174.94 173.70 2bry s SER 216 N 1.50 6.18 -0.38 3.58 0.01 0.14 -0.56 113.70 124.17 2bry s SER 216 Ca 0.03 -0.36 0.11 0.00 1.31 0.00 0.00 55.95 57.03 2bry s SER 216 Cb -0.17 -2.20 0.44 0.00 0.21 0.00 0.00 66.02 64.30 2bry s SER 216 CO 0.02 -0.41 1.05 0.00 0.41 0.00 0.00 173.24 174.32 2bry n ALA 217 N 5.44 4.36 0.37 1.44 0.00 0.62 -1.67 120.51 131.06 2bry n ALA 217 Ca -0.09 -3.80 0.09 0.00 0.00 0.00 0.00 53.44 49.65 2bry n ALA 217 Cb 0.49 -0.69 0.25 0.00 0.00 0.00 0.00 19.45 19.50 2bry n ALA 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bry n ALA 218 N -0.34 2.42 0.00 0.00 0.00 -1.16 -4.40 120.51 117.03 2bry n ALA 218 Ca 0.27 -0.92 0.00 0.00 0.00 0.00 0.00 53.44 52.79 2bry n ALA 218 Cb 0.74 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 19.23 2bry n ALA 218 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bry n GLY 219 N 1.36 -3.05 0.33 0.00 0.00 -1.26 -4.23 105.19 98.34 2bry n GLY 219 Ca 0.18 -1.75 0.04 0.00 0.00 0.00 0.00 46.02 44.49 2bry n GLY 219 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bry h GLY 220 N 0.00 0.78 0.95 -0.02 0.00 -1.96 -2.59 103.07 100.24 2bry h GLY 220 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2bry h GLY 220 CO 0.00 0.26 -0.73 0.28 0.00 0.00 0.00 176.54 176.35 2bry n LYS 221 N -4.46 0.24 -2.07 4.80 5.02 -1.26 -4.80 118.16 115.63 2bry n LYS 221 Ca 0.06 0.04 -0.42 0.00 -2.02 0.00 0.00 58.31 55.98 2bry n LYS 221 Cb 0.09 -1.62 -0.03 0.00 -0.02 0.00 0.00 35.03 33.44 2bry n LYS 221 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2bry s PHE 222 N -3.15 3.14 -0.44 2.13 5.36 -0.98 -4.98 117.98 119.06 2bry s PHE 222 Ca 0.06 0.92 -0.05 0.00 -0.96 0.00 0.00 56.93 56.90 2bry s PHE 222 Cb 0.14 -3.78 0.12 0.00 -0.34 0.00 0.00 43.02 39.16 2bry s PHE 222 CO 0.74 -2.68 0.26 0.08 -1.46 0.00 0.00 175.22 172.16 2bry s VAL 223 N 0.69 3.62 0.28 3.12 1.01 -1.26 -4.89 120.40 122.96 2bry s VAL 223 Ca 0.64 -2.01 -0.30 0.00 0.00 0.00 0.00 61.98 60.31 2bry s VAL 223 Cb -0.40 -3.44 -0.11 0.00 0.00 0.00 0.00 36.38 32.43 2bry s VAL 223 CO 0.35 -0.73 1.51 -2.16 0.00 0.00 0.00 175.10 174.07 2bry s PRO 224 N 1.16 4.20 0.22 2.72 0.04 -1.26 -4.98 135.00 137.10 2bry s PRO 224 Ca 0.08 2.44 -0.26 0.00 0.04 0.00 0.00 61.00 63.29 2bry s PRO 224 Cb -0.24 -3.06 -0.09 0.00 0.04 0.00 0.00 34.50 31.15 2bry s PRO 224 CO -0.03 -0.52 0.85 -2.00 0.04 0.00 0.00 177.00 175.34 2bry s GLU 225 N -0.54 4.62 0.00 4.56 2.12 -1.26 -3.30 118.70 124.89 2bry s GLU 225 Ca 0.61 1.25 0.00 0.00 0.36 0.00 0.00 54.97 57.18 2bry s GLU 225 Cb -0.45 -3.14 0.00 0.00 0.26 0.00 0.00 34.13 30.80 2bry s GLU 225 CO 0.46 0.49 0.00 0.41 -0.54 0.00 0.00 175.26 176.08 2bry n GLY 226 N 1.28 2.57 3.79 -1.50 0.00 -1.26 -5.00 105.19 105.08 2bry n GLY 226 Ca -0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 2bry n GLY 226 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bry s PHE 227 N -2.14 3.75 -0.14 1.61 0.08 -1.21 -5.07 117.98 114.87 2bry s PHE 227 Ca 0.00 1.21 -0.22 0.00 0.12 0.00 0.00 56.93 58.04 2bry s PHE 227 Cb 0.00 -2.52 -0.03 0.00 -0.57 0.00 0.00 43.02 39.90 2bry s PHE 227 CO 0.00 0.49 0.67 0.99 -0.10 0.00 0.00 175.22 177.28 2bry s THR 228 N -0.72 5.02 -0.11 0.64 2.01 -1.26 -4.91 115.64 116.30 2bry s THR 228 Ca 0.29 1.33 -0.03 0.00 0.31 0.00 0.00 61.69 63.59 2bry s THR 228 Cb -0.19 -4.00 -0.03 0.00 0.01 0.00 0.00 72.50 68.29 2bry s THR 228 CO 0.18 0.16 0.00 -0.63 -0.69 0.00 0.00 174.62 173.64 2bry s ILE 229 N 1.47 4.29 -0.23 1.82 -1.09 -1.26 -0.10 121.20 126.10 2bry s ILE 229 Ca 0.33 -0.24 -0.10 0.00 -2.23 0.00 0.00 60.65 58.41 2bry s ILE 229 Cb -0.16 -2.84 -0.05 0.00 -1.58 0.00 0.00 42.46 37.83 2bry s ILE 229 CO 0.13 0.56 0.14 -0.13 -1.23 0.00 0.00 174.94 174.41 2bry s ARG 230 N -0.46 4.05 -0.06 2.79 0.52 0.46 -4.89 118.95 121.37 2bry s ARG 230 Ca 0.08 -0.28 0.04 0.00 -0.52 0.00 0.00 55.73 55.05 2bry s ARG 230 Cb -0.12 -3.47 0.00 0.00 0.52 0.00 0.00 34.95 31.88 2bry s ARG 230 CO 0.02 0.11 -0.17 -2.00 0.02 0.00 0.00 175.30 173.28 2bry s GLU 231 N 0.90 2.00 -0.13 3.54 2.12 -1.26 -1.28 118.70 124.60 2bry s GLU 231 Ca 0.07 -0.60 0.02 0.00 0.36 0.00 0.00 54.97 54.82 2bry s GLU 231 Cb -0.13 -1.66 0.01 0.00 0.26 0.00 0.00 34.13 32.62 2bry s GLU 231 CO 0.03 0.17 -0.19 1.41 -0.54 0.00 0.00 175.26 176.14 2bry s MET 232 N 0.28 2.69 -0.40 4.30 -2.45 -0.93 -5.01 119.30 117.78 2bry s MET 232 Ca -0.10 -0.74 -0.25 0.00 -1.25 0.00 0.00 55.69 53.36 2bry s MET 232 Cb -0.14 -2.20 0.02 0.00 1.25 0.00 0.00 34.83 33.75 2bry s MET 232 CO 0.04 -0.03 0.88 0.50 1.05 0.00 0.00 175.02 177.46 2bry s ARG 233 N 0.86 3.71 0.00 4.11 3.52 -1.26 -2.64 118.95 127.25 2bry s ARG 233 Ca -0.07 0.36 0.00 0.00 -0.13 0.00 0.00 55.73 55.89 2bry s ARG 233 Cb -0.15 -3.84 0.00 0.00 -1.56 0.00 0.00 34.95 29.39 2bry s ARG 233 CO -0.01 -1.00 0.00 0.41 -0.81 0.00 0.00 175.30 173.89 2bry n GLY 234 N 4.60 0.77 3.76 8.12 0.00 -1.19 -5.02 105.19 116.22 2bry n GLY 234 Ca 0.05 -1.87 -0.39 0.00 0.00 0.00 0.00 46.02 43.81 2bry n GLY 234 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bry s LYS 235 N 1.36 3.61 0.16 1.61 -0.14 -1.26 -4.90 119.74 120.18 2bry s LYS 235 Ca 0.00 2.34 -0.34 0.00 -1.36 0.00 0.00 55.97 56.61 2bry s LYS 235 Cb 0.00 -2.58 -0.14 0.00 -1.68 0.00 0.00 37.83 33.43 2bry s LYS 235 CO 0.00 -0.85 1.59 -0.11 -0.76 0.00 0.00 175.35 175.22 2bry n LEU 236 N -0.33 3.13 -3.77 3.17 7.94 -1.26 -4.72 117.00 121.16 2bry n LEU 236 Ca 0.06 1.08 -0.14 0.00 -1.11 0.00 0.00 56.01 55.90 2bry n LEU 236 Cb 0.43 -1.43 -0.14 0.00 0.53 0.00 0.00 43.42 42.80 2bry n LEU 236 CO 0.57 -0.27 -0.26 0.00 -1.11 0.00 0.00 177.39 176.33 2bry s ALA 237 N 0.99 -0.19 -0.20 1.96 0.00 -1.26 -4.93 121.76 118.12 2bry s ALA 237 Ca 0.79 0.54 -0.00 0.00 0.00 0.00 0.00 51.96 53.29 2bry s ALA 237 Cb -0.67 -0.37 0.02 0.00 0.00 0.00 0.00 23.12 22.10 2bry s ALA 237 CO 0.38 -0.13 -0.15 0.42 0.00 0.00 0.00 175.76 176.28 2bry s ILE 238 N 0.97 2.40 0.03 0.00 1.01 -1.21 -1.27 121.20 123.14 2bry s ILE 238 Ca -0.08 -0.91 -0.08 0.00 0.00 0.00 0.00 60.65 59.58 2bry s ILE 238 Cb -0.10 -2.08 -0.05 0.00 0.01 0.00 0.00 42.46 40.24 2bry s ILE 238 CO -0.04 0.44 0.32 -0.83 0.00 0.00 0.00 174.94 174.83 2bry s GLY 239 N 1.32 2.29 -0.04 6.18 0.00 0.35 -0.86 107.32 116.57 2bry s GLY 239 Ca 0.04 -0.49 0.02 0.00 0.00 0.00 0.00 44.72 44.28 2bry s GLY 239 CO -0.10 -0.28 -0.07 -0.42 0.00 0.00 0.00 173.10 172.24 2bry s ILE 240 N -1.31 0.67 0.09 0.90 1.01 0.03 0.58 121.20 123.17 2bry s ILE 240 Ca 0.29 -0.24 0.08 0.00 0.00 0.00 0.00 60.65 60.77 2bry s ILE 240 Cb -0.14 -0.64 -0.04 0.00 0.01 0.00 0.00 42.46 41.66 2bry s ILE 240 CO 0.16 0.24 -0.17 0.42 0.00 0.00 0.00 174.94 175.59 2bry s THR 241 N 0.58 2.92 -0.09 2.92 -4.23 -0.55 -0.94 115.64 116.26 2bry s THR 241 Ca -0.09 -1.35 -0.09 0.00 -1.18 0.00 0.00 61.69 58.98 2bry s THR 241 Cb -0.12 -2.31 0.02 0.00 1.34 0.00 0.00 72.50 71.44 2bry s THR 241 CO 0.01 0.19 0.26 0.00 -0.54 0.00 0.00 174.62 174.53 2bry s ALA 242 N -1.08 -0.64 -0.14 3.99 0.00 0.25 -1.72 121.76 122.41 2bry s ALA 242 Ca 0.17 0.71 0.02 0.00 0.00 0.00 0.00 51.96 52.86 2bry s ALA 242 Cb -0.11 -0.40 0.01 0.00 0.00 0.00 0.00 23.12 22.62 2bry s ALA 242 CO 0.09 -0.13 -0.19 -0.80 0.00 0.00 0.00 175.76 174.73 2bry s ASN 243 N 0.06 3.32 0.13 0.00 0.01 -0.15 -0.93 114.94 117.38 2bry s ASN 243 Ca -0.01 -0.55 0.06 0.00 -0.71 0.00 0.00 52.86 51.65 2bry s ASN 243 Cb -0.02 -1.49 -0.04 0.00 0.41 0.00 0.00 41.25 40.11 2bry s ASN 243 CO 0.00 0.08 0.01 -0.36 -1.51 0.00 0.00 177.10 175.33 2bry s PHE 244 N 0.80 2.94 0.24 2.20 0.08 0.89 -0.51 117.98 124.62 2bry s PHE 244 Ca -0.07 -0.07 -0.31 0.00 0.12 0.00 0.00 56.93 56.60 2bry s PHE 244 Cb -0.16 -1.47 -0.12 0.00 -0.57 0.00 0.00 43.02 40.70 2bry s PHE 244 CO -0.01 0.49 1.68 0.28 -0.10 0.00 0.00 175.22 177.56 2bry n VAL 245 N 0.24 0.39 -3.82 -0.44 0.31 0.35 -0.17 118.33 115.19 2bry n VAL 245 Ca -0.10 -0.10 -0.36 0.00 -0.01 0.00 0.00 64.34 63.77 2bry n VAL 245 Cb 0.53 -1.97 -0.13 0.00 -0.91 0.00 0.00 33.84 31.36 2bry n VAL 245 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2bry s ASN 246 N 0.91 5.13 0.00 4.52 2.47 -1.26 -4.57 114.94 122.14 2bry s ASN 246 Ca 0.71 -1.27 0.30 0.00 0.42 0.00 0.00 52.86 53.02 2bry s ASN 246 Cb -0.50 -1.80 1.44 0.00 -1.45 0.00 0.00 41.25 38.94 2bry s ASN 246 CO 0.38 -0.32 2.01 0.61 -3.72 0.00 0.00 177.10 176.07 2bry n GLY 247 N 4.71 -1.29 2.37 1.21 0.00 -1.26 -4.91 105.19 106.02 2bry n GLY 247 Ca -0.12 -0.15 -0.18 0.00 0.00 0.00 0.00 46.02 45.57 2bry n GLY 247 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bry n ARG 248 N -1.30 -1.41 -1.50 1.61 1.74 -1.26 -4.98 116.66 109.57 2bry n ARG 248 Ca 0.13 0.91 -0.32 0.00 -0.77 0.00 0.00 57.85 57.80 2bry n ARG 248 Cb 0.26 -5.37 0.07 0.00 -1.02 0.00 0.00 32.46 26.40 2bry n ARG 248 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2bry s THR 249 N -2.86 3.30 0.32 0.55 -4.23 -1.26 -4.89 115.64 106.57 2bry s THR 249 Ca 0.00 0.51 0.04 0.00 -1.18 0.00 0.00 61.69 61.05 2bry s THR 249 Cb 0.00 -3.01 0.30 0.00 1.34 0.00 0.00 72.50 71.12 2bry s THR 249 CO 0.00 -0.47 1.88 -0.37 -0.54 0.00 0.00 174.62 175.12 2bry h VAL 250 N -0.58 0.95 -0.49 2.29 -1.51 -2.00 -2.12 116.25 112.79 2bry h VAL 250 Ca -0.45 -0.31 -0.04 0.00 -1.23 0.00 0.00 66.70 64.67 2bry h VAL 250 Cb 1.24 -0.03 -0.02 0.00 -2.13 0.00 0.00 31.29 30.35 2bry h VAL 250 CO 0.53 0.16 