#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 4.11 0.28 8.00 3.84 -1.26 -5.02 114.94 124.89 2bry s ASN 8 Ca 0.00 -1.83 -0.03 0.00 0.21 0.00 0.00 52.86 51.22 2bry s ASN 8 Cb 0.00 -1.00 0.40 0.00 -0.55 0.00 0.00 41.25 40.10 2bry s ASN 8 CO 0.00 -0.39 1.94 -0.65 -2.79 0.00 0.00 177.10 175.20 2bry h PRO 9 N 7.87 1.15 -0.52 0.43 0.11 -1.99 -1.05 132.00 138.00 2bry h PRO 9 Ca -0.11 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 65.91 2bry h PRO 9 Cb 1.01 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 31.83 2bry h PRO 9 CO 0.48 0.76 0.21 0.00 -0.21 0.00 0.00 178.00 179.24 2bry h ALA 10 N 1.45 0.68 -0.28 -0.75 0.00 -1.91 -0.67 119.26 117.78 2bry h ALA 10 Ca 0.35 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2bry h ALA 10 Cb -0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2bry h ALA 10 CO -0.10 0.29 0.09 0.45 0.00 0.00 0.00 179.25 179.98 2bry h HIS 11 N 0.71 0.45 -0.54 0.00 3.86 -1.81 -0.47 115.15 117.35 2bry h HIS 11 Ca 0.18 -0.05 0.06 0.00 -1.16 0.00 0.00 60.37 59.40 2bry h HIS 11 Cb 0.19 -0.13 -0.05 0.00 1.06 0.00 0.00 27.41 28.48 2bry h HIS 11 CO 0.00 0.48 0.26 -0.44 0.86 0.00 0.00 177.93 179.09 2bry h ASP 12 N 0.29 0.34 -0.42 2.45 3.32 -1.09 -0.56 116.42 120.75 2bry h ASP 12 Ca 0.09 0.04 -0.12 0.00 0.02 0.00 0.00 57.03 57.06 2bry h ASP 12 Cb 0.25 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2bry h ASP 12 CO -0.00 0.23 -0.21 0.45 -1.72 0.00 0.00 179.24 177.99 2bry h HIS 13 N 0.49 1.02 -0.36 4.55 3.86 -0.89 -1.02 115.15 122.80 2bry h HIS 13 Ca 0.25 -0.26 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 2bry h HIS 13 Cb 0.20 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.41 2bry h HIS 13 CO -0.12 1.04 0.19 0.35 0.86 0.00 0.00 177.93 180.25 2bry h PHE 14 N 0.71 0.50 -0.73 2.45 3.57 -0.76 0.18 116.94 122.85 2bry h PHE 14 Ca 0.09 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.55 2bry h PHE 14 Cb 0.78 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.32 2bry h PHE 14 CO 0.06 0.41 0.37 0.93 -2.23 0.00 0.00 178.31 177.85 2bry h GLU 15 N 0.45 1.05 -0.58 1.11 5.08 -0.99 0.44 114.58 121.13 2bry h GLU 15 Ca 0.13 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 2bry h GLU 15 Cb 0.08 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 2bry h GLU 15 CO -0.02 0.81 0.28 1.15 -1.00 0.00 0.00 179.01 180.22 2bry h THR 16 N 1.02 1.21 -0.07 1.13 2.02 -0.96 -2.47 112.91 114.80 2bry h THR 16 Ca 0.25 -0.60 0.01 0.00 0.77 0.00 0.00 66.41 66.85 2bry h THR 16 Cb 0.09 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 67.02 2bry h THR 16 CO -0.03 0.24 -0.02 0.15 0.37 0.00 0.00 175.52 176.22 2bry h PHE 17 N 0.79 -0.06 -0.93 3.16 3.57 -0.52 -0.00 116.94 122.96 2bry h PHE 17 Ca 0.20 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.80 2bry h PHE 17 Cb 0.13 0.03 -0.08 0.00 2.79 0.00 0.00 35.95 38.82 2bry h PHE 17 CO -0.00 -0.04 0.57 0.28 -2.23 0.00 0.00 178.31 176.89 2bry h VAL 18 N -0.01 0.95 -0.01 1.41 2.07 -0.78 -2.70 116.25 117.17 2bry h VAL 18 Ca 0.04 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.23 2bry h VAL 18 Cb 0.07 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 29.76 2bry h VAL 18 CO -0.08 0.17 -0.25 0.00 0.02 0.00 0.00 177.57 177.44 2bry n GLN 19 N -4.65 1.03 -1.74 1.57 10.64 -0.94 -4.77 117.38 118.52 2bry n GLN 19 Ca 0.16 -0.66 -0.42 0.00 -1.83 0.00 0.00 57.00 54.25 2bry n GLN 19 Cb 0.29 -1.49 -0.02 0.00 -0.86 0.00 0.00 30.24 28.16 2bry n GLN 19 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2bry n ALA 20 N -0.41 2.67 0.28 2.61 0.00 -0.05 -4.90 120.51 120.71 2bry n ALA 20 Ca 0.13 0.38 0.05 0.00 0.00 0.00 0.00 53.44 53.99 2bry n ALA 20 Cb 0.37 -2.48 0.05 0.00 0.00 0.00 0.00 19.45 17.39 2bry n ALA 20 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2bry n GLN 21 N 2.50 0.75 -4.92 0.00 1.13 -1.26 -4.86 117.38 110.71 2bry n GLN 21 Ca 0.10 -1.21 -0.26 0.00 -1.94 0.00 0.00 57.00 53.69 2bry n GLN 21 Cb 0.37 -1.18 -0.16 0.00 0.11 0.00 0.00 30.24 29.38 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 -0.80 2.01 0.20 1.08 1.43 -1.26 -5.04 118.68 116.30 2bry s LEU 22 Ca 0.12 -0.35 -0.12 0.00 -1.03 0.00 0.00 54.13 52.75 2bry s LEU 22 Cb 0.08 -1.00 0.24 0.00 0.03 0.00 0.00 46.19 45.55 2bry s LEU 22 CO 0.12 0.22 1.68 0.00 0.23 0.00 0.00 176.35 178.60 2bry h GLN 24 N 0.15 0.83 -0.25 0.00 5.75 -1.97 -1.80 115.11 117.83 2bry h GLN 24 Ca 0.29 -0.06 -0.15 0.00 -0.15 0.00 0.00 58.65 58.58 2bry h GLN 24 Cb 0.44 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.80 2bry h GLN 24 CO -0.44 0.57 -0.45 -0.44 -2.65 0.00 0.00 178.83 175.41 2bry h ASP 25 N 0.85 0.69 -0.28 -0.69 3.32 -1.65 -0.97 116.42 117.69 2bry h ASP 25 Ca 0.23 -0.33 0.02 0.00 0.02 0.00 0.00 57.03 56.97 2bry h ASP 25 Cb -0.07 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 2bry h ASP 25 CO -0.05 1.04 0.14 0.58 -1.72 0.00 0.00 179.24 179.23 2bry h VAL 26 N 0.51 0.99 -0.32 -1.35 2.07 -0.82 -1.11 116.25 116.22 2bry h VAL 26 Ca 0.03 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 2bry h VAL 26 Cb 0.99 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 2bry h VAL 26 CO 0.09 0.05 0.11 -0.07 0.02 0.00 0.00 177.57 177.78 2bry h LEU 27 N 0.29 0.46 -0.36 2.57 3.38 -1.11 -0.15 115.31 120.39 2bry h LEU 27 Ca 0.11 -0.19 -0.13 0.00 0.09 0.00 0.00 57.88 57.77 2bry h LEU 27 Cb 0.04 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2bry h LEU 27 CO -0.08 0.53 -0.28 0.77 0.09 0.00 0.00 178.44 179.46 2bry h SER 28 N 0.37 0.87 -0.14 -0.43 4.64 -1.13 -0.91 113.55 116.82 2bry h SER 28 Ca 0.11 -0.45 -0.13 0.00 -0.47 0.00 0.00 61.79 60.85 2bry h SER 28 Cb 0.22 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 2bry h SER 28 CO -0.01 1.13 -0.37 0.77 -0.87 0.00 0.00 176.83 177.49 2bry h SER 29 N 0.61 0.69 -0.72 4.97 4.64 -1.13 -0.60 113.55 122.02 2bry h SER 29 Ca 0.07 -0.30 -0.06 0.00 -0.47 0.00 0.00 61.79 61.03 2bry h SER 29 Cb 0.86 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.72 2bry h SER 29 CO 0.07 0.99 0.23 0.15 -0.87 0.00 0.00 176.83 177.40 2bry h PHE 30 N 0.55 1.15 -0.65 4.77 3.57 -0.85 -0.15 116.94 125.33 2bry h PHE 30 Ca 0.05 -0.11 -0.08 0.00 3.53 0.00 0.00 57.97 61.36 2bry h PHE 30 Cb 0.88 -0.33 -0.03 0.00 2.79 0.00 0.00 35.95 39.26 2bry h PHE 30 CO 0.04 0.91 0.11 1.96 -2.23 0.00 0.00 178.31 179.10 2bry h GLN 31 N 1.05 1.07 -0.81 1.11 1.08 -0.86 -0.31 115.11 117.46 2bry h GLN 31 Ca 0.23 -0.28 0.01 0.00 -1.45 0.00 0.00 58.65 57.16 2bry h GLN 31 Cb 0.30 -0.13 -0.04 0.00 -0.05 0.00 0.00 27.48 27.56 2bry h GLN 31 CO -0.01 0.99 0.53 0.78 -0.95 0.00 0.00 178.83 180.17 2bry h GLY 32 N 0.99 1.14 0.99 3.46 0.00 -0.82 -1.15 103.07 107.68 2bry h GLY 32 Ca 0.20 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 2bry h GLY 32 CO 0.01 0.40 -0.10 -2.00 0.00 0.00 0.00 176.54 174.85 2bry h LEU 33 N 1.08 -0.24 -0.50 3.11 5.85 -0.60 -0.16 115.31 123.85 2bry h LEU 33 Ca 0.30 -0.00 0.04 0.00 0.84 0.00 0.00 57.88 59.05 2bry h LEU 33 Cb -0.11 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 2bry h LEU 33 CO -0.07 -0.16 0.26 0.00 -0.34 0.00 0.00 178.44 178.13 2bry h ARG 35 N 0.52 0.54 -0.10 0.00 3.08 -1.07 0.38 114.38 117.73 2bry h ARG 35 Ca 0.21 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.19 2bry h ARG 35 Cb 0.10 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 2bry h ARG 35 CO -0.14 0.36 -0.13 0.00 -1.07 0.00 0.00 179.97 178.99 2bry h ALA 36 N 1.18 1.61 -0.01 0.04 0.00 -0.61 -2.18 119.26 119.29 2bry h ALA 36 Ca 0.17 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bry h ALA 36 Cb -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2bry h ALA 36 CO -0.06 0.29 -0.33 1.28 0.00 0.00 0.00 179.25 180.43 2bry n LEU 37 N -4.31 1.06 -2.30 0.00 4.77 -0.43 -4.83 117.00 110.96 2bry n LEU 37 Ca -0.01 -0.29 -0.18 0.00 -0.03 0.00 0.00 56.01 55.50 2bry n LEU 37 Cb 0.24 -0.12 0.02 0.00 -2.33 0.00 0.00 43.42 41.23 2bry n LEU 37 CO 0.37 0.21 -0.06 0.61 -1.33 0.00 0.00 177.39 177.19 2bry n GLY 38 N 1.37 -0.29 3.52 -0.72 0.00 0.04 -5.03 105.19 104.08 2bry n GLY 38 Ca 0.11 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 2bry n GLY 38 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bry s VAL 39 N -2.99 2.79 0.01 1.61 -7.23 -0.68 -5.04 120.40 108.88 2bry s VAL 39 Ca 0.18 -2.17 -0.16 0.00 -1.81 0.00 0.00 61.98 58.01 2bry s VAL 39 Cb -0.08 -2.46 -0.06 0.00 0.56 0.00 0.00 36.38 34.35 2bry s VAL 39 CO 0.22 -0.34 0.44 -1.61 -0.31 0.00 0.00 175.10 173.50 2bry s GLU 40 N -3.42 3.99 0.95 4.82 0.41 -1.26 -4.28 118.70 119.92 2bry s GLU 40 Ca 0.29 0.48 -0.12 0.00 -0.41 0.00 0.00 54.97 55.21 2bry s GLU 40 Cb -0.06 -3.23 0.16 0.00 -1.78 0.00 0.00 34.13 29.22 2bry s GLU 40 CO 0.16 0.66 1.09 -1.54 -0.49 0.00 0.00 175.26 175.14 2bry s SER 41 N -1.02 2.95 -1.05 -0.19 1.04 -1.26 -3.89 113.70 110.28 2bry s SER 41 Ca 0.25 1.44 0.00 0.00 0.48 0.00 0.00 55.95 58.12 2bry s SER 41 Cb -0.17 -2.11 0.00 0.00 0.10 0.00 0.00 66.02 63.83 2bry s SER 41 CO 0.14 -2.96 0.00 0.61 0.98 0.00 0.00 173.24 172.01 2bry n GLY 42 N -0.86 1.14 1.58 7.32 0.00 -1.25 -4.91 105.19 108.21 2bry n GLY 42 Ca 0.06 -0.57 0.05 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.76 2.66 7.00 -0.02 0.00 -1.15 -4.61 105.19 107.32 2bry n GLY 43 Ca -0.10 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 0.46 0.65 0.21 -0.02 0.00 -0.97 -2.47 105.19 103.06 2bry n GLY 44 Ca 0.22 -0.82 0.08 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.57 0.99 3.38 -1.85 -2.35 115.31 114.91 2bry h LEU 45 Ca 0.00 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 2bry h LEU 45 Cb 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 2bry h LEU 45 CO 0.00 0.28 0.32 -1.28 0.09 0.00 0.00 178.44 177.85 2bry h SER 46 N 0.00 0.49 -0.33 -0.43 0.87 -1.92 -0.21 113.55 112.01 2bry h SER 46 Ca -0.00 0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.59 2bry h SER 46 Cb 0.68 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.54 2bry h SER 46 CO 0.04 0.33 0.19 -0.61 -0.53 0.00 0.00 176.83 176.25 2bry h GLN 47 N 0.62 0.37 -0.43 2.24 4.15 -1.10 -1.32 115.11 119.64 2bry h GLN 47 Ca 0.25 -0.02 0.06 0.00 0.77 0.00 0.00 58.65 59.70 2bry h GLN 47 Cb 0.11 -0.08 -0.05 0.00 0.21 0.00 0.00 27.48 27.67 2bry h GLN 47 CO -0.14 0.25 0.15 -0.92 -1.93 0.00 0.00 178.83 176.23 2bry h TYR 48 N 0.38 0.26 -0.85 3.99 3.20 -1.23 -0.19 116.97 122.53 2bry h TYR 48 Ca 0.13 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 2bry h TYR 48 Cb 0.02 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.19 2bry h TYR 48 CO -0.08 0.09 0.51 0.45 -1.64 0.00 0.00 178.16 177.49 2bry h HIS 49 N 0.31 1.13 -0.21 -3.82 3.86 -0.71 -1.37 115.15 114.34 2bry h HIS 49 Ca 0.20 -0.01 -0.15 0.00 -1.16 0.00 0.00 60.37 59.26 2bry h HIS 49 Cb 0.20 -0.37 -0.01 0.00 1.06 0.00 0.00 27.41 28.29 2bry h HIS 49 CO -0.16 0.75 -0.49 0.87 0.86 0.00 0.00 177.93 179.77 2bry h LYS 50 N 1.17 0.57 0.23 2.45 1.57 -0.71 -1.23 116.57 120.62 2bry h LYS 50 Ca 0.31 -0.33 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 2bry h LYS 50 Cb -0.04 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.30 2bry h LYS 50 CO -0.06 0.93 -0.11 0.82 -0.57 0.00 0.00 179.45 180.46 2bry h ILE 51 N 0.45 0.85 -0.01 1.86 2.04 -0.86 -3.15 117.51 118.68 2bry h ILE 51 Ca 0.02 -0.59 -0.04 0.00 1.00 0.00 0.00 64.86 65.25 2bry h ILE 51 Cb 1.01 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 38.27 2bry h ILE 51 CO 0.09 0.13 -0.19 0.07 0.00 0.00 0.00 178.15 178.25 2bry h LYS 52 N -0.61 0.02 0.00 2.37 2.10 -1.23 -1.55 116.57 117.68 2bry h LYS 52 Ca -0.03 -0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.60 2bry h LYS 52 Cb 0.44 -0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.77 2bry h LYS 52 CO 0.05 0.21 -0.07 0.00 -2.00 0.00 0.00 179.45 177.65 2bry h ALA 53 N 1.79 1.51 -0.01 0.07 0.00 -1.21 -2.47 119.26 118.93 2bry h ALA 53 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2bry h ALA 53 Cb 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2bry h ALA 53 CO 0.03 0.09 -0.43 1.04 0.00 0.00 0.00 179.25 179.97 2bry n GLN 54 N -3.90 1.15 -2.35 0.00 6.02 -0.60 -4.42 117.38 113.27 2bry n GLN 54 Ca -0.02 -0.91 -0.18 0.00 -0.01 0.00 0.00 57.00 55.87 2bry n GLN 54 Cb 0.16 -1.48 0.02 0.00 1.02 0.00 0.00 30.24 29.96 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 -0.13 3.83 -4.46 1.08 4.77 -0.93 -4.93 117.00 116.23 2bry n LEU 55 Ca 0.10 -4.38 -0.43 0.00 -0.03 0.00 0.00 56.01 51.27 2bry n LEU 55 Cb 0.45 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 2bry n LEU 55 CO 0.28 1.85 1.83 -3.20 -1.33 0.00 0.00 177.39 176.82 2bry n ASN 56 N -0.58 4.97 -3.63 -1.43 5.15 -1.22 -4.38 115.26 114.15 2bry n ASN 56 Ca 0.32 -2.94 -0.09 0.00 -0.60 0.00 0.00 54.58 51.27 2bry n ASN 56 Cb 0.85 -1.67 -0.02 0.00 -0.53 0.00 0.00 39.78 38.41 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 3.14 0.15 0.28 1.20 -0.85 -1.26 -5.00 117.35 115.01 2bry s TYR 57 Ca 0.49 -0.61 -0.00 0.00 -0.52 0.00 0.00 57.07 56.43 2bry s TYR 57 Cb 0.03 0.52 0.64 0.00 0.38 0.00 0.00 41.96 43.53 2bry s TYR 57 CO 0.04 -1.24 1.64 0.11 -1.52 0.00 0.00 175.55 174.58 2bry h TRP 58 N 2.08 0.21 0.00 -3.49 5.08 -2.02 -1.02 115.95 116.79 2bry h TRP 58 Ca -0.25 0.05 -0.10 0.00 1.08 0.00 0.00 58.89 59.67 2bry h TRP 58 Cb 1.25 0.04 -0.01 0.00 -3.00 0.00 0.00 29.16 27.44 2bry h TRP 58 CO 0.74 -0.24 -0.48 1.03 -1.28 0.00 0.00 178.44 178.21 2bry h SER 59 N 0.16 0.00 0.00 0.11 0.87 -1.98 -3.36 113.55 109.35 2bry h SER 59 Ca 0.52 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.08 2bry h SER 59 Cb 1.02 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.98 2bry h SER 59 CO -0.68 0.48 -1.36 0.00 -0.53 0.00 0.00 176.83 174.74 2bry n ALA 60 N -2.44 2.36 -0.11 6.23 0.00 -0.50 -4.78 120.51 121.27 2bry n ALA 60 Ca -0.01 -0.21 -0.08 0.00 0.00 0.00 0.00 53.44 53.14 2bry n ALA 60 Cb 0.50 -0.30 -0.02 0.00 0.00 0.00 0.00 19.45 19.63 2bry n ALA 60 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2bry h LYS 61 N 0.00 -0.26 -0.27 0.00 1.57 -1.41 -1.64 116.57 114.57 2bry h LYS 61 Ca 0.00 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 2bry h LYS 61 Cb 0.39 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 2bry h LYS 61 CO 0.00 -0.17 0.12 0.66 -0.57 0.00 0.00 179.45 179.49 2bry h SER 62 N -0.27 0.32 -0.16 0.86 4.64 -1.86 -2.48 113.55 114.60 2bry h SER 62 Ca 0.16 -0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 61.40 2bry h SER 62 Cb 0.54 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 62.55 2bry h SER 62 CO -0.52 0.28 -0.16 0.25 -0.87 0.00 0.00 176.83 175.81 2bry h LEU 63 N 0.37 0.43 -1.04 5.97 5.85 -1.63 -2.78 115.31 122.48 2bry h LEU 63 Ca 0.09 -0.48 0.03 0.00 0.84 0.00 0.00 57.88 58.37 2bry h LEU 63 Cb 0.05 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 40.90 2bry h LEU 63 CO -0.01 0.81 0.65 -0.50 -0.34 0.00 0.00 178.44 179.05 2bry h TRP 64 N 0.04 1.21 -0.73 1.25 -0.00 -1.16 -0.96 115.95 115.60 2bry h TRP 64 Ca 0.03 0.03 -0.01 0.00 -0.00 0.00 0.00 58.89 58.94 2bry h TRP 64 Cb 0.69 -0.40 -0.03 0.00 -0.00 0.00 0.00 29.16 29.41 2bry h TRP 64 CO 0.08 0.70 0.43 0.00 -0.00 0.00 0.00 178.44 179.65 2bry h ALA 65 N 1.42 0.93 -0.11 1.49 0.00 -1.39 0.13 119.26 121.73 2bry h ALA 65 Ca 0.39 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2bry h ALA 65 Cb -0.01 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 2bry h ALA 65 CO -0.12 0.41 0.02 0.87 0.00 0.00 0.00 179.25 180.44 2bry h LYS 66 N 1.00 0.18 -0.34 0.00 1.57 -1.15 -1.85 116.57 115.98 2bry h LYS 66 Ca 0.26 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.88 2bry h LYS 66 Cb -0.01 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 2bry h LYS 66 CO -0.05 0.37 -0.24 -0.07 -0.57 0.00 0.00 179.45 178.90 2bry h LEU 67 N -0.03 0.68 -0.70 2.94 3.38 -0.99 -2.39 115.31 118.20 2bry h LEU 67 Ca 0.03 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 2bry h LEU 67 Cb 0.27 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2bry h LEU 67 CO 0.00 0.90 0.32 0.44 0.09 0.00 0.00 178.44 180.19 2bry h ASP 68 N 0.59 0.93 -0.57 -0.43 3.32 -0.76 0.13 116.42 119.63 2bry h ASP 68 Ca 0.08 -0.15 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 2bry h ASP 68 Cb 0.71 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.00 2bry h ASP 68 CO 0.05 0.82 0.34 0.50 -1.72 0.00 0.00 179.24 179.23 2bry h LYS 69 N 0.98 0.78 -0.00 3.56 3.64 -1.04 -0.38 116.57 124.12 2bry h LYS 69 Ca 0.24 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2bry h LYS 69 Cb 0.15 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.81 2bry h LYS 69 CO -0.03 0.57 -0.00 -0.09 -2.27 0.00 0.00 179.45 177.63 2bry h ARG 70 N 0.76 0.00 -0.17 1.90 9.65 -1.14 -3.19 114.38 122.20 2bry h ARG 70 Ca 0.20 -0.00 0.05 0.00 -1.10 0.00 0.00 59.98 59.13 2bry h ARG 70 Cb -0.00 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.57 2bry h ARG 70 CO -0.04 0.36 0.13 0.00 2.80 0.00 0.00 179.97 183.23 2bry h ALA 71 N 0.64 2.09 -0.00 2.80 0.00 -0.55 -2.09 119.26 122.15 2bry h ALA 71 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2bry h ALA 71 Cb 0.36 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2bry h ALA 71 CO 0.00 -0.22 -0.04 -1.13 0.00 0.00 0.00 179.25 177.87 2bry n SER 72 N -4.37 0.36 -4.76 0.00 3.41 -0.17 -4.49 113.62 103.61 2bry n SER 72 Ca 0.01 -0.78 -0.41 0.00 -0.26 0.00 0.00 58.87 57.43 2bry n SER 72 Cb 0.26 -0.07 -0.01 0.00 -0.26 0.00 0.00 64.21 64.13 2bry n SER 72 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2bry s GLN 73 N -2.26 4.11 0.55 4.33 -0.21 -0.79 -4.88 119.66 120.52 2bry s GLN 73 Ca 0.37 2.59 0.26 0.00 0.02 0.00 0.00 55.36 58.59 2bry s GLN 73 Cb 0.21 -3.00 1.46 0.00 1.00 0.00 0.00 33.01 32.67 2bry s GLN 73 CO 0.42 -0.61 2.03 -1.35 -2.12 0.00 0.00 175.29 173.65 2bry h PRO 74 N 4.28 0.00 -0.17 2.91 0.11 -1.91 -2.08 132.00 135.15 2bry h PRO 74 Ca -0.48 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.68 2bry h PRO 74 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2bry h PRO 74 CO 0.75 0.00 0.13 -0.24 -0.21 0.00 0.00 178.00 178.43 2bry h VAL 75 N 0.00 0.85 0.00 3.15 3.04 -1.95 -1.31 116.25 120.04 2bry h VAL 75 Ca 0.18 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.87 2bry h VAL 75 Cb 0.80 0.91 0.00 0.00 -2.01 0.00 0.00 31.29 30.99 2bry h VAL 75 CO -0.00 0.00 -0.37 -1.22 -1.01 0.00 0.00 177.57 174.97 2bry n TYR 76 N -4.39 0.47 -3.96 3.17 4.01 -0.78 -4.86 117.16 110.80 2bry n TYR 76 Ca 0.01 0.14 -0.28 0.00 -0.16 0.00 0.00 57.90 57.61 2bry n TYR 76 Cb 0.26 -0.63 -0.01 0.00 -0.31 0.00 0.00 39.34 38.66 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 -1.95 -3.93 -3.52 -0.72 6.02 -0.49 -1.49 117.38 111.30 2bry n GLN 77 Ca 0.05 0.47 -0.26 0.00 -0.01 0.00 0.00 57.00 57.24 2bry n GLN 77 Cb 0.40 -4.93 0.01 0.00 1.02 0.00 0.00 30.24 26.75 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 -4.43 -4.38 -0.80 -1.09 3.00 -1.26 -0.93 117.38 107.49 2bry n GLN 78 Ca -0.16 0.59 0.00 0.00 -0.01 0.00 0.00 57.00 57.42 2bry n GLN 78 Cb 0.61 -5.39 0.00 0.00 0.00 0.00 0.00 30.24 25.46 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 -1.42 0.69 0.09 1.08 0.00 -0.55 -4.92 105.19 100.15 2bry n GLY 79 Ca -0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 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 -2.56 0.57 -0.26 1.61 1.13 -0.11 -3.96 117.38 113.80 2bry n GLN 80 Ca 0.00 0.05 0.01 0.00 -1.94 0.00 0.00 57.00 55.13 2bry n GLN 80 Cb 0.00 -1.75 0.14 0.00 0.11 0.00 0.00 30.24 28.75 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 2.07 1.05 -0.08 -1.58 0.00 -1.36 -2.99 119.26 116.37 2bry h ALA 81 Ca 0.00 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 2bry h ALA 81 Cb 0.97 -0.11 -0.18 0.00 0.00 0.00 0.00 17.79 18.47 2bry h ALA 81 CO 0.00 0.05 -0.73 0.00 0.00 0.00 0.00 179.25 178.57 2bry h THR 83 N 3.26 0.56 -0.45 0.00 1.03 -1.59 0.36 112.91 116.09 2bry h THR 83 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.35 2bry h THR 83 Cb 1.35 0.75 0.00 0.00 -1.07 0.00 0.00 68.15 69.18 2bry h THR 83 CO 0.10 0.00 0.00 0.59 -0.01 0.00 0.00 175.52 176.20 2bry n ASN 84 N -4.02 3.20 -4.73 0.00 5.03 -1.26 -4.69 115.26 108.78 2bry n ASN 84 Ca 0.06 -1.97 -0.40 0.00 0.87 0.00 0.00 54.58 53.13 2bry n ASN 84 Cb 0.50 -0.30 -0.05 0.00 -1.02 0.00 0.00 39.78 38.92 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 -1.02 4.68 -0.17 3.41 2.01 0.11 -4.97 115.64 119.69 2bry s THR 85 Ca 0.31 1.81 -0.01 0.00 0.31 0.00 0.00 61.69 64.11 2bry s THR 85 Cb 0.16 -4.20 -0.01 0.00 0.01 0.00 0.00 72.50 68.47 2bry s THR 85 CO 0.22 0.32 -0.11 -0.54 -0.69 0.00 0.00 174.62 173.82 2bry s LYS 86 N 0.10 3.32 0.09 4.92 1.02 -1.26 -1.43 119.74 126.51 2bry s LYS 86 Ca 0.43 -0.69 0.08 0.00 0.02 0.00 0.00 55.97 55.81 2bry s LYS 86 Cb -0.21 -2.75 -0.04 0.00 -0.52 0.00 0.00 37.83 34.31 2bry s LYS 86 CO 0.25 -0.00 -0.16 0.00 -0.92 0.00 0.00 175.35 174.53 2bry s LEU 88 N -1.98 2.17 -0.13 0.00 2.96 0.16 -1.91 118.68 119.96 2bry s LEU 88 Ca 0.18 -0.59 -0.04 0.00 -0.22 0.00 0.00 54.13 53.46 2bry s LEU 88 Cb -0.11 -1.47 -0.03 0.00 0.50 0.00 0.00 46.19 45.08 2bry s LEU 88 CO 0.10 0.06 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.50 2bry s VAL 89 N 0.92 4.24 -0.36 1.68 1.01 0.72 -0.93 120.40 127.69 2bry s VAL 89 Ca -0.04 -0.25 -0.08 0.00 0.00 0.00 0.00 61.98 61.61 2bry s VAL 89 Cb -0.15 -2.84 0.04 0.00 0.00 0.00 0.00 36.38 33.43 2bry s VAL 89 CO -0.04 0.54 0.16 -0.69 0.00 0.00 0.00 175.10 175.06 2bry s VAL 90 N -0.19 4.11 0.00 2.92 1.01 0.75 -1.04 120.40 127.96 2bry s VAL 90 Ca 0.05 -1.06 0.00 0.00 0.00 0.00 0.00 61.98 60.97 2bry s VAL 90 Cb -0.13 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.92 2bry s VAL 90 CO 0.02 -0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.50 2bry n GLY 91 N 4.89 3.16 2.31 4.51 0.00 -0.14 -0.09 105.19 119.84 2bry n GLY 91 Ca -0.12 -1.22 -0.34 0.00 0.00 0.00 0.00 46.02 44.34 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 0.75 6.27 -1.57 4.61 0.00 -1.26 -4.09 120.51 125.22 2bry n ALA 92 Ca 0.00 -3.45 -0.30 0.00 0.00 0.00 0.00 53.44 49.69 2bry n ALA 92 Cb 0.00 -1.72 0.21 0.00 0.00 0.00 0.00 19.45 17.94 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 -1.84 1.70 0.28 0.00 0.00 -1.26 -4.76 107.32 101.44 2bry s GLY 93 Ca 0.64 -1.12 0.02 0.00 0.00 0.00 0.00 44.72 44.26 2bry s GLY 93 CO -0.00 -0.29 1.77 -2.55 0.00 0.00 0.00 173.10 172.03 2bry h PRO 94 N -2.07 0.69 0.02 2.90 0.11 -1.92 -1.65 132.00 130.08 2bry h PRO 94 Ca -0.44 -0.04 -0.22 0.00 0.11 0.00 0.00 66.00 65.40 2bry h PRO 94 Cb 1.26 -0.16 0.02 0.00 0.11 0.00 0.00 31.00 32.23 2bry h PRO 94 CO 0.35 0.46 -0.88 0.00 -0.21 0.00 0.00 178.00 177.72 2bry h GLY 96 N 0.16 0.37 0.92 0.00 0.00 -1.69 0.60 103.07 103.44 2bry h GLY 96 Ca -0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 47.33 47.17 2bry h GLY 96 CO 0.17 -0.02 0.11 1.41 0.00 0.00 0.00 176.54 178.21 2bry h LEU 97 N 0.18 0.49 -1.06 3.11 3.38 -1.25 -0.10 115.31 120.07 2bry h LEU 97 Ca 0.15 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2bry h LEU 97 Cb 0.17 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 2bry h LEU 97 CO -0.21 0.56 0.58 -0.09 0.09 0.00 0.00 178.44 179.37 2bry h ARG 98 N 0.40 1.21 -0.38 1.13 9.65 -0.89 -0.65 114.38 124.85 2bry h ARG 98 Ca 0.11 -0.09 -0.01 0.00 -1.10 0.00 0.00 59.98 58.89 2bry h ARG 98 Cb 0.24 -0.27 -0.02 0.00 -1.39 0.00 0.00 29.97 28.54 2bry h ARG 98 CO -0.00 0.82 0.19 0.00 2.80 0.00 0.00 179.97 183.78 2bry h ALA 99 N 1.39 0.49 -0.71 2.80 0.00 -0.69 -2.74 119.26 119.80 2bry h ALA 99 Ca 0.33 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.20 2bry h ALA 99 Cb -0.10 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.48 2bry h ALA 99 CO -0.07 0.04 0.40 0.00 0.00 0.00 0.00 179.25 179.63 2bry h ALA 100 N 1.04 0.96 -0.42 0.00 0.00 -0.51 -1.30 119.26 119.03 2bry h ALA 100 Ca 0.13 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.10 2bry h ALA 100 Cb 0.10 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 2bry h ALA 100 CO -0.02 0.09 0.16 0.28 0.00 0.00 0.00 179.25 179.76 2bry h VAL 101 N 0.74 0.88 -0.46 0.00 2.07 -0.97 0.26 116.25 118.77 2bry h VAL 101 Ca 0.32 -0.11 -0.04 0.00 0.82 0.00 0.00 66.70 67.68 2bry h VAL 101 Cb 0.19 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 2bry h VAL 101 CO -0.18 0.06 0.13 -0.33 0.02 0.00 0.00 177.57 177.27 2bry h GLU 102 N 0.33 0.73 -0.55 1.57 4.39 -1.12 -1.30 114.58 118.63 2bry h GLU 102 Ca 0.19 -0.16 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 2bry h GLU 102 Cb 0.17 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.69 2bry h GLU 102 CO -0.19 0.70 0.25 -0.07 -1.16 0.00 0.00 179.01 178.55 2bry h LEU 103 N 0.62 0.70 -0.38 1.33 3.38 -1.05 -1.26 115.31 118.65 2bry h LEU 103 Ca 0.15 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 2bry h LEU 103 Cb 0.29 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2bry h LEU 103 CO -0.00 0.60 0.09 0.00 0.09 0.00 0.00 178.44 179.22 2bry h ALA 104 N 1.51 0.50 -0.00 1.53 0.00 -0.44 -2.31 119.26 120.04 2bry h ALA 104 Ca 0.19 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 2bry h ALA 104 Cb 0.10 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2bry h ALA 104 CO -0.02 0.18 -0.27 -0.07 0.00 0.00 0.00 179.25 179.07 2bry h LEU 105 N 0.46 0.00 -0.64 0.00 3.38 -0.64 -0.99 115.31 116.89 2bry h LEU 105 Ca 0.12 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2bry h LEU 105 Cb 0.32 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2bry h LEU 105 CO 0.00 0.27 0.00 -0.07 0.09 0.00 0.00 178.44 178.73 2bry h LEU 106 N 0.00 0.00 0.00 1.67 3.38 -1.12 -3.34 115.31 115.91 2bry h LEU 106 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2bry h LEU 106 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2bry h LEU 106 CO 0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.17 2bry n GLY 107 N 0.35 0.94 3.82 0.83 0.00 -0.37 -0.87 105.19 109.88 2bry n GLY 107 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.01 2.77 -0.03 4.61 0.00 -0.88 -3.66 121.76 122.56 2bry s ALA 108 Ca 0.00 0.15 -0.30 0.00 0.00 0.00 0.00 51.96 51.81 2bry s ALA 108 Cb 0.00 -3.17 -0.03 0.00 0.00 0.00 0.00 23.12 19.92 2bry s ALA 108 CO 0.00 -0.99 1.00 0.50 0.00 0.00 0.00 175.76 176.27 2bry s ARG 109 N -4.74 4.51 -0.18 0.00 3.52 -0.51 -4.63 118.95 116.92 2bry s ARG 109 Ca 0.59 1.43 0.00 0.00 -0.13 0.00 0.00 55.73 57.62 2bry s ARG 109 Cb -0.14 -3.48 0.04 0.00 -1.56 0.00 0.00 34.95 29.81 2bry s ARG 109 CO 0.49 -0.15 -0.08 0.08 -0.81 0.00 0.00 175.30 174.83 2bry s VAL 110 N 1.34 1.37 -0.11 7.11 1.01 -1.26 -0.65 120.40 129.22 2bry s VAL 110 Ca 0.51 -0.81 -0.00 0.00 0.00 0.00 0.00 61.98 61.68 2bry s VAL 110 Cb -0.20 -1.49 -0.02 0.00 0.00 0.00 0.00 36.38 34.66 2bry s VAL 110 CO 0.25 0.16 -0.09 -0.69 0.00 0.00 0.00 175.10 174.72 2bry s VAL 111 N 1.52 3.47 -0.03 2.92 1.01 -0.80 -0.83 120.40 127.65 2bry s VAL 111 Ca -0.00 -0.54 0.05 0.00 0.00 0.00 0.00 61.98 61.49 2bry s VAL 111 Cb -0.16 -2.45 -0.01 0.00 0.00 0.00 0.00 36.38 33.77 2bry s VAL 111 CO -0.08 0.55 -0.18 -0.22 0.00 0.00 0.00 175.10 175.17 2bry s LEU 112 N -0.16 1.97 -0.05 3.92 0.20 0.77 -0.20 118.68 125.13 2bry s LEU 112 Ca 0.01 -0.36 0.05 0.00 0.69 0.00 0.00 54.13 54.52 2bry s LEU 112 Cb -0.13 -0.99 -0.02 0.00 -0.43 0.00 0.00 46.19 44.62 2bry s LEU 112 CO 0.03 0.19 -0.19 0.68 -0.29 0.00 0.00 176.35 176.77 2bry s VAL 113 N -0.17 2.60 -0.03 1.68 -7.23 -0.21 -0.68 120.40 116.36 2bry s VAL 113 Ca 0.01 -0.89 0.01 0.00 -1.81 0.00 0.00 61.98 59.30 2bry s VAL 113 Cb -0.10 -1.99 0.02 0.00 0.56 0.00 0.00 36.38 34.87 2bry s VAL 113 CO 0.01 0.58 -0.05 -0.70 -0.31 0.00 0.00 175.10 174.63 2bry s GLU 114 N -0.49 0.72 0.28 4.82 2.56 -0.33 -0.96 118.70 125.29 2bry s GLU 114 Ca 0.06 -0.12 0.14 0.00 0.00 0.00 0.00 54.97 55.04 2bry s GLU 114 Cb -0.12 -0.73 0.28 0.00 2.00 0.00 0.00 34.13 35.57 2bry s GLU 114 CO 0.01 -0.03 1.55 1.57 -0.56 0.00 0.00 175.26 177.80 2bry h LYS 115 N 6.89 0.00 -7.25 4.30 2.10 -1.77 0.72 116.57 121.56 2bry h LYS 115 Ca -0.37 0.00 -0.46 0.00 -2.00 0.00 0.00 60.65 57.83 2bry h LYS 115 Cb 1.16 0.00 0.09 0.00 -0.90 0.00 0.00 32.23 32.58 2bry h LYS 115 CO 0.48 0.59 0.18 1.03 -2.00 0.00 0.00 179.45 179.73 2bry s ARG 116 N -3.27 1.80 0.00 0.07 0.52 -1.26 -3.56 118.95 113.26 2bry s ARG 116 Ca 0.01 -0.67 0.00 0.00 -0.52 0.00 0.00 55.73 54.55 2bry s ARG 116 Cb 0.10 -2.22 0.00 0.00 0.52 0.00 0.00 34.95 33.35 2bry s ARG 116 CO 0.74 -1.43 0.26 0.44 0.02 0.00 0.00 175.30 175.34 2bry n ILE 117 N -2.94 0.00 -4.03 1.52 -5.35 -1.26 -1.94 119.36 105.36 2bry n ILE 117 Ca 0.12 -0.28 -0.09 0.00 -0.27 0.00 0.00 62.75 62.22 2bry n ILE 117 Cb 0.60 1.42 -0.08 0.00 -1.74 0.00 0.00 39.64 39.84 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 -0.03 1.03 -0.48 6.28 -2.85 -1.26 -4.59 119.74 117.84 2bry s LYS 118 Ca 0.00 -1.26 -0.11 0.00 -1.00 0.00 0.00 55.97 53.60 2bry s LYS 118 Cb 0.00 0.32 0.11 0.00 -2.06 0.00 0.00 37.83 36.20 2bry s LYS 118 CO 0.00 -0.34 0.37 -0.06 0.10 0.00 0.00 175.35 175.42 2bry s PHE 119 N -3.99 3.37 -1.00 1.78 0.08 -1.26 -4.94 117.98 112.02 2bry s PHE 119 Ca 0.18 -1.66 0.18 0.00 0.12 0.00 0.00 56.93 55.75 2bry s PHE 119 Cb 0.05 -3.47 -0.15 0.00 -0.57 0.00 0.00 43.02 38.87 2bry s PHE 119 CO -0.00 -0.97 0.79 -1.13 -0.10 0.00 0.00 175.22 173.80 2bry n SER 120 N 5.00 1.02 -4.70 1.36 3.41 -1.26 -4.86 113.62 113.59 2bry n SER 120 Ca -0.10 -1.01 -0.40 0.00 -0.26 0.00 0.00 58.87 57.10 2bry n SER 120 Cb 0.41 0.90 -0.05 0.00 -0.26 0.00 0.00 64.21 65.21 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 -2.55 4.36 0.00 4.33 0.52 -1.26 -4.50 118.95 119.85 2bry s ARG 121 Ca 0.08 0.83 0.17 0.00 -0.52 0.00 0.00 55.73 56.28 2bry s ARG 121 Cb 0.14 -3.50 -0.08 0.00 0.52 0.00 0.00 34.95 32.03 2bry s ARG 121 CO 0.67 -0.07 0.80 0.72 0.02 0.00 0.00 175.30 177.44 2bry n HIS 122 N 4.31 0.00 -0.97 -0.53 8.25 -1.26 -1.51 115.22 123.52 2bry n HIS 122 Ca -0.01 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.13 2bry n HIS 122 Cb 0.51 0.00 0.14 0.00 1.12 0.00 0.00 29.99 31.75 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 -0.67 0.42 -4.43 0.41 3.02 -1.26 -4.54 115.26 108.20 2bry n ASN 123 Ca 0.05 0.52 -0.33 0.00 -0.03 0.00 0.00 54.58 54.79 2bry n ASN 123 Cb 0.31 -1.46 -0.13 0.00 -0.61 0.00 0.00 39.78 37.89 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 -2.28 3.39 -0.12 2.41 1.01 -1.26 -1.03 120.40 122.52 2bry s VAL 124 Ca 0.70 -0.54 -0.05 0.00 0.00 0.00 0.00 61.98 62.09 2bry s VAL 124 Cb -0.27 -2.45 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 2bry s VAL 124 CO 0.55 0.52 0.05 -0.76 0.00 0.00 0.00 175.10 175.45 2bry s LEU 125 N 0.31 3.83 0.34 3.92 1.43 0.41 -4.91 118.68 124.00 2bry s LEU 125 Ca -0.08 0.20 -0.27 0.00 -1.03 0.00 0.00 54.13 52.95 2bry s LEU 125 Cb -0.15 -1.92 -0.09 0.00 0.03 0.00 0.00 46.19 44.06 2bry s LEU 125 CO 0.05 0.32 1.09 -2.28 0.23 0.00 0.00 176.35 175.75 2bry s HIS 126 N -0.53 3.41 -0.10 0.29 5.65 -1.26 -0.99 115.29 121.76 2bry s HIS 126 Ca 0.10 1.67 0.04 0.00 0.25 0.00 0.00 55.06 57.11 2bry s HIS 126 Cb -0.12 -3.24 0.00 0.00 -1.18 0.00 0.00 32.58 28.05 2bry s HIS 126 CO 0.02 -0.65 -0.23 -0.51 -0.65 0.00 0.00 174.74 172.72 2bry s LEU 127 N -1.99 2.06 0.72 8.88 1.43 -0.20 -4.48 118.68 125.10 2bry s LEU 127 Ca 0.51 -0.55 -0.12 0.00 -1.03 0.00 0.00 54.13 52.94 2bry s LEU 127 Cb -0.28 -1.38 0.03 0.00 0.03 0.00 0.00 46.19 44.59 2bry s LEU 127 CO 0.36 0.14 1.08 0.26 0.23 0.00 0.00 176.35 178.42 2bry s TRP 128 N 0.44 2.78 0.28 0.29 0.52 -1.26 -4.77 118.94 117.22 2bry s TRP 128 Ca -0.17 1.51 0.02 0.00 0.02 0.00 0.00 56.10 57.48 2bry s TRP 128 Cb -0.17 -3.01 0.67 0.00 -1.15 0.00 0.00 33.47 29.81 2bry s TRP 128 CO 0.07 -1.56 1.71 -1.35 0.02 0.00 0.00 176.95 175.84 2bry h PRO 129 N -0.74 0.42 -0.14 4.98 0.11 -2.00 -1.45 132.00 133.18 2bry h PRO 129 Ca -0.44 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.58 2bry h PRO 129 Cb 1.23 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2bry h PRO 129 CO 0.54 0.28 -0.21 0.27 -0.21 0.00 0.00 178.00 178.66 2bry h PHE 130 N 0.43 0.25 0.00 0.65 -5.15 -1.93 -1.90 116.94 109.30 2bry h PHE 130 Ca 0.53 -0.04 -0.18 0.00 -0.20 