#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gna n LEU 8 N 0.00 0.61 -4.71 4.03 4.77 -1.26 -4.95 117.00 115.49 2gna n LEU 8 Ca 0.00 -0.78 -0.42 0.00 -0.03 0.00 0.00 56.01 54.78 2gna n LEU 8 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 2gna n LEU 8 CO 0.00 0.15 1.38 1.51 -1.33 0.00 0.00 177.39 179.10 2gna s ASP 9 N -0.50 6.45 -1.25 -1.43 -4.77 -1.26 -1.27 116.67 112.64 2gna s ASP 9 Ca 0.01 2.75 0.00 0.00 -3.30 0.00 0.00 52.55 52.00 2gna s ASP 9 Cb 0.01 -2.58 0.00 0.00 -1.09 0.00 0.00 42.92 39.25 2gna s ASP 9 CO 0.02 -0.95 0.00 -3.20 0.70 0.00 0.00 175.17 171.74 2gna n ASN 10 N 4.77 -4.37 -4.88 2.11 2.85 -0.13 -4.88 115.26 110.73 2gna n ASN 10 Ca 0.16 0.26 -0.32 0.00 -0.11 0.00 0.00 54.58 54.57 2gna n ASN 10 Cb 0.37 -3.01 -0.05 0.00 1.24 0.00 0.00 39.78 38.33 2gna n ASN 10 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 2gna s GLN 11 N -3.22 3.32 -0.20 1.20 -1.52 -0.40 -4.62 119.66 114.23 2gna s GLN 11 Ca 0.00 -0.44 -0.08 0.00 -1.95 0.00 0.00 55.36 52.89 2gna s GLN 11 Cb 0.00 -3.00 -0.04 0.00 -0.22 0.00 0.00 33.01 29.75 2gna s GLN 11 CO 0.00 0.63 0.08 0.99 -0.25 0.00 0.00 175.29 176.74 2gna s THR 12 N -1.40 4.80 -0.07 -0.19 2.01 -1.26 -1.22 115.64 118.31 2gna s THR 12 Ca 0.30 -0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.33 2gna s THR 12 Cb -0.13 -3.18 -0.01 0.00 0.01 0.00 0.00 72.50 69.19 2gna s THR 12 CO 0.23 0.43 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.72 2gna s ILE 13 N 0.60 2.13 -0.09 1.82 1.01 0.04 -1.20 121.20 125.52 2gna s ILE 13 Ca 0.04 -1.03 0.04 0.00 0.00 0.00 0.00 60.65 59.70 2gna s ILE 13 Cb -0.13 -1.78 -0.00 0.00 0.01 0.00 0.00 42.46 40.56 2gna s ILE 13 CO 0.01 0.57 -0.23 -0.22 0.00 0.00 0.00 174.94 175.07 2gna s LEU 14 N -0.09 2.05 -0.15 2.97 0.20 -0.14 0.84 118.68 124.36 2gna s LEU 14 Ca -0.06 -0.52 0.00 0.00 0.69 0.00 0.00 54.13 54.24 2gna s LEU 14 Cb -0.14 -1.34 0.03 0.00 -0.43 0.00 0.00 46.19 44.30 2gna s LEU 14 CO 0.04 0.17 -0.11 -0.51 -0.29 0.00 0.00 176.35 175.65 2gna s ILE 15 N 0.25 1.43 0.33 6.68 2.07 0.75 -0.66 121.20 132.06 2gna s ILE 15 Ca -0.15 -0.61 -0.26 0.00 -1.41 0.00 0.00 60.65 58.22 2gna s ILE 15 Cb -0.17 -1.40 -0.09 0.00 0.13 0.00 0.00 42.46 40.93 2gna s ILE 15 CO 0.07 0.37 1.02 0.42 -1.91 0.00 0.00 174.94 174.91 2gna s THR 16 N 1.53 3.83 -1.00 4.00 -4.23 -0.37 -1.92 115.64 117.49 2gna s THR 16 Ca 0.04 1.57 0.00 0.00 -1.18 0.00 0.00 61.69 62.12 2gna s THR 16 Cb -0.13 -3.90 0.00 0.00 1.34 0.00 0.00 72.50 69.81 2gna s THR 16 CO -0.10 0.17 0.00 0.61 -0.54 0.00 0.00 174.62 174.77 2gna n GLY 17 N 0.71 0.11 0.15 3.99 0.00 0.33 -2.16 105.19 108.32 2gna n GLY 17 Ca 0.02 -0.43 0.11 0.00 0.00 0.00 0.00 46.02 45.72 2gna n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gna n GLY 18 N -1.10 -0.87 0.78 -0.02 0.00 -1.10 -1.75 105.19 101.13 2gna n GLY 18 Ca -0.13 0.19 0.11 0.00 0.00 0.00 0.00 46.02 46.19 2gna n GLY 18 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gna n THR 19 N -2.22 0.25 -2.16 2.61 -2.24 -1.26 -3.15 114.28 106.11 2gna n THR 19 Ca -0.01 -0.47 -0.24 0.00 -2.27 0.00 0.00 64.05 61.06 2gna n THR 19 Cb 0.04 0.70 0.15 0.00 -2.10 0.00 0.00 70.33 69.12 2gna n THR 19 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gna n GLY 20 N 1.28 -0.50 0.20 3.38 0.00 -0.72 -4.73 105.19 104.09 2gna n GLY 20 Ca 0.17 -1.85 -0.10 0.00 0.00 0.00 0.00 46.02 44.24 2gna n GLY 20 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2gna h SER 21 N -1.09 -0.46 -0.03 1.61 4.64 -1.93 -0.84 113.55 115.45 2gna h SER 21 Ca -0.34 0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 61.05 2gna h SER 21 Cb 1.07 0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2gna h SER 21 CO 0.29 -0.21 0.01 0.15 -0.87 0.00 0.00 176.83 176.21 2gna h PHE 22 N -0.22 0.04 -0.43 4.77 3.57 -1.94 -3.08 116.94 119.65 2gna h PHE 22 Ca 0.07 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.64 2gna h PHE 22 Cb 0.32 -0.01 -0.09 0.00 2.79 0.00 0.00 35.95 38.96 2gna h PHE 22 CO -0.23 0.18 -0.43 0.78 -2.23 0.00 0.00 178.31 176.38 2gna h GLY 23 N -0.11 -0.54 1.00 2.40 0.00 -1.63 0.22 103.07 104.41 2gna h GLY 23 Ca 0.01 0.55 -0.00 0.00 0.00 0.00 0.00 47.33 47.88 2gna h GLY 23 CO -0.00 -0.18 0.41 0.50 0.00 0.00 0.00 176.54 177.27 2gna h LYS 24 N -0.31 0.91 -0.54 4.80 1.57 -1.11 0.14 116.57 122.03 2gna h LYS 24 Ca 0.14 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 2gna h LYS 24 Cb 0.58 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 2gna h LYS 24 CO -0.59 0.65 0.13 0.00 -0.57 0.00 0.00 179.45 179.07 2gna h PHE 26 N 0.76 0.59 -0.25 0.00 3.57 -0.14 -0.82 116.94 120.65 2gna h PHE 26 Ca 0.17 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 2gna h PHE 26 Cb 0.34 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 2gna h PHE 26 CO 0.02 0.56 0.14 0.28 -2.23 0.00 0.00 178.31 177.08 2gna h VAL 27 N 0.46 1.12 -0.61 1.41 2.07 -0.56 0.82 116.25 120.96 2gna h VAL 27 Ca 0.12 -0.32 0.05 0.00 0.82 0.00 0.00 66.70 67.37 2gna h VAL 27 Cb 0.23 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 30.83 2gna h VAL 27 CO -0.01 0.12 0.33 -0.09 0.02 0.00 0.00 177.57 177.94 2gna h ARG 28 N 0.30 0.60 -0.22 1.57 9.65 -0.87 -0.03 114.38 125.37 2gna h ARG 28 Ca 0.09 -0.04 -0.11 0.00 -1.10 0.00 0.00 59.98 58.83 2gna h ARG 28 Cb 0.07 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.50 2gna h ARG 28 CO -0.01 0.40 -0.32 -0.22 2.80 0.00 0.00 179.97 182.61 2gna h LYS 29 N 0.62 0.45 -0.16 0.20 1.63 -0.76 -2.54 116.57 116.01 2gna h LYS 29 Ca 0.27 -0.19 -0.17 0.00 -0.85 0.00 0.00 60.65 59.71 2gna h LYS 29 Cb 0.17 -0.02 0.01 0.00 -0.60 0.00 0.00 32.23 31.79 2gna h LYS 29 CO -0.18 0.72 -0.56 0.28 -3.45 0.00 0.00 179.45 176.26 2gna h VAL 30 N 0.39 1.32 -0.93 2.00 2.07 -0.21 -1.65 116.25 119.23 2gna h VAL 30 Ca 0.05 -1.81 -0.00 0.00 0.82 0.00 0.00 66.70 65.76 2gna h VAL 30 Cb 0.75 1.98 -0.05 0.00 -1.52 0.00 0.00 31.29 32.46 2gna h VAL 30 CO 0.06 0.56 0.58 -0.07 0.02 0.00 0.00 177.57 178.72 2gna h LEU 31 N 0.36 1.10 0.00 2.57 3.38 -0.97 -2.28 115.31 119.46 2gna h LEU 31 Ca -0.02 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 57.75 2gna h LEU 31 Cb 1.19 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 2gna h LEU 31 CO 0.12 0.83 -0.88 0.44 0.09 0.00 0.00 178.44 179.04 2gna h ASP 32 N 1.27 0.00 0.00 -0.43 3.45 -1.46 -3.40 116.42 115.85 2gna h ASP 32 Ca 0.33 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.79 2gna h ASP 32 Cb -0.08 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.69 2gna h ASP 32 CO -0.07 0.61 0.00 0.35 -1.57 0.00 0.00 179.24 178.56 2gna n THR 33 N -3.14 0.37 -4.38 0.35 -2.24 -0.63 -5.06 114.28 99.56 2gna n THR 33 Ca -0.02 -0.67 -0.20 0.00 -2.27 0.00 0.00 64.05 60.89 2gna n THR 33 Cb 0.80 0.83 -0.10 0.00 -2.10 0.00 0.00 70.33 69.77 2gna n THR 33 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2gna s THR 34 N -0.37 0.64 -0.39 4.28 -4.23 -0.86 -5.03 115.64 109.67 2gna s THR 34 Ca 0.00 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.57 2gna s THR 34 Cb 0.00 -2.59 0.66 0.00 1.34 0.00 0.00 72.50 71.90 2gna s THR 34 CO 0.00 0.00 1.80 0.59 -0.54 0.00 0.00 174.62 176.47 2gna n ASN 35 N -0.77 3.77 -4.61 3.99 4.13 -1.26 -4.82 115.26 115.68 2gna n ASN 35 Ca -0.01 -3.54 -0.49 0.00 1.68 0.00 0.00 54.58 52.21 2gna n ASN 35 Cb 0.66 -0.78 -0.05 0.00 -1.54 0.00 0.00 39.78 38.07 2gna n ASN 35 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2gna n ALA 36 N -0.91 -0.21 0.09 5.41 0.00 -1.16 -0.96 120.51 122.78 2gna n ALA 36 Ca 0.50 0.48 -0.05 0.00 0.00 0.00 0.00 53.44 54.37 2gna n ALA 36 Cb 1.48 -2.15 -0.01 0.00 0.00 0.00 0.00 19.45 18.77 2gna n ALA 36 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2gna h LYS 37 N 4.60 0.00 -2.19 0.00 3.64 -1.36 -3.44 116.57 117.82 2gna h LYS 37 Ca -0.46 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 58.89 2gna h LYS 37 Cb 1.31 0.00 -0.23 0.00 -0.41 0.00 0.00 32.23 32.91 2gna h LYS 37 CO 0.79 0.86 -0.07 0.21 -2.27 0.00 0.00 179.45 178.97 2gna s LYS 38 N -3.05 0.63 -0.21 1.90 2.20 -1.20 -4.74 119.74 115.27 2gna s LYS 38 Ca 0.00 1.08 -0.01 0.00 -0.36 0.00 0.00 55.97 56.69 2gna s LYS 38 Cb 0.11 0.11 0.02 0.00 -1.51 0.00 0.00 37.83 36.56 2gna s LYS 38 CO 0.80 -0.15 -0.13 0.42 -0.36 0.00 0.00 175.35 175.93 2gna s ILE 39 N 1.47 2.55 -0.19 5.43 1.01 0.99 -0.78 121.20 131.67 2gna s ILE 39 Ca -0.09 -0.89 -0.06 0.00 0.00 0.00 0.00 60.65 59.61 2gna s ILE 39 Cb -0.06 -2.17 -0.03 0.00 0.01 0.00 0.00 42.46 40.21 2gna s ILE 39 CO -0.16 0.41 0.03 -0.63 0.00 0.00 0.00 174.94 174.58 2gna s ILE 40 N 1.33 4.29 -0.21 2.92 1.01 0.25 -2.04 121.20 128.75 2gna s ILE 40 Ca 0.03 -0.20 -0.12 0.00 0.00 0.00 0.00 60.65 60.37 2gna s ILE 40 Cb -0.14 -2.94 -0.05 0.00 0.01 0.00 0.00 42.46 39.34 2gna s ILE 40 CO -0.08 0.44 0.20 -0.69 0.00 0.00 0.00 174.94 174.80 2gna s VAL 41 N 0.76 5.35 -0.28 2.92 1.01 -0.79 -0.18 120.40 129.19 2gna s VAL 41 Ca 0.01 0.31 0.02 0.00 0.00 0.00 0.00 61.98 62.32 2gna s VAL 41 Cb -0.14 -3.54 0.08 0.00 0.00 0.00 0.00 36.38 32.78 2gna s VAL 41 CO 0.02 0.37 -0.01 -0.47 0.00 0.00 0.00 175.10 175.01 2gna s TYR 42 N 0.80 2.77 0.35 5.22 5.04 -0.81 -1.08 117.35 129.64 2gna s TYR 42 Ca 0.11 -2.17 -0.12 0.00 -2.44 0.00 0.00 57.07 52.45 2gna s TYR 42 Cb -0.13 -2.02 0.03 0.00 0.35 0.00 0.00 41.96 40.19 2gna s TYR 42 CO 0.03 -0.85 0.65 -1.54 -1.34 0.00 0.00 175.55 172.49 2gna s SER 43 N 1.26 0.27 -0.06 4.32 1.04 -1.16 -0.51 113.70 118.86 2gna s SER 43 Ca 0.01 -1.19 0.17 0.00 0.48 0.00 0.00 55.95 55.42 2gna s SER 43 Cb -0.19 0.75 -0.22 0.00 0.10 0.00 0.00 66.02 66.46 2gna s SER 43 CO -0.10 -1.47 0.49 0.54 0.98 0.00 0.00 173.24 173.69 2gna n ARG 44 N -0.52 0.65 -2.78 4.02 1.74 -1.13 -0.94 116.66 117.71 2gna n ARG 44 Ca -0.04 0.12 -0.43 0.00 -0.77 0.00 0.00 57.85 56.74 2gna n ARG 