0.15 -0.33 -1.23 0.00 0.00 177.57 176.86 2bry h GLU 251 N 0.90 0.76 -0.46 5.19 3.07 -1.97 -2.72 114.58 119.35 2bry h GLU 251 Ca 0.43 -0.16 -0.06 0.00 -0.50 0.00 0.00 59.36 59.07 2bry h GLU 251 Cb 0.45 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.23 2bry h GLU 251 CO -0.20 0.72 0.05 0.93 -1.40 0.00 0.00 179.01 179.11 2bry h GLU 252 N 0.66 0.73 0.00 2.33 5.08 -1.69 -2.79 114.58 118.90 2bry h GLU 252 Ca 0.16 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2bry h GLU 252 Cb 0.27 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 2bry h GLU 252 CO -0.01 0.70 -0.09 1.79 -1.00 0.00 0.00 179.01 180.40 2bry h THR 253 N 0.69 0.44 0.00 1.13 1.35 -1.10 -2.72 112.91 112.70 2bry h THR 253 Ca 0.15 -0.48 -0.04 0.00 -0.55 0.00 0.00 66.41 65.49 2bry h THR 253 Cb 0.35 1.33 -0.01 0.00 -1.73 0.00 0.00 68.15 68.10 2bry h THR 253 CO 0.01 0.09 -0.18 1.56 -0.25 0.00 0.00 175.52 176.75 2bry h GLN 254 N 0.00 0.00 -6.28 4.72 4.20 -1.44 -3.44 115.11 112.88 2bry h GLN 254 Ca -0.00 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.14 2bry h GLN 254 Cb 0.33 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 2bry h GLN 254 CO 0.01 0.18 1.12 0.08 -0.67 0.00 0.00 178.83 179.55 2bry s VAL 255 N -3.74 3.71 0.49 -0.54 1.01 -1.03 -4.95 120.40 115.35 2bry s VAL 255 Ca 0.00 0.80 -0.22 0.00 0.00 0.00 0.00 61.98 62.56 2bry s VAL 255 Cb 0.10 -3.71 -0.06 0.00 0.00 0.00 0.00 36.38 32.71 2bry s VAL 255 CO 0.61 -0.29 1.23 -2.84 0.00 0.00 0.00 175.10 173.82 2bry s PRO 256 N 4.63 3.52 0.88 2.72 0.02 -1.26 -5.01 135.00 140.50 2bry s PRO 256 Ca 0.71 1.93 -0.11 0.00 0.02 0.00 0.00 61.00 63.55 2bry s PRO 256 Cb -0.25 -2.34 0.12 0.00 0.02 0.00 0.00 34.50 32.05 2bry s PRO 256 CO 0.29 -0.79 1.09 -1.21 -0.33 0.00 0.00 177.00 176.05 2bry s GLU 257 N -2.79 1.37 -0.25 5.54 2.02 -1.26 -5.03 118.70 118.29 2bry s GLU 257 Ca 0.67 0.86 0.01 0.00 0.02 0.00 0.00 54.97 56.53 2bry s GLU 257 Cb -0.33 -1.82 0.06 0.00 0.10 0.00 0.00 34.13 32.15 2bry s GLU 257 CO 0.39 -2.18 -0.05 0.42 0.02 0.00 0.00 175.26 173.86 2bry s ILE 258 N -2.93 1.66 0.19 -1.63 1.01 -0.55 -4.95 121.20 113.99 2bry s ILE 258 Ca 0.63 -1.36 0.15 0.00 0.00 0.00 0.00 60.65 60.08 2bry s ILE 258 Cb -0.18 -1.92 0.06 0.00 0.01 0.00 0.00 42.46 40.43 2bry s ILE 258 CO 0.57 -0.13 1.66 0.77 0.00 0.00 0.00 174.94 177.80 2bry h SER 259 N 7.91 0.00 0.00 3.58 4.64 -1.87 -0.17 113.55 127.64 2bry h SER 259 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 2bry h SER 259 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 2bry h SER 259 CO 0.43 0.49 0.00 0.61 -0.87 0.00 0.00 176.83 177.49 2bry n GLY 260 N 0.33 -1.44 3.48 -0.77 0.00 -1.25 -4.86 105.19 100.67 2bry n GLY 260 Ca -0.00 -1.04 -0.39 0.00 0.00 0.00 0.00 46.02 44.59 2bry n GLY 260 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2bry s TYR 265 N -2.82 3.19 -0.47 1.61 6.04 -1.26 -4.06 117.35 119.58 2bry s TYR 265 Ca 0.00 -0.39 0.09 0.00 0.04 0.00 0.00 57.07 56.81 2bry s TYR 265 Cb 0.00 -2.38 0.56 0.00 -1.04 0.00 0.00 41.96 39.10 2bry s TYR 265 CO 0.00 -0.39 1.37 0.09 -1.54 0.00 0.00 175.55 175.08 2bry n ASN 266 N 5.02 4.21 -4.16 4.32 3.02 -1.26 -4.94 115.26 121.46 2bry n ASN 266 Ca -0.14 -2.66 -0.10 0.00 -0.03 0.00 0.00 54.58 51.65 2bry n ASN 266 Cb 0.50 -0.63 -0.10 0.00 -0.61 0.00 0.00 39.78 38.93 2bry n ASN 266 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2bry s GLN 267 N -2.21 0.80 0.11 3.52 1.11 -1.26 -4.99 119.66 116.74 2bry s GLN 267 Ca 0.37 -1.31 0.27 0.00 0.01 0.00 0.00 55.36 54.71 2bry s GLN 267 Cb 0.29 -0.16 1.02 0.00 -1.01 0.00 0.00 33.01 33.15 2bry s GLN 267 CO 0.11 -0.03 1.85 1.63 0.01 0.00 0.00 175.29 178.86 2bry n LYS 268 N 0.01 0.13 -0.20 2.91 4.01 -1.26 -4.15 118.16 119.61 2bry n LYS 268 Ca -0.13 0.11 -0.03 0.00 -0.51 0.00 0.00 58.31 57.76 2bry n LYS 268 Cb 0.61 -1.65 0.08 0.00 -0.51 0.00 0.00 35.03 33.55 2bry n LYS 268 CO 0.00 0.00 0.00 0.35 -1.11 0.00 0.00 177.40 176.64 2bry h PHE 269 N 0.00 0.54 -0.03 2.13 3.57 -1.99 -2.32 116.94 118.83 2bry h PHE 269 Ca 0.00 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.40 2bry h PHE 269 Cb 0.62 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 2bry h PHE 269 CO 0.00 0.25 -0.53 0.74 -2.23 0.00 0.00 178.31 176.53 2bry h PHE 270 N 0.56 0.12 -0.09 0.41 0.04 -1.94 0.72 116.94 116.75 2bry h PHE 270 Ca 0.26 -0.04 -0.02 0.00 2.80 0.00 0.00 57.97 60.97 2bry h PHE 270 Cb 0.19 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.31 2bry h PHE 270 CO -0.10 0.61 -0.02 1.96 -0.60 0.00 0.00 178.31 180.15 2bry h GLN 271 N 0.08 0.17 -0.17 1.51 4.20 -1.78 -1.97 115.11 117.14 2bry h GLN 271 Ca -0.00 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.59 2bry h GLN 271 Cb 0.97 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.73 2bry h GLN 271 CO 0.07 0.49 -0.12 0.66 -0.67 0.00 0.00 178.83 179.26 2bry h SER 272 N -0.17 0.26 -0.07 1.46 4.64 -1.13 0.02 113.55 118.57 2bry h SER 272 Ca 0.02 -0.06 -0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2bry h SER 272 Cb 0.43 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2bry h SER 272 CO 0.01 0.42 0.04 0.25 -0.87 0.00 0.00 176.83 176.67 2bry h LEU 273 N 0.26 0.09 -1.04 5.97 5.85 -0.89 -2.72 115.31 122.84 2bry h LEU 273 Ca 0.05 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 2bry h LEU 273 Cb 0.39 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 2bry h LEU 273 CO 0.02 0.19 0.44 0.25 -0.34 0.00 0.00 178.44 179.00 2bry h LEU 274 N -0.00 0.99 0.13 2.25 5.85 -0.51 -2.08 115.31 121.94 2bry h LEU 274 Ca 0.02 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 2bry h LEU 274 Cb 0.12 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.89 2bry h LEU 274 CO -0.00 0.80 -0.06 0.50 -0.34 0.00 0.00 178.44 179.33 2bry h LYS 275 N 1.12 -0.17 -0.15 1.25 3.11 -1.04 -0.02 116.57 120.66 2bry h LYS 275 Ca 0.28 0.01 -0.11 0.00 -2.81 0.00 0.00 60.65 58.03 2bry h LYS 275 Cb 0.02 0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 31.28 2bry h LYS 275 CO -0.05 0.07 -0.38 0.00 -2.81 0.00 0.00 179.45 176.28 2bry h ALA 276 N 0.43 1.08 0.00 5.00 0.00 -1.35 -3.37 119.26 121.05 2bry h ALA 276 Ca -0.02 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2bry h ALA 276 Cb 0.32 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2bry h ALA 276 CO 0.03 0.59 -0.79 0.25 0.00 0.00 0.00 179.25 179.33 2bry n THR 277 N -4.05 0.00 -0.78 0.00 -2.24 -0.79 -5.01 114.28 101.42 2bry n THR 277 Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 2bry n THR 277 Cb 0.47 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.69 2bry n THR 277 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bry n GLY 278 N 2.14 0.64 3.63 3.38 0.00 -0.02 -5.04 105.19 109.91 2bry n GLY 278 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2bry n GLY 278 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bry s ILE 279 N -2.14 4.93 -0.44 -0.61 -1.09 -1.26 -4.84 121.20 115.75 2bry s ILE 279 Ca 0.00 1.22 -0.09 0.00 -2.23 0.00 0.00 60.65 59.55 2bry s ILE 279 Cb 0.00 -4.00 0.10 0.00 -1.58 0.00 0.00 42.46 36.98 2bry s ILE 279 CO 0.00 -0.03 0.30 -0.62 -1.23 0.00 0.00 174.94 173.36 2bry s ASP 280 N 1.47 5.67 0.14 3.58 2.15 -1.26 -2.92 116.67 125.50 2bry s ASP 280 Ca 0.29 -1.70 0.07 0.00 0.43 0.00 0.00 52.55 51.64 2bry s ASP 280 Cb -0.15 -2.00 -0.04 0.00 -0.30 0.00 0.00 42.92 40.43 2bry s ASP 280 CO 0.09 -0.61 -0.01 -0.76 -0.17 0.00 0.00 175.17 173.70 2bry s LEU 281 N 1.40 3.32 -0.19 -1.34 1.43 -1.26 -2.07 118.68 119.97 2bry s LEU 281 Ca 0.04 -0.33 0.10 0.00 -1.03 0.00 0.00 54.13 52.91 2bry s LEU 281 Cb -0.25 -2.02 -0.22 0.00 0.03 0.00 0.00 46.19 43.74 2bry s LEU 281 CO 0.01 0.12 0.08 -0.62 0.23 0.00 0.00 176.35 176.17 2bry n GLU 282 N 0.17 0.68 -3.60 1.70 1.02 0.71 -4.87 120.64 116.44 2bry n GLU 282 Ca -0.10 0.11 -0.12 0.00 -0.02 0.00 0.00 57.16 57.02 2bry n GLU 282 Cb 0.54 -1.58 -0.05 0.00 -0.02 0.00 0.00 31.44 30.33 2bry n GLU 282 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2bry s ASN 283 N -6.05 -0.35 -0.00 1.62 2.20 -1.24 -4.46 114.94 106.66 2bry s ASN 283 Ca -0.18 -0.05 -0.03 0.00 -0.94 0.00 0.00 52.86 51.65 2bry s ASN 283 Cb 0.07 0.48 -0.00 0.00 -2.00 0.00 0.00 41.25 39.80 2bry s ASN 283 CO 0.75 -0.77 0.06 -0.51 -2.94 0.00 0.00 177.10 173.68 2bry s ILE 284 N -3.03 0.06 -0.02 0.54 2.07 -1.26 -1.91 121.20 117.66 2bry s ILE 284 Ca -0.02 -0.53 0.02 0.00 -1.41 0.00 0.00 60.65 58.71 2bry s ILE 284 Cb 0.00 -0.27 0.00 0.00 0.13 0.00 0.00 42.46 42.33 2bry s ILE 284 CO -0.06 -0.29 -0.08 -0.69 -1.91 0.00 0.00 174.94 171.91 2bry s VAL 285 N -0.92 0.67 -0.14 4.00 1.01 0.60 -3.96 120.40 121.66 2bry s VAL 285 Ca -0.10 -0.31 -0.00 0.00 0.00 0.00 0.00 61.98 61.57 2bry s VAL 285 Cb -0.06 -0.60 0.03 0.00 0.00 0.00 0.00 36.38 35.75 2bry s VAL 285 CO 0.00 0.21 -0.08 -0.47 0.00 0.00 0.00 175.10 174.77 2bry s TYR 286 N 0.18 1.68 -0.13 5.22 5.04 -0.08 -1.71 117.35 127.55 2bry s TYR 286 Ca -0.02 -0.94 -0.02 0.00 -2.44 0.00 0.00 57.07 53.65 2bry s TYR 286 Cb -0.08 -1.32 -0.02 0.00 0.35 0.00 0.00 41.96 40.89 2bry s TYR 286 CO 0.00 -0.58 -0.08 0.71 -1.34 0.00 0.00 175.55 174.26 2bry s TYR 287 N 1.64 2.92 -0.72 4.97 2.02 -0.35 -1.48 117.35 126.34 2bry s TYR 287 Ca 0.03 -0.42 -0.18 0.00 -0.37 0.00 0.00 57.07 56.13 2bry s TYR 287 Cb -0.14 -1.88 0.13 0.00 -0.40 0.00 0.00 41.96 39.67 2bry s TYR 287 CO -0.08 -0.08 0.84 0.21 -1.57 0.00 0.00 175.55 174.87 2bry s LYS 288 N 0.24 3.29 0.00 -0.62 2.20 -1.26 -1.43 119.74 122.15 2bry s LYS 288 Ca -0.06 -1.60 0.00 0.00 -0.36 0.00 0.00 55.97 53.96 2bry s LYS 288 Cb -0.15 -4.45 0.00 0.00 -1.51 0.00 0.00 37.83 31.72 2bry s LYS 288 CO 0.04 -1.58 0.00 -3.47 -0.36 0.00 0.00 175.35 169.98 2bry n ASP 289 N 6.07 0.00 0.22 1.43 2.03 -1.26 -4.98 116.55 120.06 2bry n ASP 289 Ca 0.03 0.00 0.07 0.00 0.52 0.00 0.00 54.79 55.41 2bry n ASP 289 Cb 0.45 0.00 0.51 0.00 -0.72 0.00 0.00 41.12 41.36 2bry n ASP 289 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2bry h GLU 290 N 0.00 0.00 -5.83 -0.67 4.39 -1.94 -3.42 114.58 107.11 2bry h GLU 290 Ca 0.00 0.00 -0.60 0.00 0.34 0.00 0.00 59.36 59.10 2bry h GLU 290 Cb 0.00 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 28.52 2bry h GLU 290 CO 0.00 0.24 -0.67 0.95 -1.16 0.00 0.00 179.01 178.38 2bry s THR 291 N -4.27 2.11 -0.58 1.13 -4.23 -1.26 -4.14 115.64 104.40 2bry s THR 291 Ca -0.03 -2.16 -0.27 0.00 -1.18 0.00 0.00 61.69 58.05 2bry s THR 291 Cb 0.14 -2.68 0.03 0.00 1.34 0.00 0.00 72.50 71.34 2bry s THR 291 CO 0.67 -0.18 1.12 -1.00 -0.54 0.00 0.00 174.62 174.69 2bry s HIS 292 N -2.69 2.65 -0.12 3.99 3.76 0.76 -4.58 115.29 119.07 2bry s HIS 292 Ca 0.33 0.26 -0.05 0.00 -0.15 0.00 0.00 55.06 55.45 2bry s HIS 292 Cb 0.04 -4.38 -0.04 0.00 1.11 0.00 0.00 32.58 29.31 2bry s HIS 292 CO 0.16 -1.53 0.05 -0.47 -0.85 0.00 0.00 174.74 172.10 2bry s TYR 293 N 4.67 3.28 -0.01 1.40 5.04 -0.52 -0.08 117.35 131.14 2bry s TYR 293 Ca 0.39 0.22 0.03 0.00 -2.44 0.00 0.00 57.07 55.27 2bry s TYR 293 Cb -0.09 -1.91 -0.01 0.00 0.35 0.00 0.00 41.96 40.31 2bry s TYR 293 CO 0.23 0.43 -0.11 -0.06 -1.34 0.00 0.00 175.55 174.70 2bry s PHE 294 N -0.55 1.03 -0.02 4.97 0.08 -0.10 -1.21 117.98 122.17 2bry s PHE 294 Ca 0.10 -0.20 0.04 0.00 0.12 0.00 0.00 56.93 56.98 2bry s PHE 294 Cb -0.12 -0.67 -0.00 0.00 -0.57 0.00 0.00 43.02 41.66 2bry s PHE 294 CO 0.02 -0.03 -0.13 0.54 -0.10 0.00 0.00 175.22 175.52 2bry s VAL 295 N -0.20 1.03 0.05 -0.44 0.11 -0.70 -0.58 120.40 119.67 2bry s VAL 295 Ca 0.03 -0.52 -0.07 0.00 -2.93 0.00 0.00 61.98 58.49 2bry s VAL 295 Cb -0.05 -0.88 -0.01 0.00 -1.53 0.00 0.00 36.38 33.91 2bry s VAL 295 CO -0.00 0.30 0.14 0.00 -3.33 0.00 0.00 175.10 172.21 2bry s MET 296 N -0.06 0.69 -0.18 1.54 0.23 -0.11 -0.29 119.30 121.11 2bry s MET 296 Ca 0.00 -0.82 -0.00 0.00 -1.03 0.00 0.00 55.69 53.84 2bry s MET 296 Cb -0.08 0.28 0.01 0.00 -1.53 0.00 0.00 34.83 33.51 2bry s MET 296 CO 0.00 -0.19 -0.15 0.99 -2.03 0.00 0.00 175.02 173.64 2bry s THR 297 N -3.06 2.55 0.11 3.16 2.01 -0.80 -0.79 115.64 118.82 2bry s THR 297 Ca -0.01 -0.78 0.07 0.00 0.31 0.00 0.00 61.69 61.28 2bry s THR 297 Cb 0.01 -2.10 -0.04 0.00 0.01 0.00 0.00 72.50 70.38 2bry s THR 297 CO -0.07 0.50 -0.11 0.00 -0.69 0.00 0.00 174.62 174.26 2bry s ALA 298 N 1.18 2.92 0.18 7.40 0.00 -0.04 -0.21 121.76 133.20 2bry s ALA 298 Ca 0.02 -1.27 -0.25 0.00 0.00 0.00 0.00 51.96 50.46 2bry s ALA 298 Cb -0.14 -0.86 -0.08 0.00 0.00 0.00 0.00 23.12 22.04 2bry s ALA 298 CO -0.06 0.63 0.79 0.15 0.00 0.00 0.00 175.76 177.26 2bry s LYS 299 N -2.23 4.56 0.31 0.00 -0.14 -0.88 -3.31 119.74 118.05 2bry s LYS 299 Ca 0.21 1.16 0.02 0.00 -1.36 0.00 0.00 55.97 56.00 2bry s LYS 299 Cb -0.11 -3.21 0.58 0.00 -1.68 0.00 0.00 37.83 33.41 2bry s LYS 299 CO 0.13 0.54 1.89 -0.22 -0.76 0.00 0.00 175.35 176.94 2bry h LYS 300 N 4.19 0.94 -0.64 1.68 3.64 -1.91 -2.90 116.57 121.56 2bry h LYS 300 Ca -0.47 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 58.81 2bry h LYS 300 Cb 1.20 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.78 2bry h LYS 300 CO 0.66 0.62 0.23 0.37 -2.27 0.00 0.00 179.45 179.06 2bry h GLN 301 N 0.97 0.96 0.00 1.90 5.75 -1.97 -0.71 115.11 122.01 2bry h GLN 301 Ca 0.41 -0.17 -0.13 0.00 -0.15 0.00 0.00 58.65 58.62 2bry h GLN 301 Cb 0.32 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.70 2bry h GLN 301 CO -0.17 0.81 -0.60 0.00 -2.65 0.00 0.00 178.83 176.22 2bry h LEU 303 N 0.00 0.71 -0.41 0.00 3.38 -1.22 0.37 115.31 118.14 2bry h LEU 303 Ca -0.01 -0.31 -0.05 0.00 0.09 0.00 0.00 57.88 57.60 2bry h LEU 303 Cb 1.12 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 2bry h LEU 303 CO 0.08 0.84 0.05 -0.07 0.09 0.00 0.00 178.44 179.43 2bry h LEU 304 N 0.55 0.67 -0.77 1.67 3.38 -1.18 -1.43 115.31 118.19 2bry h LEU 304 Ca 0.12 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.77 2bry h LEU 304 Cb 0.48 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 2bry h LEU 304 CO 0.02 0.77 0.32 -0.09 0.09 0.00 0.00 178.44 179.55 2bry h ARG 305 N 0.54 1.15 -0.34 1.13 2.43 -1.26 -2.94 114.38 115.09 2bry h ARG 305 Ca 0.12 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 2bry h ARG 305 Cb 0.40 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2bry h ARG 305 CO 0.01 0.93 0.00 1.28 -1.51 0.00 0.00 179.97 180.68 2bry n LEU 306 N -4.31 2.01 0.00 3.80 4.77 0.11 -4.94 117.00 118.44 2bry n LEU 306 Ca 0.07 -0.97 0.00 0.00 -0.03 0.00 0.00 56.01 55.07 2bry n LEU 306 Cb 0.18 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 2bry n LEU 306 CO 0.40 0.49 0.00 0.61 -1.33 0.00 0.00 177.39 177.56 2bry n GLY 307 N 1.12 0.69 0.25 -0.72 0.00 -1.10 -4.92 105.19 100.51 2bry n GLY 307 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 2bry n GLY 307 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2bry h VAL 308 N 0.00 1.28 -3.35 1.61 2.07 -1.52 -3.42 116.25 112.92 2bry h VAL 308 Ca 0.00 -1.51 -0.65 0.00 0.82 0.00 0.00 66.70 65.36 2bry h VAL 308 Cb 0.00 1.41 -0.23 0.00 -1.52 0.00 0.00 31.29 30.94 2bry h VAL 308 CO 0.00 0.50 -0.71 -0.76 0.02 0.00 0.00 177.57 176.62 2bry s LEU 309 N -8.93 3.03 0.05 2.57 1.43 -1.08 -0.98 118.68 114.76 2bry s LEU 309 Ca -0.11 -0.20 -0.18 0.00 -1.03 0.00 0.00 54.13 52.61 2bry s LEU 309 Cb 0.11 -1.70 -0.15 0.00 0.03 0.00 0.00 46.19 44.47 2bry s LEU 309 CO 0.87 0.19 1.30 0.03 0.23 0.00 0.00 176.35 178.97 2bry h ARG 310 N 6.55 0.51 -4.84 1.70 3.08 -0.48 -3.41 114.38 117.50 2bry h ARG 310 Ca -0.31 -0.34 -0.38 0.00 0.07 0.00 0.00 59.98 59.03 2bry h ARG 310 Cb 1.20 0.05 -0.26 0.00 0.08 0.00 0.00 29.97 31.04 2bry h ARG 310 CO 0.59 0.95 -0.77 -0.65 -1.07 0.00 0.00 179.97 179.02 2bry s GLN 311 N -4.00 0.71 -1.16 0.04 -0.21 -1.26 -5.08 119.66 108.70 2bry s GLN 311 Ca -0.13 -0.55 -0.21 0.00 0.02 0.00 0.00 55.36 54.49 2bry s GLN 311 Cb 0.06 -0.66 0.05 0.00 1.00 0.00 0.00 33.01 33.47 2bry s GLN 311 CO 0.81 0.16 1.62 0.34 -2.12 0.00 0.00 175.29 176.10 2bry s ASP 312 N -0.82 6.59 -0.12 5.90 -1.08 -1.26 -4.90 116.67 120.98 2bry s ASP 312 Ca -0.00 -1.93 -0.13 0.00 -0.52 0.00 0.00 52.55 49.97 2bry s ASP 312 Cb -0.06 -2.58 -0.05 0.00 -1.46 0.00 0.00 42.92 38.78 2bry s ASP 312 CO 0.00 -1.42 0.30 -0.76 0.52 0.00 0.00 175.17 173.81 2bry s LEU 313 N 4.92 4.31 0.35 -1.34 1.43 -1.26 -4.99 118.68 122.10 2bry s LEU 313 Ca 0.51 0.60 0.12 0.00 -1.03 0.00 0.00 54.13 54.34 2bry s LEU 313 Cb 0.02 -2.38 0.66 0.00 0.03 0.00 0.00 46.19 44.52 2bry s LEU 313 CO -0.00 0.19 1.79 0.77 0.23 0.00 0.00 176.35 179.32 2bry h SER 314 N 6.02 0.00 -3.30 2.29 4.64 -2.00 -3.41 113.55 117.79 2bry h SER 314 Ca -0.45 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.29 2bry h SER 314 Cb 1.19 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.20 2bry h SER 314 CO 0.70 0.42 0.41 -1.61 -0.87 0.00 0.00 176.83 175.88 2bry s GLU 315 N -4.08 4.28 0.30 4.77 0.41 -1.26 -4.96 118.70 118.16 2bry s GLU 315 Ca -0.02 1.01 -0.00 0.00 -0.41 0.00 0.00 54.97 55.54 2bry s GLU 315 Cb 0.14 -3.59 0.50 0.00 -1.78 0.00 0.00 34.13 29.40 2bry s GLU 315 CO 0.73 -0.37 1.94 1.15 -0.49 0.00 0.00 175.26 178.22 2bry h THR 316 N 5.24 1.13 0.00 3.63 2.02 -1.99 0.18 112.91 123.12 2bry h THR 316 Ca -0.28 -0.37 -0.07 0.00 0.77 0.00 0.00 66.41 66.46 2bry h THR 316 Cb 1.12 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 2bry h THR 316 CO 0.85 0.19 -0.34 -2.24 0.37 0.00 0.00 175.52 174.35 2bry h ASP 317 N 1.07 0.00 0.00 4.18 2.03 -1.95 -1.00 116.42 120.74 2bry h ASP 317 Ca 0.35 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.62 2bry h ASP 317 Cb 0.06 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.56 2bry h ASP 317 CO -0.11 0.34 -0.11 1.56 -1.03 0.00 0.00 179.24 179.89 2bry h GLN 318 N 0.00 0.07 -0.79 4.15 4.20 -1.82 -2.27 115.11 118.65 2bry h GLN 318 Ca -0.00 -0.08 0.19 0.00 0.06 0.00 0.00 58.65 58.82 2bry h GLN 318 Cb 0.95 0.02 -0.13 0.00 0.30 0.00 0.00 27.48 28.62 2bry h GLN 318 CO 0.04 0.89 0.14 1.25 -0.67 0.00 0.00 178.83 180.48 2bry h LEU 319 N -0.72 -0.10 -2.72 1.46 5.85 -0.76 -1.03 115.31 117.29 2bry h LEU 319 Ca -0.01 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.88 2bry h LEU 319 Cb 0.93 0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.22 2bry h LEU 319 CO 0.02 -0.12 0.00 0.18 -0.34 0.00 0.00 178.44 178.18 2bry n LEU 320 N -5.24 3.61 -4.75 2.25 4.77 -0.40 -4.59 117.00 112.66 2bry n LEU 320 Ca 0.16 -1.93 -0.32 0.00 -0.03 0.00 0.00 56.01 53.89 2bry n LEU 320 Cb 0.54 -0.39 0.09 0.00 -2.33 0.00 0.00 43.42 41.32 2bry n LEU 320 CO 0.08 0.89 0.72 -0.83 -1.33 0.00 0.00 177.39 176.92 2bry s GLY 321 N -1.05 1.91 0.45 -0.72 0.00 -0.39 -4.87 107.32 102.65 2bry s GLY 321 Ca 0.41 0.48 0.21 0.00 0.00 0.00 0.00 44.72 45.81 2bry s GLY 321 CO 0.28 0.84 1.88 1.70 0.00 0.00 0.00 173.10 177.80 2bry h LYS 