0.00 0.00 57.97 58.08 2bry h PHE 130 Cb 0.96 -0.07 -0.02 0.00 0.22 0.00 0.00 35.95 37.04 2bry h PHE 130 CO -0.14 0.44 -0.86 0.00 -2.00 0.00 0.00 178.31 175.75 2bry h THR 131 N 0.22 1.61 -0.10 0.88 1.03 -1.65 -0.31 112.91 114.59 2bry h THR 131 Ca 0.04 -2.92 -0.01 0.00 -0.01 0.00 0.00 66.41 63.51 2bry h THR 131 Cb 0.50 2.58 -0.00 0.00 -1.07 0.00 0.00 68.15 70.16 2bry h THR 131 CO 0.03 0.83 0.03 0.40 -0.01 0.00 0.00 175.52 176.80 2bry h ILE 132 N 0.00 1.19 -0.63 0.00 2.04 -1.04 -1.38 117.51 117.69 2bry h ILE 132 Ca -0.01 -0.57 -0.00 0.00 1.00 0.00 0.00 64.86 65.27 2bry h ILE 132 Cb 1.52 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 38.95 2bry h ILE 132 CO 0.11 0.17 0.38 -0.74 0.00 0.00 0.00 178.15 178.07 2bry h HIS 133 N -0.04 0.84 -0.41 1.37 2.76 -1.26 -1.71 115.15 116.69 2bry h HIS 133 Ca 0.03 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.25 2bry h HIS 133 Cb 0.24 -0.27 -0.04 0.00 1.55 0.00 0.00 27.41 28.88 2bry h HIS 133 CO 0.00 0.57 0.15 0.22 -1.30 0.00 0.00 177.93 177.57 2bry h ASP 134 N 0.86 0.17 -0.24 3.26 3.58 -0.90 -0.70 116.42 122.45 2bry h ASP 134 Ca 0.23 0.04 -0.12 0.00 0.42 0.00 0.00 57.03 57.60 2bry h ASP 134 Cb -0.02 0.03 -0.00 0.00 1.72 0.00 0.00 39.33 41.05 2bry h ASP 134 CO -0.04 0.13 -0.32 -0.07 -2.88 0.00 0.00 179.24 176.06 2bry h LEU 135 N 0.32 0.69 -1.14 2.28 3.38 -1.07 -2.59 115.31 117.17 2bry h LEU 135 Ca 0.19 -0.50 0.04 0.00 0.09 0.00 0.00 57.88 57.69 2bry h LEU 135 Cb 0.17 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.67 2bry h LEU 135 CO -0.19 1.06 0.59 0.03 0.09 0.00 0.00 178.44 180.02 2bry h ARG 136 N 0.33 1.08 0.00 1.13 3.08 -1.06 -1.32 114.38 117.63 2bry h ARG 136 Ca 0.03 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2bry h ARG 136 Cb 0.89 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.70 2bry h ARG 136 CO 0.07 0.71 0.00 0.00 -1.07 0.00 0.00 179.97 179.69 2bry n ALA 137 N -2.40 1.69 0.21 0.04 0.00 -0.29 -1.55 120.51 118.22 2bry n ALA 137 Ca 0.12 0.06 0.10 0.00 0.00 0.00 0.00 53.44 53.72 2bry n ALA 137 Cb 0.12 -1.37 0.27 0.00 0.00 0.00 0.00 19.45 18.46 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 -2.13 3.14 0.00 0.00 4.77 -0.55 -4.46 117.00 117.77 2bry n LEU 138 Ca 0.02 -1.52 0.00 0.00 -0.03 0.00 0.00 56.01 54.49 2bry n LEU 138 Cb 0.23 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 2bry n LEU 138 CO 0.19 0.76 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 2bry n GLY 139 N 1.44 0.68 0.31 -0.72 0.00 -0.59 -4.90 105.19 101.41 2bry n GLY 139 Ca 0.20 -0.72 0.09 0.00 0.00 0.00 0.00 46.02 45.58 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 1.31 -0.02 4.61 0.00 -1.50 -2.22 119.26 121.44 2bry h ALA 140 Ca 0.00 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 2bry h ALA 140 Cb 0.75 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2bry h ALA 140 CO 0.00 -0.18 -0.42 -0.22 0.00 0.00 0.00 179.25 178.43 2bry h LYS 141 N 0.54 0.04 -0.88 0.00 1.63 -1.84 0.33 116.57 116.40 2bry h LYS 141 Ca 0.49 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 60.26 2bry h LYS 141 Cb 0.78 -0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.36 2bry h LYS 141 CO -0.42 0.46 0.50 -0.22 -3.45 0.00 0.00 179.45 176.32 2bry h LYS 142 N 0.04 1.21 0.00 1.90 1.63 -1.80 -3.26 116.57 116.29 2bry h LYS 142 Ca 0.00 -0.13 -0.18 0.00 -0.85 0.00 0.00 60.65 59.49 2bry h LYS 142 Cb 0.76 -0.24 -0.03 0.00 -0.60 0.00 0.00 32.23 32.12 2bry h LYS 142 CO 0.06 0.88 -1.44 1.19 -3.45 0.00 0.00 179.45 176.68 2bry n PHE 143 N -4.37 0.99 -3.55 1.91 3.72 -0.61 -4.73 117.46 110.81 2bry n PHE 143 Ca 0.09 0.33 -0.29 0.00 -0.05 0.00 0.00 57.45 57.53 2bry n PHE 143 Cb 0.08 -1.10 -0.15 0.00 -0.94 0.00 0.00 39.48 37.37 2bry n PHE 143 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 2bry s TYR 144 N -2.89 0.37 0.19 1.38 5.04 0.11 -4.88 117.35 116.66 2bry s TYR 144 Ca -0.03 -0.88 0.34 0.00 -2.44 0.00 0.00 57.07 54.06 2bry s TYR 144 Cb 0.09 -0.92 1.71 0.00 0.35 0.00 0.00 41.96 43.19 2bry s TYR 144 CO 0.81 -0.81 2.03 0.78 -1.34 0.00 0.00 175.55 177.02 2bry h GLY 145 N 8.40 0.00 -2.25 8.97 0.00 -1.81 -1.29 103.07 115.09 2bry h GLY 145 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.14 2bry h GLY 145 CO 0.43 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.51 2bry n ARG 146 N -2.77 2.45 -1.67 4.80 1.74 -1.26 -4.97 116.66 114.98 2bry n ARG 146 Ca -0.01 -2.23 -0.42 0.00 -0.77 0.00 0.00 57.85 54.41 2bry n ARG 146 Cb 0.13 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.04 2bry n ARG 146 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2bry n PHE 147 N 1.35 2.55 -3.95 -1.55 7.35 -0.49 -3.15 117.46 119.57 2bry n PHE 147 Ca 0.21 -0.32 -0.30 0.00 -0.76 0.00 0.00 57.45 56.28 2bry n PHE 147 Cb 0.55 -2.79 0.01 0.00 0.35 0.00 0.00 39.48 37.61 2bry n PHE 147 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2bry s THR 149 N -4.05 4.28 0.00 0.00 2.01 -1.19 -4.66 115.64 112.03 2bry s THR 149 Ca 0.31 1.58 0.00 0.00 0.31 0.00 0.00 61.69 63.89 2bry s THR 149 Cb -0.17 -4.02 0.00 0.00 0.01 0.00 0.00 72.50 68.32 2bry s THR 149 CO 0.62 -0.05 0.00 0.61 -0.69 0.00 0.00 174.62 175.11 2bry n GLY 150 N 3.44 1.75 0.49 4.40 0.00 -1.26 -2.32 105.19 111.69 2bry n GLY 150 Ca 0.12 -0.69 0.12 0.00 0.00 0.00 0.00 46.02 45.56 2bry n GLY 150 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2bry n THR 151 N 0.00 0.00 -1.97 2.61 -1.04 -1.26 -4.97 114.28 107.65 2bry n THR 151 Ca 0.00 -0.26 -0.42 0.00 -2.04 0.00 0.00 64.05 61.33 2bry n THR 151 Cb 0.00 1.07 -0.03 0.00 -1.82 0.00 0.00 70.33 69.55 2bry n THR 151 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2bry s LEU 152 N -2.41 4.37 -0.38 -4.42 1.43 -0.98 -4.92 118.68 111.37 2bry s LEU 152 Ca 0.22 2.56 0.13 0.00 -1.03 0.00 0.00 54.13 56.00 2bry s LEU 152 Cb 0.19 -3.59 0.40 0.00 0.03 0.00 0.00 46.19 43.22 2bry s LEU 152 CO 0.52 -0.81 0.88 -0.90 0.23 0.00 0.00 176.35 176.28 2bry n ASP 153 N 4.14 1.89 -3.65 2.29 5.75 -1.26 -4.29 116.55 121.42 2bry n ASP 153 Ca 0.14 -3.04 -0.10 0.00 -0.01 0.00 0.00 54.79 51.77 2bry n ASP 153 Cb 0.39 -0.56 -0.03 0.00 -1.03 0.00 0.00 41.12 39.89 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 -2.94 -0.23 -0.16 2.11 -3.43 -1.26 -1.03 115.29 108.35 2bry s HIS 154 Ca 0.37 -0.08 -0.17 0.00 -0.80 0.00 0.00 55.06 54.38 2bry s HIS 154 Cb 0.39 0.41 0.05 0.00 -1.43 0.00 0.00 32.58 32.00 2bry s HIS 154 CO -0.05 -0.86 0.48 -1.50 -2.00 0.00 0.00 174.74 170.80 2bry s ILE 155 N -3.83 0.00 0.47 -5.38 2.07 -0.17 -4.56 121.20 109.81 2bry s ILE 155 Ca 0.06 -0.04 -0.23 0.00 -1.41 0.00 0.00 60.65 59.03 2bry s ILE 155 Cb -0.00 -0.68 -0.07 0.00 0.13 0.00 0.00 42.46 41.83 2bry s ILE 155 CO -0.07 -0.02 1.24 -0.94 -1.91 0.00 0.00 174.94 173.24 2bry s SER 156 N 0.05 5.99 0.15 4.50 1.04 -1.26 -0.44 113.70 123.72 2bry s SER 156 Ca -0.02 2.49 -0.22 0.00 0.48 0.00 0.00 55.95 58.69 2bry s SER 156 Cb -0.03 -2.62 0.04 0.00 0.10 0.00 0.00 66.02 63.50 2bry s SER 156 CO 0.01 -1.06 1.63 0.40 0.98 0.00 0.00 173.24 175.21 2bry h ILE 157 N 1.91 0.41 -0.12 -1.02 2.04 -1.23 -1.33 117.51 118.18 2bry h ILE 157 Ca -0.50 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.29 2bry h ILE 157 Cb 1.26 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 2bry h ILE 157 CO 0.60 0.00 -0.26 0.08 0.00 0.00 0.00 178.15 178.57 2bry h ARG 158 N -0.22 0.21 -0.47 2.37 0.11 -1.55 -0.78 114.38 114.04 2bry h ARG 158 Ca 0.14 -0.07 -0.11 0.00 0.10 0.00 0.00 59.98 60.05 2bry h ARG 158 Cb 0.44 -0.02 -0.02 0.00 1.11 0.00 0.00 29.97 31.49 2bry h ARG 158 CO -0.39 0.46 -0.14 1.96 0.10 0.00 0.00 179.97 181.96 2bry h GLN 159 N 0.19 0.89 -0.45 0.08 1.08 -1.70 -0.06 115.11 115.14 2bry h GLN 159 Ca 0.03 -0.33 -0.01 0.00 -1.45 0.00 0.00 58.65 56.89 2bry h GLN 159 Cb 0.56 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.92 2bry h GLN 159 CO 0.04 0.97 0.23 1.25 -0.95 0.00 0.00 178.83 180.37 2bry h LEU 160 N 0.79 0.59 -0.63 1.46 5.85 -0.74 -2.41 115.31 120.22 2bry h LEU 160 Ca 0.12 -0.12 0.01 0.00 0.84 0.00 0.00 57.88 58.74 2bry h LEU 160 Cb 0.66 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 2bry h LEU 160 CO 0.05 0.54 0.41 1.56 -0.34 0.00 0.00 178.44 180.65 2bry h GLN 161 N 0.59 0.80 -0.35 1.25 4.20 -0.98 -2.18 115.11 118.44 2bry h GLN 161 Ca 0.16 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 2bry h GLN 161 Cb 0.10 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 2bry h GLN 161 CO -0.02 0.53 0.20 -0.07 -0.67 0.00 0.00 178.83 178.80 2bry h LEU 162 N 0.82 0.44 -0.40 1.46 3.38 -0.81 0.18 115.31 120.38 2bry h LEU 162 Ca 0.24 -0.08 -0.18 0.00 0.09 0.00 0.00 57.88 57.95 2bry h LEU 162 Cb -0.06 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2bry h LEU 162 CO -0.07 0.39 -0.61 0.17 0.09 0.00 0.00 178.44 178.41 2bry h LEU 163 N 0.45 0.73 -0.82 1.67 8.10 -1.41 -2.05 115.31 121.98 2bry h LEU 163 Ca 0.12 -0.42 -0.10 0.00 0.11 0.00 0.00 57.88 57.60 2bry h LEU 163 Cb 0.04 -0.21 -0.01 0.00 -0.44 0.00 0.00 40.66 40.04 2bry h LEU 163 CO -0.02 1.17 -0.21 -0.07 -4.11 0.00 0.00 178.44 175.19 2bry h LEU 164 N 0.48 0.65 -0.64 0.17 3.38 -1.24 -2.37 115.31 115.74 2bry h LEU 164 Ca -0.00 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 57.76 2bry h LEU 164 Cb 1.18 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.72 2bry h LEU 164 CO 0.12 0.86 0.41 0.25 0.09 0.00 0.00 178.44 180.17 2bry h LEU 165 N 0.57 0.70 -0.17 1.67 5.85 -0.48 -0.41 115.31 123.04 2bry h LEU 165 Ca 0.08 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 2bry h LEU 165 Cb 0.68 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 2bry h LEU 165 CO 0.05 0.50 0.08 0.11 -0.34 0.00 0.00 178.44 178.83 2bry h LYS 166 N 0.83 0.26 -0.45 1.25 1.57 -1.07 -0.46 116.57 118.50 2bry h LYS 166 Ca 0.25 -0.04 0.04 0.00 -1.87 0.00 0.00 60.65 59.03 2bry h LYS 166 Cb -0.04 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.18 2bry h LYS 166 CO -0.08 0.31 0.21 0.28 -0.57 0.00 0.00 179.45 179.61 2bry h VAL 167 N 0.14 0.94 -0.58 0.50 2.07 -1.30 -1.70 116.25 116.32 2bry h VAL 167 Ca 0.06 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.44 2bry h VAL 167 Cb 0.15 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.38 2bry h VAL 167 CO -0.01 0.08 0.37 0.00 0.02 0.00 0.00 177.57 178.03 2bry h ALA 168 N 1.25 0.74 -0.34 1.67 0.00 -0.77 -1.03 119.26 120.79 2bry h ALA 168 Ca 0.20 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2bry h ALA 168 Cb 0.12 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2bry h ALA 168 CO -0.15 0.20 0.13 -0.07 0.00 0.00 0.00 179.25 179.35 2bry h LEU 169 N 0.79 0.48 -1.45 0.00 3.38 -0.89 -1.77 115.31 115.84 2bry h LEU 169 Ca 0.21 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 58.02 2bry h LEU 169 Cb -0.05 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 2bry h LEU 169 CO -0.04 0.53 0.38 -0.07 0.09 0.00 0.00 178.44 179.33 2bry h LEU 170 N 0.40 0.63 -0.58 1.67 3.38 -0.87 -0.80 115.31 119.14 2bry h LEU 170 Ca 0.11 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2bry h LEU 170 Cb 0.21 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2bry h LEU 170 CO -0.01 0.45 0.00 0.18 0.09 0.00 0.00 178.44 179.15 2bry n LEU 171 N -4.46 0.86 0.00 1.67 4.77 -0.43 -3.62 117.00 115.79 2bry n LEU 171 Ca 0.06 -0.39 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 2bry n LEU 171 Cb 0.08 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2bry n LEU 171 CO 0.35 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 2bry n GLY 172 N 0.88 0.70 3.74 -0.72 0.00 -0.30 -3.90 105.19 105.59 2bry n GLY 172 Ca 0.11 -0.48 -0.41 0.00 0.00 0.00 0.00 46.02 45.24 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 3.22 -0.38 1.61 1.01 -0.69 -2.29 120.40 120.87 2bry s VAL 173 Ca 0.00 1.03 -0.18 0.00 0.00 0.00 0.00 61.98 62.84 2bry s VAL 173 Cb 0.00 -3.66 0.01 0.00 0.00 0.00 0.00 36.38 32.73 2bry s VAL 173 CO 0.00 0.17 0.47 -0.70 0.00 0.00 0.00 175.10 175.04 2bry s GLU 174 N -0.37 3.39 -0.11 2.72 2.12 -0.01 -4.21 118.70 122.24 2bry s GLU 174 Ca 0.55 -0.44 0.01 0.00 0.36 0.00 0.00 54.97 55.45 2bry s GLU 174 Cb -0.36 -3.88 -0.02 0.00 0.26 0.00 0.00 34.13 30.14 2bry s GLU 174 CO 0.40 -0.73 -0.15 0.42 -0.54 0.00 0.00 175.26 174.65 2bry s ILE 175 N 2.28 2.90 -0.09 -3.70 1.01 -1.26 -0.17 121.20 122.18 2bry s ILE 175 Ca 0.15 -0.73 0.03 0.00 0.00 0.00 0.00 60.65 60.10 2bry s ILE 175 Cb -0.16 -2.19 -0.01 0.00 0.01 0.00 0.00 42.46 40.11 2bry s ILE 175 CO 0.14 0.54 -0.19 -1.00 0.00 0.00 0.00 174.94 174.43 2bry s HIS 176 N 0.12 2.64 0.29 3.97 3.76 0.15 -4.96 115.29 121.25 2bry s HIS 176 Ca -0.07 -0.66 0.09 0.00 -0.15 0.00 0.00 55.06 54.27 2bry s HIS 176 Cb -0.15 -1.71 -0.04 0.00 1.11 0.00 0.00 32.58 31.79 2bry s HIS 176 CO 0.05 -0.18 0.09 -1.58 -0.85 0.00 0.00 174.74 172.27 2bry s TRP 177 N 0.01 2.78 -1.74 1.40 0.52 -1.26 -1.19 118.94 119.47 2bry s TRP 177 Ca -0.07 -0.25 0.00 0.00 0.02 0.00 0.00 56.10 55.80 2bry s TRP 177 Cb -0.15 -1.39 0.00 0.00 -1.15 0.00 0.00 33.47 30.78 2bry s TRP 177 CO 0.05 0.50 0.00 0.41 0.02 0.00 0.00 176.95 177.93 2bry n GLY 178 N -1.04 -0.28 2.93 0.98 0.00 0.16 -4.89 105.19 103.05 2bry n GLY 178 Ca -0.05 -0.05 -0.20 0.00 0.00 0.00 0.00 46.02 45.72 2bry n GLY 178 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bry s VAL 179 N -2.98 0.61 -0.19 1.61 0.11 -0.68 -4.56 120.40 114.32 2bry s VAL 179 Ca 0.00 -0.21 -0.05 0.00 -2.93 0.00 0.00 61.98 58.79 2bry s VAL 179 Cb 0.00 -0.59 -0.03 0.00 -1.53 0.00 0.00 36.38 34.23 2bry s VAL 179 CO 0.00 0.22 0.01 -0.75 -3.33 0.00 0.00 175.10 171.25 2bry s LYS 180 N 0.61 3.70 -0.04 1.54 2.20 0.38 -2.30 119.74 125.82 2bry s LYS 180 Ca -0.09 -0.48 -0.30 0.00 -0.36 0.00 0.00 55.97 54.74 2bry s LYS 180 Cb -0.12 -3.08 -0.03 0.00 -1.51 0.00 0.00 37.83 33.09 2bry s LYS 180 CO 0.01 0.10 1.11 0.12 -0.36 0.00 0.00 175.35 176.33 2bry s PHE 181 N 0.78 3.40 0.00 4.03 5.36 -1.26 -0.69 117.98 129.59 2bry s PHE 181 Ca 0.01 1.41 0.00 0.00 -0.96 0.00 0.00 56.93 57.39 2bry s PHE 181 Cb -0.14 -3.31 0.00 0.00 -0.34 0.00 0.00 43.02 39.23 2bry s PHE 181 CO 0.02 -0.80 0.08 0.25 -1.46 0.00 0.00 175.22 173.30 2bry n THR 182 N 4.34 0.00 -3.92 0.12 -2.24 0.20 -4.97 114.28 107.81 2bry n THR 182 Ca 0.09 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 2bry n THR 182 Cb 0.48 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.71 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 0.83 -0.86 3.43 3.38 0.00 -1.19 -4.97 105.19 105.81 2bry n GLY 183 Ca 0.00 -1.18 -0.30 0.00 0.00 0.00 0.00 46.02 44.54 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 2.47 -0.41 0.99 1.43 -1.26 0.07 118.68 121.97 2bry s LEU 184 Ca 0.00 -0.56 -0.15 0.00 -1.03 0.00 0.00 54.13 52.38 2bry s LEU 184 Cb 0.00 -1.41 0.02 0.00 0.03 0.00 0.00 46.19 44.83 2bry s LEU 184 CO 0.00 0.22 0.33 -1.10 0.23 0.00 0.00 176.35 176.03 2bry s GLN 185 N -1.70 3.02 0.69 1.70 -0.21 0.95 -4.67 119.66 119.44 2bry s GLN 185 Ca 0.15 -0.94 -0.15 0.00 0.02 0.00 0.00 55.36 54.43 2bry s GLN 185 Cb -0.10 -3.97 0.02 0.00 1.00 0.00 0.00 33.01 29.95 2bry s GLN 185 CO 0.06 -0.76 1.16 -1.25 -2.12 0.00 0.00 175.29 172.38 2bry s PRO 186 N 1.79 2.46 0.02 2.91 0.04 -1.26 -2.35 135.00 138.62 2bry s PRO 186 Ca 0.07 1.61 -0.33 0.00 0.04 0.00 0.00 61.00 62.38 2bry s PRO 186 Cb -0.18 -1.89 -0.12 0.00 0.04 0.00 0.00 34.50 32.35 2bry s PRO 186 CO 0.11 -1.55 1.80 -2.30 0.04 0.00 0.00 177.00 175.10 2bry n PRO 187 N -2.53 2.32 -0.13 0.56 -0.02 -1.25 -4.88 135.00 129.08 2bry n PRO 187 Ca 0.12 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 2bry n PRO 187 Cb 0.51 -2.69 0.27 0.00 -0.02 0.00 0.00 33.50 31.56 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 8.35 0.82 -3.22 0.52 0.11 -1.90 -3.45 132.00 133.24 2bry h PRO 188 Ca -0.47 -0.09 0.00 0.00 0.11 0.00 0.00 66.00 65.55 2bry h PRO 188 Cb 1.26 -0.16 -0.09 0.00 0.11 0.00 0.00 31.00 32.12 2bry h PRO 188 CO 0.93 0.62 0.10 -0.98 -0.21 0.00 0.00 178.00 178.46 2bry s ARG 189 N -5.52 1.52 0.22 1.05 1.70 -1.26 -5.06 118.95 111.60 2bry s ARG 189 Ca -0.10 -0.90 -0.31 0.00 -0.47 0.00 0.00 55.73 53.95 2bry s ARG 189 Cb 