44 Cb 0.61 -1.68 -0.03 0.00 -1.02 0.00 0.00 32.46 30.33 2gna n ARG 44 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2gna s ASP 45 N -5.64 6.80 0.33 0.55 3.68 -1.26 -4.77 116.67 116.36 2gna s ASP 45 Ca -0.06 0.84 0.07 0.00 2.13 0.00 0.00 52.55 55.53 2gna s ASP 45 Cb 0.08 -2.48 0.59 0.00 -1.45 0.00 0.00 42.92 39.66 2gna s ASP 45 CO 0.83 -0.78 1.80 1.05 0.13 0.00 0.00 175.17 178.20 2gna h GLU 46 N 8.16 0.26 0.71 4.34 4.11 -1.98 -1.91 114.58 128.27 2gna h GLU 46 Ca -0.22 -0.09 -0.03 0.00 0.07 0.00 0.00 59.36 59.08 2gna h GLU 46 Cb 1.08 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 30.31 2gna h GLU 46 CO 0.97 0.52 -0.34 1.25 0.07 0.00 0.00 179.01 181.48 2gna h LEU 47 N 0.23 -0.81 -1.37 3.06 7.12 -2.00 -1.27 115.31 120.28 2gna h LEU 47 Ca 0.04 0.01 -0.01 0.00 0.13 0.00 0.00 57.88 58.04 2gna h LEU 47 Cb 0.61 0.21 -0.02 0.00 -0.53 0.00 0.00 40.66 40.92 2gna h LEU 47 CO 0.04 -0.53 0.24 0.11 -0.13 0.00 0.00 178.44 178.17 2gna h LYS 48 N -1.03 0.67 -0.09 1.25 1.57 -1.97 -2.09 116.57 114.89 2gna h LYS 48 Ca -0.10 -0.07 -0.19 0.00 -1.87 0.00 0.00 60.65 58.42 2gna h LYS 48 Cb 0.75 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.93 2gna h LYS 48 CO 0.16 0.52 -0.75 1.96 -0.57 0.00 0.00 179.45 180.76 2gna h GLN 49 N 0.68 0.47 -0.28 3.15 4.20 -1.26 0.13 115.11 122.20 2gna h GLN 49 Ca 0.17 -0.40 -0.17 0.00 0.06 0.00 0.00 58.65 58.32 2gna h GLN 49 Cb 0.06 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.92 2gna h GLN 49 CO -0.03 1.03 -0.49 0.66 -0.67 0.00 0.00 178.83 179.34 2gna h SER 50 N 0.32 0.83 0.00 1.46 4.64 -1.04 -0.25 113.55 119.51 2gna h SER 50 Ca -0.04 -0.42 -0.15 0.00 -0.47 0.00 0.00 61.79 60.72 2gna h SER 50 Cb 1.34 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 63.19 2gna h SER 50 CO 0.13 1.18 -0.48 -0.33 -0.87 0.00 0.00 176.83 176.46 2gna h GLU 51 N 0.60 0.55 0.00 4.77 5.08 -1.33 -1.23 114.58 123.02 2gna h GLU 51 Ca 0.03 -0.31 -0.04 0.00 -1.00 0.00 0.00 59.36 58.04 2gna h GLU 51 Cb 1.06 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 2gna h GLU 51 CO 0.10 0.91 -0.19 1.98 -1.00 0.00 0.00 179.01 180.81 2gna h MET 52 N 0.44 0.00 0.05 2.33 4.05 -0.60 -1.72 114.93 119.48 2gna h MET 52 Ca 0.02 0.00 -0.27 0.00 -0.28 0.00 0.00 59.70 59.17 2gna h MET 52 Cb 1.00 0.00 0.02 0.00 -0.80 0.00 0.00 31.60 31.82 2gna h MET 52 CO 0.09 0.19 -1.11 0.00 0.23 0.00 0.00 176.91 176.31 2gna h ALA 53 N 1.81 0.11 -0.50 0.39 0.00 -0.60 -1.70 119.26 118.77 2gna h ALA 53 Ca -0.00 -0.73 -0.10 0.00 0.00 0.00 0.00 54.91 54.07 2gna h ALA 53 Cb 0.81 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2gna h ALA 53 CO 0.02 0.71 -0.08 0.52 0.00 0.00 0.00 179.25 180.43 2gna h MET 54 N 0.32 0.95 0.00 0.00 2.07 -1.01 -2.93 114.93 114.32 2gna h MET 54 Ca -0.14 -0.34 -0.09 0.00 -2.07 0.00 0.00 59.70 57.05 2gna h MET 54 Cb 1.77 -0.06 -0.01 0.00 -1.87 0.00 0.00 31.60 31.42 2gna h MET 54 CO 0.21 1.01 -0.41 1.05 1.07 0.00 0.00 176.91 179.83 2gna h GLU 55 N 0.81 0.00 -2.68 1.72 4.11 -1.38 -3.32 114.58 113.83 2gna h GLU 55 Ca 0.13 0.00 -0.66 0.00 0.07 0.00 0.00 59.36 58.90 2gna h GLU 55 Cb 0.63 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 29.50 2gna h GLU 55 CO 0.04 0.41 -0.24 1.19 0.07 0.00 0.00 179.01 180.48 2gna n PHE 56 N -3.35 3.47 -2.79 2.06 3.01 -0.64 -4.98 117.46 114.24 2gna n PHE 56 Ca 0.01 -3.90 -0.44 0.00 1.01 0.00 0.00 57.45 54.13 2gna n PHE 56 Cb 0.61 -0.81 -0.00 0.00 -0.01 0.00 0.00 39.48 39.27 2gna n PHE 56 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 2gna s ASN 57 N -1.74 6.97 -0.02 4.37 3.84 -1.15 -4.69 114.94 122.52 2gna s ASN 57 Ca 0.34 -2.75 0.01 0.00 0.21 0.00 0.00 52.86 50.67 2gna s ASN 57 Cb 0.06 -2.47 0.01 0.00 -0.55 0.00 0.00 41.25 38.29 2gna s ASN 57 CO -0.04 -0.93 -0.04 -0.62 -2.79 0.00 0.00 177.10 172.69 2gna s ASP 58 N 3.43 0.64 0.57 -4.21 -1.08 -1.26 -5.04 116.67 109.72 2gna s ASP 58 Ca 0.47 -0.09 0.27 0.00 -0.52 0.00 0.00 52.55 52.68 2gna s ASP 58 Cb -0.00 -0.21 1.59 0.00 -1.46 0.00 0.00 42.92 42.84 2gna s ASP 58 CO 0.03 -0.01 2.11 -0.65 0.52 0.00 0.00 175.17 177.18 2gna h PRO 59 N 6.63 0.00 0.00 4.34 0.11 -2.01 -2.29 132.00 138.78 2gna h PRO 59 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 2gna h PRO 59 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2gna h PRO 59 CO 0.49 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.82 2gna n ARG 60 N -3.98 0.10 -2.87 1.05 5.12 -1.26 -4.80 116.66 110.02 2gna n ARG 60 Ca 0.01 0.30 -0.28 0.00 -1.93 0.00 0.00 57.85 55.96 2gna n ARG 60 Cb 0.30 -1.67 -0.01 0.00 -1.16 0.00 0.00 32.46 29.91 2gna n ARG 60 CO 0.00 0.00 0.00 -1.64 -1.93 0.00 0.00 177.63 174.06 2gna s MET 61 N -3.14 3.61 -0.23 5.56 -1.94 -0.86 -0.01 119.30 122.30 2gna s MET 61 Ca 0.07 0.19 -0.12 0.00 -1.71 0.00 0.00 55.69 54.12 2gna s MET 61 Cb 0.10 -2.45 0.08 0.00 2.01 0.00 0.00 34.83 34.57 2gna s MET 61 CO 0.36 -0.07 0.54 0.50 -0.01 0.00 0.00 175.02 176.34 2gna s ARG 62 N -4.29 0.53 -0.21 2.03 3.52 -0.86 -4.87 118.95 114.80 2gna s ARG 62 Ca 0.47 1.04 -0.05 0.00 -0.13 0.00 0.00 55.73 57.06 2gna s ARG 62 Cb -0.10 0.15 -0.02 0.00 -1.56 0.00 0.00 34.95 33.41 2gna s ARG 62 CO 0.38 -0.17 0.00 -0.06 -0.81 0.00 0.00 175.30 174.65 2gna s PHE 63 N 1.73 3.03 -0.16 5.12 0.08 -1.26 -1.89 117.98 124.63 2gna s PHE 63 Ca -0.09 -0.53 -0.02 0.00 0.12 0.00 0.00 56.93 56.41 2gna s PHE 63 Cb -0.08 -2.11 -0.01 0.00 -0.57 0.00 0.00 43.02 40.25 2gna s PHE 63 CO -0.16 -0.31 -0.09 -0.06 -0.10 0.00 0.00 175.22 174.50 2gna s PHE 64 N 1.17 2.89 -0.19 0.36 0.08 -0.24 -4.99 117.98 117.06 2gna s PHE 64 Ca 0.03 -0.71 -0.21 0.00 0.12 0.00 0.00 56.93 56.16 2gna s PHE 64 Cb -0.14 -1.94 -0.03 0.00 -0.57 0.00 0.00 43.02 40.34 2gna s PHE 64 CO 0.01 -0.30 0.64 0.42 -0.10 0.00 0.00 175.22 175.89 2gna s ILE 65 N 0.70 5.02 -0.03 0.64 -1.09 -1.26 -2.98 121.20 122.20 2gna s ILE 65 Ca -0.05 1.22 -0.30 0.00 -2.23 0.00 0.00 60.65 59.29 2gna s ILE 65 Cb -0.15 -3.96 0.11 0.00 -1.58 0.00 0.00 42.46 36.88 2gna s ILE 65 CO 0.02 0.12 1.08 -0.83 -1.23 0.00 0.00 174.94 174.10 2gna s GLY 66 N 1.16 -0.36 -0.00 6.18 0.00 -0.11 -4.94 107.32 109.25 2gna s GLY 66 Ca 0.30 0.94 0.07 0.00 0.00 0.00 0.00 44.72 46.03 2gna s GLY 66 CO 0.11 0.28 -0.22 -0.35 0.00 0.00 0.00 173.10 172.92 2gna s ASP 67 N -2.59 3.46 0.00 1.64 -1.08 -1.26 -2.82 116.67 114.03 2gna s ASP 67 Ca 0.10 -0.42 0.18 0.00 -0.52 0.00 0.00 52.55 51.89 2gna s ASP 67 Cb 0.00 -0.51 0.82 0.00 -1.46 0.00 0.00 42.92 41.77 2gna s ASP 67 CO -0.04 0.30 1.58 1.33 0.52 0.00 0.00 175.17 178.86 2gna n VAL 68 N 2.10 0.67 1.07 1.11 0.24 -1.26 -1.88 118.33 120.38 2gna n VAL 68 Ca -0.16 0.17 0.14 0.00 -2.04 0.00 0.00 64.34 62.44 2gna n VAL 68 Cb 0.52 -0.86 0.54 0.00 -1.47 0.00 0.00 33.84 32.57 2gna n VAL 68 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2gna n ARG 69 N -1.44 0.10 -3.43 7.34 1.74 -1.26 -4.29 116.66 115.42 2gna n ARG 69 Ca 0.06 -0.02 -0.44 0.00 -0.77 0.00 0.00 57.85 56.67 2gna n ARG 69 Cb 0.20 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.08 2gna n ARG 69 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2gna s ASP 70 N -2.91 6.09 0.29 0.55 -1.08 -0.79 -4.96 116.67 113.86 2gna s ASP 70 Ca 0.16 -2.13 -0.03 0.00 -0.52 0.00 0.00 52.55 50.03 2gna s ASP 70 Cb 0.19 -2.12 0.40 0.00 -1.46 0.00 0.00 42.92 39.93 2gna s ASP 70 CO 0.56 -0.70 1.93 0.25 0.52 0.00 0.00 175.17 177.74 2gna h LEU 71 N 8.33 0.96 -0.33 -1.34 5.85 -1.84 -2.42 115.31 124.51 2gna h LEU 71 Ca -0.15 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.49 2gna h LEU 71 Cb 1.06 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 2gna h LEU 71 CO 0.89 0.73 0.09 -0.08 -0.34 0.00 0.00 178.44 179.73 2gna h GLU 72 N 1.11 0.53 -0.70 1.25 4.81 -1.96 -1.78 114.58 117.84 2gna h GLU 72 Ca 0.29 -0.12 0.02 0.00 -0.13 0.00 0.00 59.36 59.42 2gna h GLU 72 Cb -0.06 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.21 2gna h GLU 72 CO -0.06 0.57 0.45 -0.09 -0.73 0.00 0.00 179.01 179.15 2gna h ARG 73 N 0.38 0.86 -0.51 1.92 9.65 -1.84 -2.58 114.38 122.26 2gna h ARG 73 Ca 0.11 -0.05 -0.06 0.00 -1.10 0.00 0.00 59.98 58.88 2gna h ARG 73 Cb 0.28 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 28.64 2gna h ARG 73 CO -0.00 0.57 0.10 -0.07 2.80 0.00 0.00 179.97 183.37 2gna h LEU 74 N 0.89 0.80 -1.02 3.80 3.38 -1.32 -0.25 115.31 121.59 2gna h LEU 74 Ca 0.27 -0.25 0.16 0.00 0.09 0.00 0.00 57.88 58.15 2gna h LEU 74 Cb -0.03 -0.21 -0.10 0.00 0.09 0.00 0.00 40.66 40.41 2gna h LEU 74 CO -0.09 0.84 0.62 0.78 0.09 0.00 0.00 178.44 180.68 2gna h ASN 75 N 0.72 0.85 -0.02 -0.43 -0.26 -0.95 0.94 115.58 116.44 2gna h ASN 75 Ca 0.16 0.07 -0.07 0.00 -0.56 0.00 0.00 56.30 55.90 2gna h ASN 75 Cb 0.37 -0.09 0.01 0.00 -1.06 0.00 0.00 38.32 37.54 2gna h ASN 75 CO 0.01 0.38 -0.28 0.22 -1.06 0.00 0.00 177.43 176.70 2gna h TYR 76 N 0.87 0.31 -0.26 1.19 3.20 -1.19 -3.28 116.97 117.81 2gna h TYR 76 Ca 0.54 -0.16 -0.04 0.00 3.14 0.00 0.00 58.73 62.21 2gna h TYR 76 Cb 0.70 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.92 2gna h TYR 76 CO -0.00 0.93 -0.03 0.00 -1.64 0.00 0.00 178.16 177.42 2gna h ALA 77 N 0.31 1.47 -0.03 1.82 0.00 -0.37 -2.80 119.26 119.66 2gna h ALA 77 Ca -0.03 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2gna h ALA 77 Cb 1.00 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2gna h ALA 77 CO 0.06 0.38 0.00 1.28 0.00 0.00 0.00 179.25 180.96 2gna n LEU 78 N -4.30 0.49 -4.70 0.00 4.77 0.26 -4.86 117.00 108.67 2gna n LEU 78 Ca 0.01 -0.19 -0.42 0.00 -0.03 0.00 0.00 56.01 55.37 2gna n LEU 78 Cb 0.23 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.27 2gna n LEU 78 CO 0.38 0.10 1.31 -0.70 -1.33 0.00 0.00 177.39 177.15 2gna s GLU 79 N -1.96 4.20 -0.01 3.23 -6.30 -1.06 -2.23 118.70 114.57 2gna s GLU 79 Ca 0.35 2.36 0.00 0.00 -2.50 0.00 