322 N -0.76 0.29 0.00 2.90 3.64 -1.88 -1.61 116.57 119.15 2bry h LYS 322 Ca -0.45 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 58.83 2bry h LYS 322 Cb 1.25 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.99 2bry h LYS 322 CO 0.51 0.19 -0.41 0.00 -2.27 0.00 0.00 179.45 177.47 2bry h ALA 323 N 1.61 0.99 0.00 5.00 0.00 -1.92 -3.27 119.26 121.68 2bry h ALA 323 Ca 0.44 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2bry h ALA 323 Cb 1.24 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2bry h ALA 323 CO -0.13 0.52 -0.94 -1.71 0.00 0.00 0.00 179.25 176.98 2bry n ASN 324 N -3.57 0.83 -4.59 0.00 5.15 -0.62 -4.88 115.26 107.58 2bry n ASN 324 Ca -0.00 -0.76 -0.36 0.00 -0.60 0.00 0.00 54.58 52.85 2bry n ASN 324 Cb 0.53 0.88 -0.11 0.00 -0.53 0.00 0.00 39.78 40.55 2bry n ASN 324 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2bry s VAL 325 N -3.03 5.01 -0.38 3.44 1.01 -1.15 0.25 120.40 125.55 2bry s VAL 325 Ca 0.08 0.06 -0.19 0.00 0.00 0.00 0.00 61.98 61.92 2bry s VAL 325 Cb 0.16 -3.33 0.01 0.00 0.00 0.00 0.00 36.38 33.21 2bry s VAL 325 CO 0.83 0.35 0.58 -0.69 0.00 0.00 0.00 175.10 176.17 2bry s VAL 326 N 1.19 4.93 0.28 2.92 1.01 -0.16 -4.96 120.40 125.62 2bry s VAL 326 Ca 0.06 0.30 -0.03 0.00 0.00 0.00 0.00 61.98 62.32 2bry s VAL 326 Cb -0.14 -4.07 0.23 0.00 0.00 0.00 0.00 36.38 32.40 2bry s VAL 326 CO 0.05 -0.36 1.92 -0.65 0.00 0.00 0.00 175.10 176.06 2bry h PRO 327 N 8.59 1.07 -0.66 2.72 0.11 -1.95 -1.05 132.00 140.84 2bry h PRO 327 Ca -0.27 -0.10 -0.08 0.00 0.11 0.00 0.00 66.00 65.66 2bry h PRO 327 Cb 1.11 -0.22 -0.03 0.00 0.11 0.00 0.00 31.00 31.97 2bry h PRO 327 CO 0.83 0.76 0.09 0.93 -0.21 0.00 0.00 178.00 180.39 2bry h GLU 328 N 1.09 1.11 -0.23 1.05 4.39 -1.97 -1.36 114.58 118.66 2bry h GLU 328 Ca 0.28 -0.31 -0.18 0.00 0.34 0.00 0.00 59.36 59.50 2bry h GLU 328 Cb -0.02 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.50 2bry h GLU 328 CO -0.05 1.03 -0.56 0.00 -1.16 0.00 0.00 179.01 178.26 2bry h ALA 329 N 1.04 0.57 -0.69 3.43 0.00 -1.76 -1.99 119.26 119.85 2bry h ALA 329 Ca 0.20 -0.52 0.02 0.00 0.00 0.00 0.00 54.91 54.60 2bry h ALA 329 Cb 0.47 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 2bry h ALA 329 CO 0.02 0.69 0.45 1.25 0.00 0.00 0.00 179.25 181.65 2bry h LEU 330 N 0.55 0.76 0.05 0.00 5.85 -1.10 -0.59 115.31 120.81 2bry h LEU 330 Ca 0.01 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2bry h LEU 330 Cb 1.14 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.99 2bry h LEU 330 CO 0.12 0.54 -0.06 1.56 -0.34 0.00 0.00 178.44 180.26 2bry h GLN 331 N 0.90 -0.12 -0.81 1.25 4.20 -1.14 0.05 115.11 119.43 2bry h GLN 331 Ca 0.26 0.01 0.03 0.00 0.06 0.00 0.00 58.65 59.01 2bry h GLN 331 Cb -0.06 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 27.70 2bry h GLN 331 CO -0.08 -0.08 0.52 0.00 -0.67 0.00 0.00 178.83 178.53 2bry h ARG 332 N -0.13 0.99 0.31 1.46 3.08 -1.17 -1.04 114.38 117.89 2bry h ARG 332 Ca 0.01 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 2bry h ARG 332 Cb 0.13 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 29.96 2bry h ARG 332 CO -0.03 0.66 -0.15 0.35 -1.07 0.00 0.00 179.97 179.73 2bry h PHE 333 N 1.02 -0.39 -0.55 3.04 3.57 -0.91 0.02 116.94 122.74 2bry h PHE 333 Ca 0.32 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.76 2bry h PHE 333 Cb -0.00 0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 2bry h PHE 333 CO -0.03 -0.24 0.15 0.00 -2.23 0.00 0.00 178.31 175.97 2bry h ALA 334 N 0.27 0.72 -0.55 2.41 0.00 -0.84 -1.76 119.26 119.51 2bry h ALA 334 Ca -0.04 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 2bry h ALA 334 Cb 0.33 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2bry h ALA 334 CO 0.07 0.40 -0.04 -0.09 0.00 0.00 0.00 179.25 179.60 2bry h ARG 335 N 0.77 1.00 -0.67 0.00 2.43 -1.10 -1.06 114.38 115.74 2bry h ARG 335 Ca 0.18 -0.34 -0.06 0.00 -0.81 0.00 0.00 59.98 58.95 2bry h ARG 335 Cb 0.31 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 2bry h ARG 335 CO -0.00 1.02 0.18 0.00 -1.51 0.00 0.00 179.97 179.66 2bry h ALA 336 N 0.95 0.89 -0.26 2.80 0.00 -0.81 0.16 119.26 122.99 2bry h ALA 336 Ca 0.15 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2bry h ALA 336 Cb 0.59 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2bry h ALA 336 CO 0.04 0.59 -0.07 0.00 0.00 0.00 0.00 179.25 179.81 2bry h ALA 337 N 1.08 0.36 -0.23 0.00 0.00 -1.18 -1.48 119.26 117.80 2bry h ALA 337 Ca 0.21 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2bry h ALA 337 Cb 0.34 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2bry h ALA 337 CO -0.00 0.17 0.07 0.00 0.00 0.00 0.00 179.25 179.49 2bry h ALA 338 N 0.76 0.31 -0.39 0.00 0.00 -1.01 0.11 119.26 119.04 2bry h ALA 338 Ca 0.06 -0.14 0.07 0.00 0.00 0.00 0.00 54.91 54.90 2bry h ALA 338 Cb 0.55 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.18 2bry h ALA 338 CO 0.03 -0.06 -0.05 0.22 0.00 0.00 0.00 179.25 179.38 2bry h ASP 339 N 0.20 -0.27 -0.15 0.00 3.58 -0.70 -1.85 116.42 117.23 2bry h ASP 339 Ca 0.07 0.10 -0.02 0.00 0.42 0.00 0.00 57.03 57.61 2bry h ASP 339 Cb 0.25 0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.49 2bry h ASP 339 CO -0.00 -0.09 0.01 0.15 -2.88 0.00 0.00 179.24 176.43 2bry h PHE 340 N 0.04 0.28 -0.87 0.28 3.57 -0.95 -1.10 116.94 118.20 2bry h PHE 340 Ca 0.19 -0.05 0.13 0.00 3.53 0.00 0.00 57.97 61.77 2bry h PHE 340 Cb 0.28 -0.08 -0.07 0.00 2.79 0.00 0.00 35.95 38.88 2bry h PHE 340 CO -0.31 0.46 0.56 0.00 -2.23 0.00 0.00 178.31 176.80 2bry h ALA 341 N 0.79 1.80 -0.57 2.41 0.00 -0.62 -1.80 119.26 121.26 2bry h ALA 341 Ca 0.04 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2bry h ALA 341 Cb 0.34 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2bry h ALA 341 CO 0.01 -0.02 0.00 0.25 0.00 0.00 0.00 179.25 179.49 2bry n THR 342 N -4.54 1.68 -2.55 0.00 -2.24 -0.71 -4.96 114.28 100.95 2bry n THR 342 Ca 0.16 -1.23 -0.17 0.00 -2.27 0.00 0.00 64.05 60.55 2bry n THR 342 Cb 0.42 0.18 -0.00 0.00 -2.10 0.00 0.00 70.33 68.83 2bry n THR 342 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2bry n HIS 343 N 0.90 -1.36 -0.91 4.78 -0.00 -0.68 -1.49 115.22 116.47 2bry n HIS 343 Ca 0.23 0.08 0.00 0.00 -0.00 0.00 0.00 57.72 58.03 2bry n HIS 343 Cb 0.79 -3.34 0.00 0.00 -0.00 0.00 0.00 29.99 27.45 2bry n HIS 343 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2bry n GLY 344 N -0.97 0.61 0.00 -1.41 0.00 -0.50 -4.88 105.19 98.04 2bry n GLY 344 Ca -0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.98 2bry n GLY 344 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2bry n LYS 345 N -1.97 0.22 -0.02 1.61 4.76 -0.56 -1.60 118.16 120.59 2bry n LYS 345 Ca 0.00 0.05 0.13 0.00 -2.87 0.00 0.00 58.31 55.62 2bry n LYS 345 Cb 0.04 -1.50 0.54 0.00 -1.84 0.00 0.00 35.03 32.27 2bry n LYS 345 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2bry n LEU 346 N -1.37 1.24 0.00 -0.35 4.77 -1.26 -4.74 117.00 115.28 2bry n LEU 346 Ca 0.10 -0.46 0.00 0.00 -0.03 0.00 0.00 56.01 55.62 2bry n LEU 346 Cb 0.24 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 2bry n LEU 346 CO 0.21 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 2bry n GLY 347 N 1.11 0.16 3.61 -0.72 0.00 -0.63 -4.62 105.19 104.11 2bry n GLY 347 Ca 0.18 -0.93 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 2bry n GLY 347 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2bry s LYS 348 N 0.00 3.70 0.07 1.61 2.20 -1.26 -4.96 119.74 121.09 2bry s LYS 348 Ca 0.00 1.14 -0.31 0.00 -0.36 0.00 0.00 55.97 56.45 2bry s LYS 348 Cb 0.00 -3.99 -0.06 0.00 -1.51 0.00 0.00 37.83 32.28 2bry s LYS 348 CO 0.00 -1.41 1.18 -0.51 -0.36 0.00 0.00 175.35 174.26 2bry s LEU 349 N 5.14 4.38 -0.13 5.43 1.43 -1.26 -5.04 118.68 128.63 2bry s LEU 349 Ca 0.62 2.01 0.01 0.00 -1.03 0.00 0.00 54.13 55.73 2bry s LEU 349 Cb -0.16 -3.58 -0.01 0.00 0.03 0.00 0.00 46.19 42.47 2bry s LEU 349 CO 0.29 -0.45 -0.15 -1.61 0.23 0.00 0.00 176.35 174.66 2bry s GLU 350 N 0.97 3.30 0.30 1.70 0.41 -1.26 -5.05 118.70 119.06 2bry s GLU 350 Ca 0.58 -0.73 -0.30 0.00 -0.41 0.00 0.00 54.97 54.11 2bry s GLU 350 Cb -0.29 -2.57 -0.11 0.00 -1.78 0.00 0.00 34.13 29.37 2bry s GLU 350 CO 0.30 0.17 1.56 -0.06 -0.49 0.00 0.00 175.26 176.74 2bry s PHE 351 N 0.43 2.76 0.82 1.61 0.08 -1.26 -0.49 117.98 121.93 2bry s PHE 351 Ca -0.11 0.86 -0.11 0.00 0.12 0.00 0.00 56.93 57.69 2bry s PHE 351 Cb -0.16 -4.03 0.08 0.00 -0.57 0.00 0.00 43.02 38.34 2bry s PHE 351 CO 0.05 -3.40 1.09 0.00 -0.10 0.00 0.00 175.22 172.86 2bry s ALA 352 N -0.15 2.00 0.02 5.36 0.00 0.33 -4.56 121.76 124.76 2bry s ALA 352 Ca 0.61 0.04 -0.12 0.00 0.00 0.00 0.00 51.96 52.49 2bry s ALA 352 Cb -0.47 -3.20 -0.06 0.00 0.00 0.00 0.00 23.12 19.39 2bry s ALA 352 CO 0.49 -1.95 0.38 -0.65 0.00 0.00 0.00 175.76 174.03 2bry s GLN 353 N -4.97 3.81 0.89 0.00 -0.21 -1.26 -0.73 119.66 117.19 2bry s GLN 353 Ca 0.62 0.27 -0.15 0.00 0.02 0.00 0.00 55.36 56.11 2bry s GLN 353 Cb -0.17 -3.13 0.21 0.00 1.00 0.00 0.00 33.01 30.93 2bry s GLN 353 CO 0.56 0.65 1.06 -0.40 -2.12 0.00 0.00 175.29 175.03 2bry n ASP 354 N 1.46 -0.57 -0.25 5.90 5.68 0.15 -4.77 116.55 124.14 2bry n ASP 354 Ca -0.12 -1.29 0.20 0.00 -0.50 0.00 0.00 54.79 53.08 2bry n ASP 354 Cb 0.53 -0.85 0.52 0.00 -1.14 0.00 0.00 41.12 40.18 2bry n ASP 354 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2bry h ALA 355 N -2.09 2.25 -0.00 2.12 0.00 -1.89 -1.35 119.26 118.30 2bry h ALA 355 Ca -0.36 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2bry h ALA 355 Cb 1.