0.17 0.55 -0.14 0.00 -0.57 0.00 0.00 34.95 34.95 2bry s ARG 189 CO 0.78 -0.66 1.23 1.17 -1.08 0.00 0.00 175.30 176.73 2bry n LYS 190 N -0.39 1.54 0.00 3.89 3.00 -1.26 -0.71 118.16 124.23 2bry n LYS 190 Ca -0.08 0.55 0.00 0.00 -0.00 0.00 0.00 58.31 58.78 2bry n LYS 190 Cb 0.62 -2.08 0.00 0.00 0.00 0.00 0.00 35.03 33.56 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 1.89 2.35 3.86 3.14 0.00 -1.26 -5.05 105.19 110.13 2bry n GLY 191 Ca 0.13 0.00 -0.31 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 -2.20 6.56 0.50 1.61 0.01 0.11 -5.11 113.70 115.18 2bry s SER 192 Ca 0.00 1.26 0.05 0.00 1.31 0.00 0.00 55.95 58.57 2bry s SER 192 Cb 0.00 -2.38 0.01 0.00 0.21 0.00 0.00 66.02 63.86 2bry s SER 192 CO 0.00 -0.45 0.29 -0.83 0.41 0.00 0.00 173.24 172.67 2bry s GLY 193 N -3.10 2.45 0.19 3.44 0.00 -1.26 -4.67 107.32 104.36 2bry s GLY 193 Ca 0.53 -1.36 -0.30 0.00 0.00 0.00 0.00 44.72 43.60 2bry s GLY 193 CO 0.31 -1.96 1.00 -0.98 0.00 0.00 0.00 173.10 171.47 2bry s TRP 194 N -2.73 3.81 0.31 1.90 0.52 -1.26 -3.84 118.94 117.65 2bry s TRP 194 Ca 0.32 1.79 0.05 0.00 0.02 0.00 0.00 56.10 58.28 2bry s TRP 194 Cb -0.00 -3.10 -0.06 0.00 -1.15 0.00 0.00 33.47 29.16 2bry s TRP 194 CO 0.19 0.05 0.02 1.03 0.02 0.00 0.00 176.95 178.27 2bry s ARG 195 N -0.64 1.62 -0.04 4.98 0.52 -0.99 -2.31 118.95 122.09 2bry s ARG 195 Ca 0.45 -1.88 -0.04 0.00 -0.52 0.00 0.00 55.73 53.75 2bry s ARG 195 Cb -0.26 -0.96 -0.04 0.00 0.52 0.00 0.00 34.95 34.21 2bry s ARG 195 CO 0.33 -0.12 0.16 0.00 0.02 0.00 0.00 175.30 175.69 2bry s ALA 196 N -3.21 3.89 -0.15 2.13 0.00 -1.26 -0.04 121.76 123.13 2bry s ALA 196 Ca 0.34 -0.74 -0.21 0.00 0.00 0.00 0.00 51.96 51.35 2bry s ALA 196 Cb 0.07 -1.87 -0.03 0.00 0.00 0.00 0.00 23.12 21.30 2bry s ALA 196 CO 0.14 0.71 0.63 -0.65 0.00 0.00 0.00 175.76 176.59 2bry s GLN 197 N -1.67 4.29 0.03 0.00 -0.21 0.11 -4.63 119.66 117.58 2bry s GLN 197 Ca 0.24 0.67 0.03 0.00 0.02 0.00 0.00 55.36 56.32 2bry s GLN 197 Cb -0.12 -3.52 -0.02 0.00 1.00 0.00 0.00 33.01 30.34 2bry s GLN 197 CO 0.14 -0.11 -0.10 -0.51 -2.12 0.00 0.00 175.29 172.59 2bry s LEU 198 N 1.45 2.17 -0.09 2.90 1.43 -1.26 -0.62 118.68 124.66 2bry s LEU 198 Ca 0.31 -0.43 0.03 0.00 -1.03 0.00 0.00 54.13 53.01 2bry s LEU 198 Cb -0.16 -0.37 0.01 0.00 0.03 0.00 0.00 46.19 45.70 2bry s LEU 198 CO 0.12 -0.05 -0.18 -1.10 0.23 0.00 0.00 176.35 175.37 2bry s GLN 199 N -1.12 2.39 0.85 1.70 -0.21 0.13 -3.35 119.66 120.05 2bry s GLN 199 Ca -0.03 -0.64 -0.12 0.00 0.02 0.00 0.00 55.36 54.59 2bry s GLN 199 Cb -0.08 -1.91 0.10 0.00 1.00 0.00 0.00 33.01 32.13 2bry s GLN 199 CO 0.01 0.06 1.16 -1.25 -2.12 0.00 0.00 175.29 173.15 2bry s PRO 200 N 0.64 1.61 -0.24 2.91 0.04 -1.26 -0.47 135.00 138.22 2bry s PRO 200 Ca -0.14 0.18 -0.22 0.00 0.04 0.00 0.00 61.00 60.87 2bry s PRO 200 Cb -0.16 -1.90 -0.09 0.00 0.04 0.00 0.00 34.50 32.38 2bry s PRO 200 CO 0.04 -1.85 0.94 -1.71 0.04 0.00 0.00 177.00 174.45 2bry n ASN 201 N -3.51 0.46 -4.88 6.66 5.15 -1.21 -4.89 115.26 113.03 2bry n ASN 201 Ca 0.07 0.43 -0.30 0.00 -0.60 0.00 0.00 54.58 54.18 2bry n ASN 201 Cb 0.60 -0.43 0.03 0.00 -0.53 0.00 0.00 39.78 39.45 2bry n ASN 201 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2bry s PRO 202 N 2.34 3.15 1.03 1.20 0.04 -1.26 -5.06 135.00 136.44 2bry s PRO 202 Ca 0.56 0.55 -0.12 0.00 0.04 0.00 0.00 61.00 62.02 2bry s PRO 202 Cb -0.73 -2.06 0.21 0.00 0.04 0.00 0.00 34.50 31.96 2bry s PRO 202 CO 0.35 -0.83 1.07 -2.14 0.04 0.00 0.00 177.00 175.49 2bry s PRO 203 N -5.27 0.17 0.37 0.56 0.02 -1.26 -4.58 135.00 125.01 2bry s PRO 203 Ca 0.57 0.83 0.12 0.00 0.02 0.00 0.00 61.00 62.54 2bry s PRO 203 Cb -0.11 -1.68 0.93 0.00 0.02 0.00 0.00 34.50 33.66 2bry s PRO 203 CO 0.52 -2.99 1.82 0.00 -0.33 0.00 0.00 177.00 176.02 2bry h ALA 204 N -2.09 1.98 0.56 -1.55 0.00 -1.98 -1.05 119.26 115.12 2bry h ALA 204 Ca -0.55 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 2bry h ALA 204 Cb 1.31 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 19.05 2bry h ALA 204 CO 0.52 -0.29 -0.27 0.37 0.00 0.00 0.00 179.25 179.58 2bry h GLN 205 N 0.57 -0.73 -0.23 0.00 5.75 -1.98 -1.25 115.11 117.24 2bry h GLN 205 Ca 0.52 0.05 -0.15 0.00 -0.15 0.00 0.00 58.65 58.91 2bry h GLN 205 Cb 1.04 0.16 -0.01 0.00 1.07 0.00 0.00 27.48 29.75 2bry h GLN 205 CO -0.26 -0.46 -0.49 1.25 -2.65 0.00 0.00 178.83 176.22 2bry h LEU 206 N -0.82 0.67 -0.98 -2.39 5.85 -1.84 -2.49 115.31 113.32 2bry h LEU 206 Ca -0.08 -0.34 0.06 0.00 0.84 0.00 0.00 57.88 58.37 2bry h LEU 206 Cb 0.61 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 41.38 2bry h LEU 206 CO 0.13 1.05 0.63 0.00 -0.34 0.00 0.00 178.44 179.91 2bry h ALA 207 N 0.97 1.35 -0.01 1.25 0.00 -1.14 -2.37 119.26 119.31 2bry h ALA 207 Ca 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bry h ALA 207 Cb 1.04 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2bry h ALA 207 CO 0.10 0.42 -0.26 -1.13 0.00 0.00 0.00 179.25 178.38 2bry n SER 208 N -4.52 0.91 -4.67 0.00 3.41 -0.48 -4.74 113.62 103.53 2bry n SER 208 Ca 0.15 -0.79 -0.42 0.00 -0.26 0.00 0.00 58.87 57.55 2bry n SER 208 Cb 0.18 0.12 -0.03 0.00 -0.26 0.00 0.00 64.21 64.21 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 -2.55 1.93 -0.11 7.33 5.04 -0.89 -4.99 117.35 123.10 2bry s TYR 209 Ca 0.24 0.02 -0.02 0.00 -2.44 0.00 0.00 57.07 54.87 2bry s TYR 209 Cb 0.19 -4.05 -0.03 0.00 0.35 0.00 0.00 41.96 38.42 2bry s TYR 209 CO 0.53 -4.45 -0.05 -1.21 -1.34 0.00 0.00 175.55 169.03 2bry s GLU 210 N 3.61 3.24 0.05 4.97 2.02 -1.26 -4.45 118.70 126.87 2bry s GLU 210 Ca 0.79 -0.53 0.02 0.00 0.02 0.00 0.00 54.97 55.27 2bry s GLU 210 Cb -0.39 -2.76 -0.03 0.00 0.10 0.00 0.00 34.13 31.05 2bry s GLU 210 CO 0.34 0.45 -0.08 -0.59 0.02 0.00 0.00 175.26 175.40 2bry s PHE 211 N -0.21 0.70 -1.66 1.61 -0.12 -0.98 -4.87 117.98 112.45 2bry s PHE 211 Ca 0.03 -0.53 0.14 0.00 -0.05 0.00 0.00 56.93 56.51 2bry s PHE 211 Cb -0.13 -0.42 0.10 0.00 -0.63 0.00 0.00 43.02 41.94 2bry s PHE 211 CO 0.02 -0.09 0.92 -0.40 -0.05 0.00 0.00 175.22 175.62 2bry n ASP 212 N 1.33 2.08 -3.96 1.98 5.75 -0.32 -4.25 116.55 119.15 2bry n ASP 212 Ca -0.22 -1.54 -0.22 0.00 -0.01 0.00 0.00 54.79 52.80 2bry n ASP 212 Cb 0.55 0.04 -0.16 0.00 -1.03 0.00 0.00 41.12 40.52 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 -1.17 0.82 -0.20 2.12 1.01 -0.91 -0.97 120.40 121.10 2bry s VAL 213 Ca 0.15 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.84 2bry s VAL 213 Cb 0.11 -0.78 0.04 0.00 0.00 0.00 0.00 36.38 35.75 2bry s VAL 213 CO 0.18 0.28 -0.15 -0.22 0.00 0.00 0.00 175.10 175.19 2bry s LEU 214 N 0.69 2.47 -0.27 3.92 2.96 0.03 -0.66 118.68 127.81 2bry s LEU 214 Ca -0.12 -0.88 -0.08 0.00 -0.22 0.00 0.00 54.13 52.83 2bry s LEU 214 Cb -0.14 -1.42 -0.02 0.00 0.50 0.00 0.00 46.19 45.11 2bry s LEU 214 CO 0.02 -0.08 0.09 -0.63 -1.32 0.00 0.00 176.35 174.43 2bry s ILE 215 N 1.28 4.33 -0.32 6.68 -1.09 -0.11 -0.95 121.20 131.03 2bry s ILE 215 Ca 0.00 -0.31 -0.13 0.00 -2.23 0.00 0.00 60.65 57.98 2bry s ILE 215 Cb -0.15 -3.10 -0.02 0.00 -1.58 0.00 0.00 42.46 37.60 2bry s ILE 215 CO -0.10 0.23 0.25 -0.44 -1.23 0.00 0.00 174.94 173.66 2bry s SER 216 N 1.60 6.08 -0.35 3.58 0.01 0.03 -0.18 113.70 124.46 2bry s SER 216 Ca 0.05 -0.27 0.14 0.00 1.31 0.00 0.00 55.95 57.17 2bry s SER 216 Cb -0.16 -2.15 0.45 0.00 0.21 0.00 0.00 66.02 64.38 2bry s SER 216 CO 0.04 -0.21 1.04 0.00 0.41 0.00 0.00 173.24 174.53 2bry n ALA 217 N 5.15 3.98 0.45 1.44 0.00 0.87 -1.24 120.51 131.15 2bry n ALA 217 Ca -0.12 -3.52 0.07 0.00 0.00 0.00 0.00 53.44 49.87 2bry n ALA 217 Cb 0.50 -0.75 0.21 0.00 0.00 0.00 0.00 19.45 19.42 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 -0.32 2.49 0.00 0.00 0.00 -1.09 -4.39 120.51 117.20 2bry n ALA 218 Ca 0.21 -0.86 0.00 0.00 0.00 0.00 0.00 53.44 52.80 2bry n ALA 218 Cb 0.78 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 19.26 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 1.19 -2.71 0.00 0.00 0.00 -1.26 -4.27 105.19 98.14 2bry n GLY 219 Ca 0.16 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.51 2bry n GLY 219 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bry n GLY 220 N -0.73 -0.28 0.00 -0.02 0.00 -1.26 -2.64 105.19 100.26 2bry n GLY 220 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2bry n GLY 220 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2bry n LYS 221 N -1.25 0.91 -3.76 1.61 5.02 -1.26 -4.91 118.16 114.52 2bry n LYS 221 Ca 0.00 -0.95 -0.17 0.00 -2.02 0.00 0.00 58.31 55.17 2bry n LYS 221 Cb 0.09 -0.97 -0.17 0.00 -0.02 0.00 0.00 35.03 33.96 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 -0.46 0.08 -0.02 2.13 5.36 -1.08 -5.14 117.98 118.84 2bry s PHE 222 Ca 0.00 0.15 0.02 0.00 -0.96 0.00 0.00 56.93 56.13 2bry s PHE 222 Cb 0.00 -0.34 0.01 0.00 -0.34 0.00 0.00 43.02 42.35 2bry s PHE 222 CO 0.00 -0.13 -0.06 0.08 -1.46 0.00 0.00 175.22 173.66 2bry s VAL 223 N 1.40 0.52 1.06 3.12 1.01 -1.26 -4.49 120.40 121.75 2bry s VAL 223 Ca -0.05 -0.21 -0.15 0.00 0.00 0.00 0.00 61.98 61.58 2bry s VAL 223 Cb -0.13 -0.48 0.13 0.00 0.00 0.00 0.00 36.38 35.90 2bry s VAL 223 CO -0.03 0.18 0.48 -2.65 0.00 0.00 0.00 175.10 173.08 2bry n PRO 224 N 3.41 -1.30 -1.89 2.72 -0.02 -1.26 -4.90 135.00 131.76 2bry n PRO 224 Ca -0.19 -0.35 -0.36 0.00 -2.02 0.00 0.00 63.50 60.59 2bry n PRO 224 Cb 0.55 -1.93 0.05 0.00 -0.02 0.00 0.00 33.50 32.14 2bry n PRO 224 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2bry s GLU 225 N -3.86 2.79 0.00 -0.52 2.02 -1.26 -3.81 118.70 114.05 2bry s GLU 225 Ca 0.60 1.86 0.00 0.00 0.02 0.00 0.00 54.97 57.45 2bry s GLU 225 Cb -0.19 -1.90 0.00 0.00 0.10 0.00 0.00 34.13 32.14 2bry s GLU 225 CO 0.65 -1.36 0.00 0.41 0.02 0.00 0.00 175.26 174.98 2bry n GLY 226 N 0.55 2.36 3.80 -1.39 0.00 -1.26 -5.06 105.19 104.18 2bry n GLY 226 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.63 3.81 -0.08 1.61 0.08 -1.25 -5.06 117.98 114.46 2bry s PHE 227 Ca 0.00 1.46 -0.18 0.00 0.12 0.00 0.00 56.93 58.33 2bry s PHE 227 Cb 0.00 -2.64 -0.05 0.00 -0.57 0.00 0.00 43.02 39.76 2bry s PHE 227 CO 0.00 0.49 0.48 0.99 -0.10 0.00 0.00 175.22 177.09 2bry s THR 228 N -1.23 5.11 -0.11 0.64 2.01 -1.26 -5.03 115.64 115.77 2bry s THR 228 Ca 0.35 0.98 -0.01 0.00 0.31 0.00 0.00 61.69 63.32 2bry s THR 228 Cb -0.20 -3.82 -0.02 0.00 0.01 0.00 0.00 72.50 68.47 2bry s THR 228 CO 0.23 0.39 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.83 2bry s ILE 229 N 0.19 3.52 -0.24 1.82 -1.09 -1.26 -0.67 121.20 123.47 2bry s ILE 229 Ca 0.26 -0.51 -0.13 0.00 -2.23 0.00 0.00 60.65 58.04 2bry s ILE 229 Cb -0.16 -2.48 -0.05 0.00 -1.58 0.00 0.00 42.46 38.20 2bry s ILE 229 CO 0.12 0.54 0.25 -0.13 -1.23 0.00 0.00 174.94 174.49 2bry s ARG 230 N -0.08 4.07 -0.13 2.79 0.52 0.18 -4.90 118.95 121.41 2bry s ARG 230 Ca -0.00 -0.11 0.02 0.00 -0.52 0.00 0.00 55.73 55.12 2bry s ARG 230 Cb -0.13 -3.57 -0.00 0.00 0.52 0.00 0.00 34.95 31.76 2bry s ARG 230 CO 0.03 -0.04 -0.19 -2.00 0.02 0.00 0.00 175.30 173.12 2bry s GLU 231 N 1.36 3.16 -0.13 3.54 2.56 -1.26 -0.92 118.70 127.00 2bry s GLU 231 Ca 0.11 -0.80 0.00 0.00 0.00 0.00 0.00 54.97 54.29 2bry s GLU 231 Cb -0.14 -2.48 0.02 0.00 2.00 0.00 0.00 34.13 33.52 2bry s GLU 231 CO 0.07 0.11 -0.12 1.41 -0.56 0.00 0.00 175.26 176.17 2bry s MET 232 N 0.56 2.02 -0.46 4.30 1.75 -0.95 -4.99 119.30 121.53 2bry s MET 232 Ca -0.11 -0.46 -0.20 0.00 -1.25 0.00 0.00 55.69 53.67 2bry s MET 232 Cb -0.16 -1.89 0.03 0.00 2.84 0.00 0.00 34.83 35.65 2bry s MET 232 CO 0.04 -0.22 0.61 0.50 -0.65 0.00 0.00 175.02 175.30 2bry s ARG 233 N 1.47 3.20 0.00 4.11 3.52 -1.26 -1.99 118.95 128.01 2bry s ARG 233 Ca 0.03 -0.58 0.00 0.00 -0.13 0.00 0.00 55.73 55.05 2bry s ARG 233 Cb -0.13 -4.00 0.00 0.00 -1.56 0.00 0.00 34.95 29.26 2bry s ARG 233 CO -0.08 -1.05 0.00 0.41 -0.81 0.00 0.00 175.30 173.76 2bry n GLY 234 N 5.09 0.89 3.77 8.12 0.00 -1.02 -5.02 105.19 117.01 2bry n GLY 234 Ca -0.04 -1.79 -0.40 0.00 0.00 0.00 0.00 46.02 43.79 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 1.71 3.84 0.02 1.61 -0.14 -1.26 -4.88 119.74 120.64 2bry s LYS 235 Ca 0.00 2.26 -0.34 0.00 -1.36 0.00 0.00 55.97 56.53 2bry s LYS 235 Cb 0.00 -2.71 -0.13 0.00 -1.68 0.00 0.00 37.83 33.32 2bry s LYS 235 CO 0.00 -0.64 1.73 -0.11 -0.76 0.00 0.00 175.35 175.57 2bry n LEU 236 N -0.03 3.21 -3.84 3.17 7.94 -1.26 -4.69 117.00 121.51 2bry n LEU 236 Ca 0.04 1.03 -0.23 0.00 -1.11 0.00 0.00 56.01 55.74 2bry n LEU 236 Cb 0.43 -1.39 -0.17 0.00 0.53 0.00 0.00 43.42 42.82 2bry n LEU 236 CO 0.57 -0.20 -0.41 0.00 -1.11 0.00 0.00 177.39 176.25 2bry s ALA 237 N 2.54 0.85 -0.25 1.96 0.00 -1.26 -4.96 121.76 120.64 2bry s ALA 237 Ca 0.86 -0.21 -0.04 0.00 0.00 0.00 0.00 51.96 52.58 2bry s ALA 237 Cb -0.70 -0.69 0.01 0.00 0.00 0.00 0.00 23.12 21.74 2bry s ALA 237 CO 0.46 -0.31 -0.02 0.42 0.00 0.00 0.00 175.76 176.31 2bry s ILE 238 N 1.58 3.37 0.11 0.00 1.01 -1.24 -0.45 121.20 125.58 2bry s ILE 238 Ca -0.00 -0.72 -0.10 0.00 0.00 0.00 0.00 60.65 59.83 2bry s ILE 238 Cb -0.13 -2.65 -0.06 0.00 0.01 0.00 0.00 42.46 39.63 2bry s ILE 238 CO -0.04 0.26 0.44 -0.83 0.00 0.00 0.00 174.94 174.77 2bry s GLY 239 N 1.44 2.35 -0.06 6.18 0.00 0.07 -0.51 107.32 116.79 2bry s GLY 239 Ca 0.03 -0.33 0.01 0.00 0.00 0.00 0.00 44.72 44.43 2bry s GLY 239 CO -0.02 -0.12 -0.05 -0.42 0.00 0.00 0.00 173.10 172.50 2bry s ILE 240 N -1.46 0.62 0.11 0.90 1.01 0.04 0.08 121.20 122.50 2bry s ILE 240 Ca 0.36 -0.13 0.07 0.00 0.00 0.00 0.00 60.65 60.95 2bry s ILE 240 Cb -0.14 -0.66 -0.04 0.00 0.01 0.00 0.00 42.46 41.64 2bry s ILE 240 CO 0.19 0.26 -0.09 0.42 0.00 0.00 0.00 174.94 175.72 2bry s THR 241 N 1.16 3.43 -0.13 2.92 -4.23 -0.49 -0.82 115.64 117.48 2bry s THR 241 Ca -0.07 -1.29 -0.12 0.00 -1.18 0.00 0.00 61.69 59.03 2bry s THR 241 Cb -0.14 -2.62 0.03 0.00 1.34 0.00 0.00 72.50 71.11 2bry s THR 241 CO -0.01 0.08 0.35 0.00 -0.54 0.00 0.00 174.62 174.49 2bry s ALA 242 N -1.29 -0.86 -0.15 3.99 0.00 -0.47 -1.48 121.76 121.50 2bry s ALA 242 Ca 0.22 0.96 0.02 0.00 0.00 0.00 0.00 51.96 53.16 2bry s ALA 242 Cb -0.11 -0.55 0.01 0.00 0.00 0.00 0.00 23.12 22.47 2bry s ALA 242 CO 0.15 -0.17 -0.19 -0.80 0.00 0.00 0.00 175.76 174.74 2bry s ASN 243 N 0.14 3.32 0.12 0.00 0.01 -0.42 -0.63 114.94 117.48 2bry s ASN 243 Ca -0.00 -0.55 0.07 0.00 -0.71 0.00 0.00 52.86 51.66 2bry s ASN 243 Cb -0.02 -1.49 -0.04 0.00 0.41 0.00 0.00 41.25 40.10 2bry s ASN 243 CO 0.01 0.08 -0.07 -0.36 -1.51 0.00 0.00 177.10 175.25 2bry s PHE 244 N 0.82 2.78 0.23 2.20 0.08 0.07 -0.74 117.98 123.42 2bry s PHE 244 Ca -0.06 -0.14 -0.31 0.00 0.12 0.00 0.00 56.93 56.53 2bry s PHE 244 Cb -0.15 -1.42 -0.12 0.00 -0.57 0.00 0.00 43.02 40.76 2bry s PHE 244 CO -0.01 0.46 1.69 0.28 -0.10 0.00 0.00 175.22 177.54 2bry n VAL 245 N 0.46 0.28 -3.72 -0.44 0.31 0.82 -0.51 118.33 115.53 2bry n VAL 245 Ca -0.12 -0.07 -0.38 0.00 -0.01 0.00 0.00 64.34 63.76 2bry n VAL 245 Cb 0.53 -1.98 -0.12 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 0.99 5.37 0.00 4.52 2.47 -1.26 -4.54 114.94 122.48 2bry s ASN 246 Ca 0.72 -1.03 0.28 0.00 0.42 0.00 0.00 52.86 53.25 2bry s ASN 246 Cb -0.50 -1.90 1.24 0.00 -1.45 0.00 0.00 41.25 38.63 2bry s ASN 246 CO 0.37 -0.31 1.91 0.61 -3.72 0.00 0.00 177.10 175.96 2bry n GLY 247 N 4.86 -1.43 2.50 1.21 0.00 -1.26 -4.91 105.19 106.17 2bry n GLY 247 Ca -0.13 -0.10 -0.20 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.46 -2.22 -1.48 1.61 1.74 -1.26 -4.98 116.66 108.61 2bry n ARG 248 Ca 0.08 0.95 -0.32 0.00 -0.77 0.00 0.00 57.85 57.79 2bry n ARG 248 Cb 0.31 -5.64 0.07 0.00 -1.02 0.00 0.00 32.46 26.18 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 -3.02 3.44 0.33 0.55 -4.23 -1.26 -4.91 115.64 106.54 2bry s THR 249 Ca 0.05 0.53 0.06 0.00 -1.18 0.00 0.00 61.69 61.15 2bry s THR 249 Cb -0.02 -3.06 0.31 0.00 1.34 0.00 0.00 72.50 71.06 2bry s THR 249 CO 0.06 -0.55 1.84 1.62 -0.54 0.00 0.00 174.62 177.05 2bry h VAL 250 N -0.67 0.84 -0.32 2.29 3.04 -2.01 -1.94 116.25 117.47 2bry h VAL 250 Ca -0.45 -0.27 -0.11 0.00 -1.01 0.00 0.00 66.70 