#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qfu s GLU 2 N 0.00 2.84 0.15 2.12 2.02 -1.26 -4.89 118.70 119.68 2qfu s GLU 2 Ca 0.00 1.38 -0.18 0.00 0.02 0.00 0.00 54.97 56.19 2qfu s GLU 2 Cb 0.00 -1.96 0.04 0.00 0.10 0.00 0.00 34.13 32.32 2qfu s GLU 2 CO 0.00 -1.22 0.49 -1.54 0.02 0.00 0.00 175.26 173.01 2qfu s SER 3 N -2.59 -0.34 -0.00 -0.19 1.04 -1.26 -0.64 113.70 109.72 2qfu s SER 3 Ca 0.67 -0.26 0.02 0.00 0.48 0.00 0.00 55.95 56.86 2qfu s SER 3 Cb -0.20 0.54 -0.01 0.00 0.10 0.00 0.00 66.02 66.45 2qfu s SER 3 CO 0.41 -0.93 -0.07 -0.22 0.98 0.00 0.00 173.24 173.41 2qfu s LEU 4 N -2.80 2.02 -0.15 2.42 0.20 -0.38 -4.91 118.68 115.08 2qfu s LEU 4 Ca 0.04 -0.15 -0.01 0.00 0.69 0.00 0.00 54.13 54.70 2qfu s LEU 4 Cb 0.00 -0.37 -0.01 0.00 -0.43 0.00 0.00 46.19 45.38 2qfu s LEU 4 CO -0.10 0.08 -0.12 -0.89 -0.29 0.00 0.00 176.35 175.03 2qfu s THR 5 N -0.22 3.07 -0.23 3.68 2.01 -1.26 0.01 115.64 122.70 2qfu s THR 5 Ca 0.02 -0.64 -0.10 0.00 0.31 0.00 0.00 61.69 61.28 2qfu s THR 5 Cb -0.03 -2.31 -0.05 0.00 0.01 0.00 0.00 72.50 70.12 2qfu s THR 5 CO -0.00 0.51 0.15 -0.76 -0.69 0.00 0.00 174.62 173.83 2qfu s LEU 6 N 0.62 4.15 0.53 4.42 1.43 0.35 -4.97 118.68 125.21 2qfu s LEU 6 Ca -0.07 0.15 -0.11 0.00 -1.03 0.00 0.00 54.13 53.08 2qfu s LEU 6 Cb -0.15 -2.11 -0.05 0.00 0.03 0.00 0.00 46.19 43.91 2qfu s LEU 6 CO 0.03 0.10 0.93 -1.10 0.23 0.00 0.00 176.35 176.53 2qfu s GLN 7 N 0.85 3.69 0.26 1.70 -0.21 -1.26 -2.02 119.66 122.67 2qfu s GLN 7 Ca 0.08 0.63 -0.29 0.00 0.02 0.00 0.00 55.36 55.79 2qfu s GLN 7 Cb -0.13 -2.21 -0.14 0.00 1.00 0.00 0.00 33.01 31.53 2qfu s GLN 7 CO 0.03 -0.34 1.10 -2.30 -2.12 0.00 0.00 175.29 171.66 2qfu n PRO 8 N -2.17 1.45 -3.77 2.91 -0.02 -1.26 -4.90 135.00 127.25 2qfu n PRO 8 Ca 0.04 0.51 -0.37 0.00 -2.02 0.00 0.00 63.50 61.67 2qfu n PRO 8 Cb 0.54 -1.95 -0.13 0.00 -0.02 0.00 0.00 33.50 31.94 2qfu n PRO 8 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2qfu s ILE 9 N -0.78 4.07 0.24 4.25 1.01 0.89 -5.00 121.20 125.87 2qfu s ILE 9 Ca 0.62 -0.46 0.03 0.00 0.00 0.00 0.00 60.65 60.85 2qfu s ILE 9 Cb -0.71 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 38.73 2qfu s ILE 9 CO 0.57 0.22 1.58 0.00 0.00 0.00 0.00 174.94 177.31 2qfu h ALA 10 N 8.23 0.87 -1.96 9.38 0.00 -1.83 -3.43 119.26 130.54 2qfu h ALA 10 Ca -0.35 -0.50 -0.02 0.00 0.00 0.00 0.00 54.91 54.03 2qfu h ALA 10 Cb 1.15 -0.09 -0.19 0.00 0.00 0.00 0.00 17.79 18.66 2qfu h ALA 10 CO 0.60 0.69 0.27 0.50 0.00 0.00 0.00 179.25 181.31 2qfu s ARG 11 N -3.91 0.96 0.04 0.00 3.52 -1.06 -4.99 118.95 113.53 2qfu s ARG 11 Ca -0.05 0.19 0.09 0.00 -0.13 0.00 0.00 55.73 55.83 2qfu s ARG 11 Cb 0.12 0.45 -0.03 0.00 -1.56 0.00 0.00 34.95 33.94 2qfu s ARG 11 CO 0.80 -0.31 -0.24 0.14 -0.81 0.00 0.00 175.30 174.88 2qfu s VAL 12 N -1.33 1.96 -0.28 7.11 -7.23 -0.68 -0.27 120.40 119.68 2qfu s VAL 12 Ca -0.08 -1.32 -0.24 0.00 -1.81 0.00 0.00 61.98 58.53 2qfu s VAL 12 Cb -0.00 -1.69 0.13 0.00 0.56 0.00 0.00 36.38 35.38 2qfu s VAL 12 CO 0.07 0.31 1.05 -0.62 -0.31 0.00 0.00 175.10 175.59 2qfu s ASP 13 N -1.22 -0.44 0.00 4.85 -1.08 -0.33 -4.00 116.67 114.46 2qfu s ASP 13 Ca 0.10 0.83 0.00 0.00 -0.52 0.00 0.00 52.55 52.96 2qfu s ASP 13 Cb -0.10 0.87 0.00 0.00 -1.46 0.00 0.00 42.92 42.23 2qfu s ASP 13 CO 0.02 -0.14 0.00 0.61 0.52 0.00 0.00 175.17 176.18 2qfu n GLY 14 N 2.29 0.31 3.02 2.66 0.00 -0.53 -4.54 105.19 108.39 2qfu n GLY 14 Ca -0.13 -1.64 -0.22 0.00 0.00 0.00 0.00 46.02 44.03 2qfu n GLY 14 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qfu s THR 15 N -2.66 0.92 -0.11 2.61 2.01 -1.26 -0.75 115.64 116.39 2qfu s THR 15 Ca 0.00 -0.41 0.03 0.00 0.31 0.00 0.00 61.69 61.62 2qfu s THR 15 Cb 0.00 -0.82 0.00 0.00 0.01 0.00 0.00 72.50 71.69 2qfu s THR 15 CO 0.00 0.29 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.37 2qfu s ILE 16 N 0.31 2.19 -0.38 1.82 -1.09 0.16 -4.96 121.20 119.24 2qfu s ILE 16 Ca -0.06 -0.96 -0.19 0.00 -2.23 0.00 0.00 60.65 57.21 2qfu s ILE 16 Cb -0.11 -1.85 0.01 0.00 -1.58 0.00 0.00 42.46 38.93 2qfu s ILE 16 CO 0.01 0.55 0.56 0.20 -1.23 0.00 0.00 174.94 175.04 2qfu s ASN 17 N 0.47 6.33 0.58 3.58 0.01 -1.26 -0.70 114.94 123.95 2qfu s ASN 17 Ca -0.15 -0.13 -0.19 0.00 -0.71 0.00 0.00 52.86 51.68 2qfu s ASN 17 Cb -0.17 -2.29 -0.04 0.00 0.41 0.00 0.00 41.25 39.16 2qfu s ASN 17 CO 0.06 -0.58 1.19 -0.76 -1.51 0.00 0.00 177.10 175.50 2qfu s LEU 18 N 2.53 3.69 0.76 0.60 1.43 -0.73 -4.94 118.68 122.02 2qfu s LEU 18 Ca 0.20 2.35 -0.11 0.00 -1.03 0.00 0.00 54.13 55.54 2qfu s LEU 18 Cb -0.15 -4.59 0.05 0.00 0.03 0.00 0.00 46.19 41.53 2qfu s LEU 18 CO 0.15 -1.51 1.09 -2.16 0.23 0.00 0.00 176.35 174.15 2qfu s PRO 19 N -3.31 2.40 0.74 1.29 0.04 -1.26 -4.74 135.00 130.16 2qfu s PRO 19 Ca 0.76 0.68 -0.14 0.00 0.04 0.00 0.00 61.00 62.34 2qfu s PRO 19 Cb -0.29 -1.95 0.05 0.00 0.04 0.00 0.00 34.50 32.34 2qfu s PRO 19 CO 0.32 -1.41 1.16 0.20 0.04 0.00 0.00 177.00 177.31 2qfu s GLY 20 N -3.96 2.13 0.07 0.56 0.00 -1.24 -0.52 107.32 104.37 2qfu s GLY 20 Ca 0.60 0.69 -0.31 0.00 0.00 0.00 0.00 44.72 45.70 2qfu s GLY 20 CO 0.54 1.08 1.47 -0.45 0.00 0.00 0.00 173.10 175.74 2qfu s SER 21 N -2.40 6.76 0.14 1.64 0.15 0.42 -4.10 113.70 116.31 2qfu s SER 21 Ca 0.70 2.32 -0.14 0.00 0.70 0.00 0.00 55.95 59.54 2qfu s SER 21 Cb -0.25 -2.57 0.01 0.00 -1.71 0.00 0.00 66.02 61.50 2qfu s SER 21 CO 0.47 -0.74 1.63 0.50 1.20 0.00 0.00 173.24 176.30 2qfu h LYS 22 N 7.48 0.78 -0.34 5.44 3.11 -1.92 0.23 116.57 131.35 2qfu h LYS 22 Ca -0.41 -0.21 -0.00 0.00 -2.81 0.00 0.00 60.65 57.22 2qfu h LYS 22 Cb 1.20 -0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 32.32 2qfu h LYS 22 CO 0.90 0.79 0.20 0.77 -2.81 0.00 0.00 179.45 179.29 2qfu h SER 23 N 0.65 0.41 -0.31 4.20 0.02 -1.99 -1.64 113.55 114.89 2qfu h SER 23 Ca 0.14 -0.06 -0.14 0.00 -0.84 0.00 0.00 61.79 60.89 2qfu h SER 23 Cb 0.38 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.81 2qfu h SER 23 CO 0.01 0.35 -0.37 0.58 -1.14 0.00 0.00 176.83 176.26 2qfu h VAL 24 N 0.43 1.29 -0.12 2.27 2.07 -1.93 -3.00 116.25 117.25 2qfu h VAL 24 Ca 0.12 -1.55 0.02 0.00 0.82 0.00 0.00 66.70 66.12 2qfu h VAL 24 Cb 0.02 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 2qfu h VAL 24 CO -0.02 0.50 -0.03 0.28 0.02 0.00 0.00 177.57 178.32 2qfu h SER 25 N 0.57 -0.12 0.23 0.57 0.02 -0.70 0.59 113.55 114.72 2qfu h SER 25 Ca 0.04 0.04 -0.12 0.00 -0.84 0.00 0.00 61.79 60.91 2qfu h SER 25 Cb 0.96 0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.57 2qfu h SER 25 CO 0.09 -0.04 -0.45 0.78 -1.14 0.00 0.00 176.83 176.07 2qfu h ASN 26 N -0.00 0.29 -0.26 3.07 2.35 -1.38 -0.61 115.58 119.04 2qfu h ASN 26 Ca 0.06 -0.13 -0.08 0.00 -0.55 0.00 0.00 56.30 55.60 2qfu h ASN 26 Cb 0.09 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 2qfu h ASN 26 CO -0.13 0.70 -0.14 0.03 -1.65 0.00 0.00 177.43 176.25 2qfu h ARG 27 N 0.22 0.55 -0.59 0.81 3.08 -1.36 -2.56 114.38 114.54 2qfu h ARG 27 Ca 0.02 -0.25 -0.05 0.00 0.07 0.00 0.00 59.98 59.76 2qfu h ARG 27 Cb 0.89 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.90 2qfu h ARG 27 CO 0.07 0.81 0.15 0.00 -1.07 0.00 0.00 179.97 179.93 2qfu h ALA 28 N 0.73 1.16 -0.32 0.04 0.00 -0.67 -0.62 119.26 119.58 2qfu h ALA 28 Ca 0.06 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 2qfu h ALA 28 Cb 0.65 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2qfu h ALA 28 CO 0.04 0.57 0.01 -0.07 0.00 0.00 0.00 179.25 179.80 2qfu h LEU 29 N 0.87 0.54 -0.48 0.00 3.38 -1.08 0.31 115.31 118.85 2qfu h LEU 29 Ca 0.19 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 2qfu h LEU 29 Cb 0.30 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2qfu h LEU 29 CO -0.00 0.71 0.07 0.25 0.09 0.00 0.00 178.44 179.56 2qfu h LEU 30 N 0.36 0.78 -0.67 1.67 5.85 -1.22 -0.99 115.31 121.09 2qfu h LEU 30 Ca 0.09 -0.27 -0.09 0.00 0.84 0.00 0.00 57.88 58.46 2qfu h LEU 30 Cb 0.43 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 2qfu h LEU 30 CO 0.01 0.85 0.08 -0.07 -0.34 0.00 0.00 178.44 178.97 2qfu h LEU 31 N 0.68 1.08 -1.12 2.25 3.38 -1.06 -1.24 115.31 119.28 2qfu h LEU 31 Ca 0.15 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2qfu h LEU 31 Cb 0.41 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 2qfu h LEU 31 CO 0.01 1.08 0.40 0.00 0.09 0.00 0.00 178.44 180.02 2qfu h ALA 32 N 1.04 1.33 -0.30 1.53 0.00 -0.73 0.48 119.26 122.61 2qfu h ALA 32 Ca 0.20 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 2qfu h ALA 32 Cb 0.48 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2qfu h ALA 32 CO 0.02 0.55 -0.30 0.00 0.00 0.00 0.00 179.25 179.52 2qfu h ALA 33 N 1.42 0.93 0.00 0.00 0.00 -0.63 -3.02 119.26 117.96 2qfu h ALA 33 Ca 0.26 -0.39 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 2qfu h ALA 33 Cb 0.02 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2qfu h ALA 33 CO -0.04 0.62 -0.59 -0.07 0.00 0.00 0.00 179.25 179.17 2qfu h LEU 34 N 0.53 0.00-10.41 0.00 3.38 -0.79 0.25 115.31 108.27 2qfu h LEU 34 Ca 0.06 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.56 2qfu h LEU 34 Cb 0.78 0.00 0.13 0.00 0.09 0.00 0.00 40.66 41.67 2qfu h LEU 34 CO 0.06 0.59 0.28 0.00 0.09 0.00 0.00 178.44 179.46 2qfu s ALA 35 N -2.95 1.68 -0.14 1.53 0.00 0.12 -0.35 121.76 121.66 2qfu s ALA 35 Ca 0.03 -0.32 -0.15 0.00 0.00 0.00 0.00 51.96 51.52 2qfu s ALA 35 Cb 0.08 -3.10 -0.05 0.00 0.00 0.00 0.00 23.12 20.06 2qfu s ALA 35 CO 0.76 -2.27 0.35 -1.01 0.00 0.00 0.00 175.76 173.59 2qfu s HIS 36 N -3.11 3.49 0.00 0.00 3.76 -0.46 -0.84 115.29 118.13 2qfu s HIS 36 Ca 0.63 0.71 0.00 0.00 -0.15 0.00 0.00 55.06 56.25 2qfu s HIS 36 Cb -0.16 -2.40 0.00 0.00 1.11 0.00 0.00 32.58 31.13 2qfu s HIS 36 CO 0.55 0.25 0.00 0.41 -0.85 0.00 0.00 174.74 175.10 2qfu n GLY 37 N 3.23 0.98 3.70 -2.22 0.00 -1.26 -1.02 105.19 108.60 2qfu n GLY 37 Ca -0.11 -2.11 -0.36 0.00 0.00 0.00 0.00 46.02 43.44 2qfu n GLY 37 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qfu s LYS 38 N -1.42 4.15 -0.09 1.61 2.20 -1.26 -0.88 119.74 124.04 2qfu s LYS 38 Ca 0.00 -0.19 -0.00 0.00 -0.36 0.00 0.00 55.97 55.42 2qfu s LYS 38 Cb 0.00 -3.47 -0.03 0.00 -1.51 0.00 0.00 37.83 32.82 2qfu s LYS 38 CO 0.00 0.19 -0.07 0.99 -0.36 0.00 0.00 175.35 176.10 2qfu s THR 39 N 0.68 3.70 -0.27 3.43 2.01 -0.42 -4.34 115.64 120.43 2qfu s THR 39 Ca 0.09 -0.47 -0.02 0.00 0.31 0.00 0.00 61.69 61.61 2qfu s THR 39 Cb -0.12 -2.54 0.03 0.00 0.01 0.00 0.00 72.50 69.88 2qfu s THR 39 CO 0.01 0.57 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.79 2qfu s VAL 40 N -0.46 2.95 -0.16 3.82 1.01 -0.29 -0.26 120.40 127.00 2qfu s VAL 40 Ca 0.07 -1.15 -0.10 0.00 0.00 0.00 0.00 61.98 60.79 2qfu s VAL 40 Cb -0.12 -2.57 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 2qfu s VAL 40 CO 0.02 0.08 0.19 -0.76 0.00 0.00 0.00 175.10 174.63 2qfu s LEU 41 N 1.30 4.28 0.18 3.92 1.43 0.48 -0.53 118.68 129.75 2qfu s LEU 41 Ca -0.02 0.41 0.11 0.00 -1.03 0.00 0.00 54.13 53.60 2qfu s LEU 41 Cb -0.18 -2.19 -0.04 0.00 0.03 0.00 0.00 46.19 43.81 2qfu s LEU 41 CO -0.03 0.23 -0.22 0.42 0.23 0.00 0.00 176.35 176.98 2qfu s THR 42 N -0.08 2.20 -1.51 5.49 -4.23 -0.39 -0.75 115.64 116.37 2qfu s THR 42 Ca 0.13 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.64 2qfu s THR 42 Cb -0.12 -2.04 0.00 0.00 1.34 0.00 0.00 72.50 71.68 2qfu s THR 42 CO 0.02 -0.17 0.00 -3.20 -0.54 0.00 0.00 174.62 170.73 2qfu n ASN 43 N 0.28 -4.91 -4.76 3.99 4.05 -0.39 -0.94 115.26 112.58 2qfu n ASN 43 Ca -0.13 0.12 -0.39 0.00 0.45 0.00 0.00 54.58 54.63 2qfu n ASN 43 Cb 0.56 -3.97 0.01 0.00 1.23 0.00 0.00 39.78 37.62 2qfu n ASN 43 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 177.26 173.99 2qfu s LEU 44 N -4.42 4.04 0.16 1.20 2.96 0.31 -3.71 118.68 119.22 2qfu s LEU 44 Ca 0.00 2.65 -0.30 0.00 -0.22 0.00 0.00 54.13 56.26 2qfu s LEU 44 Cb 0.00 -4.10 -0.07 0.00 0.50 0.00 0.00 46.19 42.52 2qfu s LEU 44 CO 0.00 -1.14 1.00 -0.22 -1.32 0.00 0.00 176.35 174.67 2qfu s LEU 45 N -2.95 4.53 -0.43 -0.68 2.96 -1.26 -4.33 118.68 116.52 2qfu s LEU 45 Ca 0.64 1.92 -0.10 0.00 -0.22 0.00 0.00 54.13 56.37 2qfu s LEU 45 Cb -0.37 -3.60 0.08 0.00 0.50 0.00 0.00 46.19 42.80 2qfu s LEU 45 CO 0.46 -0.07 0.28 -0.62 -1.32 0.00 0.00 176.35 175.08 2qfu s ASP 46 N -0.30 5.68 0.29 3.68 3.68 -1.26 -4.78 116.67 123.65 2qfu s ASP 46 Ca 0.46 -1.54 -0.15 0.00 2.13 0.00 0.00 52.55 53.45 2qfu s ASP 46 Cb -0.26 -2.00 0.01 0.00 -1.45 0.00 0.00 42.92 39.22 2qfu s ASP 46 CO 0.32 -0.56 0.62 -0.94 0.13 0.00 0.00 175.17 174.74 2qfu s SER 47 N 2.21 -0.05 0.18 -0.34 1.04 -1.26 -4.57 113.70 110.90 2qfu s SER 47 Ca 0.03 -0.89 -0.13 0.00 0.48 0.00 0.00 55.95 55.44 2qfu s SER 47 Cb -0.23 0.69 0.15 0.00 0.10 0.00 0.00 66.02 66.72 2qfu s SER 47 CO 0.02 -1.32 1.75 0.44 0.98 0.00 0.00 173.24 175.11 2qfu h ASP 48 N 2.11 0.19 -0.56 7.02 3.45 -0.90 0.29 116.42 128.02 2qfu h ASP 48 Ca -0.24 0.05 -0.01 0.00 0.43 0.00 0.00 57.03 57.26 2qfu h ASP 48 Cb 1.25 0.03 -0.03 0.00 -0.56 0.00 0.00 39.33 40.02 2qfu h ASP 48 CO 0.32 0.14 0.32 0.44 -1.57 0.00 0.00 179.24 178.89 2qfu h ASP 49 N 0.35 0.70 0.22 6.45 5.19 -1.71 -0.50 116.42 127.13 2qfu h ASP 49 Ca 0.22 -0.05 -0.27 0.00 -0.62 0.00 0.00 57.03 56.32 2qfu h ASP 49 Cb 0.22 -0.18 0.02 0.00 0.18 0.00 0.00 39.33 39.57 2qfu h ASP 49 CO -0.22 0.56 -1.12 0.58 -3.12 0.00 0.00 179.24 175.92 2qfu h VAL 50 N 0.80 1.34 -0.78 -1.35 2.07 -1.72 -3.07 116.25 113.54 2qfu h VAL 50 Ca 0.21 -2.49 0.01 0.00 0.82 0.00 0.00 66.70 65.25 2qfu h VAL 50 Cb 0.01 2.58 -0.04 0.00 -1.52 0.00 0.00 31.29 32.33 2qfu h VAL 50 CO -0.03 0.75 0.51 -0.09 0.02 0.00 0.00 177.57 178.73 2qfu h ARG 51 N 0.26 1.00 -0.43 1.57 2.43 -0.35 0.84 114.38 119.69 2qfu h ARG 51 Ca -0.14 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 58.87 2qfu h ARG 51 Cb 1.78 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 31.09 2qfu h ARG 51 CO 0.21 0.66 -0.12 0.45 -1.51 0.00 0.00 179.97 179.66 2qfu h HIS 52 N 1.03 0.87 -0.36 2.20 3.86 -1.12 0.10 115.15 121.73 2qfu h HIS 52 Ca 0.29 -0.16 -0.05 0.00 -1.16 0.00 0.00 60.37 59.29 2qfu h HIS 52 Cb -0.08 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.16 2qfu h HIS 52 CO -0.00 0.86 0.02 1.98 0.86 0.00 0.00 177.93 181.66 2qfu h MET 53 N 0.71 0.62 -0.77 2.45 1.85 -1.24 -1.16 114.93 117.38 2qfu h MET 53 Ca 0.12 -0.18 -0.00 0.00 -0.61 0.00 0.00 59.70 59.02 2qfu h MET 53 Cb 0.61 -0.06 -0.04 0.00 0.43 0.00 0.00 31.60 32.54 2qfu h MET 53 CO 0.04 0.71 0.48 -0.07 -0.40 0.00 0.00 176.91 177.67 2qfu h LEU 54 N 0.44 0.92 -0.96 3.39 3.38 -0.42 -0.81 115.31 121.26 2qfu h LEU 54 Ca 0.10 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 