#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1umg s THR 4 N 0.00 2.05 -0.14 3.15 2.01 0.13 -4.68 115.64 118.17 1umg s THR 4 Ca 0.00 -1.12 -0.01 0.00 0.31 0.00 0.00 61.69 60.87 1umg s THR 4 Cb 0.00 -1.70 -0.02 0.00 0.01 0.00 0.00 72.50 70.79 1umg s THR 4 CO 0.00 0.57 -0.11 -0.89 -0.69 0.00 0.00 174.62 173.49 1umg s THR 5 N -0.62 3.18 -0.28 -0.82 2.01 0.48 -0.09 115.64 119.50 1umg s THR 5 Ca 0.10 -0.61 -0.09 0.00 0.31 0.00 0.00 61.69 61.40 1umg s THR 5 Cb -0.10 -2.35 -0.02 0.00 0.01 0.00 0.00 72.50 70.04 1umg s THR 5 CO -0.01 0.52 0.11 -0.63 -0.69 0.00 0.00 174.62 173.92 1umg s ILE 6 N 0.39 4.50 -0.18 1.82 1.01 -0.65 -1.47 121.20 126.63 1umg s ILE 6 Ca -0.09 -0.27 0.01 0.00 0.00 0.00 0.00 60.65 60.30 1umg s ILE 6 Cb -0.16 -3.20 0.02 0.00 0.01 0.00 0.00 42.46 39.13 1umg s ILE 6 CO 0.05 0.21 -0.20 -0.44 0.00 0.00 0.00 174.94 174.56 1umg s SER 7 N 1.62 3.14 -0.33 3.58 0.01 0.17 -1.96 113.70 119.93 1umg s SER 7 Ca 0.05 -0.64 -0.05 0.00 1.31 0.00 0.00 55.95 56.62 1umg s SER 7 Cb -0.16 -1.48 0.04 0.00 0.21 0.00 0.00 66.02 64.63 1umg s SER 7 CO 0.05 0.01 0.08 -0.69 0.41 0.00 0.00 173.24 173.10 1umg s VAL 8 N 1.25 3.58 -0.13 3.43 1.01 -0.03 -0.22 120.40 129.29 1umg s VAL 8 Ca 0.04 -1.19 0.02 0.00 0.00 0.00 0.00 61.98 60.85 1umg s VAL 8 Cb -0.13 -3.03 0.01 0.00 0.00 0.00 0.00 36.38 33.23 1umg s VAL 8 CO -0.12 -0.16 -0.20 -0.63 0.00 0.00 0.00 175.10 173.99 1umg s ILE 9 N 1.36 1.89 0.15 2.22 1.01 -0.34 -1.50 121.20 126.00 1umg s ILE 9 Ca -0.03 -0.88 0.05 0.00 0.00 0.00 0.00 60.65 59.79 1umg s ILE 9 Cb -0.20 -1.68 -0.04 0.00 0.01 0.00 0.00 42.46 40.55 1umg s ILE 9 CO 0.02 0.52 -0.12 -1.59 0.00 0.00 0.00 174.94 173.77 1umg s LYS 10 N 0.81 1.10 -0.06 2.79 0.00 -0.61 -0.92 119.74 122.84 1umg s LYS 10 Ca -0.08 -1.41 -0.30 0.00 0.00 0.00 0.00 55.97 54.18 1umg s LYS 10 Cb -0.16 -0.80 0.09 0.00 0.00 0.00 0.00 37.83 36.97 1umg s LYS 10 CO -0.01 0.12 0.80 0.00 0.00 0.00 0.00 175.35 176.27 1umg s ALA 11 N -2.91 -1.81 -0.32 0.59 0.00 -0.91 -0.31 121.76 116.07 1umg s ALA 11 Ca 0.15 1.31 -0.18 0.00 0.00 0.00 0.00 51.96 53.25 1umg s ALA 11 Cb -0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 1umg s ALA 11 CO 0.02 -0.41 0.51 0.34 0.00 0.00 0.00 175.76 176.22 1umg s ASP 12 N -1.41 6.34 -0.11 0.00 -1.08 -1.26 -1.53 116.67 117.62 1umg s ASP 12 Ca -0.05 0.14 0.15 0.00 -0.52 0.00 0.00 52.55 52.26 1umg s ASP 12 Cb -0.00 -2.27 0.30 0.00 -1.46 0.00 0.00 42.92 39.49 1umg s ASP 12 CO 0.03 -0.42 1.20 2.30 0.52 0.00 0.00 175.17 178.81 1umg n ILE 13 N 5.35 1.78 0.00 4.11 -6.64 -1.26 -0.43 119.36 122.27 1umg n ILE 13 Ca -0.05 -1.87 0.00 0.00 -1.77 0.00 0.00 62.75 59.06 1umg n ILE 13 Cb 0.49 -0.07 0.00 0.00 -1.44 0.00 0.00 39.64 38.62 1umg n ILE 13 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1umg n GLY 14 N -0.91 3.46 3.29 3.28 0.00 -1.13 -0.76 105.19 112.43 1umg n GLY 14 Ca 0.14 -1.78 -0.10 0.00 0.00 0.00 0.00 46.02 44.28 1umg n GLY 14 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1umg s SER 15 N 0.00 -0.14 0.06 1.61 1.04 -0.01 -4.63 113.70 111.62 1umg s SER 15 Ca 0.00 -0.39 -0.29 0.00 0.48 0.00 0.00 55.95 55.75 1umg s SER 15 Cb 0.00 0.44 -0.05 0.00 0.10 0.00 0.00 66.02 66.51 1umg s SER 15 CO 0.00 -0.81 0.95 -0.22 0.98 0.00 0.00 173.24 174.14 1umg s LEU 16 N -2.78 4.44 -1.77 2.42 2.96 -0.57 -0.96 118.68 122.43 1umg s LEU 16 Ca 0.03 1.70 0.00 0.00 -0.22 0.00 0.00 54.13 55.64 1umg s LEU 16 Cb 0.02 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.17 1umg s LEU 16 CO -0.11 -0.14 0.00 0.00 -1.32 0.00 0.00 176.35 174.78 1umg n ALA 17 N 3.26 -0.25 0.00 5.97 0.00 -1.26 -4.05 120.51 124.17 1umg n ALA 17 Ca 0.03 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1umg n ALA 17 Cb 0.50 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 18.04 1umg n ALA 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1umg n GLY 18 N -0.14 0.78 2.22 0.00 0.00 -1.26 -4.78 105.19 102.01 1umg n GLY 18 Ca -0.17 -1.96 -0.21 0.00 0.00 0.00 0.00 46.02 43.68 1umg n GLY 18 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1umg n HIS 19 N 5.98 1.39 -0.07 1.61 8.25 -1.26 -4.36 115.22 126.75 1umg n HIS 19 Ca 0.00 -1.89 -0.06 0.00 -0.26 0.00 0.00 57.72 55.51 1umg n HIS 19 Cb 0.00 -1.24 -0.02 0.00 1.12 0.00 0.00 29.99 29.85 1umg n HIS 19 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1umg n HIS 20 N 0.86 0.89 -3.62 4.41 -0.00 -1.26 -4.38 115.22 112.13 1umg n HIS 20 Ca 0.41 0.39 -0.16 0.00 -0.00 0.00 0.00 57.72 58.36 1umg n HIS 20 Cb 0.59 -0.78 -0.07 0.00 -0.00 0.00 0.00 29.99 29.73 1umg n HIS 20 CO 0.00 0.00 0.00 -1.50 -0.00 0.00 0.00 176.34 174.84 1umg s ILE 21 N -2.28 0.03 0.10 3.57 2.07 -1.26 -2.23 121.20 121.19 1umg s ILE 21 Ca -0.16 -0.22 -0.30 0.00 -1.41 0.00 0.00 60.65 58.55 1umg s ILE 21 Cb 0.02 -0.85 -0.06 0.00 0.13 0.00 0.00 42.46 41.71 1umg s ILE 21 CO 0.25 -0.12 1.09 -0.69 -1.91 0.00 0.00 174.94 173.57 1umg s VAL 22 N -1.41 4.18 0.09 4.00 1.01 -0.95 -1.51 120.40 125.82 1umg s VAL 22 Ca -0.11 1.70 -0.30 0.00 0.00 0.00 0.00 61.98 63.27 1umg s VAL 22 Cb -0.02 -4.09 -0.05 0.00 0.00 0.00 0.00 36.38 32.22 1umg s VAL 22 CO 0.06 0.21 1.03 -2.28 0.00 0.00 0.00 175.10 174.12 1umg s HIS 23 N 0.43 3.68 0.34 5.22 2.46 -1.26 -4.92 115.29 121.23 1umg s HIS 23 Ca 0.52 1.67 0.12 0.00 0.47 0.00 0.00 55.06 57.84 1umg s HIS 23 Cb -0.27 -3.16 0.96 0.00 -0.13 0.00 0.00 32.58 29.97 1umg s HIS 23 CO 0.31 -0.21 1.73 -1.35 -2.47 0.00 0.00 174.74 172.75 1umg h PRO 24 N 5.94 0.49 -0.42 2.88 0.11 -2.00 -0.93 132.00 138.07 1umg h PRO 24 Ca -0.43 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1umg h PRO 24 Cb 1.21 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1umg h PRO 24 CO 0.74 0.33 0.28 -0.44 -0.21 0.00 0.00 178.00 178.69 1umg h ASP 25 N 0.51 0.49 0.32 -2.05 5.19 -1.99 -1.17 116.42 117.71 1umg h ASP 25 Ca 0.65 -0.01 -0.14 0.00 -0.62 0.00 0.00 57.03 56.91 1umg h ASP 25 Cb 1.36 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 40.73 1umg h ASP 25 CO -0.46 0.36 -0.58 0.71 -3.12 0.00 0.00 179.24 176.15 1umg h THR 26 N 0.57 1.37 -0.03 0.35 1.35 -1.46 -2.40 112.91 112.66 1umg h THR 26 Ca 0.15 -1.91 -0.15 0.00 -0.55 0.00 0.00 66.41 63.95 1umg h THR 26 Cb -0.06 1.94 -0.01 0.00 -1.73 0.00 0.00 68.15 68.29 1umg h THR 26 CO -0.03 0.57 -0.66 0.24 -0.25 0.00 0.00 175.52 175.38 1umg h MET 27 N 0.20 0.14 -0.70 4.72 2.86 -1.31 -2.37 114.93 118.47 1umg h MET 27 Ca -0.00 -0.11 -0.06 0.00 -2.06 0.00 0.00 59.70 57.47 1umg h MET 27 Cb 1.07 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.72 1umg h MET 27 CO 0.09 0.76 0.21 0.00 1.06 0.00 0.00 176.91 179.03 1umg h ALA 28 N 1.21 1.06 -0.55 6.32 0.00 -0.99 0.76 119.26 127.07 1umg h ALA 28 Ca -0.01 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1umg h ALA 28 Cb 1.19 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1umg h ALA 28 CO 0.10 0.64 0.05 0.00 0.00 0.00 0.00 179.25 180.04 1umg h ALA 29 N 1.19 0.74 -0.25 0.00 0.00 -1.26 -2.33 119.26 117.36 1umg h ALA 29 Ca 0.23 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1umg h ALA 29 Cb 0.30 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1umg h ALA 29 CO -0.01 0.52 -0.13 0.00 0.00 0.00 0.00 179.25 179.63 1umg h ALA 30 N 0.98 1.33 -0.54 0.00 0.00 -0.89 -2.86 119.26 117.28 1umg h ALA 30 Ca 0.16 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 1umg h ALA 30 Cb 0.47 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1umg h ALA 30 CO 0.02 0.45 0.02 -0.97 0.00 0.00 0.00 179.25 178.77 1umg h ASN 31 N 0.38 0.91 -0.86 0.00 -0.73 -0.43 -2.26 115.58 112.59 1umg h ASN 31 Ca 0.07 -0.30 0.05 0.00 1.87 0.00 0.00 56.30 58.00 1umg h ASN 31 Cb 0.46 -0.25 -0.06 0.00 0.27 0.00 0.00 38.32 38.74 1umg h ASN 31 CO 0.03 0.99 0.54 0.11 -0.37 0.00 0.00 177.43 178.73 1umg h LYS 32 N 0.81 0.99 -0.30 6.67 1.57 -1.20 0.25 116.57 125.35 1umg h LYS 32 Ca 0.15 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.84 1umg h LYS 32 Cb 0.51 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1umg h LYS 32 CO 0.02 0.65 0.04 0.28 -0.57 0.00 0.00 179.45 179.87 1umg h VAL 33 N 1.02 1.24 0.00 0.50 2.07 -1.43 -2.23 116.25 117.42 1umg h VAL 33 Ca 0.37 -0.84 -0.13 0.00 0.82 0.00 0.00 66.70 66.91 1umg h VAL 33 Cb 0.11 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 1umg h VAL 33 CO -0.15 0.27 -0.63 -0.07 0.02 0.00 0.00 177.57 177.01 1umg h LEU 34 N 0.32 0.00 -0.87 2.57 3.38 -1.06 -1.58 115.31 118.07 1umg h LEU 34 Ca 0.09 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 1umg h LEU 34 Cb 0.37 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1umg h LEU 34 CO 0.01 0.63 0.22 0.00 0.09 0.00 0.00 178.44 179.38 1umg h ALA 35 N 1.37 1.09 -0.21 1.53 0.00 -0.40 0.32 119.26 122.95 1umg h ALA 35 Ca -0.01 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 1umg h ALA 35 Cb 1.12 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 1umg h ALA 35 CO 0.08 0.62 -0.22 1.03 0.00 0.00 0.00 179.25 180.76 1umg h SER 36 N 1.01 0.56 -0.80 0.00 0.87 -1.18 -1.66 113.55 112.36 1umg h SER 36 Ca 0.22 -0.48 0.02 0.00 -1.23 0.00 0.00 61.79 60.33 1umg h SER 36 Cb 0.28 -0.16 -0.04 0.00 -0.44 0.00 0.00 62.40 62.04 1umg h SER 36 CO -0.01 0.93 0.53 0.00 -0.53 0.00 0.00 176.83 177.75 1umg h ALA 37 N 0.65 1.48 -0.35 6.23 0.00 -0.95 0.16 119.26 126.48 1umg h ALA 37 Ca 0.03 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1umg h ALA 37 Cb 0.77 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1umg h ALA 37 CO 0.05 0.46 -0.20 -0.22 0.00 0.00 0.00 179.25 179.34 1umg h LYS 38 N 1.03 0.75 -0.63 0.00 3.64 -0.84 0.90 116.57 121.42 1umg h LYS 38 Ca 0.31 -0.34 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1umg h LYS 38 Cb -0.03 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 1umg h LYS 38 CO -0.08 0.96 0.24 1.49 -2.27 0.00 0.00 179.45 179.79 1umg h GLU 39 N 0.53 0.93 0.00 1.90 4.81 -0.49 -1.61 114.58 120.65 1umg h GLU 39 Ca 0.07 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1umg h GLU 39 Cb 0.75 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.98 1umg h GLU 39 CO 0.06 0.77 0.00 1.04 -0.73 0.00 0.00 179.01 180.15 1umg n GLN 40 N -4.30 0.27 -0.85 1.92 6.02 0.47 -4.90 117.38 116.01 1umg n GLN 40 Ca 0.05 0.04 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 1umg n GLN 40 Cb 0.18 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.94 1umg n GLN 40 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1umg n GLY 41 N 1.06 0.67 0.20 1.08 0.00 -0.61 -4.93 105.19 102.67 1umg n GLY 41 Ca 0.11 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.02 1umg n GLY 41 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1umg h ILE 42 N 0.00 1.26 -3.07 -0.61 2.04 -1.07 -3.44 117.51 112.61 1umg h ILE 42 Ca 0.00 -0.96 -0.55 0.00 1.00 0.00 0.00 64.86 64.35 1umg h ILE 42 Cb 0.00 1.17 -0.17 0.00 -0.74 0.00 0.00 36.82 37.08 1umg h ILE 42 CO 0.00 0.32 -0.78 0.27 0.00 0.00 0.00 178.15 177.96 1umg s ILE 43 N -5.02 1.99 -0.06 -0.67 -4.36 -1.18 -4.70 121.20 107.20 1umg s ILE 43 Ca -0.13 -2.05 0.12 0.00 -0.26 0.00 0.00 60.65 58.33 1umg s ILE 43 Cb 0.09 -1.98 -0.23 0.00 1.25 0.00 0.00 42.46 41.58 1umg s ILE 43 CO 0.78 -0.33 0.59 0.18 0.24 0.00 0.00 174.94 176.40 1umg n LEU 44 N 0.07 0.90 -3.72 0.37 4.77 0.35 -4.28 117.00 115.46 1umg n LEU 44 Ca -0.11 0.37 -0.05 0.00 -0.03 0.00 0.00 56.01 56.18 1umg n LEU 44 Cb 0.58 0.13 -0.02 0.00 -2.33 0.00 0.00 43.42 41.78 1umg n LEU 44 CO 0.31 0.42 0.64 -0.62 -1.33 0.00 0.00 177.39 176.82 1umg s ASP 45 N -6.09 -0.25 0.07 -1.43 2.15 -1.09 -4.85 116.67 105.19 1umg s ASP 45 Ca -0.06 -0.36 -0.26 0.00 0.43 0.00 0.00 52.55 52.30 1umg s ASP 45 Cb 0.08 0.53 0.08 0.00 -0.30 0.00 0.00 42.92 43.31 1umg s ASP 45 CO 0.82 -0.96 0.84 -0.72 -0.17 0.00 0.00 175.17 174.99 1umg s TYR 46 N -3.42 -0.33 -0.08 -5.34 -0.85 -1.26 -1.46 117.35 104.60 1umg s TYR 46 Ca 0.10 0.13 -0.04 0.00 -0.52 0.00 0.00 57.07 56.74 1umg s TYR 46 Cb -0.02 0.57 0.04 0.00 0.38 0.00 0.00 41.96 42.93 1umg s TYR 46 CO 0.01 -0.70 0.19 -0.47 -1.52 0.00 0.00 175.55 173.06 1umg s TYR 47 N -3.32 -0.24 -0.09 -3.49 5.04 0.52 -4.99 117.35 110.78 1umg s TYR 47 Ca 0.06 0.62 0.02 0.00 -2.44 0.00 0.00 57.07 55.33 1umg s TYR 47 Cb -0.01 -0.04 -0.02 0.00 0.35 0.00 0.00 41.96 42.24 1umg s TYR 47 CO -0.07 -0.20 -0.14 0.42 -1.34 0.00 0.00 175.55 174.22 1umg s ILE 48 N 1.27 3.00 0.00 3.14 1.01 -1.26 -0.92 121.20 127.44 1umg s ILE 48 Ca -0.09 -0.71 0.00 0.00 0.00 0.00 0.00 60.65 59.85 1umg s ILE 48 