64.87 2bry h VAL 250 Cb 1.23 -0.02 -0.01 0.00 -2.01 0.00 0.00 31.29 30.48 2bry h VAL 250 CO 0.53 0.14 -0.24 -0.33 -1.01 0.00 0.00 177.57 176.67 2bry h GLU 251 N 0.79 0.63 -0.34 4.17 3.07 -1.97 -2.72 114.58 118.21 2bry h GLU 251 Ca 0.48 -0.25 -0.11 0.00 -0.50 0.00 0.00 59.36 58.99 2bry h GLU 251 Cb 0.69 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.56 2bry h GLU 251 CO -0.25 0.81 -0.24 0.93 -1.40 0.00 0.00 179.01 178.86 2bry h GLU 252 N 0.55 0.66 0.00 2.33 5.08 -1.66 -2.84 114.58 118.70 2bry h GLU 252 Ca 0.08 -0.27 -0.02 0.00 -1.00 0.00 0.00 59.36 58.15 2bry h GLU 252 Cb 0.70 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.92 2bry h GLU 252 CO 0.05 0.85 -0.11 1.79 -1.00 0.00 0.00 179.01 180.59 2bry h THR 253 N 0.58 0.46 0.00 1.13 1.35 -1.14 -2.60 112.91 112.70 2bry h THR 253 Ca 0.08 -0.54 -0.04 0.00 -0.55 0.00 0.00 66.41 65.36 2bry h THR 253 Cb 0.72 1.37 -0.01 0.00 -1.73 0.00 0.00 68.15 68.50 2bry h THR 253 CO 0.06 0.11 -0.20 -0.61 -0.25 0.00 0.00 175.52 174.62 2bry h GLN 254 N 0.00 0.00 -6.26 4.72 4.15 -1.48 -3.44 115.11 112.80 2bry h GLN 254 Ca -0.00 0.00 -0.56 0.00 0.77 0.00 0.00 58.65 58.86 2bry h GLN 254 Cb 0.36 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.02 2bry h GLN 254 CO 0.01 0.20 1.03 0.08 -1.93 0.00 0.00 178.83 178.23 2bry s VAL 255 N -3.75 3.91 0.46 2.39 1.01 -0.98 -4.95 120.40 118.49 2bry s VAL 255 Ca -0.00 1.06 -0.25 0.00 0.00 0.00 0.00 61.98 62.79 2bry s VAL 255 Cb 0.11 -3.84 -0.08 0.00 0.00 0.00 0.00 36.38 32.57 2bry s VAL 255 CO 0.62 -0.26 1.42 -2.84 0.00 0.00 0.00 175.10 174.05 2bry s PRO 256 N 4.19 3.63 0.95 2.72 0.02 -1.26 -5.01 135.00 140.23 2bry s PRO 256 Ca 0.64 2.41 -0.12 0.00 0.02 0.00 0.00 61.00 63.96 2bry s PRO 256 Cb -0.24 -2.62 0.16 0.00 0.02 0.00 0.00 34.50 31.82 2bry s PRO 256 CO 0.24 -0.86 1.09 -1.21 -0.33 0.00 0.00 177.00 175.94 2bry s GLU 257 N -2.50 0.85 -0.24 5.54 2.02 -1.26 -5.03 118.70 118.09 2bry s GLU 257 Ca 0.62 0.76 0.01 0.00 0.02 0.00 0.00 54.97 56.37 2bry s GLU 257 Cb -0.44 -1.77 0.06 0.00 0.10 0.00 0.00 34.13 32.09 2bry s GLU 257 CO 0.56 -2.50 -0.05 0.42 0.02 0.00 0.00 175.26 173.71 2bry s ILE 258 N -2.90 1.53 0.17 -1.63 1.01 -0.59 -4.94 121.20 113.84 2bry s ILE 258 Ca 0.64 -1.24 0.22 0.00 0.00 0.00 0.00 60.65 60.27 2bry s ILE 258 Cb -0.19 -1.81 0.20 0.00 0.01 0.00 0.00 42.46 40.68 2bry s ILE 258 CO 0.58 -0.12 1.81 0.77 0.00 0.00 0.00 174.94 177.98 2bry h SER 259 N 7.95 0.00 0.00 3.58 4.64 -1.87 -0.95 113.55 126.90 2bry h SER 259 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 2bry h SER 259 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2bry h SER 259 CO 0.41 0.27 0.00 0.61 -0.87 0.00 0.00 176.83 177.26 2bry n GLY 260 N 0.12 3.38 2.08 -0.77 0.00 -1.25 -4.87 105.19 103.87 2bry n GLY 260 Ca -0.00 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.62 2bry n GLY 260 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2bry n TYR 265 N 0.60 0.00 -0.41 1.61 4.11 -1.26 -4.91 117.16 116.90 2bry n TYR 265 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 57.90 57.96 2bry n TYR 265 Cb 0.00 0.00 0.17 0.00 -0.00 0.00 0.00 39.34 39.51 2bry n TYR 265 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.86 176.95 2bry n ASN 266 N 2.03 3.07 -4.22 9.48 3.02 -1.26 -5.05 115.26 122.32 2bry n ASN 266 Ca 0.00 -2.31 -0.37 0.00 -0.03 0.00 0.00 54.58 51.87 2bry n ASN 266 Cb 0.00 -0.30 -0.12 0.00 -0.61 0.00 0.00 39.78 38.75 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 -1.55 2.45 0.53 3.52 1.11 -1.26 -4.81 119.66 119.65 2bry s GLN 267 Ca 0.26 -1.37 0.34 0.00 0.01 0.00 0.00 55.36 54.60 2bry s GLN 267 Cb 0.17 -3.46 1.44 0.00 -1.01 0.00 0.00 33.01 30.15 2bry s GLN 267 CO 0.12 -0.78 1.99 0.87 0.01 0.00 0.00 175.29 177.50 2bry h LYS 268 N 8.16 0.00 0.09 2.91 1.57 -2.00 -3.33 116.57 123.97 2bry h LYS 268 Ca -0.21 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.57 2bry h LYS 268 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 2bry h LYS 268 CO 0.63 0.00 -0.05 0.35 -0.57 0.00 0.00 179.45 179.81 2bry h PHE 269 N 0.00 -0.12 -0.03 -1.35 3.57 -1.99 -0.54 116.94 116.49 2bry h PHE 269 Ca 0.00 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.44 2bry h PHE 269 Cb 0.43 0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.20 2bry h PHE 269 CO 0.00 0.16 -0.28 0.74 -2.23 0.00 0.00 178.31 176.70 2bry h PHE 270 N -0.39 0.05 -0.32 0.41 0.04 -1.93 0.88 116.94 115.68 2bry h PHE 270 Ca -0.01 -0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.69 2bry h PHE 270 Cb 0.33 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.45 2bry h PHE 270 CO 0.01 0.32 -0.03 1.96 -0.60 0.00 0.00 178.31 179.97 2bry h GLN 271 N 0.04 0.58 -0.62 1.51 4.20 -1.65 -1.32 115.11 117.85 2bry h GLN 271 Ca 0.00 -0.20 -0.07 0.00 0.06 0.00 0.00 58.65 58.44 2bry h GLN 271 Cb 0.51 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.22 2bry h GLN 271 CO 0.04 0.73 0.11 0.66 -0.67 0.00 0.00 178.83 179.70 2bry h SER 272 N 0.36 0.99 -0.25 1.46 4.64 -0.51 -1.36 113.55 118.87 2bry h SER 272 Ca 0.09 -0.26 0.02 0.00 -0.47 0.00 0.00 61.79 61.17 2bry h SER 272 Cb 0.49 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 2bry h SER 272 CO 0.02 0.99 0.11 0.25 -0.87 0.00 0.00 176.83 177.34 2bry h LEU 273 N 0.94 0.16 -0.72 5.97 5.85 -0.83 -1.92 115.31 124.75 2bry h LEU 273 Ca 0.19 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.94 2bry h LEU 273 Cb 0.42 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.40 2bry h LEU 273 CO 0.01 0.13 0.47 0.25 -0.34 0.00 0.00 178.44 178.96 2bry h LEU 274 N 0.25 0.80 -0.37 2.25 5.85 -0.98 -0.78 115.31 122.32 2bry h LEU 274 Ca 0.10 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.82 2bry h LEU 274 Cb 0.04 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 2bry h LEU 274 CO -0.08 0.57 0.24 0.50 -0.34 0.00 0.00 178.44 179.33 2bry h LYS 275 N 0.95 0.47 -0.01 1.25 3.64 -1.09 0.15 116.57 121.92 2bry h LYS 275 Ca 0.28 -0.03 -0.21 0.00 -1.27 0.00 0.00 60.65 59.42 2bry h LYS 275 Cb -0.06 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.65 2bry h LYS 275 CO -0.08 0.31 -0.88 0.00 -2.27 0.00 0.00 179.45 176.54 2bry h ALA 276 N 1.15 0.47 0.00 5.00 0.00 -0.98 -3.39 119.26 121.50 2bry h ALA 276 Ca 0.14 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2bry h ALA 276 Cb -0.03 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2bry h ALA 276 CO -0.04 0.84 -0.47 0.25 0.00 0.00 0.00 179.25 179.83 2bry n THR 277 N -3.73 0.00 -1.00 0.00 -2.24 -0.33 -5.00 114.28 101.98 2bry n THR 277 Ca -0.05 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2bry n THR 277 Cb 0.80 0.52 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 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 1.36 0.45 3.66 3.38 0.00 0.52 -5.02 105.19 109.55 2bry n GLY 278 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.92 5.01 -0.36 -0.61 1.01 -1.26 -4.83 121.20 118.23 2bry s ILE 279 Ca 0.00 1.24 -0.01 0.00 0.00 0.00 0.00 60.65 61.88 2bry s ILE 279 Cb 0.00 -3.97 0.09 0.00 0.01 0.00 0.00 42.46 38.59 2bry s ILE 279 CO 0.00 0.11 0.12 -0.62 0.00 0.00 0.00 174.94 174.55 2bry s ASP 280 N 1.16 5.07 0.10 3.58 -1.08 -1.26 -3.17 116.67 121.07 2bry s ASP 280 Ca 0.30 -1.81 0.06 0.00 -0.52 0.00 0.00 52.55 50.59 2bry s ASP 280 Cb -0.16 -1.76 -0.04 0.00 -1.46 0.00 0.00 42.92 39.50 2bry s ASP 280 CO 0.11 -0.43 -0.06 -0.76 0.52 0.00 0.00 175.17 174.55 2bry s LEU 281 N 1.14 3.21 -0.07 -1.34 1.43 -1.26 -1.74 118.68 120.06 2bry s LEU 281 Ca 0.04 -0.30 0.09 0.00 -1.03 0.00 0.00 54.13 52.93 2bry s LEU 281 Cb -0.21 -1.98 -0.24 0.00 0.03 0.00 0.00 46.19 43.79 2bry s LEU 281 CO -0.04 0.18 0.58 -0.62 0.23 0.00 0.00 176.35 176.67 2bry n GLU 282 N 0.65 0.66 -3.45 1.70 1.02 0.30 -4.96 120.64 116.56 2bry n GLU 282 Ca -0.12 0.28 -0.13 0.00 -0.02 0.00 0.00 57.16 57.16 2bry n GLU 282 Cb 0.52 -1.76 -0.03 0.00 -0.02 0.00 0.00 31.44 30.15 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 -6.24 -0.58 -0.03 1.62 2.20 -1.24 -4.75 114.94 105.92 2bry s ASN 283 Ca -0.08 0.17 -0.10 0.00 -0.94 0.00 0.00 52.86 51.91 2bry s ASN 283 Cb 0.08 0.58 0.01 0.00 -2.00 0.00 0.00 41.25 39.92 2bry s ASN 283 CO 0.81 -0.87 0.22 -0.51 -2.94 0.00 0.00 177.10 173.81 2bry s ILE 284 N -3.12 0.05 -0.01 0.54 2.07 -1.26 -1.87 121.20 117.60 2bry s ILE 284 Ca -0.02 -0.44 0.02 0.00 -1.41 0.00 0.00 60.65 58.80 2bry s ILE 284 Cb -0.01 -0.46 0.00 0.00 0.13 0.00 0.00 42.46 42.12 2bry s ILE 284 CO -0.07 -0.24 -0.06 -0.69 -1.91 0.00 0.00 174.94 171.96 2bry s VAL 285 N -0.96 0.53 -0.14 4.00 1.01 -0.03 -3.81 120.40 121.00 2bry s VAL 285 Ca -0.10 -0.25 -0.01 0.00 0.00 0.00 0.00 61.98 61.62 2bry s VAL 285 Cb -0.05 -0.47 0.03 0.00 0.00 0.00 0.00 36.38 35.89 2bry s VAL 285 CO 0.02 0.17 -0.06 -0.47 0.00 0.00 0.00 175.10 174.76 2bry s TYR 286 N 0.07 1.59 -0.13 5.22 5.04 -0.36 -1.99 117.35 126.79 2bry s TYR 286 Ca -0.01 -0.93 -0.02 0.00 -2.44 0.00 0.00 57.07 53.68 2bry s TYR 286 Cb -0.05 -1.27 -0.03 0.00 0.35 0.00 0.00 41.96 40.96 2bry s TYR 286 CO -0.00 -0.57 -0.06 0.71 -1.34 0.00 0.00 175.55 174.29 2bry s TYR 287 N 1.67 2.97 -0.75 4.97 2.02 -0.36 -1.54 117.35 126.34 2bry s TYR 287 Ca 0.03 -0.27 -0.19 0.00 -0.37 0.00 0.00 57.07 56.27 2bry s TYR 287 Cb -0.14 -1.88 0.12 0.00 -0.40 0.00 0.00 41.96 39.66 2bry s TYR 287 CO -0.08 0.03 0.91 0.21 -1.57 0.00 0.00 175.55 175.05 2bry s LYS 288 N 0.07 3.32 0.00 -0.62 2.20 -1.26 -1.35 119.74 122.10 2bry s LYS 288 Ca -0.01 -1.54 0.00 0.00 -0.36 0.00 0.00 55.97 54.06 2bry s LYS 288 Cb -0.14 -4.51 0.00 0.00 -1.51 0.00 0.00 37.83 31.67 2bry s LYS 288 CO 0.03 -1.64 0.00 -3.47 -0.36 0.00 0.00 175.35 169.91 2bry n ASP 289 N 6.35 0.00 0.18 1.43 2.03 -1.26 -4.99 116.55 120.29 2bry n ASP 289 Ca 0.06 0.00 0.06 0.00 0.52 0.00 0.00 54.79 55.43 2bry n ASP 289 Cb 0.46 0.00 0.52 0.00 -0.72 0.00 0.00 41.12 41.38 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 0.13 -5.94 -0.67 4.39 -1.95 -3.42 114.58 107.13 2bry h GLU 290 Ca 0.00 -0.02 -0.61 0.00 0.34 0.00 0.00 59.36 59.08 2bry h GLU 290 Cb 0.00 -0.03 -0.12 0.00 -0.10 0.00 0.00 28.75 28.50 2bry h GLU 290 CO 0.00 0.18 -0.64 0.95 -1.16 0.00 0.00 179.01 178.34 2bry s THR 291 N -4.95 2.37 -0.51 1.13 -4.23 -1.26 -4.14 115.64 104.05 2bry s THR 291 Ca -0.05 -2.08 -0.29 0.00 -1.18 0.00 0.00 61.69 58.09 2bry s THR 291 Cb 0.16 -2.75 0.03 0.00 1.34 0.00 0.00 72.50 71.28 2bry s THR 291 CO 0.70 -0.17 1.17 -1.00 -0.54 0.00 0.00 174.62 174.77 2bry s HIS 292 N -2.58 2.73 -0.15 3.99 3.76 0.33 -4.59 115.29 118.79 2bry s HIS 292 Ca 0.34 0.63 -0.06 0.00 -0.15 0.00 0.00 55.06 55.81 2bry s HIS 292 Cb 0.02 -4.46 -0.04 0.00 1.11 0.00 0.00 32.58 29.21 2bry s HIS 292 CO 0.18 -1.40 0.08 -0.47 -0.85 0.00 0.00 174.74 172.28 2bry s TYR 293 N 4.65 3.34 0.00 1.40 5.04 -0.46 -0.75 117.35 130.57 2bry s TYR 293 Ca 0.47 0.24 0.05 0.00 -2.44 0.00 0.00 57.07 55.39 2bry s TYR 293 Cb -0.07 -1.99 -0.02 0.00 0.35 0.00 0.00 41.96 40.23 2bry s TYR 293 CO 0.30 0.38 -0.17 -0.06 -1.34 0.00 0.00 175.55 174.66 2bry s PHE 294 N -0.23 1.49 -0.03 4.97 0.08 0.20 -1.22 117.98 123.25 2bry s PHE 294 Ca 0.08 -0.30 0.05 0.00 0.12 0.00 0.00 56.93 56.88 2bry s PHE 294 Cb -0.12 -0.94 -0.01 0.00 -0.57 0.00 0.00 43.02 41.38 2bry s PHE 294 CO 0.01 -0.00 -0.17 0.54 -0.10 0.00 0.00 175.22 175.51 2bry s VAL 295 N -0.51 1.34 0.05 -0.44 0.11 -0.84 -1.37 120.40 118.74 2bry s VAL 295 Ca 0.06 -0.70 -0.04 0.00 -2.93 0.00 0.00 61.98 58.37 2bry s VAL 295 Cb -0.07 -1.13 -0.02 0.00 -1.53 0.00 0.00 36.38 33.63 2bry s VAL 295 CO -0.00 0.38 0.05 0.00 -3.33 0.00 0.00 175.10 172.20 2bry s MET 296 N -0.19 0.61 -0.17 1.54 0.23 -0.00 -0.85 119.30 120.47 2bry s MET 296 Ca 0.02 -0.95 -0.01 0.00 -1.03 0.00 0.00 55.69 53.71 2bry s MET 296 Cb -0.09 0.23 -0.01 0.00 -1.53 0.00 0.00 34.83 33.44 2bry s MET 296 CO 0.00 -0.14 -0.10 0.99 -2.03 0.00 0.00 175.02 173.74 2bry s THR 297 N -3.21 3.05 0.09 3.16 2.01 -0.78 -0.78 115.64 119.19 2bry s THR 297 Ca 0.00 -0.63 0.10 0.00 0.31 0.00 0.00 61.69 61.47 2bry s THR 297 Cb 0.03 -2.33 -0.04 0.00 0.01 0.00 0.00 72.50 70.17 2bry s THR 297 CO -0.07 0.49 -0.26 0.00 -0.69 0.00 0.00 174.62 174.09 2bry s ALA 298 N 0.91 2.36 0.27 7.40 0.00 0.33 -0.54 121.76 132.49 2bry s ALA 298 Ca -0.02 -1.37 -0.29 0.00 0.00 0.00 0.00 51.96 50.28 2bry s ALA 298 Cb -0.15 -0.45 -0.09 0.00 0.00 0.00 0.00 23.12 22.42 2bry s ALA 298 CO -0.00 0.54 1.03 0.15 0.00 0.00 0.00 175.76 177.48 2bry s LYS 299 N -1.70 4.71 0.22 0.00 -0.14 -0.71 -3.73 119.74 118.39 2bry s LYS 299 Ca 0.13 1.65 -0.08 0.00 -1.36 0.00 0.00 55.97 56.32 2bry s LYS 299 Cb -0.10 -3.19 0.32 0.00 -1.68 0.00 0.00 37.83 33.17 2bry s LYS 299 CO 0.05 0.33 1.77 -0.22 -0.76 0.00 0.00 175.35 176.51 2bry h LYS 300 N 3.89 0.51 -0.61 1.68 3.64 -1.92 -2.88 116.57 120.87 2bry h LYS 300 Ca -0.46 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 58.96 2bry h LYS 300 Cb 1.21 -0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 32.85 2bry h LYS 300 CO 0.67 0.34 0.28 0.37 -2.27 0.00 0.00 179.45 178.85 2bry h GLN 301 N 0.53 0.50 -0.07 1.90 5.75 -1.97 -0.45 115.11 121.30 2bry h GLN 301 Ca 0.34 -0.03 -0.13 0.00 -0.15 0.00 0.00 58.65 58.68 2bry h GLN 301 Cb 0.38 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.80 2bry h GLN 301 CO -0.28 0.33 -0.54 0.00 -2.65 0.00 0.00 178.83 175.69 2bry h LEU 303 N 0.15 0.91 -0.16 0.00 3.38 -0.96 0.40 115.31 119.03 2bry h LEU 303 Ca 0.00 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 2bry h LEU 303 Cb 1.00 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 2bry h LEU 303 CO 0.08 0.96 -0.08 -0.07 0.09 0.00 0.00 178.44 179.42 2bry h LEU 304 N 0.87 0.34 -1.65 1.67 3.38 -1.03 0.08 115.31 118.96 2bry h LEU 304 Ca 0.16 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 57.69 2bry h LEU 304 Cb 0.49 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 2bry h LEU 304 CO 0.02 0.67 -0.11 -0.09 0.09 0.00 0.00 178.44 179.02 2bry h ARG 305 N 0.00 0.08 -0.20 1.13 2.43 -0.88 -1.90 114.38 115.04 2bry h ARG 305 Ca 0.04 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 2bry h ARG 305 Cb 0.55 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 2bry h ARG 305 CO 0.02 0.20 0.00 1.28 -1.51 0.00 0.00 179.97 179.96 2bry n LEU 306 N -4.36 2.87 0.00 3.80 4.77 0.10 -4.96 117.00 119.22 2bry n LEU 306 Ca -0.02 -1.12 0.00 0.00 -0.03 0.00 0.00 56.01 54.84 2bry n LEU 306 Cb 0.21 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2bry n LEU 306 CO 0.36 0.56 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 2bry n GLY 307 N 1.37 0.46 0.20 -0.72 0.00 -0.71 -4.92 105.19 100.88 2bry n GLY 307 Ca 0.17 -0.55 -0.09 0.00 0.00 0.00 0.00 46.02 45.54 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 1.33 -3.51 1.61 2.07 -1.23 -3.42 116.25 113.11 2bry h VAL 308 Ca 0.00 -1.87 -0.67 0.00 0.82 0.00 0.00 66.70 64.98 2bry h VAL 308 Cb 0.00 1.85 -0.27 0.00 -1.52 0.00 0.00 31.29 31.35 2bry h VAL 308 CO 0.00 0.57 -0.79 -0.76 0.02 0.00 0.00 177.57 176.61 2bry s LEU 309 N -8.24 2.57 -0.04 2.57 1.43 -0.99 -0.30 118.68 115.68 2bry s LEU 309 Ca -0.07 -0.35 -0.26 0.00 -1.03 0.00 0.00 54.13 52.42 2bry s LEU 309 Cb 0.11 -1.55 -0.21 0.00 0.03 0.00 0.00 46.19 44.57 2bry s LEU 309 CO 0.84 0.20 1.19 0.03 0.23 0.00 0.00 176.35 178.84 2bry h ARG 310 N 6.41 0.01 -4.97 1.70 3.08 -1.07 -3.40 114.38 116.14 2bry h ARG 310 Ca -0.29 -0.00 -0.36 0.00 0.07 0.00 0.00 59.98 59.40 2bry h ARG 310 Cb 1.20 0.00 -0.22 0.00 0.08 0.00 0.00 29.97 31.03 2bry h ARG 310 CO 0.53 0.58 -0.76 -0.65 -1.07 0.00 0.00 179.97 178.59 2bry s GLN 311 N -3.92 0.70 -1.27 0.04 -0.21 -1.26 -5.07 119.66 108.67 2bry s GLN 311 Ca -0.16 -0.79 -0.18 0.00 0.02 0.00 0.00 55.36 54.24 2bry s GLN 311 Cb 0.01 -0.61 0.02 0.00 1.00 0.00 0.00 33.01 33.42 2bry s GLN 311 CO 0.68 0.14 1.90 -3.47 -2.12 0.00 0.00 175.29 172.42 2bry n ASP 312 N 1.57 4.16 -4.74 5.90 2.03 -1.26 -4.93 116.55 119.28 2bry n ASP 312 Ca -0.21 -2.84 -0.40 0.00 0.52 0.00 0.00 54.79 51.86 2bry n ASP 312 Cb 0.55 -1.67 -0.05 0.00 -0.72 0.00 0.00 41.12 39.23 2bry n ASP 312 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2bry