2qfu h LEU 54 Cb 0.42 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 2qfu h LEU 54 CO 0.01 0.70 -0.05 0.78 0.09 0.00 0.00 178.44 179.97 2qfu h ASN 55 N 1.06 0.67 -0.41 -0.43 -0.26 -0.67 -0.41 115.58 115.13 2qfu h ASN 55 Ca 0.28 -0.17 -0.05 0.00 -0.56 0.00 0.00 56.30 55.80 2qfu h ASN 55 Cb -0.06 -0.18 -0.02 0.00 -1.06 0.00 0.00 38.32 37.01 2qfu h ASN 55 CO -0.05 0.78 0.08 0.00 -1.06 0.00 0.00 177.43 177.17 2qfu h ALA 56 N 1.30 0.54 -0.74 -0.83 0.00 -0.58 -0.87 119.26 118.07 2qfu h ALA 56 Ca 0.12 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2qfu h ALA 56 Cb 0.48 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2qfu h ALA 56 CO 0.02 0.24 0.34 -0.07 0.00 0.00 0.00 179.25 179.78 2qfu h LEU 57 N 0.52 0.98 -0.44 0.00 3.38 -0.80 -0.69 115.31 118.27 2qfu h LEU 57 Ca 0.12 -0.15 0.02 0.00 0.09 0.00 0.00 57.88 57.96 2qfu h LEU 57 Cb 0.35 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 2qfu h LEU 57 CO 0.01 0.86 0.27 0.74 0.09 0.00 0.00 178.44 180.40 2qfu h THR 58 N 1.05 1.06 -0.07 0.22 2.02 -0.79 -1.07 112.91 115.33 2qfu h THR 58 Ca 0.25 -0.18 -0.04 0.00 0.77 0.00 0.00 66.41 67.21 2qfu h THR 58 Cb 0.15 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.03 2qfu h THR 58 CO -0.03 0.10 -0.12 0.00 0.37 0.00 0.00 175.52 175.84 2qfu h ALA 59 N 1.19 1.66 -0.00 6.16 0.00 -0.60 -1.56 119.26 126.10 2qfu h ALA 59 Ca 0.17 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2qfu h ALA 59 Cb -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2qfu h ALA 59 CO -0.07 0.25 -0.03 1.28 0.00 0.00 0.00 179.25 180.69 2qfu n LEU 60 N -4.33 0.14 0.00 0.00 4.77 -0.32 -4.90 117.00 112.36 2qfu n LEU 60 Ca -0.02 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 2qfu n LEU 60 Cb 0.23 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2qfu n LEU 60 CO 0.37 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 2qfu n GLY 61 N 1.22 0.85 3.74 -0.72 0.00 -0.59 -4.58 105.19 105.12 2qfu n GLY 61 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2qfu n GLY 61 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qfu s VAL 62 N -2.05 4.14 -0.17 1.61 1.01 -0.46 -5.02 120.40 119.46 2qfu s VAL 62 Ca 0.00 1.97 -0.09 0.00 0.00 0.00 0.00 61.98 63.86 2qfu s VAL 62 Cb 0.00 -4.25 -0.05 0.00 0.00 0.00 0.00 36.38 32.08 2qfu s VAL 62 CO 0.00 0.39 0.13 -0.55 0.00 0.00 0.00 175.10 175.07 2qfu s SER 63 N -0.59 6.26 0.20 3.32 0.15 -1.26 -4.36 113.70 117.41 2qfu s SER 63 Ca 0.45 0.31 -0.19 0.00 0.70 0.00 0.00 55.95 57.21 2qfu s SER 63 Cb -0.26 -2.08 0.03 0.00 -1.71 0.00 0.00 66.02 62.00 2qfu s SER 63 CO 0.32 0.26 0.56 -0.72 1.20 0.00 0.00 173.24 174.86 2qfu s TYR 64 N -0.10 -0.19 0.07 3.44 -0.85 -1.26 -1.02 117.35 117.44 2qfu s TYR 64 Ca 0.10 -0.14 0.05 0.00 -0.52 0.00 0.00 57.07 56.56 2qfu s TYR 64 Cb -0.11 0.46 -0.03 0.00 0.38 0.00 0.00 41.96 42.66 2qfu s TYR 64 CO 0.00 -0.95 -0.15 0.95 -1.52 0.00 0.00 175.55 173.88 2qfu s THR 65 N -3.86 1.17 0.05 -3.49 -4.23 -0.51 -4.97 115.64 99.80 2qfu s THR 65 Ca 0.08 -1.32 0.09 0.00 -1.18 0.00 0.00 61.69 59.36 2qfu s THR 65 Cb -0.02 -1.12 -0.03 0.00 1.34 0.00 0.00 72.50 72.68 2qfu s THR 65 CO -0.03 -0.20 -0.24 -0.76 -0.54 0.00 0.00 174.62 172.84 2qfu s LEU 66 N -1.74 2.18 0.98 4.79 1.43 -1.26 -1.17 118.68 123.89 2qfu s LEU 66 Ca -0.01 -0.58 -0.13 0.00 -1.03 0.00 0.00 54.13 52.37 2qfu s LEU 66 Cb -0.10 -1.17 0.18 0.00 0.03 0.00 0.00 46.19 45.13 2qfu s LEU 66 CO 0.02 0.22 1.13 -0.94 0.23 0.00 0.00 176.35 177.01 2qfu s SER 67 N -1.29 2.85 0.32 2.29 1.04 -0.26 -4.86 113.70 113.80 2qfu s SER 67 Ca 0.10 0.94 0.06 0.00 0.48 0.00 0.00 55.95 57.53 2qfu s SER 67 Cb -0.10 -1.48 0.71 0.00 0.10 0.00 0.00 66.02 65.25 2qfu s SER 67 CO 0.02 -2.96 1.85 0.00 0.98 0.00 0.00 173.24 173.13 2qfu h ALA 68 N -1.78 1.70 -0.32 5.32 0.00 -2.01 -0.70 119.26 121.47 2qfu h ALA 68 Ca -0.51 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2qfu h ALA 68 Cb 1.32 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2qfu h ALA 68 CO 0.56 0.05 0.00 -0.40 0.00 0.00 0.00 179.25 179.46 2qfu n ASP 69 N -4.60 2.38 -1.64 0.00 3.85 -1.26 -4.93 116.55 110.35 2qfu n ASP 69 Ca 0.18 -1.88 -0.19 0.00 -0.71 0.00 0.00 54.79 52.19 2qfu n ASP 69 Cb 0.43 -0.21 -0.07 0.00 -1.35 0.00 0.00 41.12 39.92 2qfu n ASP 69 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 2qfu n ARG 70 N 0.79 -1.40 0.00 0.11 1.74 -0.27 -4.85 116.66 112.78 2qfu n ARG 70 Ca 0.17 1.14 0.09 0.00 -0.77 0.00 0.00 57.85 58.47 2qfu n ARG 70 Cb 0.42 -5.52 -0.03 0.00 -1.02 0.00 0.00 32.46 26.31 2qfu n ARG 70 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2qfu n THR 71 N -2.76 0.00 -4.87 0.55 -2.24 -1.26 -4.47 114.28 99.23 2qfu n THR 71 Ca -0.20 -0.25 -0.32 0.00 -2.27 0.00 0.00 64.05 61.00 2qfu n THR 71 Cb 0.65 1.15 -0.16 0.00 -2.10 0.00 0.00 70.33 69.87 2qfu n THR 71 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2qfu s ARG 72 N -2.21 3.07 -0.06 -0.78 3.52 -1.26 -0.53 118.95 120.69 2qfu s ARG 72 Ca 0.13 -0.85 0.01 0.00 -0.13 0.00 0.00 55.73 54.89 2qfu s ARG 72 Cb 0.14 -2.41 0.02 0.00 -1.56 0.00 0.00 34.95 31.14 2qfu s ARG 72 CO 0.52 0.07 -0.07 0.00 -0.81 0.00 0.00 175.30 175.01 2qfu s GLU 74 N 1.06 2.75 -0.17 0.00 2.12 -0.32 -0.39 118.70 123.75 2qfu s GLU 74 Ca -0.08 -1.10 -0.06 0.00 0.36 0.00 0.00 54.97 54.08 2qfu s GLU 74 Cb -0.14 -3.52 -0.04 0.00 0.26 0.00 0.00 34.13 30.69 2qfu s GLU 74 CO -0.01 -0.64 0.03 0.42 -0.54 0.00 0.00 175.26 174.52 2qfu s ILE 75 N 1.46 4.48 -0.47 -3.70 1.09 0.64 -1.42 121.20 123.27 2qfu s ILE 75 Ca -0.00 -0.15 -0.22 0.00 -1.10 0.00 0.00 60.65 59.18 2qfu s ILE 75 Cb -0.19 -3.00 0.03 0.00 -1.06 0.00 0.00 42.46 38.24 2qfu s ILE 75 CO 0.04 0.47 0.75 -0.63 -0.10 0.00 0.00 174.94 175.47 2qfu s ILE 76 N 0.37 4.69 0.47 2.92 -1.09 -0.19 -1.30 121.20 127.08 2qfu s ILE 76 Ca 0.01 0.19 -0.24 0.00 -2.23 0.00 0.00 60.65 58.37 2qfu s ILE 76 Cb -0.13 -4.32 -0.07 0.00 -1.58 0.00 0.00 42.46 36.36 2qfu s ILE 76 CO 0.01 -0.76 1.38 -0.83 -1.23 0.00 0.00 174.94 173.51 2qfu s GLY 77 N 2.28 2.90 0.29 6.18 0.00 -0.06 -4.34 107.32 114.58 2qfu s GLY 77 Ca 0.26 1.37 0.26 0.00 0.00 0.00 0.00 44.72 46.61 2qfu s GLY 77 CO 0.20 1.95 1.74 -0.57 0.00 0.00 0.00 173.10 176.41 2qfu h ASN 78 N 2.09 0.00 -4.27 1.64 -1.24 -0.19 -3.41 115.58 110.19 2qfu h ASN 78 Ca -0.51 0.00 -0.25 0.00 0.71 0.00 0.00 56.30 56.26 2qfu h ASN 78 Cb 1.27 0.00 0.10 0.00 0.73 0.00 0.00 38.32 40.42 2qfu h ASN 78 CO 0.60 0.00 -0.47 0.61 -1.29 0.00 0.00 177.43 176.88 2qfu n GLY 79 N 1.03 -0.05 0.00 1.57 0.00 -0.02 -4.92 105.19 102.80 2qfu n GLY 79 Ca 0.05 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2qfu n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qfu n GLY 80 N -1.34 1.64 3.50 -0.02 0.00 0.53 -4.92 105.19 104.57 2qfu n GLY 80 Ca -0.07 -1.92 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 2qfu n GLY 80 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2qfu n PRO 81 N -1.92 0.80 -3.04 1.61 -0.02 -1.26 -4.61 135.00 126.55 2qfu n PRO 81 Ca 0.00 0.29 -0.33 0.00 -2.02 0.00 0.00 63.50 61.44 2qfu n PRO 81 Cb 0.00 -1.66 -0.06 0.00 -0.02 0.00 0.00 33.50 31.76 2qfu n PRO 81 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2qfu s LEU 82 N 1.04 4.03 0.02 2.45 1.43 -1.26 -5.07 118.68 121.32 2qfu s LEU 82 Ca 0.63 1.40 0.00 0.00 -1.03 0.00 0.00 54.13 55.14 2qfu s LEU 82 Cb -0.60 -4.20 -0.02 0.00 0.03 0.00 0.00 46.19 41.40 2qfu s LEU 82 CO 0.57 -0.24 -0.03 -1.00 0.23 0.00 0.00 176.35 175.88 2qfu s HIS 83 N -2.03 0.25 -0.01 0.29 3.76 -1.26 -4.91 115.29 111.38 2qfu s HIS 83 Ca 0.56 -0.40 -0.29 0.00 -0.15 0.00 0.00 55.06 54.79 2qfu s HIS 83 Cb -0.10 -0.17 0.08 0.00 1.11 0.00 0.00 32.58 33.50 2qfu s HIS 83 CO 0.16 -0.13 0.74 0.00 -0.85 0.00 0.00 174.74 174.66 2qfu s ALA 84 N -1.09 -1.76 0.07 -1.40 0.00 -1.26 -4.83 121.76 111.49 2qfu s ALA 84 Ca -0.11 1.13 0.01 0.00 0.00 0.00 0.00 51.96 52.99 2qfu s ALA 84 Cb -0.08 0.14 -0.00 0.00 0.00 0.00 0.00 23.12 23.18 2qfu s ALA 84 CO -0.01 -0.49 0.04 0.39 0.00 0.00 0.00 175.76 175.69 2qfu n GLU 85 N 0.43 0.59 -1.57 0.00 1.02 -1.26 -1.60 120.64 118.26 2qfu n GLU 85 Ca -0.16 -0.65 -0.07 0.00 -0.02 0.00 0.00 57.16 56.26 2qfu n GLU 85 Cb 0.60 0.42 -0.02 0.00 -0.02 0.00 0.00 31.44 32.41 2qfu n GLU 85 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qfu n GLY 86 N 1.08 0.59 3.87 0.62 0.00 -1.24 -3.16 105.19 106.95 2qfu n GLY 86 Ca -0.00 -0.68 -0.28 0.00 0.00 0.00 0.00 46.02 45.05 2qfu n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qfu n ALA 87 N 0.16 -1.43 -1.66 4.61 0.00 -0.16 -4.85 120.51 117.17 2qfu n ALA 87 Ca -0.07 0.13 -0.49 0.00 0.00 0.00 0.00 53.44 53.00 2qfu n ALA 87 Cb 0.36 -4.00 -0.05 0.00 0.00 0.00 0.00 19.45 15.76 2qfu n ALA 87 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2qfu n LEU 88 N -4.62 2.86 -4.69 0.00 7.94 -1.05 -4.25 117.00 113.19 2qfu n LEU 88 Ca -0.03 1.06 -0.38 0.00 -1.11 0.00 0.00 56.01 55.55 2qfu n LEU 88 Cb 0.56 -1.34 -0.07 0.00 0.53 0.00 0.00 43.42 43.10 2qfu n LEU 88 CO 0.74 -0.37 0.13 -0.70 -1.11 0.00 0.00 177.39 176.08 2qfu s GLU 89 N 2.07 4.23 -0.23 1.96 2.12 -1.26 -0.35 118.70 127.24 2qfu s GLU 89 Ca 0.86 0.30 -0.06 0.00 0.36 0.00 0.00 54.97 56.44 2qfu s GLU 89 Cb -0.78 -3.50 -0.02 0.00 0.26 0.00 0.00 34.13 30.09 2qfu s GLU 89 CO 0.47 0.03 0.02 -0.51 -0.54 0.00 0.00 175.26 174.72 2qfu s LEU 90 N 1.08 3.18 -0.25 2.70 1.43 0.50 -4.96 118.68 122.36 2qfu s LEU 90 Ca 0.22 -0.29 -0.16 0.00 -1.03 0.00 0.00 54.13 52.87 2qfu s LEU 90 Cb -0.15 -1.83 -0.03 0.00 0.03 0.00 0.00 46.19 44.20 2qfu s LEU 90 CO 0.08 -0.02 0.42 0.12 0.23 0.00 0.00 176.35 177.18 2qfu s PHE 91 N 1.53 3.27 -0.20 0.29 5.36 -1.26 -1.46 117.98 125.51 2qfu s PHE 91 Ca 0.06 0.51 0.15 0.00 -0.96 0.00 0.00 56.93 56.69 2qfu s PHE 91 Cb -0.15 -2.61 0.45 0.00 -0.34 0.00 0.00 43.02 40.38 2qfu s PHE 91 CO 0.00 -0.21 1.34 1.28 -1.46 0.00 0.00 175.22 176.18 2qfu n LEU 92 N 5.24 3.44 0.00 6.12 4.77 0.20 -4.87 117.00 131.89 2qfu n LEU 92 Ca -0.07 -3.33 0.00 0.00 -0.03 0.00 0.00 56.01 52.58 2qfu n LEU 92 Cb 0.50 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2qfu n LEU 92 CO 0.38 0.91 0.00 0.61 -1.33 0.00 0.00 177.39 177.97 2qfu n GLY 93 N -0.98 3.45 1.48 -0.72 0.00 -1.26 -1.39 105.19 105.77 2qfu n GLY 93 Ca 0.23 0.13 -0.03 0.00 0.00 0.00 0.00 46.02 46.34 2qfu n GLY 93 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2qfu n ASN 94 N 5.45 2.40 -4.48 1.61 5.15 -1.26 -0.66 115.26 123.47 2qfu n ASN 94 Ca 0.00 -3.21 -0.43 0.00 -0.60 0.00 0.00 54.58 50.35 2qfu n ASN 94 Cb 0.00 -0.43 -0.03 0.00 -0.53 0.00 0.00 39.78 38.79 2qfu n ASN 94 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2qfu s ALA 95 N -2.75 3.05 0.29 5.20 0.00 -0.48 -4.88 121.76 122.19 2qfu s ALA 95 Ca 0.39 -2.00 -0.02 0.00 0.00 0.00 0.00 51.96 50.33 2qfu s ALA 95 Cb 0.38 -4.06 0.43 0.00 0.00 0.00 0.00 23.12 19.86 2qfu s ALA 95 CO -0.06 -3.02 1.93 0.78 0.00 0.00 0.00 175.76 175.39 2qfu h GLY 96 N 11.65 1.11 1.83 0.00 0.00 -1.95 -0.23 103.07 115.48 2qfu h GLY 96 Ca -0.13 -0.46 -0.03 0.00 0.00 0.00 0.00 47.33 46.71 2qfu h GLY 96 CO 1.22 0.45 -0.04 -0.91 0.00 0.00 0.00 176.54 177.25 2qfu h THR 97 N 1.05 1.12 0.16 4.70 1.35 -1.97 0.15 112.91 119.47 2qfu h THR 97 Ca 0.27 -0.51 -0.23 0.00 -0.55 0.00 0.00 66.41 65.40 2qfu h THR 97 Cb -0.03 1.06 0.02 0.00 -1.73 0.00 0.00 68.15 67.48 2qfu h THR 97 CO -0.05 0.16 -1.02 0.00 -0.25 0.00 0.00 175.52 174.36 2qfu h ALA 98 N 1.75 -0.06 0.14 6.62 0.00 -1.66 -2.91 119.26 123.15 2qfu h ALA 98 Ca 0.05 -0.79 -0.00 0.00 0.00 0.00 0.00 54.91 54.17 2qfu h ALA 98 Cb 0.22 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2qfu h ALA 98 CO 0.01 0.50 -0.09 1.98 0.00 0.00 0.00 179.25 181.65 2qfu h MET 99 N -0.28 -0.22 -0.22 0.00 -1.53 -0.68 -0.82 114.93 111.18 2qfu h MET 99 Ca -0.19 0.01 -0.07 0.00 -3.44 0.00 0.00 59.70 56.02 2qfu h MET 99 Cb 1.75 0.05 -0.01 0.00 -0.55 0.00 0.00 31.60 32.84 2qfu h MET 99 CO 0.16 -0.14 -0.12 0.00 0.14 0.00 0.00 176.91 176.94 2qfu h ARG 100 N -0.22 0.47 -0.47 0.39 -0.00 -0.87 -0.77 114.38 112.91 2qfu h ARG 100 Ca -0.01 -0.21 -0.04 0.00 -0.50 0.00 0.00 59.98 59.21 2qfu h ARG 100 Cb 0.19 -0.01 -0.02 0.00 0.00 0.00 0.00 29.97 30.13 2qfu h ARG 100 CO 0.01 0.76 0.13 -0.07 0.00 0.00 0.00 179.97 180.80 2qfu h LEU 101 N 0.18 0.69 -0.75 3.04 4.07 -1.51 -2.80 115.31 118.24 2qfu h LEU 101 Ca 0.05 -0.22 -0.13 0.00 0.08 0.00 0.00 57.88 57.66 2qfu h LEU 101 Cb 0.62 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.17 2qfu h LEU 101 CO 0.04 0.73 -0.58 -0.07 -1.08 0.00 0.00 178.44 177.48 2qfu h LEU 102 N 0.62 0.15 -1.17 1.67 3.38 -1.18 -0.79 115.31 117.99 2qfu h LEU 102 Ca 0.15 -0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.07 2qfu h LEU 102 Cb 0.30 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 2qfu h LEU 102 CO -0.00 0.70 0.57 0.00 0.09 0.00 0.00 178.44 179.80 2qfu h ALA 103 N 1.30 1.47 0.01 1.53 0.00 -0.88 -0.81 119.26 121.89 2qfu h ALA 103 Ca -0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2qfu h ALA 103 Cb 1.05 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 2qfu h ALA 103 CO 0.08 0.43 -0.10 0.00 0.00 0.00 0.00 179.25 179.67 2qfu h ALA 104 N 1.50 0.01 -0.91 0.00 0.00 -1.32 -3.36 119.26 115.17 2qfu h ALA 104 Ca 0.35 -0.54 0.04 0.00 0.00 0.00 0.00 54.91 54.76 2qfu h ALA 104 Cb 0.06 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 2qfu h ALA 104 CO -0.11 0.05 0.60 0.00 0.00 0.00 0.00 179.25 179.79 2qfu h ALA 105 N -0.02 1.43 0.00 0.00 0.00 -0.95 -1.42 119.26 118.31 2qfu h ALA 105 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2qfu h ALA 105 Cb 1.05 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2qfu h ALA 105 CO 0.00 0.48 0.00 1.28 0.00 0.00 0.00 179.25 181.01 2qfu n LEU 106 N -4.45 0.00 -0.12 0.00 4.77 -0.33 -2.34 117.00 114.53 2qfu n LEU 106 Ca 0.12 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.24 2qfu n LEU 106 Cb 0.11 0.00 0.52 0.00 -2.33 0.00 0.00 43.42 41.72 2qfu n LEU 106 CO 0.34 0.00 0.78 0.00 -1.33 0.00 0.00 177.39 177.19 2qfu s LEU 108 N -2.58 4.38 0.00 0.00 1.43 -0.99 -1.34 118.68 119.58 2qfu s LEU 108 Ca 0.25 1.82 0.00 0.00 -1.03 0.00 0.00 54.13 55.16 2qfu s LEU 108 Cb 0.19 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.84 2qfu s LEU 108 CO 0.51 -0.32 0.00 0.61 0.23 0.00 0.00 176.35 177.38 2qfu n GLY 109 N 2.93 0.17 3.54 -3.19 0.00 -1.26 -4.73 105.19 102.65 2qfu n GLY 109 Ca 0.07 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 44.80 2qfu n GLY 109 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qfu s SER 110 N -4.00 4.24 0.11 1.61 0.01 -1.26 -0.44 113.70 113.96 2qfu s SER 110 Ca 0.00 -0.33 -0.26 0.00 1.31 0.00 0.00 55.95 56.67 2qfu s SER 110 Cb 0.00 -0.83 0.08 0.00 0.21 0.00 0.00 66.02 65.48 2qfu s SER 110 CO 0.00 0.24 0.97 0.20 0.41 0.00 0.00 173.24 175.06 2qfu s ASN 111 N -1.66 -0.20 -0.37 2.44 0.01 -1.26 -4.77 114.94 109.14 2qfu s ASN 111 Ca 0.17 -0.30 0.04 0.00 -0.71 0.00 0.00 52.86 52.06 2qfu s ASN 111 Cb -0.11 0.44 0.16 0.00 0.41 0.00 0.00 41.25 42.15 2qfu s ASN 111 CO 0.08 -0.79 0.43 -0.62 -1.51 0.00 0.00 177.10 174.69 2qfu s ASP 112 N -2.85 0.59 0.02 -1.22 3.68 -0.62 -4.01 116.67 112.25 2qfu s ASP 112 Ca 0.11 -1.30 0.02 0.00 2.13 0.00 0.00 52.55 53.51 2qfu s ASP 112 Cb -0.01 0.88 -0.01 0.00 -1.45 0.00 0.00 42.92 42.33 2qfu s ASP 112 CO -0.00 -0.25 -0.07 -0.63 0.13 0.00 0.00 175.17 174.34 2qfu s ILE 113 N 1.63 0.57 -0.13 4.11 1.01 -0.70 -0.99 121.20 126.70 2qfu s ILE 113 Ca 0.16 -0.61 -0.00 0.00 0.00 0.00 0.00 60.65 60.20 2qfu s ILE 113 Cb -0.13 -0.54 -0.02 0.00 0.01 0.00 0.00 42.46 41.79 2qfu s ILE 113 CO -0.07 -0.05 -0.11 -0.69 0.00 0.00 0.00 174.94 174.02 2qfu s VAL 114 N -0.62 3.24 -0.17 2.92 1.01 0.53 0.18 120.40 127.48 2qfu s VAL 114 Ca -0.02 -0.60 -0.04 0.00 0.00 0.00 0.00 61.98 61.32 2qfu s VAL 114 Cb -0.05 -2.36 -0.02 0.00 0.00 0.00 0.00 36.38 33.94 2qfu s VAL 114 CO 0.00 0.53 -0.03 -0.76 0.00 0.00 0.00 175.10 174.84 2qfu s LEU 115 N 0.22 3.21 0.00 3.92 1.43 0.02 -0.37 118.68 127.11 2qfu s LEU 115 Ca -0.07 -0.18 0.01 0.00 -1.03 0.00 0.00 54.13 52.87 2qfu s LEU 115 Cb -0.15 -1.79 -0.01 0.00 0.03 0.00 0.00 46.19 44.28 2qfu s LEU 115 CO 0.05 0.12 0.11 1.07 0.23 0.00 0.00 176.35 177.93 2qfu n THR 116 N 3.84 0.00 -2.52 5.49 5.66 -0.54 -1.64 114.28 124.58 2qfu n THR 116 Ca -0.17 -0.72 0.00 0.00 -3.05 0.00 0.00 64.05 60.11 2qfu n THR 116 Cb 0.52 0.38 0.00 0.00 -1.55 0.00 0.00 70.33 69.68 2qfu n THR 116 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2qfu n GLY 117 N -0.20 1.50 3.73 1.09 0.00 -1.26 -0.63 105.19 109.42 2qfu n GLY 117 Ca 0.02 -0.59 -0.31 0.00 0.00 0.00 0.00 46.02 45.14 2qfu n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qfu s GLU 118 N 1.15 1.71 0.29 1.61 2.02 0.16 -4.84 118.70 120.81 2qfu s GLU 118 Ca 0.00 1.09 0.03 0.00 0.02 0.00 0.00 54.97 56.11 2qfu s GLU 118 Cb 0.00 -1.84 0.71 0.00 0.10 0.00 0.00 34.13 33.10 2qfu s GLU 118 CO 0.00 -2.00 1.70 -1.35 0.02 0.00 0.00 175.26 173.63 2qfu h PRO 119 N -1.39 0.40 -0.26 0.39 0.11 -2.00 0.57 132.00 129.82 2qfu h PRO 119 Ca -0.46 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 2qfu h PRO 119 Cb 1.25 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 2qfu h PRO 119 CO 0.51 0.27 -0.04 -0.09 -0.21 0.00 0.00 178.00 178.44 2qfu h ARG 120 N 0.41 0.39 0.00 1.05 9.65 -1.93 -1.74 114.38 122.22 2qfu h ARG 120 Ca 0.55 -0.08 -0.04 0.00 -1.10 0.00 0.00 59.98 59.31 2qfu h ARG 120 Cb 1.02 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.54 2qfu h ARG 120 CO -0.52 0.46 -0.17 1.98 2.80 0.00 0.00 179.97 184.52 2qfu h MET 121 N 0.38 0.00 0.00 0.20 4.05 -1.14 -0.29 114.93 118.13 2qfu h MET 121 Ca 0.08 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.50 2qfu h MET 121 Cb 0.32 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.12 2qfu h MET 121 CO 0.01 0.17 0.00 1.63 0.23 0.00 0.00 176.91 178.95 2qfu n LYS 122 N -3.89 0.63 -0.03 0.39 5.02 -0.66 -2.21 118.16 117.42 2qfu n LYS 122 Ca -0.02 0.02 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 2qfu n LYS 122 Cb 0.26 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 33.83 2qfu n LYS 122 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2qfu n GLU 123 N -1.11 0.79 -3.76 1.97 1.02 -0.14 -4.57 120.64 114.85 2qfu n GLU 123 Ca 0.16 -1.23 -0.36 0.00 -0.02 0.00 0.00 57.16 55.71 2qfu n GLU 123 Cb 0.13 -1.19 -0.09 0.00 -0.02 0.00 0.00 31.44 30.27 2qfu n GLU 123 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2qfu s ARG 124 N -0.83 4.05 0.48 3.49 0.52 -0.94 -5.05 118.95 120.68 2qfu s ARG 124 Ca 0.13 -0.29 -0.24 0.00 -0.52 0.00 0.00 55.73 54.81 2qfu s ARG 124 Cb 0.08 -3.43 -0.07 0.00 0.52 0.00 0.00 34.95 32.05 2qfu s ARG 124 CO 0.12 0.15 1.42 -0.35 0.02 0.00 0.00 175.30 176.66 2qfu n PRO 125 N 3.97 2.11 0.00 3.54 -0.04 -1.26 -4.36 135.00 138.96 2qfu n PRO 125 Ca -0.16 0.76 0.00 0.00 -0.04 0.00 0.00 63.50 64.06 2qfu n PRO 125 Cb 0.52 -2.62 0.00 0.00 -0.04 0.00 0.00 33.50 31.36 2qfu n PRO 125 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 2qfu n ILE 126 N -0.44 0.00 -0.33 0.52 3.06 -0.04 -4.93 119.36 117.21 2qfu n ILE 126 Ca 0.07 0.00 0.05 0.00 -2.50 0.00 0.00 62.75 60.37 2qfu n ILE 126 Cb 0.42 1.14 0.24 0.00 0.54 0.00 0.00 39.64 41.98 2qfu n ILE 126 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 2qfu h GLY 127 N 0.00 1.42 1.40 4.50 0.00 -1.75 -1.55 103.07 107.10 2qfu h GLY 127 Ca 0.00 -0.42 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 2qfu h GLY 127 CO 0.00 0.25 0.22 0.45 0.00 0.00 0.00 176.54 177.46 2qfu h HIS 128 N 1.01 0.77 -0.09 5.60 3.86 -1.92 0.88 115.15 125.26 2qfu h HIS 128 Ca 0.43 -0.04 -0.13 0.00 -1.16 0.00 0.00 60.37 59.48 2qfu h HIS 128 Cb 0.32 -0.24 0.01 0.00 1.06 0.00 0.00 27.41 28.55 2qfu h HIS 128 CO -0.00 0.59 -0.43 1.25 0.86 0.00 0.00 177.93 180.20 2qfu h LEU 129 N 0.76 0.54 -0.71 2.43 5.85 -1.69 -2.67 115.31 119.83 2qfu h LEU 129 Ca 0.18 -0.64 0.01 0.00 0.84 0.00 0.00 57.88 58.28 2qfu h LEU 129 Cb 0.14 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 2qfu h LEU 129 CO -0.02 1.09 0.46 0.58 -0.34 0.00 0.00 178.44 180.22 2qfu h VAL 130 N 0.03 1.16 -0.44 1.05 2.07 -1.02 -0.35 116.25 118.74 2qfu h VAL 130 Ca -0.03 -0.32 0.04 0.00 0.82 0.00 0.00 66.70 67.21 2qfu h VAL 130 Cb 1.07 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 2qfu h VAL 130 CO 0.09 0.17 0.21 0.44 0.02 0.00 0.00 177.57 178.50 2qfu h ASP 131 N 0.93 0.30 -0.39 0.57 3.45 -0.84 -0.91 116.42 119.53 2qfu h ASP 131 Ca 0.27 0.03 -0.04 0.00 0.43 0.00 0.00 57.03 57.72 2qfu h ASP 131 Cb -0.07 -0.03 -0.02 0.00 -0.56 0.00 0.00 39.33 38.65 2qfu h ASP 131 CO -0.07 0.21 0.10 0.00 -1.57 0.00 0.00 179.24 177.92 2qfu h ALA 132 N 1.24 0.52 -0.88 3.45 0.00 -1.05 -2.08 119.26 120.45 2qfu h ALA 132 Ca 0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2qfu h ALA 132 Cb 0.11 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 2qfu h ALA 132 CO -0.14 0.18 0.50 -0.07 0.00 0.00 0.00 179.25 179.72 2qfu h LEU 133 N 0.49 1.09 -0.80 0.00 3.38 -0.79 -2.18 115.31 116.50 2qfu h LEU 133 Ca 0.12 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 2qfu h LEU 133 Cb 0.29 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2qfu h LEU 133 CO -0.00 0.86 0.07 0.03 0.09 0.00 0.00 178.44 179.49 2qfu h ARG 134 N 1.23 0.98 0.00 1.13 3.08 -1.03 -1.05 114.38 118.72 2qfu h ARG 134 Ca 0.31 -0.26 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2qfu h ARG 134 Cb 0.00 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 29.93 2qfu h ARG 134 CO -0.05 0.92 -0.05 -0.07 -1.07 0.00 0.00 179.97 179.65 2qfu h LEU 135 N 0.91 0.00 -0.64 3.04 3.38 -0.75 -0.52 115.31 120.73 2qfu h LEU 135 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2qfu h LEU 135 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 2qfu h LEU 135 CO 0.01 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.20 2qfu n GLY 136 N -1.29 -0.34 0.00 0.83 0.00 -0.76 -4.81 105.19 98.82 2qfu n GLY 136 Ca -0.03 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.63 2qfu n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qfu n GLY 137 N 1.11 0.89 3.77 -0.02 0.00 -0.20 -0.89 105.19 109.85 2qfu n GLY 137 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 2qfu n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qfu s ALA 138 N -2.00 2.93 -0.29 4.61 0.00 -0.47 -4.19 121.76 122.35 2qfu s ALA 138 Ca 0.00 1.03 -0.09 0.00 0.00 0.00 0.00 51.96 52.89 2qfu s ALA 138 Cb 0.00 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 19.67 2qfu s ALA 138 CO 0.00 -0.83 0.14 0.21 0.00 0.00 0.00 175.76 175.28 2qfu s LYS 139 N -2.76 3.53 -0.02 0.00 2.47 0.40 -4.30 119.74 119.06 2qfu s LYS 139 Ca 0.66 -0.58 0.01 0.00 -1.56 0.00 0.00 55.97 54.49 2qfu s LYS 139 Cb -0.31 -3.54 0.02 0.00 -1.46 0.00 0.00 37.83 32.54 2qfu s LYS 139 CO 0.38 -0.32 -0.02 0.42 0.16 0.00 0.00 175.35 175.96 2qfu s ILE 140 N 1.65 0.28 -0.07 5.43 1.01 -1.26 -1.27 121.20 126.96 2qfu s ILE 140 Ca 0.06 -0.04 0.05 0.00 0.00 0.00 0.00 60.65 60.71 2qfu s ILE 140 Cb -0.16 -0.32 -0.01 0.00 0.01 0.00 0.00 42.46 41.98 2qfu s ILE 140 CO 0.07 0.14 -0.22 -0.89 0.00 0.00 0.00 174.94 174.03 2qfu s THR 141 N 0.60 2.26 -0.21 2.92 2.01 -0.42 -4.97 115.64 117.83 2qfu s THR 141 Ca -0.06 -0.98 -0.23 0.00 0.31 0.00 0.00 61.69 60.73 2qfu s THR 141 Cb -0.10 -1.85 -0.02 0.00 0.01 0.00 0.00 72.50 70.55 2qfu s THR 141 CO -0.01 0.56 0.74 -0.31 -0.69 0.00 0.00 174.62 174.92 2qfu s TYR 142 N -0.05 3.36 -0.39 4.92 2.02 -1.26 -0.84 117.35 125.11 2qfu s TYR 142 Ca -0.06 1.06 0.23 0.00 -0.37 0.00 0.00 57.07 57.93 2qfu s TYR 142 Cb -0.15 -2.93 0.20 0.00 -0.40 0.00 0.00 41.96 38.68 2qfu s TYR 142 CO 0.05 -0.28 1.29 -0.07 -1.57 0.00 0.00 175.55 174.97 2qfu h LEU 143 N 8.61 0.00 0.00 -1.29 3.38 -1.68 -3.47 115.31 120.86 2qfu h LEU 143 Ca -0.28 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.65 2qfu h LEU 143 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 2qfu h LEU 143 CO 0.82 0.02 0.00 -0.62 0.09 0.00 0.00 178.44 178.75 2qfu n GLU 144 N -2.67 0.00 -2.46 1.13 1.02 -1.26 -5.00 120.64 111.39 2qfu n GLU 144 Ca 0.02 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.74 2qfu n GLU 144 Cb 0.52 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.90 2qfu n GLU 144 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 2qfu s GLN 145 N 2.45 4.51 0.29 3.49 2.00 -1.26 -4.97 119.66 126.16 2qfu s GLN 145 Ca 0.00 1.75 -0.30 0.00 -2.00 0.00 0.00 55.36 54.81 2qfu s GLN 145 Cb 0.00 -3.31 -0.13 0.00 0.80 0.00 0.00 33.01 30.38 2qfu s GLN 145 CO 0.00 -0.10 1.43 -1.91 -0.50 0.00 0.00 175.29 174.22 2qfu n GLU 146 N 3.11 2.26 -0.88 1.67 4.07 -1.26 -2.20 120.64 127.40 2qfu n GLU 146 Ca 0.06 0.80 0.00 0.00 -0.06 0.00 0.00 57.16 57.96 2qfu n GLU 146 Cb 0.46 -2.48 0.00 0.00 -0.06 0.00 0.00 31.44 29.37 2qfu n GLU 146 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2qfu n ASN 147 N 1.73 -1.60 -4.11 4.31 3.02 -1.26 -5.01 115.26 112.34 2qfu n ASN 147 Ca 0.09 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.55 2qfu n ASN 147 Cb 0.34 -0.27 -0.10 0.00 -0.61 0.00 0.00 39.78 39.15 2qfu n ASN 147 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2qfu s TYR 148 N -2.70 0.63 0.87 3.10 1.51 -0.94 -0.86 117.35 118.96 2qfu s TYR 148 Ca 0.00 -0.99 -0.11 0.00 -1.01 0.00 0.00 57.07 54.96 2qfu s TYR 148 Cb 0.00 -0.42 0.11 0.00 -0.11 0.00 0.00 41.96 41.54 2qfu s TYR 148 CO 0.00 -0.29 1.10 -2.14 -1.11 0.00 0.00 175.55 173.11 2qfu s PRO 149 N -3.75 1.49 0.53 -1.71 0.02 -1.26 -4.62 135.00 125.70 2qfu s PRO 149 Ca 0.07 1.12 -0.17 0.00 0.02 0.00 0.00 61.00 62.04 2qfu s PRO 149 Cb 0.06 -1.81 -0.07 0.00 0.02 0.00 0.00 34.50 32.70 2qfu s PRO 149 CO -0.08 -2.17 1.01 -1.25 -0.33 0.00 0.00 177.00 174.19 2qfu s PRO 150 N -4.83 3.74 0.05 5.54 0.04 -1.26 -4.46 135.00 133.80 2qfu s PRO 150 Ca 0.63 1.08 0.09 0.00 0.04 0.00 0.00 61.00 62.84 2qfu s PRO 150 Cb -0.19 -2.10 -0.03 0.00 0.04 0.00 0.00 34.50 32.22 2qfu s PRO 150 CO 0.57 -0.46 -0.24 -0.51 0.04 0.00 0.00 177.00 176.40 2qfu s LEU 151 N -4.12 2.17 -0.22 -3.56 1.43 -0.65 -1.91 118.68 111.82 2qfu s LEU 151 Ca 0.61 -0.57 -0.04 0.00 -1.03 0.00 0.00 54.13 53.10 2qfu s LEU 151 Cb -0.12 -1.17 -0.01 0.00 0.03 0.00 0.00 46.19 44.91 2qfu s LEU 151 CO 0.31 0.22 -0.03 -0.60 0.23 0.00 0.00 176.35 176.48 2qfu s ARG 152 N -1.23 3.38 -0.23 1.70 3.52 -0.02 -0.80 118.95 125.27 2qfu s ARG 152 Ca 0.10 -0.62 -0.09 0.00 -0.13 0.00 0.00 55.73 54.99 2qfu s ARG 152 Cb -0.10 -3.04 -0.04 0.00 -1.56 0.00 0.00 34.95 30.22 2qfu s ARG 152 CO 0.02 -0.20 0.11 -0.51 -0.81 0.00 0.00 175.30 173.91 2qfu s LEU 153 N 1.49 3.83 -0.11 -0.88 1.43 0.13 -1.30 118.68 123.26 2qfu s LEU 153 Ca 0.06 -0.01 0.15 0.00 -1.03 0.00 0.00 54.13 53.30 2qfu s LEU 153 Cb -0.14 -2.02 0.28 0.00 0.03 0.00 0.00 46.19 44.34 2qfu s LEU 153 CO -0.03 0.04 1.18 0.00 0.23 0.00 0.00 176.35 177.77 2qfu n GLN 154 N 4.41 1.97 0.00 1.70 6.02 -0.40 -1.73 117.38 129.35 2qfu n GLN 154 Ca -0.16 -2.40 0.00 0.00 -0.01 0.00 0.00 57.00 54.44 2qfu n GLN 154 Cb 0.52 -1.46 0.00 0.00 1.02 0.00 0.00 30.24 30.32 2qfu n GLN 154 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qfu n GLY 155 N -1.00 -1.69 0.00 1.08 0.00 -1.25 -3.99 105.19 98.34 2qfu n GLY 155 Ca 0.14 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.83 2qfu n GLY 155 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qfu n GLY 156 N 0.00 0.60 3.63 -0.02 0.00 0.41 -0.45 105.19 109.35 2qfu n GLY 156 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2qfu n GLY 156 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2qfu s PHE 157 N -2.00 2.26 -0.24 1.61 5.36 -0.45 -3.48 117.98 121.03 2qfu s PHE 157 Ca 0.00 0.63 0.09 0.00 -0.96 0.00 0.00 56.93 56.69 2qfu s PHE 157 Cb 0.00 -3.96 -0.12 0.00 -0.34 0.00 0.00 43.02 38.60 2qfu s PHE 157 CO 0.00 -2.62 0.30 0.25 -1.46 0.00 0.00 175.22 171.69 2qfu n THR 158 N 6.34 0.00 0.00 0.12 -2.24 -0.07 -4.51 114.28 113.92 2qfu n THR 158 Ca 0.18 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2qfu n THR 158 Cb 0.46 0.68 0.00 0.00 -2.10 0.00 0.00 70.33 69.37 2qfu n THR 158 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qfu n GLY 159 N 1.55 0.19 0.00 3.38 0.00 -1.12 -1.29 105.19 107.89 2qfu n GLY 159 Ca 0.00 -2.19 0.00 0.00 0.00 0.00 0.00 46.02 43.83 2qfu n GLY 159 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qfu n GLY 160 N 0.00 -0.99 3.61 -0.02 0.00 0.25 -4.50 105.19 103.55 2qfu n GLY 160 Ca 0.00 -2.08 -0.41 0.00 0.00 0.00 0.00 46.02 43.53 2qfu n GLY 160 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qfu s ASN 161 N -4.00 6.58 -0.13 1.61 0.01 -1.26 -1.02 114.94 116.73 2qfu s ASN 161 Ca 0.00 0.61 0.02 0.00 -0.71 0.00 0.00 52.86 52.77 2qfu s ASN 161 Cb 0.00 -2.36 0.02 0.00 0.41 0.00 0.00 41.25 39.32 2qfu s ASN 161 CO 0.00 -0.48 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.25 2qfu s VAL 162 N 2.68 1.66 0.09 1.60 1.01 -0.06 -4.69 120.40 122.70 2qfu s VAL 162 Ca 0.28 -0.73 -0.04 0.00 0.00 0.00 0.00 61.98 61.49 2qfu s VAL 162 Cb -0.15 -1.52 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 2qfu s VAL 162 CO 0.11 0.47 0.32 -1.81 0.00 0.00 0.00 175.10 174.19 2qfu s ASP 163 N 1.09 6.47 -0.06 3.32 1.01 -1.26 -0.33 116.67 126.90 2qfu s ASP 163 Ca -0.03 0.52 -0.05 0.00 0.71 0.00 0.00 52.55 53.70 