Cb -0.11 -2.21 0.00 0.00 0.01 0.00 0.00 42.46 40.15 1umg s ILE 48 CO -0.07 0.56 0.00 1.07 0.00 0.00 0.00 174.94 176.50 1umg n THR 49 N 2.94 0.00 -3.81 2.92 5.66 -0.85 -5.00 114.28 116.14 1umg n THR 49 Ca -0.18 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.73 1umg n THR 49 Cb 0.52 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.26 1umg n THR 49 CO 0.00 0.00 0.00 -1.38 -3.05 0.00 0.00 175.07 170.64 1umg s HIS 50 N -3.12 -0.00 -0.16 1.09 -3.43 -1.26 -0.13 115.29 108.27 1umg s HIS 50 Ca 0.00 -0.35 -0.04 0.00 -0.80 0.00 0.00 55.06 53.87 1umg s HIS 50 Cb 0.00 0.34 0.08 0.00 -1.43 0.00 0.00 32.58 31.57 1umg s HIS 50 CO 0.00 -0.93 0.25 0.54 -2.00 0.00 0.00 174.74 172.60 1umg s VAL 51 N -3.91 -0.38 0.00 -5.38 0.11 -0.88 -4.94 120.40 105.02 1umg s VAL 51 Ca 0.12 0.10 0.00 0.00 -2.93 0.00 0.00 61.98 59.27 1umg s VAL 51 Cb -0.01 -0.55 0.00 0.00 -1.53 0.00 0.00 36.38 34.29 1umg s VAL 51 CO -0.00 -0.03 0.00 0.61 -3.33 0.00 0.00 175.10 172.35 1umg n GLY 52 N 5.34 2.97 1.58 6.54 0.00 0.27 -1.73 105.19 120.16 1umg n GLY 52 Ca -0.05 -0.30 -0.00 0.00 0.00 0.00 0.00 46.02 45.66 1umg n GLY 52 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1umg n ASP 53 N 3.20 4.17 -4.28 1.61 5.68 -1.26 -2.23 116.55 123.45 1umg n ASP 53 Ca 0.00 -2.77 -0.35 0.00 -0.50 0.00 0.00 54.79 51.16 1umg n ASP 53 Cb 0.00 -0.66 -0.14 0.00 -1.14 0.00 0.00 41.12 39.18 1umg n ASP 53 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 1umg s ASP 54 N -0.56 4.47 -0.11 -1.12 1.01 -0.71 -4.34 116.67 115.32 1umg s ASP 54 Ca 0.39 -0.63 -0.30 0.00 0.71 0.00 0.00 52.55 52.73 1umg s ASP 54 Cb 0.31 -1.74 -0.01 0.00 1.01 0.00 0.00 42.92 42.48 1umg s ASP 54 CO 0.10 -0.09 1.01 -0.22 0.21 0.00 0.00 175.17 176.18 1umg s LEU 55 N 1.43 4.25 -0.18 1.23 0.20 -0.58 -2.06 118.68 122.96 1umg s LEU 55 Ca 0.03 1.53 -0.07 0.00 0.69 0.00 0.00 54.13 56.31 1umg s LEU 55 Cb -0.16 -3.56 -0.04 0.00 -0.43 0.00 0.00 46.19 42.01 1umg s LEU 55 CO -0.03 -0.45 0.06 -1.10 -0.29 0.00 0.00 176.35 174.54 1umg s GLN 56 N 2.02 3.96 -0.33 1.98 -1.52 0.82 -2.15 119.66 124.44 1umg s GLN 56 Ca 0.48 -0.35 0.02 0.00 -1.95 0.00 0.00 55.36 53.55 1umg s GLN 56 Cb -0.18 -3.20 0.08 0.00 -0.22 0.00 0.00 33.01 29.49 1umg s GLN 56 CO 0.18 0.26 0.03 -0.51 -0.25 0.00 0.00 175.29 175.00 1umg s LEU 57 N 0.40 4.37 -0.33 2.90 1.43 -0.10 -2.00 118.68 125.35 1umg s LEU 57 Ca 0.03 -1.79 -0.14 0.00 -1.03 0.00 0.00 54.13 51.20 1umg s LEU 57 Cb -0.12 -1.66 -0.02 0.00 0.03 0.00 0.00 46.19 44.42 1umg s LEU 57 CO 0.00 -0.34 0.28 -0.63 0.23 0.00 0.00 176.35 175.90 1umg s ILE 58 N 1.05 5.24 0.03 -0.59 1.01 -0.09 -1.19 121.20 126.66 1umg s ILE 58 Ca 0.03 -0.04 0.04 0.00 0.00 0.00 0.00 60.65 60.68 1umg s ILE 58 Cb -0.20 -3.73 -0.02 0.00 0.01 0.00 0.00 42.46 38.52 1umg s ILE 58 CO -0.05 -0.00 -0.13 -0.04 0.00 0.00 0.00 174.94 174.71 1umg s MET 59 N 1.85 0.91 -0.02 2.79 -1.94 0.70 -0.35 119.30 123.23 1umg s MET 59 Ca 0.09 -0.68 0.07 0.00 -1.71 0.00 0.00 55.69 53.46 1umg s MET 59 Cb -0.17 -0.89 -0.02 0.00 2.01 0.00 0.00 34.83 35.76 1umg s MET 59 CO 0.11 0.22 -0.24 0.95 -0.01 0.00 0.00 175.02 176.05 1umg s THR 60 N -0.75 2.20 0.12 2.05 -4.23 -0.54 0.42 115.64 114.92 1umg s THR 60 Ca 0.02 -1.07 -0.06 0.00 -1.18 0.00 0.00 61.69 59.39 1umg s THR 60 Cb -0.07 -1.78 0.02 0.00 1.34 0.00 0.00 72.50 72.02 1umg s THR 60 CO 0.01 0.57 0.33 0.00 -0.54 0.00 0.00 174.62 174.98 1umg n HIS 61 N 2.38 -1.32 -2.03 3.99 1.44 -0.54 -0.49 115.22 118.65 1umg n HIS 61 Ca -0.16 -0.63 -0.02 0.00 -2.01 0.00 0.00 57.72 54.90 1umg n HIS 61 Cb 0.51 0.31 0.11 0.00 0.12 0.00 0.00 29.99 31.05 1umg n HIS 61 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1umg n THR 62 N -0.22 1.69 -0.45 0.61 -2.24 -1.26 -0.39 114.28 112.02 1umg n THR 62 Ca -0.03 -2.94 0.08 0.00 -2.27 0.00 0.00 64.05 58.90 1umg n THR 62 Cb 0.22 0.00 0.25 0.00 -2.10 0.00 0.00 70.33 68.70 1umg n THR 62 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1umg n ARG 63 N -0.62 3.06 -0.86 -0.78 1.74 -1.26 -4.97 116.66 112.98 1umg n ARG 63 Ca 0.20 -2.48 0.12 0.00 -0.77 0.00 0.00 57.85 54.92 1umg n ARG 63 Cb 0.87 -1.56 -0.03 0.00 -1.02 0.00 0.00 32.46 30.72 1umg n ARG 63 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1umg n GLY 64 N 0.68 -1.67 3.81 -0.13 0.00 -1.26 -4.58 105.19 102.03 1umg n GLY 64 Ca 0.19 -1.31 -0.33 0.00 0.00 0.00 0.00 46.02 44.56 1umg n GLY 64 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1umg s GLU 65 N -1.78 3.80 -1.41 1.61 2.02 -1.26 -3.96 118.70 117.72 1umg s GLU 65 Ca 0.00 1.25 -0.03 0.00 0.02 0.00 0.00 54.97 56.21 1umg s GLU 65 Cb 0.00 -2.10 0.02 0.00 0.10 0.00 0.00 34.13 32.15 1umg s GLU 65 CO 0.00 -0.42 0.57 1.28 0.02 0.00 0.00 175.26 176.71 1umg n LEU 66 N -1.17 -2.47 -4.72 1.80 4.77 -1.26 -4.93 117.00 109.02 1umg n LEU 66 Ca 0.09 -0.93 -0.39 0.00 -0.03 0.00 0.00 56.01 54.74 1umg n LEU 66 Cb 0.53 -2.37 -0.05 0.00 -2.33 0.00 0.00 43.42 39.20 1umg n LEU 66 CO 0.41 0.42 0.34 -0.62 -1.33 0.00 0.00 177.39 176.61 1umg s ASP 67 N -4.20 6.91 0.19 -1.43 2.15 -1.25 -4.98 116.67 114.06 1umg s ASP 67 Ca 0.12 1.09 -0.12 0.00 0.43 0.00 0.00 52.55 54.07 1umg s ASP 67 Cb -0.06 -2.38 0.13 0.00 -0.30 0.00 0.00 42.92 40.31 1umg s ASP 67 CO 0.86 -0.09 1.83 0.74 -0.17 0.00 0.00 175.17 178.34 1umg h THR 68 N 4.75 1.07 -0.45 1.71 2.02 -1.93 -1.50 112.91 118.60 1umg h THR 68 Ca -0.41 -0.24 -0.14 0.00 0.77 0.00 0.00 66.41 66.39 1umg h THR 68 Cb 1.19 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.90 1umg h THR 68 CO 0.75 0.13 -0.27 0.50 0.37 0.00 0.00 175.52 177.00 1umg h LYS 69 N 0.70 0.97 -0.24 6.66 3.64 -1.98 0.11 116.57 126.43 1umg h LYS 69 Ca 0.23 -0.44 -0.03 0.00 -1.27 0.00 0.00 60.65 59.14 1umg h LYS 69 Cb 0.02 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1umg h LYS 69 CO -0.10 1.11 0.03 0.28 -2.27 0.00 0.00 179.45 178.50 1umg h VAL 70 N 0.82 1.24 -0.44 2.00 2.07 -1.90 0.09 116.25 120.13 1umg h VAL 70 Ca 0.09 -0.82 -0.08 0.00 0.82 0.00 0.00 66.70 66.72 1umg h VAL 70 Cb 0.86 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.91 1umg h VAL 70 CO 0.08 0.26 -0.05 0.45 0.02 0.00 0.00 177.57 178.33 1umg h HIS 71 N 0.20 0.79 -0.27 1.57 3.86 -1.21 -0.74 115.15 119.35 1umg h HIS 71 Ca 0.07 -0.12 -0.11 0.00 -1.16 0.00 0.00 60.37 59.05 1umg h HIS 71 Cb 0.36 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.60 1umg h HIS 71 CO 0.03 0.76 -0.29 1.49 0.86 0.00 0.00 177.93 180.78 1umg h GLU 72 N 0.68 0.55 -0.41 2.45 4.81 -0.61 0.97 114.58 123.03 1umg h GLU 72 Ca 0.13 -0.23 -0.04 0.00 -0.13 0.00 0.00 59.36 59.09 1umg h GLU 72 Cb 0.49 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 1umg h GLU 72 CO 0.03 0.79 0.10 1.15 -0.73 0.00 0.00 179.01 180.34 1umg h THR 73 N 0.48 1.23 -0.41 0.32 2.02 -0.44 -0.53 112.91 115.59 1umg h THR 73 Ca 0.06 -0.80 -0.01 0.00 0.77 0.00 0.00 66.41 66.44 1umg h THR 73 Cb 0.75 0.96 -0.02 0.00 -1.74 0.00 0.00 68.15 68.10 1umg h THR 73 CO 0.06 0.28 0.22 0.00 0.37 0.00 0.00 175.52 176.45 1umg h ALA 74 N 0.95 0.52 -0.73 6.16 0.00 -0.74 -1.10 119.26 124.33 1umg h ALA 74 Ca 0.13 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.98 1umg h ALA 74 Cb 0.32 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1umg h ALA 74 CO 0.00 0.05 0.46 2.35 0.00 0.00 0.00 179.25 182.11 1umg h TRP 75 N 0.52 0.87 -0.35 0.00 2.91 -0.53 -0.67 115.95 118.70 1umg h TRP 75 Ca 0.14 0.02 -0.08 0.00 1.13 0.00 0.00 58.89 60.10 1umg h TRP 75 Cb 0.07 -0.29 -0.02 0.00 -0.51 0.00 0.00 29.16 28.41 1umg h TRP 75 CO -0.02 0.50 -0.12 -0.91 -1.03 0.00 0.00 178.44 176.86 1umg h ASN 76 N 0.91 0.59 -0.39 2.65 2.35 -0.75 0.63 115.58 121.57 1umg h ASN 76 Ca 0.29 -0.16 -0.02 0.00 -0.55 0.00 0.00 56.30 55.86 1umg h ASN 76 Cb 0.00 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 1umg h ASN 76 CO -0.10 0.75 0.18 0.00 -1.65 0.00 0.00 177.43 176.60 1umg h ALA 77 N 1.31 0.50 -0.52 -0.83 0.00 -0.36 -0.94 119.26 118.43 1umg h ALA 77 Ca 0.10 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 1umg h ALA 77 Cb 0.54 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1umg h ALA 77 CO 0.03 0.07 -0.06 0.74 0.00 0.00 0.00 179.25 180.03 1umg h PHE 78 N 0.48 1.01 -0.44 0.00 0.04 -0.79 -1.72 116.94 115.53 1umg h PHE 78 Ca 0.13 -0.18 -0.01 0.00 2.80 0.00 0.00 57.97 60.71 1umg h PHE 78 Cb 0.14 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.00 1umg h PHE 78 CO -0.01 0.94 0.24 0.87 -0.60 0.00 0.00 178.31 179.75 1umg h LYS 79 N 0.84 0.61 -0.37 1.51 1.79 -0.55 0.35 116.57 120.74 1umg h LYS 79 Ca 0.14 -0.07 -0.08 0.00 -2.18 0.00 0.00 60.65 58.47 1umg h LYS 79 Cb 0.58 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 31.10 1umg h LYS 79 CO 0.04 0.48 -0.10 0.93 -1.08 0.00 0.00 179.45 179.71 1umg h GLU 80 N 0.57 0.64 -0.41 3.15 4.39 -1.05 -0.76 114.58 121.10 1umg h GLU 80 Ca 0.15 -0.19 -0.13 0.00 0.34 0.00 0.00 59.36 59.53 1umg h GLU 80 Cb 0.04 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 1umg h GLU 80 CO -0.03 0.73 -0.27 0.00 -1.16 0.00 0.00 179.01 178.29 1umg h ALA 81 N 1.31 0.58 -0.38 3.43 0.00 -0.81 -2.76 119.26 120.63 1umg h ALA 81 Ca 0.11 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1umg h ALA 81 Cb 0.52 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1umg h ALA 81 CO 0.03 0.60 0.00 0.00 0.00 0.00 0.00 179.25 179.88 1umg h ALA 82 N 0.80 1.29 -0.61 0.00 0.00 0.08 -0.43 119.26 120.39 1umg h ALA 82 Ca 0.08 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1umg h ALA 82 Cb 0.85 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1umg h ALA 82 CO 0.07 0.48 0.05 0.87 0.00 0.00 0.00 179.25 180.72 1umg h LYS 83 N 0.58 1.04 -0.40 0.00 1.57 -1.00 0.81 116.57 119.16 1umg h LYS 83 Ca 0.12 -0.30 -0.11 0.00 -1.87 0.00 0.00 60.65 58.49 1umg h LYS 83 Cb 0.36 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 1umg h LYS 83 CO 0.01 0.99 -0.18 0.28 -0.57 0.00 0.00 179.45 179.98 1umg h VAL 84 N 0.96 1.28 -0.81 0.50 2.07 -1.17 -1.31 116.25 117.77 1umg h VAL 84 Ca 0.18 -1.32 0.04 0.00 0.82 0.00 0.00 66.70 66.42 1umg h VAL 84 Cb 0.49 1.28 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 1umg h VAL 84 CO 0.02 0.44 0.51 0.00 0.02 0.00 0.00 177.57 178.57 1umg h ALA 85 N 0.82 1.08 -0.31 1.67 0.00 -0.69 0.15 119.26 121.97 1umg h ALA 85 Ca 0.09 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1umg h ALA 85 Cb 0.74 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1umg h ALA 85 CO 0.06 0.31 0.06 -0.22 0.00 0.00 0.00 179.25 179.46 1umg h LYS 86 N 0.99 0.52 0.00 0.00 1.63 -0.62 0.55 116.57 119.64 1umg h LYS 86 Ca 0.33 -0.14 -0.04 0.00 -0.85 0.00 0.00 60.65 59.95 1umg h LYS 86 Cb 0.05 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.61 1umg h LYS 86 CO -0.13 0.61 -0.20 -0.44 -3.45 0.00 0.00 179.45 175.84 1umg h ASP 87 N 0.34 0.00 0.19 4.20 3.32 -0.74 -0.78 116.42 122.95 1umg h ASP 87 Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1umg h ASP 87 Cb 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 1umg h ASP 87 CO 0.01 0.20 -0.11 0.18 -1.72 0.00 0.00 179.24 177.79 1umg n LEU 88 N -4.13 0.88 -1.55 1.55 4.77 -0.00 -4.93 117.00 113.59 1umg n LEU 88 Ca -0.02 -0.22 -0.15 0.00 -0.03 0.00 0.00 56.01 55.59 1umg n LEU 88 Cb 0.27 -0.10 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 1umg n LEU 88 CO 0.35 0.16 -0.18 0.61 -1.33 0.00 0.00 177.39 177.00 1umg n GLY 89 N 1.24 0.37 3.72 -0.72 0.00 -0.30 -4.97 105.19 104.53 1umg n GLY 89 Ca 0.16 -0.26 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 1umg n GLY 89 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1umg s LEU 90 N -4.10 3.05 0.37 0.99 1.43 0.08 -4.97 118.68 115.53 1umg s LEU 90 Ca 0.00 2.13 -0.25 0.00 -1.03 0.00 0.00 54.13 54.98 1umg s LEU 90 Cb 0.00 -4.56 -0.09 0.00 0.03 0.00 0.00 46.19 41.57 1umg s LEU 90 CO 0.00 -2.52 1.05 -0.47 0.23 0.00 0.00 176.35 174.64 1umg s TYR 91 N -2.52 3.36 -1.45 0.29 5.04 -0.13 -3.55 117.35 118.40 1umg s TYR 91 Ca 0.67 1.67 -0.07 0.00 -2.44 0.00 0.00 57.07 56.90 1umg s TYR 91 Cb -0.23 -3.14 0.03 0.00 0.35 0.00 0.00 41.96 38.97 1umg s TYR 91 CO 0.53 -0.55 0.61 0.00 -1.34 0.00 0.00 175.55 174.81 1umg n ALA 92 N 0.23 -1.04 -1.67 3.97 0.00 -0.92 -0.83 120.51 120.24 1umg n ALA 92 Ca 0.04 0.22 -0.48 0.00 0.00 0.00 0.00 53.44 53.21 1umg n ALA 92 Cb 0.49 -3.62 -0.05 0.00 0.00 0.00 0.00 19.45 16.27 1umg n ALA 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1umg n ALA 93 N -3.68 0.90 -1.21 0.00 0.00 -1.23 -0.28 120.51 115.01 1umg n ALA 