s LEU 313 N 4.68 4.45 0.22 -2.67 1.43 -1.26 -4.98 118.68 120.55 2bry s LEU 313 Ca 0.55 1.53 -0.03 0.00 -1.03 0.00 0.00 54.13 55.16 2bry s LEU 313 Cb 0.06 -3.34 0.21 0.00 0.03 0.00 0.00 46.19 43.16 2bry s LEU 313 CO 0.05 -0.04 1.62 -1.28 0.23 0.00 0.00 176.35 176.94 2bry h SER 314 N 5.81 0.70 -3.24 2.29 0.87 -1.99 -3.42 113.55 114.56 2bry h SER 314 Ca -0.43 -0.27 -0.58 0.00 -1.23 0.00 0.00 61.79 59.28 2bry h SER 314 Cb 1.21 -0.19 -0.07 0.00 -0.44 0.00 0.00 62.40 62.91 2bry h SER 314 CO 0.72 0.95 0.53 -1.61 -0.53 0.00 0.00 176.83 176.88 2bry s GLU 315 N -4.48 4.28 0.33 2.24 0.41 -1.26 -4.96 118.70 115.27 2bry s GLU 315 Ca -0.09 1.13 0.04 0.00 -0.41 0.00 0.00 54.97 55.64 2bry s GLU 315 Cb 0.13 -3.60 0.59 0.00 -1.78 0.00 0.00 34.13 29.47 2bry s GLU 315 CO 0.83 -0.43 1.88 1.15 -0.49 0.00 0.00 175.26 178.19 2bry h THR 316 N 5.29 1.19 0.00 3.63 2.02 -1.99 0.76 112.91 123.82 2bry h THR 316 Ca -0.26 -0.74 -0.06 0.00 0.77 0.00 0.00 66.41 66.12 2bry h THR 316 Cb 1.11 0.86 -0.01 0.00 -1.74 0.00 0.00 68.15 68.37 2bry h THR 316 CO 0.88 0.26 -0.30 -2.24 0.37 0.00 0.00 175.52 174.49 2bry h ASP 317 N 0.56 0.00 0.21 4.18 2.03 -1.96 -1.30 116.42 120.14 2bry h ASP 317 Ca 0.12 0.00 -0.33 0.00 -0.73 0.00 0.00 57.03 56.09 2bry h ASP 317 Cb 0.29 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 38.81 2bry h ASP 317 CO 0.00 0.30 -1.56 1.56 -1.03 0.00 0.00 179.24 178.52 2bry h GLN 318 N 0.00 0.45 -1.00 4.15 4.20 -1.77 -2.94 115.11 118.20 2bry h GLN 318 Ca -0.00 -0.78 0.16 0.00 0.06 0.00 0.00 58.65 58.09 2bry h GLN 318 Cb 0.60 0.29 -0.09 0.00 0.30 0.00 0.00 27.48 28.57 2bry h GLN 318 CO 0.04 1.37 0.62 1.25 -0.67 0.00 0.00 178.83 181.44 2bry h LEU 319 N 0.07 0.83 -3.04 1.46 5.85 -0.43 -2.21 115.31 117.84 2bry h LEU 319 Ca -0.29 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.50 2bry h LEU 319 Cb 2.09 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 43.04 2bry h LEU 319 CO 0.22 0.37 0.00 0.18 -0.34 0.00 0.00 178.44 178.86 2bry n LEU 320 N -4.69 3.78 -4.86 2.25 4.77 -0.53 -4.52 117.00 113.20 2bry n LEU 320 Ca 0.21 -2.37 -0.31 0.00 -0.03 0.00 0.00 56.01 53.51 2bry n LEU 320 Cb 0.48 -0.43 0.02 0.00 -2.33 0.00 0.00 43.42 41.16 2bry n LEU 320 CO 0.24 0.76 0.72 -0.83 -1.33 0.00 0.00 177.39 176.95 2bry s GLY 321 N -1.20 1.66 0.46 -0.72 0.00 -0.83 -4.81 107.32 101.88 2bry s GLY 321 Ca 0.38 -0.06 0.19 0.00 0.00 0.00 0.00 44.72 45.23 2bry s GLY 321 CO 0.18 0.22 1.92 1.70 0.00 0.00 0.00 173.10 177.12 2bry h LYS 322 N -0.42 0.28 0.00 2.90 3.64 -1.90 -0.04 116.57 121.04 2bry h LYS 322 Ca -0.44 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 58.87 2bry h LYS 322 Cb 1.20 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.94 2bry h LYS 322 CO 0.61 0.19 -0.26 0.00 -2.27 0.00 0.00 179.45 177.72 2bry h ALA 323 N 1.65 1.11 0.00 5.00 0.00 -1.92 -3.28 119.26 121.81 2bry h ALA 323 Ca 0.37 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2bry h ALA 323 Cb 1.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2bry h ALA 323 CO -0.10 0.33 -1.08 -1.71 0.00 0.00 0.00 179.25 176.69 2bry n ASN 324 N -3.56 0.91 -4.70 0.00 5.15 -0.10 -4.91 115.26 108.05 2bry n ASN 324 Ca -0.01 -0.59 -0.36 0.00 -0.60 0.00 0.00 54.58 53.02 2bry n ASN 324 Cb 0.41 1.25 -0.08 0.00 -0.53 0.00 0.00 39.78 40.82 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 -2.72 5.33 -0.51 3.44 1.01 -0.78 -0.51 120.40 125.66 2bry s VAL 325 Ca 0.02 0.38 -0.16 0.00 0.00 0.00 0.00 61.98 62.22 2bry s VAL 325 Cb 0.12 -3.57 0.09 0.00 0.00 0.00 0.00 36.38 33.01 2bry s VAL 325 CO 0.67 0.37 0.49 -0.69 0.00 0.00 0.00 175.10 175.93 2bry s VAL 326 N 0.74 5.13 0.21 2.92 1.01 0.58 -4.88 120.40 126.12 2bry s VAL 326 Ca 0.12 -1.08 -0.11 0.00 0.00 0.00 0.00 61.98 60.92 2bry s VAL 326 Cb -0.13 -4.24 0.20 0.00 0.00 0.00 0.00 36.38 32.21 2bry s VAL 326 CO 0.03 -0.74 1.66 -0.65 0.00 0.00 0.00 175.10 175.41 2bry h PRO 327 N 8.87 0.12 -0.54 2.72 0.11 -1.94 0.39 132.00 141.73 2bry h PRO 327 Ca -0.29 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2bry h PRO 327 Cb 1.10 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 2bry h PRO 327 CO 0.95 0.08 0.34 0.93 -0.21 0.00 0.00 178.00 180.10 2bry h GLU 328 N 0.12 0.72 -0.50 1.05 4.39 -1.97 -0.29 114.58 118.11 2bry h GLU 328 Ca 0.32 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.90 2bry h GLU 328 Cb 0.52 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.99 2bry h GLU 328 CO -0.52 0.50 0.03 0.00 -1.16 0.00 0.00 179.01 177.86 2bry h ALA 329 N 1.18 0.66 -0.64 3.43 0.00 -1.61 -2.08 119.26 120.21 2bry h ALA 329 Ca 0.20 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.85 2bry h ALA 329 Cb -0.05 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 2bry h ALA 329 CO -0.04 0.44 0.42 1.25 0.00 0.00 0.00 179.25 181.32 2bry h LEU 330 N 0.72 0.74 0.05 0.00 5.85 -0.58 -0.64 115.31 121.45 2bry h LEU 330 Ca 0.14 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.86 2bry h LEU 330 Cb 0.47 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 2bry h LEU 330 CO 0.02 0.54 -0.18 1.56 -0.34 0.00 0.00 178.44 180.04 2bry h GLN 331 N 0.87 -0.30 -0.92 1.25 4.20 -0.95 -0.75 115.11 118.51 2bry h GLN 331 Ca 0.23 0.02 0.01 0.00 0.06 0.00 0.00 58.65 58.97 2bry h GLN 331 Cb -0.09 0.07 -0.05 0.00 0.30 0.00 0.00 27.48 27.71 2bry h GLN 331 CO -0.05 -0.20 0.60 0.00 -0.67 0.00 0.00 178.83 178.51 2bry h ARG 332 N -0.31 1.22 0.47 1.46 3.08 -1.02 -1.18 114.38 118.10 2bry h ARG 332 Ca 0.04 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 2bry h ARG 332 Cb 0.36 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 30.14 2bry h ARG 332 CO -0.13 0.81 -0.22 0.35 -1.07 0.00 0.00 179.97 179.71 2bry h PHE 333 N 1.25 -0.58 -0.50 3.04 3.57 -0.93 -0.95 116.94 121.83 2bry h PHE 333 Ca 0.33 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.85 2bry h PHE 333 Cb -0.13 0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 2bry h PHE 333 CO 0.00 -0.31 0.29 0.00 -2.23 0.00 0.00 178.31 176.07 2bry h ALA 334 N -0.25 0.64 -0.66 2.41 0.00 -0.94 -1.54 119.26 118.93 2bry h ALA 334 Ca -0.06 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 2bry h ALA 334 Cb 0.53 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 2bry h ALA 334 CO 0.11 -0.01 0.15 -0.09 0.00 0.00 0.00 179.25 179.40 2bry h ARG 335 N 0.59 1.07 -0.61 0.00 2.43 -1.19 -0.75 114.38 115.92 2bry h ARG 335 Ca 0.20 -0.26 -0.04 0.00 -0.81 0.00 0.00 59.98 59.07 2bry h ARG 335 Cb 0.03 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.42 2bry h ARG 335 CO -0.10 0.96 0.24 0.00 -1.51 0.00 0.00 179.97 179.56 2bry h ALA 336 N 1.06 0.79 -0.18 2.80 0.00 -0.85 0.19 119.26 123.07 2bry h ALA 336 Ca 0.21 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2bry h ALA 336 Cb 0.39 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2bry h ALA 336 CO 0.01 0.42 0.02 0.00 0.00 0.00 0.00 179.25 179.69 2bry h ALA 337 N 1.09 0.24 -0.29 0.00 0.00 -1.15 -2.04 119.26 117.10 2bry h ALA 337 Ca 0.20 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2bry h ALA 337 Cb 0.22 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2bry h ALA 337 CO -0.02 -0.08 0.18 0.00 0.00 0.00 0.00 179.25 179.33 2bry h ALA 338 N 0.80 0.37 -0.35 0.00 0.00 -0.96 -0.09 119.26 119.03 2bry h ALA 338 Ca 0.05 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.95 2bry h ALA 338 Cb 0.34 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2bry h ALA 338 CO 0.01 -0.13 0.16 0.22 0.00 0.00 0.00 179.25 179.50 2bry h ASP 339 N 0.37 0.23 -0.62 0.00 3.58 -0.95 -2.25 116.42 116.78 2bry h ASP 339 Ca 0.10 0.02 -0.05 0.00 0.42 0.00 0.00 57.03 57.53 2bry h ASP 339 Cb 0.00 -0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.01 2bry h ASP 339 CO -0.02 0.17 0.20 0.15 -2.88 0.00 0.00 179.24 176.86 2bry h PHE 340 N 0.34 0.99 -0.10 0.28 3.57 -1.17 0.54 116.94 121.39 2bry h PHE 340 Ca 0.15 -0.10 -0.07 0.00 3.53 0.00 0.00 57.97 61.48 2bry h PHE 340 Cb 0.08 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.52 2bry h PHE 340 CO -0.11 0.82 -0.26 0.00 -2.23 0.00 0.00 178.31 176.53 2bry h ALA 341 N 1.07 1.38 -0.59 2.41 0.00 -0.70 -2.32 119.26 120.50 2bry h ALA 341 Ca 0.20 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2bry h ALA 341 Cb 0.29 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2bry h ALA 341 CO -0.01 0.43 0.00 0.25 0.00 0.00 0.00 179.25 179.93 2bry n THR 342 N -4.17 0.99 -2.70 0.00 -2.24 -0.88 -4.97 114.28 100.32 2bry n THR 342 Ca -0.01 -1.00 -0.20 0.00 -2.27 0.00 0.00 64.05 60.57 2bry n THR 342 Cb 0.35 0.51 0.01 0.00 -2.10 0.00 0.00 70.33 69.10 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 1.24 -1.46 -0.93 4.78 -0.00 -0.35 -1.86 115.22 116.65 2bry n HIS 343 Ca 0.20 0.22 0.00 0.00 -0.00 0.00 0.00 57.72 58.14 2bry n HIS 343 Cb 0.55 -3.94 0.00 0.00 -0.00 0.00 0.00 29.99 26.61 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 -1.18 0.34 0.01 -1.41 0.00 0.03 -4.87 105.19 98.11 2bry n GLY 344 Ca -0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.38 0.21 0.00 1.61 4.76 -0.78 -1.89 118.16 120.70 2bry n LYS 345 Ca 0.00 -0.01 0.14 0.00 -2.87 0.00 0.00 58.31 55.57 2bry n LYS 345 Cb 0.16 -1.50 0.54 0.00 -1.84 0.00 0.00 35.03 32.40 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 -1.38 1.06 0.00 -0.35 4.77 -1.26 -4.77 117.00 115.07 2bry n LEU 346 Ca 0.10 -0.31 0.00 0.00 -0.03 0.00 0.00 56.01 55.78 2bry n LEU 346 Cb 0.30 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 2bry n LEU 346 CO 0.25 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 2bry n GLY 347 N 1.22 -0.58 3.59 -0.72 0.00 -0.79 -4.65 105.19 103.26 2bry n GLY 347 Ca 0.17 -1.12 -0.42 0.00 0.00 0.00 0.00 46.02 44.65 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 3.19 0.10 1.61 2.20 -1.26 -4.96 119.74 120.62 2bry s LYS 348 Ca 0.00 1.40 -0.30 0.00 -0.36 0.00 0.00 55.97 56.70 2bry s LYS 348 Cb 0.00 -4.25 -0.06 0.00 -1.51 0.00 0.00 37.83 32.01 2bry s LYS 348 CO 0.00 -2.03 1.07 -0.51 -0.36 0.00 0.00 175.35 173.53 2bry s LEU 349 N 7.45 4.44 -0.13 5.43 1.43 -1.26 -5.04 118.68 131.00 2bry s LEU 349 Ca 0.81 1.92 0.01 0.00 -1.03 0.00 0.00 54.13 55.85 2bry s LEU 349 Cb -0.22 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.41 2bry s LEU 349 CO 0.32 -0.26 -0.17 -1.61 0.23 0.00 0.00 176.35 174.86 2bry s GLU 350 N 0.36 3.23 0.29 1.70 0.41 -1.26 -5.04 118.70 118.40 2bry s GLU 350 Ca 0.52 -0.76 -0.30 0.00 -0.41 0.00 0.00 54.97 54.01 2bry s GLU 350 Cb -0.26 -2.53 -0.12 0.00 -1.78 0.00 0.00 34.13 29.44 2bry s GLU 350 CO 0.31 0.14 1.61 1.19 -0.49 0.00 0.00 175.26 178.02 2bry n PHE 351 N 3.69 2.89 -1.22 1.61 3.72 -1.26 -0.13 117.46 126.77 2bry n PHE 351 Ca -0.19 0.24 -0.30 0.00 -0.05 0.00 0.00 57.45 57.15 2bry n PHE 351 Cb 0.52 -2.61 0.11 0.00 -0.94 0.00 0.00 39.48 36.57 2bry n PHE 351 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2bry s ALA 352 N 0.03 1.93 -0.00 4.37 0.00 0.08 -4.59 121.76 123.58 2bry s ALA 352 Ca 0.64 0.13 -0.13 0.00 0.00 0.00 0.00 51.96 52.60 2bry s ALA 352 Cb -0.49 -3.24 -0.05 0.00 0.00 0.00 0.00 23.12 19.33 2bry s ALA 352 CO 0.48 -2.05 0.38 -0.65 0.00 0.00 0.00 175.76 173.92 2bry s GLN 353 N -4.91 3.84 0.72 0.00 -0.21 -1.26 -0.38 119.66 117.46 2bry s GLN 353 Ca 0.62 0.32 -0.11 0.00 0.02 0.00 0.00 55.36 56.21 2bry s GLN 353 Cb -0.18 -3.19 0.16 0.00 1.00 0.00 0.00 33.01 30.81 2bry s GLN 353 CO 0.56 0.68 0.98 -0.40 -2.12 0.00 0.00 175.29 175.00 2bry n ASP 354 N 1.71 0.23 0.26 5.90 5.68 0.75 -4.79 116.55 126.28 2bry n ASP 354 Ca -0.14 -1.45 0.16 0.00 -0.50 0.00 0.00 54.79 52.87 2bry n ASP 354 Cb 0.53 -0.73 0.87 0.00 -1.14 0.00 0.00 41.12 40.64 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 -1.64 1.05 -0.27 2.12 0.00 -1.89 0.37 119.26 119.00 2bry h ALA 355 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2bry h ALA 355 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2bry h ALA 355 CO 0.24 -0.05 0.00 0.54 0.00 0.00 0.00 179.25 179.97 2bry n ARG 356 N -2.66 2.07 -0.63 0.00 3.00 -1.26 -4.98 116.66 112.19 2bry n ARG 356 Ca -0.02 -1.91 0.00 0.00 -0.01 0.00 0.00 57.85 55.91 2bry n ARG 356 Cb 0.11 -1.36 0.00 0.00 0.00 0.00 0.00 32.46 31.22 2bry n ARG 356 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2bry n GLY 357 N 0.95 0.68 3.94 -0.13 0.00 0.12 -5.06 105.19 105.69 2bry n GLY 357 Ca 0.13 -0.05 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.43 3.49 0.21 1.61 0.52 -1.26 -4.76 118.95 118.33 2bry s ARG 358 Ca 0.00 -0.43 -0.32 0.00 -0.52 0.00 0.00 55.73 54.45 2bry s ARG 358 Cb 0.00 -2.83 -0.12 0.00 0.52 0.00 0.00 34.95 32.51 2bry s ARG 358 CO 0.00 0.38 1.70 -2.30 0.02 0.00 0.00 175.30 175.10 2bry n PRO 359 N -0.94 2.70 -2.59 3.54 -0.02 -1.26 -0.17 135.00 136.25 2bry n PRO 359 Ca -0.06 0.97 -0.43 0.00 -2.02 0.00 0.00 63.50 61.97 2bry n PRO 359 Cb 0.55 -2.81 -0.01 0.00 -0.02 0.00 0.00 33.50 31.21 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 1.09 6.77 -0.03 2.55 -1.08 0.49 -4.74 116.67 121.72 2bry s ASP 360 Ca 0.75 -2.25 -0.04 0.00 -0.52 0.00 0.00 52.55 50.48 2bry s ASP 360 Cb -0.52 -2.57 0.01 0.00 -1.46 0.00 0.00 42.92 38.37 2bry s ASP 360 CO 0.34 -1.23 0.11 0.54 0.52 0.00 0.00 175.17 175.45 2bry s VAL 361 N 4.29 0.02 -0.06 1.11 0.11 -1.26 -1.30 120.40 123.31 2bry s VAL 361 Ca 0.52 -0.19 -0.19 0.00 -2.93 0.00 0.00 61.98 59.18 2bry s VAL 361 Cb 0.03 -0.23 0.04 0.00 -1.53 0.00 0.00 36.38 34.69 2bry s VAL 361 CO 0.04 -0.10 0.44 0.00 -3.33 0.00 0.00 175.10 172.14 2bry s ALA 362 N -0.31 -1.12 -0.10 1.54 0.00 -0.55 -5.00 121.76 116.21 2bry s ALA 362 Ca -0.04 0.80 -0.05 0.00 0.00 0.00 0.00 51.96 52.68 2bry s ALA 362 Cb -0.03 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.93 2bry s ALA 362 CO 0.00 -0.28 0.08 0.00 0.00 0.00 0.00 175.76 175.56 2bry s ALA 363 N -0.95 3.62 0.05 0.00 0.00 -1.26 -1.39 121.76 121.82 2bry s ALA 363 Ca -0.10 -0.71 0.03 0.00 0.00 0.00 0.00 51.96 51.18 2bry s ALA 363 Cb -0.03 -1.75 -0.03 0.00 0.00 0.00 0.00 23.12 21.31 2bry s ALA 363 CO 0.05 0.61 -0.10 -0.06 0.00 0.00 0.00 175.76 176.26 2bry s PHE 364 N -0.97 0.87 -0.34 0.00 0.08 0.11 -4.99 117.98 112.74 2bry s PHE 364 Ca 0.14 -0.47 -0.29 0.00 0.12 0.00 0.00 56.93 56.43 2bry s PHE 364 Cb -0.12 -0.51 0.02 0.00 -0.57 0.00 0.00 43.02 41.84 2bry s PHE 364 CO 0.03 -0.03 1.10 0.34 -0.10 0.00 0.00 175.22 176.57 2bry s ASP 365 N -1.58 6.86 -0.11 1.36 2.15 -1.26 -0.75 116.67 123.34 2bry s ASP 365 Ca -0.07 0.96 0.17 0.00 0.43 0.00 0.00 52.55 54.05 2bry s ASP 365 Cb -0.10 -2.54 0.63 0.00 -0.30 0.00 0.00 42.92 40.61 2bry s ASP 365 CO 0.01 -0.96 1.54 0.49 -0.17 0.00 0.00 175.17 176.09 2bry n PHE 366 N 7.09 1.26 0.02 -5.34 3.01 0.41 -4.66 117.46 119.25 2bry n PHE 366 Ca 0.12 -0.64 -0.21 0.00 1.01 0.00 0.00 57.45 57.72 2bry n PHE 366 Cb 0.47 -0.23 -0.14 0.00 -0.01 0.00 0.00 39.48 39.57 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 3.38 1.09 -3.36 4.37 2.02 -1.81 -3.42 112.91 115.17 2bry h THR 367 Ca 0.00 -2.43 -0.66 0.00 0.77 0.00 0.00 66.41 64.09 2bry h THR 367 Cb 1.36 2.79 -0.19 0.00 -1.74 0.00 0.00 68.15 70.37 2bry h THR 367 CO 0.20 0.72 -0.65 -0.44 0.37 0.00 0.00 175.52 175.73 2bry s SER 368 N -7.06 4.99 -0.11 4.18 0.01 -1.26 -2.43 113.70 112.02 2bry s SER 368 Ca -0.18 -0.01 0.01 0.00 1.31 0.00 0.00 55.95 57.08 2bry s SER 368 Cb 0.04 -1.61 0.02 0.00 0.21 0.00 0.00 66.02 64.68 2bry s SER 368 CO 0.79 0.27 -0.15 -0.04 0.41 0.00 0.00 173.24 174.52 2bry s MET 369 N -0.21 2.17 -0.04 12.44 1.00 -0.84 -4.97 119.30 128.86 2bry s MET 369 Ca 0.04 -0.54 -0.02 0.00 0.00 0.00 0.00 55.69 55.18 2bry s MET 369 Cb -0.13 -1.88 -0.04 0.00 0.00 0.00 0.00 34.83 32.78 2bry s MET 369 CO 0.02 -0.10 0.08 -1.64 0.00 0.00 0.00 175.02 173.38 2bry s MET 370 N 1.09 3.12 -0.15 2.03 -1.94 -1.26 -2.25 119.30 119.93 2bry s MET 370 Ca -0.05 -0.41 -0.11 0.00 -1.71 0.00 0.00 55.69 53.41 2bry s MET 370 Cb -0.14 -2.90 0.05 0.00 2.01 0.00 0.00 34.83 33.84 2bry s MET 370 CO -0.03 0.68 0.38 -0.98 -0.01 0.00 0.00 175.02 175.05 2bry s ARG 371 N -1.47 0.40 0.46 2.03 1.70 -0.10 -1.11 118.95 120.85 2bry s ARG 371 Ca 0.20 0.63 -0.24 0.00 -0.47 0.00 