2qfu s ASP 163 Cb -0.14 -2.07 0.02 0.00 1.01 0.00 0.00 42.92 41.74 2qfu s ASP 163 CO -0.04 0.12 0.16 0.54 0.21 0.00 0.00 175.17 176.16 2qfu s VAL 164 N -1.54 -0.01 -0.06 -1.27 0.11 -0.09 -4.20 120.40 113.33 2qfu s VAL 164 Ca 0.37 0.05 -0.28 0.00 -2.93 0.00 0.00 61.98 59.18 2qfu s VAL 164 Cb -0.13 -0.24 -0.02 0.00 -1.53 0.00 0.00 36.38 34.46 2qfu s VAL 164 CO 0.23 0.02 0.93 -0.62 -3.33 0.00 0.00 175.10 172.34 2qfu s ASP 165 N 0.43 7.23 -0.08 3.54 -1.08 -1.26 -1.10 116.67 124.36 2qfu s ASP 165 Ca -0.03 1.50 0.13 0.00 -0.52 0.00 0.00 52.55 53.63 2qfu s ASP 165 Cb -0.04 -2.53 0.42 0.00 -1.46 0.00 0.00 42.92 39.30 2qfu s ASP 165 CO -0.02 -0.32 1.34 0.61 0.52 0.00 0.00 175.17 177.30 2qfu n GLY 166 N 3.06 3.28 0.06 2.66 0.00 -1.23 -4.69 105.19 108.32 2qfu n GLY 166 Ca 0.06 -0.67 0.13 0.00 0.00 0.00 0.00 46.02 45.54 2qfu n GLY 166 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qfu n SER 167 N 0.13 0.53 -0.05 1.61 3.41 -1.05 -1.35 113.62 116.85 2qfu n SER 167 Ca 0.16 0.40 -0.08 0.00 -0.26 0.00 0.00 58.87 59.10 2qfu n SER 167 Cb 0.64 -0.45 -0.04 0.00 -0.26 0.00 0.00 64.21 64.09 2qfu n SER 167 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2qfu n VAL 168 N -1.94 0.56 -3.77 -3.33 0.31 -1.26 -4.74 118.33 104.15 2qfu n VAL 168 Ca 0.06 -0.20 -0.13 0.00 -0.01 0.00 0.00 64.34 64.06 2qfu n VAL 168 Cb 0.40 -1.02 -0.12 0.00 -0.91 0.00 0.00 33.84 32.18 2qfu n VAL 168 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2qfu s SER 169 N -5.16 -0.24 0.23 4.52 0.15 -1.26 -4.82 113.70 107.12 2qfu s SER 169 Ca -0.13 0.47 0.26 0.00 0.70 0.00 0.00 55.95 57.24 2qfu s SER 169 Cb 0.04 0.43 0.84 0.00 -1.71 0.00 0.00 66.02 65.62 2qfu s SER 169 CO 0.21 -0.11 1.76 -1.54 1.20 0.00 0.00 173.24 174.77 2qfu n SER 170 N 3.38 0.82 0.25 5.45 3.41 -1.26 -3.52 113.62 122.15 2qfu n SER 170 Ca -0.17 0.60 0.10 0.00 -0.26 0.00 0.00 58.87 59.14 2qfu n SER 170 Cb 0.57 -0.81 0.66 0.00 -0.26 0.00 0.00 64.21 64.37 2qfu n SER 170 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2qfu h GLN 171 N 0.00 0.00 -0.20 4.33 4.20 -1.94 -0.99 115.11 120.51 2qfu h GLN 171 Ca 0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 2qfu h GLN 171 Cb 0.66 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.43 2qfu h GLN 171 CO 0.00 0.13 0.01 0.74 -0.67 0.00 0.00 178.83 179.04 2qfu h PHE 172 N 0.00 0.36 -0.47 2.96 0.04 -1.92 0.13 116.94 118.04 2qfu h PHE 172 Ca -0.00 -0.06 -0.03 0.00 2.80 0.00 0.00 57.97 60.68 2qfu h PHE 172 Cb 0.29 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.32 2qfu h PHE 172 CO 0.00 0.51 0.17 1.25 -0.60 0.00 0.00 178.31 179.64 2qfu h LEU 173 N 0.11 0.67 -0.54 1.54 5.85 -1.65 -1.96 115.31 119.32 2qfu h LEU 173 Ca 0.06 -0.19 0.08 0.00 0.84 0.00 0.00 57.88 58.67 2qfu h LEU 173 Cb 0.36 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.15 2qfu h LEU 173 CO 0.01 0.68 0.19 0.74 -0.34 0.00 0.00 178.44 179.71 2qfu h THR 174 N 0.62 0.79 -0.74 1.05 2.02 -1.04 0.00 112.91 115.62 2qfu h THR 174 Ca 0.15 -0.12 -0.02 0.00 0.77 0.00 0.00 66.41 67.18 2qfu h THR 174 Cb 0.23 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 67.01 2qfu h THR 174 CO -0.01 0.07 0.36 0.00 0.37 0.00 0.00 175.52 176.31 2qfu h ALA 175 N 1.37 0.95 -0.44 6.16 0.00 -0.72 -1.58 119.26 125.01 2qfu h ALA 175 Ca 0.27 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 2qfu h ALA 175 Cb 0.31 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2qfu h ALA 175 CO -0.28 0.51 0.11 -0.07 0.00 0.00 0.00 179.25 179.51 2qfu h LEU 176 N 1.03 0.67 -0.86 0.00 3.38 -0.82 -2.40 115.31 116.31 2qfu h LEU 176 Ca 0.25 -0.23 0.02 0.00 0.09 0.00 0.00 57.88 58.01 2qfu h LEU 176 Cb 0.10 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.63 2qfu h LEU 176 CO -0.03 0.73 0.56 -0.07 0.09 0.00 0.00 178.44 179.72 2qfu h LEU 177 N 0.58 0.96 -0.88 1.67 3.38 -0.62 0.02 115.31 120.42 2qfu h LEU 177 Ca 0.14 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.98 2qfu h LEU 177 Cb 0.32 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2qfu h LEU 177 CO 0.00 0.67 -0.55 0.24 0.09 0.00 0.00 178.44 178.89 2qfu h MET 178 N 1.12 0.00 0.12 1.13 2.86 -1.22 -3.33 114.93 115.61 2qfu h MET 178 Ca 0.33 0.00 -0.24 0.00 -2.06 0.00 0.00 59.70 57.73 2qfu h MET 178 Cb -0.06 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.60 2qfu h MET 178 CO -0.09 0.55 -1.16 1.15 1.06 0.00 0.00 176.91 178.42 2qfu h THR 179 N 0.00 1.23 -1.00 2.22 2.02 -1.06 -3.40 112.91 112.93 2qfu h THR 179 Ca -0.01 -2.45 0.20 0.00 0.77 0.00 0.00 66.41 64.92 2qfu h THR 179 Cb 0.99 2.90 -0.10 0.00 -1.74 0.00 0.00 68.15 70.20 2qfu h THR 179 CO 0.07 0.70 0.61 0.00 0.37 0.00 0.00 175.52 177.28 2qfu h ALA 180 N -0.01 1.77 -0.38 6.16 0.00 -1.11 -2.22 119.26 123.47 2qfu h ALA 180 Ca -0.24 0.07 0.11 0.00 0.00 0.00 0.00 54.91 54.85 2qfu h ALA 180 Cb 1.70 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 2qfu h ALA 180 CO 0.09 -0.14 0.30 -1.35 0.00 0.00 0.00 179.25 178.15 2qfu h PRO 181 N 0.70 0.00 -0.01 0.00 0.11 -1.77 -1.13 132.00 129.89 2qfu h PRO 181 Ca 0.57 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.68 2qfu h PRO 181 Cb 0.97 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.08 2qfu h PRO 181 CO -0.35 0.00 -0.13 1.28 -0.21 0.00 0.00 178.00 178.58 2qfu n LEU 182 N -4.25 1.49 -4.80 2.35 4.32 -0.83 -0.65 117.00 114.62 2qfu n LEU 182 Ca 0.06 -0.47 -0.33 0.00 -0.02 0.00 0.00 56.01 55.25 2qfu n LEU 182 Cb 0.48 -0.05 -0.01 0.00 -1.62 0.00 0.00 43.42 42.22 2qfu n LEU 182 CO 0.34 0.26 0.71 0.00 -1.22 0.00 0.00 177.39 177.48 2qfu s ALA 183 N -2.23 2.83 0.30 -1.18 0.00 -0.43 -4.60 121.76 116.45 2qfu s ALA 183 Ca 0.30 0.46 0.04 0.00 0.00 0.00 0.00 51.96 52.76 2qfu s ALA 183 Cb 0.20 -3.23 0.48 0.00 0.00 0.00 0.00 23.12 20.57 2qfu s ALA 183 CO 0.42 -0.54 1.76 -1.00 0.00 0.00 0.00 175.76 176.40 2qfu h PRO 184 N 0.94 0.44 -6.21 0.00 0.13 -1.84 0.90 132.00 126.35 2qfu h PRO 184 Ca -0.48 -0.15 -0.48 0.00 -0.87 0.00 0.00 66.00 64.02 2qfu h PRO 184 Cb 1.22 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 2qfu h PRO 184 CO 0.58 0.64 -0.47 -1.21 -0.23 0.00 0.00 178.00 177.31 2qfu s GLU 185 N -4.54 3.04 0.58 0.86 2.02 -0.41 -4.12 118.70 116.12 2qfu s GLU 185 Ca -0.07 -1.02 -0.18 0.00 0.02 0.00 0.00 54.97 53.73 2qfu s GLU 185 Cb 0.14 -2.66 -0.04 0.00 0.10 0.00 0.00 34.13 31.67 2qfu s GLU 185 CO 0.78 0.32 1.11 -0.51 0.02 0.00 0.00 175.26 176.98 2qfu s ASP 186 N -3.94 5.56 -0.03 -0.19 -0.00 -1.26 -3.83 116.67 112.98 2qfu s ASP 186 Ca 0.36 2.07 0.04 0.00 -0.00 0.00 0.00 52.55 55.02 2qfu s ASP 186 Cb -0.08 -2.57 -0.01 0.00 -0.00 0.00 0.00 42.92 40.27 2qfu s ASP 186 CO 0.27 -1.32 -0.15 -0.89 -0.00 0.00 0.00 175.17 173.07 2qfu s THR 187 N -2.03 1.24 -0.25 -1.27 2.01 -0.29 -0.58 115.64 114.47 2qfu s THR 187 Ca 0.70 -0.63 0.00 0.00 0.31 0.00 0.00 61.69 62.07 2qfu s THR 187 Cb -0.22 -1.05 0.04 0.00 0.01 0.00 0.00 72.50 71.28 2qfu s THR 187 CO 0.32 0.36 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.83 2qfu s VAL 188 N -0.08 2.55 -0.31 3.82 1.01 -0.19 -0.72 120.40 126.48 2qfu s VAL 188 Ca -0.00 -1.26 -0.13 0.00 0.00 0.00 0.00 61.98 60.58 2qfu s VAL 188 Cb -0.09 -2.36 -0.03 0.00 0.00 0.00 0.00 36.38 33.90 2qfu s VAL 188 CO 0.01 0.13 0.28 -0.63 0.00 0.00 0.00 175.10 174.88 2qfu s ILE 189 N 1.24 5.25 -0.18 2.22 1.01 0.27 -0.88 121.20 130.12 2qfu s ILE 189 Ca -0.03 0.07 -0.05 0.00 0.00 0.00 0.00 60.65 60.65 2qfu s ILE 189 Cb -0.18 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.58 2qfu s ILE 189 CO -0.05 0.07 -0.01 -0.60 0.00 0.00 0.00 174.94 174.34 2qfu s ARG 190 N 1.86 3.67 -0.05 2.79 3.00 0.56 -0.61 118.95 130.17 2qfu s ARG 190 Ca 0.09 -0.51 -0.29 0.00 -1.00 0.00 0.00 55.73 54.02 2qfu s ARG 190 Cb -0.17 -3.01 -0.02 0.00 0.00 0.00 0.00 34.95 31.75 2qfu s ARG 190 CO 0.11 0.14 0.96 0.42 0.00 0.00 0.00 175.30 176.93 2qfu s ILE 191 N 0.64 4.85 0.09 4.11 -1.09 -0.20 -0.91 121.20 128.69 2qfu s ILE 191 Ca -0.01 1.99 -0.20 0.00 -2.23 0.00 0.00 60.65 60.20 2qfu s ILE 191 Cb -0.14 -4.29 -0.09 0.00 -1.58 0.00 0.00 42.46 36.37 2qfu s ILE 191 CO 0.02 0.11 1.62 0.11 -1.23 0.00 0.00 174.94 175.57 2qfu h LYS 192 N 6.93 0.31 0.00 2.79 1.57 -1.44 -3.47 116.57 123.26 2qfu h LYS 192 Ca -0.37 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 2qfu h LYS 192 Cb 1.19 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.45 2qfu h LYS 192 CO 0.79 0.38 0.00 0.41 -0.57 0.00 0.00 179.45 180.46 2qfu n GLY 193 N -0.68 2.97 3.80 3.86 0.00 -1.26 -5.07 105.19 108.81 2qfu n GLY 193 Ca -0.04 -0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 2qfu n GLY 193 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qfu s ASP 194 N 1.41 5.47 -0.16 1.61 1.01 -1.26 -4.89 116.67 119.87 2qfu s ASP 194 Ca 0.00 1.79 -0.00 0.00 0.71 0.00 0.00 52.55 55.05 2qfu s ASP 194 Cb 0.00 -2.52 0.04 0.00 1.01 0.00 0.00 42.92 41.44 2qfu s ASP 194 CO 0.00 -1.38 -0.08 -0.22 0.21 0.00 0.00 175.17 173.71 2qfu s LEU 195 N -4.95 1.68 0.44 1.23 2.96 -1.25 -2.53 118.68 116.27 2qfu s LEU 195 Ca 0.62 -0.63 0.01 0.00 -0.22 0.00 0.00 54.13 53.91 2qfu s LEU 195 Cb -0.16 -0.99 -0.00 0.00 0.50 0.00 0.00 46.19 45.53 2qfu s LEU 195 CO 0.44 -0.15 0.66 0.68 -1.32 0.00 0.00 176.35 176.65 2qfu s VAL 196 N 1.58 3.94 -1.60 1.68 -7.23 -0.46 -4.40 120.40 113.91 2qfu s VAL 196 Ca 0.01 -0.56 -0.16 0.00 -1.81 0.00 0.00 61.98 59.47 2qfu s VAL 196 Cb -0.15 -3.45 0.12 0.00 0.56 0.00 0.00 36.38 33.46 2qfu s VAL 196 CO -0.08 -0.30 0.91 -1.20 -0.31 0.00 0.00 175.10 174.11 2qfu n SER 197 N -2.05 -4.19 -0.35 4.85 7.64 -1.22 -4.09 113.62 114.21 2qfu n SER 197 Ca 0.02 -0.88 0.13 0.00 1.01 0.00 0.00 58.87 59.15 2qfu n SER 197 Cb 0.58 -3.42 0.32 0.00 -1.01 0.00 0.00 64.21 60.68 2qfu n SER 197 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 2qfu h LYS 198 N -1.85 0.74 -0.13 1.43 3.64 -1.82 -1.74 116.57 116.85 2qfu h LYS 198 Ca -0.58 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 58.79 2qfu h LYS 198 Cb 1.38 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 2qfu h LYS 198 CO 0.72 0.49 0.17 -1.35 -2.27 0.00 0.00 179.45 177.21 2qfu h PRO 199 N 0.76 0.00 0.00 1.90 0.11 -1.89 -0.09 132.00 132.80 2qfu h PRO 199 Ca 0.58 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.65 2qfu h PRO 199 Cb 0.90 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 2qfu h PRO 199 CO -0.38 0.00 -0.18 1.88 -0.21 0.00 0.00 178.00 179.11 2qfu h TYR 200 N 0.00 0.00 -0.33 0.65 -1.99 -1.68 -2.14 116.97 111.48 2qfu h TYR 200 Ca 0.06 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.69 2qfu h TYR 200 Cb 0.40 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.11 2qfu h TYR 200 CO 0.00 0.18 -0.20 0.82 -0.00 0.00 0.00 178.16 178.96 2qfu h ILE 201 N 0.00 1.26 -0.25 -2.88 1.08 -1.16 -2.02 117.51 113.54 2qfu h ILE 201 Ca -0.00 -1.24 -0.08 0.00 -0.39 0.00 0.00 64.86 63.14 2qfu h ILE 201 Cb 0.68 1.23 -0.01 0.00 -3.07 0.00 0.00 36.82 35.64 2qfu h ILE 201 CO 0.02 0.41 -0.19 0.44 -0.69 0.00 0.00 178.15 178.14 2qfu h ASP 202 N 0.55 0.44 -0.40 1.72 3.45 -1.44 -1.13 116.42 119.61 2qfu h ASP 202 Ca 0.08 -0.13 -0.03 0.00 0.43 0.00 0.00 57.03 57.39 2qfu h ASP 202 Cb 0.65 -0.12 -0.02 0.00 -0.56 0.00 0.00 39.33 39.29 2qfu h ASP 202 CO 0.05 0.65 0.14 0.40 -1.57 0.00 0.00 179.24 178.91 2qfu h ILE 203 N 0.41 1.20 -0.22 0.35 2.04 -1.20 -1.21 117.51 118.88 2qfu h ILE 203 Ca 0.07 -0.65 0.02 0.00 1.00 0.00 0.00 64.86 65.31 2qfu h ILE 203 Cb 0.57 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 2qfu h ILE 203 CO 0.04 0.23 0.07 0.74 0.00 0.00 0.00 178.15 179.23 2qfu h THR 204 N 0.50 0.94 -0.38 -0.27 2.02 -0.85 -1.12 112.91 113.76 2qfu h THR 204 Ca 0.13 -0.06 -0.07 0.00 0.77 0.00 0.00 66.41 67.18 2qfu h THR 204 Cb 0.22 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 2qfu h THR 204 CO -0.01 0.03 -0.05 -0.07 0.37 0.00 0.00 175.52 175.80 2qfu h LEU 205 N 0.17 0.59 -0.10 2.58 3.38 -1.10 -0.81 115.31 120.03 2qfu h LEU 205 Ca 0.09 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 2qfu h LEU 205 Cb 0.06 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2qfu h LEU 205 CO -0.10 0.70 0.04 -1.13 0.09 0.00 0.00 178.44 178.04 2qfu h ASN 206 N 0.58 0.14 -0.63 -0.43 -0.73 -0.87 -1.17 115.58 112.47 2qfu h ASN 206 Ca 0.11 -0.16 -0.05 0.00 1.87 0.00 0.00 56.30 58.07 2qfu h ASN 206 Cb 0.44 -0.04 -0.03 0.00 0.27 0.00 0.00 38.32 38.97 2qfu h ASN 206 CO 0.02 0.26 0.19 -0.07 -0.37 0.00 0.00 177.43 177.46 2qfu h LEU 207 N -0.00 0.93 -0.72 0.34 -0.00 -0.90 -1.59 115.31 113.37 2qfu h LEU 207 Ca 0.03 -0.21 0.02 0.00 -0.00 0.00 0.00 57.88 57.72 2qfu h LEU 207 Cb 0.17 -0.24 -0.04 0.00 -0.00 0.00 0.00 40.66 40.55 2qfu h LEU 207 CO -0.00 0.89 0.47 0.24 -0.00 0.00 0.00 178.44 180.04 2qfu h MET 208 N 0.91 0.91 -0.68 1.13 2.86 -1.03 -1.70 114.93 117.34 2qfu h MET 208 Ca 0.20 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.74 2qfu h MET 208 Cb 0.31 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 2qfu h MET 208 CO -0.00 0.60 0.23 -0.22 1.06 0.00 0.00 176.91 178.58 2qfu h LYS 209 N 0.94 1.02 -0.69 1.72 3.64 -0.77 -0.69 116.57 121.73 2qfu h LYS 209 Ca 0.27 -0.20 0.04 0.00 -1.27 0.00 0.00 60.65 59.49 2qfu h LYS 209 Cb -0.06 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 31.56 2qfu h LYS 209 CO -0.08 0.86 0.46 1.15 -2.27 0.00 0.00 179.45 179.57 2qfu h THR 210 N 0.99 1.09 -0.33 1.00 2.02 -0.57 -1.01 112.91 116.10 2qfu h THR 210 Ca 0.22 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 67.12 2qfu h THR 210 Cb 0.25 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 66.86 2qfu h THR 210 CO -0.01 0.15 0.00 0.49 0.37 0.00 0.00 175.52 176.52 2qfu n PHE 211 N -4.46 1.09 -0.61 3.16 3.72 -0.67 -4.48 117.46 115.21 2qfu n PHE 211 Ca 0.09 -0.39 0.00 0.00 -0.05 0.00 0.00 57.45 57.10 2qfu n PHE 211 Cb 0.13 -0.29 0.00 0.00 -0.94 0.00 0.00 39.48 38.39 2qfu n PHE 211 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qfu n GLY 212 N 0.46 0.67 3.04 1.37 0.00 -0.38 -0.55 105.19 109.81 2qfu n GLY 212 Ca 0.15 -0.21 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 2qfu n GLY 212 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qfu s VAL 213 N -2.00 1.16 0.18 1.61 1.01 -0.36 -4.90 120.40 117.10 2qfu s VAL 213 Ca 0.00 -0.52 0.09 0.00 0.00 0.00 0.00 61.98 61.56 2qfu s VAL 213 Cb 0.00 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 2qfu s VAL 213 CO 0.00 0.36 -0.20 -1.61 0.00 0.00 0.00 175.10 173.65 2qfu s GLU 214 N 0.49 1.35 0.30 2.72 2.02 -1.26 -2.28 118.70 122.04 2qfu s GLU 214 Ca -0.11 -1.45 0.03 0.00 0.02 0.00 0.00 54.97 53.45 2qfu s GLU 214 Cb -0.14 -1.48 -0.04 0.00 0.10 0.00 0.00 34.13 32.57 2qfu s GLU 214 CO 0.03 