0.00 54.97 55.18 2gna s GLU 79 Cb 0.17 -3.47 0.00 0.00 0.00 0.00 0.00 34.13 30.83 2gna s GLU 79 CO 0.28 -0.71 0.00 0.41 0.02 0.00 0.00 175.26 175.26 2gna n GLY 80 N 3.94 0.48 3.82 -1.50 0.00 -1.26 -5.03 105.19 105.64 2gna n GLY 80 Ca 0.15 -0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 2gna n GLY 80 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gna s VAL 81 N -1.97 4.84 -0.23 1.61 1.01 -0.95 -4.70 120.40 120.02 2gna s VAL 81 Ca 0.00 1.06 0.05 0.00 0.00 0.00 0.00 61.98 63.09 2gna s VAL 81 Cb 0.00 -3.82 -0.20 0.00 0.00 0.00 0.00 36.38 32.36 2gna s VAL 81 CO 0.00 0.53 -0.08 0.47 0.00 0.00 0.00 175.10 176.02 2gna n ASP 82 N 1.65 1.50 -4.01 3.32 9.92 -0.34 -4.27 116.55 124.32 2gna n ASP 82 Ca -0.11 -0.06 -0.18 0.00 -0.53 0.00 0.00 54.79 53.91 2gna n ASP 82 Cb 0.51 -0.11 -0.15 0.00 -0.64 0.00 0.00 41.12 40.74 2gna n ASP 82 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2gna s ILE 83 N -2.52 0.64 -0.08 0.53 1.01 -0.83 -0.32 121.20 119.63 2gna s ILE 83 Ca -0.27 -0.35 0.02 0.00 0.00 0.00 0.00 60.65 60.05 2gna s ILE 83 Cb 0.08 -0.54 0.01 0.00 0.01 0.00 0.00 42.46 42.02 2gna s ILE 83 CO 0.67 0.18 -0.14 0.00 0.00 0.00 0.00 174.94 175.66 2gna s ILE 85 N 0.73 3.28 -0.49 0.00 -1.09 0.17 -1.17 121.20 122.63 2gna s ILE 85 Ca -0.13 -0.55 -0.14 0.00 -2.23 0.00 0.00 60.65 57.61 2gna s ILE 85 Cb -0.16 -2.50 0.10 0.00 -1.58 0.00 0.00 42.46 38.32 2gna s ILE 85 CO 0.03 0.41 0.41 -2.28 -1.23 0.00 0.00 174.94 172.28 2gna s HIS 86 N 1.46 3.28 0.00 3.97 5.65 0.17 -1.23 115.29 128.59 2gna s HIS 86 Ca 0.05 -1.26 0.00 0.00 0.25 0.00 0.00 55.06 54.10 2gna s HIS 86 Cb -0.14 -3.42 0.00 0.00 -1.18 0.00 0.00 32.58 27.83 2gna s HIS 86 CO -0.04 -0.91 0.69 0.00 -0.65 0.00 0.00 174.74 173.83 2gna n ALA 87 N 5.15 2.17 -1.90 1.58 0.00 -0.92 -1.32 120.51 125.26 2gna n ALA 87 Ca -0.12 -0.69 -0.41 0.00 0.00 0.00 0.00 53.44 52.22 2gna n ALA 87 Cb 0.42 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.83 2gna n ALA 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gna s ALA 88 N -0.42 3.46 -0.10 0.00 0.00 -1.01 -4.68 121.76 119.00 2gna s ALA 88 Ca 0.00 1.03 -0.33 0.00 0.00 0.00 0.00 51.96 52.66 2gna s ALA 88 Cb 0.00 -3.42 0.14 0.00 0.00 0.00 0.00 23.12 19.85 2gna s ALA 88 CO 0.00 -0.40 1.38 0.00 0.00 0.00 0.00 175.76 176.74 2gna s ALA 89 N -0.55 -2.38 -0.30 0.00 0.00 -1.26 -4.89 121.76 112.38 2gna s ALA 89 Ca 0.50 1.04 -0.01 0.00 0.00 0.00 0.00 51.96 53.50 2gna s ALA 89 Cb -0.35 0.17 0.06 0.00 0.00 0.00 0.00 23.12 23.00 2gna s ALA 89 CO 0.41 -0.97 -0.01 -0.51 0.00 0.00 0.00 175.76 174.68 2gna s LEU 90 N -2.83 3.91 0.00 0.00 1.43 -1.26 -4.99 118.68 114.93 2gna s LEU 90 Ca 0.14 -1.35 0.09 0.00 -1.03 0.00 0.00 54.13 51.99 2gna s LEU 90 Cb 0.06 -1.69 0.00 0.00 0.03 0.00 0.00 46.19 44.59 2gna s LEU 90 CO -0.05 -0.26 0.62 2.29 0.23 0.00 0.00 176.35 179.17 2gna n LYS 91 N 4.58 1.98 -2.24 1.70 2.85 -1.26 -4.93 118.16 120.85 2gna n LYS 91 Ca -0.12 -0.62 -0.40 0.00 -1.05 0.00 0.00 58.31 56.12 2gna n LYS 91 Cb 0.43 -1.06 -0.03 0.00 -0.65 0.00 0.00 35.03 33.72 2gna n LYS 91 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 2gna s HIS 92 N -1.23 2.00 0.17 5.58 2.46 -1.26 -4.89 115.29 118.12 2gna s HIS 92 Ca 0.08 0.53 -0.19 0.00 0.47 0.00 0.00 55.06 55.95 2gna s HIS 92 Cb 0.07 -4.28 0.11 0.00 -0.13 0.00 0.00 32.58 28.34 2gna s HIS 92 CO 0.22 -2.21 1.63 0.28 -2.47 0.00 0.00 174.74 172.19 2gna h VAL 93 N 6.56 0.40 -0.17 0.89 2.07 -1.99 -0.19 116.25 123.83 2gna h VAL 93 Ca -0.27 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 2gna h VAL 93 Cb 1.12 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 2gna h VAL 93 CO 1.19 0.00 0.10 -0.65 0.02 0.00 0.00 177.57 178.23 2gna h PRO 94 N -0.12 0.24 0.00 1.57 0.11 -1.98 -1.76 132.00 130.05 2gna h PRO 94 Ca 0.20 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.28 2gna h PRO 94 Cb 0.44 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.50 2gna h PRO 94 CO -0.50 0.22 -0.01 0.82 -0.21 0.00 0.00 178.00 178.33 2gna h ILE 95 N 0.19 0.65 -0.01 4.15 2.04 -1.89 -0.18 117.51 122.46 2gna h ILE 95 Ca 0.06 -0.04 -0.16 0.00 1.00 0.00 0.00 64.86 65.72 2gna h ILE 95 Cb 0.05 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 2gna h ILE 95 CO -0.01 0.01 -0.72 0.00 0.00 0.00 0.00 178.15 177.43 2gna h ALA 96 N 1.99 0.79 -0.05 1.87 0.00 -0.37 0.82 119.26 124.31 2gna h ALA 96 Ca -0.00 -0.64 -0.13 0.00 0.00 0.00 0.00 54.91 54.14 2gna h ALA 96 Cb 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2gna h ALA 96 CO 0.00 0.87 -0.57 0.93 0.00 0.00 0.00 179.25 180.48 2gna h GLU 97 N 0.04 0.14 0.00 0.00 4.39 -0.20 -1.71 114.58 117.24 2gna h GLU 97 Ca -0.01 -0.09 -0.14 0.00 0.34 0.00 0.00 59.36 59.45 2gna h GLU 97 Cb 1.27 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.91 2gna h GLU 97 CO 0.10 0.68 -1.25 1.88 -1.16 0.00 0.00 179.01 179.25 2gna h TYR 98 N 0.11 0.00 -2.11 4.33 0.05 -1.29 -3.37 116.97 114.69 2gna h TYR 98 Ca -0.00 0.00 -0.56 0.00 0.05 0.00 0.00 58.73 58.21 2gna h TYR 98 Cb 1.04 0.00 -0.42 0.00 1.01 0.00 0.00 36.73 38.36 2gna h TYR 98 CO 0.01 0.50 -0.77 0.09 -1.05 0.00 0.00 178.16 176.94 2gna n ASN 99 N -2.91 3.73 -0.33 3.88 3.02 0.27 -4.95 115.26 117.97 2gna n ASN 99 Ca -0.07 -3.53 0.06 0.00 -0.03 0.00 0.00 54.58 51.00 2gna n ASN 99 Cb 0.79 -0.56 0.21 0.00 -0.61 0.00 0.00 39.78 39.62 2gna n ASN 99 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2gna h PRO 100 N 2.94 0.85 -0.04 3.52 0.13 -1.49 -2.39 132.00 135.53 2gna h PRO 100 Ca 0.14 -0.05 -0.10 0.00 -0.87 0.00 0.00 66.00 65.11 2gna h PRO 100 Cb 0.66 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 31.58 2gna h PRO 100 CO 0.75 0.56 -0.45 1.25 -0.23 0.00 0.00 178.00 179.88 2gna h LEU 101 N 0.88 0.09 -0.37 1.56 5.85 -1.92 -2.15 115.31 119.25 2gna h LEU 101 Ca 0.46 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 59.06 2gna h LEU 101 Cb 0.47 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 2gna h LEU 101 CO -0.27 0.54 -0.09 -0.33 -0.34 0.00 0.00 178.44 177.94 2gna h GLU 102 N 0.07 0.72 -0.68 1.25 4.39 -1.82 -0.13 114.58 118.38 2gna h GLU 102 Ca 0.00 -0.28 -0.04 0.00 0.34 0.00 0.00 59.36 59.39 2gna h GLU 102 Cb 0.83 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.41 2gna h GLU 102 CO 0.06 0.87 0.27 0.00 -1.16 0.00 0.00 179.01 179.05 2gna h ILE 104 N 0.96 1.22 -0.13 0.00 2.04 -1.23 0.20 117.51 120.58 2gna h ILE 104 Ca 0.23 -0.71 -0.00 0.00 1.00 0.00 0.00 64.86 65.37 2gna h ILE 104 Cb 0.21 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 2gna h ILE 104 CO -0.02 0.27 0.07 0.11 0.00 0.00 0.00 178.15 178.58 2gna h LYS 105 N 0.73 0.19 -0.06 2.37 1.57 -0.73 -1.11 116.57 119.53 2gna h LYS 105 Ca 0.18 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.90 2gna h LYS 105 Cb 0.22 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 2gna h LYS 105 CO -0.01 0.23 -0.09 1.15 -0.57 0.00 0.00 179.45 180.16 2gna h THR 106 N 0.10 1.41 0.12 -0.16 2.02 -1.24 -1.48 112.91 113.68 2gna h THR 106 Ca 0.05 -1.36 -0.24 0.00 0.77 0.00 0.00 66.41 65.63 2gna h THR 106 Cb 0.10 2.18 0.02 0.00 -1.74 0.00 0.00 68.15 68.71 2gna h THR 106 CO -0.01 0.37 -1.00 0.78 0.37 0.00 0.00 175.52 176.04 2gna h ASN 107 N -0.32 0.67 0.00 4.18 2.35 -0.65 -3.03 115.58 118.77 2gna h ASN 107 Ca 0.00 -0.87 -0.05 0.00 -0.55 0.00 0.00 56.30 54.83 2gna h ASN 107 Cb 0.65 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.80 2gna h ASN 107 CO 0.02 1.47 -0.65 0.40 -1.65 0.00 0.00 177.43 177.02 2gna h ILE 108 N -0.04 0.21 -0.23 2.81 2.04 -1.37 -3.17 117.51 117.76 2gna h ILE 108 Ca -0.16 -1.27 -0.04 0.00 1.00 0.00 0.00 64.86 64.39 2gna h ILE 108 Cb 1.74 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 38.31 2gna h ILE 108 CO 0.19 0.07 -0.04 0.24 0.00 0.00 0.00 178.15 178.62 2gna h MET 109 N -1.00 0.35 -0.54 2.37 2.86 -1.22 -1.65 114.93 116.10 2gna h MET 109 Ca -0.08 -0.07 -0.05 0.00 -2.06 0.00 0.00 59.70 57.45 2gna h MET 109 Cb 0.67 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.25 2gna h MET 109 CO -0.05 0.41 0.14 0.78 1.06 0.00 0.00 176.91 179.26 2gna h GLY 110 N 0.71 0.88 0.83 8.32 0.00 -1.14 -0.68 103.07 111.99 2gna h GLY 110 Ca 0.08 -0.49 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 2gna h GLY 110 CO 0.01 0.46 0.02 0.00 0.00 0.00 0.00 176.54 177.03 2gna h ALA 111 N 1.37 0.26 -0.80 3.60 0.00 -1.30 -1.38 119.26 121.01 2gna h ALA 111 Ca 0.18 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2gna h ALA 111 Cb 0.27 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 2gna h ALA 111 CO -0.00 -0.06 0.51 1.03 0.00 0.00 0.00 179.25 180.73 2gna h SER 112 N 0.10 0.85 -0.25 0.00 0.87 -0.95 -0.60 113.55 113.57 2gna h SER 112 Ca 0.06 -0.01 -0.10 0.00 -1.23 0.00 0.00 61.79 60.51 2gna h SER 112 Cb 0.34 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.11 2gna h SER 112 CO 0.01 0.59 -0.23 0.78 -0.53 0.00 0.00 176.83 177.45 2gna h ASN 113 N 1.00 0.64 -0.29 6.23 2.35 -1.03 -0.97 115.58 123.51 2gna h ASN 113 Ca 0.32 -0.46 0.03 0.00 -0.55 0.00 0.00 56.30 55.64 2gna h ASN 113 Cb -0.00 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.15 2gna h ASN 113 CO -0.11 0.97 0.09 0.58 -1.65 0.00 0.00 177.43 177.32 2gna h VAL 114 N 0.32 0.91 -0.20 2.81 2.07 -1.04 0.56 116.25 121.67 2gna h VAL 114 Ca 0.04 -0.07 0.03 0.00 0.82 0.00 0.00 66.70 67.52 2gna h VAL 114 Cb 0.78 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 2gna h VAL 114 CO 0.06 0.04 0.01 0.40 0.02 0.00 0.00 177.57 178.09 2gna h ILE 115 N 0.22 0.86 0.13 4.57 2.04 -1.01 -0.65 117.51 123.68 2gna h ILE 115 Ca 0.13 -0.03 0.02 0.00 1.00 0.00 0.00 64.86 65.98 2gna h ILE 115 Cb 0.11 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 2gna h ILE 115 CO -0.14 0.01 -0.27 -1.13 0.00 0.00 0.00 178.15 176.62 2gna h ASN 116 N 0.07 -0.77 -0.11 1.72 -0.73 -0.73 -1.52 115.58 113.51 2gna h ASN 116 Ca 0.10 0.09 0.00 0.00 1.87 0.00 0.00 56.30 58.36 2gna h ASN 116 Cb 0.12 0.29 -0.01 0.00 0.27 0.00 0.00 38.32 38.99 2gna h ASN 116 CO -0.16 -0.36 0.08 0.00 -0.37 0.00 0.00 177.43 176.62 2gna h ALA 117 N 0.22 1.93 -0.19 1.57 0.00 -0.61 -1.62 119.26 120.56 2gna h ALA 117 Ca 0.03 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 2gna h ALA 117 Cb 0.51 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.26 2gna h ALA 117 CO -0.15 0.07 -0.65 0.00 0.00 0.00 0.00 179.25 178.52 2gna h LEU 119 N 0.52 0.57 -0.83 0.00 3.38 -0.86 -0.86 115.31 117.23 2gna h LEU 119 Ca -0.03 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.65 2gna h LEU 119 Cb 1.27 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 2gna h LEU 119 CO 0.14 0.67 0.33 0.50 0.09 0.00 0.00 178.44 180.17 2gna h LYS 120 N 0.45 1.19 -0.15 1.13 3.64 -1.30 -2.52 116.57 119.01 2gna h LYS 120 Ca 0.11 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 2gna h LYS 120 Cb 0.33 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2gna h LYS 120 CO 0.00 0.96 0.00 0.09 -2.27 0.00 0.00 179.45 178.23 2gna n ASN 121 N -4.28 1.44 -3.62 4.20 3.02 -0.70 -4.95 115.26 110.38 2gna n ASN 121 Ca 0.07 -1.67 -0.20 0.00 -0.03 0.00 0.00 54.58 52.74 2gna n ASN 121 Cb 0.18 -0.09 0.05 0.00 -0.61 0.00 0.00 39.78 39.31 2gna n ASN 121 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2gna n ALA 122 N 0.17 -2.06 -1.77 5.41 0.00 -0.53 -4.64 120.51 117.09 2gna n ALA 122 Ca 0.16 -0.13 -0.36 0.00 0.00 0.00 0.00 53.44 53.10 2gna n ALA 122 Cb 0.29 -2.32 0.01 0.00 0.00 0.00 0.00 19.45 17.43 2gna n ALA 122 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2gna s ILE 123 N -3.58 2.99 -0.11 0.00 1.09 -0.44 -4.93 121.20 116.21 2gna s ILE 123 Ca 0.04 0.67 -0.23 0.00 -1.10 0.00 0.00 60.65 60.02 2gna s ILE 123 Cb -0.01 -3.30 -0.27 0.00 -1.06 0.00 0.00 42.46 37.82 2gna s ILE 123 CO 0.79 -0.09 0.69 0.28 -0.10 0.00 0.00 174.94 176.52 2gna h SER 124 N 1.45 0.22 -4.25 3.58 0.02 -0.90 -3.38 113.55 110.29 2gna h SER 124 Ca -0.50 -0.89 -0.32 0.00 -0.84 0.00 0.00 61.79 59.24 2gna h SER 124 Cb 1.27 -0.07 -0.26 0.00 0.14 0.00 0.00 62.40 63.48 2gna h SER 124 CO 0.58 1.30 -0.75 -1.10 -1.14 0.00 0.00 176.83 175.72 2gna s GLN 125 N -2.35 0.51 -0.02 3.45 -0.21 -1.02 -1.15 119.66 118.88 2gna s GLN 125 Ca -0.19 -0.44 0.00 0.00 0.02 0.00 0.00 55.36 54.76 2gna s GLN 125 Cb 0.01 -0.42 0.01 0.00 1.00 0.00 0.00 33.01 33.61 2gna s GLN 125 CO 0.73 0.10 -0.01 0.08 -2.12 0.00 0.00 175.29 174.08 2gna s VAL 126 N -0.63 0.14 -0.09 1.09 1.01 0.11 -1.32 120.40 120.71 2gna s VAL 126 Ca -0.02 0.02 -0.00 0.00 0.00 0.00 0.00 61.98 61.98 2gna s VAL 126 Cb -0.05 -0.19 0.02 0.00 0.00 0.00 0.00 36.38 36.16 2gna s VAL 126 CO 0.00 0.09 -0.05 -0.63 0.00 0.00 0.00 175.10 174.51 2gna s ILE 127 N 0.52 0.77 -0.11 2.22 1.01 -0.32 -0.74 121.20 124.56 2gna s ILE 127 Ca -0.05 -0.16 -0.05 0.00 0.00 0.00 0.00 60.65 60.40 2gna s ILE 127 Cb -0.08 -0.82 -0.04 0.00 0.01 0.00 0.00 42.46 41.54 2gna s ILE 127 CO -0.01 0.31 0.08 0.00 0.00 0.00 0.00 174.94 175.32 2gna s ALA 128 N 1.59 3.61 -0.20 9.38 0.00 -0.80 -0.66 121.76 134.68 2gna s ALA 128 Ca 0.01 -0.71 -0.24 0.00 0.00 0.00 0.00 51.96 51.02 2gna s ALA 128 Cb -0.13 -1.76 -0.01 0.00 0.00 0.00 0.00 23.12 21.22 2gna s ALA 128 CO -0.05 0.59 0.78 -0.51 0.00 0.00 0.00 175.76 176.57 2gna s LEU 129 N -0.92 4.13 0.00 0.00 1.43 -0.43 -1.67 118.68 121.22 2gna s LEU 129 Ca 0.14 1.03 0.00 0.00 -1.03 0.00 0.00 54.13 54.27 2gna s LEU 129 Cb -0.12 -3.13 0.00 0.00 0.03 0.00 0.00 46.19 42.98 2gna s LEU 129 CO 0.03 -0.41 0.00 -0.24 0.23 0.00 0.00 176.35 175.96 2gna n SER 130 N 5.46 0.27 -3.81 2.29 2.88 0.07 -4.94 113.62 115.85 2gna n SER 130 Ca 0.03 -0.81 -0.11 0.00 -1.33 0.00 0.00 58.87 56.66 2gna n SER 130 Cb 0.49 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.87 2gna n SER 130 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2gna s THR 131 N 0.95 0.10 -0.33 2.46 -1.32 -1.26 -4.27 115.64 111.96 2gna s THR 131 Ca 0.00 -0.82 0.26 0.00 -1.21 0.00 0.00 61.69 59.91 2gna s THR 131 Cb 0.00 -0.96 0.27 0.00 -1.51 0.00 0.00 72.50 70.31 2gna s THR 131 CO 0.00 -0.45 1.77 -2.24 -2.21 0.00 0.00 174.62 171.48 2gna h ASP 132 N 3.29 0.00 0.47 8.08 2.03 -1.83 -1.52 116.42 126.94 2gna h ASP 132 Ca -0.32 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.98 2gna h ASP 132 Cb 1.20 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.70 2gna h ASP 132 CO 0.48 0.00 0.00 0.29 -1.03 0.00 0.00 179.24 178.98 2gna n LYS 133 N -2.40 0.29 0.00 4.15 5.02 -1.26 -2.47 118.16 121.48 2gna n LYS 133 Ca 0.01 0.08 0.12 0.00 -2.02 0.00 0.00 58.31 56.50 2gna n LYS 133 Cb 0.22 -1.50 0.27 0.00 -0.02 0.00 0.00 35.03 34.01 2gna n LYS 133 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2gna n ALA 134 N -1.31 3.45 -2.67 7.82 0.00 -0.57 -4.17 120.51 123.05 2gna n ALA 134 Ca 0.10 -0.38 -0.40 0.00 0.00 0.00 0.00 53.44 52.76 2gna n ALA 134 Cb 0.19 -1.11 -0.06 0.00 0.00 0.00 0.00 19.45 18.47 2gna n ALA 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gna s ALA 135 N -2.84 3.52 -1.47 0.00 0.00 -1.03 -4.08 121.76 115.86 2gna s ALA 135 Ca 0.15 -0.23 -0.04 0.00 0.00 0.00 0.00 51.96 51.85 2gna s ALA 135 Cb 0.18 -2.94 0.00 0.00 0.00 0.00 0.00 23.12 20.36 2gna s ALA 135 CO 0.65 -0.46 0.21 0.09 0.00 0.00 0.00 175.76 176.24 2gna n ASN 136 N 4.80 -0.02 -4.71 0.00 3.02 -1.26 -4.68 115.26 112.42 2gna n ASN 136 Ca -0.02 -1.19 -0.35 0.00 -0.03 0.00 0.00 54.58 52.99 2gna n ASN 136 Cb 0.50 -2.09 0.11 0.00 -0.61 0.00 0.00 39.78 37.68 2gna n ASN 136 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2gna n PRO 137 N -4.56 0.52 0.00 3.52 -0.04 -1.26 -4.97 135.00 128.22 2gna n PRO 137 Ca -0.30 0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 2gna n PRO 137 Cb 0.68 -2.48 0.00 0.00 -0.04 0.00 0.00 33.50 31.67 2gna n PRO 137 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 2gna n ILE 138 N -2.80 0.00 -4.13 0.52 -6.64 -1.26 -4.94 119.36 100.11 2gna n ILE 138 Ca 0.14 -0.07 -0.26 0.00 -1.77 0.00 0.00 62.75 60.80 2gna n ILE 138 Cb 0.49 0.45 -0.06 0.00 -1.44 0.00 0.00 39.64 39.08 2gna n ILE 138 CO 0.00 0.00 0.00 0.54 -1.77 0.00 0.00 176.55 175.32 2gna s ASN 139 N -0.93 5.24 0.16 7.28 2.20 -1.26 -5.03 114.94 122.59 2gna s ASN 139 Ca 0.00 -0.23 -0.16 0.00 -0.94 0.00 0.00 52.86 51.53 2gna s ASN 139 Cb 0.00 -1.28 0.09 0.00 -2.00 0.00 0.00 41.25 38.06 2gna s ASN 139 CO 0.00 0.08 1.72 0.25 -2.94 0.00 0.00 177.10 176.21 2gna h LEU 140 N 2.54 -0.03 -0.49 3.54 5.85 -1.92 -1.91 115.31 122.89 2gna h LEU 140 Ca -0.47 0.07 0.10 0.00 0.84 0.00 0.00 57.88 58.41 2gna h LEU 140 Cb 1.20 0.10 -0.10 0.00 0.37 0.00 0.00 40.66 42.23 2gna h LEU 140 CO 0.61 0.02 -0.15 0.22 -0.34 0.00 0.00 178.44 178.80 2gna h TYR 141 N 0.17 -0.34 -0.90 1.25 3.20 -1.88 -0.13 116.97 118.34 2gna h TYR 141 Ca 0.18 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 2gna h TYR 141 Cb 0.22 0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.67 2gna h TYR 141 CO -0.21 -0.24 0.50 0.78 -1.64 0.00 0.00 178.16 177.36 2gna h GLY 142 N -0.03 1.33 1.02 1.82 0.00 -1.64 -2.10 103.07 103.45 2gna h GLY 142 Ca 0.23 -0.59 -0.03 0.00 0.00 0.00 0.00 47.33 46.95 2gna h GLY 142 CO -0.52 0.56 0.36 0.00 0.00 0.00 0.00 176.54 176.95 2gna h ALA 143 N 1.31 0.96 -0.46 3.60 0.00 -0.42 -1.31 119.26 122.93 2gna h ALA 143 Ca 0.32 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 2gna h ALA 143 Cb 0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2gna h ALA 143 CO -0.05 0.52 -0.01 1.79 0.00 0.00 0.00 179.25 181.50 2gna h THR 144 N 1.05 1.24 -0.32 0.00 1.35 -0.56 -1.94 112.91 113.73 2gna h THR 144 Ca 0.26 -0.99 -0.13 0.00 -0.55 0.00 0.00 66.41 64.99 2gna h THR 144 Cb 0.11 0.89 -0.01 0.00 -1.73 0.00 0.00 68.15 67.42 2gna h THR 144 CO -0.03 0.35 -0.34 0.11 -0.25 0.00 0.00 175.52 175.36 2gna h LYS 145 N 0.71 0.71 -0.77 4.72 1.79 -0.99 -0.06 116.57 122.68 2gna h LYS 145 Ca 0.14 -0.34 -0.03 0.00 -2.18 0.00 0.00 60.65 58.24 2gna h LYS 145 Cb 0.45 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 31.05 2gna h LYS 145 CO 0.02 0.95 0.35 1.25 -1.08 0.00 0.00 179.45 180.94 2gna h LEU 146 N 0.60 1.03 -0.59 2.94 5.85 -0.90 0.35 115.31 124.59 2gna h LEU 146 Ca 0.06 -0.15 -0.06 0.00 0.84 0.00 0.00 57.88 58.58 2gna h LEU 146 Cb 0.86 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 2gna h LEU 146 CO 0.07 0.89 0.15 0.00 -0.34 0.00 0.00 178.44 179.21 2gna h SER 148 N 0.85 -1.00 -0.76 0.00 0.87 -0.19 -0.69 113.55 112.64 2gna h SER 148 Ca 0.19 0.07 0.15 0.00 -1.23 0.00 0.00 61.79 60.96 2gna h SER 148 Cb 0.34 0.32 -0.10 0.00 -0.44 0.00 0.00 62.40 62.52 2gna h SER 148 CO 0.00 -0.55 0.29 0.44 -0.53 0.00 0.00 176.83 176.48 2gna h ASP 149 N -0.85 0.25 -0.56 6.23 3.45 -0.18 -0.41 116.42 124.34 2gna h ASP 149 Ca -0.05 0.11 -0.00 0.00 0.43 0.00 0.00 57.03 57.52 2gna h ASP 149 Cb 0.73 0.10 -0.03 0.00 -0.56 0.00 0.00 39.33 39.57 2gna h ASP 149 CO -0.00 0.08 0.35 0.11 -1.57 0.00 0.00 179.24 178.21 2gna h LYS 150 N 0.42 0.76 -0.20 3.56 1.79 -0.87 -0.69 116.57 121.35 2gna h LYS 150 Ca 0.42 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.83 2gna h LYS 150 Cb 0.65 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 31.13 2gna h LYS 150 CO -0.42 0.54 0.13 -0.07 -1.08 0.00 0.00 179.45 178.54 2gna h LEU 151 N 0.76 0.23 -0.45 2.94 3.38 0.43 -1.06 115.31 121.53 2gna h LEU 151 Ca 0.20 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2gna h LEU 151 Cb -0.04 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2gna h LEU 151 CO -0.04 0.18 0.30 -0.26 0.09 0.00 0.00 178.44 178.71 2gna h PHE 152 N 0.25 0.57 -0.63 1.13 0.04 -0.92 0.19 116.94 117.57 2gna h PHE 152 Ca 0.07 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.84 2gna h PHE 152 Cb -0.01 -0.19 -0.03 0.00 2.20 0.00 0.00 35.95 37.92 2gna h PHE 152 CO -0.06 0.36 0.35 0.28 -0.60 0.00 0.00 178.31 178.64 2gna h VAL 153 N 0.61 1.20 -0.04 -0.55 2.07 -1.00 -2.75 116.25 115.79 2gna h VAL 153 Ca 0.17 -0.49 -0.07 0.00 0.82 0.00 0.00 66.70 67.13 2gna h VAL 153 Cb -0.07 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.07 2gna h VAL 153 CO -0.04 0.21 -0.29 -1.28 0.02 0.00 0.00 177.57 176.20 2gna h SER 154 N 0.85 0.07 0.00 0.57 0.87 -0.76 -3.04 113.55 112.12 2gna h SER 154 Ca 0.22 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 2gna h SER 154 Cb 0.03 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2gna h SER 154 CO -0.04 0.36 0.09 0.00 -0.53 0.00 0.00 176.83 176.72 2gna h ALA 155 N 1.64 1.07 0.00 6.23 0.00 -0.65 -2.41 119.26 125.14 2gna h ALA 155 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2gna h ALA 155 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2gna h ALA 155 CO 0.04 -0.07 0.00 0.09 0.00 0.00 0.00 179.25 179.31 2gna n ASN 156 N -2.36 0.00 -0.14 0.00 3.02 -1.15 -2.98 115.26 111.64 2gna n ASN 156 Ca -0.02 -0.37 0.15 0.00 -0.03 0.00 0.00 54.58 54.31 2gna n ASN 156 Cb 0.13 -0.14 0.72 0.00 -0.61 0.00 0.00 39.78 39.88 2gna n ASN 156 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2gna n ASN 157 N -1.14 0.49 -4.83 6.41 3.02 -0.91 -4.84 115.26 113.47 2gna n ASN 157 Ca 0.13 -0.89 -0.34 0.00 -0.03 0.00 0.00 54.58 53.45 2gna n ASN 157 Cb 0.12 -0.05 -0.06 0.00 -0.61 0.00 0.00 39.78 39.18 2gna n ASN 157 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2gna s PHE 158 N -2.22 3.52 -0.32 3.10 5.36 -1.16 -4.82 117.98 121.44 2gna s PHE 158 Ca 0.37 1.35 0.16 0.00 -0.96 0.00 0.00 56.93 57.86 2gna s PHE 158 Cb 0.21 -2.61 0.45 0.00 -0.34 0.00 0.00 43.02 40.72 2gna s PHE 158 CO 0.41 0.20 1.30 1.63 -1.46 0.00 0.00 175.22 177.31 2gna n LYS 159 N 0.19 1.43 0.00 10.12 5.02 -1.26 -4.78 118.16 128.88 2gna n LYS 159 Ca 0.01 -2.31 0.00 0.00 -2.02 0.00 0.00 58.31 53.99 2gna n LYS 159 Cb 0.52 -0.51 0.00 0.00 -0.02 0.00 0.00 35.03 35.02 2gna n LYS 159 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2gna n GLY 160 N -0.91 -0.28 0.00 0.72 0.00 -1.26 -4.92 105.19 98.54 2gna n GLY 160 Ca -0.04 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.93 2gna n GLY 160 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gna n SER 161 N 0.00 0.00 -4.91 1.61 3.41 -1.26 -4.83 113.62 107.64 2gna n SER 161 Ca 0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.29 2gna n SER 161 Cb 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 2gna n SER 161 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2gna s SER 162 N -2.09 6.42 -0.76 4.04 0.01 -1.26 -5.03 113.70 115.03 2gna s SER 162 Ca 0.00 0.42 -0.26 0.00 1.31 0.00 0.00 55.95 57.42 2gna s SER 162 Cb 0.00 -2.02 0.01 0.00 0.21 0.00 0.00 66.02 64.22 2gna s SER 162 CO 0.00 0.14 1.50 -1.58 0.41 0.00 0.00 173.24 173.71 2gna s GLN 163 N -2.45 3.06 0.00 12.44 2.00 -1.26 -4.91 119.66 128.54 2gna s GLN 163 Ca 0.36 -0.15 -0.30 0.00 -2.00 0.00 0.00 55.36 53.27 2gna s GLN 163 Cb -0.13 -4.46 -0.03 0.00 0.80 0.00 0.00 33.01 29.19 2gna s GLN 163 CO 0.25 -2.39 0.98 0.99 -0.50 0.00 0.00 175.29 174.62 2gna s THR 164 N 6.79 4.86 -0.17 -0.34 2.01 -1.26 -4.86 115.64 122.67 2gna s THR 164 Ca 0.47 2.06 -0.07 0.00 0.31 0.00 0.00 61.69 64.46 2gna s THR 164 Cb -0.08 -4.32 -0.04 0.00 0.01 0.00 0.00 72.50 68.07 2gna s THR 164 CO 0.12 0.17 0.08 -1.10 -0.69 0.00 0.00 174.62 173.19 2gna s GLN 165 N 0.97 3.84 -0.11 4.92 -0.21 -0.30 -4.80 119.66 123.96 2gna s GLN 165 Ca 0.52 -0.30 0.03 0.00 0.02 0.00 0.00 55.36 55.63 2gna s GLN 165 Cb -0.21 -3.20 0.00 0.00 1.00 0.00 0.00 33.01 30.61 2gna s GLN 165 CO 0.28 0.39 -0.23 -0.06 -2.12 0.00 0.00 175.29 173.55 2gna s PHE 166 N 0.06 2.54 0.29 0.91 0.08 -1.26 0.07 117.98 120.67 2gna s PHE 166 Ca 0.06 -1.11 0.02 0.00 0.12 0.00 0.00 56.93 56.02 2gna s PHE 166 Cb -0.12 -1.71 -0.04 0.00 -0.57 0.00 0.00 43.02 40.58 2gna s PHE 166 CO 0.00 -0.47 0.13 -1.12 -0.10 0.00 0.00 175.22 173.66 2gna s SER 167 N 0.50 1.48 -0.01 1.36 0.01 0.08 -0.23 113.70 116.89 2gna s SER 167 Ca -0.15 -1.48 0.03 0.00 1.31 0.00 0.00 55.95 55.66 2gna s SER 167 Cb -0.17 0.28 -0.01 0.00 0.21 0.00 0.00 66.02 66.33 2gna s SER 167 CO 0.06 -0.81 -0.10 -0.69 0.41 0.00 0.00 173.24 172.10 2gna s VAL 168 N -3.64 0.82 -0.22 3.43 1.01 0.08 -1.91 120.40 119.97 2gna s VAL 168 Ca 0.36 -0.43 -0.00 0.00 0.00 0.00 0.00 61.98 61.91 2gna s VAL 168 Cb 0.06 -0.70 0.02 0.00 0.00 0.00 0.00 36.38 35.77 2gna s VAL 168 CO 0.15 0.24 -0.12 -0.69 0.00 0.00 0.00 175.10 174.68 2gna s VAL 169 N -0.13 2.55 -0.12 2.92 1.01 -0.67 0.43 120.40 126.39 2gna s VAL 169 Ca 0.02 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.04 2gna s VAL 169 Cb -0.05 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.11 2gna s VAL 169 CO -0.00 0.34 -0.19 -0.60 0.00 0.00 0.00 175.10 174.65 2gna s ARG 170 N 1.31 3.19 0.19 2.72 3.52 -0.42 -0.75 118.95 128.71 2gna s ARG 170 Ca 0.02 -0.80 -0.23 0.00 -0.13 0.00 0.00 55.73 54.60 2gna s ARG 170 Cb -0.15 -2.45 0.06 0.00 -1.56 0.00 0.00 34.95 30.84 2gna s ARG 170 CO -0.08 0.17 0.63 1.52 -0.81 0.00 0.00 175.30 176.73 2gna s TYR 171 N 0.40 -0.46 0.00 5.12 -0.85 -1.26 -4.17 117.35 116.13 2gna s TYR 171 Ca -0.14 0.19 0.00 0.00 -0.52 0.00 0.00 57.07 56.60 2gna s TYR 171 Cb -0.17 0.59 0.00 0.00 0.38 0.00 0.00 41.96 42.77 2gna s TYR 171 CO 0.07 -0.94 0.00 0.41 -1.52 0.00 0.00 175.55 173.57 2gna n GLY 172 N -0.40 0.40 2.89 5.49 0.00 -1.26 -3.39 105.19 108.92 2gna n GLY 172 Ca -0.14 -1.80 -0.44 0.00 0.00 0.00 0.00 46.02 43.64 2gna n GLY 172 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2gna n ASN 173 N 0.00 -0.64 -4.57 1.61 5.03 -1.26 -4.81 115.26 110.63 2gna n ASN 173 Ca 0.00 0.96 -0.36 0.00 0.87 0.00 0.00 54.58 56.05 2gna n ASN 173 Cb 0.00 -0.79 -0.11 0.00 -1.02 0.00 0.00 39.78 37.86 2gna n ASN 173 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2gna s VAL 174 N -0.51 4.88 0.23 2.41 1.01 -1.26 -3.50 120.40 123.66 2gna s VAL 174 Ca 0.63 0.02 -0.29 0.00 0.00 0.00 0.00 61.98 62.33 2gna s VAL 174 Cb -0.89 -3.27 -0.15 0.00 0.00 0.00 0.00 36.38 32.06 2gna s VAL 174 CO 0.47 0.35 0.90 0.52 0.00 0.00 0.00 175.10 177.35 2gna n VAL 175 N 4.48 1.69 0.00 2.92 0.31 -0.63 -1.66 118.33 125.44 2gna n VAL 175 Ca -0.15 -0.42 0.00 0.00 -0.01 0.00 0.00 64.34 63.75 2gna n VAL 175 Cb 0.52 -0.64 0.00 0.00 -0.91 0.00 0.00 33.84 32.81 2gna n VAL 175 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2gna n GLY 176 N 1.62 0.45 0.00 2.92 0.00 -1.26 -4.62 105.19 104.30 2gna n GLY 176 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2gna n GLY 176 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2gna n SER 177 N 0.00 0.00 -4.30 1.61 2.88 -0.67 -4.28 113.62 108.87 2gna n SER 177 Ca 0.00 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.23 2gna n SER 177 Cb 0.00 0.00 -0.18 0.00 -0.75 0.00 0.00 64.21 63.28 2gna n SER 177 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2gna n ARG 178 N 0.00 0.00 -1.45 -1.46 0.63 -1.26 -1.39 116.66 111.72 2gna n ARG 178 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2gna n ARG 178 Cb 0.00 -1.21 0.00 0.00 0.45 0.00 0.00 32.46 31.70 2gna n ARG 178 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2gna n GLY 179 N 5.77 0.77 0.00 5.14 0.00 -1.26 -5.10 105.19 110.51 2gna n GLY 179 Ca 0.64 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2gna n GLY 179 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2gna n SER 180 N -1.18 1.26 0.00 1.61 3.41 -0.49 -5.01 113.62 113.22 2gna n SER 180 Ca 0.00 -0.72 0.00 0.00 -0.26 0.00 0.00 58.87 57.89 2gna n SER 180 Cb 0.44 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 2gna n SER 180 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 2gna n VAL 181 N 0.00 0.00 -0.29 -3.33 3.14 -1.26 -3.14 118.33 113.45 2gna n VAL 181 Ca 0.00 1.31 -0.08 0.00 -2.96 0.00 0.00 64.34 62.60 2gna n VAL 181 Cb 0.00 -2.17 -0.07 0.00 -1.06 0.00 0.00 33.84 30.54 2gna n VAL 181 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 2gna h VAL 182 N 0.00 0.00 0.00 1.55 2.07 -1.94 -0.98 116.25 116.94 2gna h VAL 182 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2gna h VAL 182 Cb 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 2gna h VAL 182 CO 0.00 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.78 2gna n PRO 183 N -4.68 0.00 0.23 1.57 -0.04 -1.25 -1.77 135.00 129.06 2gna n PRO 183 Ca 0.01 0.41 0.07 0.00 -0.04 0.00 0.00 63.50 63.96 2gna n PRO 183 Cb 0.20 -1.17 0.40 0.00 -0.04 0.00 0.00 33.50 32.89 2gna n PRO 183 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2gna h PHE 184 N 0.00 0.00 0.00 0.54 -1.00 -1.56 1.02 116.94 115.94 2gna h PHE 184 Ca 0.00 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 60.59 2gna h PHE 184 Cb 0.00 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.53 2gna h PHE 184 CO -0.11 0.00 -0.89 0.74 -1.61 0.00 0.00 178.31 176.44 2gna h PHE 185 N 0.00 0.00 -0.19 -0.55 -1.00 -0.34 -3.15 116.94 111.70 2gna h PHE 185 Ca 0.00 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.65 2gna h PHE 185 Cb 0.88 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.43 2gna h PHE 185 CO 0.00 0.89 -0.43 0.87 -1.61 0.00 0.00 178.31 178.03 2gna h LYS 186 N 0.00 0.46 -0.04 1.51 1.57 0.19 -1.73 116.57 118.53 2gna h LYS 186 Ca -0.01 -0.24 0.01 0.00 -1.87 0.00 0.00 60.65 58.55 2gna h LYS 186 Cb 1.58 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.90 2gna h LYS 186 CO 0.12 0.80 0.04 0.87 -0.57 0.00 0.00 179.45 180.71 2gna h LYS 187 N 0.37 0.00 0.11 3.15 1.57 -1.50 -0.25 116.57 120.02 2gna h LYS 187 Ca 0.03 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 2gna h LYS 187 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 2gna h LYS 187 CO 