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2bry h ALA 355 CO 0.25 -0.56 -0.21 0.54 0.00 0.00 0.00 179.25 179.27 2bry n ARG 356 N -4.51 0.53 -0.15 0.00 1.74 -1.26 -4.92 116.66 108.08 2bry n ARG 356 Ca 0.20 -0.23 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 2bry n ARG 356 Cb 0.75 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.69 2bry n ARG 356 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bry n GLY 357 N 1.36 0.67 3.85 -0.13 0.00 -0.51 -5.09 105.19 105.34 2bry n GLY 357 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 2bry n GLY 357 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bry s ARG 358 N -0.85 3.94 0.15 1.61 0.52 -1.26 -4.73 118.95 118.33 2bry s ARG 358 Ca 0.00 0.74 -0.34 0.00 -0.52 0.00 0.00 55.73 55.60 2bry s ARG 358 Cb 0.00 -2.30 -0.15 0.00 0.52 0.00 0.00 34.95 33.02 2bry s ARG 358 CO 0.00 -0.06 1.46 -2.30 0.02 0.00 0.00 175.30 174.42 2bry n PRO 359 N -1.09 1.78 -2.85 3.54 -0.02 -1.26 0.29 135.00 135.40 2bry n PRO 359 Ca 0.04 0.64 -0.43 0.00 -2.02 0.00 0.00 63.50 61.73 2bry n PRO 359 Cb 0.54 -2.34 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 2bry n PRO 359 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2bry s ASP 360 N 0.65 6.71 -0.08 2.55 2.15 0.09 -4.68 116.67 124.06 2bry s ASP 360 Ca 0.79 -2.15 -0.10 0.00 0.43 0.00 0.00 52.55 51.51 2bry s ASP 360 Cb -0.77 -2.44 0.02 0.00 -0.30 0.00 0.00 42.92 39.44 2bry s ASP 360 CO 0.43 -1.08 0.27 0.54 -0.17 0.00 0.00 175.17 175.15 2bry s VAL 361 N 2.95 0.02 -0.03 1.11 0.11 -1.26 -0.98 120.40 122.32 2bry s VAL 361 Ca 0.38 -0.17 -0.25 0.00 -2.93 0.00 0.00 61.98 59.02 2bry s VAL 361 Cb -0.03 -0.44 0.05 0.00 -1.53 0.00 0.00 36.38 34.43 2bry s VAL 361 CO -0.07 -0.09 0.53 0.00 -3.33 0.00 0.00 175.10 172.15 2bry s ALA 362 N -0.30 -1.38 -0.05 1.54 0.00 -0.70 -5.01 121.76 115.87 2bry s ALA 362 Ca -0.04 0.92 -0.00 0.00 0.00 0.00 0.00 51.96 52.83 2bry s ALA 362 Cb -0.03 0.05 -0.03 0.00 0.00 0.00 0.00 23.12 23.10 2bry s ALA 362 CO 0.01 -0.33 -0.00 0.00 0.00 0.00 0.00 175.76 175.44 2bry s ALA 363 N -1.30 3.27 0.06 0.00 0.00 -1.26 -1.48 121.76 121.05 2bry s ALA 363 Ca -0.12 -0.88 0.03 0.00 0.00 0.00 0.00 51.96 50.99 2bry s ALA 363 Cb -0.02 -1.40 -0.03 0.00 0.00 0.00 0.00 23.12 21.67 2bry s ALA 363 CO 0.07 0.62 -0.09 -0.06 0.00 0.00 0.00 175.76 176.30 2bry s PHE 364 N -0.97 0.78 -0.50 0.00 0.08 0.20 -4.99 117.98 112.58 2bry s PHE 364 Ca 0.16 -0.55 -0.28 0.00 0.12 0.00 0.00 56.93 56.38 2bry s PHE 364 Cb -0.11 -0.46 0.01 0.00 -0.57 0.00 0.00 43.02 41.89 2bry s PHE 364 CO 0.06 -0.07 1.42 0.34 -0.10 0.00 0.00 175.22 176.87 2bry s ASP 365 N -1.83 6.21 0.00 1.36 2.15 -1.26 -0.49 116.67 122.81 2bry s ASP 365 Ca -0.06 0.52 0.20 0.00 0.43 0.00 0.00 52.55 53.64 2bry s ASP 365 Cb -0.08 -2.54 0.55 0.00 -0.30 0.00 0.00 42.92 40.55 2bry s ASP 365 CO -0.00 -1.60 1.46 0.49 -0.17 0.00 0.00 175.17 175.35 2bry n PHE 366 N 9.30 0.81 -0.05 -5.34 3.01 -0.39 -4.59 117.46 120.20 2bry n PHE 366 Ca 0.14 -0.41 -0.08 0.00 1.01 0.00 0.00 57.45 58.11 2bry n PHE 366 Cb 0.49 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.88 2bry n PHE 366 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 2bry h THR 367 N 3.71 1.03 -3.25 4.37 2.02 -1.82 -3.43 112.91 115.54 2bry h THR 367 Ca 0.00 -1.72 -0.58 0.00 0.77 0.00 0.00 66.41 64.88 2bry h THR 367 Cb 0.85 1.92 -0.07 0.00 -1.74 0.00 0.00 68.15 69.11 2bry h THR 367 CO 0.00 0.34 -0.13 -0.44 0.37 0.00 0.00 175.52 175.66 2bry s SER 368 N -5.89 6.77 -0.10 4.18 0.01 -1.26 -3.17 113.70 114.24 2bry s SER 368 Ca -0.11 0.92 0.03 0.00 1.31 0.00 0.00 55.95 58.10 2bry s SER 368 Cb -0.02 -2.29 -0.01 0.00 0.21 0.00 0.00 66.02 63.92 2bry s SER 368 CO 0.41 0.11 -0.21 -0.04 0.41 0.00 0.00 173.24 173.92 2bry s MET 369 N 0.02 3.09 0.02 12.44 1.00 -1.08 -5.00 119.30 129.79 2bry s MET 369 Ca 0.26 -0.82 0.09 0.00 0.00 0.00 0.00 55.69 55.21 2bry s MET 369 Cb -0.16 -2.38 -0.03 0.00 0.00 0.00 0.00 34.83 32.26 2bry s MET 369 CO 0.12 0.22 -0.25 -1.64 0.00 0.00 0.00 175.02 173.47 2bry s MET 370 N 0.28 1.95 -0.08 2.03 -1.94 -1.26 -2.19 119.30 118.09 2bry s MET 370 Ca -0.15 -1.02 -0.08 0.00 -1.71 0.00 0.00 55.69 52.73 2bry s MET 370 Cb -0.17 -2.03 0.02 0.00 2.01 0.00 0.00 34.83 34.67 2bry s MET 370 CO 0.07 0.53 0.22 -0.98 -0.01 0.00 0.00 175.02 174.86 2bry s ARG 371 N -1.01 0.25 0.45 2.03 1.70 -0.40 -0.83 118.95 121.14 2bry s ARG 371 Ca 0.11 0.31 -0.24 0.00 -0.47 0.00 0.00 55.73 55.44 2bry s ARG 371 Cb -0.10 0.12 -0.07 0.00 -0.57 0.00 0.00 34.95 34.33 2bry s ARG 371 CO 0.01 -0.03 1.23 0.00 -1.08 0.00 0.00 175.30 175.43 2bry s ALA 372 N 0.13 3.05 0.27 7.88 0.00 0.86 -0.40 121.76 133.55 2bry s ALA 372 Ca -0.00 1.08 0.03 0.00 0.00 0.00 0.00 51.96 53.07 2bry s ALA 372 Cb -0.02 -3.44 0.37 0.00 0.00 0.00 0.00 23.12 20.03 2bry s ALA 372 CO 0.00 -0.79 1.67 1.49 0.00 0.00 0.00 175.76 178.13 2bry h GLU 373 N 2.20 0.38 -4.62 0.00 4.81 -0.85 -3.44 114.58 113.06 2bry h GLU 373 Ca -0.50 -0.18 -0.26 0.00 -0.13 0.00 0.00 59.36 58.29 2bry h GLU 373 Cb 1.25 -0.00 -0.19 0.00 0.63 0.00 0.00 28.75 30.44 2bry h GLU 373 CO 0.61 0.71 -0.72 -1.54 -0.73 0.00 0.00 179.01 177.34 2bry s SER 374 N -6.86 0.98 0.00 1.04 1.04 -1.26 -5.06 113.70 103.58 2bry s SER 374 Ca -0.06 -0.70 0.26 0.00 0.48 0.00 0.00 55.95 55.93 2bry s SER 374 Cb 0.13 0.05 0.59 0.00 0.10 0.00 0.00 66.02 66.90 2bry s SER 374 CO 0.79 -0.29 1.46 -1.54 0.98 0.00 0.00 173.24 174.65 2bry n SER 375 N 0.96 0.95 -3.59 7.02 3.41 -1.26 -4.93 113.62 116.18 2bry n SER 375 Ca -0.19 -0.76 -0.13 0.00 -0.26 0.00 0.00 58.87 57.52 2bry n SER 375 Cb 0.57 0.23 -0.05 0.00 -0.26 0.00 0.00 64.21 64.69 2bry n SER 375 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bry s ALA 376 N -2.66 -1.26 0.13 7.33 0.00 -1.26 -0.90 121.76 123.14 2bry s ALA 376 Ca 0.20 0.49 -0.06 0.00 0.00 0.00 0.00 51.96 52.59 2bry s ALA 376 Cb 0.19 0.43 -0.02 0.00 0.00 0.00 0.00 23.12 23.72 2bry s ALA 376 CO 0.59 -0.52 0.18 1.03 0.00 0.00 0.00 175.76 177.03 2bry s ARG 377 N -2.63 0.98 -0.04 0.00 0.52 -0.27 -4.96 118.95 112.56 2bry s ARG 377 Ca -0.04 -1.20 0.05 0.00 -0.52 0.00 0.00 55.73 54.01 2bry s ARG 377 Cb -0.00 0.32 -0.01 0.00 0.52 0.00 0.00 34.95 35.78 2bry s ARG 377 CO -0.03 -0.32 -0.17 0.08 0.02 0.00 0.00 175.30 174.87 2bry s VAL 378 N -3.96 1.44 0.01 3.52 1.01 0.46 -0.00 120.40 122.88 2bry s VAL 378 Ca 0.15 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.49 2bry s VAL 378 Cb 0.05 -1.23 -0.02 0.00 0.00 0.00 0.00 36.38 35.18 2bry s VAL 378 CO -0.03 0.41 -0.25 -1.10 0.00 0.00 0.00 175.10 174.13 2bry s GLN 379 N -0.05 1.92 -0.02 2.72 -0.21 -0.34 -0.46 119.66 123.22 2bry s GLN 379 Ca -0.02 -0.98 0.03 0.00 0.02 0.00 0.00 55.36 54.41 2bry s GLN 379 Cb -0.11 -1.96 -0.00 0.00 1.00 0.00 0.00 33.01 31.95 2bry s GLN 379 CO 0.02 0.52 -0.10 -2.00 -2.12 0.00 0.00 175.29 171.62 2bry s GLU 380 N -0.87 0.91 -0.15 2.91 -6.30 -0.46 0.09 118.70 114.84 2bry s GLU 380 Ca 0.10 -0.33 -0.11 0.00 -2.50 0.00 0.00 54.97 52.14 2bry s GLU 380 Cb -0.10 -0.86 0.05 0.00 0.00 0.00 0.00 34.13 33.22 2bry s GLU 380 CO 0.00 0.16 0.37 0.21 0.02 0.00 0.00 175.26 176.02 2bry s LYS 381 N 0.02 0.39 -1.55 4.30 2.20 -0.89 -2.13 119.74 122.08 2bry s LYS 381 Ca -0.00 0.61 0.00 0.00 -0.36 0.00 0.00 55.97 56.22 2bry s LYS 381 Cb -0.07 0.09 0.00 0.00 -1.51 0.00 0.00 37.83 36.34 2bry s LYS 381 CO 0.00 -0.10 0.00 0.72 -0.36 0.00 0.00 175.35 175.61 2bry n HIS 382 N 3.52 -1.08 -0.32 4.03 8.25 -1.26 -1.47 115.22 126.89 2bry n HIS 382 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 2bry n HIS 382 Cb 0.56 -3.51 0.00 0.00 1.12 0.00 0.00 29.99 28.16 2bry n HIS 382 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bry n GLY 383 N -0.90 1.16 3.61 -1.41 0.00 -1.26 -4.26 105.19 102.13 2bry n GLY 383 Ca -0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.43 2bry n GLY 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bry s ALA 384 N -2.87 3.55 -0.12 4.61 0.00 -0.54 -5.05 121.76 121.33 2bry s ALA 384 Ca 0.00 -0.96 -0.06 0.00 0.00 0.00 0.00 51.96 50.94 2bry s ALA 384 Cb 0.00 -2.54 -0.04 0.00 0.00 0.00 0.00 23.12 20.54 2bry s ALA 384 CO 0.00 -0.53 0.11 1.03 0.00 0.00 0.00 175.76 176.37 2bry s ARG 385 N 1.76 3.40 -0.13 0.00 0.52 -1.26 -2.09 118.95 121.14 2bry s ARG 385 Ca 0.10 -0.19 0.01 0.00 -0.52 0.00 0.00 55.73 55.13 2bry s ARG 385 Cb -0.16 -3.13 0.02 0.00 0.52 0.00 0.00 34.95 32.20 2bry s ARG 385 CO 0.10 0.73 -0.15 -1.17 0.02 0.00 0.00 175.30 174.83 2bry s LEU 386 N -0.91 1.73 -0.16 2.53 2.96 0.11 -4.68 118.68 120.26 2bry s LEU 386 Ca 0.14 -0.47 -0.17 0.00 -0.22 0.00 0.00 54.13 53.41 2bry s LEU 386 Cb -0.12 -1.17 -0.04 0.00 0.50 0.00 0.00 46.19 45.37 2bry s LEU 386 CO 0.03 -0.02 0.45 -0.22 -1.32 0.00 0.00 176.35 175.27 2bry s LEU 387 N 1.25 4.22 -0.16 -0.68 2.96 -0.04 -1.20 118.68 125.03 2bry s LEU 387 Ca -0.00 0.68 -0.01 0.00 -0.22 0.00 0.00 54.13 54.58 2bry s LEU 387 Cb -0.14 -2.62 -0.01 0.00 0.50 0.00 0.00 46.19 43.93 2bry s LEU 387 CO -0.07 -0.04 -0.12 -0.76 -1.32 0.00 0.00 176.35 174.04 2bry s LEU 388 N 0.98 2.67 0.04 -0.68 1.02 1.00 -0.58 118.68 123.13 2bry s LEU 388 Ca 0.23 -0.39 0.07 0.00 0.02 0.00 