0.30 0.14 0.96 0.02 0.00 0.00 175.26 176.72 2qfu s ILE 215 N -1.96 0.38 -0.37 -1.63 -5.25 -1.26 -4.83 121.20 106.27 2qfu s ILE 215 Ca 0.17 -2.00 -0.14 0.00 -0.99 0.00 0.00 60.65 57.69 2qfu s ILE 215 Cb -0.06 -2.53 -0.00 0.00 2.95 0.00 0.00 42.46 42.81 2qfu s ILE 215 CO 0.08 0.00 0.28 -0.70 -1.79 0.00 0.00 174.94 172.81 2qfu s GLU 216 N -3.87 3.27 -0.41 0.37 2.12 -0.37 -4.97 118.70 114.84 2qfu s GLU 216 Ca 0.36 -0.79 -0.16 0.00 0.36 0.00 0.00 54.97 54.74 2qfu s GLU 216 Cb 0.06 -3.88 0.02 0.00 0.26 0.00 0.00 34.13 30.58 2qfu s GLU 216 CO 0.17 -0.59 0.37 1.21 -0.54 0.00 0.00 175.26 175.88 2qfu s ASN 217 N 1.71 6.16 -1.02 -1.70 3.84 -1.26 -0.74 114.94 121.92 2qfu s ASN 217 Ca 0.06 -0.73 -0.13 0.00 0.21 0.00 0.00 52.86 52.27 2qfu s ASN 217 Cb -0.18 -2.19 0.21 0.00 -0.55 0.00 0.00 41.25 38.54 2qfu s ASN 217 CO 0.10 -0.51 1.08 -1.10 -2.79 0.00 0.00 177.10 173.89 2qfu s GLN 218 N 1.94 3.91 -1.40 0.43 -0.21 0.52 -4.64 119.66 120.21 2qfu s GLN 218 Ca 0.09 -2.63 -0.13 0.00 0.02 0.00 0.00 55.36 52.71 2qfu s GLN 218 Cb -0.18 -4.69 0.10 0.00 1.00 0.00 0.00 33.01 29.25 2qfu s GLN 218 CO 0.12 -1.45 0.60 0.72 -2.12 0.00 0.00 175.29 173.16 2qfu n HIS 219 N 4.31 -1.80 -1.37 0.91 8.25 -1.26 -1.45 115.22 122.81 2qfu n HIS 219 Ca 0.24 0.59 -0.13 0.00 -0.26 0.00 0.00 57.72 58.15 2qfu n HIS 219 Cb 0.44 -2.94 -0.06 0.00 1.12 0.00 0.00 29.99 28.55 2qfu n HIS 219 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2qfu n TYR 220 N -4.08 -0.04 -0.09 4.41 4.02 -1.26 -4.77 117.16 115.34 2qfu n TYR 220 Ca 0.02 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.81 2qfu n TYR 220 Cb 0.52 -2.88 -0.14 0.00 -0.02 0.00 0.00 39.34 36.82 2qfu n TYR 220 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2qfu n GLN 221 N -1.26 1.04 -3.73 -0.72 1.13 -0.53 -4.82 117.38 108.49 2qfu n GLN 221 Ca -0.13 0.01 -0.13 0.00 -1.94 0.00 0.00 57.00 54.81 2qfu n GLN 221 Cb 0.59 -1.45 -0.10 0.00 0.11 0.00 0.00 30.24 29.39 2qfu n GLN 221 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 2qfu s GLN 222 N -2.43 0.47 -0.10 -1.09 0.74 -1.16 -1.04 119.66 115.06 2qfu s GLN 222 Ca -0.11 0.60 0.03 0.00 0.05 0.00 0.00 55.36 55.92 2qfu s GLN 222 Cb 0.06 0.21 0.01 0.00 1.10 0.00 0.00 33.01 34.38 2qfu s GLN 222 CO 0.70 -0.07 -0.18 -0.06 -0.55 0.00 0.00 175.29 175.13 2qfu s PHE 223 N 0.35 2.14 -0.26 1.67 0.40 0.22 -0.35 117.98 122.15 2qfu s PHE 223 Ca -0.01 -0.95 -0.08 0.00 -0.60 0.00 0.00 56.93 55.29 2qfu s PHE 223 Cb -0.03 -1.49 -0.03 0.00 0.51 0.00 0.00 43.02 41.97 2qfu s PHE 223 CO -0.01 -0.45 0.09 0.08 0.70 0.00 0.00 175.22 175.64 2qfu s VAL 224 N 0.73 4.47 -0.10 -0.44 1.01 0.08 -0.57 120.40 125.58 2qfu s VAL 224 Ca -0.11 -0.14 0.04 0.00 0.00 0.00 0.00 61.98 61.76 2qfu s VAL 224 Cb -0.16 -3.11 -0.00 0.00 0.00 0.00 0.00 36.38 33.11 2qfu s VAL 224 CO 0.02 0.31 -0.23 -0.69 0.00 0.00 0.00 175.10 174.51 2qfu s VAL 225 N 1.63 2.16 0.03 2.92 1.01 0.10 -1.24 120.40 127.01 2qfu s VAL 225 Ca 0.06 -0.99 -0.23 0.00 0.00 0.00 0.00 61.98 60.83 2qfu s VAL 225 Cb -0.15 -1.82 -0.06 0.00 0.00 0.00 0.00 36.38 34.35 2qfu s VAL 225 CO 0.05 0.56 0.68 -0.54 0.00 0.00 0.00 175.10 175.84 2qfu s LYS 226 N 0.27 4.40 0.89 2.72 1.02 -1.26 -1.14 119.74 126.64 2qfu s LYS 226 Ca -0.16 0.90 -0.10 0.00 0.02 0.00 0.00 55.97 56.63 2qfu s LYS 226 Cb -0.17 -3.34 0.19 0.00 -0.52 0.00 0.00 37.83 33.98 2qfu s LYS 226 CO 0.08 0.35 1.21 0.20 -0.92 0.00 0.00 175.35 176.28 2qfu s GLY 227 N -0.23 1.79 -1.03 -3.33 0.00 -1.25 -4.46 107.32 98.81 2qfu s GLY 227 Ca 0.34 -1.53 0.00 0.00 0.00 0.00 0.00 44.72 43.53 2qfu s GLY 227 CO 0.20 -0.80 0.00 0.61 0.00 0.00 0.00 173.10 173.12 2qfu n GLY 228 N -3.45 1.12 3.97 0.20 0.00 0.31 -4.90 105.19 102.45 2qfu n GLY 228 Ca 0.17 -0.57 -0.23 0.00 0.00 0.00 0.00 46.02 45.39 2qfu n GLY 228 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2qfu s GLN 229 N -2.80 2.15 -0.00 1.61 -0.21 0.17 -5.02 119.66 115.56 2qfu s GLN 229 Ca 0.00 -0.77 0.00 0.00 0.02 0.00 0.00 55.36 54.61 2qfu s GLN 229 Cb 0.00 -2.36 0.00 0.00 1.00 0.00 0.00 33.01 31.65 2qfu s GLN 229 CO 0.00 -1.10 -0.00 -1.12 -2.12 0.00 0.00 175.29 170.95 2qfu s SER 230 N -4.55 0.10 0.36 5.90 0.01 -1.26 -4.39 113.70 109.86 2qfu s SER 230 Ca 0.61 -0.01 -0.21 0.00 1.31 0.00 0.00 55.95 57.65 2qfu s SER 230 Cb -0.09 -0.02 -0.10 0.00 0.21 0.00 0.00 66.02 66.02 2qfu s SER 230 CO 0.42 -0.01 0.88 -0.31 0.41 0.00 0.00 173.24 174.63 2qfu s TYR 231 N 0.11 3.45 -0.03 2.43 2.02 -1.26 -4.81 117.35 119.26 2qfu s TYR 231 Ca -0.01 1.55 0.05 0.00 -0.37 0.00 0.00 57.07 58.28 2qfu s TYR 231 Cb -0.02 -2.78 -0.01 0.00 -0.40 0.00 0.00 41.96 38.76 2qfu s TYR 231 CO -0.00 0.06 -0.16 -0.65 -1.57 0.00 0.00 175.55 173.22 2qfu s GLN 232 N -2.74 1.53 0.28 -0.62 -1.52 0.29 -1.36 119.66 115.53 2qfu s GLN 232 Ca 0.55 -0.58 -0.30 0.00 -1.95 0.00 0.00 55.36 53.08 2qfu s GLN 232 Cb -0.12 -1.40 -0.12 0.00 -0.22 0.00 0.00 33.01 31.15 2qfu s GLN 232 CO 0.17 0.29 1.51 0.45 -0.25 0.00 0.00 175.29 177.46 2qfu n SER 233 N 2.93 3.41 -0.49 5.90 2.88 -0.19 -4.39 113.62 123.67 2qfu n SER 233 Ca -0.16 1.15 0.11 0.00 -1.33 0.00 0.00 58.87 58.63 2qfu n SER 233 Cb 0.54 -1.53 0.40 0.00 -0.75 0.00 0.00 64.21 62.87 2qfu n SER 233 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2qfu n PRO 234 N 1.95 1.65 0.00 -1.46 -0.04 -1.26 -5.00 135.00 130.83 2qfu n PRO 234 Ca 0.09 -0.97 0.00 0.00 -0.04 0.00 0.00 63.50 62.58 2qfu n PRO 234 Cb 0.35 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.42 2qfu n PRO 234 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qfu n GLY 235 N 1.10 1.67 3.78 0.55 0.00 -1.26 -4.77 105.19 106.26 2qfu n GLY 235 Ca 0.16 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 45.09 2qfu n GLY 235 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qfu s THR 236 N 0.00 5.14 -0.04 2.61 -4.23 -1.26 -1.14 115.64 116.72 2qfu s THR 236 Ca 0.00 0.80 0.01 0.00 -1.18 0.00 0.00 61.69 61.31 2qfu s THR 236 Cb 0.00 -3.72 0.02 0.00 1.34 0.00 0.00 72.50 70.15 2qfu s THR 236 CO 0.00 0.47 -0.02 -0.47 -0.54 0.00 0.00 174.62 174.06 2qfu s TYR 237 N -0.28 0.53 -0.31 3.99 5.04 0.31 -4.95 117.35 121.69 2qfu s TYR 237 Ca 0.23 -0.10 -0.17 0.00 -2.44 0.00 0.00 57.07 54.59 2qfu s TYR 237 Cb -0.15 -0.54 -0.02 0.00 0.35 0.00 0.00 41.96 41.59 2qfu s TYR 237 CO 0.10 -0.17 0.46 -1.17 -1.34 0.00 0.00 175.55 173.43 2qfu s LEU 238 N 1.03 4.21 -0.03 6.97 2.96 -1.26 -1.26 118.68 131.30 2qfu s LEU 238 Ca -0.10 0.15 -0.30 0.00 -0.22 0.00 0.00 54.13 53.67 2qfu s LEU 238 Cb -0.14 -2.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.99 2qfu s LEU 238 CO -0.01 -0.34 1.15 -0.69 -1.32 0.00 0.00 176.35 175.15 2qfu s VAL 239 N 2.24 4.33 0.74 1.68 1.01 -0.12 -4.96 120.40 125.32 2qfu s VAL 239 Ca 0.17 1.66 -0.15 0.00 0.00 0.00 0.00 61.98 63.66 2qfu s VAL 239 Cb -0.16 -4.06 0.05 0.00 0.00 0.00 0.00 36.38 32.21 2qfu s VAL 239 CO 0.11 0.04 1.25 -1.61 0.00 0.00 0.00 175.10 174.89 2qfu s GLU 240 N 1.78 1.98 0.82 2.72 2.02 -1.26 -4.73 118.70 122.03 2qfu s GLU 240 Ca 0.55 1.90 -0.11 0.00 0.02 0.00 0.00 54.97 57.33 2qfu s GLU 240 Cb -0.25 -1.80 0.09 0.00 0.10 0.00 0.00 34.13 32.27 2qfu s GLU 240 CO 0.24 -1.99 1.12 0.20 0.02 0.00 0.00 175.26 174.85 2qfu s GLY 241 N -1.83 1.72 -0.35 -1.39 0.00 0.01 -0.44 107.32 105.05 2qfu s GLY 241 Ca 0.77 0.42 -0.27 0.00 0.00 0.00 0.00 44.72 45.64 2qfu s GLY 241 CO 0.46 0.80 1.00 -0.35 0.00 0.00 0.00 173.10 175.01 2qfu s ASP 242 N -3.04 6.80 0.39 1.64 2.15 0.33 -4.22 116.67 120.70 2qfu s ASP 242 Ca 0.64 0.81 0.17 0.00 0.43 0.00 0.00 52.55 54.60 2qfu s ASP 242 Cb -0.20 -2.50 0.79 0.00 -0.30 0.00 0.00 42.92 40.71 2qfu s ASP 242 CO 0.56 -0.87 1.82 0.00 -0.17 0.00 0.00 175.17 176.50 2qfu h ALA 243 N 8.31 1.20 -0.13 3.66 0.00 -1.91 -1.69 119.26 128.70 2qfu h ALA 243 Ca -0.22 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.24 2qfu h ALA 243 Cb 1.07 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2qfu h ALA 243 CO 1.01 0.44 -0.44 0.77 0.00 0.00 0.00 179.25 181.03 2qfu h SER 244 N 0.00 0.60 -0.15 0.00 0.02 -1.91 -2.97 113.55 109.15 2qfu h SER 244 Ca -0.00 -0.61 -0.01 0.00 -0.84 0.00 0.00 61.79 60.32 2qfu h SER 244 Cb 0.72 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.08 2qfu h SER 244 CO 0.05 1.11 0.06 0.28 -1.14 0.00 0.00 176.83 177.19 2qfu h SER 245 N 0.13 0.25 0.45 3.07 0.02 -1.93 -1.94 113.55 113.59 2qfu h SER 245 Ca -0.02 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.87 2qfu h SER 245 Cb 1.06 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.54 2qfu h SER 245 CO 0.09 0.25 -0.19 0.00 -1.14 0.00 0.00 176.83 175.84 2qfu h ALA 246 N 1.79 1.28 -0.92 3.77 0.00 -1.16 -3.27 119.26 120.76 2qfu h ALA 246 Ca 0.07 -0.18 0.11 0.00 0.00 0.00 0.00 54.91 54.91 2qfu h ALA 246 Cb 0.09 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.78 2qfu h ALA 246 CO -0.01 0.24 0.59 0.66 0.00 0.00 0.00 179.25 180.74 2qfu h SER 247 N 0.00 0.82 -0.77 0.00 4.64 -1.20 -2.00 113.55 115.04 2qfu h SER 247 Ca -0.00 0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.30 2qfu h SER 247 Cb 0.47 -0.14 -0.03 0.00 -0.31 0.00 0.00 62.40 62.39 2qfu h SER 247 CO 0.03 0.47 0.31 1.88 -0.87 0.00 0.00 176.83 178.64 2qfu h TYR 248 N 0.89 1.16 -0.03 4.77 0.05 -1.75 0.12 116.97 122.19 2qfu h TYR 248 Ca 0.43 -0.09 -0.24 0.00 0.05 0.00 0.00 58.73 58.89 2qfu h TYR 248 Cb 0.45 -0.35 0.01 0.00 1.01 0.00 0.00 36.73 37.85 2qfu h TYR 248 CO -0.00 0.88 -0.94 0.74 -1.05 0.00 0.00 178.16 177.79 2qfu h PHE 249 N 1.11 0.87 -0.43 4.88 0.04 -1.59 0.37 116.94 122.18 2qfu h PHE 249 Ca 0.26 -0.45 -0.11 0.00 2.80 0.00 0.00 57.97 60.47 2qfu h PHE 249 Cb 0.21 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 38.24 2qfu h PHE 249 CO 0.02 1.27 -0.17 -0.07 -0.60 0.00 0.00 178.31 178.76 2qfu h LEU 250 N 0.36 0.89 -0.80 1.54 3.38 -1.31 -2.64 115.31 116.73 2qfu h LEU 250 Ca -0.09 -0.39 -0.07 0.00 0.09 0.00 0.00 57.88 57.42 2qfu h LEU 250 Cb 1.57 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 42.05 2qfu h LEU 250 CO 0.18 1.08 0.13 0.00 0.09 0.00 0.00 178.44 179.92 2qfu h ALA 251 N 0.84 1.02 -0.97 1.53 0.00 -0.93 -1.98 119.26 118.77 2qfu h ALA 251 Ca 0.10 -0.25 0.07 0.00 0.00 0.00 0.00 54.91 54.83 2qfu h ALA 251 Cb 0.73 -0.25 -0.07 0.00 0.00 0.00 0.00 17.79 18.20 2qfu h ALA 251 CO 0.06 0.63 0.63 0.00 0.00 0.00 0.00 179.25 180.57 2qfu h ALA 252 N 1.16 1.45 -0.38 0.00 0.00 -0.63 -0.92 119.26 119.95 2qfu h ALA 252 Ca 0.20 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.95 2qfu h ALA 252 Cb 0.38 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2qfu h ALA 252 CO 0.01 0.39 -0.32 0.00 0.00 0.00 0.00 179.25 179.33 2qfu h ALA 253 N 1.48 0.71 -0.05 0.00 0.00 -1.12 0.18 119.26 120.46 2qfu h ALA 253 Ca 0.42 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2qfu h ALA 253 Cb 0.21 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2qfu h ALA 253 CO -0.17 0.66 -0.05 0.00 0.00 0.00 0.00 179.25 179.69 2qfu h ALA 254 N 0.92 1.83 0.12 0.00 0.00 -0.55 0.47 119.26 122.06 2qfu h ALA 254 Ca 0.07 -0.08 -0.33 0.00 0.00 0.00 0.00 54.91 54.58 2qfu h ALA 254 Cb 0.88 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2qfu h ALA 254 CO 0.08 0.13 -1.75 0.82 0.00 0.00 0.00 179.25 178.53 2qfu h ILE 255 N 0.06 0.80 0.00 0.00 2.04 -0.94 -3.41 117.51 116.06 2qfu h ILE 255 Ca 0.02 -2.36 -0.03 0.00 1.00 0.00 0.00 64.86 63.49 2qfu h ILE 255 Cb 0.13 2.56 -0.06 0.00 -0.74 0.00 0.00 36.82 38.72 2qfu h ILE 255 CO 0.01 0.78 -0.56 1.17 0.00 0.00 0.00 178.15 179.55 2qfu n LYS 256 N -3.71 0.06 -2.20 2.37 3.00 0.61 -5.07 118.16 113.22 2qfu n LYS 256 Ca -0.29 -1.22 -0.28 0.00 -0.00 0.00 0.00 58.31 56.52 2qfu n LYS 256 Cb 0.98 -0.47 0.17 0.00 0.00 0.00 0.00 35.03 35.71 2qfu n LYS 256 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2qfu s GLY 257 N -1.23 1.79 0.07 3.14 0.00 0.15 -1.68 107.32 109.56 2qfu s GLY 257 Ca 0.06 -1.52 0.00 0.00 0.00 0.00 0.00 44.72 43.27 2qfu s GLY 257 CO -0.02 -0.77 0.00 0.61 0.00 0.00 0.00 173.10 172.92 2qfu n GLY 258 N -3.49 -2.10 3.06 0.20 0.00 -1.26 -4.55 105.19 97.05 2qfu n GLY 258 Ca 0.17 -1.44 -0.26 0.00 0.00 0.00 0.00 46.02 44.48 2qfu n GLY 258 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qfu s THR 259 N -2.27 1.34 -0.12 2.61 2.01 -1.26 -1.94 115.64 116.02 2qfu s THR 259 Ca 0.00 -0.59 0.03 0.00 0.31 0.00 0.00 61.69 61.44 2qfu s THR 259 Cb 0.00 -1.21 0.01 0.00 0.01 0.00 0.00 72.50 71.30 2qfu s THR 259 CO 0.00 0.40 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.41 2qfu s VAL 260 N 0.66 2.07 -0.10 3.82 1.01 -0.32 -1.45 120.40 126.10 2qfu s VAL 260 Ca -0.14 -0.99 -0.01 0.00 0.00 0.00 0.00 61.98 60.84 2qfu s VAL 260 Cb -0.16 -1.81 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 2qfu s VAL 260 CO 0.04 0.55 -0.08 -0.75 0.00 0.00 0.00 175.10 174.87 2qfu s LYS 261 N 0.59 3.14 -0.08 2.72 2.20 0.07 -1.03 119.74 127.35 2qfu s LYS 261 Ca -0.13 -0.58 0.02 0.00 -0.36 0.00 0.00 55.97 54.93 2qfu s LYS 261 Cb -0.17 -2.68 -0.02 0.00 -1.51 0.00 0.00 37.83 33.45 2qfu s LYS 261 CO 0.03 0.45 -0.13 0.14 -0.36 0.00 0.00 175.35 175.48 2qfu s VAL 262 N -0.22 3.14 0.18 4.02 -7.23 0.15 -0.67 120.40 119.77 2qfu s VAL 262 Ca 0.03 -0.67 0.08 0.00 -1.81 0.00 0.00 61.98 59.61 2qfu s VAL 262 Cb -0.13 -2.27 -0.04 0.00 0.56 0.00 0.00 36.38 34.50 2qfu s VAL 262 CO 0.03 0.57 -0.05 0.42 -0.31 0.00 0.00 175.10 175.75 2qfu s THR 263 N -0.39 3.43 0.00 5.32 -4.23 0.12 -1.68 115.64 118.21 2qfu s THR 263 Ca 0.04 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 58.99 2qfu s THR 263 Cb -0.12 -2.71 0.00 0.00 1.34 0.00 0.00 72.50 71.00 2qfu s THR 263 CO 0.02 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.60 2qfu n GLY 264 N -0.05 1.39 3.09 3.99 0.00 -0.73 -1.78 105.19 111.10 2qfu n GLY 264 Ca -0.10 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.82 2qfu n GLY 264 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qfu s ILE 265 N -2.14 0.41 0.00 -0.61 -4.36 -1.25 -0.81 121.20 112.44 2qfu s ILE 265 Ca 0.00 -1.51 0.00 0.00 -0.26 0.00 0.00 60.65 58.88 2qfu s ILE 265 Cb 0.00 -1.12 0.00 0.00 1.25 0.00 0.00 42.46 42.59 2qfu s ILE 265 CO 0.00 -0.73 0.00 0.61 0.24 0.00 0.00 174.94 175.06 2qfu n GLY 266 N 0.66 2.32 0.31 6.27 0.00 -1.26 -1.10 105.19 112.39 2qfu n GLY 266 Ca -0.17 -0.83 0.18 0.00 0.00 0.00 0.00 46.02 45.20 2qfu n GLY 266 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2qfu h ARG 267 N 0.00 0.00 -0.02 1.61 0.11 -1.45 -1.87 114.38 112.76 2qfu h ARG 267 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2qfu h ARG 267 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 2qfu h ARG 267 CO 0.00 0.01 -0.00 0.09 0.10 0.00 0.00 179.97 180.17 2qfu