0.08 0.00 -0.05 -0.07 -0.57 0.00 0.00 179.45 178.83 2gna h LEU 188 N 0.00 -0.13 0.00 2.94 3.38 -1.35 0.14 115.31 120.29 2gna h LEU 188 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2gna h LEU 188 Cb 0.09 0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2gna h LEU 188 CO -0.00 -0.05 0.00 0.52 0.09 0.00 0.00 178.44 179.00 2gna n VAL 189 N -2.65 0.44 -0.04 1.22 0.31 -1.08 -0.22 118.33 116.31 2gna n VAL 189 Ca -0.02 0.11 0.01 0.00 -0.01 0.00 0.00 64.34 64.43 2gna n VAL 189 Cb 0.06 -1.05 -0.14 0.00 -0.91 0.00 0.00 33.84 31.80 2gna n VAL 189 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2gna n GLN 190 N -1.13 0.88 -0.88 5.55 7.27 -0.12 -4.36 117.38 124.60 2gna n GLN 190 Ca 0.02 -0.09 -0.08 0.00 0.07 0.00 0.00 57.00 56.92 2gna n GLN 190 Cb 0.02 -1.43 0.23 0.00 2.41 0.00 0.00 30.24 31.46 2gna n GLN 190 CO 0.00 0.00 0.00 -1.71 0.07 0.00 0.00 177.06 175.42 2gna n ASN 191 N -2.37 4.17 0.00 1.69 2.85 0.70 -4.88 115.26 117.41 2gna n ASN 191 Ca -0.15 -3.06 0.00 0.00 -0.11 0.00 0.00 54.58 51.26 2gna n ASN 191 Cb 0.75 -0.72 0.00 0.00 1.24 0.00 0.00 39.78 41.05 2gna n ASN 191 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2gna n LYS 192 N -0.24 0.00 -0.52 1.20 4.76 -1.18 -4.85 118.16 117.33 2gna n LYS 192 Ca 0.37 0.00 -0.20 0.00 -2.87 0.00 0.00 58.31 55.61 2gna n LYS 192 Cb 1.26 -4.37 -0.03 0.00 -1.84 0.00 0.00 35.03 30.06 2gna n LYS 192 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2gna n ALA 193 N 1.00 -1.30 1.43 7.82 0.00 -1.16 -4.75 120.51 123.55 2gna n ALA 193 Ca 0.00 0.19 0.01 0.00 0.00 0.00 0.00 53.44 53.65 2gna n ALA 193 Cb 0.00 -0.60 0.09 0.00 0.00 0.00 0.00 19.45 18.93 2gna n ALA 193 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2gna n SER 194 N 0.70 0.00 -3.64 0.00 3.41 -1.26 -4.82 113.62 108.01 2gna n SER 194 Ca 0.08 -1.34 -0.02 0.00 -0.26 0.00 0.00 58.87 57.33 2gna n SER 194 Cb 0.02 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.95 2gna n SER 194 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2gna s GLU 195 N -2.00 0.03 -0.14 4.33 -1.05 -1.26 -4.47 118.70 114.14 2gna s GLU 195 Ca 0.04 -0.01 0.01 0.00 -0.15 0.00 0.00 54.97 54.86 2gna s GLU 195 Cb 0.02 0.02 -0.00 0.00 -0.44 0.00 0.00 34.13 33.72 2gna s GLU 195 CO 0.03 -0.02 -0.17 0.42 0.95 0.00 0.00 175.26 176.48 2gna s ILE 196 N -2.05 2.57 0.00 1.83 -1.09 0.80 -4.88 121.20 118.39 2gna s ILE 196 Ca 0.12 -0.81 -0.30 0.00 -2.23 0.00 0.00 60.65 57.43 2gna s ILE 196 Cb -0.00 -2.07 -0.07 0.00 -1.58 0.00 0.00 42.46 38.74 2gna s ILE 196 CO -0.03 0.52 1.81 -2.84 -1.23 0.00 0.00 174.94 173.18 2gna s PRO 197 N 0.72 4.16 -0.18 2.79 0.02 -1.26 -0.38 135.00 140.87 2gna s PRO 197 Ca -0.07 2.41 -0.02 0.00 0.02 0.00 0.00 61.00 63.33 2gna s PRO 197 Cb -0.16 -4.04 0.05 0.00 0.02 0.00 0.00 34.50 30.38 2gna s PRO 197 CO 0.01 -0.89 0.02 0.42 -0.33 0.00 0.00 177.00 176.23 2gna s ILE 198 N 4.13 0.61 0.37 2.83 -1.09 -1.18 -4.90 121.20 121.95 2gna s ILE 198 Ca 0.81 -0.52 0.06 0.00 -2.23 0.00 0.00 60.65 58.77 2gna s ILE 198 Cb -0.38 -1.03 0.29 0.00 -1.58 0.00 0.00 42.46 39.75 2gna s ILE 198 CO 0.36 -0.12 1.98 0.71 -1.23 0.00 0.00 174.94 176.63 2gna h THR 199 N 6.49 1.04 -2.68 2.92 1.35 -1.84 0.20 112.91 120.39 2gna h THR 199 Ca -0.17 -0.25 0.05 0.00 -0.55 0.00 0.00 66.41 65.48 2gna h THR 199 Cb 1.12 0.24 -0.13 0.00 -1.73 0.00 0.00 68.15 67.65 2gna h THR 199 CO 0.34 0.13 0.34 -0.62 -0.25 0.00 0.00 175.52 175.46 2gna s ASP 200 N -6.28 -0.46 -0.02 5.36 -1.08 -1.26 -3.67 116.67 109.26 2gna s ASP 200 Ca -0.10 -0.04 -0.13 0.00 -0.52 0.00 0.00 52.55 51.76 2gna s ASP 200 Cb 0.19 0.51 -0.33 0.00 -1.46 0.00 0.00 42.92 41.83 2gna s ASP 200 CO 0.77 -0.84 0.80 0.40 0.52 0.00 0.00 175.17 176.82 2gna h ILE 201 N 2.00 1.08 -0.27 4.11 2.04 -1.96 -3.33 117.51 121.18 2gna h ILE 201 Ca -0.28 -2.59 0.00 0.00 1.00 0.00 0.00 64.86 62.99 2gna h ILE 201 Cb 1.28 2.88 0.00 0.00 -0.74 0.00 0.00 36.82 40.24 2gna h ILE 201 CO 0.34 0.84 0.00 -2.11 0.00 0.00 0.00 178.15 177.22 2gna n ARG 202 N -3.66 1.99 -2.08 2.37 1.85 -1.26 -4.42 116.66 111.46 2gna n ARG 202 Ca -0.22 -1.12 -0.43 0.00 -1.00 0.00 0.00 57.85 55.08 2gna n ARG 202 Cb 1.09 -1.44 -0.03 0.00 -1.05 0.00 0.00 32.46 31.03 2gna n ARG 202 CO 0.00 0.00 0.00 1.41 -0.01 0.00 0.00 177.63 179.03 2gna s MET 203 N -1.64 3.70 0.34 2.89 1.75 -1.25 -4.86 119.30 120.22 2gna s MET 203 Ca 0.20 1.62 0.09 0.00 -1.25 0.00 0.00 55.69 56.36 2gna s MET 203 Cb 0.12 -4.07 -0.06 0.00 2.84 0.00 0.00 34.83 33.66 2gna s MET 203 CO 0.11 -1.41 -0.04 -0.08 -0.65 0.00 0.00 175.02 172.95 2gna s THR 204 N 5.55 2.52 0.03 10.11 -1.32 -1.04 0.28 115.64 131.77 2gna s THR 204 Ca 0.73 -2.07 -0.28 0.00 -1.21 0.00 0.00 61.69 58.86 2gna s THR 204 Cb -0.25 -2.72 0.07 0.00 -1.51 0.00 0.00 72.50 68.10 2gna s THR 204 CO 0.30 -0.22 0.66 -0.13 -2.21 0.00 0.00 174.62 173.03 2gna s ARG 205 N -3.67 1.13 0.37 7.08 1.81 -0.48 -4.45 118.95 120.75 2gna s ARG 205 Ca 0.34 -0.05 -0.22 0.00 -1.72 0.00 0.00 55.73 54.08 2gna s ARG 205 Cb 0.00 0.53 -0.10 0.00 -0.45 0.00 0.00 34.95 34.93 2gna s ARG 205 CO 0.18 -0.42 0.91 -0.06 -0.68 0.00 0.00 175.30 175.23 2gna s PHE 206 N -2.27 3.46 -0.04 -0.53 0.40 -1.26 -0.90 117.98 116.84 2gna s PHE 206 Ca -0.06 1.60 0.03 0.00 -0.60 0.00 0.00 56.93 57.91 2gna s PHE 206 Cb -0.00 -2.82 0.00 0.00 0.51 0.00 0.00 43.02 40.71 2gna s PHE 206 CO 0.00 0.05 -0.12 -1.58 0.70 0.00 0.00 175.22 174.27 2gna s TRP 207 N -1.93 1.26 -0.05 0.36 0.52 0.08 -4.18 118.94 115.00 2gna s TRP 207 Ca 0.56 -0.36 -0.13 0.00 0.02 0.00 0.00 56.10 56.18 2gna s TRP 207 Cb -0.13 -0.89 0.03 0.00 -1.15 0.00 0.00 33.47 31.33 2gna s TRP 207 CO 0.17 -0.15 0.31 -1.50 0.02 0.00 0.00 176.95 175.80 2gna s ILE 208 N 0.25 0.04 0.37 2.03 2.07 -1.23 -4.07 121.20 120.66 2gna s ILE 208 Ca -0.06 -0.31 -0.06 0.00 -1.41 0.00 0.00 60.65 58.81 2gna s ILE 208 Cb -0.11 -0.55 -0.05 0.00 0.13 0.00 0.00 42.46 41.87 2gna s ILE 208 CO 0.02 -0.17 0.67 0.42 -1.91 0.00 0.00 174.94 173.97 2gna s THR 209 N -0.80 4.93 0.23 4.00 -4.23 -1.26 -1.61 115.64 116.90 2gna s THR 209 Ca -0.09 0.23 -0.07 0.00 -1.18 0.00 0.00 61.69 60.58 2gna s THR 209 Cb -0.04 -3.77 0.18 0.00 1.34 0.00 0.00 72.50 70.21 2gna s THR 209 CO 0.03 -0.51 1.74 0.25 -0.54 0.00 0.00 174.62 175.58 2gna h LEU 210 N 1.17 0.24 -0.92 4.79 5.85 -1.92 -1.26 115.31 123.26 2gna h LEU 210 Ca -0.48 0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.23 2gna h LEU 210 Cb 1.19 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.29 2gna h LEU 210 CO 0.64 0.12 -0.34 0.44 -0.34 0.00 0.00 178.44 178.96 2gna h ASP 211 N 0.43 0.39 -0.37 1.25 5.19 -1.98 -2.48 116.42 118.85 2gna h ASP 211 Ca 0.36 -0.15 -0.07 0.00 -0.62 0.00 0.00 57.03 56.55 2gna h ASP 211 Cb 0.49 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.88 2gna h ASP 211 CO -0.36 0.71 -0.03 -0.33 -3.12 0.00 0.00 179.24 176.12 2gna h GLU 212 N 0.33 0.66 -0.02 3.56 5.08 -1.65 -1.50 114.58 121.03 2gna h GLU 212 Ca 0.04 -0.23 0.01 0.00 -1.00 0.00 0.00 59.36 58.19 2gna h GLU 212 Cb 0.76 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 2gna h GLU 212 CO 0.06 0.79 -0.05 0.78 -1.00 0.00 0.00 179.01 179.58 2gna h GLY 213 N 0.47 -0.03 0.39 -3.84 0.00 -1.20 0.22 103.07 99.09 2gna h GLY 213 Ca 0.10 0.06 0.09 0.00 0.00 0.00 0.00 47.33 47.58 2gna h GLY 213 CO 0.02 -0.06 0.15 -2.08 0.00 0.00 0.00 176.54 174.58 2gna h VAL 214 N -0.08 0.75 -0.27 4.60 2.07 -1.40 0.76 116.25 122.69 2gna h VAL 214 Ca 0.03 -0.11 0.03 0.00 0.82 0.00 0.00 66.70 67.48 2gna h VAL 214 Cb 0.12 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 2gna h VAL 214 CO -0.07 0.06 0.06 -1.28 0.02 0.00 0.00 177.57 176.36 2gna h SER 215 N 0.31 0.04 -0.34 0.57 0.87 -0.65 -1.82 113.55 112.53 2gna h SER 215 Ca 0.27 0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.84 2gna h SER 215 Cb 0.34 0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.32 2gna h SER 215 CO -0.31 0.06 0.12 0.15 -0.53 0.00 0.00 176.83 176.32 2gna h PHE 216 N 0.17 0.58 -0.47 2.24 3.57 0.43 -0.94 116.94 122.52 2gna h PHE 216 Ca 0.12 -0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.52 2gna h PHE 216 Cb 0.12 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 2gna h PHE 216 CO -0.15 0.49 0.03 0.28 -2.23 0.00 0.00 178.31 176.72 2gna h VAL 217 N 0.57 1.26 -0.28 1.41 2.07 -0.29 -1.03 116.25 119.96 2gna h VAL 217 Ca 0.14 -1.01 -0.08 0.00 0.82 0.00 0.00 66.70 66.56 2gna h VAL 217 Cb 0.18 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 2gna h VAL 217 CO -0.01 0.35 -0.18 -0.07 0.02 0.00 0.00 177.57 177.68 2gna h LEU 218 N 0.67 0.49 -0.29 2.57 3.38 -0.62 -1.88 115.31 119.64 2gna h LEU 218 Ca 0.14 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 2gna h LEU 218 Cb 0.47 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 2gna h LEU 218 CO 0.02 0.69 -0.29 0.11 0.09 0.00 0.00 178.44 179.06 2gna h LYS 219 N 0.45 0.70 -0.90 1.13 1.57 -1.01 -2.91 116.57 115.61 2gna h LYS 219 Ca 0.08 -0.37 0.12 0.00 -1.87 0.00 0.00 60.65 58.60 2gna h LYS 219 Cb 0.58 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.83 2gna h LYS 219 CO 0.04 0.99 0.58 0.77 -0.57 0.00 0.00 179.45 181.26 2gna h SER 220 N 0.45 0.75 -0.37 0.86 0.02 -0.88 0.50 113.55 114.88 2gna h SER 220 Ca 0.04 0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 60.96 2gna h SER 220 Cb 0.86 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.26 2gna h SER 220 CO 0.07 0.41 0.01 -0.07 -1.14 0.00 0.00 176.83 176.12 2gna h LEU 221 N 0.82 0.69 -0.74 5.07 3.38 -1.20 0.73 115.31 124.07 2gna h LEU 221 Ca 0.43 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 58.20 2gna h LEU 221 Cb 0.54 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2gna h LEU 221 CO -0.20 0.75 -0.24 0.11 0.09 0.00 0.00 178.44 178.95 2gna h LYS 222 N 0.69 0.00 0.00 1.13 1.57 -0.73 -3.33 116.57 115.89 2gna h LYS 222 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2gna h LYS 222 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2gna h LYS 222 CO 0.01 0.24 -0.92 2.89 -0.57 0.00 0.00 179.45 181.11 2gna n ARG 223 N -3.29 2.17 -1.77 3.15 1.85 -0.78 -4.32 116.66 113.68 2gna n ARG 223 Ca 0.01 -0.04 -0.40 0.00 -1.00 0.00 0.00 57.85 56.42 2gna n ARG 223 Cb 0.50 -1.07 0.02 0.00 -1.05 0.00 0.00 32.46 30.86 2gna n ARG 223 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2gna n MET 224 N -1.51 2.33 -0.01 2.89 0.00 0.23 -1.53 117.12 119.53 2gna n MET 224 Ca -0.00 0.83 0.07 0.00 0.00 0.00 0.00 57.70 58.60 2gna n MET 224 Cb 0.19 -2.64 -0.10 0.00 0.00 0.00 0.00 33.22 30.66 2gna n MET 224 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 2gna n HIS 225 N -0.10 0.00 -0.01 3.17 8.25 -1.26 -4.78 115.22 120.48 2gna n HIS 225 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 2gna n HIS 225 Cb 0.41 -0.27 0.00 0.00 1.12 0.00 0.00 29.99 31.25 2gna n HIS 225 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gna n GLY 226 N 1.67 0.67 0.00 -1.41 0.00 -1.26 -4.89 105.19 99.97 2gna n GLY 226 Ca -0.02 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.02 2gna n GLY 226 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gna n GLY 227 N 2.69 1.23 3.89 -0.02 0.00 0.69 -4.80 105.19 108.86 2gna n GLY 227 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2gna n GLY 227 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gna s GLU 228 N 0.00 3.57 -0.29 1.61 8.01 -1.26 -4.13 118.70 126.21 2gna s GLU 228 Ca 0.00 0.45 0.02 0.00 0.01 0.00 0.00 54.97 55.45 2gna s GLU 228 Cb 0.00 -2.25 0.08 0.00 -4.31 0.00 0.00 34.13 27.65 2gna s GLU 228 CO 0.00 -0.36 -0.01 0.42 0.01 0.00 0.00 175.26 175.32 2gna s ILE 229 N -2.92 1.90 -0.12 -1.63 1.01 -1.20 -0.74 121.20 117.51 2gna s ILE 229 Ca 0.51 -1.77 -0.26 0.00 0.00 0.00 0.00 60.65 59.13 2gna s ILE 229 Cb -0.11 -2.24 -0.02 0.00 0.01 0.00 0.00 42.46 40.10 2gna s ILE 229 CO 0.48 -0.34 0.84 -0.36 0.00 0.00 0.00 174.94 175.57 2gna s PHE 230 N 1.16 3.50 -0.15 3.97 0.08 0.17 -1.97 117.98 124.74 2gna s PHE 230 Ca 0.01 1.36 0.02 0.00 0.12 0.00 0.00 56.93 58.44 2gna s PHE 230 Cb -0.19 -3.00 0.01 0.00 -0.57 0.00 0.00 43.02 39.27 2gna s PHE 230 CO -0.09 -0.13 -0.20 0.08 -0.10 0.00 0.00 175.22 174.78 2gna s VAL 231 N 1.67 1.96 0.34 -0.44 1.01 -0.28 -1.30 120.40 123.37 2gna s VAL 231 Ca 0.41 -0.90 -0.20 0.00 0.00 0.00 0.00 61.98 61.28 2gna s VAL 231 Cb -0.18 -1.76 -0.10 0.00 0.00 0.00 0.00 36.38 34.35 2gna s VAL 231 CO 0.16 0.53 0.86 -2.16 0.00 0.00 0.00 175.10 174.49 2gna s PRO 232 N 1.05 4.26 -0.61 2.72 0.04 -1.26 0.40 135.00 141.60 2gna s PRO 232 Ca -0.02 1.01 -0.27 0.00 0.04 0.00 0.00 61.00 61.77 2gna s PRO 232 Cb -0.14 -2.51 0.03 0.00 0.04 0.00 0.00 34.50 31.92 2gna s PRO 232 CO -0.06 0.16 1.16 0.15 0.04 0.00 0.00 177.00 178.44 2gna s LYS 233 N -2.66 3.39 0.21 4.56 1.02 -0.49 -4.87 119.74 120.89 2gna s LYS 233 Ca 0.54 0.00 0.08 0.00 0.02 0.00 0.00 55.97 56.62 2gna s LYS 233 Cb -0.13 -4.07 -0.05 0.00 -0.52 0.00 0.00 37.83 33.07 2gna s LYS 233 CO 0.18 -1.75 -0.16 0.96 -0.92 0.00 0.00 175.35 173.66 2gna s ILE 234 N 4.90 1.85 0.39 2.17 -4.36 -1.26 -4.97 121.20 119.92 2gna s ILE 234 Ca 0.38 -2.17 -0.17 0.00 -0.26 0.00 0.00 60.65 58.42 2gna s ILE 234 Cb -0.09 -2.03 -0.10 0.00 1.25 0.00 0.00 42.46 41.49 2gna s ILE 234 CO 0.21 -0.51 0.85 -2.84 0.24 0.00 0.00 174.94 172.89 2gna s PRO 235 N -3.44 4.08 0.48 0.37 0.02 -1.26 -4.86 135.00 130.39 2gna s PRO 235 Ca 0.22 0.86 -0.02 0.00 0.02 0.00 0.00 61.00 62.08 2gna s PRO 235 Cb -0.02 -2.30 0.10 0.00 0.02 0.00 0.00 34.50 32.30 2gna s PRO 235 CO 0.08 0.03 0.66 0.43 -0.33 0.00 0.00 177.00 177.87 2gna n SER 236 N -0.65 0.69 -3.65 2.53 7.64 0.39 -0.74 113.62 119.84 2gna n SER 236 Ca 0.05 -1.63 -0.01 0.00 1.01 0.00 0.00 58.87 58.30 2gna n SER 236 Cb 0.54 -0.44 -0.06 0.00 -1.01 0.00 0.00 64.21 63.23 2gna n SER 236 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 2gna s MET 237 N -4.21 0.24 0.13 1.43 0.00 -0.07 -1.89 119.30 114.92 2gna s MET 237 Ca 0.42 0.40 -0.30 0.00 0.00 0.00 0.00 55.69 56.21 2gna s MET 237 Cb -0.02 0.05 -0.06 0.00 0.00 0.00 0.00 34.83 34.80 2gna s MET 237 CO 0.28 -0.05 1.06 0.21 0.00 0.00 0.00 175.02 176.52 2gna s LYS 238 N 1.14 4.60 0.28 4.11 2.20 -1.26 -1.39 119.74 129.42 2gna s LYS 238 Ca -0.08 1.62 0.22 0.00 -0.36 0.00 0.00 55.97 57.37 2gna s LYS 238 Cb -0.03 -3.33 1.04 0.00 -1.51 0.00 0.00 37.83 33.99 2gna s LYS 238 CO -0.13 0.07 1.68 -1.33 -0.36 0.00 0.00 175.35 175.28 2gna n MET 239 N 2.82 0.17 -0.29 4.03 2.81 0.14 -1.74 117.12 125.06 2gna n MET 239 Ca 0.04 0.51 -0.06 0.00 -1.81 0.00 0.00 57.70 56.38 2gna n MET 239 Cb 0.47 -1.90 0.07 0.00 -0.71 0.00 0.00 33.22 31.15 2gna n MET 239 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 2gna h THR 240 N 0.00 1.26 0.00 2.03 2.02 -1.77 -2.72 112.91 113.73 2gna h THR 240 Ca 0.00 -0.78 -0.06 0.00 0.77 0.00 0.00 66.41 66.34 2gna h THR 240 Cb 0.22 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 66.91 2gna h THR 240 CO 0.00 0.32 -0.85 0.44 0.37 0.00 0.00 175.52 175.80 2gna h ASP 241 N 1.15 0.00 0.20 4.18 3.32 -1.73 -3.15 116.42 120.38 2gna h ASP 241 Ca 0.27 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.21 2gna h ASP 241 Cb 0.18 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 2gna h ASP 241 CO -0.03 0.23 -0.42 0.25 -1.72 0.00 0.00 179.24 177.55 2gna h LEU 242 N 0.00 0.30 0.03 1.55 5.85 -1.32 -2.69 115.31 119.02 2gna h LEU 242 Ca -0.04 -0.13 -0.28 0.00 0.84 0.00 0.00 57.88 58.27 2gna h LEU 242 Cb 1.21 -0.08 0.02 0.00 0.37 0.00 0.00 40.66 42.18 2gna h LEU 242 CO 0.02 0.69 -1.11 0.00 -0.34 0.00 0.00 178.44 177.70 2gna h ALA 243 N 1.33 0.10 -0.10 1.25 0.00 -1.58 -3.10 119.26 117.16 2gna h ALA 243 Ca 0.02 -0.73 -0.03 0.00 0.00 0.00 0.00 54.91 54.17 2gna h ALA 243 Cb 0.84 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 2gna h ALA 243 CO 0.07 0.71 0.04 1.63 0.00 0.00 0.00 179.25 181.69 2gna n LYS 244 N -3.81 1.31 0.01 0.00 5.02 -1.12 -1.01 118.16 118.56 2gna n LYS 244 Ca -0.12 -0.37 -0.01 0.00 -2.02 0.00 0.00 58.31 55.79 2gna n LYS 244 Cb 0.92 -1.37 -0.00 0.00 -0.02 0.00 0.00 35.03 34.56 2gna n LYS 244 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2gna n ALA 245 N 0.19 2.89 0.71 7.82 0.00 -1.03 -4.33 120.51 126.76 2gna n ALA 245 Ca 0.05 -0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.57 2gna n ALA 245 Cb 0.50 0.38 0.43 0.00 0.00 0.00 0.00 19.45 20.76 2gna n ALA 245 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2gna n LEU 246 N -3.26 0.62 -3.31 0.00 4.77 -1.18 -4.22 117.00 110.42 2gna n LEU 246 Ca -0.02 0.51 -0.26 0.00 -0.03 0.00 0.00 56.01 56.21 2gna n LEU 246 Cb 0.33 -0.34 -0.09 0.00 -2.33 0.00 0.00 43.42 40.99 2gna n LEU 246 CO 0.01 -0.12 -0.31 0.00 -1.33 0.00 0.00 177.39 175.63 2gna n ALA 247 N -1.72 2.70 -0.29 -1.18 0.00 -0.18 -4.74 120.51 115.10 2gna n ALA 247 Ca 0.06 -3.23 0.07 0.00 0.00 0.00 0.00 53.44 50.34 2gna n ALA 247 Cb 0.41 -0.78 0.29 0.00 0.00 0.00 0.00 19.45 19.38 2gna n ALA 247 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2gna h PRO 248 N 4.99 0.86 -2.96 0.00 0.11 -1.76 -3.32 132.00 129.93 2gna h PRO 248 Ca 0.19 -0.05 -0.61 0.00 0.11 0.00 0.00 66.00 65.63 2gna h PRO 248 Cb 0.90 -0.19 -0.41 0.00 0.11 0.00 0.00 31.00 31.40 2gna h PRO 248 CO 0.41 0.57 -0.69 -0.80 -0.21 0.00 0.00 178.00 177.28 2gna s ASN 249 N -5.89 3.86 -0.28 -2.05 0.01 -1.26 -4.98 114.94 104.35 2gna s ASN 249 Ca -0.11 -3.36 -0.18 0.00 -0.71 0.00 0.00 52.86 48.50 2gna s ASN 249 Cb 0.21 -1.28 0.11 0.00 0.41 0.00 0.00 41.25 40.70 2gna s ASN 249 CO 0.80 -0.15 0.87 -0.89 -1.51 0.00 0.00 177.10 176.21 2gna s THR 250 N -0.67 0.00 0.74 1.60 2.01 -1.25 -5.09 115.64 112.98 2gna s THR 250 Ca 0.24 0.00 -0.11 0.00 0.31 0.00 0.00 61.69 62.13 2gna s THR 250 Cb -0.09 -1.00 0.04 0.00 0.01 0.00 0.00 72.50 71.46 2gna s THR 250 CO -0.12 0.00 1.08 -2.16 -0.69 0.00 0.00 174.62 172.73 2gna s PRO 251 N 1.19 2.47 -0.13 4.92 0.04 -1.26 -4.79 135.00 137.43 2gna s PRO 251 Ca -0.07 1.13 -0.02 0.00 0.04 0.00 0.00 61.00 62.08 2gna s PRO 251 Cb -0.04 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.55 2gna s PRO 251 CO -0.14 -1.48 -0.06 0.95 0.04 0.00 0.00 177.00 176.32 2gna s THR 252 N -2.89 3.74 -1.25 1.26 -4.23 -1.26 -0.14 115.64 110.86 2gna s THR 252 Ca 0.61 -0.42 -0.12 0.00 -1.18 0.00 0.00 61.69 60.58 2gna s THR 252 Cb -0.17 -2.61 0.16 0.00 1.34 0.00 0.00 72.50 71.23 2gna s THR 252 CO 0.55 0.52 1.68 1.17 -0.54 0.00 0.00 174.62 178.00 2gna n LYS 253 N 3.21 3.48 -1.53 3.99 4.81 0.49 -4.85 118.16 127.77 2gna n LYS 253 Ca -0.18 -3.65 -0.19 0.00 -0.87 0.00 0.00 58.31 53.42 2gna n LYS 253 Cb 0.53 -3.00 -0.15 0.00 0.02 0.00 0.00 35.03 32.42 2gna n LYS 253 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 2gna n ILE 254 N 4.01 -0.00 -0.29 3.15 5.41 -1.26 -3.11 119.36 127.28 2gna n ILE 254 Ca 0.39 -0.49 0.00 0.00 1.00 0.00 0.00 62.75 63.65 2gna n ILE 254 Cb 0.39 -0.93 0.00 0.00 -0.71 0.00 0.00 39.64 38.39 2gna n ILE 254 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 2gna n ILE 255 N 7.02 0.00 -3.80 1.39 -5.35 0.70 -4.97 119.36 114.35 2gna n ILE 255 Ca 0.58 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 63.06 2gna n ILE 255 Cb 0.27 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.17 2gna n ILE 255 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2gna n GLY 256 N 5.00 4.51 3.77 3.28 0.00 -1.24 -4.58 105.19 115.92 2gna n GLY 256 Ca 0.00 -2.18 -0.39 0.00 0.00 0.00 0.00 46.02 43.45 2gna n GLY 256 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gna s ILE 257 N -0.60 4.81 1.08 -0.61 -1.09 -1.26 -4.30 121.20 119.23 2gna s ILE 257 Ca 0.00 1.35 -0.13 0.00 -2.23 0.00 0.00 60.65 59.64 2gna s ILE 