0.00 54.13 54.06 2bry s LEU 388 Cb -0.15 -1.62 -0.02 0.00 0.02 0.00 0.00 46.19 44.41 2bry s LEU 388 CO 0.09 0.10 -0.20 -0.83 0.02 0.00 0.00 176.35 175.52 2bry s GLY 389 N 0.77 1.09 -0.12 -3.19 0.00 0.07 -1.11 107.32 104.83 2bry s GLY 389 Ca -0.05 -1.03 -0.03 0.00 0.00 0.00 0.00 44.72 43.61 2bry s GLY 389 CO 0.01 -0.96 -0.01 1.08 0.00 0.00 0.00 173.10 173.23 2bry s LEU 390 N -1.14 3.49 -0.02 0.66 1.43 -0.08 -0.69 118.68 122.34 2bry s LEU 390 Ca 0.07 0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 2bry s LEU 390 Cb -0.09 -1.82 0.01 0.00 0.03 0.00 0.00 46.19 44.32 2bry s LEU 390 CO 0.02 0.29 -0.04 -0.69 0.23 0.00 0.00 176.35 176.15 2bry s VAL 391 N -0.35 0.42 0.00 -1.59 1.01 -0.67 -4.84 120.40 114.37 2bry s VAL 391 Ca 0.07 -0.16 0.00 0.00 0.00 0.00 0.00 61.98 61.89 2bry s VAL 391 Cb -0.12 -0.40 0.00 0.00 0.00 0.00 0.00 36.38 35.86 2bry s VAL 391 CO 0.02 0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.88 2bry n GLY 392 N 3.38 -0.12 0.27 4.51 0.00 -1.26 -4.21 105.19 107.76 2bry n GLY 392 Ca -0.18 -1.46 0.11 0.00 0.00 0.00 0.00 46.02 44.49 2bry n GLY 392 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2bry h ASP 393 N 4.00 0.00 1.12 1.61 5.19 -1.88 -0.87 116.42 125.58 2bry h ASP 393 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2bry h ASP 393 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 2bry h ASP 393 CO 0.00 0.05 0.00 0.00 -3.12 0.00 0.00 179.24 176.17 2bry h LEU 395 N 0.00 0.00 -7.65 0.00 5.85 -1.38 -3.42 115.31 108.70 2bry h LEU 395 Ca 0.00 -0.03 -0.40 0.00 0.84 0.00 0.00 57.88 58.29 2bry h LEU 395 Cb 0.56 0.00 -0.35 0.00 0.37 0.00 0.00 40.66 41.24 2bry h LEU 395 CO 0.00 0.72 -0.77 0.68 -0.34 0.00 0.00 178.44 178.73 2bry s VAL 396 N -2.08 0.42 -0.12 1.05 -7.23 -0.91 -0.10 120.40 111.44 2bry s VAL 396 Ca -0.12 -0.02 -0.29 0.00 -1.81 0.00 0.00 61.98 59.73 2bry s VAL 396 Cb 0.02 -0.49 -0.01 0.00 0.56 0.00 0.00 36.38 36.45 2bry s VAL 396 CO 0.18 0.22 1.02 -0.70 -0.31 0.00 0.00 175.10 175.51 2bry s GLU 397 N 1.18 4.39 0.43 4.82 2.12 -0.01 -4.13 118.70 127.49 2bry s GLU 397 Ca -0.07 1.40 -0.22 0.00 0.36 0.00 0.00 54.97 56.44 2bry s GLU 397 Cb -0.14 -3.56 -0.09 0.00 0.26 0.00 0.00 34.13 30.60 2bry s GLU 397 CO -0.02 -0.38 1.01 -1.25 -0.54 0.00 0.00 175.26 174.09 2bry s PRO 398 N 2.23 4.11 -0.45 4.30 0.04 -1.26 -4.68 135.00 139.29 2bry s PRO 398 Ca 0.48 1.33 -0.21 0.00 0.04 0.00 0.00 61.00 62.64 2bry s PRO 398 Cb -0.18 -2.32 0.03 0.00 0.04 0.00 0.00 34.50 32.06 2bry s PRO 398 CO 0.16 -0.16 0.67 0.12 0.04 0.00 0.00 177.00 177.84 2bry s PHE 399 N -1.90 3.04 0.22 0.56 5.36 -1.26 -4.97 117.98 119.03 2bry s PHE 399 Ca 0.61 -0.07 -0.07 0.00 -0.96 0.00 0.00 56.93 56.43 2bry s PHE 399 Cb -0.16 -3.44 0.30 0.00 -0.34 0.00 0.00 43.02 39.37 2bry s PHE 399 CO 0.21 -0.92 1.81 -1.49 -1.46 0.00 0.00 175.22 173.36 2bry h TRP 400 N 8.92 0.73 -0.14 10.12 6.55 -1.99 -1.15 115.95 139.00 2bry h TRP 400 Ca -0.26 0.03 0.04 0.00 0.95 0.00 0.00 58.89 59.65 2bry h TRP 400 Cb 1.09 -0.22 -0.01 0.00 -0.86 0.00 0.00 29.16 29.16 2bry h TRP 400 CO 0.75 0.33 0.15 -1.35 -1.05 0.00 0.00 178.44 177.27 2bry h PRO 401 N 0.72 0.00 -0.00 0.49 0.11 -1.97 -1.75 132.00 129.60 2bry h PRO 401 Ca 0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.44 2bry h PRO 401 Cb 0.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.36 2bry h PRO 401 CO -0.21 0.00 -0.37 1.28 -0.21 0.00 0.00 178.00 178.49 2bry n LEU 402 N -3.83 0.41 -1.01 2.35 4.77 -0.44 -4.95 117.00 114.32 2bry n LEU 402 Ca 0.00 0.10 -0.09 0.00 -0.03 0.00 0.00 56.01 55.99 2bry n LEU 402 Cb 0.27 -0.30 -0.01 0.00 -2.33 0.00 0.00 43.42 41.05 2bry n LEU 402 CO 0.28 0.10 -0.11 0.61 -1.33 0.00 0.00 177.39 176.93 2bry n GLY 403 N 1.48 0.06 0.33 -0.72 0.00 -0.66 -4.92 105.19 100.76 2bry n GLY 403 Ca 0.06 -0.52 0.12 0.00 0.00 0.00 0.00 46.02 45.69 2bry n GLY 403 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2bry n THR 404 N -3.94 0.00 0.15 2.61 -2.24 -1.26 -4.62 114.28 104.97 2bry n THR 404 Ca -0.11 -0.17 -0.13 0.00 -2.27 0.00 0.00 64.05 61.37 2bry n THR 404 Cb 0.57 0.72 -0.06 0.00 -2.10 0.00 0.00 70.33 69.46 2bry n THR 404 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2bry h GLY 405 N 4.90 -0.53 0.90 3.38 0.00 -1.90 -0.22 103.07 109.61 2bry h GLY 405 Ca 0.00 0.30 -0.08 0.00 0.00 0.00 0.00 47.33 47.55 2bry h GLY 405 CO 0.00 -0.23 -0.13 -2.08 0.00 0.00 0.00 176.54 174.11 2bry h VAL 406 N -0.51 1.29 0.39 4.60 2.07 -1.82 -1.77 116.25 120.51 2bry h VAL 406 Ca 0.01 -1.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.31 2bry h VAL 406 Cb 0.50 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 2bry h VAL 406 CO -0.10 0.39 -0.30 0.00 0.02 0.00 0.00 177.57 177.58 2bry h ALA 407 N 0.76 -0.70 0.00 1.67 0.00 -1.79 0.12 119.26 119.33 2bry h ALA 407 Ca 0.07 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 2bry h ALA 407 Cb 0.64 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2bry h ALA 407 CO 0.04 -0.92 -0.41 0.00 0.00 0.00 0.00 179.25 177.97 2bry h ARG 408 N -0.69 0.00 -0.27 0.00 3.08 -1.12 -0.45 114.38 114.93 2bry h ARG 408 Ca -0.03 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.96 2bry h ARG 408 Cb 0.60 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 2bry h ARG 408 CO -0.01 0.41 -0.05 0.78 -1.07 0.00 0.00 179.97 180.03 2bry h GLY 409 N 2.28 0.56 1.01 0.04 0.00 -1.11 -0.49 103.07 105.36 2bry h GLY 409 Ca -0.00 -0.45 -0.11 0.00 0.00 0.00 0.00 47.33 46.77 2bry h GLY 409 CO 0.05 0.42 -0.16 0.74 0.00 0.00 0.00 176.54 177.59 2bry h PHE 410 N 0.28 0.94 -0.76 5.60 -1.00 -0.48 0.29 116.94 121.81 2bry h PHE 410 Ca 0.07 -0.22 0.03 0.00 2.81 0.00 0.00 57.97 60.66 2bry h PHE 410 Cb 0.52 -0.22 -0.05 0.00 3.61 0.00 0.00 35.95 39.81 2bry h PHE 410 CO 0.05 0.97 0.48 -0.07 -1.61 0.00 0.00 178.31 178.13 2bry h LEU 411 N 0.63 0.80 -0.87 1.54 3.38 -1.05 0.61 115.31 120.35 2bry h LEU 411 Ca 0.09 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2bry h LEU 411 Cb 0.71 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 2bry h LEU 411 CO 0.05 0.55 0.39 0.00 0.09 0.00 0.00 178.44 179.52 2bry h ALA 412 N 1.32 1.11 -0.29 1.53 0.00 -0.88 -0.43 119.26 121.63 2bry h ALA 412 Ca 0.30 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2bry h ALA 412 Cb 0.01 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 2bry h ALA 412 CO -0.11 0.66 0.18 0.00 0.00 0.00 0.00 179.25 179.98 2bry h ALA 413 N 1.23 0.36 -0.44 0.00 0.00 -0.17 0.87 119.26 121.12 2bry h ALA 413 Ca 0.29 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 2bry h ALA 413 Cb 0.13 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2bry h ALA 413 CO -0.03 -0.15 0.18 0.74 0.00 0.00 0.00 179.25 179.98 2bry h PHE 414 N 0.37 0.66 -0.45 0.00 0.04 -0.54 -1.05 116.94 115.98 2bry h PHE 414 Ca 0.10 -0.05 -0.10 0.00 2.80 0.00 0.00 57.97 60.72 2bry h PHE 414 Cb -0.01 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 37.92 2bry h PHE 414 CO -0.05 0.57 -0.12 -0.44 -0.60 0.00 0.00 178.31 177.67 2bry h ASP 415 N 0.56 0.82 -0.41 2.17 3.32 -0.93 0.15 116.42 122.10 2bry h ASP 415 Ca 0.15 -0.26 -0.02 0.00 0.02 0.00 0.00 57.03 56.92 2bry h ASP 415 Cb 0.19 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 2bry h ASP 415 CO -0.01 0.96 0.17 0.00 -1.72 0.00 0.00 179.24 178.63 2bry h ALA 416 N 1.12 0.53 -0.40 3.45 0.00 -0.73 -0.19 119.26 123.03 2bry h ALA 416 Ca 0.12 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2bry h ALA 416 Cb 0.62 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2bry h ALA 416 CO 0.04 0.13 -0.04 0.00 0.00 0.00 0.00 179.25 179.38 2bry h ALA 417 N 1.01 0.55 -0.75 0.00 0.00 -0.88 -1.02 119.26 118.17 2bry h ALA 417 Ca 0.14 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.80 2bry h ALA 417 Cb 0.19 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2bry h ALA 417 CO -0.01 0.37 0.46 2.35 0.00 0.00 0.00 179.25 182.42 2bry h TRP 418 N 0.56 0.86 -1.00 0.00 2.91 -0.96 -0.79 115.95 117.53 2bry h TRP 418 Ca 0.11 0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.18 2bry h TRP 418 Cb 0.54 -0.28 -0.05 0.00 -0.51 0.00 0.00 29.16 28.86 2bry h TRP 418 CO 0.04 0.46 0.66 1.98 -1.03 0.00 0.00 178.44 180.56 2bry h MET 419 N 0.88 1.28 -0.37 2.65 4.05 -0.60 -1.11 114.93 121.70 2bry h MET 419 Ca 0.31 -0.08 -0.10 0.00 -0.28 0.00 0.00 59.70 59.56 2bry h MET 419 Cb 0.09 -0.29 -0.02 0.00 -0.80 0.00 0.00 31.60 30.58 2bry h MET 419 CO -0.14 0.85 -0.19 0.28 0.23 0.00 0.00 176.91 177.94 2bry h VAL 420 N 1.32 1.26 -0.47 -5.77 2.07 -0.40 -0.09 116.25 114.18 2bry h VAL 420 Ca 0.38 -1.25 0.01 0.00 0.82 0.00 0.00 66.70 66.66 2bry h VAL 420 Cb -0.08 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 2bry h VAL 420 CO -0.10 0.42 0.30 0.50 0.02 0.00 0.00 177.57 178.70 2bry h LYS 421 N 0.63 0.59 -0.50 1.57 3.64 -0.19 0.99 116.57 123.30 2bry h LYS 421 Ca 0.10 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2bry h LYS 421 Cb 0.66 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.32 2bry h LYS 421 CO 0.05 0.39 0.33 0.00 -2.27 0.00 0.00 179.45 177.94 2bry h ARG 422 N 0.60 0.64 -0.19 1.90 2.47 -0.72 -1.29 114.38 117.79 2bry h ARG 422 Ca 0.18 -0.04 0.03 0.00 -1.26 0.00 0.00 59.98 58.89 2bry h ARG 422 Cb -0.04 -0.14 -0.03 0.00 -1.65 0.00 0.00 29.97 28.11 2bry h ARG 422 CO -0.06 0.42 0.03 2.35 0.56 0.00 0.00 179.97 183.28 2bry h TRP 423 N 0.66 0.05 