n ASN 268 N -3.50 1.94 -4.72 0.08 3.02 -1.26 -4.98 115.26 105.84 2qfu n ASN 268 Ca -0.03 -1.64 -0.38 0.00 -0.03 0.00 0.00 54.58 52.50 2qfu n ASN 268 Cb 0.10 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.32 2qfu n ASN 268 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2qfu n SER 269 N 0.51 2.23 0.04 6.41 7.64 -0.71 -4.92 113.62 124.83 2qfu n SER 269 Ca 0.17 0.93 0.13 0.00 1.01 0.00 0.00 58.87 61.11 2qfu n SER 269 Cb 0.43 -1.54 0.32 0.00 -1.01 0.00 0.00 64.21 62.42 2qfu n SER 269 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 2qfu n MET 270 N -1.14 0.13 -2.52 1.43 0.00 -1.26 -4.90 117.12 108.87 2qfu n MET 270 Ca 0.12 0.06 -0.42 0.00 0.00 0.00 0.00 57.70 57.46 2qfu n MET 270 Cb 0.45 -1.61 -0.03 0.00 0.00 0.00 0.00 33.22 32.04 2qfu n MET 270 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 175.97 175.32 2qfu s GLN 271 N -3.07 4.51 0.53 3.17 -0.21 -1.26 -4.54 119.66 118.79 2qfu s GLN 271 Ca 0.10 1.67 0.30 0.00 0.02 0.00 0.00 55.36 57.45 2qfu s GLN 271 Cb 0.16 -3.35 1.42 0.00 1.00 0.00 0.00 33.01 32.23 2qfu s GLN 271 CO 0.66 -0.11 2.03 0.78 -2.12 0.00 0.00 175.29 176.53 2qfu h GLY 272 N 6.31 0.00 1.45 3.09 0.00 -1.90 -2.89 103.07 109.13 2qfu h GLY 272 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.91 2qfu h GLY 272 CO 0.77 0.00 0.00 1.22 0.00 0.00 0.00 176.54 178.53 2qfu n ASP 273 N -3.38 0.00 0.24 0.19 10.43 -1.26 -1.35 116.55 121.41 2qfu n ASP 273 Ca -0.01 -0.08 0.17 0.00 2.57 0.00 0.00 54.79 57.44 2qfu n ASP 273 Cb 0.28 -0.23 0.73 0.00 1.84 0.00 0.00 41.12 43.74 2qfu n ASP 273 CO 0.00 0.00 0.00 0.16 -1.07 0.00 0.00 177.20 176.29 2qfu h ILE 274 N 0.00 0.00 0.00 0.53 3.07 -1.80 -1.50 117.51 117.80 2qfu h ILE 274 Ca 0.00 -0.31 0.00 0.00 1.55 0.00 0.00 64.86 66.10 2qfu h ILE 274 Cb 0.13 1.20 0.00 0.00 -0.27 0.00 0.00 36.82 37.87 2qfu h ILE 274 CO 0.00 0.00 0.00 0.54 -1.05 0.00 0.00 178.15 177.64 2qfu n ARG 275 N -2.81 0.04 -0.04 0.16 5.12 -0.46 -1.72 116.66 116.96 2qfu n ARG 275 Ca 0.00 0.25 0.02 0.00 -1.93 0.00 0.00 57.85 56.19 2qfu n ARG 275 Cb 0.22 -1.50 0.35 0.00 -1.16 0.00 0.00 32.46 30.37 2qfu n ARG 275 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 2qfu h PHE 276 N 0.00 0.60 -0.52 -1.55 3.57 -1.48 -1.86 116.94 115.70 2qfu h PHE 276 Ca 0.00 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 2qfu h PHE 276 Cb 0.21 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 2qfu h PHE 276 CO 0.00 0.44 0.29 0.00 -2.23 0.00 0.00 178.31 176.81 2qfu h ALA 277 N 1.62 1.53 -0.26 2.41 0.00 -1.54 -1.33 119.26 121.70 2qfu h ALA 277 Ca 0.16 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2qfu h ALA 277 Cb 0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2qfu h ALA 277 CO -0.02 0.40 -0.09 -0.44 0.00 0.00 0.00 179.25 179.09 2qfu h ASP 278 N 0.72 0.39 -0.40 0.00 5.19 -1.50 -1.21 116.42 119.62 2qfu h ASP 278 Ca 0.19 -0.09 -0.10 0.00 -0.62 0.00 0.00 57.03 56.41 2qfu h ASP 278 Cb 0.01 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 39.41 2qfu h ASP 278 CO -0.03 0.53 -0.13 0.58 -3.12 0.00 0.00 179.24 177.07 2qfu h VAL 279 N 0.39 1.28 -0.70 -1.35 2.07 -1.15 -0.95 116.25 115.84 2qfu h VAL 279 Ca 0.08 -1.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.34 2qfu h VAL 279 Cb 0.41 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 2qfu h VAL 279 CO 0.02 0.42 0.34 -0.07 0.02 0.00 0.00 177.57 178.29 2qfu h LEU 280 N 0.61 0.89 -0.64 2.57 3.38 -0.98 -1.16 115.31 119.98 2qfu h LEU 280 Ca 0.10 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2qfu h LEU 280 Cb 0.67 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 2qfu h LEU 280 CO 0.05 0.75 0.15 -0.08 0.09 0.00 0.00 178.44 179.39 2qfu h GLU 281 N 0.98 1.03 0.00 1.13 4.81 -0.97 -1.08 114.58 120.48 2qfu h GLU 281 Ca 0.24 -0.25 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 2qfu h GLU 281 Cb 0.09 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 2qfu h GLU 281 CO -0.03 0.93 -0.17 0.87 -0.73 0.00 0.00 179.01 179.88 2qfu h LYS 282 N 0.95 0.00 0.00 1.92 1.57 -0.46 -1.22 116.57 119.34 2qfu h LYS 282 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2qfu h LYS 282 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 2qfu h LYS 282 CO 0.00 0.17 0.00 -1.33 -0.57 0.00 0.00 179.45 177.72 2qfu n MET 283 N -4.23 0.16 0.00 3.15 2.81 -0.51 -4.88 117.12 113.62 2qfu n MET 283 Ca -0.02 0.14 0.00 0.00 -1.81 0.00 0.00 57.70 56.01 2qfu n MET 283 Cb 0.24 -1.69 0.00 0.00 -0.71 0.00 0.00 33.22 31.06 2qfu n MET 283 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qfu n GLY 284 N 1.32 0.98 3.91 3.03 0.00 -0.46 0.15 105.19 114.12 2qfu n GLY 284 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 2qfu n GLY 284 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qfu s ALA 285 N -1.94 3.28 -0.18 4.61 0.00 -0.46 -1.46 121.76 125.60 2qfu s ALA 285 Ca 0.00 -0.61 -0.08 0.00 0.00 0.00 0.00 51.96 51.28 2qfu s ALA 285 Cb 0.00 -2.66 -0.04 0.00 0.00 0.00 0.00 23.12 20.42 2qfu s ALA 285 CO 0.00 -0.75 0.08 0.99 0.00 0.00 0.00 175.76 176.08 2qfu s THR 286 N -2.99 4.92 -0.04 0.00 2.01 -0.54 -4.23 115.64 114.77 2qfu s THR 286 Ca 0.53 0.01 0.06 0.00 0.31 0.00 0.00 61.69 62.60 2qfu s THR 286 Cb -0.11 -3.22 -0.02 0.00 0.01 0.00 0.00 72.50 69.17 2qfu s THR 286 CO 0.46 0.46 -0.22 -0.63 -0.69 0.00 0.00 174.62 174.01 2qfu s ILE 287 N 0.30 2.39 -0.05 1.82 -1.09 -1.26 -0.35 121.20 122.96 2qfu s ILE 287 Ca 0.04 -0.97 0.06 0.00 -2.23 0.00 0.00 60.65 57.56 2qfu s ILE 287 Cb -0.12 -1.88 -0.01 0.00 -1.58 0.00 0.00 42.46 38.87 2qfu s ILE 287 CO -0.00 0.58 -0.24 0.00 -1.23 0.00 0.00 174.94 174.05 2qfu s TRP 289 N -0.24 2.87 0.40 0.00 0.52 -1.26 -0.79 118.94 120.44 2qfu s TRP 289 Ca -0.01 -0.18 0.03 0.00 0.02 0.00 0.00 56.10 55.96 2qfu s TRP 289 Cb -0.12 -1.75 -0.01 0.00 -1.15 0.00 0.00 33.47 30.43 2qfu s TRP 289 CO 0.02 0.15 0.13 0.41 0.02 0.00 0.00 176.95 177.68 2qfu n GLY 290 N 2.66 3.31 0.18 0.98 0.00 -0.00 -4.95 105.19 107.35 2qfu n GLY 290 Ca -0.18 -2.13 -0.11 0.00 0.00 0.00 0.00 46.02 43.60 2qfu n GLY 290 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2qfu h ASP 291 N 1.52 0.52 0.00 1.61 3.58 -1.95 -1.45 116.42 120.25 2qfu h ASP 291 Ca -0.31 -0.35 -0.03 0.00 0.42 0.00 0.00 57.03 56.75 2qfu h ASP 291 Cb 1.17 -0.15 -0.07 0.00 1.72 0.00 0.00 39.33 41.99 2qfu h ASP 291 CO 0.50 1.11 -0.43 -0.67 -2.88 0.00 0.00 179.24 176.87 2qfu n ASP 292 N -3.83 1.34 -3.72 2.28 2.03 -1.26 -4.13 116.55 109.26 2qfu n ASP 292 Ca -0.05 -2.79 -0.10 0.00 0.52 0.00 0.00 54.79 52.37 2qfu n ASP 292 Cb 0.73 -0.37 -0.05 0.00 -0.72 0.00 0.00 41.12 40.71 2qfu n ASP 292 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 2qfu s TYR 293 N -1.68 -0.08 -0.02 -0.67 -0.85 -0.26 -1.78 117.35 112.01 2qfu s TYR 293 Ca 0.25 -0.26 0.01 0.00 -0.52 0.00 0.00 57.07 56.56 2qfu s TYR 293 Cb 0.25 0.23 0.01 0.00 0.38 0.00 0.00 41.96 42.82 2qfu s TYR 293 CO -0.04 -0.75 -0.05 0.42 -1.52 0.00 0.00 175.55 173.62 2qfu s ILE 294 N -3.85 0.44 0.11 -3.49 1.01 -0.68 -0.82 121.20 113.92 2qfu s ILE 294 Ca 0.06 -0.16 0.06 0.00 0.00 0.00 0.00 60.65 60.61 2qfu s ILE 294 Cb 0.02 -0.42 -0.04 0.00 0.01 0.00 0.00 42.46 42.03 2qfu s ILE 294 CO -0.08 0.16 -0.14 -0.94 0.00 0.00 0.00 174.94 173.94 2qfu s SER 295 N 0.32 1.90 -0.04 3.58 1.04 0.03 -0.68 113.70 119.85 2qfu s SER 295 Ca -0.04 -0.77 0.03 0.00 0.48 0.00 0.00 55.95 55.65 2qfu s SER 295 Cb -0.07 -0.06 0.00 0.00 0.10 0.00 0.00 66.02 65.99 2qfu s SER 295 CO -0.00 -0.14 -0.13 0.00 0.98 0.00 0.00 173.24 173.94 2qfu s THR 297 N 0.12 1.77 0.24 0.00 2.01 0.53 -1.17 115.64 119.14 2qfu s THR 297 Ca -0.04 -0.93 -0.31 0.00 0.31 0.00 0.00 61.69 60.72 2qfu s THR 297 Cb -0.10 -1.49 -0.13 0.00 0.01 0.00 0.00 72.50 70.78 2qfu s THR 297 CO 0.01 0.50 1.43 -1.14 -0.69 0.00 0.00 174.62 174.73 2qfu n ARG 298 N 2.85 2.08 0.00 4.92 3.00 -0.82 -1.47 116.66 127.21 2qfu n ARG 298 Ca -0.17 0.74 0.00 0.00 -0.00 0.00 0.00 57.85 58.42 2qfu n ARG 298 Cb 0.52 -2.41 0.00 0.00 0.00 0.00 0.00 32.46 30.57 2qfu n ARG 298 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2qfu n GLY 299 N 2.22 1.72 3.40 5.14 0.00 -1.26 -4.74 105.19 111.68 2qfu n GLY 299 Ca 0.12 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 2qfu n GLY 299 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2qfu s GLU 300 N 1.13 1.77 -0.21 1.61 -1.05 -0.53 -4.97 118.70 116.44 2qfu s GLU 300 Ca 0.00 -2.05 -0.04 0.00 -0.15 0.00 0.00 54.97 52.73 2qfu s GLU 300 Cb 0.00 -0.20 0.08 0.00 -0.44 0.00 0.00 34.13 33.57 2qfu s GLU 300 CO 0.00 -0.51 0.14 -1.17 0.95 0.00 0.00 175.26 174.67 2qfu s LEU 301 N -3.47 0.25 0.02 1.83 2.96 -1.23 -3.26 118.68 115.78 2qfu s LEU 301 Ca 0.32 -0.70 0.04 0.00 -0.22 0.00 0.00 54.13 53.57 2qfu s LEU 301 Cb 0.03 -0.08 -0.03 0.00 0.50 0.00 0.00 46.19 46.61 2qfu s LEU 301 CO 0.19 -0.37 -0.07 0.20 -1.32 0.00 0.00 176.35 174.98 2qfu s ASN 302 N 2.19 4.57 0.69 3.68 0.01 0.12 -0.91 114.94 125.29 2qfu s ASN 302 Ca 0.05 -0.20 -0.16 0.00 -0.71 0.00 0.00 52.86 51.85 2qfu s ASN 302 Cb -0.16 -1.03 0.02 0.00 0.41 0.00 0.00 41.25 40.49 2qfu s ASN 302 CO -0.18 0.26 1.20 0.00 -1.51 0.00 0.00 177.10 176.88 2qfu s ALA 303 N -1.04 2.25 0.16 0.60 0.00 -0.26 -4.53 121.76 118.94 2qfu s ALA 303 Ca 0.18 0.90 0.03 0.00 0.00 0.00 0.00 51.96 53.07 2qfu s ALA 303 Cb -0.11 -3.46 -0.05 0.00 0.00 0.00 0.00 23.12 19.50 2qfu s ALA 303 CO 0.09 -1.67 -0.05 0.96 0.00 0.00 0.00 175.76 175.09 2qfu s ILE 304 N -1.90 0.93 -0.27 0.00 -5.25 -1.26 -4.96 121.20 108.49 2qfu s ILE 304 Ca 0.75 -2.01 -0.01 0.00 -0.99 0.00 0.00 60.65 58.38 2qfu s ILE 304 Cb -0.29 -1.97 0.08 0.00 2.95 0.00 0.00 42.46 43.23 2qfu s ILE 304 CO 0.42 -0.63 0.06 -0.62 -1.79 0.00 0.00 174.94 172.39 2qfu s ASP 305 N -3.17 3.71 0.02 4.36 3.68 -1.26 -0.92 116.67 123.09 2qfu s ASP 305 Ca 0.20 -1.37 -0.03 0.00 2.13 0.00 0.00 52.55 53.47 2qfu s ASP 305 Cb 0.04 -0.82 -0.01 0.00 -1.45 0.00 0.00 42.92 40.68 2qfu s ASP 305 CO 0.02 -0.37 0.04 -0.04 0.13 0.00 0.00 175.17 174.96 2qfu s MET 306 N 1.66 0.41 -0.17 4.34 -1.94 -0.57 -4.98 119.30 118.05 2qfu s MET 306 Ca 0.05 -0.56 -0.29 0.00 -1.71 0.00 0.00 55.69 53.17 2qfu s MET 306 Cb -0.17 0.16 -0.01 0.00 2.01 0.00 0.00 34.83 36.82 2qfu s MET 306 CO -0.19 -0.09 1.13 0.34 -0.01 0.00 0.00 175.02 176.21 2qfu s ASP 307 N -1.54 7.05 -0.17 3.03 -1.08 -1.26 -0.69 116.67 122.01 2qfu s ASP 307 Ca -0.14 1.56 0.16 0.00 -0.52 0.00 0.00 52.55 53.61 2qfu s ASP 307 Cb -0.08 -2.54 0.54 0.00 -1.46 0.00 0.00 42.92 39.38 2qfu s ASP 307 CO -0.01 -0.67 1.44 0.23 0.52 0.00 0.00 175.17 176.68 2qfu n MET 308 N 6.16 3.07 0.26 4.34 2.81 0.01 -4.68 117.12 129.09 2qfu n MET 308 Ca 0.12 -2.81 0.17 0.00 -1.81 0.00 0.00 57.70 53.37 2qfu n MET 308 Cb 0.46 -1.83 0.89 0.00 -0.71 0.00 0.00 33.22 32.03 2qfu n MET 308 CO 0.00 0.00 0.00 -0.97 1.51 0.00 0.00 175.97 176.51 2qfu h ASN 309 N 2.00 0.00 1.37 7.83 -0.73 -1.68 -1.41 115.58 122.95 2qfu h ASN 309 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2qfu h ASN 309 Cb 1.43 0.00 0.00 0.00 0.27 0.00 0.00 38.32 40.02 2qfu h ASN 309 CO 0.23 0.00 -0.03 0.00 -0.37 0.00 0.00 177.43 177.25 2qfu n HIS 310 N -3.73 0.77 -3.09 0.67 1.44 -1.26 -3.45 115.22 106.57 2qfu n HIS 310 Ca -0.01 0.22 -0.16 0.00 -2.01 0.00 0.00 57.72 55.77 2qfu n HIS 310 Cb 0.21 -0.86 -0.01 0.00 0.12 0.00 0.00 29.99 29.45 2qfu n HIS 310 CO 0.00 0.00 0.00 0.44 -2.81 0.00 0.00 176.34 173.97 2qfu n ILE 311 N -2.13 -0.07 -0.16 0.61 -5.35 -0.55 -4.71 119.36 107.00 2qfu n ILE 311 Ca 0.06 -4.03 0.09 0.00 -0.27 0.00 0.00 62.75 58.60 2qfu n ILE 311 Cb 0.42 0.06 0.41 0.00 -1.74 0.00 0.00 39.64 38.78 2qfu n ILE 311 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 2qfu h PRO 312 N 2.99 0.61 0.06 6.28 0.13 -1.68 0.45 132.00 140.82 2qfu h PRO 312 Ca 0.05 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 65.15 2qfu h PRO 312 Cb 1.01 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.00 2qfu h PRO 312 CO 0.44 0.40 -0.03 -0.44 -0.23 0.00 0.00 178.00 178.15 2qfu h ASP 313 N 0.63 -0.06 0.20 1.44 3.45 -1.94 -3.28 116.42 116.85 2qfu h ASP 313 Ca 0.32 -0.34 -0.01 0.00 0.43 0.00 0.00 57.03 57.44 2qfu h ASP 313 Cb 0.43 0.02 -0.00 0.00 -0.56 0.00 0.00 39.33 39.22 2qfu h ASP 313 CO -0.11 0.58 -0.05 0.00 -1.57 0.00 0.00 179.24 178.09 2qfu h ALA 314 N -0.62 1.32 -0.07 3.45 0.00 -1.88 -2.12 119.26 119.35 2qfu h ALA 314 Ca -0.01 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.88 2qfu h ALA 314 Cb 0.40 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2qfu h ALA 314 CO 0.01 0.06 0.05 0.00 0.00 0.00 0.00 179.25 179.38 2qfu h ALA 315 N 1.95 1.93 -0.09 0.00 0.00 -0.96 -0.30 119.26 121.80 2qfu h ALA 315 Ca -0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2qfu h ALA 315 Cb 0.16 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2qfu h ALA 315 CO 0.01 -0.09 0.00 0.52 0.00 0.00 0.00 179.25 179.69 2qfu h MET 316 N 0.00 0.12 -0.15 0.00 2.86 -1.48 -1.13 114.93 115.15 2qfu h MET 316 Ca 0.03 -0.01 -0.07 0.00 -2.06 0.00 0.00 59.70 57.59 2qfu h MET 316 Cb 0.14 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 2qfu h MET 316 CO -0.00 0.13 -0.21 1.15 1.06 0.00 0.00 176.91 179.04 2qfu h THR 317 N 0.12 1.22 -0.09 2.22 2.02 -1.22 -1.33 112.91 115.86 2qfu h THR 317 Ca 0.03 -1.02 -0.10 0.00 0.77 0.00 0.00 66.41 66.09 2qfu h THR 317 Cb 0.08 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 2qfu h THR 317 CO 0.00 0.31 -0.38 0.40 0.37 0.00 0.00 175.52 176.22 2qfu h ILE 318 N 0.23 1.30 -0.94 3.11 1.08 -1.25 -1.07 117.51 119.96 2qfu h ILE 318 Ca 0.04 -1.43 0.01 0.00 -0.39 0.00 0.00 64.86 63.09 2qfu h ILE 318 Cb 0.51 1.65 -0.05 0.00 -3.07 0.00 0.00 36.82 35.87 2qfu h ILE 318 CO 0.03 0.43 0.62 0.00 -0.69 0.00 0.00 178.15 178.54 2qfu h ALA 319 N 1.44 1.33 0.02 1.87 0.00 -1.03 0.16 119.26 123.06 2qfu h ALA 319 Ca 0.02 -0.06 -0.26 0.00 0.00 0.00 0.00 54.91 54.60 2qfu h ALA 319 Cb 0.76 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 2qfu h ALA 319 CO 0.06 0.61 -1.41 1.79 0.00 0.00 0.00 179.25 180.31 2qfu h THR 320 N 1.27 1.23 0.00 0.00 1.35 -1.49 -3.25 112.91 112.02 2qfu h THR 320 Ca 0.35 -3.00 -0.02 0.00 -0.55 0.00 0.00 66.41 63.20 2qfu h THR 320 Cb -0.14 2.64 -0.00 0.00 -1.73 0.00 0.00 68.15 68.93 2qfu h THR 320 CO -0.08 0.74 -0.07 0.00 -0.25 0.00 0.00 175.52 175.86 2qfu h ALA 321 N 0.90 1.82 -0.07 6.62 0.00 -0.90 -1.25 119.26 126.39 2qfu h ALA 321 Ca -0.17 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.69 2qfu h ALA 321 Cb 1.92 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.70 2qfu h ALA 321 CO 0.11 0.09 0.10 0.00 0.00 0.00 0.00 179.25 179.55 2qfu h ALA 322 N 1.93 1.49 0.00 0.00 0.00 -0.71 -0.52 119.26 