0.00 55.73 55.84 2bry s ARG 371 Cb -0.12 0.09 -0.07 0.00 -0.57 0.00 0.00 34.95 34.27 2bry s ARG 371 CO 0.10 -0.10 1.32 0.00 -1.08 0.00 0.00 175.30 175.54 2bry s ALA 372 N 0.77 3.09 0.29 7.88 0.00 0.36 -0.64 121.76 133.51 2bry s ALA 372 Ca -0.05 1.26 0.05 0.00 0.00 0.00 0.00 51.96 53.21 2bry s ALA 372 Cb -0.06 -3.51 0.45 0.00 0.00 0.00 0.00 23.12 20.00 2bry s ALA 372 CO -0.06 -1.02 1.72 1.49 0.00 0.00 0.00 175.76 177.90 2bry h GLU 373 N 2.17 0.36 -4.56 0.00 4.81 -1.24 -3.45 114.58 112.67 2bry h GLU 373 Ca -0.50 -0.15 -0.23 0.00 -0.13 0.00 0.00 59.36 58.35 2bry h GLU 373 Cb 1.26 -0.02 -0.17 0.00 0.63 0.00 0.00 28.75 30.46 2bry h GLU 373 CO 0.60 0.64 -0.71 -1.54 -0.73 0.00 0.00 179.01 177.28 2bry s SER 374 N -6.85 0.96 0.00 1.04 1.04 -1.26 -5.05 113.70 103.58 2bry s SER 374 Ca -0.06 -0.84 0.25 0.00 0.48 0.00 0.00 55.95 55.78 2bry s SER 374 Cb 0.14 0.09 0.37 0.00 0.10 0.00 0.00 66.02 66.72 2bry s SER 374 CO 0.78 -0.39 1.35 -1.54 0.98 0.00 0.00 173.24 174.43 2bry n SER 375 N 0.52 2.41 -3.49 7.02 3.41 -1.26 -4.93 113.62 117.30 2bry n SER 375 Ca -0.16 -1.75 -0.15 0.00 -0.26 0.00 0.00 58.87 56.55 2bry n SER 375 Cb 0.59 0.08 -0.04 0.00 -0.26 0.00 0.00 64.21 64.58 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 -2.11 -1.73 0.14 7.33 0.00 -1.26 -0.79 121.76 123.34 2bry s ALA 376 Ca 0.28 1.04 -0.08 0.00 0.00 0.00 0.00 51.96 53.20 2bry s ALA 376 Cb 0.20 0.27 -0.01 0.00 0.00 0.00 0.00 23.12 23.58 2bry s ALA 376 CO 0.36 -0.52 0.24 1.03 0.00 0.00 0.00 175.76 176.87 2bry s ARG 377 N -2.19 1.05 -0.03 0.00 0.52 -0.27 -4.97 118.95 113.06 2bry s ARG 377 Ca -0.05 -1.15 0.05 0.00 -0.52 0.00 0.00 55.73 54.06 2bry s ARG 377 Cb -0.00 0.35 -0.01 0.00 0.52 0.00 0.00 34.95 35.81 2bry s ARG 377 CO 0.00 -0.37 -0.17 0.08 0.02 0.00 0.00 175.30 174.87 2bry s VAL 378 N -3.95 1.38 0.01 3.52 1.01 0.06 -0.37 120.40 122.07 2bry s VAL 378 Ca 0.15 -0.71 0.08 0.00 0.00 0.00 0.00 61.98 61.50 2bry s VAL 378 Cb 0.04 -1.18 -0.02 0.00 0.00 0.00 0.00 36.38 35.22 2bry s VAL 378 CO -0.03 0.40 -0.24 -1.10 0.00 0.00 0.00 175.10 174.13 2bry s GLN 379 N -0.08 1.78 -0.02 2.72 -0.21 -0.24 -0.49 119.66 123.11 2bry s GLN 379 Ca -0.01 -0.94 0.02 0.00 0.02 0.00 0.00 55.36 54.45 2bry s GLN 379 Cb -0.10 -1.82 0.00 0.00 1.00 0.00 0.00 33.01 32.09 2bry s GLN 379 CO 0.01 0.49 -0.08 -2.00 -2.12 0.00 0.00 175.29 171.59 2bry s GLU 380 N -0.88 0.80 -0.09 2.91 -6.30 0.04 -0.36 118.70 114.81 2bry s GLU 380 Ca 0.10 -0.27 -0.07 0.00 -2.50 0.00 0.00 54.97 52.23 2bry s GLU 380 Cb -0.09 -0.76 0.03 0.00 0.00 0.00 0.00 34.13 33.30 2bry s GLU 380 CO 0.00 0.11 0.23 0.21 0.02 0.00 0.00 175.26 175.84 2bry s LYS 381 N 0.12 0.24 -1.58 4.30 2.20 -0.83 -1.65 119.74 122.55 2bry s LYS 381 Ca -0.02 0.37 -0.15 0.00 -0.36 0.00 0.00 55.97 55.81 2bry s LYS 381 Cb -0.07 0.06 0.11 0.00 -1.51 0.00 0.00 37.83 36.42 2bry s LYS 381 CO 0.00 -0.07 0.92 0.72 -0.36 0.00 0.00 175.35 176.56 2bry n HIS 382 N 3.32 -2.12 -0.22 4.03 8.25 -1.26 -1.13 115.22 126.08 2bry n HIS 382 Ca -0.16 0.86 0.00 0.00 -0.26 0.00 0.00 57.72 58.16 2bry n HIS 382 Cb 0.57 -3.63 0.00 0.00 1.12 0.00 0.00 29.99 28.05 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 -1.58 1.93 3.56 -1.41 0.00 -1.26 -4.15 105.19 102.28 2bry n GLY 383 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 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 -3.01 3.47 -0.04 4.61 0.00 -0.29 -5.04 121.76 121.47 2bry s ALA 384 Ca 0.00 -1.16 -0.13 0.00 0.00 0.00 0.00 51.96 50.67 2bry s ALA 384 Cb 0.00 -2.46 -0.05 0.00 0.00 0.00 0.00 23.12 20.60 2bry s ALA 384 CO 0.00 -0.63 0.34 1.03 0.00 0.00 0.00 175.76 176.50 2bry s ARG 385 N 1.73 3.85 -0.11 0.00 0.52 -1.26 -1.96 118.95 121.72 2bry s ARG 385 Ca 0.07 0.27 0.02 0.00 -0.52 0.00 0.00 55.73 55.57 2bry s ARG 385 Cb -0.16 -3.24 0.01 0.00 0.52 0.00 0.00 34.95 32.09 2bry s ARG 385 CO 0.10 0.66 -0.16 -1.17 0.02 0.00 0.00 175.30 174.75 2bry s LEU 386 N -0.90 1.76 -0.22 2.53 2.96 0.51 -4.67 118.68 120.65 2bry s LEU 386 Ca 0.21 -0.44 -0.16 0.00 -0.22 0.00 0.00 54.13 53.53 2bry s LEU 386 Cb -0.15 -1.11 -0.04 0.00 0.50 0.00 0.00 46.19 45.39 2bry s LEU 386 CO 0.11 0.03 0.40 -0.22 -1.32 0.00 0.00 176.35 175.34 2bry s LEU 387 N 0.91 4.13 -0.16 -0.68 2.96 -0.14 -1.08 118.68 124.62 2bry s LEU 387 Ca -0.08 0.47 -0.03 0.00 -0.22 0.00 0.00 54.13 54.28 2bry s LEU 387 Cb -0.15 -2.50 -0.02 0.00 0.50 0.00 0.00 46.19 44.02 2bry s LEU 387 CO -0.01 -0.10 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.09 2bry s LEU 388 N 1.48 3.01 0.04 -0.68 1.02 0.50 -0.79 118.68 123.27 2bry s LEU 388 Ca 0.18 -0.24 0.05 0.00 0.02 0.00 0.00 54.13 54.15 2bry s LEU 388 Cb -0.15 -1.72 -0.02 0.00 0.02 0.00 0.00 46.19 44.32 2bry s LEU 388 CO 0.08 0.14 -0.16 -0.83 0.02 0.00 0.00 176.35 175.60 2bry s GLY 389 N 0.55 0.86 -0.10 -3.19 0.00 -0.12 -1.11 107.32 104.21 2bry s GLY 389 Ca -0.05 -0.87 -0.02 0.00 0.00 0.00 0.00 44.72 43.78 2bry s GLY 389 CO 0.03 -0.83 -0.00 1.08 0.00 0.00 0.00 173.10 173.37 2bry s LEU 390 N -1.11 3.52 -0.02 0.66 1.43 0.03 -0.79 118.68 122.39 2bry s LEU 390 Ca 0.03 0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.23 2bry s LEU 390 Cb -0.08 -1.81 0.01 0.00 0.03 0.00 0.00 46.19 44.34 2bry s LEU 390 CO 0.01 0.33 -0.03 -0.69 0.23 0.00 0.00 176.35 176.21 2bry s VAL 391 N -0.62 0.30 0.00 -1.59 1.01 -0.37 -4.82 120.40 114.30 2bry s VAL 391 Ca 0.10 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.01 2bry s VAL 391 Cb -0.12 -0.31 0.00 0.00 0.00 0.00 0.00 36.38 35.95 2bry s VAL 391 CO 0.02 0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.86 2bry n GLY 392 N 3.53 -0.42 0.37 4.51 0.00 -1.26 -4.20 105.19 107.72 2bry n GLY 392 Ca -0.20 -1.65 0.19 0.00 0.00 0.00 0.00 46.02 44.37 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 1.96 0.00 1.33 1.61 5.19 -1.89 -0.51 116.42 124.11 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 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.12 2bry h LEU 395 N 0.00 0.00 -7.66 0.00 5.85 -1.32 -3.42 115.31 108.76 2bry h LEU 395 Ca 0.00 -0.24 -0.37 0.00 0.84 0.00 0.00 57.88 58.11 2bry h LEU 395 Cb 0.66 0.00 -0.34 0.00 0.37 0.00 0.00 40.66 41.35 2bry h LEU 395 CO 0.00 1.09 -0.76 0.68 -0.34 0.00 0.00 178.44 179.12 2bry s VAL 396 N -2.28 0.32 -0.08 1.05 -7.23 -0.91 -0.49 120.40 110.78 2bry s VAL 396 Ca -0.21 0.00 -0.29 0.00 -1.81 0.00 0.00 61.98 59.67 2bry s VAL 396 Cb 0.04 -0.39 -0.02 0.00 0.56 0.00 0.00 36.38 36.57 2bry s VAL 396 CO 0.39 0.18 0.98 -0.70 -0.31 0.00 0.00 175.10 175.64 2bry s GLU 397 N 0.98 4.45 0.41 4.82 2.12 -0.27 -4.13 118.70 127.08 2bry s GLU 397 Ca -0.10 1.37 -0.20 0.00 0.36 0.00 0.00 54.97 56.40 2bry s GLU 397 Cb -0.14 -3.52 -0.11 0.00 0.26 0.00 0.00 34.13 30.62 2bry s GLU 397 CO -0.01 -0.25 0.91 -1.25 -0.54 0.00 0.00 175.26 174.12 2bry s PRO 398 N 1.77 4.18 -0.53 4.30 0.04 -1.26 -4.73 135.00 138.77 2bry s PRO 398 Ca 0.48 1.02 -0.21 0.00 0.04 0.00 0.00 61.00 62.34 2bry s PRO 398 Cb -0.19 -2.23 0.06 0.00 0.04 0.00 0.00 34.50 32.18 2bry s PRO 398 CO 0.20 0.00 0.73 0.12 0.04 0.00 0.00 177.00 178.09 2bry s PHE 399 N -2.15 2.96 0.22 0.56 5.36 -1.26 -4.97 117.98 118.69 2bry s PHE 399 Ca 0.60 -0.43 -0.09 0.00 -0.96 0.00 0.00 56.93 56.06 2bry s PHE 399 Cb -0.09 -3.75 0.32 0.00 -0.34 0.00 0.00 43.02 39.16 2bry s PHE 399 CO 0.14 -1.17 1.70 -1.49 -1.46 0.00 0.00 175.22 172.95 2bry h TRP 400 N 9.12 0.22 -0.16 10.12 6.55 -1.99 -1.51 115.95 138.31 2bry h TRP 400 Ca -0.27 0.04 0.05 0.00 0.95 0.00 0.00 58.89 59.65 2bry h TRP 400 Cb 1.09 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.38 2bry h TRP 400 CO 0.81 -0.04 0.19 -1.35 -1.05 0.00 0.00 178.44 177.01 2bry h PRO 401 N 0.26 0.00 -0.00 0.49 0.11 -1.96 -1.24 132.00 129.66 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 0.51 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.62 2bry h PRO 401 CO -0.42 0.00 -0.43 1.28 -0.21 0.00 0.00 178.00 178.22 2bry n LEU 402 N -3.70 0.48 -0.86 2.35 4.77 -0.57 -4.93 117.00 114.54 2bry n LEU 402 Ca 0.01 0.04 -0.08 0.00 -0.03 0.00 0.00 56.01 55.95 2bry n LEU 402 Cb 0.31 -0.27 -0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2bry n LEU 402 CO 0.26 0.11 -0.10 0.61 -1.33 0.00 0.00 177.39 176.95 2bry n GLY 403 N 1.49 0.06 0.51 -0.72 0.00 -0.47 -4.93 105.19 101.13 2bry n GLY 403 Ca 0.06 -0.57 0.13 0.00 0.00 0.00 0.00 46.02 45.64 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 -4.00 0.00 0.19 2.61 -2.24 -1.26 -4.66 114.28 104.92 2bry n THR 404 Ca -0.09 -0.27 -0.14 0.00 -2.27 0.00 0.00 64.05 61.28 2bry n THR 404 Cb 0.57 0.73 -0.08 0.00 -2.10 0.00 0.00 70.33 69.45 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 4.85 -0.47 0.84 3.38 0.00 -1.90 0.04 103.07 109.80 2bry h GLY 405 Ca 0.00 0.17 -0.04 0.00 0.00 0.00 0.00 47.33 47.46 2bry h GLY 405 CO 0.00 -0.17 -0.02 -2.08 0.00 0.00 0.00 176.54 174.27 2bry h VAL 406 N -0.59 1.27 0.02 4.60 2.07 -1.83 -0.81 116.25 120.97 2bry h VAL 406 Ca -0.05 -0.96 0.02 0.00 0.82 0.00 0.00 66.70 66.54 2bry h VAL 406 Cb 0.43 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 2bry h VAL 406 CO 0.07 0.30 -0.13 0.00 0.02 0.00 0.00 177.57 177.83 2bry h ALA 407 N 0.78 -0.17 -0.07 1.67 0.00 -1.81 0.13 119.26 119.79 2bry h ALA 407 Ca 0.06 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 2bry h ALA 407 Cb 0.45 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2bry h ALA 407 CO 0.02 -0.63 -0.63 0.00 0.00 0.00 0.00 179.25 178.00 2bry h ARG 408 N -0.23 0.25 -0.48 0.00 3.08 -1.02 -0.61 114.38 115.36 2bry h ARG 408 Ca 0.04 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.92 2bry h ARG 408 Cb 0.28 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 2bry h ARG 408 CO -0.12 0.80 0.32 0.78 -1.07 0.00 0.00 179.97 180.68 2bry h GLY 409 N 1.49 0.68 1.01 0.04 0.00 -0.89 -1.55 103.07 103.86 2bry h GLY 409 Ca -0.01 -0.25 -0.11 0.00 0.00 0.00 0.00 47.33 46.96 2bry h GLY 409 CO 0.10 0.25 -0.18 0.74 0.00 0.00 0.00 176.54 177.45 2bry h PHE 410 N 0.65 0.94 -0.72 5.60 -1.00 -0.48 0.37 116.94 122.30 2bry h PHE 410 Ca 0.18 -0.23 0.01 0.00 2.81 0.00 0.00 57.97 60.74 2bry h PHE 410 Cb -0.07 -0.22 -0.04 0.00 3.61 0.00 0.00 35.95 39.23 2bry h PHE 410 CO -0.04 0.98 0.47 -0.07 -1.61 0.00 0.00 178.31 178.04 2bry h LEU 411 N 0.63 0.81 -1.09 1.54 3.38 -1.10 0.80 115.31 120.28 2bry h LEU 411 Ca 0.09 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2bry h LEU 411 Cb 0.73 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 2bry h LEU 411 CO 0.06 0.58 0.48 0.00 0.09 0.00 0.00 178.44 179.64 2bry h ALA 412 N 1.27 1.31 -0.43 1.53 0.00 -1.01 0.34 119.26 122.27 2bry h ALA 412 Ca 0.27 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2bry h ALA 412 Cb -0.09 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.36 2bry h ALA 412 CO -0.07 0.58 0.27 0.00 0.00 0.00 0.00 179.25 180.03 2bry h ALA 413 N 1.41 0.54 -0.21 0.00 0.00 0.07 -0.12 119.26 120.95 2bry h ALA 413 Ca 0.29 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 2bry h ALA 413 Cb -0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2bry h ALA 413 CO -0.05 0.02 0.07 0.74 0.00 0.00 0.00 179.25 180.02 2bry h PHE 414 N 0.57 0.33 -0.57 0.00 0.04 -0.49 -0.71 116.94 116.10 2bry h PHE 414 Ca 0.15 -0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.85 2bry h PHE 414 Cb -0.03 -0.10 -0.03 0.00 2.20 0.00 0.00 35.95 38.00 2bry h PHE 414 CO -0.04 0.41 0.18 -0.44 -0.60 0.00 0.00 178.31 177.82 2bry h ASP 415 N 0.17 0.80 -0.38 2.17 3.32 -0.82 0.33 116.42 122.00 2bry h ASP 415 Ca 0.07 -0.13 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 2bry h ASP 415 Cb 0.23 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 2bry h ASP 415 CO -0.00 0.75 0.02 0.00 -1.72 0.00 0.00 179.24 178.30 2bry h ALA 416 N 1.36 0.51 -0.71 3.45 0.00 -0.91 -1.17 119.26 121.78 2bry h ALA 416 Ca 0.19 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 2bry h ALA 416 Cb 0.24 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2bry h ALA 416 CO -0.01 0.25 0.24 0.00 0.00 0.00 0.00 179.25 179.74 2bry h ALA 417 N 0.89 0.93 -0.06 0.00 0.00 -0.45 -0.04 119.26 120.53 2bry h ALA 417 Ca 0.11 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2bry h ALA 417 Cb 0.43 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2bry h ALA 417 CO 0.01 0.59 -0.00 2.35 0.00 0.00 0.00 179.25 182.20 2bry h TRP 418 N 1.04 -0.01 -0.76 0.00 2.91 -0.84 -0.57 115.95 117.71 2bry h TRP 418 Ca 0.23 0.00 0.17 0.00 1.13 0.00 0.00 58.89 60.43 2bry h TRP 418 Cb 0.27 0.01 -0.12 0.00 -0.51 0.00 0.00 29.16 28.82 2bry h TRP 418 CO 0.02 -0.01 0.18 1.98 -1.03 0.00 0.00 178.44 179.58 2bry h MET 419 N 0.01 0.24 -0.74 2.65 4.05 -0.98 -1.34 114.93 118.82 2bry h MET 419 Ca 0.03 -0.01 -0.06 0.00 -0.28 0.00 0.00 59.70 59.37 2bry h MET 419 Cb 0.04 -0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 30.75 2bry h MET 419 CO -0.05 0.16 0.22 0.28 0.23 0.00 0.00 176.91 177.75 2bry h VAL 420 N 0.25 1.26 -0.69 -5.77 2.07 -0.33 -0.18 116.25 112.86 2bry h VAL 420 Ca 0.44 -0.93 0.07 0.00 0.82 0.00 0.00 66.70 67.10 2bry h VAL 420 Cb 0.78 0.46 -0.06 0.00 -1.52 0.00 0.00 31.29 30.94 2bry h VAL 420 CO -0.54 0.36 0.38 0.50 0.02 0.00 0.00 177.57 178.29 2bry h LYS 421 N 1.10 0.67 -0.68 1.57 3.64 -0.58 0.29 116.57 122.59 2bry h LYS 421 Ca 0.24 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.51 2bry h LYS 421 Cb 0.32 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 2bry h LYS 421 CO -0.01 0.44 0.16 0.00 -2.27 0.00 0.00 179.45 177.78 2bry h ARG 422 N 0.69 1.09 -0.16 1.90 2.47 -0.63 -1.35 114.38 118.39 2bry h ARG 422 Ca 0.32 -0.27 0.03 0.00 -1.26 0.00 0.00 59.98 58.80 2bry h ARG 422 Cb 0.22 -0.14 -0.03 0.00 -1.65 0.00 0.00 29.97 28.37 2bry h ARG 422 CO -0.20 0.97 -0.04 2.35 0.56 0.00 0.00 179.97 183.61 2bry h TRP 423 N 1.02 -0.09 0.00 3.04 2.91 -0.78 -2.70 115.95 119.34 2bry h TRP 423 Ca 0.21 0.01 -0.04 0.00 1.13 0.00 0.00 58.89 60.20 2bry h TRP 423 Cb 0.38 0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 29.09 2bry h TRP 423 CO 0.03 -0.07 -0.21 0.00 -1.03 0.00 0.00 178.44 177.16 2bry h ALA 424 N 1.16 1.51 0.00 2.65 0.00 -0.56 -1.18 119.26 122.84 2bry h ALA 424 Ca 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2bry h ALA 424 Cb 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2bry h ALA 424 CO -0.17 0.26 0.00 0.39 0.00 0.00 0.00 179.25 179.73 2bry n GLU 425 N -4.07 0.15 -0.64 0.00 1.02 -0.54 -4.90 120.64 111.65 2bry n GLU 425 Ca -0.02 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.29 2bry n GLU 425 Cb 0.28 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 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 0.04 0.64 3.77 0.62 0.00 -0.44 -5.04 105.19 104.77 2bry n GLY 426 Ca 0.06 -0.37 -0.40 0.00 0.00 0.00 0.00 46.02 45.31 2bry n GLY 426 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bry s ALA 427 N -2.00 3.35 0.75 4.61 0.00 -1.06 -4.96 121.76 122.45 2bry s ALA 427 Ca 0.00 1.46 -0.14 0.00 0.00 0.00 0.00 51.96 53.28 2bry s ALA 427 Cb 0.00 -3.58 0.05 0.00 0.00 0.00 0.00 23.12 19.59 2bry s ALA 427 CO 0.00 -1.10 1.20 0.20 0.00 0.00 0.00 175.76 176.06 2bry s GLY 428 N -0.43 2.28 0.24 0.00 0.00 -1.26 -4.73 107.32 103.42 2bry s GLY 428 Ca 0.58 0.84 -0.05 0.00 0.00 0.00 0.00 44.72 46.09 2bry s GLY 428 CO 0.57 1.25 1.82 -2.55 0.00 0.00 0.00 173.10 174.20 2bry h PRO 429 N -0.45 0.81 -0.52 2.90 0.11 -1.99 -1.33 132.00 131.52 2bry h PRO 429 Ca -0.47 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.55 2bry h PRO 429 Cb 1.29 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 2bry h PRO 429 CO 0.49 0.54 0.16 -0.07 -0.21 0.00 0.00 178.00 178.91 2bry h LEU 430 N 0.84 0.72 -0.31 2.35 3.38 -1.92 -1.15 115.31 119.22 2bry h LEU 430 Ca 0.37 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 58.13 2bry h LEU 430 Cb 0.27 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2bry h LEU 430 CO -0.21 0.68 -0.23 -0.08 0.09 0.00 0.00 178.44 178.69 2bry h GLU 431 N 0.76 0.71 -0.01 1.13 4.57 -1.77 0.14 114.58 120.10 2bry h GLU 431 Ca 0.18 -0.35 0.01 0.00 -1.18 0.00 0.00 59.36 58.02 2bry h GLU 431 Cb 0.22 