0.00 3.04 2.91 -0.72 -1.83 115.95 120.07 2bry h TRP 423 Ca 0.19 0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.21 2bry h TRP 423 Cb -0.05 0.01 -0.00 0.00 -0.51 0.00 0.00 29.16 28.60 2bry h TRP 423 CO -0.05 0.01 -0.04 0.00 -1.03 0.00 0.00 178.44 177.33 2bry h ALA 424 N 1.14 1.47 0.00 2.65 0.00 -0.41 -0.60 119.26 123.51 2bry h ALA 424 Ca 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2bry h ALA 424 Cb 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2bry h ALA 424 CO -0.12 0.05 0.00 0.39 0.00 0.00 0.00 179.25 179.57 2bry n GLU 425 N -3.82 0.12 -0.63 0.00 1.02 -0.52 -4.93 120.64 111.88 2bry n GLU 425 Ca -0.03 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 2bry n GLU 425 Cb 0.13 -1.66 0.00 0.00 -0.02 0.00 0.00 31.44 29.89 2bry n GLU 425 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bry n GLY 426 N 0.95 0.78 0.30 0.62 0.00 -0.23 -4.98 105.19 102.62 2bry n GLY 426 Ca 0.05 -0.55 0.16 0.00 0.00 0.00 0.00 46.02 45.68 2bry n GLY 426 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bry h ALA 427 N 0.00 1.46 0.00 4.61 0.00 -1.65 -3.48 119.26 120.19 2bry h ALA 427 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bry h ALA 427 Cb 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2bry h ALA 427 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2bry n GLY 428 N -1.28 0.10 0.30 0.00 0.00 -1.26 -4.47 105.19 98.58 2bry n GLY 428 Ca -0.03 -1.44 -0.03 0.00 0.00 0.00 0.00 46.02 44.52 2bry n GLY 428 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2bry h PRO 429 N 0.00 -0.10 -0.70 1.61 0.11 -1.98 -2.06 132.00 128.87 2bry h PRO 429 Ca 0.00 0.01 -0.07 0.00 0.11 0.00 0.00 66.00 66.05 2bry h PRO 429 Cb 0.00 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.11 2bry h PRO 429 CO 0.00 -0.07 0.16 -0.07 -0.21 0.00 0.00 178.00 177.81 2bry h LEU 430 N -0.11 1.07 -0.32 2.35 3.38 -1.92 -1.81 115.31 117.95 2bry h LEU 430 Ca 0.26 -0.24 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 2bry h LEU 430 Cb 0.52 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2bry h LEU 430 CO -0.66 1.03 -0.13 -0.08 0.09 0.00 0.00 178.44 178.70 2bry h GLU 431 N 1.07 0.65 -0.56 1.13 4.57 -1.65 -1.36 114.58 118.43 2bry h GLU 431 Ca 0.22 -0.28 0.04 0.00 -1.18 0.00 0.00 59.36 58.16 2bry h GLU 431 Cb 0.39 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.91 2bry h GLU 431 CO 0.00 0.86 0.32 -0.39 -1.18 0.00 0.00 179.01 178.62 2bry h VAL 432 N 0.42 1.02 -0.47 0.32 -1.51 -1.22 -1.99 116.25 112.82 2bry h VAL 432 Ca 0.07 -0.21 -0.12 0.00 -1.23 0.00 0.00 66.70 65.21 2bry h VAL 432 Cb 0.65 0.34 -0.01 0.00 -2.13 0.00 0.00 31.29 30.14 2bry h VAL 432 CO 0.04 0.11 -0.17 -0.07 -1.23 0.00 0.00 177.57 176.26 2bry h LEU 433 N 0.62 0.97 -0.39 4.19 3.38 -1.24 -1.34 115.31 121.49 2bry h LEU 433 Ca 0.24 -0.38 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 2bry h LEU 433 Cb 0.08 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2bry h LEU 433 CO -0.13 1.13 0.03 0.00 0.09 0.00 0.00 178.44 179.56 2bry h ALA 434 N 0.87 0.53 -0.23 1.53 0.00 -1.04 0.82 119.26 121.74 2bry h ALA 434 Ca 0.11 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2bry h ALA 434 Cb 0.74 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2bry h ALA 434 CO 0.06 0.27 0.12 0.93 0.00 0.00 0.00 179.25 180.63 2bry h GLU 435 N 0.51 0.32 -0.53 0.00 5.08 -1.34 -0.45 114.58 118.16 2bry h GLU 435 Ca 0.12 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2bry h GLU 435 Cb 0.42 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.58 2bry h GLU 435 CO 0.01 0.31 0.34 -0.09 -1.00 0.00 0.00 179.01 178.58 2bry h ARG 436 N 0.25 0.67 -0.06 2.33 9.65 -0.85 -2.45 114.38 123.91 2bry h ARG 436 Ca 0.08 -0.04 -0.10 0.00 -1.10 0.00 0.00 59.98 58.82 2bry h ARG 436 Cb 0.08 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 28.50 2bry h ARG 436 CO -0.01 0.44 -0.40 0.93 2.80 0.00 0.00 179.97 183.72 2bry h GLU 437 N 0.69 0.12 -0.78 0.20 4.39 -0.69 0.80 114.58 119.31 2bry h GLU 437 Ca 0.20 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.82 2bry h GLU 437 Cb -0.04 -0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.57 2bry h GLU 437 CO -0.07 0.51 0.36 0.77 -1.16 0.00 0.00 179.01 179.42 2bry h SER 438 N 0.10 1.03 -0.34 1.42 0.02 -0.76 -1.68 113.55 113.34 2bry h SER 438 Ca 0.01 -0.13 -0.14 0.00 -0.84 0.00 0.00 61.79 60.69 2bry h SER 438 Cb 0.76 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 2bry h SER 438 CO 0.06 0.88 -0.33 -0.07 -1.14 0.00 0.00 176.83 176.24 2bry h LEU 439 N 1.12 0.88 -1.37 5.07 3.38 -0.92 -3.30 115.31 120.17 2bry h LEU 439 Ca 0.27 -0.46 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 2bry h LEU 439 Cb 0.14 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2bry h LEU 439 CO -0.03 1.16 0.19 0.22 0.09 0.00 0.00 178.44 180.08 2bry h TYR 440 N 0.61 0.62 -0.39 1.13 3.20 -0.46 -1.89 116.97 119.79 2bry h TYR 440 Ca 0.06 -0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.02 2bry h TYR 440 Cb 0.91 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.97 2bry h TYR 440 CO 0.07 0.47 0.49 1.96 -1.64 0.00 0.00 178.16 179.51 2bry h GLN 441 N 0.62 0.00 0.00 1.82 4.20 -1.39 -2.09 115.11 118.27 2bry h GLN 441 Ca 0.16 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.85 2bry h GLN 441 Cb 0.10 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 2bry h GLN 441 CO -0.02 0.00 -0.80 -0.07 -0.67 0.00 0.00 178.83 177.27 2bry h LEU 442 N 0.00 0.00 -0.08 1.46 3.38 -1.52 -3.43 115.31 115.12 2bry h LEU 442 Ca 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 2bry h LEU 442 Cb 1.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 2bry h LEU 442 CO -0.00 0.04 0.04 0.25 0.09 0.00 0.00 178.44 178.86 2bry h LEU 443 N 0.00 0.11 0.00 1.67 5.85 -1.48 -1.58 115.31 119.88 2bry h LEU 443 Ca -0.01 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.59 2bry h LEU 443 Cb 1.04 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.04 2bry h LEU 443 CO 0.00 0.19 0.00 -1.20 -0.34 0.00 0.00 178.44 177.10 2bry n SER 444 N -4.96 0.00 -0.31 1.25 7.64 -1.26 -2.49 113.62 113.49 2bry n SER 444 Ca -0.06 -0.31 0.05 0.00 1.01 0.00 0.00 58.87 59.56 2bry n SER 444 Cb 0.09 -0.10 0.02 0.00 -1.01 0.00 0.00 64.21 63.21 2bry n SER 444 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2bry n GLN 445 N -1.10 1.33 -1.98 1.43 3.00 -0.62 -5.04 117.38 114.40 2bry n GLN 445 Ca 0.11 -0.83 -0.40 0.00 -0.01 0.00 0.00 57.00 55.87 2bry n GLN 445 Cb 0.08 -1.13 0.00 0.00 0.00 0.00 0.00 30.24 29.19 2bry n GLN 445 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 2bry s THR 446 N -1.11 2.46 0.12 5.09 -4.23 -1.04 -4.98 115.64 111.96 2bry s THR 446 Ca 0.10 0.41 -0.12 0.00 -1.18 0.00 0.00 61.69 60.90 2bry s THR 446 Cb 0.08 -3.24 0.01 0.00 1.34 0.00 0.00 72.50 70.69 2bry s THR 446 CO 0.19 0.06 0.30 -0.94 -0.54 0.00 0.00 174.62 173.69 2bry s SER 447 N -0.66 -0.04 0.33 3.99 1.04 -1.26 -5.03 113.70 112.08 2bry s SER 447 Ca 0.58 -0.54 0.07 0.00 0.48 0.00 0.00 55.95 56.54 2bry s SER 447 Cb -0.40 0.41 0.77 0.00 0.10 0.00 0.00 66.02 66.90 2bry s SER 447 CO 0.51 -0.81 1.84 -0.65 0.98 0.00 0.00 173.24 175.11 2bry h PRO 448 N 2.55 0.73 -0.82 4.02 0.11 -1.96 -2.28 132.00 134.35 2bry h PRO 448 Ca -0.33 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 2bry h PRO 448 Cb 1.23 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 2bry h PRO 448 CO 0.51 0.48 0.47 0.93 -0.21 0.00 0.00 178.00 180.17 2bry h GLU 449 N 0.75 1.14 -0.64 1.05 3.07 -1.97 -3.09 114.58 114.89 2bry h GLU 449 Ca 0.49 -0.12 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 2bry h GLU 449 Cb 0.74 -0.23 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 2bry h GLU 449 CO -0.25 0.83 0.00 0.27 -1.40 0.00 0.00 179.01 178.46 2bry n ASN 450 N -4.41 3.84 -4.98 1.42 0.23 -0.89 -4.93 115.26 105.55 2bry n ASN 450 Ca 0.08 -2.00 -0.20 0.00 -0.53 0.00 0.00 54.58 51.93 2bry n ASN 450 Cb 0.08 -0.42 0.02 0.00 -2.08 0.00 0.00 39.78 37.38 2bry n ASN 450 CO 0.00 0.00 0.00 -0.04 -0.93 0.00 0.00 177.26 176.29 2bry s MET 451 N -1.15 2.48 0.20 -3.83 -1.94 -1.01 -4.57 119.30 109.48 2bry s MET 451 Ca 0.47 -1.58 -0.32 0.00 -1.71 0.00 0.00 55.69 52.55 2bry s MET 451 Cb 0.25 -2.55 -0.13 0.00 2.01 0.00 0.00 34.83 34.41 2bry s MET 451 CO 0.33 -0.55 1.54 0.72 -0.01 0.00 0.00 175.02 177.05 2bry n HIS 452 N -1.94 2.34 0.06 -0.03 8.25 -0.83 -4.86 115.22 118.22 2bry n HIS 452 Ca 0.09 0.30 -0.06 0.00 -0.26 0.00 0.00 57.72 57.78 2bry n HIS 452 Cb 0.61 -2.53 0.10 0.00 1.12 0.00 0.00 29.99 29.29 2bry n HIS 452 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 2bry h ARG 453 N 5.34 0.33 -5.73 -0.41 0.11 -1.92 -3.39 114.38 108.71 2bry h ARG 453 Ca -0.45 -0.22 -0.65 0.00 0.10 0.00 0.00 59.98 58.75 2bry h ARG 453 Cb 1.25 0.03 -0.11 0.00 1.11 0.00 0.00 29.97 32.25 2bry h ARG 453 CO 0.84 0.82 1.64 1.21 0.10 0.00 0.00 179.97 184.58 2bry s ASN 454 N -6.91 6.70 0.49 0.08 3.84 -1.26 -4.82 114.94 113.06 2bry s ASN 454 Ca -0.05 -2.05 0.28 0.00 0.21 0.00 0.00 52.86 51.26 2bry s ASN 454 Cb 0.12 -2.53 1.13 0.00 -0.55 0.00 0.00 41.25 39.41 2bry s ASN 454 CO 0.81 -1.25 1.90 -0.37 -2.79 0.00 0.00 177.10 175.40 2bry h VAL 455 N 6.01 0.32 0.00 -5.21 -1.51 -1.95 -2.43 116.25 111.48 2bry h VAL 455 Ca 0.29 -0.84 -0.01 0.00 -1.23 0.00 0.00 66.70 64.91 2bry h VAL 455 Cb 0.95 1.64 -0.00 0.00 -2.13 0.00 0.00 31.29 