121.46 2qfu h ALA 322 Ca -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qfu h ALA 322 Cb 0.13 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2qfu h ALA 322 CO 0.01 -0.13 -0.02 -0.07 0.00 0.00 0.00 179.25 179.04 2qfu h LEU 323 N 0.00 0.00 -1.59 0.00 3.38 -1.37 -2.43 115.31 113.30 2qfu h LEU 323 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2qfu h LEU 323 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2qfu h LEU 323 CO -0.00 0.02 -0.03 0.49 0.09 0.00 0.00 178.44 179.01 2qfu n PHE 324 N -3.23 0.00 -3.09 1.13 3.01 -0.21 -4.71 117.46 110.36 2qfu n PHE 324 Ca -0.02 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.18 2qfu n PHE 324 Cb 0.15 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.61 2qfu n PHE 324 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2qfu s ALA 325 N -1.46 3.57 -0.36 4.37 0.00 -0.92 -4.84 121.76 122.12 2qfu s ALA 325 Ca 0.19 -0.68 -0.22 0.00 0.00 0.00 0.00 51.96 51.25 2qfu s ALA 325 Cb 0.14 -2.33 0.01 0.00 0.00 0.00 0.00 23.12 20.94 2qfu s ALA 325 CO 0.23 -0.09 0.72 0.21 0.00 0.00 0.00 175.76 176.83 2qfu s LYS 326 N -4.33 3.74 0.00 0.00 2.20 -0.09 -4.78 119.74 116.48 2qfu s LYS 326 Ca 0.44 0.23 0.00 0.00 -0.36 0.00 0.00 55.97 56.27 2qfu s LYS 326 Cb -0.10 -3.80 0.00 0.00 -1.51 0.00 0.00 37.83 32.42 2qfu s LYS 326 CO 0.38 -0.79 0.00 0.41 -0.36 0.00 0.00 175.35 174.99 2qfu n GLY 327 N 4.56 -2.31 3.69 5.54 0.00 -1.26 -1.10 105.19 114.31 2qfu n GLY 327 Ca 0.01 -2.18 -0.37 0.00 0.00 0.00 0.00 46.02 43.48 2qfu n GLY 327 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qfu s THR 328 N -0.78 5.25 -0.13 2.61 2.01 -1.26 -4.44 115.64 118.90 2qfu s THR 328 Ca 0.00 0.62 -0.08 0.00 0.31 0.00 0.00 61.69 62.53 2qfu s THR 328 Cb 0.00 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.79 2qfu s THR 328 CO 0.00 0.31 0.17 -0.89 -0.69 0.00 0.00 174.62 173.51 2qfu s THR 329 N 0.98 5.45 -0.08 -0.82 2.01 -0.32 -4.39 115.64 118.46 2qfu s THR 329 Ca 0.17 0.27 0.02 0.00 0.31 0.00 0.00 61.69 62.46 2qfu s THR 329 Cb -0.14 -3.45 0.01 0.00 0.01 0.00 0.00 72.50 68.94 2qfu s THR 329 CO 0.06 0.58 -0.13 -0.89 -0.69 0.00 0.00 174.62 173.55 2qfu s THR 330 N -0.73 1.20 -0.20 -0.82 2.01 -0.10 -0.14 115.64 116.87 2qfu s THR 330 Ca 0.14 -0.50 -0.02 0.00 0.31 0.00 0.00 61.69 61.63 2qfu s THR 330 Cb -0.12 -1.11 -0.00 0.00 0.01 0.00 0.00 72.50 71.28 2qfu s THR 330 CO 0.04 0.37 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.49 2qfu s LEU 331 N 0.80 2.68 0.30 4.42 1.43 -0.35 -1.52 118.68 126.44 2qfu s LEU 331 Ca -0.12 -0.44 0.10 0.00 -1.03 0.00 0.00 54.13 52.64 2qfu s LEU 331 Cb -0.15 -1.66 -0.05 0.00 0.03 0.00 0.00 46.19 44.36 2qfu s LEU 331 CO 0.02 0.02 -0.04 -0.13 0.23 0.00 0.00 176.35 176.45 2qfu s ARG 332 N 1.24 2.06 -1.25 1.70 0.52 0.13 -1.22 118.95 122.13 2qfu s ARG 332 Ca 0.03 -1.63 -0.02 0.00 -0.52 0.00 0.00 55.73 53.58 2qfu s ARG 332 Cb -0.14 -1.98 0.00 0.00 0.52 0.00 0.00 34.95 33.36 2qfu s ARG 332 CO -0.04 0.26 0.98 -1.71 0.02 0.00 0.00 175.30 174.81 2qfu n ASN 333 N -0.86 -2.66 -1.91 0.23 5.15 -0.80 -0.81 115.26 113.60 2qfu n ASN 333 Ca -0.05 -0.64 -0.13 0.00 -0.60 0.00 0.00 54.58 53.16 2qfu n ASN 333 Cb 0.61 -4.92 0.06 0.00 -0.53 0.00 0.00 39.78 35.00 2qfu n ASN 333 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 2qfu n ILE 334 N -4.31 2.09 -0.32 -1.44 -5.35 -0.46 -3.51 119.36 106.06 2qfu n ILE 334 Ca -0.24 -3.63 0.09 0.00 -0.27 0.00 0.00 62.75 58.71 2qfu n ILE 334 Cb 0.65 -0.40 0.26 0.00 -1.74 0.00 0.00 39.64 38.41 2qfu n ILE 334 CO 0.00 0.00 0.00 0.22 -1.76 0.00 0.00 176.55 175.01 2qfu h TYR 335 N 2.00 0.89 0.00 4.28 3.20 -1.86 -1.89 116.97 123.58 2qfu h TYR 335 Ca 0.18 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.08 2qfu h TYR 335 Cb 1.42 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 39.43 2qfu h TYR 335 CO 0.73 0.21 0.00 0.27 -1.64 0.00 0.00 178.16 177.73 2qfu n ASN 336 N -4.83 0.00 0.10 -2.11 0.23 -1.26 -0.82 115.26 106.57 2qfu n ASN 336 Ca 0.19 -0.39 0.17 0.00 -0.53 0.00 0.00 54.58 54.02 2qfu n ASN 336 Cb 0.48 -0.06 0.70 0.00 -2.08 0.00 0.00 39.78 38.83 2qfu n ASN 336 CO 0.00 0.00 0.00 -0.50 -0.93 0.00 0.00 177.26 175.83 2qfu h TRP 337 N 0.00 0.00 0.00 -2.53 4.06 -1.72 -1.86 115.95 113.90 2qfu h TRP 337 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2qfu h TRP 337 Cb 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.19 2qfu h TRP 337 CO 0.00 0.00 0.00 0.00 -3.56 0.00 0.00 178.44 174.88 2qfu h ARG 338 N 0.00 0.00 -0.15 0.49 3.08 -1.19 -0.29 114.38 116.32 2qfu h ARG 338 Ca 0.17 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.17 2qfu h ARG 338 Cb 0.70 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.72 2qfu h ARG 338 CO -0.00 0.00 -0.11 1.33 -1.07 0.00 0.00 179.97 180.12 2qfu n VAL 339 N -2.91 2.20 -0.30 2.04 0.24 -0.70 -4.01 118.33 114.89 2qfu n VAL 339 Ca 0.01 -2.47 0.00 0.00 -2.04 0.00 0.00 64.34 59.84 2qfu n VAL 339 Cb 0.29 -0.26 0.00 0.00 -1.47 0.00 0.00 33.84 32.40 2qfu n VAL 339 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2qfu n LYS 340 N -1.07 3.26 -0.21 7.34 5.02 -1.22 -4.69 118.16 126.58 2qfu n LYS 340 Ca 0.22 0.00 0.23 0.00 -2.02 0.00 0.00 58.31 56.74 2qfu n LYS 340 Cb 0.81 0.00 0.61 0.00 -0.02 0.00 0.00 35.03 36.42 2qfu n LYS 340 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2qfu h GLU 341 N 0.00 0.21 -3.74 1.97 3.07 -1.93 -3.42 114.58 110.74 2qfu h GLU 341 Ca 0.00 -0.01 -0.18 0.00 -0.50 0.00 0.00 59.36 58.67 2qfu h GLU 341 Cb 0.00 -0.05 -0.06 0.00 -0.84 0.00 0.00 28.75 27.81 2qfu h GLU 341 CO 0.00 0.14 -0.04 -0.08 -1.40 0.00 0.00 179.01 177.63 2qfu s THR 342 N -5.23 0.00 -0.69 1.13 -1.32 -1.26 -4.81 115.64 103.47 2qfu s THR 342 Ca -0.07 -1.40 -0.27 0.00 -1.21 0.00 0.00 61.69 58.74 2qfu s THR 342 Cb 0.22 -2.67 0.03 0.00 -1.51 0.00 0.00 72.50 68.57 2qfu s THR 342 CO 0.78 0.00 1.28 -0.62 -2.21 0.00 0.00 174.62 173.85 2qfu s ASP 343 N -3.17 6.20 0.45 8.08 3.68 -1.26 -4.39 116.67 126.27 2qfu s ASP 343 Ca 0.25 -0.24 0.24 0.00 2.13 0.00 0.00 52.55 54.93 2qfu s ASP 343 Cb -0.02 -2.56 0.96 0.00 -1.45 0.00 0.00 42.92 39.85 2qfu s ASP 343 CO 0.17 -1.76 1.84 0.03 0.13 0.00 0.00 175.17 175.58 2qfu h ARG 344 N 10.11 0.00 -0.23 4.34 3.08 -1.30 -0.70 114.38 129.69 2qfu h ARG 344 Ca -0.27 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.64 2qfu h ARG 344 Cb 1.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.11 2qfu h ARG 344 CO 1.25 0.21 -0.40 -0.07 -1.07 0.00 0.00 179.97 179.89 2qfu h LEU 345 N 0.00 0.75 -0.30 3.04 3.38 -1.89 0.35 115.31 120.64 2qfu h LEU 345 Ca -0.00 -0.53 -0.04 0.00 0.09 0.00 0.00 57.88 57.39 2qfu h LEU 345 Cb 0.72 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2qfu h LEU 345 CO 0.03 1.14 0.01 0.15 0.09 0.00 0.00 178.44 179.86 2qfu h PHE 346 N 0.38 0.56 -0.24 1.13 3.57 -1.91 -2.17 116.94 118.27 2qfu h PHE 346 Ca 0.01 -0.09 -0.04 0.00 3.53 0.00 0.00 57.97 61.38 2qfu h PHE 346 Cb 1.00 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.58 2qfu h PHE 346 CO 0.08 0.65 -0.00 0.00 -2.23 0.00 0.00 178.31 176.81 2qfu h ALA 347 N 0.84 0.32 -0.55 2.41 0.00 -1.11 -1.26 119.26 119.91 2qfu h ALA 347 Ca 0.09 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 2qfu h ALA 347 Cb 0.41 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2qfu h ALA 347 CO 0.01 0.05 0.21 1.98 0.00 0.00 0.00 179.25 181.51 2qfu h MET 348 N 0.19 0.82 -0.55 0.00 1.85 -0.97 -1.04 114.93 115.24 2qfu h MET 348 Ca 0.07 -0.15 -0.03 0.00 -0.61 0.00 0.00 59.70 58.97 2qfu h MET 348 Cb 0.42 -0.13 -0.02 0.00 0.43 0.00 0.00 31.60 32.29 2qfu h MET 348 CO 0.01 0.72 0.22 0.00 -0.40 0.00 0.00 176.91 177.46 2qfu h ALA 349 N 1.06 0.71 -0.17 0.39 0.00 -1.31 -0.18 119.26 119.76 2qfu h ALA 349 Ca 0.18 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2qfu h ALA 349 Cb 0.21 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2qfu h ALA 349 CO -0.01 0.32 0.10 1.15 0.00 0.00 0.00 179.25 180.80 2qfu h THR 350 N 0.74 1.09 -0.04 0.00 2.02 -0.96 -2.14 112.91 113.62 2qfu h THR 350 Ca 0.18 -0.23 -0.19 0.00 0.77 0.00 0.00 66.41 66.94 2qfu h THR 350 Cb 0.20 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 2qfu h THR 350 CO -0.01 0.08 -0.78 -0.33 0.37 0.00 0.00 175.52 174.84 2qfu h GLU 351 N 0.18 0.30 -0.73 6.66 4.39 -1.08 -2.99 114.58 121.31 2qfu h GLU 351 Ca 0.06 -0.28 -0.03 0.00 0.34 0.00 0.00 59.36 59.45 2qfu h GLU 351 Cb 0.05 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 2qfu h GLU 351 CO -0.01 0.94 0.32 -0.07 -1.16 0.00 0.00 179.01 179.04 2qfu h LEU 352 N 0.19 0.97 -1.59 1.33 3.38 -0.94 -1.91 115.31 116.75 2qfu h LEU 352 Ca -0.04 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 2qfu h LEU 352 Cb 1.37 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 2qfu h LEU 352 CO 0.13 0.84 -0.20 0.03 0.09 0.00 0.00 178.44 179.33 2qfu h ARG 353 N 1.05 0.00 0.00 1.13 3.08 -1.25 -2.64 114.38 115.75 2qfu h ARG 353 Ca 0.25 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.27 2qfu h ARG 353 Cb 0.15 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 2qfu h ARG 353 CO -0.03 0.21 -0.16 0.87 -1.07 0.00 0.00 179.97 179.79 2qfu h LYS 354 N 0.00 0.00 -0.31 0.04 1.57 -1.20 -1.60 116.57 115.07 2qfu h LYS 354 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2qfu h LYS 354 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.67 2qfu h LYS 354 CO 0.03 0.16 0.00 1.33 -0.57 0.00 0.00 179.45 180.39 2qfu n VAL 355 N -3.90 0.40 0.00 0.50 0.24 -1.02 -4.64 118.33 109.91 2qfu n VAL 355 Ca -0.02 -0.60 0.00 0.00 -2.04 0.00 0.00 64.34 61.68 2qfu n VAL 355 Cb 0.25 0.76 0.00 0.00 -1.47 0.00 0.00 33.84 33.38 2qfu n VAL 355 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qfu n GLY 356 N 1.37 1.02 3.82 7.63 0.00 -0.60 -2.03 105.19 116.39 2qfu n GLY 356 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 2qfu n GLY 356 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qfu s ALA 357 N -2.00 2.91 -0.22 4.61 0.00 -1.05 -4.20 121.76 121.82 2qfu s ALA 357 Ca 0.00 0.36 -0.14 0.00 0.00 0.00 0.00 51.96 52.17 2qfu s ALA 357 Cb 0.00 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 2qfu s ALA 357 CO 0.00 -0.43 0.33 -2.00 0.00 0.00 0.00 175.76 173.66 2qfu s GLU 358 N -3.84 4.14 -0.04 0.00 2.12 -0.44 -4.20 118.70 116.44 2qfu s GLU 358 Ca 0.62 0.06 0.02 0.00 0.36 0.00 0.00 54.97 56.03 2qfu s GLU 358 Cb -0.13 -3.54 0.01 0.00 0.26 0.00 0.00 34.13 30.73 2qfu s GLU 358 CO 0.30 -0.02 -0.08 0.08 -0.54 0.00 0.00 175.26 174.99 2qfu s VAL 359 N 1.27 0.76 -0.29 3.70 1.01 -1.26 -0.58 120.40 125.01 2qfu s VAL 359 Ca 0.15 -0.31 -0.10 0.00 0.00 0.00 0.00 61.98 61.72 2qfu s VAL 359 Cb -0.14 -0.70 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 2qfu s VAL 359 CO 0.07 0.25 0.16 -0.70 0.00 0.00 0.00 175.10 174.88 2qfu s GLU 360 N 0.45 3.61 -0.65 2.72 2.12 0.06 -4.97 118.70 122.03 2qfu s GLU 360 Ca -0.07 -0.54 -0.22 0.00 0.36 0.00 0.00 54.97 54.51 2qfu s GLU 360 Cb -0.11 -3.57 0.08 0.00 0.26 0.00 0.00 34.13 30.79 2qfu s GLU 360 CO 0.01 -0.30 0.91 -2.00 -0.54 0.00 0.00 175.26 173.34 2qfu s GLU 361 N 1.67 3.11 0.77 4.30 2.12 -1.26 -1.44 118.70 127.98 2qfu s GLU 361 Ca 0.06 -0.99 -0.12 0.00 0.36 0.00 0.00 54.97 54.28 2qfu s GLU 361 Cb -0.16 -4.26 0.06 0.00 0.26 0.00 0.00 34.13 30.02 2qfu s GLU 361 CO 0.08 -1.75 1.15 0.20 -0.54 0.00 0.00 175.26 174.39 2qfu s GLY 362 N 3.67 1.60 0.28 -1.50 0.00 0.46 -4.96 107.32 106.87 2qfu s GLY 362 Ca 0.20 -0.52 -0.02 0.00 0.00 0.00 0.00 44.72 44.38 2qfu s GLY 362 CO 0.08 -0.08 1.88 0.84 0.00 0.00 0.00 173.10 175.83 2qfu h HIS 363 N -0.92 0.96 0.00 1.90 2.76 -2.02 -3.30 115.15 114.52 2qfu h HIS 363 Ca -0.46 -0.04 -0.11 0.00 -2.20 0.00 0.00 60.37 57.56 2qfu h HIS 363 Cb 1.30 -0.30 -0.24 0.00 1.55 0.00 0.00 27.41 29.72 2qfu h HIS 363 CO 0.39 0.70 -0.82 -0.40 -1.30 0.00 0.00 177.93 176.50 2qfu n ASP 364 N -4.33 0.88 -3.87 3.26 3.85 -1.26 -4.75 116.55 110.32 2qfu n ASP 364 Ca 0.06 -2.23 -0.09 0.00 -0.71 0.00 0.00 54.79 51.83 2qfu n ASP 364 Cb 0.14 -0.30 -0.04 0.00 -1.35 0.00 0.00 41.12 39.56 2qfu n ASP 364 CO 0.00 0.00 0.00 -0.72 -1.01 0.00 0.00 177.20 175.47 2qfu s TYR 365 N -0.43 0.06 -0.01 2.11 -0.85 -1.25 -1.36 117.35 115.63 2qfu s TYR 365 Ca 0.26 -0.44 -0.00 0.00 -0.52 0.00 0.00 57.07 56.37 2qfu s TYR 365 Cb 0.29 0.38 0.01 0.00 0.38 0.00 0.00 41.96 43.02 2qfu s TYR 365 CO -0.11 -1.02 0.01 -1.50 -1.52 0.00 0.00 175.55 171.41 2qfu s ILE 366 N -3.94 -0.02 -0.13 -3.49 2.07 -0.36 -0.41 121.20 114.92 2qfu s ILE 366 Ca 0.15 0.07 0.03 0.00 -1.41 0.00 0.00 60.65 59.49 2qfu s ILE 366 Cb -0.02 -0.04 0.01 0.00 0.13 0.00 0.00 42.46 42.54 2qfu s ILE 366 CO 0.04 0.03 -0.22 -0.60 -1.91 0.00 0.00 174.94 172.28 2qfu s ARG 367 N 0.36 3.00 -0.15 3.50 3.52 -0.52 -1.21 118.95 127.45 2qfu s ARG 367 Ca -0.03 -0.85 0.01 0.00 -0.13 0.00 0.00 55.73 54.72 2qfu s ARG 367 Cb -0.04 -2.39 0.02 0.00 -1.56 0.00 0.00 34.95 30.98 2qfu s ARG 367 CO -0.01 0.03 -0.16 0.42 -0.81 0.00 0.00 175.30 174.78 2qfu s ILE 368 N 0.70 1.66 -0.28 4.11 1.01 0.80 -0.76 121.20 128.44 2qfu s ILE 368 Ca -0.10 -0.70 -0.03 0.00 0.00 0.00 0.00 60.65 59.82 2qfu s ILE 368 Cb -0.16 -1.54 0.03 0.00 0.01 0.00 0.00 42.46 40.80 2qfu s ILE 368 CO 0.01 0.47 0.01 -0.89 0.00 0.00 0.00 174.94 174.54 2qfu s THR 369 N 1.37 3.23 0.63 2.92 2.01 0.25 -1.18 115.64 124.88 2qfu s THR 369 Ca 0.03 -1.09 -0.17 0.00 0.31 0.00 0.00 61.69 60.77 2qfu s THR 369 Cb -0.13 -2.74 -0.01 0.00 0.01 0.00 0.00 72.50 69.62 2qfu s THR 369 CO -0.10 0.03 1.14 -2.16 -0.69 0.00 0.00 174.62 172.85 2qfu s PRO 370 N 1.34 2.88 0.70 4.92 0.04 -1.26 -1.32 135.00 142.29 2qfu s PRO 370 Ca -0.01 1.56 -0.10 0.00 0.04 0.00 0.00 61.00 62.49 2qfu s PRO 370 Cb -0.18 -1.95 0.03 0.00 0.04 0.00 0.00 34.50 32.44 2qfu s PRO 370 CO -0.01 -1.22 1.06 -1.25 0.04 0.00 0.00 177.00 175.62 2qfu s PRO 371 N -3.75 2.68 0.25 0.56 0.04 -1.26 -4.84 135.00 128.69 2qfu s PRO 371 Ca 0.71 0.25 -0.05 0.00 0.04 0.00 0.00 61.00 61.96 2qfu s PRO 371 Cb -0.24 -2.08 0.28 0.00 0.04 0.00 0.00 34.50 32.51 2qfu s PRO 371 CO 0.37 -1.07 1.82 0.93 0.04 0.00 0.00 177.00 179.09 2qfu h GLU 372 N -0.61 1.05 -3.31 4.56 4.39 -1.96 -3.43 114.58 115.27 2qfu h GLU 372 Ca -0.45 -0.18 -0.17 0.00 0.34 0.00 0.00 59.36 58.90 2qfu h GLU 372 Cb 1.27 -0.17 -0.25 0.00 -0.10 0.00 0.00 28.75 29.50 2qfu h GLU 372 CO 0.63 0.86 -0.49 -1.59 -1.16 0.00 0.00 179.01 177.26 2qfu s LYS 373 N -5.47 0.29 0.61 2.33 -2.85 -1.26 -5.15 119.74 108.24 2qfu s LYS 373 Ca -0.11 0.11 -0.14 0.00 -1.00 0.00 0.00 55.97 54.83 2qfu s LYS 373 Cb 0.16 0.13 -0.03 0.00 -2.06 0.00 0.00 37.83 36.03 2qfu s LYS 373 CO 0.82 -0.05 1.04 -0.51 0.10 0.00 0.00 175.35 176.75 2qfu s LEU 