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.80 2bry h GLU 431 CO -0.01 0.96 -0.03 0.28 -1.18 0.00 0.00 179.01 179.02 2bry h VAL 432 N 0.46 0.91 -0.54 0.32 2.07 -1.14 -2.07 116.25 116.26 2bry h VAL 432 Ca 0.06 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.58 2bry h VAL 432 Cb 0.79 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2bry h VAL 432 CO 0.06 0.00 0.34 -0.07 0.02 0.00 0.00 177.57 177.92 2bry h LEU 433 N -0.05 0.64 -0.45 2.57 3.38 -1.12 -1.78 115.31 118.50 2bry h LEU 433 Ca 0.02 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 2bry h LEU 433 Cb 0.08 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2bry h LEU 433 CO -0.04 0.49 0.04 0.00 0.09 0.00 0.00 178.44 179.02 2bry h ALA 434 N 1.17 0.60 -0.01 1.53 0.00 -0.92 -0.92 119.26 120.72 2bry h ALA 434 Ca 0.20 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2bry h ALA 434 Cb -0.04 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2bry h ALA 434 CO -0.04 0.36 -0.01 0.93 0.00 0.00 0.00 179.25 180.49 2bry h GLU 435 N 0.62 -0.02 -0.37 0.00 5.08 -1.24 -0.80 114.58 117.85 2bry h GLU 435 Ca 0.13 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.53 2bry h GLU 435 Cb 0.44 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.66 2bry h GLU 435 CO 0.02 -0.01 0.15 -0.09 -1.00 0.00 0.00 179.01 178.07 2bry h ARG 436 N -0.02 0.31 -0.21 2.33 9.65 -1.27 -2.13 114.38 123.03 2bry h ARG 436 Ca 0.01 -0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 58.83 2bry h ARG 436 Cb 0.03 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.53 2bry h ARG 436 CO -0.02 0.21 -0.06 0.93 2.80 0.00 0.00 179.97 183.83 2bry h GLU 437 N 0.32 0.32 -0.79 0.20 4.39 -0.98 0.23 114.58 118.26 2bry h GLU 437 Ca 0.16 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.80 2bry h GLU 437 Cb 0.11 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 28.67 2bry h GLU 437 CO -0.14 0.39 0.50 0.77 -1.16 0.00 0.00 179.01 179.37 2bry h SER 438 N 0.31 0.94 -0.25 1.42 0.02 -0.52 -1.61 113.55 113.86 2bry h SER 438 Ca 0.07 -0.05 -0.06 0.00 -0.84 0.00 0.00 61.79 60.91 2bry h SER 438 Cb 0.30 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 2bry h SER 438 CO 0.01 0.71 -0.09 -0.07 -1.14 0.00 0.00 176.83 176.25 2bry h LEU 439 N 1.08 0.51 -1.09 5.07 3.38 -0.79 -3.20 115.31 120.27 2bry h LEU 439 Ca 0.29 -0.39 0.10 0.00 0.09 0.00 0.00 57.88 57.97 2bry h LEU 439 Cb -0.07 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 40.46 2bry h LEU 439 CO -0.06 0.78 0.61 0.22 0.09 0.00 0.00 178.44 180.09 2bry h TYR 440 N 0.23 1.08 -1.15 1.13 3.20 -0.69 -2.05 116.97 118.72 2bry h TYR 440 Ca 0.06 0.03 0.33 0.00 3.14 0.00 0.00 58.73 62.29 2bry h TYR 440 Cb 0.57 -0.35 -0.05 0.00 1.54 0.00 0.00 36.73 38.45 2bry h TYR 440 CO 0.06 0.48 0.94 1.96 -1.64 0.00 0.00 178.16 179.96 2bry h GLN 441 N 0.99 0.00 0.00 1.82 4.20 -1.29 -0.24 115.11 120.59 2bry h GLN 441 Ca 0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.16 2bry h GLN 441 Cb 0.39 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.17 2bry h GLN 441 CO -0.21 0.00 -0.52 -0.07 -0.67 0.00 0.00 178.83 177.37 2bry h LEU 442 N 0.00 0.00 -0.44 1.46 3.38 -1.54 -3.42 115.31 114.76 2bry h LEU 442 Ca 0.55 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.50 2bry h LEU 442 Cb 2.42 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 43.15 2bry h LEU 442 CO -0.01 0.01 0.25 0.25 0.09 0.00 0.00 178.44 179.03 2bry h LEU 443 N 0.00 0.54 0.00 1.67 5.85 -1.15 -2.37 115.31 119.85 2bry h LEU 443 Ca 0.00 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2bry h LEU 443 Cb 0.97 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.87 2bry h LEU 443 CO 0.00 0.46 0.00 -1.20 -0.34 0.00 0.00 178.44 177.36 2bry n SER 444 N -4.72 0.00 -0.03 1.25 7.64 -1.26 -2.42 113.62 114.08 2bry n SER 444 Ca 0.01 -1.11 0.00 0.00 1.01 0.00 0.00 58.87 58.79 2bry n SER 444 Cb 0.07 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.27 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 -0.90 -0.12 -1.83 1.43 3.00 -0.92 -5.06 117.38 112.97 2bry n GLN 445 Ca 0.18 -0.49 -0.40 0.00 -0.01 0.00 0.00 57.00 56.28 2bry n GLN 445 Cb 0.08 -0.97 0.01 0.00 0.00 0.00 0.00 30.24 29.37 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 -0.16 2.15 0.09 5.09 -4.23 -1.02 -4.97 115.64 112.59 2bry s THR 446 Ca 0.01 0.13 -0.11 0.00 -1.18 0.00 0.00 61.69 60.53 2bry s THR 446 Cb 0.01 -3.08 0.01 0.00 1.34 0.00 0.00 72.50 70.78 2bry s THR 446 CO 0.01 0.02 0.27 -0.94 -0.54 0.00 0.00 174.62 173.44 2bry s SER 447 N -0.53 -0.02 0.55 3.99 1.04 -1.26 -5.02 113.70 112.45 2bry s SER 447 Ca 0.60 -0.48 0.23 0.00 0.48 0.00 0.00 55.95 56.77 2bry s SER 447 Cb -0.43 0.38 1.48 0.00 0.10 0.00 0.00 66.02 67.55 2bry s SER 447 CO 0.55 -0.74 2.15 -0.65 0.98 0.00 0.00 173.24 175.52 2bry h PRO 448 N 2.72 0.00 -0.17 4.02 0.11 -1.96 -2.59 132.00 134.14 2bry h PRO 448 Ca -0.34 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.63 2bry h PRO 448 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2bry h PRO 448 CO 0.52 0.00 -0.48 0.93 -0.21 0.00 0.00 178.00 178.76 2bry h GLU 449 N 0.00 0.45 -0.45 1.05 3.07 -1.97 -3.24 114.58 113.49 2bry h GLU 449 Ca 0.05 -0.26 0.00 0.00 -0.50 0.00 0.00 59.36 58.65 2bry h GLU 449 Cb 0.22 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 2bry h GLU 449 CO -0.00 0.84 0.00 0.27 -1.40 0.00 0.00 179.01 178.72 2bry n ASN 450 N -3.98 3.57 -4.97 1.42 0.23 -1.00 -4.95 115.26 105.58 2bry n ASN 450 Ca -0.02 -1.99 -0.19 0.00 -0.53 0.00 0.00 54.58 51.85 2bry n ASN 450 Cb 0.55 -0.29 0.01 0.00 -2.08 0.00 0.00 39.78 37.96 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 -1.39 2.64 0.26 -3.83 -1.94 -1.09 -4.49 119.30 109.47 2bry s MET 451 Ca 0.41 -1.42 -0.31 0.00 -1.71 0.00 0.00 55.69 52.66 2bry s MET 451 Cb 0.23 -2.61 -0.13 0.00 2.01 0.00 0.00 34.83 34.34 2bry s MET 451 CO 0.32 -0.35 1.47 0.72 -0.01 0.00 0.00 175.02 177.16 2bry n HIS 452 N -1.82 2.40 0.15 -0.03 8.25 -0.65 -4.86 115.22 118.65 2bry n HIS 452 Ca 0.07 0.38 0.04 0.00 -0.26 0.00 0.00 57.72 57.95 2bry n HIS 452 Cb 0.60 -2.50 0.07 0.00 1.12 0.00 0.00 29.99 29.28 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 4.36 0.00 -5.86 -0.41 -0.00 -1.92 -3.39 114.38 107.16 2bry h ARG 453 Ca -0.46 0.00 -0.65 0.00 -0.00 0.00 0.00 59.98 58.87 2bry h ARG 453 Cb 1.26 0.00 -0.10 0.00 -0.00 0.00 0.00 29.97 31.13 2bry h ARG 453 CO 0.77 0.43 1.80 1.21 -0.00 0.00 0.00 179.97 184.18 2bry s ASN 454 N -6.42 6.70 0.49 0.08 3.84 -1.26 -4.80 114.94 113.58 2bry s ASN 454 Ca 0.04 -2.05 0.28 0.00 0.21 0.00 0.00 52.86 51.35 2bry s ASN 454 Cb 0.07 -2.56 0.99 0.00 -0.55 0.00 0.00 41.25 39.21 2bry s ASN 454 CO 0.73 -1.28 1.85 -0.37 -2.79 0.00 0.00 177.10 175.23 2bry h VAL 455 N 6.04 0.16 0.00 -5.21 -1.51 -1.94 -2.50 116.25 111.30 2bry h VAL 455 Ca 0.33 -0.83 -0.03 0.00 -1.23 0.00 0.00 66.70 64.93 2bry h VAL 455 Cb 0.94 1.71 -0.00 0.00 -2.13 0.00 0.00 31.29 31.80 2bry h VAL 455 CO 1.42 0.07 -0.15 0.00 -1.23 0.00 0.00 177.57 177.68 2bry h ALA 456 N 1.93 1.37 -0.71 5.19 0.00 -1.96 -2.29 119.26 122.79 2bry h ALA 456 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2bry h ALA 456 Cb 0.71 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2bry h ALA 456 CO 0.01 0.19 0.00 1.04 0.00 0.00 0.00 179.25 180.49 2bry n GLN 457 N -3.81 2.69 -1.88 0.00 1.13 -0.94 -4.94 117.38 109.63 2bry n GLN 457 Ca -0.02 -2.57 -0.41 0.00 -1.94 0.00 0.00 57.00 52.05 2bry n GLN 457 Cb 0.26 -1.56 -0.02 0.00 0.11 0.00 0.00 30.24 29.02 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 -1.08 2.85 0.24 1.08 1.51 -0.86 -4.89 117.35 116.20 2bry s TYR 458 Ca 0.48 0.90 0.01 0.00 -1.01 0.00 0.00 57.07 57.45 2bry s TYR 458 Cb 0.25 -3.96 -0.00 0.00 -0.11 0.00 0.00 41.96 38.13 2bry s TYR 458 CO 0.32 -3.18 0.29 0.41 -1.11 0.00 0.00 175.55 172.28 2bry n GLY 459 N 2.09 2.69 0.29 0.71 0.00 -1.26 -5.06 105.19 104.65 2bry n GLY 459 Ca 0.07 -1.63 0.09 0.00 0.00 0.00 0.00 46.02 44.55 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 0.11 -9.15 0.99 3.38 -1.94 -3.41 115.31 105.29 2bry h LEU 460 Ca -0.18 0.15 -0.62 0.00 0.09 0.00 0.00 57.88 57.33 2bry h LEU 460 Cb 0.81 0.18 0.01 0.00 0.09 0.00 0.00 40.66 41.76 2bry h LEU 460 CO 0.25 -0.03 1.19 -0.67 0.09 0.00 0.00 178.44 179.27 2bry n ASP 461 N -5.13 3.29 0.28 -0.43 -0.08 -1.26 -4.79 116.55 108.43 2bry n ASP 461 Ca 0.17 0.81 0.18 0.00 -1.51 0.00 0.00 54.79 54.44 2bry n ASP 461 Cb 0.54 -1.38 0.88 0.00 2.34 0.00 0.00 41.12 43.50 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 10.38 0.00 0.00 -0.67 0.13 -1.96 -0.57 132.00 139.32 2bry h PRO 462 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2bry h PRO 462 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2bry h PRO 462 CO 0.96 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.73 2bry h ALA 463 N 2.03 1.00 -0.00 -0.56 0.00 -1.87 -0.74 119.26 119.12 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 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2bry h ALA 463 CO 0.00 0.00 -0.14 0.25 0.00 0.00 0.00 179.25 179.36 2bry n THR 464 N -2.71 0.00 0.00 0.00 -2.24 -0.22 -4.42 114.28 104.68 2bry n THR 464 Ca -0.01 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2bry n THR 464 Cb 0.12 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.10 2bry n THR 464 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2bry n ARG 465 N -1.43 0.00 -3.90 -0.78 1.74 -0.47 -4.48 116.66 107.34 2bry n ARG 465 Ca 0.08 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.80 2bry n ARG 465 Cb 0.33 -0.81 -0.12 0.00 -1.02 0.00 0.00 32.46 30.84 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 -1.99 3.11 0.54 -1.55 2.02 -0.41 -1.64 117.35 117.42 2bry s TYR 466 Ca 0.00 -0.32 -0.18 0.00 -0.37 0.00 0.00 57.07 56.20 2bry s TYR 466 Cb 0.00 -2.16 -0.06 0.00 -0.40 0.00 0.00 41.96 39.33 2bry s TYR 466 CO 0.00 -0.22 1.05 -2.14 -1.57 0.00 0.00 175.55 172.67 2bry s PRO 467 N 1.19 3.59 -1.55 -1.71 0.02 -1.26 -3.72 135.00 131.56 2bry s PRO 467 Ca 0.04 1.27 -0.12 0.00 0.02 0.00 0.00 61.00 62.21 2bry s PRO 467 Cb -0.14 -2.07 0.09 0.00 0.02 0.00 0.00 34.50 32.40 2bry s PRO 467 CO 0.03 -0.60 0.84 0.09 -0.33 0.00 0.00 177.00 177.03 2bry n ASN 468 N -1.47 -3.53 -4.74 2.53 3.02 -1.26 -4.82 115.26 105.00 2bry n ASN 468 Ca 0.09 -0.88 -0.42 0.00 -0.03 0.00 0.00 54.58 53.35 2bry n ASN 468 Cb 0.53 -3.48 -0.02 0.00 -0.61 0.00 0.00 39.78 36.19 2bry n ASN 468 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2bry s LEU 469 N -7.19 4.36 -0.42 3.41 0.20 -1.24 -5.00 118.68 112.79 2bry s LEU 469 Ca 0.55 2.82 -0.00 0.00 0.69 0.00 0.00 54.13 58.18 2bry s LEU 469 Cb -0.28 -3.62 0.12 0.00 -0.43 0.00 0.00 46.19 41.97 2bry s LEU 469 CO 0.86 -0.88 0.19 0.21 -0.29 0.00 0.00 176.35 176.45 2bry s ASN 470 N 0.78 5.05 0.00 3.68 2.47 -1.26 -4.96 114.94 120.69 2bry s ASN 470 Ca 0.67 -2.25 0.23 0.00 0.42 0.00 0.00 52.86 51.94 2bry s ASN 470 Cb -0.47 -1.76 1.39 0.00 -1.45 0.00 0.00 41.25 38.96 2bry s ASN 470 CO 0.40 -0.45 1.78 0.18 -3.72 0.00 0.00 177.10 175.28 2bry n LEU 471 N 4.24 0.00 -0.42 3.21 4.77 -1.26 -3.17 117.00 124.37 2bry n LEU 471 Ca 0.01 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.07 2bry n LEU 471 Cb 0.40 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.66 2bry n LEU 471 CO 0.30 0.00 0.43 0.54 -1.33 0.00 0.00 177.39 177.33 2bry n ARG 472 N -0.97 1.35 -0.17 3.23 1.74 -1.26 -4.42 116.66 116.17 2bry n ARG 472 Ca 0.17 -2.88 -0.02 0.00 -0.77 0.00 0.00 57.85 54.35 2bry n ARG 472 Cb 0.08 -1.47 0.20 0.00 -1.02 0.00 0.00 32.46 30.25 2bry n ARG 472 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2bry h ALA 473 N 0.56 1.28 -3.89 7.54 0.00 -1.89 -3.40 119.26 119.47 2bry h ALA 473 Ca -0.01 -0.16 -0.68 0.00 0.00 0.00 0.00 54.91 54.06 2bry h ALA 473 Cb 1.05 -0.25 -0.26 0.00 0.00 0.00 0.00 17.79 18.33 2bry h ALA 473 CO 0.00 0.53 -0.79 0.08 0.00 0.00 0.00 179.25 179.07 2bry s VAL 474 N -5.43 2.84 0.28 0.00 1.01 -1.26 -5.01 120.40 112.82 2bry s VAL 474 Ca -0.10 -0.79 0.09 0.00 0.00 0.00 0.00 61.98 61.18 2bry s VAL 474 Cb 0.16 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 2bry s VAL 474 CO 0.80 0.57 0.06 0.42 0.00 0.00 0.00 175.10 176.95 2bry s THR 475 N -0.37 3.49 0.41 3.92 -4.23 -1.26 -4.51 115.64 113.10 2bry s THR 475 Ca 0.03 -1.78 0.20 0.00 -1.18 0.00 0.00 61.69 58.96 2bry s THR 475 Cb -0.12 -2.96 0.40 0.00 1.34 0.00 0.00 72.50 71.15 2bry s THR 475 CO 0.02 -0.32 1.80 -0.65 -0.54 0.00 0.00 174.62 174.93 2bry h PRO 476 N 1.74 0.36 -0.89 3.99 0.11 -1.94 -0.01 132.00 135.36 2bry h PRO 476 Ca -0.45 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.72 2bry h PRO 476 Cb 1.25 -0.08 -0.06 0.00 0.11 0.00 0.00 31.00 32.22 2bry h PRO 476 CO 0.61 0.24 0.58 -0.91 -0.21 0.00 0.00 178.00 178.31 2bry h ASN 477 N 0.37 0.85 1.08 -2.05 2.35 -1.96 -2.80 115.58 113.42 2bry h ASN 477 Ca 0.55 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.32 2bry h ASN 477 Cb 1.46 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.66 2bry h ASN 477 CO -0.24 0.53 0.00 1.56 -1.65 0.00 0.00 177.43 177.63 2bry h GLN 478 N 0.96 0.00 -0.17 0.81 4.20 -1.39 -3.24 115.11 116.28 2bry h GLN 478 Ca 0.40 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.11 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 -0.16 0.00 0.00 1.33 -0.67 0.00 0.00 178.83 179.33 2bry n VAL 479 N -2.78 2.03 -0.00 -0.54 0.24 -1.06 -4.65 118.33 111.57 2bry n VAL 479 Ca 0.02 -1.93 0.04 0.00 -2.04 0.00 0.00 64.34 60.43 2bry n VAL 479 Cb 0.32 -0.18 0.43 0.00 -1.47 0.00 0.00 33.84 32.94 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 1.13 0.53 0.00 7.34 4.20 -1.61 0.40 115.11 127.10 2bry h GLN 480 Ca 0.00 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2bry h GLN 480 Cb 1.21 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.87 2bry h GLN 480 CO 0.13 0.35 0.00 -0.40 -0.67 0.00 0.00 178.83 178.24 2bry n ASP 481 N -4.48 0.00 -0.48 1.46 5.75 -1.26 -2.15 116.55 115.40 2bry n ASP 481 Ca 0.03 0.43 0.13 0.00 -0.01 0.00 0.00 54.79 55.37 2bry n ASP 481 Cb 0.07 -0.46 0.28 0.00 -1.03 0.00 0.00 41.12 39.98 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 -1.46 1.70 -4.08 -2.12 4.77 0.13 -4.75 117.00 111.18 2bry n LEU 482 Ca 0.04 -0.56 -0.33 0.00 -0.03 0.00 0.00 56.01 55.13 2bry n LEU 482 Cb 0.15 -0.04 -0.14 0.00 -2.33 0.00 0.00 43.42 41.06 2bry n LEU 482 CO 0.12 0.30 -0.32 -0.47 -1.33 0.00 0.00 177.39 175.69 2bry s TYR 483 N -2.28 3.54 -0.95 -1.77 5.04 -0.91 -0.76 117.35 119.25 2bry s TYR 483 Ca 0.27 -2.53 -0.17 0.00 -2.44 0.00 0.00 57.07 52.20 2bry s TYR 483 Cb 0.20 -2.67 0.16 0.00 0.35 0.00 0.00 41.96 39.99 2bry s TYR 483 CO 0.45 -0.92 1.10 0.34 -1.34 0.00 0.00 175.55 175.18 2bry s ASP 484 N 1.23 6.73 -0.52 4.32 2.15 0.35 -4.98 116.67 125.96 2bry s ASP 484 Ca 0.04 -2.34 -0.20 0.00 0.43 0.00 0.00 52.55 50.48 2bry s ASP 484 Cb -0.20 -2.36 0.06 0.00 -0.30 0.00 0.00 42.92 40.12 2bry s ASP 484 CO -0.05 -0.90 0.69 -0.32 -0.17 0.00 0.00 175.17 174.42 2bry s MET 485 N 1.92 3.16 0.35 4.34 1.75 -1.26 -0.78 119.30 128.78 2bry s MET 485 Ca 0.31 -0.80 0.23 0.00 -1.25 0.00 0.00 55.69 54.19 2bry s MET 485 Cb -0.06 -4.10 0.36 0.00 2.84 0.00 0.00 34.83 33.87 2bry s MET 485 CO -0.08 -1.30 1.53 0.52 -0.65 0.00 0.00 175.02 175.04 2bry h MET 486 N 9.07 0.00 -4.70 4.11 0.00 -1.69 -3.48 114.93 118.25 2bry h MET 486 Ca -0.27 0.00 -0.26 0.00 0.00 0.00 0.00 59.70 59.17 2bry h MET 486 Cb 1.09 0.00 -0.15 0.00 0.00 0.00 0.00 31.60 32.54 2bry h MET 486 CO 1.00 0.00 -0.66 -0.51 0.00 0.00 0.00 176.91 176.74 2bry s ASP 487 N -5.72 0.96 0.00 1.22 1.01 -1.26 -4.99 116.67 107.89 2bry s ASP 487 Ca 0.06 -1.19 0.24 0.00 0.71 0.00 0.00 52.55 52.38 2bry s ASP 487 Cb 0.07 0.17 0.45 0.00 1.01 0.00 0.00 42.92 44.62 2bry s ASP 487 CO 0.68 -0.62 1.41 1.17 0.21 0.00 0.00 175.17 178.02 2bry n LYS 488 N -0.21 2.19 0.00 8.23 3.00 -1.26 -4.97 118.16 125.14 2bry n LYS 488 Ca -0.06 -1.74 0.16 0.00 -0.00 0.00 0.00 58.31 56.67 2bry n LYS 488 Cb 0.63 -1.47 0.95 0.00 0.00 0.00 0.00 35.03 35.14 2bry n LYS 488 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79