31.75 2bry h VAL 455 CO 1.38 0.12 -0.07 0.00 -1.23 0.00 0.00 177.57 177.77 2bry h ALA 456 N 1.88 1.37 -0.36 5.19 0.00 -1.95 -2.66 119.26 122.72 2bry h ALA 456 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2bry h ALA 456 Cb 0.63 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2bry h ALA 456 CO 0.02 0.09 0.00 1.04 0.00 0.00 0.00 179.25 180.39 2bry n GLN 457 N -3.71 2.50 -1.79 0.00 1.13 -0.92 -4.96 117.38 109.64 2bry n GLN 457 Ca -0.02 -2.26 -0.42 0.00 -1.94 0.00 0.00 57.00 52.36 2bry n GLN 457 Cb 0.17 -1.51 -0.02 0.00 0.11 0.00 0.00 30.24 28.99 2bry n GLN 457 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 2bry s TYR 458 N -1.54 2.86 0.05 1.08 1.51 -1.01 -4.90 117.35 115.41 2bry s TYR 458 Ca 0.38 0.60 -0.00 0.00 -1.01 0.00 0.00 57.07 57.04 2bry s TYR 458 Cb 0.23 -4.07 0.00 0.00 -0.11 0.00 0.00 41.96 38.01 2bry s TYR 458 CO 0.32 -3.82 0.08 0.41 -1.11 0.00 0.00 175.55 171.42 2bry n GLY 459 N 3.08 2.98 0.35 0.71 0.00 -1.26 -5.05 105.19 106.00 2bry n GLY 459 Ca 0.12 -1.41 0.03 0.00 0.00 0.00 0.00 46.02 44.75 2bry n GLY 459 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2bry h LEU 460 N 0.00 0.91 -8.92 0.99 3.38 -1.94 -3.41 115.31 106.33 2bry h LEU 460 Ca -0.04 0.02 -0.64 0.00 0.09 0.00 0.00 57.88 57.31 2bry h LEU 460 Cb 0.18 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2bry h LEU 460 CO 0.06 0.56 1.29 -0.67 0.09 0.00 0.00 178.44 179.77 2bry n ASP 461 N -4.59 2.83 0.30 -0.43 -0.08 -1.26 -4.73 116.55 108.60 2bry n ASP 461 Ca 0.15 0.61 0.16 0.00 -1.51 0.00 0.00 54.79 54.20 2bry n ASP 461 Cb 0.23 -1.35 0.96 0.00 2.34 0.00 0.00 41.12 43.30 2bry n ASP 461 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2bry h PRO 462 N 11.49 0.00 0.00 -0.67 0.13 -1.95 -0.78 132.00 140.22 2bry h PRO 462 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2bry h PRO 462 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2bry h PRO 462 CO 0.98 0.01 0.00 0.00 -0.23 0.00 0.00 178.00 178.76 2bry h ALA 463 N 1.99 1.00 0.00 -0.56 0.00 -1.88 0.19 119.26 120.00 2bry h ALA 463 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bry h ALA 463 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2bry h ALA 463 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 179.25 181.04 2bry h THR 464 N 0.00 0.00 0.00 0.00 1.35 -1.44 -3.40 112.91 109.43 2bry h THR 464 Ca 0.00 -0.71 -0.07 0.00 -0.55 0.00 0.00 66.41 65.08 2bry h THR 464 Cb 0.17 1.71 -0.01 0.00 -1.73 0.00 0.00 68.15 68.29 2bry h THR 464 CO 0.00 0.00 -1.25 0.54 -0.25 0.00 0.00 175.52 174.56 2bry n ARG 465 N -2.64 0.62 -3.82 4.72 1.74 -0.16 -4.55 116.66 112.57 2bry n ARG 465 Ca 0.05 0.02 -0.36 0.00 -0.77 0.00 0.00 57.85 56.79 2bry n ARG 465 Cb 0.47 -1.09 -0.13 0.00 -1.02 0.00 0.00 32.46 30.69 2bry n ARG 465 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2bry s TYR 466 N -2.09 3.16 0.38 -1.55 2.02 0.50 -1.96 117.35 117.80 2bry s TYR 466 Ca -0.05 -1.27 -0.28 0.00 -0.37 0.00 0.00 57.07 55.10 2bry s TYR 466 Cb 0.01 -2.20 -0.10 0.00 -0.40 0.00 0.00 41.96 39.27 2bry s TYR 466 CO 0.11 -0.66 1.41 -2.14 -1.57 0.00 0.00 175.55 172.70 2bry s PRO 467 N 1.42 4.12 -1.10 -1.71 0.02 -1.26 -3.87 135.00 132.61 2bry s PRO 467 Ca 0.01 2.42 -0.20 0.00 0.02 0.00 0.00 61.00 63.24 2bry s PRO 467 Cb -0.18 -2.94 0.00 0.00 0.02 0.00 0.00 34.50 31.40 2bry s PRO 467 CO 0.01 -0.47 0.76 0.09 -0.33 0.00 0.00 177.00 177.06 2bry n ASN 468 N 0.44 -5.27 -4.69 2.53 4.13 -1.26 -4.86 115.26 106.29 2bry n ASN 468 Ca 0.01 -1.01 -0.42 0.00 1.68 0.00 0.00 54.58 54.84 2bry n ASN 468 Cb 0.41 -3.09 -0.03 0.00 -1.54 0.00 0.00 39.78 35.53 2bry n ASN 468 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2bry s LEU 469 N -6.37 4.30 -0.86 3.41 0.20 -1.25 -4.98 118.68 113.13 2bry s LEU 469 Ca 0.42 2.04 -0.10 0.00 0.69 0.00 0.00 54.13 57.18 2bry s LEU 469 Cb -0.16 -3.56 0.22 0.00 -0.43 0.00 0.00 46.19 42.26 2bry s LEU 469 CO 0.88 -0.70 0.78 0.21 -0.29 0.00 0.00 176.35 177.23 2bry s ASN 470 N 1.83 6.52 0.00 3.68 3.84 -1.26 -4.90 114.94 124.65 2bry s ASN 470 Ca 0.62 -3.02 0.19 0.00 0.21 0.00 0.00 52.86 50.86 2bry s ASN 470 Cb -0.30 -2.11 1.14 0.00 -0.55 0.00 0.00 41.25 39.42 2bry s ASN 470 CO 0.25 -0.43 1.56 0.18 -2.79 0.00 0.00 177.10 175.87 2bry n LEU 471 N 3.44 0.00 -0.20 3.21 4.77 -1.26 -2.71 117.00 124.25 2bry n LEU 471 Ca 0.16 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.17 2bry n LEU 471 Cb 0.43 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.58 2bry n LEU 471 CO 0.36 0.00 0.55 0.54 -1.33 0.00 0.00 177.39 177.51 2bry n ARG 472 N -0.92 2.77 -0.16 3.23 5.12 -1.26 -4.36 116.66 121.08 2bry n ARG 472 Ca 0.14 -1.82 0.23 0.00 -1.93 0.00 0.00 57.85 54.47 2bry n ARG 472 Cb 0.07 -1.16 0.64 0.00 -1.16 0.00 0.00 32.46 30.84 2bry n ARG 472 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2bry h ALA 473 N 0.57 2.53 -4.13 7.54 0.00 -1.85 -3.36 119.26 120.55 2bry h ALA 473 Ca 0.00 -0.01 -0.69 0.00 0.00 0.00 0.00 54.91 54.21 2bry h ALA 473 Cb 0.66 0.02 -0.29 0.00 0.00 0.00 0.00 17.79 18.18 2bry h ALA 473 CO 0.01 -0.77 -0.86 0.08 0.00 0.00 0.00 179.25 177.71 2bry s VAL 474 N -5.16 2.28 0.20 0.00 1.01 -1.26 -4.99 120.40 112.49 2bry s VAL 474 Ca -0.06 -1.00 0.05 0.00 0.00 0.00 0.00 61.98 60.97 2bry s VAL 474 Cb 0.21 -1.84 -0.04 0.00 0.00 0.00 0.00 36.38 34.72 2bry s VAL 474 CO 0.77 0.57 0.21 0.42 0.00 0.00 0.00 175.10 177.07 2bry s THR 475 N -0.34 4.70 0.33 3.92 -4.23 -1.26 -4.52 115.64 114.24 2bry s THR 475 Ca 0.02 -1.13 0.07 0.00 -1.18 0.00 0.00 61.69 59.48 2bry s THR 475 Cb -0.12 -3.47 0.40 0.00 1.34 0.00 0.00 72.50 70.65 2bry s THR 475 CO 0.02 -0.22 1.57 -2.65 -0.54 0.00 0.00 174.62 172.80 2bry n PRO 476 N -0.81 -0.07 -0.13 3.99 -0.02 -1.26 -1.28 135.00 135.41 2bry n PRO 476 Ca -0.08 1.46 -0.03 0.00 -2.02 0.00 0.00 63.50 62.84 2bry n PRO 476 Cb 0.56 -2.41 0.19 0.00 -0.02 0.00 0.00 33.50 31.83 2bry n PRO 476 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 2bry h ASN 477 N 0.00 0.77 1.06 2.55 4.21 -1.95 -2.96 115.58 119.25 2bry h ASN 477 Ca 0.67 -0.14 0.00 0.00 1.21 0.00 0.00 56.30 58.05 2bry h ASN 477 Cb 1.53 -0.20 0.00 0.00 -1.12 0.00 0.00 38.32 38.53 2bry h ASN 477 CO -0.89 0.75 0.00 1.56 -1.29 0.00 0.00 177.43 177.56 2bry h GLN 478 N 0.80 0.00 -0.40 0.81 4.20 -1.59 -3.19 115.11 115.75 2bry h GLN 478 Ca 0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.89 2bry h GLN 478 Cb 0.29 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.07 2bry h GLN 478 CO -0.00 0.00 0.00 1.33 -0.67 0.00 0.00 178.83 179.49 2bry n VAL 479 N -2.95 2.42 -0.25 -0.54 0.24 -1.12 -4.71 118.33 111.42 2bry n VAL 479 Ca 0.01 -1.66 0.03 0.00 -2.04 0.00 0.00 64.34 60.69 2bry n VAL 479 Cb 0.31 -0.23 0.26 0.00 -1.47 0.00 0.00 33.84 32.72 2bry n VAL 479 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 2bry h GLN 480 N 2.72 0.95 0.00 7.34 4.20 -1.64 -1.04 115.11 127.64 2bry h GLN 480 Ca 0.00 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.65 2bry h GLN 480 Cb 1.63 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 29.20 2bry h GLN 480 CO 0.32 0.63 0.00 -0.40 -0.67 0.00 0.00 178.83 178.71 2bry n ASP 481 N -4.46 0.38 -0.12 1.46 5.75 -1.26 -2.05 116.55 116.25 2bry n ASP 481 Ca 0.11 0.60 0.13 0.00 -0.01 0.00 0.00 54.79 55.62 2bry n ASP 481 Cb 0.14 -0.68 0.38 0.00 -1.03 0.00 0.00 41.12 39.94 2bry n ASP 481 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2bry n LEU 482 N -1.93 0.68 -4.17 -2.12 4.77 -0.39 -4.65 117.00 109.18 2bry n LEU 482 Ca 0.02 -0.07 -0.37 0.00 -0.03 0.00 0.00 56.01 55.56 2bry n LEU 482 Cb 0.18 -0.20 -0.12 0.00 -2.33 0.00 0.00 43.42 40.94 2bry n LEU 482 CO 0.15 0.14 -0.21 -0.47 -1.33 0.00 0.00 177.39 175.67 2bry s TYR 483 N -2.71 3.44 -1.02 -1.77 5.04 -0.87 -0.40 117.35 119.06 2bry s TYR 483 Ca 0.19 -2.06 -0.14 0.00 -2.44 0.00 0.00 57.07 52.62 2bry s TYR 483 Cb 0.19 -2.85 0.20 0.00 0.35 0.00 0.00 41.96 39.85 2bry s TYR 483 CO 0.58 -0.89 1.11 0.34 -1.34 0.00 0.00 175.55 175.35 2bry s ASP 484 N 1.71 6.94 -0.55 4.32 2.15 0.39 -4.97 116.67 126.66 2bry s ASP 484 Ca 0.03 -2.82 -0.22 0.00 0.43 0.00 0.00 52.55 49.98 2bry s ASP 484 Cb -0.22 -2.31 0.05 0.00 -0.30 0.00 0.00 42.92 40.15 2bry s ASP 484 CO -0.02 -0.67 0.81 -0.32 -0.17 0.00 0.00 175.17 174.80 2bry s MET 485 N 0.83 3.21 0.38 4.34 -2.45 -1.26 -1.35 119.30 122.99 2bry s MET 485 Ca 0.31 -0.64 0.21 0.00 -1.25 0.00 0.00 55.69 54.32 2bry s MET 485 Cb -0.07 -4.10 0.38 0.00 1.25 0.00 0.00 34.83 32.29 2bry s MET 485 CO -0.07 -1.43 1.60 0.52 1.05 0.00 0.00 175.02 176.69 2bry h MET 486 N 9.22 0.00 0.00 4.11 0.00 -1.81 -3.48 114.93 122.97 2bry h MET 486 Ca -0.27 0.00 -0.14 0.00 0.00 0.00 0.00 59.70 59.29 2bry h MET 486 Cb 1.08 0.00 -0.03 0.00 0.00 0.00 0.00 31.60 32.65 2bry h MET 486 CO 1.05 0.24 -0.01 -0.40 0.00 0.00 0.00 176.91 177.79 2bry n ASP 487 N -3.19 -1.18 -1.43 1.22 3.85 -1.26 -5.04 116.55 109.52 2bry n ASP 487 Ca 0.02 -2.27 0.01 0.00 -0.71 0.00 0.00 54.79 51.85 2bry n ASP 487 Cb 0.58 2.09 0.28 0.00 -1.35 0.00 0.00 41.12 42.73 2bry n ASP 487 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 2bry n LYS 488 N -0.40 3.22 0.00 0.11 4.01 -1.26 -4.94 118.16 118.90 2bry n LYS 488 Ca -0.02 -3.02 0.14 0.00 -0.51 0.00 0.00 58.31 54.90 2bry n LYS 488 Cb 0.42 -2.02 0.45 0.00 -0.51 0.00 0.00 35.03 33.37 2bry n LYS 488 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68