374 N -0.25 3.40 0.29 2.77 1.43 -1.26 -4.90 118.68 120.15 2qfu s LEU 374 Ca -0.03 1.66 0.09 0.00 -1.03 0.00 0.00 54.13 54.81 2qfu s LEU 374 Cb -0.03 -4.51 -0.06 0.00 0.03 0.00 0.00 46.19 41.63 2qfu s LEU 374 CO 0.01 -1.07 -0.11 0.54 0.23 0.00 0.00 176.35 175.95 2qfu s ASN 375 N -3.29 3.20 0.37 2.29 4.22 -0.86 -4.84 114.94 116.03 2qfu s ASN 375 Ca 0.60 -1.14 -0.27 0.00 -2.14 0.00 0.00 52.86 49.91 2qfu s ASN 375 Cb -0.13 -0.25 -0.09 0.00 1.28 0.00 0.00 41.25 42.05 2qfu s ASN 375 CO 0.43 -0.20 1.30 0.12 -2.04 0.00 0.00 177.10 176.70 2qfu s PHE 376 N -2.78 2.95 0.05 1.54 5.36 -1.26 -4.60 117.98 119.23 2qfu s PHE 376 Ca 0.30 1.42 -0.11 0.00 -0.96 0.00 0.00 56.93 57.58 2qfu s PHE 376 Cb 0.01 -3.66 0.01 0.00 -0.34 0.00 0.00 43.02 39.04 2qfu s PHE 376 CO 0.13 -1.92 0.23 0.00 -1.46 0.00 0.00 175.22 172.20 2qfu s ALA 377 N -1.21 -0.45 -0.40 11.12 0.00 -1.26 -4.84 121.76 124.72 2qfu s ALA 377 Ca 0.53 -0.23 -0.16 0.00 0.00 0.00 0.00 51.96 52.10 2qfu s ALA 377 Cb -0.38 0.31 0.01 0.00 0.00 0.00 0.00 23.12 23.06 2qfu s ALA 377 CO 0.50 -0.39 0.36 -2.00 0.00 0.00 0.00 175.76 174.23 2qfu s GLU 378 N -2.69 3.13 -0.14 0.00 2.12 -1.26 -2.21 118.70 117.64 2qfu s GLU 378 Ca -0.04 -0.82 -0.21 0.00 0.36 0.00 0.00 54.97 54.26 2qfu s GLU 378 Cb -0.00 -3.94 -0.03 0.00 0.26 0.00 0.00 34.13 30.41 2qfu s GLU 378 CO -0.04 -0.74 0.61 0.42 -0.54 0.00 0.00 175.26 174.96 2qfu s ILE 379 N 1.91 5.07 0.25 -3.70 -1.09 0.10 -4.95 121.20 118.79 2qfu s ILE 379 Ca 0.09 1.19 -0.25 0.00 -2.23 0.00 0.00 60.65 59.44 2qfu s ILE 379 Cb -0.18 -3.94 -0.09 0.00 -1.58 0.00 0.00 42.46 36.68 2qfu s ILE 379 CO 0.12 0.20 0.86 0.00 -1.23 0.00 0.00 174.94 174.89 2qfu s ALA 380 N 1.30 3.34 -0.75 9.38 0.00 -1.26 -1.21 121.76 132.57 2qfu s ALA 380 Ca 0.30 0.43 0.07 0.00 0.00 0.00 0.00 51.96 52.77 2qfu s ALA 380 Cb -0.16 -3.06 0.02 0.00 0.00 0.00 0.00 23.12 19.92 2qfu s ALA 380 CO 0.12 0.24 0.59 0.25 0.00 0.00 0.00 175.76 176.96 2qfu n THR 381 N 1.03 0.00 -2.89 0.00 -2.24 -1.26 -4.92 114.28 104.01 2qfu n THR 381 Ca -0.02 -0.45 -0.19 0.00 -2.27 0.00 0.00 64.05 61.12 2qfu n THR 381 Cb 0.49 1.11 0.00 0.00 -2.10 0.00 0.00 70.33 69.83 2qfu n THR 381 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2qfu n TYR 382 N -0.11 -1.64 -3.39 4.78 4.01 -1.26 -0.42 117.16 119.13 2qfu n TYR 382 Ca 0.03 0.29 -0.25 0.00 -0.16 0.00 0.00 57.90 57.82 2qfu n TYR 382 Cb 0.16 -3.39 0.02 0.00 -0.31 0.00 0.00 39.34 35.82 2qfu n TYR 382 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2qfu n ASN 383 N -2.17 -4.78 -3.89 7.72 3.02 -1.26 -4.57 115.26 109.33 2qfu n ASN 383 Ca -0.11 -0.45 -0.30 0.00 -0.03 0.00 0.00 54.58 53.69 2qfu n ASN 383 Cb 0.60 -3.88 -0.15 0.00 -0.61 0.00 0.00 39.78 35.74 2qfu n ASN 383 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2qfu s ASP 384 N -2.86 4.14 0.33 6.41 -1.08 0.44 -4.88 116.67 119.18 2qfu s ASP 384 Ca 0.44 -1.60 0.10 0.00 -0.52 0.00 0.00 52.55 50.97 2qfu s ASP 384 Cb -0.22 -1.19 1.01 0.00 -1.46 0.00 0.00 42.92 41.06 2qfu s ASP 384 CO 0.54 -0.34 1.59 1.12 0.52 0.00 0.00 175.17 178.60 2qfu h HIS 385 N 7.91 0.38 0.00 -5.34 2.07 -1.83 0.96 115.15 119.30 2qfu h HIS 385 Ca -0.12 0.06 -0.05 0.00 -2.85 0.00 0.00 60.37 57.41 2qfu h HIS 385 Cb 1.04 -0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.01 2qfu h HIS 385 CO 0.44 -0.42 -0.22 0.00 -3.07 0.00 0.00 177.93 174.66 2qfu h ARG 386 N 0.04 0.00 -0.45 5.12 3.08 -1.92 -1.68 114.38 118.56 2qfu h ARG 386 Ca 0.70 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.65 2qfu h ARG 386 Cb 1.65 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.69 2qfu h ARG 386 CO -0.83 0.22 -0.10 0.52 -1.07 0.00 0.00 179.97 178.71 2qfu h MET 387 N 0.00 0.87 -0.24 0.04 2.86 -1.07 0.17 114.93 117.55 2qfu h MET 387 Ca -0.00 -0.33 -0.02 0.00 -2.06 0.00 0.00 59.70 57.29 2qfu h MET 387 Cb 0.79 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.39 2qfu h MET 387 CO 0.03 0.97 0.07 0.00 1.06 0.00 0.00 176.91 179.04 2qfu h ALA 388 N 0.87 0.32 -0.40 6.32 0.00 -1.36 -2.03 119.26 122.99 2qfu h ALA 388 Ca 0.12 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.73 2qfu h ALA 388 Cb 0.65 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2qfu h ALA 388 CO 0.04 -0.04 -0.32 0.52 0.00 0.00 0.00 179.25 179.45 2qfu h MET 389 N 0.22 0.92 -0.67 0.00 2.07 -1.22 -2.30 114.93 113.95 2qfu h MET 389 Ca 0.08 -0.46 -0.02 0.00 -2.07 0.00 0.00 59.70 57.23 2qfu h MET 389 Cb 0.26 0.00 -0.03 0.00 -1.87 0.00 0.00 31.60 29.96 2qfu h MET 389 CO -0.00 1.11 0.34 0.00 1.07 0.00 0.00 176.91 179.43 2qfu n PHE 391 N -4.49 0.13 0.28 0.00 3.72 -0.77 -2.45 117.46 113.90 2qfu n PHE 391 Ca 0.05 0.04 0.13 0.00 -0.05 0.00 0.00 57.45 57.63 2qfu n PHE 391 Cb 0.11 -0.57 0.81 0.00 -0.94 0.00 0.00 39.48 38.90 2qfu n PHE 391 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2qfu h SER 392 N 0.00 0.00 0.63 4.37 4.64 -1.11 -1.59 113.55 120.50 2qfu h SER 392 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qfu h SER 392 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2qfu h SER 392 CO 0.00 0.06 0.00 -0.07 -0.87 0.00 0.00 176.83 175.95 2qfu h LEU 393 N 0.00 0.00 -1.99 5.97 3.38 -1.61 -2.34 115.31 118.72 2qfu h LEU 393 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qfu h LEU 393 Cb 0.15 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 2qfu h LEU 393 CO 0.01 0.00 -0.01 0.58 0.09 0.00 0.00 178.44 179.10 2qfu h VAL 394 N 0.00 0.99 0.00 1.22 2.07 -1.49 -1.44 116.25 117.60 2qfu h VAL 394 Ca 0.00 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.47 2qfu h VAL 394 Cb 0.32 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 2qfu h VAL 394 CO 0.00 0.01 0.00 0.00 0.02 0.00 0.00 177.57 177.60 2qfu n ALA 395 N -2.53 1.89 1.57 1.67 0.00 -0.88 -2.01 120.51 120.22 2qfu n ALA 395 Ca -0.03 -0.08 0.01 0.00 0.00 0.00 0.00 53.44 53.35 2qfu n ALA 395 Cb 0.10 -1.24 0.04 0.00 0.00 0.00 0.00 19.45 18.36 2qfu n ALA 395 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qfu n LEU 396 N -1.21 0.66 0.00 0.00 4.77 -0.54 -0.08 117.00 120.61 2qfu n LEU 396 Ca 0.08 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 2qfu n LEU 396 Cb 0.10 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2qfu n LEU 396 CO 0.10 0.15 0.00 -1.54 -1.33 0.00 0.00 177.39 174.78 2qfu n SER 397 N -0.18 0.76 -0.12 -1.43 3.41 -0.85 -4.83 113.62 110.37 2qfu n SER 397 Ca 0.03 -0.50 0.14 0.00 -0.26 0.00 0.00 58.87 58.29 2qfu n SER 397 Cb 0.12 0.00 0.63 0.00 -0.26 0.00 0.00 64.21 64.71 2qfu n SER 397 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2qfu n ASP 398 N -1.11 0.47 -4.53 4.04 8.00 -1.26 -4.35 116.55 117.80 2qfu n ASP 398 Ca 0.00 -0.63 -0.31 0.00 0.71 0.00 0.00 54.79 54.55 2qfu n ASP 398 Cb 0.00 -0.07 -0.11 0.00 -0.02 0.00 0.00 41.12 40.91 2qfu n ASP 398 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2qfu s THR 399 N -2.42 3.25 0.88 -3.53 -1.32 -1.26 -4.86 115.64 106.38 2qfu s THR 399 Ca 0.31 -1.00 -0.12 0.00 -1.21 0.00 0.00 61.69 59.66 2qfu s THR 399 Cb 0.20 -2.41 0.12 0.00 -1.51 0.00 0.00 72.50 68.91 2qfu s THR 399 CO 0.46 0.34 1.16 -2.16 -2.21 0.00 0.00 174.62 172.21 2qfu s PRO 400 N -1.51 1.35 -0.03 7.08 0.04 -1.26 -4.36 135.00 136.31 2qfu s PRO 400 Ca 0.16 0.20 -0.04 0.00 0.04 0.00 0.00 61.00 61.36 2qfu s PRO 400 Cb -0.11 -1.87 0.01 0.00 0.04 0.00 0.00 34.50 32.57 2qfu s PRO 400 CO 0.07 -2.03 0.11 0.54 0.04 0.00 0.00 177.00 175.73 2qfu s VAL 401 N -3.39 0.03 -0.17 -0.36 0.11 -0.86 -4.50 120.40 111.26 2qfu s VAL 401 Ca 0.64 -0.26 -0.03 0.00 -2.93 0.00 0.00 61.98 59.39 2qfu s VAL 401 Cb -0.13 -0.24 -0.02 0.00 -1.53 0.00 0.00 36.38 34.45 2qfu s VAL 401 CO 0.52 -0.14 -0.04 -0.89 -3.33 0.00 0.00 175.10 171.21 2qfu s THR 402 N -0.44 3.75 -0.25 5.04 2.01 -0.94 -0.50 115.64 124.31 2qfu s THR 402 Ca -0.05 -0.40 -0.06 0.00 0.31 0.00 0.00 61.69 61.49 2qfu s THR 402 Cb -0.03 -2.65 -0.01 0.00 0.01 0.00 0.00 72.50 69.82 2qfu s THR 402 CO 0.00 0.48 0.02 -0.63 -0.69 0.00 0.00 174.62 173.81 2qfu s ILE 403 N 0.56 3.80 0.44 1.82 -1.09 0.10 0.01 121.20 126.84 2qfu s ILE 403 Ca -0.03 -0.46 -0.22 0.00 -2.23 0.00 0.00 60.65 57.71 2qfu s ILE 403 Cb -0.14 -2.81 -0.09 0.00 -1.58 0.00 0.00 42.46 37.83 2qfu s ILE 403 CO 0.03 0.30 1.02 -0.76 -1.23 0.00 0.00 174.94 174.30 2qfu s LEU 404 N 1.52 4.00 -1.30 2.97 1.43 -0.35 -1.25 118.68 125.70 2qfu s LEU 404 Ca 0.05 1.92 -0.13 0.00 -1.03 0.00 0.00 54.13 54.95 2qfu s LEU 404 Cb -0.15 -4.39 0.00 0.00 0.03 0.00 0.00 46.19 41.68 2qfu s LEU 404 CO 0.00 -0.56 0.55 -0.67 0.23 0.00 0.00 176.35 175.90 2qfu n ASP 405 N -0.50 -2.48 0.26 2.29 4.64 0.19 -4.44 116.55 116.51 2qfu n ASP 405 Ca 0.07 -1.08 0.18 0.00 -1.38 0.00 0.00 54.79 52.58 2qfu n ASP 405 Cb 0.52 -2.83 0.91 0.00 -1.04 0.00 0.00 41.12 38.67 2qfu n ASP 405 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 2qfu h PRO 406 N -1.98 0.00 0.00 -0.67 0.13 -1.79 -1.07 132.00 126.62 2qfu h PRO 406 Ca -0.66 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.47 2qfu h PRO 406 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 2qfu h PRO 406 CO 0.57 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 179.97 2qfu n LYS 407 N -3.59 0.10 0.16 0.86 4.76 -1.26 -2.33 118.16 116.86 2qfu n LYS 407 Ca -0.00 0.21 0.12 0.00 -2.87 0.00 0.00 58.31 55.76 2qfu n LYS 407 Cb 0.25 -1.50 0.58 0.00 -1.84 0.00 0.00 35.03 32.52 2qfu n LYS 407 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qfu h THR 409 N 0.00 0.00 0.00 0.00 1.35 -1.71 -2.82 112.91 109.74 2qfu h THR 409 Ca 0.00 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.69 2qfu h THR 409 Cb 0.17 0.89 0.00 0.00 -1.73 0.00 0.00 68.15 67.47 2qfu h THR 409 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 2qfu n ALA 410 N -1.85 1.10 -0.27 6.62 0.00 -0.50 -0.03 120.51 125.56 2qfu n ALA 410 Ca 0.00 0.15 0.07 0.00 0.00 0.00 0.00 53.44 53.67 2qfu n ALA 410 Cb 0.16 -1.26 0.31 0.00 0.00 0.00 0.00 19.45 18.65 2qfu n ALA 410 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2qfu h LYS 411 N 0.00 0.83 0.00 0.00 3.64 -1.74 0.18 116.57 119.48 2qfu h LYS 411 Ca 0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2qfu h LYS 411 Cb 0.03 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 2qfu h LYS 411 CO 0.00 0.55 0.00 0.25 -2.27 0.00 0.00 179.45 177.98 2qfu n THR 412 N -4.52 0.00 -2.77 1.00 -2.24 -0.98 -2.33 114.28 102.44 2qfu n THR 412 Ca 0.15 -0.09 -0.07 0.00 -2.27 0.00 0.00 64.05 61.76 2qfu n THR 412 Cb 0.31 1.14 0.03 0.00 -2.10 0.00 0.00 70.33 69.71 2qfu n THR 412 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2qfu n PHE 413 N -0.15 -3.41 -0.34 4.78 -0.00 0.95 -4.87 117.46 114.42 2qfu n PHE 413 Ca 0.00 -1.69 0.12 0.00 -0.00 0.00 0.00 57.45 55.88 2qfu n PHE 413 Cb 0.03 1.48 0.31 0.00 -0.00 0.00 0.00 39.48 41.30 2qfu n PHE 413 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.76 175.41 2qfu h PRO 414 N 4.34 0.70 -0.73 -7.13 0.11 -1.77 -2.03 132.00 125.50 2qfu h PRO 414 Ca -0.07 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.00 2qfu h PRO 414 Cb 1.05 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.00 2qfu h PRO 414 CO 0.23 0.46 0.00 -0.25 -0.21 0.00 0.00 178.00 178.23 2qfu n ASP 415 N -4.80 3.77 -0.10 -2.05 10.43 -1.26 -4.66 116.55 117.87 2qfu n ASP 415 Ca 0.23 -2.52 -0.08 0.00 2.57 0.00 0.00 54.79 54.98 2qfu n ASP 415 Cb 0.56 -0.59 -0.02 0.00 1.84 0.00 0.00 41.12 42.91 2qfu n ASP 415 CO 0.00 0.00 0.00 0.22 -1.07 0.00 0.00 177.20 176.35 2qfu h TYR 416 N 2.43 -0.93 -0.33 1.24 3.20 -1.73 -1.86 116.97 118.99 2qfu h TYR 416 Ca 0.00 0.06 -0.06 0.00 3.14 0.00 0.00 58.73 61.87 2qfu h TYR 416 Cb 1.34 0.46 -0.02 0.00 1.54 0.00 0.00 36.73 40.06 2qfu h TYR 416 CO 0.64 -0.39 -0.03 0.74 -1.64 0.00 0.00 178.16 177.48 2qfu h PHE 417 N -0.28 0.55 -0.23 -3.82 0.04 -1.86 -0.31 116.94 111.03 2qfu h PHE 417 Ca 0.16 -0.06 -0.12 0.00 2.80 0.00 0.00 57.97 60.75 2qfu h PHE 417 Cb 0.54 -0.16 -0.01 0.00 2.20 0.00 0.00 35.95 38.53 2qfu h PHE 417 CO -0.53 0.56 -0.36 1.49 -0.60 0.00 0.00 178.31 178.87 2qfu h GLU 418 N 0.50 0.50 -0.51 1.51 4.22 -1.82 -1.10 114.58 117.89 2qfu h GLU 418 Ca 0.10 -0.23 -0.13 0.00 0.08 0.00 0.00 59.36 59.18 2qfu h GLU 418 Cb 0.37 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 2qfu h GLU 418 CO 0.01 0.79 -0.18 1.96 -2.18 0.00 0.00 179.01 179.42 2qfu h GLN 419 N 0.42 1.02 -0.67 1.92 1.08 -0.57 -0.96 115.11 117.35 2qfu h GLN 419 Ca 0.04 -0.42 -0.02 0.00 -1.45 0.00 0.00 58.65 56.80 2qfu h GLN 419 Cb 0.83 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 28.18 2qfu h GLN 419 CO 0.07 1.10 0.32 1.25 -0.95 0.00 0.00 178.83 180.62 2qfu h LEU 420 N 0.89 0.88 -1.44 1.46 5.85 -0.94 -2.28 115.31 119.73 2qfu h LEU 420 Ca 0.12 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 2qfu h LEU 420 Cb 0.76 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 2qfu h LEU 420 CO 0.06 0.76 0.12 0.00 -0.34 0.00 0.00 178.44 179.05 2qfu h ALA 421 N 1.15 1.56 -0.78 1.25 0.00 -0.91 -2.38 119.26 119.16 2qfu h ALA 421 Ca 0.23 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.08 2qfu h ALA 421 Cb 0.12 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 2qfu h ALA 421 CO -0.03 0.34 0.51 -0.09 0.00 0.00 0.00 179.25 179.98 2qfu h ARG 422 N 0.49 0.87 -0.13 0.00 2.43 -0.57 -1.85 114.38 115.63 2qfu h ARG 422 Ca 0.12 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2qfu h ARG 422 Cb 0.13 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 2qfu h ARG 422 CO -0.01 0.57 0.00 0.44 -1.51 0.00 0.00 179.97 179.46 2qfu n ILE 423 N -4.47 0.14 -2.86 1.20 -5.35 -1.01 -4.91 119.36 102.11 2qfu n ILE 423 Ca 0.11 -0.51 -0.41 0.00 -0.27 0.00 0.00 62.75 61.66 2qfu n ILE 423 Cb 0.17 1.14 -0.04 0.00 -1.74 0.00 0.00 39.64 39.17 2qfu n ILE 423 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 2qfu s SER 424 N -1.84 7.06 0.12 7.28 0.01 -0.70 -1.18 113.70 124.44 2qfu s SER 424 Ca 0.32 1.29 0.10 0.00 1.31 0.00 0.00 55.95 58.98 2qfu s SER 424 Cb 0.21 -2.48 -0.04 0.00 0.21 0.00 0.00 66.02 63.92 2qfu s SER 424 CO 0.31 -0.35 -0.25 -1.10 0.41 0.00 0.00 173.24 172.26 2qfu s GLN 425 N 1.79 1.31 0.17 12.44 -1.52 0.63 -4.97 119.66 129.51 2qfu s GLN 425 Ca 0.41 -1.29 0.23 0.00 -1.95 0.00 0.00 55.36 52.75 2qfu s GLN 425 Cb -0.17 -1.73 -0.02 0.00 -0.22 0.00 0.00 33.01 30.86 2qfu s GLN 425 CO 0.16 0.41 0.99 0.00 -0.25 0.00 0.00 175.29 176.59 2qfu n ALA 426 N 0.94 2.61 -0.68 6.09 0.00 -1.26 -2.56 120.51 125.65 2qfu n ALA 426 Ca -0.18 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 52.98 2qfu n ALA 426 Cb 0.53 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.92 2qfu n ALA 426 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50