93 Ca -0.06 0.38 -0.07 0.00 0.00 0.00 0.00 53.44 53.68 1umg n ALA 93 Cb 0.58 -2.39 -0.03 0.00 0.00 0.00 0.00 19.45 17.62 1umg n ALA 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1umg n GLY 94 N 3.80 0.92 0.32 0.00 0.00 0.06 -4.47 105.19 105.83 1umg n GLY 94 Ca 0.20 -0.46 -0.08 0.00 0.00 0.00 0.00 46.02 45.68 1umg n GLY 94 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1umg n GLN 95 N -2.36 -0.33 0.00 1.61 7.27 0.62 -0.44 117.38 123.75 1umg n GLN 95 Ca -0.07 1.16 0.14 0.00 0.07 0.00 0.00 57.00 58.30 1umg n GLN 95 Cb 0.29 -1.71 0.67 0.00 2.41 0.00 0.00 30.24 31.91 1umg n GLN 95 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1umg n ASP 96 N -4.90 0.00 -0.10 1.69 8.00 0.43 -1.14 116.55 120.52 1umg n ASP 96 Ca 0.02 0.15 -0.12 0.00 0.71 0.00 0.00 54.79 55.55 1umg n ASP 96 Cb 0.20 -0.38 -0.15 0.00 -0.02 0.00 0.00 41.12 40.77 1umg n ASP 96 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1umg n LEU 97 N -1.38 0.82 -4.28 0.64 4.77 0.42 -0.76 117.00 117.23 1umg n LEU 97 Ca 0.11 -0.02 -0.33 0.00 -0.03 0.00 0.00 56.01 55.73 1umg n LEU 97 Cb 0.27 0.11 -0.15 0.00 -2.33 0.00 0.00 43.42 41.32 1umg n LEU 97 CO 0.24 0.61 -0.48 -0.76 -1.33 0.00 0.00 177.39 175.67 1umg s LEU 98 N -5.79 2.47 0.51 2.23 1.43 0.17 -4.70 118.68 115.01 1umg s LEU 98 Ca -0.16 -0.46 0.34 0.00 -1.03 0.00 0.00 54.13 52.82 1umg s LEU 98 Cb 0.07 -1.55 1.56 0.00 0.03 0.00 0.00 46.19 46.29 1umg s LEU 98 CO 0.77 0.11 2.01 0.77 0.23 0.00 0.00 176.35 180.24 1umg h SER 99 N 7.12 0.00 -0.23 2.29 4.64 -1.83 -2.67 113.55 122.86 1umg h SER 99 Ca -0.30 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.97 1umg h SER 99 Cb 1.20 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.26 1umg h SER 99 CO 0.55 0.00 -0.03 -0.90 -0.87 0.00 0.00 176.83 175.58 1umg n ASP 100 N -2.87 3.20 -4.70 4.97 5.75 -1.26 -4.72 116.55 116.93 1umg n ASP 100 Ca -0.00 -3.25 -0.31 0.00 -0.01 0.00 0.00 54.79 51.22 1umg n ASP 100 Cb 0.21 -0.55 0.14 0.00 -1.03 0.00 0.00 41.12 39.89 1umg n ASP 100 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1umg s SER 101 N -2.29 3.42 -1.12 -1.12 1.04 -1.02 -4.88 113.70 107.73 1umg s SER 101 Ca 0.41 2.01 -0.21 0.00 0.48 0.00 0.00 55.95 58.64 1umg s SER 101 Cb 0.35 -2.53 0.05 0.00 0.10 0.00 0.00 66.02 64.00 1umg s SER 101 CO 0.05 -2.76 1.57 0.12 0.98 0.00 0.00 173.24 173.20 1umg s PHE 102 N -2.74 2.60 0.07 5.02 5.36 -1.26 -4.88 117.98 122.15 1umg s PHE 102 Ca 0.65 -1.08 -0.27 0.00 -0.96 0.00 0.00 56.93 55.27 1umg s PHE 102 Cb -0.21 -4.70 0.09 0.00 -0.34 0.00 0.00 43.02 37.86 1umg s PHE 102 CO 0.57 -1.88 0.87 -1.54 -1.46 0.00 0.00 175.22 171.78 1umg s SER 103 N 4.79 -0.34 0.00 6.13 1.04 -1.26 -2.17 113.70 121.89 1umg s SER 103 Ca 0.50 -0.13 0.24 0.00 0.48 0.00 0.00 55.95 57.03 1umg s SER 103 Cb 0.01 0.45 0.16 0.00 0.10 0.00 0.00 66.02 66.74 1umg s SER 103 CO -0.03 -0.76 1.22 0.61 0.98 0.00 0.00 173.24 175.25 1umg n GLY 104 N -0.33 0.49 2.04 7.32 0.00 -1.26 -4.98 105.19 108.47 1umg n GLY 104 Ca -0.09 -0.65 -0.12 0.00 0.00 0.00 0.00 46.02 45.16 1umg n GLY 104 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1umg n ASN 105 N 0.65 0.80 -4.63 1.61 6.94 -1.26 -5.01 115.26 114.36 1umg n ASN 105 Ca 0.12 -1.65 -0.43 0.00 -0.02 0.00 0.00 54.58 52.61 1umg n ASN 105 Cb 0.53 -0.31 -0.03 0.00 -2.36 0.00 0.00 39.78 37.61 1umg n ASN 105 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1umg s VAL 106 N -1.35 3.59 0.36 3.53 1.01 -1.26 -4.99 120.40 121.29 1umg s VAL 106 Ca 0.34 0.67 0.08 0.00 0.00 0.00 0.00 61.98 63.07 1umg s VAL 106 Cb -0.02 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 1umg s VAL 106 CO 0.22 -0.22 0.21 -0.13 0.00 0.00 0.00 175.10 175.18 1umg s ARG 107 N 4.68 2.43 -2.13 2.72 0.52 -1.26 -4.77 118.95 121.14 1umg s ARG 107 Ca 0.75 -1.55 0.00 0.00 -0.52 0.00 0.00 55.73 54.41 1umg s ARG 107 Cb -0.28 -2.22 0.00 0.00 0.52 0.00 0.00 34.95 32.97 1umg s ARG 107 CO 0.30 0.03 0.00 0.41 0.02 0.00 0.00 175.30 176.06 1umg n GLY 108 N -1.26 1.70 0.15 -3.53 0.00 -0.29 -4.56 105.19 97.41 1umg n GLY 108 Ca -0.02 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.11 1umg n GLY 108 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1umg h LEU 109 N 0.00 0.00 0.00 0.99 3.38 -1.83 -3.44 115.31 114.42 1umg h LEU 109 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1umg h LEU 109 Cb 1.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.09 1umg h LEU 109 CO 0.61 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.75 1umg n GLY 110 N 1.10 1.02 3.77 0.83 0.00 0.06 -5.00 105.19 106.97 1umg n GLY 110 Ca 0.05 -1.99 -0.35 0.00 0.00 0.00 0.00 46.02 43.72 1umg n GLY 110 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1umg s PRO 111 N -1.85 3.20 0.16 1.61 0.02 -1.26 -4.93 135.00 131.95 1umg s PRO 111 Ca 0.00 1.70 -0.10 0.00 0.02 0.00 0.00 61.00 62.62 1umg s PRO 111 Cb 0.00 -1.97 -0.06 0.00 0.02 0.00 0.00 34.50 32.48 1umg s PRO 111 CO 0.00 -0.99 0.47 0.20 -0.33 0.00 0.00 177.00 176.35 1umg s GLY 112 N -1.70 2.32 0.00 0.52 0.00 0.57 -4.92 107.32 104.11 1umg s GLY 112 Ca 0.75 -0.33 0.00 0.00 0.00 0.00 0.00 44.72 45.13 1umg s GLY 112 CO 0.29 -0.16 -0.01 0.14 0.00 0.00 0.00 173.10 173.37 1umg s VAL 113 N -1.61 0.03 -0.13 1.40 1.01 -1.26 -1.58 120.40 118.27 1umg s VAL 113 Ca 0.40 -0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.21 1umg s VAL 113 Cb -0.13 -0.07 0.04 0.00 0.00 0.00 0.00 36.38 36.23 1umg s VAL 113 CO 0.21 -0.08 -0.00 0.00 0.00 0.00 0.00 175.10 175.23 1umg s ALA 114 N -0.25 0.96 0.01 5.51 0.00 -0.56 -3.92 121.76 123.52 1umg s ALA 114 Ca -0.03 -0.44 0.01 0.00 0.00 0.00 0.00 51.96 51.51 1umg s ALA 114 Cb -0.02 -0.95 -0.01 0.00 0.00 0.00 0.00 23.12 22.15 1umg s ALA 114 CO -0.00 -0.72 -0.04 -1.21 0.00 0.00 0.00 175.76 173.79 1umg s GLU 115 N 1.87 0.30 -0.10 0.00 2.02 -1.26 -0.85 118.70 120.68 1umg s GLU 115 Ca 0.03 -0.33 -0.04 0.00 0.02 0.00 0.00 54.97 54.64 1umg s GLU 115 Cb -0.14 -0.16 0.05 0.00 0.10 0.00 0.00 34.13 33.98 1umg s GLU 115 CO -0.07 0.03 0.20 0.00 0.02 0.00 0.00 175.26 175.45 1umg s MET 116 N -0.65 0.09 -0.22 1.61 0.23 -0.83 -4.93 119.30 114.60 1umg s MET 116 Ca -0.05 0.62 -0.15 0.00 -1.03 0.00 0.00 55.69 55.08 1umg s MET 116 Cb -0.05 -0.17 -0.04 0.00 -1.53 0.00 0.00 34.83 33.04 1umg s MET 116 CO -0.00 -0.28 0.38 -2.00 -2.03 0.00 0.00 175.02 171.08 1umg s GLU 117 N 2.22 4.13 0.27 3.16 2.12 -1.26 -1.63 118.70 127.71 1umg s GLU 117 Ca 0.01 0.14 0.03 0.00 0.36 0.00 0.00 54.97 55.51 1umg s GLU 117 Cb -0.12 -3.56 -0.04 0.00 0.26 0.00 0.00 34.13 30.67 1umg s GLU 117 CO -0.07 -0.09 0.18 0.96 -0.54 0.00 0.00 175.26 175.71 1umg s ILE 118 N 1.47 0.08 -0.34 -3.70 -4.36 0.87 -4.97 121.20 110.25 1umg s ILE 118 Ca 0.17 -2.00 -0.07 0.00 -0.26 0.00 0.00 60.65 58.49 1umg s ILE 118 Cb -0.15 -2.51 0.04 0.00 1.25 0.00 0.00 42.46 41.09 1umg s ILE 118 CO 0.08 0.00 0.12 -0.70 0.24 0.00 0.00 174.94 174.68 1umg s GLU 119 N -3.85 2.68 0.20 0.37 2.12 -1.26 0.23 118.70 119.19 1umg s GLU 119 Ca 0.39 -1.14 -0.32 0.00 0.36 0.00 0.00 54.97 54.26 1umg s GLU 119 Cb 0.05 -3.50 -0.15 0.00 0.26 0.00 0.00 34.13 30.79 1umg s GLU 119 CO 0.18 -0.66 1.27 0.39 -0.54 0.00 0.00 175.26 175.90 1umg n GLU 120 N 4.85 1.54 -2.07 4.30 1.02 -1.26 -4.98 120.64 124.03 1umg n GLU 120 Ca -0.12 0.55 -0.28 0.00 -0.02 0.00 0.00 57.16 57.28 1umg n GLU 120 Cb 0.45 -2.12 0.15 0.00 -0.02 0.00 0.00 31.44 29.91 1umg n GLU 120 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1umg s ARG 121 N -0.39 1.08 0.29 3.49 0.52 -1.26 -4.91 118.95 117.76 1umg s ARG 121 Ca 0.71 -0.48 0.01 0.00 -0.52 0.00 0.00 55.73 55.44 1umg s ARG 121 Cb -0.76 -1.97 0.69 0.00 0.52 0.00 0.00 34.95 33.43 1umg s ARG 121 CO 0.51 -2.07 1.63 0.00 0.02 0.00 0.00 175.30 175.39 1umg h ALA 122 N -1.30 1.19 -3.83 2.13 0.00 -1.99 -3.36 119.26 112.10 1umg h ALA 122 Ca -0.43 0.25 -0.41 0.00 0.00 0.00 0.00 54.91 54.33 1umg h ALA 122 Cb 1.26 0.40 -0.30 0.00 0.00 0.00 0.00 17.79 19.14 1umg h ALA 122 CO 0.43 -0.50 -0.78 0.45 0.00 0.00 0.00 179.25 178.85 1umg s SER 123 N -5.07 1.09 -0.67 0.00 0.15 -1.26 -5.10 113.70 102.84 1umg s SER 123 Ca -0.12 -0.17 0.05 0.00 0.70 0.00 0.00 55.95 56.41 1umg s SER 123 Cb 0.26 -0.27 0.19 0.00 -1.71 0.00 0.00 66.02 64.50 1umg s SER 123 CO 0.77 0.06 0.56 1.21 1.20 0.00 0.00 173.24 177.05 1umg n GLU 124 N 3.25 1.95 -2.68 5.44 4.07 -1.26 -5.05 120.64 126.36 1umg n GLU 124 Ca -0.18 -4.47 -0.41 0.00 -0.06 0.00 0.00 57.16 52.05 1umg n GLU 124 Cb 0.55 -2.24 -0.05 0.00 -0.06 0.00 0.00 31.44 29.65 1umg n GLU 124 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 1umg s PRO 125 N -1.70 4.72 0.05 5.31 0.04 -1.26 -1.54 135.00 140.61 1umg s PRO 125 Ca 0.30 1.53 -0.01 0.00 0.04 0.00 0.00 61.00 62.86 1umg s PRO 125 Cb 0.02 -3.32 -0.04 0.00 0.04 0.00 0.00 34.50 31.20 1umg s PRO 125 CO -0.13 0.26 -0.03 0.96 0.04 0.00 0.00 177.00 178.11 1umg s ILE 126 N -0.40 0.23 -0.08 0.56 -4.36 -0.40 -1.34 121.20 115.41 1umg s ILE 126 Ca 0.46 -1.70 0.03 0.00 -0.26 0.00 0.00 60.65 59.18 1umg s ILE 126 Cb -0.26 -1.37 0.01 0.00 1.25 0.00 0.00 42.46 42.09 1umg s ILE 126 CO 0.32 -0.93 -0.18 0.00 0.24 0.00 0.00 174.94 174.39 1umg s ALA 127 N -3.59 1.67 -0.16 2.27 0.00 -0.46 -1.25 121.76 120.24 1umg s ALA 127 Ca 0.04 -0.68 -0.01 0.00 0.00 0.00 0.00 51.96 51.32 1umg s ALA 127 Cb 0.06 -0.66 -0.01 0.00 0.00 0.00 0.00 23.12 22.51 1umg s ALA 127 CO -0.09 0.21 -0.12 0.42 0.00 0.00 0.00 175.76 176.18 1umg s ILE 128 N 0.45 2.95 -0.11 0.00 1.01 0.41 -1.32 121.20 124.59 1umg s ILE 128 Ca -0.15 -0.67 0.00 0.00 0.00 0.00 0.00 60.65 59.83 1umg s ILE 128 Cb -0.16 -2.27 -0.02 0.00 0.01 0.00 0.00 42.46 40.02 1umg s ILE 128 CO 0.06 0.50 -0.11 -0.36 0.00 0.00 0.00 174.94 175.02 1umg s PHE 129 N 0.80 2.83 -0.05 3.97 0.08 -0.15 -0.70 117.98 124.76 1umg s PHE 129 Ca -0.04 -0.43 0.02 0.00 0.12 0.00 0.00 56.93 56.60 1umg s PHE 129 Cb -0.15 -1.80 0.01 0.00 -0.57 0.00 0.00 43.02 40.51 1umg s PHE 129 CO 0.01 -0.05 -0.09 -1.64 -0.10 0.00 0.00 175.22 173.35 1umg s MET 130 N 0.01 1.21 0.11 0.44 -1.94 -0.19 -0.54 119.30 118.40 1umg s MET 130 Ca -0.03 -0.29 0.07 0.00 -1.71 0.00 0.00 55.69 53.72 1umg s MET 130 Cb -0.14 -1.08 -0.04 0.00 2.01 0.00 0.00 34.83 35.58 1umg s MET 130 CO 0.04 0.03 -0.16 0.00 -0.01 0.00 0.00 175.02 174.91 1umg s ALA 131 N 0.58 1.56 0.03 3.03 0.00 -0.55 -0.46 121.76 125.96 1umg s ALA 131 Ca -0.10 -1.25 0.07 0.00 0.00 0.00 0.00 51.96 50.68 1umg s ALA 131 Cb -0.13 -0.13 -0.02 0.00 0.00 0.00 0.00 23.12 22.84 1umg s ALA 131 CO 0.02 0.19 -0.20 0.34 0.00 0.00 0.00 175.76 176.10 1umg s ASP 132 N -2.22 2.40 -0.49 0.00 2.15 -0.59 -3.84 116.67 114.09 1umg s ASP 132 Ca 0.07 -0.49 -0.02 0.00 0.43 0.00 0.00 52.55 52.53 1umg s ASP 132 Cb -0.07 -0.21 0.00 0.00 -0.30 0.00 0.00 42.92 42.35 1umg s ASP 132 CO 0.04 0.16 0.31 0.29 -0.17 0.00 0.00 175.17 175.80 1umg n LYS 133 N 1.96 -2.20 -2.97 4.34 4.76 -1.26 -2.20 118.16 120.58 1umg n LYS 133 Ca -0.17 0.29 -0.06 0.00 -2.87 0.00 0.00 58.31 55.50 1umg n LYS 133 Cb 0.53 -3.77 0.02 0.00 -1.84 0.00 0.00 35.03 29.98 1umg n LYS 133 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 1umg n THR 134 N -3.49 0.00 -4.56 -0.18 5.66 -1.26 -0.12 114.28 110.32 1umg n THR 134 Ca -0.02 -0.71 -0.26 0.00 -3.05 0.00 0.00 64.05 60.01 1umg n THR 134 Cb 0.53 0.70 -0.11 0.00 -1.55 0.00 0.00 70.33 69.91 1umg n THR 134 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 1umg s GLU 135 N -2.07 1.85 0.31 1.09 -1.05 -1.19 0.68 118.70 118.32 1umg s GLU 135 Ca 0.11 -2.02 0.07 0.00 -0.15 0.00 0.00 54.97 52.98 1umg s GLU 135 Cb -0.03 -1.50 0.85 0.00 -0.44 0.00 0.00 34.13 33.00 1umg s GLU 135 CO 0.09 -0.03 1.67 -1.35 0.95 0.00 0.00 175.26 176.59 1umg h PRO 136 N 1.91 0.31 0.00 -4.83 0.11 -1.84 0.38 132.00 128.04 1umg h PRO 136 Ca -0.43 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1umg h PRO 136 Cb 1.24 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1umg h PRO 136 CO 0.76 0.20 0.09 0.41 -0.21 0.00 0.00 178.00 179.25 1umg n GLY 137 N -1.34 -0.73 0.30 -0.55 0.00 -1.26 -1.56 105.19 100.04 1umg n GLY 137 Ca 0.25 0.15 0.15 0.00 0.00 0.00 0.00 46.02 46.57 1umg n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1umg h ALA 138 N 1.75 1.54 -0.00 4.61 0.00 -1.24 -1.40 119.26 124.51 1umg h ALA 138 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1umg h ALA 138 Cb 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1umg h ALA 138 CO 0.00 0.00 -0.19 0.66 0.00 0.00 0.00 179.25 179.72 1umg n TYR 139 N -3.87 0.00 0.14 0.00 4.01 -0.60 -4.29 117.16 112.55 1umg n TYR 139 Ca -0.03 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.58 1umg n TYR 139 Cb 0.08 -0.18 -0.06 0.00 -0.31 0.00 0.00 39.34 38.87 1umg n TYR 139 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 1umg h ASN 140 N 0.72 -0.73 -0.02 7.72 4.21 -1.44 -0.46 115.58 125.58 1umg h ASN 140 Ca 0.00 0.08 0.00 0.00 1.21 0.00 0.00 56.30 57.59 1umg h ASN 140 Cb 0.43 0.27 -0.00 0.00 -1.12 0.00 0.00 38.32 37.90 1umg h ASN 140 CO 0.00 -0.36 0.02 0.25 -1.29 0.00 0.00 177.43 176.04 1umg h LEU 141 N -0.50 0.03 -0.42 1.61 5.85 -1.78 -1.27 115.31 118.83 1umg h LEU 141 Ca 0.02 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1umg h LEU 141 Cb 0.50 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 1umg h LEU 141 CO -0.11 0.03 0.21 -0.65 -0.34 0.00 0.00 178.44 177.57 1umg h PRO 142 N 0.02 0.41 -0.67 5.25 0.11 -1.76 -1.71 132.00 133.64 1umg h PRO 142 Ca 0.01 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.06 1umg h PRO 142 Cb 0.01 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.00 1umg h PRO 142 CO -0.00 0.27 0.28 -0.07 -0.21 0.00 0.00 178.00 178.27 1umg h LEU 143 N 0.42 0.92 -0.52 2.35 3.38 -0.98 0.57 115.31 121.44 1umg h LEU 143 Ca 0.18 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 58.01 1umg h LEU 143 Cb 0.09 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 1umg h LEU 143 CO -0.13 0.83 0.31 0.22 0.09 0.00 0.00 178.44 179.77 1umg h TYR 144 N 0.95 0.58 -0.17 1.13 3.20 -0.96 -1.25 116.97 120.45 1umg h TYR 144 Ca 0.23 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.10 1umg h TYR 144 Cb 0.19 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 1umg h TYR 144 CO 0.01 0.33 0.04 0.87 -1.64 0.00 0.00 178.16 177.77 1umg h LYS 145 N 0.62 0.27 -0.50 1.82 1.57 -0.87 0.14 116.57 119.62 1umg h LYS 145 Ca 0.21 -0.07 0.06 0.00 -1.87 0.00 0.00 60.65 58.99 1umg h LYS 145 Cb 0.03 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.25 1umg h LYS 145 CO -0.10 0.41 0.19 0.52 -0.57 0.00 0.00 179.45 179.90 1umg h MET 146 N 0.08 0.37 -0.01 3.15 2.86 -0.62 -2.86 114.93 117.91 1umg h MET 146 Ca 0.05 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1umg h MET 146 Cb 0.26 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.84 1umg h MET 146 CO 0.00 0.24 -0.43 1.19 1.06 0.00 0.00 176.91 178.98 1umg n PHE 147 N -4.98 0.00 0.00 -0.22 3.72 -0.49 -4.70 117.46 110.78 1umg n PHE 147 Ca 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 1umg n PHE 147 Cb 0.19 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.73 1umg n PHE 147 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1umg n ALA 148 N -0.28 0.27 -2.54 4.37 0.00 0.45 -4.27 120.51 118.52 1umg n ALA 148 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.08 1umg n ALA 148 Cb 0.36 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.75 1umg n ALA 148 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1umg s ASP 149 N -0.27 6.41 0.22 0.00 2.15 -0.98 -4.92 116.67 119.28 1umg s ASP 149 Ca 0.00 -0.12 0.19 0.00 0.43 0.00 0.00 52.55 53.05 1umg s ASP 149 Cb 0.00 -2.38 0.90 0.00 -0.30 0.00 0.00 42.92 41.14 1umg s ASP 149 CO 0.00 -0.89 1.58 -0.81 -0.17 0.00 0.00 175.17 174.89 1umg n PRO 150 N 6.63 0.13 0.00 4.34 -0.04 -1.26 -1.17 135.00 143.63 1umg n PRO 150 Ca 0.02 0.49 0.13 0.00 -0.04 0.00 0.00 63.50 64.10 1umg n PRO 150 Cb 0.48 -1.82 0.43 0.00 -0.04 0.00 0.00 33.50 32.55 1umg n PRO 150 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1umg n PHE 151 N -2.08 0.00 -0.07 0.54 3.01 -1.26 -3.90 117.46 113.70 1umg n PHE 151 Ca 0.01 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.33 1umg n PHE 151 Cb 0.12 -0.24 -0.06 0.00 -0.01 0.00 0.00 39.48 39.30 1umg n PHE 151 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1umg n ASN 152 N -1.15 1.66 -4.02 4.37 5.15 -0.35 -4.88 115.26 116.04 1umg n ASN 152 Ca 0.10 0.09 -0.33 0.00 -0.60 0.00 0.00 54.58 53.84 1umg n ASN 152 Cb 0.32 -0.36 -0.11 0.00 -0.53 0.00 0.00 39.78 39.10 1umg n ASN 152 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1umg s THR 153 N -2.27 3.23 0.63 -0.44 2.01 -0.32 -4.82 115.64 113.67 1umg s THR 153 Ca -0.20 -3.35 0.41 0.00 0.31 0.00 0.00 61.69 58.86 1umg s THR 153 Cb 0.07 -3.14 0.41 0.00 0.01 0.00 0.00 72.50 69.85 1umg s THR 153 CO 0.27 -0.88 2.26 1.55 -0.69 0.00 0.00 174.62 177.13 1umg h PRO 154 N 6.52 0.00 -0.45 4.92 0.13 -1.84 -2.09 132.00 139.19 1umg h PRO 154 Ca -0.01 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 65.22 1umg h PRO 154 Cb 0.89 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.00 1umg h PRO 154 CO 0.72 0.00 0.31 0.78 -0.23 0.00 0.00 178.00 179.58 1umg h GLY 155 N 0.00 0.26 2.00 1.56 0.00 -1.92 0.22 103.07 105.20 1umg h GLY 155 Ca 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.24 1umg h GLY 155 CO 0.00 0.05 -0.03 1.41 0.00 0.00 0.00 176.54 177.97 1umg h LEU 156 N 0.19 0.00 0.00 3.11 3.38 -1.65 0.21 115.31 120.55 1umg h LEU 156 Ca 0.21 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.83 1umg h LEU 156 Cb 0.58 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.26 1umg h LEU 156 CO -0.03 0.03 -2.34 0.52 0.09 0.00 0.00 178.44 176.71 1umg n VAL 157 N -4.33 1.34 0.31 1.22 0.31 0.27 -4.20 118.33 113.25 1umg n VAL 157 Ca -0.03 -0.69 0.04 0.00 -0.01 0.00 0.00 64.34 63.65 1umg n VAL 157 Cb 0.12 -0.86 0.03 0.00 -0.91 0.00 0.00 33.84 32.21 1umg n VAL 157 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1umg n ILE 158 N -2.92 0.00 -3.83 2.52 -5.35 0.53 -4.91 119.36 105.41 1umg n ILE 158 Ca -0.36 -0.50 -0.36 0.00 -0.27 0.00 0.00 62.75 61.26 1umg n ILE 158 Cb 1.05 1.15 -0.13 0.00 -1.74 0.00 0.00 39.64 39.98 1umg n ILE 158 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1umg s ASP 159 N -0.64 5.11 0.37 7.28 -1.08 0.05 -4.98 116.67 122.78 1umg s ASP 159 Ca 0.09 -1.39 0.17 0.00 -0.52 0.00 0.00 52.55 50.89 1umg s ASP 159 Cb 0.06 -1.79 1.10 0.00 -1.46 0.00 0.00 42.92 40.83 1umg s ASP 159 CO 0.10 -0.35 1.71 -0.65 0.52 0.00 0.00 175.17 176.50 1umg h PRO 160 N 8.09 0.37 0.00 4.34 0.11 -1.91 0.43 132.00 143.42 1umg h PRO 160 Ca -0.20 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1umg h PRO 160 Cb 1.07 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1umg h PRO 160 CO 0.59 0.24 0.00 0.25 -0.21 0.00 0.00 178.00 178.88 1umg n THR 161 N -4.80 1.09 0.21 -1.15 -2.24 -1.26 -2.73 114.28 103.40 1umg n THR 161 Ca 0.29 0.27 0.02 0.00 -2.27 0.00 0.00 64.05 62.37 1umg n THR 161 Cb 0.95 -1.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.13 1umg n THR 161 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1umg n MET 162 N -1.48 2.31 -0.05 -0.78 2.81 0.13 -4.70 117.12 115.36 1umg n MET 162 Ca 0.03 -0.44 0.17 0.00 -1.81 0.00 0.00 57.70 55.65 1umg n MET 162 Cb 0.14 -0.92 0.60 0.00 -0.71 0.00 0.00 33.22 32.33 1umg n MET 162 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1umg h HIS 163 N 0.55 0.21 0.00 2.03 6.17 -1.34 -0.70 115.15 122.08 1umg h HIS 163 Ca 0.00 0.01 -0.01 0.00 0.71 0.00 0.00 60.37 61.07 1umg h HIS 163 Cb 0.16 -0.07 -0.00 0.00 2.52 0.00 0.00 27.41 30.02 1umg h HIS 163 CO 0.00 0.09 -0.05 0.78 0.71 0.00 0.00 177.93 179.46 1umg h GLY 164 N 0.19 0.00 0.00 5.26 0.00 -1.84 -3.49 103.07 103.19 1umg h GLY 164 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.61 1umg h GLY 164 CO -0.05 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.10 1umg n GLY 165 N -0.83 -2.09 3.20 4.60 0.00 -0.27 -4.71 105.19 105.10 1umg n GLY 165 Ca -0.02 -1.61 -0.12 0.00 0.00 0.00 0.00 46.02 44.27 1umg n GLY 165 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1umg s PHE 166 N -0.11 1.06 0.11 1.61 0.08 -1.21 -1.46 117.98 118.06 1umg s PHE 166 Ca 0.00 -0.82 0.10 0.00 0.12 0.00 0.00 56.93 56.33 1umg s PHE 166 Cb 0.00 -0.57 -0.04 0.00 -0.57 0.00 0.00 43.02 41.84 1umg s PHE 166 CO 0.00 -0.04 -0.25 -1.59 -0.10 0.00 0.00 175.22 173.24 1umg s LYS 167 N -3.69 1.36 -0.10 0.44 -2.85 0.33 -0.91 119.74 114.31 1umg s LYS 167 Ca 0.13 -1.26 0.02 0.00 -1.00 0.00 0.00 55.97 53.86 1umg s LYS 167 Cb 0.03 -1.75 -0.02 0.00 -2.06 0.00 0.00 37.83 34.04 1umg s LYS 167 CO -0.02 0.42 -0.15 -0.06 0.10 0.00 0.00 175.35 175.63 1umg s PHE 168 N -1.06 2.73 -0.49 1.78 0.08 0.12 -1.44 117.98 119.70 1umg s PHE 168 Ca 0.11 -0.54 -0.19 0.00 0.12 0.00 0.00 56.93 56.43 1umg s PHE 168 Cb -0.10 -1.75 0.05 0.00 -0.57 0.00 0.00 43.02 40.65 1umg s PHE 168 CO 0.05 -0.11 0.63 -2.00 -0.10 0.00 0.00 175.22 173.69 1umg s GLU 169 N -0.01 3.15 -0.26 0.44 2.12 -0.20 -1.27 118.70 122.68 1umg s GLU 169 Ca -0.04 -0.78 -0.10 0.00 0.36 0.00 0.00 54.97 54.40 1umg s GLU 169 Cb -0.14 -4.07 -0.05 0.00 0.26 0.00 0.00 34.13 30.13 1umg s GLU 169 CO 0.04 -1.18 0.16 0.08 -0.54 0.00 0.00 175.26 173.82 1umg s VAL 170 N 2.69 5.24 -0.20 3.70 1.01 0.46 -0.94 120.40 132.36 1umg s VAL 170 Ca 0.17 0.14 -0.12 0.00 0.00 0.00 0.00 61.98 62.16 1umg s VAL 170 Cb -0.18 -3.46 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 1umg s VAL 170 CO 0.13 0.31 0.24 -0.22 0.00 0.00 0.00 175.10 175.56 1umg s LEU 171 N 1.37 4.19 -0.60 3.92 2.96 -0.01 -0.91 118.68 129.60 1umg s LEU 171 Ca 0.07 0.33 -0.25 0.00 -0.22 0.00 0.00 54.13 54.07 1umg s LEU 171 Cb -0.15 -2.26 0.04 0.00 0.50 0.00 0.00 46.19 44.33 1umg s LEU 171 CO 0.07 0.08 1.02 -0.62 -1.32 0.00 0.00 176.35 175.58 1umg s ASP 172 N 0.70 6.30 0.31 3.68 -1.08 0.93 -1.75 116.67 125.75 1umg s ASP 172 Ca 0.12 -0.44 0.24 0.00 -0.52 0.00 0.00 52.55 51.95 1umg s ASP 172 Cb -0.13 -2.46 1.12 0.00 -1.46 0.00 0.00 42.92 39.99 1umg s ASP 172 CO 0.03 -1.38 1.72 -0.37 0.52 0.00 0.00 175.17 175.69 1umg h VAL 173 N 6.03 0.00 0.03 1.11 -1.51 -1.50 0.15 116.25 120.55 1umg h VAL 173 Ca -0.27 -0.13 -0.31 0.00 -1.23 0.00 0.00 66.70 64.77 1umg h VAL 173 Cb 1.07 0.76 -0.04 0.00 -2.13 0.00 0.00 31.29 30.95 1umg h VAL 173 CO 1.14 0.00 -1.70 -1.22 -1.23 0.00 0.00 177.57 174.56 1umg n TYR 174 N -2.30 0.84 0.17 5.19 4.01 -1.26 0.36 117.16 124.17 1umg n TYR 174 Ca 0.00 0.31 0.06 0.00 -0.16 0.00 0.00 57.90 58.11 1umg n TYR 174 Cb 0.14 -1.09 0.09 0.00 -0.31 0.00 0.00 39.34 38.16 1umg n TYR 174 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 1umg h GLN 175 N -0.72 0.00 -1.11 -0.72 1.08 -1.92 -3.45 115.11 108.27 1umg h GLN 175 Ca -0.44 0.00 -0.10 0.00 -1.45 0.00 0.00 58.65 56.66 1umg h GLN 175 Cb 1.54 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.98 1umg h GLN 175 CO -0.18 0.31 -0.14 0.41 -0.95 0.00 0.00 178.83 178.28 1umg n GLY 176 N 1.16 0.26 3.23 3.46 0.00 0.50 -5.05 105.19 108.76 1umg n GLY 176 Ca 0.03 -0.61 -0.22 0.00 0.00 0.00 0.00 46.02 45.22 1umg n GLY 176 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1umg s GLU 177 N -4.53 1.01 0.08 1.61 2.02 -1.21 -4.96 118.70 112.72 1umg s GLU 177 Ca 0.04 -1.05 0.08 0.00 0.02 0.00 0.00 54.97 54.06 1umg s GLU 177 Cb -0.02 -1.16 -0.03 0.00 0.10 0.00 0.00 34.13 33.03 1umg s GLU 177 CO 0.05 0.27 -0.21 0.00 0.02 0.00 0.00 175.26 175.39 1umg s ALA 178 N -1.16 1.78 0.07 5.21 0.00 -1.26 -0.05 121.76 126.34 1umg s ALA 178 Ca 0.03 -1.17 0.07 0.00 0.00 0.00 0.00 51.96 50.89 1umg s ALA 178 Cb -0.10 -0.28 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 1umg s ALA 178 CO 0.03 0.37 -0.18 0.54 0.00 0.00 0.00 175.76 176.52 1umg s VAL 179 N -1.01 1.45 -0.25 0.00 0.11 -0.09 -4.94 120.40 115.67 1umg s VAL 179 Ca 0.07 -1.28 -0.09 0.00 -2.93 0.00 0.00 61.98 57.75 1umg s VAL 179 Cb -0.09 -1.31 -0.04 0.00 -1.53 0.00 0.00 36.38 33.40 1umg s VAL 179 CO 0.03 -0.01 0.11 -0.04 -3.33 0.00 0.00 175.10 171.87 1umg s MET 180 N -1.51 3.79 -0.07 1.54 -1.94 -1.26 -0.41 119.30 119.45 1umg s MET 180 Ca 0.04 -0.41 0.05 0.00 -1.71 0.00 0.00 55.69 53.67 1umg s MET 180 Cb -0.09 -3.44 -0.01 0.00 2.01 0.00 0.00 34.83 33.30 1umg s MET 180 CO 0.03 -0.15 -0.25 -0.51 -0.01 0.00 0.00 175.02 174.14 1umg s LEU 181 N 1.56 2.07 -0.08 -0.03 1.43 -0.40 -4.94 118.68 118.29 1umg s LEU 181 Ca 0.06 -0.52 -0.03 0.00 -1.03 0.00 0.00 54.13 52.61 1umg s LEU 181 Cb -0.15 -1.37 -0.04 0.00 0.03 0.00 0.00 46.19 44.66 1umg s LEU 181 CO 0.06 0.22 0.07 -0.44 0.23 0.00 0.00 176.35 176.49 1umg s SER 182 N -0.01 5.75 0.05 2.29 0.01 -1.26 0.16 113.70 120.68 1umg s SER 182 Ca -0.08 0.26 0.05 0.00 1.31 0.00 0.00 55.95 57.49 1umg s SER 182 Cb -0.15 -1.72 -0.04 0.00 0.21 0.00 0.00 66.02 64.32 1umg s SER 182 CO 0.05 0.37 -0.10 0.00 0.41 0.00 0.00 173.24 173.97 1umg s ALA 183 N -1.00 2.92 -0.75 1.44 0.00 -0.09 -1.26 121.76 123.02 1umg s ALA 183 Ca 0.16 -1.13 0.26 0.00 0.00 0.00 0.00 51.96 51.25 1umg s ALA 183 Cb -0.12 -0.98 0.75 0.00 0.00 0.00 0.00 23.12 22.77 1umg s ALA 183 CO 0.05 0.62 1.68 -0.35 0.00 0.00 0.00 175.76 177.76 1umg n PRO 184 N 1.26 0.23 0.00 0.00 -0.04 -1.26 -3.31 135.00 131.88 1umg n PRO 184 Ca -0.15 0.16 0.14 0.00 -0.04 0.00 0.00 63.50 63.61 1umg n PRO 184 Cb 0.52 -1.74 0.62 0.00 -0.04 0.00 0.00 33.50 32.87 1umg n PRO 184 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1umg n GLN 185 N -2.13 0.04 -0.26 0.54 0.00 -1.13 -3.24 117.38 111.20 1umg n GLN 185 Ca 0.05 0.01 0.08 0.00 0.00 0.00 0.00 57.00 57.15 1umg n GLN 185 Cb 0.42 -1.50 0.17 0.00 0.00 0.00 0.00 30.24 29.33 1umg n GLN 185 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 1umg n GLU 186 N -1.48 1.62 0.09 2.61 1.02 -0.39 -4.75 120.64 119.35 1umg n GLU 186 Ca 0.07 -2.78 0.01 0.00 -0.02 0.00 0.00 57.16 54.45 1umg n GLU 186 Cb 0.32 -1.59 0.34 0.00 -0.02 0.00 0.00 31.44 30.49 1umg n GLU 186 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 1umg h ILE 187 N 0.50 1.21 -0.27 -3.67 3.07 -1.71 0.74 117.51 117.38 1umg h ILE 187 Ca 0.01 -0.92 -0.13 0.00 1.55 0.00 0.00 64.86 65.36 1umg h ILE 187 Cb 1.11 1.25 -0.01 0.00 -0.27 0.00 0.00 36.82 38.90 1umg h ILE 187 CO 0.06 0.29 -0.39 1.88 -1.05 0.00 0.00 178.15 178.94 1umg h TYR 188 N 0.28 0.74 -0.16 0.16 0.05 -1.87 0.10 116.97 116.27 1umg h TYR 188 Ca 0.05 -0.21 -0.04 0.00 0.05 0.00 0.00 58.73 58.58 1umg h TYR 188 Cb 0.45 -0.16 -0.00 0.00 1.01 0.00 0.00 36.73 38.03 1umg h TYR 188 CO 0.01 0.92 -0.07 -0.44 -1.05 0.00 0.00 178.16 177.53 1umg h ASP 189 N 0.52 0.34 -0.12 3.88 3.32 -1.81 -2.20 116.42 120.35 1umg h ASP 189 Ca 0.05 -0.40 0.04 0.00 0.02 0.00 0.00 57.03 56.74 1umg h ASP 189 Cb 0.90 -0.09 -0.05 0.00 0.22 0.00 0.00 39.33 40.31 1umg h ASP 189 CO 0.08 0.67 -0.15 0.25 -1.72 0.00 0.00 179.24 178.37 1umg h LEU 190 N 0.01 -0.46 -1.46 1.55 5.85 -0.65 -2.42 115.31 117.73 1umg h LEU 190 Ca 0.04 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 1umg h LEU 190 Cb 0.53 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 1umg h LEU 190 CO 0.02 -0.20 0.05 -0.07 -0.34 0.00 0.00 178.44 177.91 1umg h LEU 191 N -0.19 0.37 -2.11 2.25 3.38 -0.97 -0.61 115.31 117.44 1umg h LEU 191 Ca 0.09 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1umg h LEU 191 Cb 0.32 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1umg h LEU 191 CO -0.23 0.39 -0.02 0.00 0.09 0.00 0.00 178.44 178.67 1umg h ALA 192 N 1.66 1.79 0.00 1.53 0.00 -0.89 -2.12 119.26 121.23 1umg h ALA 192 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1umg h ALA 192 Cb 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1umg h ALA 192 CO -0.00 0.03 -0.54 1.28 0.00 0.00 0.00 179.25 180.02 1umg n LEU 193 N -4.26 1.64 0.00 0.00 4.77 -0.55 -4.45 117.00 114.15 1umg n LEU 193 Ca -0.03 0.54 0.03 0.00 -0.03 0.00 0.00 56.01 56.52 1umg n LEU 193 Cb 0.11 -0.81 0.16 0.00 -2.33 0.00 0.00 43.42 40.55 1umg n LEU 193 CO 0.32 -0.44 0.58 2.30 -1.33 0.00 0.00 177.39 178.82 1umg n ILE 194 N -4.34 1.28 0.46 -0.08 -5.35 -0.34 -1.39 119.36 109.59 1umg n ILE 194 Ca -0.08 0.32 0.08 0.00 -0.27 0.00 0.00 62.75 62.81 1umg n ILE 194 Cb 0.28 -1.20 0.35 0.00 -1.74 0.00 0.00 39.64 37.33 1umg n ILE 194 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1umg n GLY 195 N -0.75 -1.06 3.00 3.28 0.00 -0.80 -3.58 105.19 105.29 1umg n GLY 195 Ca 0.02 -0.01 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 1umg n GLY 195 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1umg s THR 196 N -3.08 3.59 0.62 2.61 2.01 -0.49 -4.96 115.64 115.94 1umg s THR 196 Ca 0.06 -4.03 0.32 0.00 0.31 0.00 0.00 61.69 58.35 1umg s THR 196 Cb 0.09 -3.29 0.36 0.00 0.01 0.00 0.00 72.50 69.68 1umg s THR 196 CO 0.29 -1.03 2.09 -0.65 -0.69 0.00 0.00 174.62 174.63 1umg h PRO 197 N 5.76 0.00 0.00 4.92 0.11 -1.74 -1.12 132.00 139.93 1umg h PRO 197 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1umg h PRO 197 Cb 0.79 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.90 1umg h PRO 197 CO 0.78 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.57 1umg h ALA 198 N 1.68 1.00 0.00 -0.75 0.00 -1.93 -3.37 119.26 115.89 1umg h ALA 198 Ca 0.06 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 1umg h ALA 198 Cb 0.50 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1umg h ALA 198 CO -0.00 0.00 -1.45 -2.13 0.00 0.00 0.00 179.25 175.67 1umg n ARG 199 N -2.78 0.19 -4.01 0.00 3.00 -0.79 -4.86 116.66 107.41 1umg n ARG 199 Ca 0.04 0.05 -0.34 0.00 -0.00 0.00 0.00 57.85 57.61 1umg n ARG 199 Cb 0.48 -1.04 -0.15 0.00 0.00 0.00 0.00 32.46 31.74 1umg n ARG 199 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 1umg s TYR 200 N -2.15 2.92 -0.06 -0.14 2.02 -0.49 -1.34 117.35 118.10 1umg s TYR 200 Ca -0.11 -1.40 0.05 0.00 -0.37 0.00 0.00 57.07 55.24 1umg s TYR 200 Cb 0.03 -2.01 -0.00 0.00 -0.40 0.00 0.00 41.96 39.57 1umg s TYR 200 CO 0.17 -0.70 -0.20 0.08 -1.57 0.00 0.00 175.55 173.32 1umg s VAL 201 N 1.36 1.69 -0.10 0.71 1.01 -0.72 -4.27 120.40 120.08 1umg s VAL 201 Ca 0.04 -0.85 -0.30 0.00 0.00 0.00 0.00 61.98 60.88 1umg s VAL 201 Cb -0.14 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 1umg s VAL 201 CO -0.08 0.48 1.42 -0.63 0.00 0.00 0.00 175.10 176.29 1umg s ILE 202 N 0.08 3.95 -0.22 2.22 1.01 -1.26 -0.83 121.20 126.14 1umg s ILE 202 Ca -0.07 1.19 0.04 0.00 0.00 0.00 0.00 60.65 61.81 1umg s ILE 202 Cb -0.14 -3.77 -0.20 0.00 0.01 0.00 0.00 42.46 38.37 1umg s ILE 202 CO 0.04 -0.08 -0.07 -1.14 0.00 0.00 0.00 174.94 173.68 1umg n ARG 203 N 6.53 0.67 -3.84 2.79 0.63 -0.12 -4.59 116.66 118.72 1umg n ARG 203 Ca 0.15 0.14 -0.10 0.00 -0.92 0.00 0.00 57.85 57.12 1umg n ARG 203 Cb 0.44 -1.55 -0.08 0.00 0.45 0.00 0.00 32.46 31.72 1umg n ARG 203 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1umg s ARG 204 N -2.52 0.75 -0.02 -0.14 0.52 -1.23 -0.36 118.95 115.96 1umg s ARG 204 Ca -0.28 -0.74 0.03 0.00 -0.52 0.00 0.00 55.73 54.21 1umg s ARG 204 Cb 0.08 0.31 0.00 0.00 0.52 0.00 0.00 34.95 35.86 1umg s ARG 204 CO 0.67 -0.23 -0.10 0.08 0.02 0.00 0.00 175.30 175.75 1umg s VAL 205 N -3.04 0.83 0.08 3.52 1.01 -0.51 -1.03 120.40 121.26 1umg s VAL 205 Ca -0.01 -0.40 0.07 0.00 0.00 0.00 0.00 61.98 61.63 1umg s VAL 205 Cb 0.01 -0.73 -0.03 0.00 0.00 0.00 0.00 36.38 35.63 1umg s VAL 205 CO -0.06 0.25 -0.18 -0.31 0.00 0.00 0.00 175.10 174.80 1umg s TYR 206 N 0.09 1.52 0.07 5.22 2.02 -0.52 -0.24 117.35 125.51 1umg s TYR 206 Ca -0.02 -0.43 -0.29 0.00 -0.37 0.00 0.00 57.07 55.97 1umg s TYR 206 Cb -0.08 -0.85 -0.05 0.00 -0.40 0.00 0.00 41.96 40.58 1umg s TYR 206 CO 0.00 0.13 0.93 0.50 -1.57 0.00 0.00 175.55 175.54 1umg s ARG 207 N -1.74 4.63 0.12 -0.62 3.52 -0.26 -0.51 118.95 124.09 1umg s ARG 207 Ca 0.03 1.37 -0.18 0.00 -0.13 0.00 0.00 55.73 56.81 1umg s ARG 207 Cb -0.10 -3.39 -0.05 0.00 -1.56 0.00 0.00 34.95 29.85 1umg s ARG 207 CO 0.03 0.16 1.72 -0.91 -0.81 0.00 0.00 175.30 175.49 1umg h ASN 208 N 5.89 0.35 -0.86 -2.12 2.35 -1.53 0.16 115.58 119.81 1umg h ASN 208 Ca -0.43 -0.09 0.10 0.00 -0.55 0.00 0.00 56.30 55.33 1umg h ASN 208 Cb 1.21 -0.09 -0.08 0.00 0.05 0.00 0.00 38.32 39.42 1umg h ASN 208 CO 0.72 0.34 0.50 -0.08 -1.65 0.00 0.00 177.43 177.26 1umg h GLU 209 N 0.33 0.79 0.00 0.81 4.81 -1.85 -3.30 114.58 116.16 1umg h GLU 209 Ca 0.10 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1umg h GLU 209 Cb 0.07 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.27 1umg h GLU 209 CO -0.01 0.52 -0.01 -0.40 -0.73 0.00 0.00 179.01 178.38 1umg n ASP 210 N -4.73 0.98 -2.06 1.04 5.75 -1.24 -5.01 116.55 111.29 1umg n ASP 210 Ca 0.15 -1.52 -0.20 0.00 -0.01 0.00 0.00 54.79 53.21 1umg n ASP 210 Cb 0.30 -0.01 -0.04 0.00 -1.03 0.00 0.00 41.12 40.34 1umg n ASP 210 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1umg n ASN 211 N -0.26 -5.56 -4.72 -1.12 3.02 0.56 -4.93 115.26 102.26 1umg n ASN 211 Ca 0.00 0.21 -0.42 0.00 -0.03 0.00 0.00 54.58 54.34 1umg n ASN 211 Cb 0.39 -4.75 -0.03 0.00 -0.61 0.00 0.00 39.78 34.78 1umg n ASN 211 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1umg s LEU 212 N -5.43 4.37 0.00 3.41 2.96 -1.22 -4.66 118.68 118.10 1umg s LEU 212 Ca 0.00 2.40 -0.30 0.00 -0.22 0.00 0.00 54.13 56.01 1umg s LEU 212 Cb 0.00 -3.59 -0.06 0.00 0.50 0.00 0.00 46.19 43.04 1umg s LEU 212 CO 0.00 -0.69 1.44 -0.22 -1.32 0.00 0.00 176.35 175.56 1umg s LEU 213 N 1.08 4.32 -0.05 -0.68 2.96 -1.26 -1.10 118.68 123.95 1umg s LEU 213 Ca 0.66 2.16 0.07 0.00 -0.22 0.00 0.00 54.13 56.79 1umg s LEU 213 Cb -0.38 -3.56 -0.10 0.00 0.50 0.00 0.00 46.19 42.65 1umg s LEU 213 CO 0.31 -0.75 0.07 0.00 -1.32 0.00 0.00 176.35 174.66 1umg n ALA 214 N 5.51 1.98 -3.35 5.97 0.00 0.67 -4.90 120.51 126.37 1umg n ALA 214 Ca 0.14 -0.37 -0.15 0.00 0.00 0.00 0.00 53.44 53.05 1umg n ALA 214 Cb 0.43 -0.02 -0.06 0.00 0.00 0.00 0.00 19.45 19.80 1umg n ALA 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1umg s ALA 215 N -2.29 -1.33 -0.02 0.00 0.00 -1.10 -0.12 121.76 116.90 1umg s ALA 215 Ca -0.03 0.76 -0.01 0.00 0.00 0.00 0.00 51.96 52.68 1umg s ALA 215 Cb 0.03 0.17 0.01 0.00 0.00 0.00 0.00 23.12 23.33 1umg s ALA 215 CO 0.30 -0.39 0.04 0.08 0.00 0.00 0.00 175.76 175.79 1umg s VAL 216 N -1.74 -0.01 0.05 0.00 1.01 -0.62 -1.42 120.40 117.68 1umg s VAL 216 Ca -0.09 0.03 0.09 0.00 0.00 0.00 0.00 61.98 62.01 1umg s VAL 216 Cb -0.02 -0.07 -0.03 0.00 0.00 0.00 0.00 36.38 36.26 1umg s VAL 216 CO 0.04 0.01 -0.25 -0.69 0.00 0.00 0.00 175.10 174.21 1umg s VAL 217 N 0.17 2.27 -0.62 2.92 1.01 0.52 -1.39 120.40 125.28 1umg s VAL 217 Ca -0.01 -1.39 -0.28 0.00 0.00 0.00 0.00 61.98 60.30 1umg s VAL 217 Cb -0.02 -1.91 0.02 0.00 0.00 0.00 0.00 36.38 34.47 1umg s VAL 217 CO -0.00 0.33 1.33 -0.94 0.00 0.00 0.00 175.10 175.82 1umg s SER 218 N -1.36 6.20 -0.24 3.32 1.04 -0.63 -4.82 113.70 117.22 1umg s SER 218 Ca 0.12 0.04 -0.18 0.00 0.48 0.00 0.00 55.95 56.41 1umg s SER 218 Cb -0.10 -2.55 0.07 0.00 0.10 0.00 0.00 66.02 63.53 1umg s SER 218 CO 0.03 -1.70 0.61 -0.51 0.98 0.00 0.00 173.24 172.64 1umg s ILE 219 N 5.77 -0.00 0.06 -1.02 1.10 -1.26 -4.66 121.20 121.18 1umg s ILE 219 Ca 0.45 0.01 0.02 0.00 -0.51 0.00 0.00 60.65 60.63 1umg s ILE 219 Cb -0.09 -0.86 -0.03 0.00 0.15 0.00 0.00 42.46 41.63 1umg s ILE 219 CO 0.22 0.01 -0.07 -1.61 -2.11 0.00 0.00 174.94 171.38 1umg s GLU 220 N 0.87 0.61 0.73 3.50 2.02 -1.26 -5.05 118.70 120.12 1umg s GLU 220 Ca -0.04 -0.95 -0.16 0.00 0.02 0.00 0.00 54.97 53.84 1umg s GLU 220 Cb -0.05 -0.21 0.03 0.00 0.10 0.00 0.00 34.13 34.00 1umg s GLU 220 CO -0.07 0.01 1.10 2.89 0.02 0.00 0.00 175.26 179.21 1umg n ARG 221 N 0.93 0.54 -1.44 1.61 1.85 -1.26 -4.92 116.66 113.97 1umg n ARG 221 Ca -0.19 0.25 -0.32 0.00 -1.00 0.00 0.00 57.85 56.58 1umg n ARG 221 Cb 0.57 -2.35 0.08 0.00 -1.05 0.00 0.00 32.46 29.71 1umg n ARG 221 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1umg s LEU 222 N -4.10 3.19 0.09 2.89 1.43 0.16 -4.96 118.68 117.38 1umg s LEU 222 Ca 0.75 1.97 0.08 0.00 -1.03 0.00 0.00 54.13 55.90 1umg s LEU 222 Cb -0.34 -4.54 -0.03 0.00 0.03 0.00 0.00 46.19 41.31 1umg s LEU 222 CO 0.48 -1.97 -0.21 0.20 0.23 0.00 0.00 176.35 175.09 1umg s ASN 223 N -2.88 2.49 -0.43 2.29 0.02 -0.43 -4.91 114.94 111.09 1umg s ASN 223 Ca 0.65 -0.66 -0.16 0.00 -1.02 0.00 0.00 52.86 51.67 1umg s ASN 223 Cb -0.20 -0.14 0.03 0.00 0.02 0.00 0.00 41.25 40.96 1umg s ASN 223 CO 0.49 0.07 0.36 -0.22 0.02 0.00 0.00 177.10 177.82 1umg s LEU 224 N -1.80 5.15 0.00 0.60 0.20 -1.26 0.60 118.68 122.17 1umg s LEU 224 Ca 0.06 -0.94 0.00 0.00 0.69 0.00 0.00 54.13 53.95 1umg s LEU 224 Cb -0.10 -2.23 0.00 0.00 -0.43 0.00 0.00 46.19 43.44 1umg s LEU 224 CO 0.04 -0.54 0.00 -0.38 -0.29 0.00 0.00 176.35 175.18 1umg n ILE 225 N 5.25 0.00 -2.31 6.68 5.41 -1.26 -5.01 119.36 128.12 1umg n ILE 225 Ca -0.10 -0.18 -0.43 0.00 1.00 0.00 0.00 62.75 63.04 1umg n ILE 225 Cb 0.46 0.75 -0.02 0.00 -0.71 0.00 0.00 39.64 40.12 1umg n ILE 225 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 1umg s TYR 229 N -0.73 2.35 0.09 1.39 2.02 -1.25 -5.29 117.35 115.93 1umg s TYR 229 Ca 0.00 0.68 0.05 0.00 -0.37 0.00 0.00 57.07 57.44 1umg s TYR 229 Cb 0.00 -4.22 -0.03 0.00 -0.40 0.00 0.00 41.96 37.30 1umg s TYR 229 CO 0.00 -2.11 -0.14 0.14 -1.57 0.00 0.00 175.55 171.87 1umg s VAL 230 N 5.44 1.19 0.25 0.71 -7.23 0.20 -4.89 120.40 116.08 1umg s VAL 230 Ca 0.63 -1.47 -0.08 0.00 -1.81 0.00 0.00 61.98 59.26 1umg s VAL 230 Cb -0.16 -1.26 -0.01 0.00 0.56 0.00 0.00 36.38 35.52 1umg s VAL 230 CO 0.31 -0.30 0.38 -0.83 -0.31 0.00 0.00 175.10 174.36 1umg s GLY 231 N -2.02 0.93 0.76 2.32 0.00 -1.26 -1.32 107.32 106.74 1umg s GLY 231 Ca 0.02 -1.20 -0.11 0.00 0.00 0.00 0.00 44.72 43.43 1umg s GLY 231 CO 0.02 -0.89 1.08 0.54 0.00 0.00 0.00 173.10 173.86 1umg s LYS 232 N -3.91 2.36 0.00 2.90 1.02 -1.26 -5.09 119.74 115.77 1umg s LYS 232 Ca 0.28 0.74 0.00 0.00 0.02 0.00 0.00 55.97 57.01 1umg s LYS 232 Cb 0.01 -1.94 0.00 0.00 -0.52 0.00 0.00 37.83 35.38 1umg s LYS 232 CO 0.12 -1.45 0.00 -0.40 -0.92 0.00 0.00 175.35 172.69 1umg n ASP 233 N -3.34 0.58 -3.45 2.83 5.68 -1.26 -4.70 116.55 112.89 1umg n ASP 233 Ca 0.07 -0.37 -0.16 0.00 -0.50 0.00 0.00 54.79 53.83 1umg n ASP 233 Cb 0.55 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.54 1umg n ASP 233 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1umg n ASP 234 N -0.90 -6.15 -4.81 -1.12 8.00 0.21 -4.90 116.55 106.90 1umg n ASP 234 Ca 0.00 -0.49 -0.32 0.00 0.71 0.00 0.00 54.79 54.69 1umg n ASP 234 Cb 0.00 -3.19 0.02 0.00 -0.02 0.00 0.00 41.12 37.93 1umg n ASP 234 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1umg s PRO 235 N -3.89 3.22 0.17 -0.24 0.04 -1.25 -4.73 135.00 128.32 1umg s PRO 235 Ca 0.05 1.15 0.08 0.00 0.04 0.00 0.00 61.00 62.31 1umg s PRO 235 Cb -0.01 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 1umg s PRO 235 CO 0.84 -0.89 -0.16 0.14 0.04 0.00 0.00 177.00 176.97 1umg s VAL 236 N -2.59 1.68 -0.10 -0.36 -7.23 -1.26 -1.48 120.40 109.06 1umg s VAL 236 Ca 0.62 -2.01 -0.15 0.00 -1.81 0.00 0.00 61.98 58.64 1umg s VAL 236 Cb -0.16 -1.87 0.03 0.00 0.56 0.00 0.00 36.38 34.95 1umg s VAL 236 CO 0.41 -0.46 0.38 -0.32 -0.31 0.00 0.00 175.10 174.79 1umg s MET 237 N -3.16 0.55 -0.12 4.82 0.00 0.30 -1.61 119.30 120.08 1umg s MET 237 Ca 0.17 0.30 0.02 0.00 0.00 0.00 0.00 55.69 56.18 1umg s MET 237 Cb -0.03 0.26 -0.00 0.00 0.00 0.00 0.00 34.83 35.05 1umg s MET 237 CO 0.06 -0.11 -0.20 0.42 0.00 0.00 0.00 175.02 175.19 1umg s ILE 238 N -0.34 2.38 -0.11 10.11 1.01 -0.49 -0.98 121.20 132.79 1umg s ILE 238 Ca -0.05 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 59.72 1umg s ILE 238 Cb -0.03 -1.95 0.02 0.00 0.01 0.00 0.00 42.46 40.50 1umg s ILE 238 CO 0.02 0.54 -0.14 -0.69 0.00 0.00 0.00 174.94 174.68 1umg s VAL 239 N 0.46 1.39 0.16 2.92 1.01 -0.44 -1.59 120.40 124.32 1umg s VAL 239 Ca -0.14 -0.57 -0.26 0.00 0.00 0.00 0.00 61.98 61.01 1umg s VAL 239 Cb -0.17 -1.29 -0.08 0.00 0.00 0.00 0.00 36.38 34.84 1umg s VAL 239 CO 0.06 0.42 0.81 -0.13 0.00 0.00 0.00 175.10 176.25 1umg s ARG 240 N 1.08 4.61 0.31 2.72 0.52 0.82 -1.35 118.95 127.66 1umg s ARG 240 Ca -0.05 1.21 0.10 0.00 -0.52 0.00 0.00 55.73 56.47 1umg s ARG 240 Cb -0.15 -3.28 -0.06 0.00 0.52 0.00 0.00 34.95 31.99 1umg s ARG 240 CO -0.03 0.52 -0.14 -0.51 0.02 0.00 0.00 175.30 175.16 1umg s LEU 241 N -0.98 2.66 0.37 2.53 1.43 -0.45 -4.52 118.68 119.72 1umg s LEU 241 Ca 0.37 -1.13 0.00 0.00 -1.03 0.00 0.00 54.13 52.35 1umg s LEU 241 Cb -0.23 -1.02 0.00 0.00 0.03 0.00 0.00 46.19 44.97 1umg s LEU 241 CO 0.27 -0.11 0.00 0.00 0.23 0.00 0.00 176.35 176.74 1umg n GLN 242 N -0.71 -2.51 -3.80 1.70 1.13 -0.37 -4.51 117.38 108.30 1umg n GLN 242 Ca -0.05 1.84 -0.31 0.00 -1.94 0.00 0.00 57.00 56.54 1umg n GLN 242 Cb 0.62 -3.01 0.02 0.00 0.11 0.00 0.00 30.24 27.98 1umg n GLN 242 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 1umg n HIS 243 N -3.91 -1.78 0.00 1.08 -0.00 -1.26 -1.97 115.22 107.38 1umg n HIS 243 Ca -0.02 0.52 0.00 0.00 0.46 0.00 0.00 57.72 58.68 1umg n HIS 243 Cb 0.55 -3.50 0.00 0.00 -0.12 0.00 0.00 29.99 26.91 1umg n HIS 243 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1umg n GLY 244 N -1.81 0.23 3.54 1.57 0.00 -1.26 -5.06 105.19 102.40 1umg n GLY 244 Ca -0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 1umg n GLY 244 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1umg s LEU 245 N 0.00 2.79 0.24 0.99 1.43 -0.83 -4.62 118.68 118.68 1umg s LEU 245 Ca 0.00 -0.99 -0.30 0.00 -1.03 0.00 0.00 54.13 51.81 1umg s LEU 245 Cb 0.00 -1.23 -0.14 0.00 0.03 0.00 0.00 46.19 44.85 1umg s LEU 245 CO 0.00 -0.05 1.17 -2.65 0.23 0.00 0.00 176.35 175.05 1umg n PRO 246 N -0.75 1.51 -1.33 1.29 -0.02 -1.26 -2.88 135.00 131.55 1umg n PRO 246 Ca -0.05 0.53 -0.32 0.00 -2.02 0.00 0.00 63.50 61.65 1umg n PRO 246 Cb 0.61 -2.03 0.09 0.00 -0.02 0.00 0.00 33.50 32.15 1umg n PRO 246 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1umg s ALA 247 N -0.55 2.25 0.25 3.55 0.00 -1.26 -1.24 121.76 124.75 1umg s ALA 247 Ca 0.65 0.36 -0.03 0.00 0.00 0.00 0.00 51.96 52.94 1umg s ALA 247 Cb -0.73 -3.30 0.49 0.00 0.00 0.00 0.00 23.12 19.58 1umg s ALA 247 CO 0.55 -1.73 1.72 1.25 0.00 0.00 0.00 175.76 177.56 1umg h LEU 248 N -0.91 0.28 -1.76 0.00 5.85 -1.94 0.86 115.31 117.68 1umg h LEU 248 Ca -0.44 0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.36 1umg h LEU 248 Cb 1.24 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.36 1umg h LEU 248 CO 0.51 0.09 -0.16 1.23 -0.34 0.00 0.00 178.44 179.77 1umg h GLY 249 N 0.44 0.00 1.73 3.75 0.00 -1.98 -0.08 103.07 106.93 1umg h GLY 249 Ca 0.43 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.51 1umg h GLY 249 CO -0.42 0.00 -1.13 0.83 0.00 0.00 0.00 176.54 175.82 1umg h GLU 250 N 0.00 0.21 -0.34 4.80 5.08 -1.20 -0.88 114.58 122.25 1umg h GLU 250 Ca -0.00 -0.33 -0.11 0.00 -1.00 0.00 0.00 59.36 57.92 1umg h GLU 250 Cb 0.32 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1umg h GLU 250 CO 0.02 1.13 -0.23 0.00 -1.00 0.00 0.00 179.01 178.93 1umg h ALA 251 N 0.73 0.49 0.00 3.43 0.00 -0.67 -3.01 119.26 120.22 1umg h ALA 251 Ca -0.09 -0.38 -0.10 0.00 0.00 0.00 0.00 54.91 54.34 1umg h ALA 251 Cb 1.85 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.51 1umg h ALA 251 CO 0.18 0.46 -0.47 -0.07 0.00 0.00 0.00 179.25 179.35 1umg h LEU 252 N 0.53 0.00 -1.60 0.00 3.38 -1.04 -2.63 115.31 113.95 1umg h LEU 252 Ca 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1umg h LEU 252 Cb 0.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1umg h LEU 252 CO 0.06 0.47 0.04 -0.08 0.09 0.00 0.00 178.44 179.02 1umg h GLU 253 N 0.00 0.29 0.00 1.13 4.57 -1.03 -1.60 114.58 117.94 1umg h GLU 253 Ca -0.00 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 1umg h GLU 253 Cb 0.88 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.42 1umg h GLU 253 CO 0.06 0.29 0.00 0.00 -1.18 0.00 0.00 179.01 178.18 1umg n ALA 254 N -2.50 1.62 0.17 2.92 0.00 -0.99 -2.08 120.51 119.65 1umg n ALA 254 Ca 0.00 -0.03 0.04 0.00 0.00 0.00 0.00 53.44 53.44 1umg n ALA 254 Cb 0.15 -1.23 0.05 0.00 0.00 0.00 0.00 19.45 18.42 1umg n ALA 254 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1umg n PHE 255 N -1.56 0.10 0.26 0.00 3.72 -0.62 -4.55 117.46 114.80 1umg n PHE 255 Ca 0.03 -0.16 0.11 0.00 -0.05 0.00 0.00 57.45 57.38 1umg n PHE 255 Cb 0.16 -0.01 0.69 0.00 -0.94 0.00 0.00 39.48 39.38 1umg n PHE 255 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1umg h ALA 256 N 1.38 1.35 -2.77 4.37 0.00 -1.22 -3.38 119.26 118.98 1umg h ALA 256 Ca 0.00 -0.12 -0.66 0.00 0.00 0.00 0.00 54.91 54.13 1umg h ALA 256 Cb 0.41 -0.02 -0.18 0.00 0.00 0.00 0.00 17.79 18.00 1umg h ALA 256 CO 0.00 0.17 -0.48 0.12 0.00 0.00 0.00 179.25 179.05 1umg s PHE 257 N -4.27 3.23 -1.23 0.00 5.36 -1.26 -4.65 117.98 115.16 1umg s PHE 257 Ca -0.03 -0.08 -0.19 0.00 -0.96 0.00 0.00 56.93 55.66 1umg s PHE 257 Cb 0.14 -2.45 0.06 0.00 -0.34 0.00 0.00 43.02 40.42 1umg s PHE 257 CO 0.60 -0.29 1.69 -1.25 -1.46 0.00 0.00 175.22 174.51 1umg s PRO 258 N 1.75 3.81 0.70 10.12 0.04 -1.26 -4.97 135.00 145.19 1umg s PRO 258 Ca 0.07 -1.74 -0.13 0.00 0.04 0.00 0.00 61.00 59.23 1umg s PRO 258 Cb -0.17 -5.48 0.02 0.00 0.04 0.00 0.00 34.50 28.91 1umg s PRO 258 CO 0.11 -2.34 1.09 -3.38 0.04 0.00 0.00 177.00 172.52 1umg s HIS 259 N 4.78 2.70 0.01 0.56 -3.43 -1.26 -4.20 115.29 114.46 1umg s HIS 259 Ca 0.53 1.53 -0.30 0.00 -0.80 0.00 0.00 55.06 56.02 1umg s HIS 259 Cb 0.03 -3.08 -0.04 0.00 -1.43 0.00 0.00 32.58 28.06 1umg s HIS 259 CO 0.04 -1.61 1.17 -0.51 -2.00 0.00 0.00 174.74 171.83 1umg s LEU 260 N -5.27 4.34 0.12 5.38 1.43 -1.26 -0.97 118.68 122.44 1umg s LEU 260 Ca 0.64 1.90 0.08 0.00 -1.03 0.00 0.00 54.13 55.71 1umg s LEU 260 Cb -0.18 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.43 1umg s LEU 260 CO 0.48 -0.48 -0.18 0.68 0.23 0.00 0.00 176.35 177.07 1umg s VAL 261 N 1.46 1.61 0.25 -1.59 -7.23 0.63 -4.86 120.40 110.66 1umg s VAL 261 Ca 0.57 -1.67 -0.30 0.00 -1.81 0.00 0.00 61.98 58.78 1umg s VAL 261 Cb -0.27 -1.59 -0.09 0.00 0.56 0.00 0.00 36.38 34.99 1umg s VAL 261 CO 0.27 -0.22 1.08 -2.16 -0.31 0.00 0.00 175.10 173.75 1umg s PRO 262 N -2.31 4.66 0.00 4.82 0.04 -1.26 -1.51 135.00 139.44 1umg s PRO 262 Ca 0.09 1.74 0.00 0.00 0.04 0.00 0.00 61.00 62.87 1umg s PRO 262 Cb -0.08 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 31.24 1umg s PRO 262 CO 0.05 0.21 0.00 0.41 0.04 0.00 0.00 177.00 177.71 1umg n GLY 263 N 1.47 0.73 7.00 0.56 0.00 0.28 -3.16 105.19 112.06 1umg n GLY 263 Ca -0.00 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1umg n GLY 263 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1umg n TRP 264 N 0.00 0.00 -1.66 1.61 -0.00 0.83 -1.19 117.44 117.03 1umg n TRP 264 Ca 0.00 0.00 -0.49 0.00 -0.00 0.00 0.00 57.50 57.01 1umg n TRP 264 Cb 0.00 0.06 -0.05 0.00 -0.00 0.00 0.00 31.31 31.32 1umg n TRP 264 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 177.69 177.57 1umg n MET 265 N 8.08 1.81 -2.27 5.87 1.56 -1.19 -2.13 117.12 128.85 1umg n MET 265 Ca 0.00 0.65 -0.11 0.00 -0.27 0.00 0.00 57.70 57.98 1umg n MET 265 Cb 0.00 -2.40 -0.01 0.00 2.15 0.00 0.00 33.22 32.96 1umg n MET 265 CO 0.00 0.00 0.00 0.54 -0.73 0.00 0.00 175.97 175.78 1umg n ARG 266 N 4.06 -2.14 -3.07 2.12 1.74 -1.26 -1.56 116.66 116.54 1umg n ARG 266 Ca 0.19 0.55 -0.18 0.00 -0.77 0.00 0.00 57.85 57.64 1umg n ARG 266 Cb 0.25 -5.07 -0.01 0.00 -1.02 0.00 0.00 32.46 26.61 1umg n ARG 266 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1umg n GLY 267 N -0.68 -0.48 0.40 -0.13 0.00 -0.91 -3.86 105.19 99.54 1umg n GLY 267 Ca -0.13 0.05 0.05 0.00 0.00 0.00 0.00 46.02 45.99 1umg n GLY 267 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1umg n SER 268 N -2.04 1.11 -4.20 1.61 7.64 -0.60 -2.68 113.62 114.46 1umg n SER 268 Ca -0.03 -2.55 -0.12 0.00 1.01 0.00 0.00 58.87 57.18 1umg n SER 268 Cb 0.54 -0.32 -0.10 0.00 -1.01 0.00 0.00 64.21 63.32 1umg n SER 268 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1umg s HIS 269 N -1.35 1.15 -0.14 1.43 3.76 -0.34 -0.35 115.29 119.46 1umg s HIS 269 Ca 0.17 -1.34 -0.03 0.00 -0.15 0.00 0.00 55.06 53.71 1umg s HIS 269 Cb 0.16 -0.58 -0.03 0.00 1.11 0.00 0.00 32.58 33.25 1umg s HIS 269 CO -0.00 -0.60 -0.02 0.71 -0.85 0.00 0.00 174.74 173.98 1umg s TYR 270 N -4.11 3.07 0.09 1.40 2.02 0.12 0.99 117.35 120.93 1umg s TYR 270 Ca 0.37 -0.12 -0.12 0.00 -0.37 0.00 0.00 57.07 56.83 1umg s TYR 270 Cb 0.07 -1.91 0.01 0.00 -0.40 0.00 0.00 41.96 39.73 1umg s TYR 270 CO 0.11 0.13 0.27 0.20 -1.57 0.00 0.00 175.55 174.69 1umg s GLY 271 N -0.01 -0.06 0.20 0.71 0.00 -0.57 -4.83 107.32 102.76 1umg s GLY 271 Ca 0.02 -0.31 -0.30 0.00 0.00 0.00 0.00 44.72 44.13 1umg s GLY 271 CO 0.02 -0.52 1.23 2.56 0.00 0.00 0.00 173.10 176.39 1umg s PRO 272 N -3.51 4.46 -0.12 2.90 0.04 -1.26 -0.27 135.00 137.24 1umg s PRO 272 Ca 0.02 1.94 -0.29 0.00 0.04 0.00 0.00 61.00 62.70 1umg s PRO 272 Cb 0.03 -3.22 -0.02 0.00 0.04 0.00 0.00 34.50 31.33 1umg s PRO 272 CO -0.09 -0.12 1.28 -1.17 0.04 0.00 0.00 177.00 176.94 1umg s LEU 273 N -0.34 4.22 -0.38 -3.56 2.96 -0.15 -3.79 118.68 117.65 1umg s LEU 273 Ca 0.53 1.79 -0.08 0.00 -0.22 0.00 0.00 54.13 56.15 1umg s LEU 273 Cb -0.34 -3.54 0.05 0.00 0.50 0.00 0.00 46.19 42.86 1umg s LEU 273 CO 0.38 -0.73 0.18 -0.32 -1.32 0.00 0.00 176.35 174.54 1umg s MET 274 N 3.16 2.61 0.01 1.98 -2.45 0.14 -4.46 119.30 120.29 1umg s MET 274 Ca 0.57 -1.29 -0.30 0.00 -1.25 0.00 0.00 55.69 53.41 1umg s MET 274 Cb -0.24 -3.62 -0.06 0.00 1.25 0.00 0.00 34.83 32.17 1umg s MET 274 CO 0.18 -0.79 1.37 -2.14 1.05 0.00 0.00 175.02 174.69 1umg s PRO 275 N 1.42 4.30 0.17 4.11 0.02 -1.26 -1.32 135.00 142.43 1umg s PRO 275 Ca 0.01 1.95 0.02 0.00 0.02 0.00 0.00 61.00 62.99 1umg s PRO 275 Cb -0.21 -3.52 -0.05 0.00 0.02 0.00 0.00 34.50 30.74 1umg s PRO 275 CO 0.03 -0.53 0.00 0.14 -0.33 0.00 0.00 177.00 176.30 1umg s VAL 276 N 2.17 0.65 0.93 3.83 -7.23 -0.05 -4.80 120.40 115.90 1umg s VAL 276 Ca 0.63 -1.97 -0.13 0.00 -1.81 0.00 0.00 61.98 58.70 1umg s VAL 276 Cb -0.31 -2.08 0.15 0.00 0.56 0.00 0.00 36.38 34.69 1umg s VAL 276 CO 0.27 -0.50 1.16 -0.94 -0.31 0.00 0.00 175.10 174.77 1umg s SER 277 N -3.16 3.39 0.23 4.85 1.04 -1.26 -4.45 113.70 114.35 1umg s SER 277 Ca 0.23 0.84 -0.08 0.00 0.48 0.00 0.00 55.95 57.42 1umg s SER 277 Cb 0.06 -1.32 0.21 0.00 0.10 0.00 0.00 66.02 65.07 1umg s SER 277 CO 0.03 -2.61 1.90 -0.61 0.98 0.00 0.00 173.24 172.93 1umg h GLN 278 N -1.54 1.14 0.00 4.02 5.75 -1.96 -2.13 115.11 120.39 1umg h GLN 278 Ca -0.49 -0.07 -0.05 0.00 -0.15 0.00 0.00 58.65 57.90 1umg h GLN 278 Cb 1.32 -0.26 -0.01 0.00 1.07 0.00 0.00 27.48 29.61 1umg h GLN 278 CO 0.58 0.75 -0.22 0.07 -2.65 0.00 0.00 178.83 177.36 1umg h ARG 279 N 1.17 0.00 -0.62 1.69 0.11 -1.98 -2.54 114.38 112.21 1umg h ARG 279 Ca 0.32 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.40 1umg h ARG 279 Cb -0.12 0.00 0.00 0.00 1.11 0.00 0.00 29.97 30.96 1umg h ARG 279 CO -0.07 0.22 0.00 -0.25 0.10 0.00 0.00 179.97 179.96 1umg n ASP 280 N -3.57 3.40 -3.62 0.08 8.00 -0.85 -4.72 116.55 115.27 1umg n ASP 280 Ca -0.01 -1.99 -0.41 0.00 0.71 0.00 0.00 54.79 53.09 1umg n ASP 280 Cb 0.36 -0.41 -0.01 0.00 -0.02 0.00 0.00 41.12 41.04 1umg n ASP 280 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1umg n ALA 281 N 1.37 6.18 -3.19 2.24 0.00 -0.93 -4.80 120.51 121.39 1umg n ALA 281 Ca 0.21 -3.91 -0.13 0.00 0.00 0.00 0.00 53.44 49.61 1umg n ALA 281 Cb 0.54 -3.28 -0.09 0.00 0.00 0.00 0.00 19.45 16.62 1umg n ALA 281 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1umg s LYS 282 N 1.77 0.60 -0.18 0.00 -2.85 -1.26 -0.56 119.74 117.25 1umg s LYS 282 Ca 0.52 -0.26 -0.18 0.00 -1.00 0.00 0.00 55.97 55.05 1umg s LYS 282 Cb 0.15 0.26 -0.04 0.00 -2.06 0.00 0.00 37.83 36.14 1umg s LYS 282 CO -0.06 -0.16 0.49 0.00 0.10 0.00 0.00 175.35 175.72 1umg s ALA 283 N -1.33 3.53 0.00 0.59 0.00 -0.95 -4.87 121.76 118.73 1umg s ALA 283 Ca -0.14 -0.37 0.00 0.00 0.00 0.00 0.00 51.96 51.46 1umg s ALA 283 Cb -0.06 -2.75 0.00 0.00 0.00 0.00 0.00 23.12 20.31 1umg s ALA 283 CO 0.03 -0.31 0.00 0.25 0.00 0.00 0.00 175.76 175.73 1umg n THR 284 N 4.30 0.00 -1.64 0.00 -2.24 -0.61 -4.57 114.28 109.53 1umg n THR 284 Ca -0.06 0.00 -0.50 0.00 -2.27 0.00 0.00 64.05 61.22 1umg n THR 284 Cb 0.51 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.68 1umg n THR 284 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1umg n ARG 285 N 0.00 1.79 -2.73 -0.78 0.63 -1.07 -0.70 116.66 113.80 1umg n ARG 285 Ca 0.00 0.63 -0.20 0.00 -0.92 0.00 0.00 57.85 57.36 1umg n ARG 285 Cb 0.00 -2.56 0.01 0.00 0.45 0.00 0.00 32.46 30.36 1umg n ARG 285 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1umg n PHE 286 N 7.34 -1.51 -3.50 -0.14 7.35 -1.26 -1.22 117.46 124.52 1umg n PHE 286 Ca 0.27 0.23 -0.21 0.00 -0.76 0.00 0.00 57.45 56.98 1umg n PHE 286 Cb 0.26 -3.76 0.08 0.00 0.35 0.00 0.00 39.48 36.41 1umg n PHE 286 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 1umg n ASP 287 N -2.17 -5.37 0.00 -2.13 8.00 0.13 -3.14 116.55 111.86 1umg n ASP 287 Ca -0.15 -0.52 0.00 0.00 0.71 0.00 0.00 54.79 54.83 1umg n ASP 287 Cb 0.63 -4.77 0.00 0.00 -0.02 0.00 0.00 41.12 36.96 1umg n ASP 287 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1umg n GLY 288 N -1.78 1.15 3.56 0.44 0.00 -0.36 -4.42 105.19 103.78 1umg n GLY 288 Ca -0.04 0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 1umg n GLY 288 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1umg s PRO 289 N 4.62 -0.30 0.16 1.61 0.02 -1.25 -1.57 135.00 138.30 1umg s PRO 289 Ca 0.00 0.94 -0.33 0.00 0.02 0.00 0.00 61.00 61.62 1umg s PRO 289 Cb 0.00 -1.62 -0.16 0.00 0.02 0.00 0.00 34.50 32.75 1umg s PRO 289 CO 0.00 -3.34 1.22 -2.30 -0.33 0.00 0.00 177.00 172.25 1umg n PRO 290 N -4.66 1.26 -4.36 5.54 -0.02 -1.25 -4.79 135.00 126.72 1umg n PRO 290 Ca 0.05 0.45 -0.35 0.00 -2.02 0.00 0.00 63.50 61.63 1umg n PRO 290 Cb 0.54 -1.99 -0.10 0.00 -0.02 0.00 0.00 33.50 31.94 1umg n PRO 290 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1umg s ARG 291 N -0.22 3.09 -0.17 -0.52 1.81 -0.94 -0.69 118.95 121.31 1umg s ARG 291 Ca 0.75 -0.42 0.01 0.00 -1.72 0.00 0.00 55.73 54.35 1umg s ARG 291 Cb -0.85 -2.82 0.02 0.00 -0.45 0.00 0.00 34.95 30.86 1umg s ARG 291 CO 0.51 0.64 -0.17 -1.17 -0.68 0.00 0.00 175.30 174.43 1umg s LEU 292 N -0.71 2.04 -0.13 2.53 2.96 -0.43 -1.54 118.68 123.40 1umg s LEU 292 Ca 0.11 -0.64 -0.05 0.00 -0.22 0.00 0.00 54.13 53.32 1umg s LEU 292 Cb -0.12 -1.35 -0.04 0.00 0.50 0.00 0.00 46.19 45.18 1umg s LEU 292 CO 0.02 -0.04 0.06 -0.22 -1.32 0.00 0.00 176.35 174.85 1umg s LEU 293 N 1.36 3.87 -0.09 -0.68 2.96 0.40 -0.87 118.68 125.63 1umg s LEU 293 Ca 0.04 0.20 0.01 0.00 -0.22 0.00 0.00 54.13 54.15 1umg s LEU 293 Cb -0.13 -1.94 0.02 0.00 0.50 0.00 0.00 46.19 44.64 1umg s LEU 293 CO -0.11 0.30 -0.10 -0.83 -1.32 0.00 0.00 176.35 174.29 1umg s GLY 294 N -0.42 0.82 -0.08 7.98 0.00 -1.26 -1.02 107.32 113.34 1umg s GLY 294 Ca 0.09 -0.50 0.04 0.00 0.00 0.00 0.00 44.72 44.35 1umg s GLY 294 CO 0.02 0.47 -0.20 1.08 0.00 0.00 0.00 173.10 174.47 1umg s LEU 295 N 1.20 1.93 -0.13 0.66 1.43 0.12 -1.08 118.68 122.81 1umg s LEU 295 Ca -0.04 -0.46 -0.08 0.00 -1.03 0.00 0.00 54.13 52.52 1umg s LEU 295 Cb -0.14 -1.18 -0.04 0.00 0.03 0.00 0.00 46.19 44.85 1umg s LEU 295 CO -0.03 0.13 0.15 -0.83 0.23 0.00 0.00 176.35 176.00 1umg s GLY 296 N 0.37 2.15 0.22 -3.19 0.00 -0.38 -0.44 107.32 106.06 1umg s GLY 296 Ca -0.15 -0.63 0.00 0.00 0.00 0.00 0.00 44.72 43.94 1umg s GLY 296 CO 0.06 -0.26 0.14 -1.36 0.00 0.00 0.00 173.10 171.68 1umg s PHE 297 N -0.78 1.28 -0.07 1.90 0.08 -0.38 -1.52 117.98 118.49 1umg s PHE 297 Ca 0.14 -1.38 0.01 0.00 0.12 0.00 0.00 56.93 55.83 1umg s PHE 297 Cb -0.12 -0.63 0.02 0.00 -0.57 0.00 0.00 43.02 41.72 1umg s PHE 297 CO 0.03 -0.61 -0.08 -0.80 -0.10 0.00 0.00 175.22 173.66 1umg s ASN 298 N -3.21 1.58 -0.27 1.36 -0.87 -0.64 -1.28 114.94 111.60 1umg s ASN 298 Ca 0.39 -0.23 -0.11 0.00 -1.57 0.00 0.00 52.86 51.34 1umg s ASN 298 Cb 0.07 -0.68 -0.05 0.00 -0.02 0.00 0.00 41.25 40.57 1umg s ASN 298 CO 0.14 -0.04 0.18 -0.69 -2.57 0.00 0.00 177.10 174.12 1umg s VAL 299 N 1.06 5.30 -0.24 1.60 1.01 -0.59 -0.91 120.40 127.63 1umg s VAL 299 Ca -0.08 0.16 -0.01 0.00 0.00 0.00 0.00 61.98 62.06 1umg s VAL 299 Cb -0.14 -3.52 0.07 0.00 0.00 0.00 0.00 36.38 32.79 1umg s VAL 299 CO -0.01 0.26 0.02 -0.75 0.00 0.00 0.00 175.10 174.63 1umg s LYS 300 N 1.67 1.03 -1.42 2.72 2.47 -0.54 -4.03 119.74 121.64 1umg s LYS 300 Ca 0.07 -0.80 -0.07 0.00 -1.56 0.00 0.00 55.97 53.60 1umg s LYS 300 Cb -0.16 -2.29 0.04 0.00 -1.46 0.00 0.00 37.83 33.97 1umg s LYS 300 CO 0.10 -0.71 0.87 0.09 0.16 0.00 0.00 175.35 175.86 1umg n ASN 301 N 4.85 -3.23 0.00 1.43 3.02 -1.26 -1.39 115.26 118.67 1umg n ASN 301 Ca -0.08 -0.78 0.00 0.00 -0.03 0.00 0.00 54.58 53.69 1umg n ASN 301 Cb 0.45 -4.06 0.00 0.00 -0.61 0.00 0.00 39.78 35.56 1umg n ASN 301 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1umg n GLY 302 N -1.65 0.95 3.90 7.41 0.00 -1.26 -5.03 105.19 109.52 1umg n GLY 302 Ca -0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 1umg n GLY 302 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1umg s ARG 303 N -0.06 3.47 -0.46 1.61 3.52 -0.49 -3.89 118.95 122.66 1umg s ARG 303 Ca 0.00 -0.29 -0.14 0.00 -0.13 0.00 0.00 55.73 55.16 1umg s ARG 303 Cb 0.00 -3.08 0.07 0.00 -1.56 0.00 0.00 34.95 30.38 1umg s ARG 303 CO 0.00 0.65 0.36 -0.51 -0.81 0.00 0.00 175.30 175.00 1umg s LEU 304 N -2.03 5.49 -0.26 -0.88 1.43 -1.26 -1.47 118.68 119.70 1umg s LEU 304 Ca 0.29 -1.30 -0.17 0.00 -1.03 0.00 0.00 54.13 51.92 1umg s LEU 304 Cb -0.13 -2.15 -0.03 0.00 0.03 0.00 0.00 46.19 43.91 1umg s LEU 304 CO 0.20 -0.61 0.49 -0.69 0.23 0.00 0.00 176.35 175.97 1umg s VAL 305 N 1.62 5.09 -3.32 -1.59 1.01 -0.09 -4.88 120.40 118.24 1umg s VAL 305 Ca 0.04 0.81 0.00 0.00 0.00 0.00 0.00 61.98 62.83 1umg s VAL 305 Cb -0.23 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.34 1umg s VAL 305 CO 0.06 0.09 0.00 0.61 0.00 0.00 0.00 175.10 175.87 1umg n GLY 306 N 4.46 0.68 3.99 4.51 0.00 -1.26 -1.62 105.19 115.95 1umg n GLY 306 Ca -0.05 -1.86 -0.22 0.00 0.00 0.00 0.00 46.02 43.89 1umg n GLY 306 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1umg s PRO 307 N -1.33 2.20 -0.11 1.61 0.04 -1.26 -5.09 135.00 131.06 1umg s PRO 307 Ca 0.00 -1.01 0.02 0.00 0.04 0.00 0.00 61.00 60.05 1umg s PRO 307 Cb 0.00 -2.45 -0.01 0.00 0.04 0.00 0.00 34.50 32.08 1umg s PRO 307 CO 0.00 -0.99 -0.19 -0.08 0.04 0.00 0.00 177.00 175.78 1umg s THR 308 N -2.88 2.49 -0.57 1.26 -1.32 -0.57 -4.92 115.64 109.13 1umg s THR 308 Ca 0.61 -0.86 -0.28 0.00 -1.21 0.00 0.00 61.69 59.95 1umg s THR 308 Cb -0.08 -2.00 0.01 0.00 -1.51 0.00 0.00 72.50 68.92 1umg s THR 308 CO 0.40 0.54 1.49 -0.62 -2.21 0.00 0.00 174.62 174.23 1umg s ASP 309 N 0.36 6.00 0.09 8.08 -1.08 -1.26 -1.24 116.67 127.62 1umg s ASP 309 Ca -0.15 0.29 -0.20 0.00 -0.52 0.00 0.00 52.55 51.97 1umg s ASP 309 Cb -0.17 -2.54 -0.09 0.00 -1.46 0.00 0.00 42.92 38.66 1umg s ASP 309 CO 0.07 -1.81 1.64 -0.07 0.52 0.00 0.00 175.17 175.52 1umg h LEU 310 N 13.58 0.27 -0.22 -1.34 3.38 -1.47 -3.20 115.31 126.30 1umg h LEU 310 Ca -0.27 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1umg h LEU 310 Cb 1.10 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1umg h LEU 310 CO 1.18 0.35 -0.13 0.49 0.09 0.00 0.00 178.44 180.42 1umg n PHE 311 N -4.84 0.00 -2.33 1.13 3.72 -1.26 -4.41 117.46 109.47 1umg n PHE 311 Ca -0.04 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.93 1umg n PHE 311 Cb 0.12 -0.20 0.00 0.00 -0.94 0.00 0.00 39.48 38.46 1umg n PHE 311 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1umg n ASP 312 N -1.00 4.68 -3.58 4.37 2.03 -1.21 -4.46 116.55 117.38 1umg n ASP 312 Ca 0.13 -2.94 -0.16 0.00 0.52 0.00 0.00 54.79 52.34 1umg n ASP 312 Cb 0.29 -1.64 -0.07 0.00 -0.72 0.00 0.00 41.12 38.98 1umg n ASP 312 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1umg s ASP 313 N 3.04 -0.60 0.61 1.67 2.15 -1.26 -4.99 116.67 117.29 1umg s ASP 313 Ca 0.47 0.77 0.35 0.00 0.43 0.00 0.00 52.55 54.58 1umg s ASP 313 Cb 0.07 0.69 2.00 0.00 -0.30 0.00 0.00 42.92 45.38 1umg s ASP 313 CO -0.00 -0.50 2.27 1.55 -0.17 0.00 0.00 175.17 178.32 1umg h PRO 314 N 3.59 0.00 0.00 4.34 0.13 -1.97 -2.50 132.00 135.59 1umg h PRO 314 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1umg h PRO 314 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1umg h PRO 314 CO 0.32 0.01 0.00 0.00 -0.23 0.00 0.00 178.00 178.11 1umg n ALA 315 N -2.22 1.17 -0.11 -0.56 0.00 -1.26 -1.31 120.51 116.23 1umg n ALA 315 Ca -0.03 0.09 0.04 0.00 0.00 0.00 0.00 53.44 53.54 1umg n ALA 315 Cb 0.10 -1.20 0.11 0.00 0.00 0.00 0.00 19.45 18.47 1umg n ALA 315 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1umg n PHE 316 N -1.90 0.34 -0.26 0.00 3.72 -0.94 -4.66 117.46 113.76 1umg n PHE 316 Ca 0.00 -0.47 -0.07 0.00 -0.05 0.00 0.00 57.45 56.86 1umg n PHE 316 Cb 0.06 -0.03 0.05 0.00 -0.94 0.00 0.00 39.48 38.62 1umg n PHE 316 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1umg h ASP 317 N 1.58 1.01 0.70 4.37 3.32 -1.33 -1.83 116.42 124.23 1umg h ASP 317 Ca 0.00 -0.18 -0.11 0.00 0.02 0.00 0.00 57.03 56.75 1umg h ASP 317 Cb 0.66 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 1umg h ASP 317 CO 0.00 0.92 -0.54 -0.33 -1.72 0.00 0.00 179.24 177.57 1umg h GLU 318 N 1.04 0.00 -0.39 3.56 4.39 -1.83 -1.05 114.58 120.30 1umg h GLU 318 Ca 0.24 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.92 1umg h GLU 318 Cb 0.24 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.87 1umg h GLU 318 CO -0.02 0.54 0.19 1.15 -1.16 0.00 0.00 179.01 179.71 1umg h THR 319 N 0.00 1.17 -0.42 1.13 2.02 -1.71 -0.17 112.91 114.93 1umg h THR 319 Ca -0.01 -0.49 -0.12 0.00 0.77 0.00 0.00 66.41 66.56 1umg h THR 319 Cb 1.04 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 68.21 1umg h THR 319 CO 0.07 0.19 -0.23 0.03 0.37 0.00 0.00 175.52 175.95 1umg h ARG 320 N 0.50 0.86 -0.60 6.66 3.08 -1.11 -1.08 114.38 122.70 1umg h ARG 320 Ca 0.13 -0.36 -0.06 0.00 0.07 0.00 0.00 59.98 59.76 1umg h ARG 320 Cb 0.12 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 1umg h ARG 320 CO -0.02 1.00 0.14 -0.09 -1.07 0.00 0.00 179.97 179.94 1umg h ARG 321 N 0.75 0.96 -0.66 0.04 2.43 -0.94 -1.10 114.38 115.84 1umg h ARG 321 Ca 0.10 -0.23 -0.05 0.00 -0.81 0.00 0.00 59.98 58.99 1umg h ARG 321 Cb 0.77 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 30.17 1umg h ARG 321 CO 0.06 0.88 0.21 1.25 -1.51 0.00 0.00 179.97 180.87 1umg h LEU 322 N 0.87 0.94 -0.75 3.80 5.85 -0.86 -0.97 115.31 124.19 1umg h LEU 322 Ca 0.19 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1umg h LEU 322 Cb 0.36 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 1umg h LEU 322 CO 0.00 0.87 0.49 0.00 -0.34 0.00 0.00 178.44 179.46 1umg h ALA 323 N 1.25 0.95 -0.59 1.25 0.00 -0.68 0.91 119.26 122.36 1umg h ALA 323 Ca 0.22 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 1umg h ALA 323 Cb 0.27 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1umg h ALA 323 CO -0.01 0.39 -0.02 -0.91 0.00 0.00 0.00 179.25 178.69 1umg h ASN 324 N 1.02 1.03 -0.24 0.00 2.35 -0.62 0.11 115.58 119.24 1umg h ASN 324 Ca 0.27 -0.30 -0.04 0.00 -0.55 0.00 0.00 56.30 55.68 1umg h ASN 324 Cb -0.10 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 37.99 1umg h ASN 324 CO -0.06 1.10 -0.01 0.40 -1.65 0.00 0.00 177.43 177.21 1umg h ILE 325 N 0.96 1.26 -0.45 2.81 2.04 -0.78 -2.23 117.51 121.12 1umg h ILE 325 Ca 0.17 -0.92 -0.08 0.00 1.00 0.00 0.00 64.86 65.02 1umg h ILE 325 Cb 0.58 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 1umg h ILE 325 CO 0.03 0.29 -0.04 0.58 0.00 0.00 0.00 178.15 179.01 1umg h VAL 326 N 0.20 1.25 -0.66 1.67 2.07 -0.76 -1.93 116.25 118.08 1umg h VAL 326 Ca 0.07 -1.05 0.01 0.00 0.82 0.00 0.00 66.70 66.55 1umg h VAL 326 Cb 0.43 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 1umg h VAL 326 CO 0.01 0.36 0.43 0.00 0.02 0.00 0.00 177.57 178.40 1umg h ALA 327 N 1.25 0.85 -0.38 1.67 0.00 -0.59 0.79 119.26 122.84 1umg h ALA 327 Ca 0.13 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1umg h ALA 327 Cb 0.49 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1umg h ALA 327 CO 0.03 0.24 0.07 0.22 0.00 0.00 0.00 179.25 179.80 1umg h ASP 328 N 0.87 0.60 -0.08 0.00 3.58 -1.11 -1.57 116.42 118.72 1umg h ASP 328 Ca 0.25 -0.25 0.02 0.00 0.42 0.00 0.00 57.03 57.46 1umg h ASP 328 Cb -0.07 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 40.81 1umg h ASP 328 CO -0.07 0.70 -0.02 0.22 -2.88 0.00 0.00 179.24 177.19 1umg h TYR 329 N 0.48 -0.05 -0.63 0.28 3.20 -0.87 -2.63 116.97 116.75 1umg h TYR 329 Ca 0.12 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.01 1umg h TYR 329 Cb 0.35 0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.62 1umg h TYR 329 CO 0.02 -0.04 0.40 0.52 -1.64 0.00 0.00 178.16 177.42 1umg h MET 330 N -0.01 0.78 -0.02 1.82 2.86 -0.75 -2.53 114.93 117.07 1umg h MET 330 Ca 0.04 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.64 1umg h MET 330 Cb 0.07 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.55 1umg h MET 330 CO -0.08 0.51 0.03 0.00 1.06 0.00 0.00 176.91 178.43 1umg h ARG 331 N 0.80 0.00 0.00 1.72 2.47 -0.94 -0.97 114.38 117.45 1umg h ARG 331 Ca 0.24 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.96 1umg h ARG 331 Cb -0.03 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.29 1umg h ARG 331 CO -0.08 0.00 0.00 0.54 0.56 0.00 0.00 179.97 180.99 1umg n ARG 332 N -3.80 0.17 0.05 0.04 1.74 -0.95 -1.91 116.66 112.00 1umg n ARG 332 Ca -0.02 0.16 0.13 0.00 -0.77 0.00 0.00 57.85 57.34 1umg n ARG 332 Cb 0.11 -1.50 0.35 0.00 -1.02 0.00 0.00 32.46 30.40 1umg n ARG 332 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1umg n HIS 333 N -1.35 0.48 -4.39 -1.55 8.25 -0.37 -5.02 115.22 111.27 1umg n HIS 333 Ca 0.07 0.14 0.00 0.00 -0.26 0.00 0.00 57.72 57.67 1umg n HIS 333 Cb 0.15 -0.65 0.00 0.00 1.12 0.00 0.00 29.99 30.60 1umg n HIS 333 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1umg n GLY 334 N 1.39 2.68 0.90 -1.41 0.00 -0.80 -2.26 105.19 105.69 1umg n GLY 334 Ca 0.05 -0.37 -0.01 0.00 0.00 0.00 0.00 46.02 45.70 1umg n GLY 334 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1umg n PRO 335 N 13.08 1.09 -4.06 1.61 -0.04 -1.26 -4.50 135.00 140.93 1umg n PRO 335 Ca 0.00 -0.13 -0.34 0.00 -0.04 0.00 0.00 63.50 62.99 1umg n PRO 335 Cb 0.00 -1.20 -0.07 0.00 -0.04 0.00 0.00 33.50 32.20 1umg n PRO 335 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1umg s PHE 336 N -0.43 3.37 0.60 0.54 0.08 -0.96 -4.77 117.98 116.42 1umg s PHE 336 Ca 0.02 0.28 -0.17 0.00 0.12 0.00 0.00 56.93 57.19 1umg s PHE 336 Cb 0.02 -1.79 -0.03 0.00 -0.57 0.00 0.00 43.02 40.65 1umg s PHE 336 CO 0.01 0.59 1.10 -1.64 -0.10 0.00 0.00 175.22 175.17 1umg s MET 337 N -1.61 3.14 0.00 0.44 -1.94 -1.26 -1.26 119.30 116.81 1umg s MET 337 Ca 0.22 1.41 0.20 0.00 -1.71 0.00 0.00 55.69 55.80 1umg s MET 337 Cb -0.12 -1.99 1.02 0.00 2.01 0.00 0.00 34.83 35.75 1umg s MET 337 CO 0.12 -0.99 1.68 -0.35 -0.01 0.00 0.00 175.02 175.48 1umg n PRO 338 N -1.92 1.21 -0.06 2.03 -0.04 -1.26 -4.80 135.00 130.16 1umg n PRO 338 Ca 0.10 -0.32 -0.14 0.00 -0.04 0.00 0.00 63.50 63.10 1umg n PRO 338 Cb 0.52 -1.33 -0.07 0.00 -0.04 0.00 0.00 33.50 32.59 1umg n PRO 338 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1umg h HIS 339 N 0.66 0.63 -3.75 0.54 2.76 -1.62 -3.39 115.15 110.98 1umg h HIS 339 Ca 0.00 -0.22 -0.49 0.00 -2.20 0.00 0.00 60.37 57.46 1umg h HIS 339 Cb 0.14 -0.12 -0.03 0.00 1.55 0.00 0.00 27.41 28.96 1umg h HIS 339 CO 0.03 0.93 0.20 0.50 -1.30 0.00 0.00 177.93 178.29 1umg s ARG 340 N -4.10 4.30 0.82 5.26 3.52 -0.39 0.13 118.95 128.49 1umg s ARG 340 Ca -0.13 1.00 -0.11 0.00 -0.13 0.00 0.00 55.73 56.35 1umg s ARG 340 Cb 0.06 -2.69 0.08 0.00 -1.56 0.00 0.00 34.95 30.85 1umg s ARG 340 CO 0.80 0.27 1.09 -0.51 -0.81 0.00 0.00 175.30 176.14 1umg s LEU 341 N -2.32 2.53 0.71 -0.88 1.43 0.52 -4.16 118.68 116.51 1umg s LEU 341 Ca 0.49 1.37 -0.16 0.00 -1.03 0.00 0.00 54.13 54.81 1umg s LEU 341 Cb -0.15 -3.94 0.03 0.00 0.03 0.00 0.00 46.19 42.16 1umg s LEU 341 CO 0.20 -2.14 1.24 -1.83 0.23 0.00 0.00 176.35 174.05 1umg s GLU 342 N -5.09 2.20 0.20 1.70 -1.05 -1.26 -4.76 118.70 110.64 1umg s GLU 342 Ca 0.61 1.86 -0.19 0.00 -0.15 0.00 0.00 54.97 57.11 1umg s GLU 342 Cb -0.15 -1.83 0.16 0.00 -0.44 0.00 0.00 34.13 31.87 1umg s GLU 342 CO 0.55 -1.82 1.45 -2.30 0.95 0.00 0.00 175.26 174.09 1umg n PRO 343 N -2.53 -0.26 0.06 -4.83 -0.02 -1.26 -1.36 135.00 124.80 1umg n PRO 343 Ca 0.14 1.43 0.11 0.00 -2.02 0.00 0.00 63.50 63.16 1umg n PRO 343 Cb 0.50 -2.12 0.44 0.00 -0.02 0.00 0.00 33.50 32.29 1umg n PRO 343 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1umg n THR 344 N -5.33 0.73 1.01 3.45 -2.24 -1.26 -3.15 114.28 107.49 1umg n THR 344 Ca 0.08 0.13 0.11 0.00 -2.27 0.00 0.00 64.05 62.09 1umg n THR 344 Cb 0.35 -0.92 -0.02 0.00 -2.10 0.00 0.00 70.33 67.63 1umg n THR 344 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1umg n GLU 345 N -1.88 0.38 -2.21 -0.78 -0.58 -0.47 -4.94 120.64 110.16 1umg n GLU 345 Ca 0.04 -0.30 -0.42 0.00 -0.42 0.00 0.00 57.16 56.05 1umg n GLU 345 Cb 0.26 -1.49 -0.03 0.00 -0.57 0.00 0.00 31.44 29.60 1umg n GLU 345 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 1umg s MET 346 N -2.83 4.29 0.32 3.49 -1.94 -1.14 -4.83 119.30 116.66 1umg s MET 346 Ca 0.12 1.99 0.10 0.00 -1.71 0.00 0.00 55.69 56.19 1umg s MET 346 Cb 0.17 -3.51 0.54 0.00 2.01 0.00 0.00 34.83 34.04 1umg s MET 346 CO 0.75 -0.54 1.73 1.49 -0.01 0.00 0.00 175.02 178.44 1umg h GLU 347 N 7.63 0.08 -6.56 2.03 4.81 -1.65 -3.42 114.58 117.49 1umg h GLU 347 Ca -0.39 -0.04 -0.70 0.00 -0.13 0.00 0.00 59.36 58.10 1umg h GLU 347 Cb 1.19 -0.00 -0.30 0.00 0.63 0.00 0.00 28.75 30.27 1umg h GLU 347 CO 0.89 0.52 -0.88 0.71 -0.73 0.00 0.00 179.01 179.52 1umg s TYR 348 N -4.03 2.36 -0.10 0.92 4.12 -1.25 -4.94 117.35 114.43 1umg s TYR 348 Ca -0.03 -0.43 -0.30 0.00 0.02 0.00 0.00 57.07 56.33 1umg s TYR 348 Cb 0.14 -1.51 0.08 0.00 -1.52 0.00 0.00 41.96 39.14 1umg s TYR 348 CO 0.75 -0.03 0.75 -0.08 0.02 0.00 0.00 175.55 176.96 1umg s THR 349 N -0.60 0.00 -0.05 -0.71 -1.32 -1.26 -4.97 115.64 106.72 1umg s THR 349 Ca 0.09 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.58 1umg s THR 349 Cb -0.10 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.89 1umg s THR 349 CO -0.01 0.00 0.53 0.41 -2.21 0.00 0.00 174.62 173.34 1umg n THR 350 N 1.12 0.03 -0.13 5.08 -1.04 -1.26 -4.79 114.28 113.29 1umg n THR 350 Ca -0.17 -0.52 -0.04 0.00 -2.04 0.00 0.00 64.05 61.28 1umg n THR 350 Cb 0.57 0.99 0.02 0.00 -1.82 0.00 0.00 70.33 70.09 1umg n THR 350 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1umg h LEU 351 N 0.08 -0.42 -0.70 -4.42 5.85 -1.99 -0.27 115.31 113.45 1umg h LEU 351 Ca 0.00 0.13 0.10 0.00 0.84 0.00 0.00 57.88 58.95 1umg h LEU 351 Cb 0.03 0.28 -0.08 0.00 0.37 0.00 0.00 40.66 41.26 1umg h LEU 351 CO 0.00 -0.15 0.32 -0.65 -0.34 0.00 0.00 178.44 177.62 1umg h PRO 352 N -0.01 0.52 -0.34 5.25 0.11 -2.00 -0.38 132.00 135.16 1umg h PRO 352 Ca 0.21 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 66.17 1umg h PRO 352 Cb 0.33 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 1umg h PRO 352 CO -0.45 0.34 -0.28 -0.07 -0.21 0.00 0.00 178.00 177.33 1umg h LEU 353 N 0.54 0.72 -0.03 2.35 3.38 -1.72 -2.27 115.31 118.27 1umg h LEU 353 Ca 0.35 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1umg h LEU 353 Cb 0.42 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1umg h LEU 353 CO -0.30 0.96 0.00 0.40 0.09 0.00 0.00 178.44 179.59 1umg h ILE 354 N 0.60 1.23 -0.68 1.22 1.08 -0.18 -1.31 117.51 119.47 1umg h ILE 354 Ca 0.07 -0.70 0.00 0.00 -0.39 0.00 0.00 64.86 63.85 1umg h ILE 354 Cb 0.79 1.65 -0.03 0.00 -3.07 0.00 0.00 36.82 36.15 1umg h ILE 354 CO 0.06 0.19 0.44 -0.07 -0.69 0.00 0.00 178.15 178.08 1umg h LEU 355 N -0.23 0.79 -0.47 1.44 3.38 -1.10 -0.05 115.31 119.08 1umg h LEU 355 Ca 0.01 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1umg h LEU 355 Cb 0.30 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1umg h LEU 355 CO 0.00 0.59 0.18 -0.08 0.09 0.00 0.00 178.44 179.22 1umg h GLU 356 N 0.93 0.70 0.00 1.13 4.57 -1.25 0.07 114.58 120.74 1umg h GLU 356 Ca 0.25 -0.13 -0.07 0.00 -1.18 0.00 0.00 59.36 58.23 1umg h GLU 356 Cb -0.09 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.38 1umg h GLU 356 CO -0.05 0.64 -0.34 -0.22 -1.18 0.00 0.00 179.01 177.86 1umg h LYS 357 N 0.61 0.00 -0.58 1.92 3.64 -0.21 -3.06 116.57 118.90 1umg h LYS 357 Ca 0.16 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1umg h LYS 357 Cb 0.20 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1umg h LYS 357 CO -0.01 0.34 0.00 1.28 -2.27 0.00 0.00 179.45 178.79 1umg n LEU 358 N -4.12 3.77 -0.30 5.20 4.77 -0.13 -4.65 117.00 121.54 1umg n LEU 358 Ca -0.02 -2.12 0.13 0.00 -0.03 0.00 0.00 56.01 53.97 1umg n LEU 358 Cb 0.38 -0.43 0.37 0.00 -2.33 0.00 0.00 43.42 41.41 1umg n LEU 358 CO 0.38 0.86 1.22 0.07 -1.33 0.00 0.00 177.39 178.60 1umg h LYS 359 N 3.42 0.68 0.00 3.23 2.10 -0.88 -1.09 116.57 124.04 1umg h LYS 359 Ca 0.00 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.61 1umg h LYS 359 Cb 1.01 -0.15 0.00 0.00 -0.90 0.00 0.00 32.23 32.18 1umg h LYS 359 CO 0.05 0.45 -0.56 -0.25 -2.00 0.00 0.00 179.45 177.14 1umg n ASP 360 N -4.60 0.56 0.06 7.07 8.00 -1.26 -3.94 116.55 122.44 1umg n ASP 360 Ca 0.19 -0.34 0.12 0.00 0.71 0.00 0.00 54.79 55.47 1umg n ASP 360 Cb 0.51 0.35 0.11 0.00 -0.02 0.00 0.00 41.12 42.07 1umg n ASP 360 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1umg h ARG 361 N 0.00 0.00 -6.30 -1.24 3.08 -1.52 -3.45 114.38 104.95 1umg h ARG 361 Ca 0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.50 1umg h ARG 361 Cb 0.50 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.52 1umg h ARG 361 CO 0.00 0.00 0.64 -0.06 -1.07 0.00 0.00 179.97 179.48 1umg s PHE 362 N -3.21 3.32 -0.05 3.04 0.08 -0.94 -5.03 117.98 115.20 1umg s PHE 362 Ca 0.04 1.36 0.01 0.00 0.12 0.00 0.00 56.93 58.47 1umg s PHE 362 Cb 0.13 -3.33 -0.03 0.00 -0.57 0.00 0.00 43.02 39.21 1umg s PHE 362 CO 0.75 -0.89 -0.05 0.15 -0.10 0.00 0.00 175.22 175.07 1umg s LYS 363 N 2.09 2.74 0.00 0.44 -0.14 -1.26 -5.04 119.74 118.56 1umg s LYS 363 Ca 0.53 -0.58 0.32 0.00 -1.36 0.00 0.00 55.97 54.88 1umg s LYS 363 Cb -0.22 -2.61 1.90 0.00 -1.68 0.00 0.00 37.83 35.22 1umg s LYS 363 CO 0.21 0.65 2.22 1.63 -0.76 0.00 0.00 175.35 179.30