257 Cb 0.00 -3.98 0.23 0.00 -1.58 0.00 0.00 42.46 37.13 2gna s ILE 257 CO 0.00 0.43 1.07 -0.13 -1.23 0.00 0.00 174.94 175.08 2gna s ARG 258 N -0.35 -0.20 0.03 2.79 1.81 -1.26 -4.94 118.95 116.82 2gna s ARG 258 Ca 0.33 0.52 -0.05 0.00 -1.72 0.00 0.00 55.73 54.81 2gna s ARG 258 Cb -0.19 -1.66 -0.01 0.00 -0.45 0.00 0.00 34.95 32.63 2gna s ARG 258 CO 0.19 -3.16 0.97 -2.30 -0.68 0.00 0.00 175.30 170.32 2gna n PRO 259 N -4.48 -0.07 -2.07 3.54 -0.02 -1.26 -3.28 135.00 127.37 2gna n PRO 259 Ca 0.05 0.97 -0.27 0.00 -2.02 0.00 0.00 63.50 62.23 2gna n PRO 259 Cb 0.57 -1.45 0.02 0.00 -0.02 0.00 0.00 33.50 32.63 2gna n PRO 259 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gna n GLY 260 N -1.04 6.17 3.90 -1.23 0.00 -1.26 -5.06 105.19 106.68 2gna n GLY 260 Ca 0.00 -2.65 -0.28 0.00 0.00 0.00 0.00 46.02 43.10 2gna n GLY 260 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gna s GLU 261 N -3.64 3.56 0.30 1.61 2.02 -1.20 -4.53 118.70 116.81 2gna s GLU 261 Ca 0.52 0.22 0.10 0.00 0.02 0.00 0.00 54.97 55.83 2gna s GLU 261 Cb 0.42 -2.38 -0.06 0.00 0.10 0.00 0.00 34.13 32.22 2gna s GLU 261 CO -0.06 -0.19 -0.15 0.15 0.02 0.00 0.00 175.26 175.03 2gna s LYS 262 N -4.66 1.69 -0.02 1.61 1.02 -1.26 -4.95 119.74 113.18 2gna s LYS 262 Ca 0.48 -1.82 -0.21 0.00 0.02 0.00 0.00 55.97 54.44 2gna s LYS 262 Cb -0.10 -1.65 -0.29 0.00 -0.52 0.00 0.00 37.83 35.27 2gna s LYS 262 CO 0.44 0.22 0.98 -0.07 -0.92 0.00 0.00 175.35 176.00 2gna h LEU 263 N 2.20 0.52 -8.10 3.17 3.38 -1.95 -3.45 115.31 111.08 2gna h LEU 263 Ca -0.41 -0.88 -0.52 0.00 0.09 0.00 0.00 57.88 56.17 2gna h LEU 263 Cb 1.25 -0.17 -0.32 0.00 0.09 0.00 0.00 40.66 41.52 2gna h LEU 263 CO 0.65 1.35 -0.82 -1.00 0.09 0.00 0.00 178.44 178.71 2gna s HIS 264 N -2.74 1.45 -0.00 1.13 3.76 -1.26 -2.50 115.29 115.14 2gna s HIS 264 Ca -0.13 -0.43 -0.21 0.00 -0.15 0.00 0.00 55.06 54.14 2gna s HIS 264 Cb 0.02 -1.01 -0.05 0.00 1.11 0.00 0.00 32.58 32.65 2gna s HIS 264 CO 0.84 -0.17 0.61 -1.21 -0.85 0.00 0.00 174.74 173.95 2gna s GLU 265 N 0.23 4.33 0.11 1.40 0.41 -1.26 -4.88 118.70 119.03 2gna s GLU 265 Ca -0.06 0.75 -0.11 0.00 -0.41 0.00 0.00 54.97 55.14 2gna s GLU 265 Cb -0.12 -3.34 -0.06 0.00 -1.78 0.00 0.00 34.13 28.83 2gna s GLU 265 CO 0.02 0.37 0.46 0.08 -0.49 0.00 0.00 175.26 175.69 2gna s VAL 266 N -0.19 5.01 -0.13 2.63 1.01 -1.26 -1.91 120.40 125.55 2gna s VAL 266 Ca 0.31 0.58 -0.05 0.00 0.00 0.00 0.00 61.98 62.82 2gna s VAL 266 Cb -0.18 -3.68 -0.06 0.00 0.00 0.00 0.00 36.38 32.46 2gna s VAL 266 CO 0.18 0.26 -0.16 0.80 0.00 0.00 0.00 175.10 176.17 2gna n MET 267 N 0.83 0.29 -3.90 2.72 1.56 0.10 -4.55 117.12 114.19 2gna n MET 267 Ca -0.07 0.12 -0.29 0.00 -0.27 0.00 0.00 57.70 57.19 2gna n MET 267 Cb 0.52 -1.04 -0.16 0.00 2.15 0.00 0.00 33.22 34.69 2gna n MET 267 CO 0.00 0.00 0.00 0.42 -0.73 0.00 0.00 175.97 175.66 2gna s ILE 268 N -2.25 1.21 0.73 1.12 1.01 -1.09 -4.90 121.20 117.04 2gna s ILE 268 Ca -0.19 -0.80 -0.14 0.00 0.00 0.00 0.00 60.65 59.52 2gna s ILE 268 Cb 0.07 -1.43 0.04 0.00 0.01 0.00 0.00 42.46 41.15 2gna s ILE 268 CO 0.25 0.05 1.15 -2.84 0.00 0.00 0.00 174.94 173.55 2gna s PRO 269 N 1.57 2.24 0.14 2.79 0.02 -1.26 -1.80 135.00 138.70 2gna s PRO 269 Ca -0.01 1.53 -0.12 0.00 0.02 0.00 0.00 61.00 62.42 2gna s PRO 269 Cb -0.16 -1.87 -0.01 0.00 0.02 0.00 0.00 34.50 32.48 2gna s PRO 269 CO -0.07 -1.71 1.55 -0.22 -0.33 0.00 0.00 177.00 176.21 2gna h LYS 270 N -0.49 0.87 0.00 5.54 3.64 -1.96 -1.36 116.57 122.81 2gna h LYS 270 Ca -0.46 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 58.58 2gna h LYS 270 Cb 1.27 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2gna h LYS 270 CO 0.50 0.97 0.00 -0.44 -2.27 0.00 0.00 179.45 178.22 2gna h ASP 271 N 0.70 0.00 0.00 4.20 3.32 -1.92 -2.25 116.42 120.47 2gna h ASP 271 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 2gna h ASP 271 Cb 0.66 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.21 2gna h ASP 271 CO 0.05 0.00 -0.62 -0.62 -1.72 0.00 0.00 179.24 176.32 2gna n GLU 272 N -2.58 2.67 -0.30 3.56 1.02 -1.03 -4.66 120.64 119.33 2gna n GLU 272 Ca -0.00 -0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.22 2gna n GLU 272 Cb 0.16 -1.12 0.17 0.00 -0.02 0.00 0.00 31.44 30.63 2gna n GLU 272 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2gna n SER 273 N -1.31 -0.22 0.32 1.62 2.88 -0.54 0.88 113.62 117.25 2gna n SER 273 Ca 0.02 1.45 0.18 0.00 -1.33 0.00 0.00 58.87 59.19 2gna n SER 273 Cb 0.20 -0.47 0.94 0.00 -0.75 0.00 0.00 64.21 64.13 2gna n SER 273 CO 0.00 0.00 0.00 1.12 -1.23 0.00 0.00 175.04 174.93 2gna h HIS 274 N 0.00 0.00 -0.01 0.66 2.07 -1.79 0.31 115.15 116.39 2gna h HIS 274 Ca 0.45 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.97 2gna h HIS 274 Cb 0.80 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.78 2gna h HIS 274 CO -0.56 0.00 -0.35 1.28 -3.07 0.00 0.00 177.93 175.24 2gna n LEU 275 N -2.90 1.50 -4.85 6.12 4.77 0.25 -4.96 117.00 116.94 2gna n LEU 275 Ca -0.02 -0.49 -0.30 0.00 -0.03 0.00 0.00 56.01 55.16 2gna n LEU 275 Cb 0.25 -0.06 0.06 0.00 -2.33 0.00 0.00 43.42 41.33 2gna n LEU 275 CO 0.15 0.28 0.73 0.00 -1.33 0.00 0.00 177.39 177.22 2gna s ALA 276 N -2.47 2.68 -0.16 -1.18 0.00 0.11 -0.70 121.76 120.03 2gna s ALA 276 Ca 0.22 -0.20 -0.07 0.00 0.00 0.00 0.00 51.96 51.91 2gna s ALA 276 Cb 0.19 -3.08 0.07 0.00 0.00 0.00 0.00 23.12 20.29 2gna s ALA 276 CO 0.54 -1.29 0.35 -0.51 0.00 0.00 0.00 175.76 174.85 2gna s LEU 277 N -5.50 -0.25 0.14 0.00 1.43 -0.74 -4.30 118.68 109.46 2gna s LEU 277 Ca 0.59 0.79 -0.11 0.00 -1.03 0.00 0.00 54.13 54.37 2gna s LEU 277 Cb -0.13 1.09 -0.06 0.00 0.03 0.00 0.00 46.19 47.12 2gna s LEU 277 CO 0.53 -0.21 0.48 -0.70 0.23 0.00 0.00 176.35 176.68 2gna s GLU 278 N 2.04 3.82 0.38 1.70 2.12 0.48 -2.23 118.70 127.01 2gna s GLU 278 Ca -0.04 0.27 0.04 0.00 0.36 0.00 0.00 54.97 55.60 2gna s GLU 278 Cb -0.11 -2.88 -0.02 0.00 0.26 0.00 0.00 34.13 31.38 2gna s GLU 278 CO -0.11 0.47 0.15 1.19 -0.54 0.00 0.00 175.26 176.42 2gna n PHE 279 N 0.56 0.06 0.09 5.30 3.72 -0.09 -0.36 117.46 126.75 2gna n PHE 279 Ca -0.05 -2.49 -0.13 0.00 -0.05 0.00 0.00 57.45 54.73 2gna n PHE 279 Cb 0.52 0.02 -0.08 0.00 -0.94 0.00 0.00 39.48 38.99 2gna n PHE 279 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 2gna h GLU 280 N 0.00 -0.22 -0.00 -1.08 4.81 -1.98 -3.34 114.58 112.77 2gna h GLU 280 Ca -0.29 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 2gna h GLU 280 Cb 1.15 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.58 2gna h GLU 280 CO 0.46 0.06 -0.96 -0.25 -0.73 0.00 0.00 179.01 177.59 2gna n ASP 281 N -5.07 1.04 -1.33 1.04 8.00 -1.26 -4.99 116.55 113.97 2gna n ASP 281 Ca -0.09 -1.00 -0.02 0.00 0.71 0.00 0.00 54.79 54.39 2gna n ASP 281 Cb 0.20 0.95 0.00 0.00 -0.02 0.00 0.00 41.12 42.26 2gna n ASP 281 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 2gna n PHE 282 N -1.43 -1.15 -4.25 1.24 1.16 -1.25 -1.40 117.46 110.38 2gna n PHE 282 Ca 0.04 -0.36 -0.15 0.00 -1.87 0.00 0.00 57.45 55.11 2gna n PHE 282 Cb 0.34 0.16 -0.10 0.00 -1.61 0.00 0.00 39.48 38.26 2gna n PHE 282 CO 0.00 0.00 0.00 -0.06 -1.87 0.00 0.00 176.76 174.83 2gna s PHE 283 N -7.23 1.32 -0.08 2.97 0.08 0.16 -0.92 117.98 114.29 2gna s PHE 283 Ca 0.03 -0.69 -0.00 0.00 0.12 0.00 0.00 56.93 56.39 2gna s PHE 283 Cb -0.01 -0.67 0.02 0.00 -0.57 0.00 0.00 43.02 41.80 2gna s PHE 283 CO 0.02 0.12 -0.04 0.42 -0.10 0.00 0.00 175.22 175.65 2gna s ILE 284 N -2.97 0.63 -0.35 0.64 1.01 -0.95 -1.13 121.20 118.09 2gna s ILE 284 Ca 0.15 -0.07 -0.16 0.00 0.00 0.00 0.00 60.65 60.57 2gna s ILE 284 Cb 0.00 -0.70 -0.01 0.00 0.01 0.00 0.00 42.46 41.76 2gna s ILE 284 CO 0.02 0.29 0.38 -0.63 0.00 0.00 0.00 174.94 174.99 2gna s ILE 285 N 1.60 5.15 0.68 2.92 1.01 -0.83 -1.79 121.20 129.93 2gna s ILE 285 Ca 0.00 0.06 -0.15 0.00 0.00 0.00 0.00 60.65 60.56 2gna s ILE 285 Cb -0.13 -3.85 0.01 0.00 0.01 0.00 0.00 42.46 38.50 2gna s ILE 285 CO -0.04 -0.12 1.14 -1.10 0.00 0.00 0.00 174.94 174.81 2gna s GLN 286 N 2.06 2.61 0.88 2.79 -0.21 0.12 -3.20 119.66 124.71 2gna s GLN 286 Ca 0.12 1.50 -0.12 0.00 0.02 0.00 0.00 55.36 56.88 2gna s GLN 286 Cb -0.16 -1.92 0.08 0.00 1.00 0.00 0.00 33.01 32.00 2gna s GLN 286 CO 0.12 -1.42 0.84 -2.30 -2.12 0.00 0.00 175.29 170.42 2gna n PRO 287 N -2.49 -0.18 0.00 2.91 -0.02 -1.26 -4.91 135.00 129.05 2gna n PRO 287 Ca 0.11 0.01 0.11 0.00 -2.02 0.00 0.00 63.50 61.71 2gna n PRO 287 Cb 0.51 -2.16 -0.01 0.00 -0.02 0.00 0.00 33.50 31.83 2gna n PRO 287 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 2gna n THR 288 N -3.62 0.00 -4.40 3.45 5.66 -1.26 -4.94 114.28 109.17 2gna n THR 288 Ca 0.10 -0.14 -0.24 0.00 -3.05 0.00 0.00 64.05 60.73 2gna n THR 288 Cb 0.52 1.05 -0.09 0.00 -1.55 0.00 0.00 70.33 70.26 2gna n THR 288 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 2gna s ILE 289 N -2.71 2.75 -0.23 1.09 -4.36 -1.26 -5.13 121.20 111.35 2gna s ILE 289 Ca 0.14 -2.16 -0.09 0.00 -0.26 0.00 0.00 60.65 58.28 2gna s ILE 289 Cb 0.17 -2.59 -0.04 0.00 1.25 0.00 0.00 42.46 41.26 2gna s ILE 289 CO 0.69 -0.33 0.12 -0.44 0.24 0.00 0.00 174.94 175.21 2gna s SER 290 N -3.61 5.70 0.47 4.36 0.01 -1.26 -5.09 113.70 114.28 2gna s SER 290 Ca 0.32 -0.01 -0.16 0.00 1.31 0.00 0.00 55.95 57.41 2gna s SER 290 Cb -0.04 -2.02 -0.08 0.00 0.21 0.00 0.00 66.02 64.09 2gna s SER 290 CO 0.17 0.05 0.92 -0.36 0.41 0.00 0.00 173.24 174.43 2gna s PHE 291 N 1.16 3.43 0.63 2.43 0.08 -1.26 -4.90 117.98 119.55 2gna s PHE 291 Ca 0.06 1.39 0.25 0.00 0.12 0.00 0.00 56.93 58.74 2gna s PHE 291 Cb -0.14 -2.71 1.35 0.00 -0.57 0.00 0.00 43.02 40.95 2gna s PHE 291 CO 0.04 -0.25 1.76 1.96 -0.10 0.00 0.00 175.22 178.63 2gna h GLN 292 N 1.21 0.00 -3.03 0.44 1.08 -1.89 -3.28 115.11 109.63 2gna h GLN 292 Ca -0.47 0.00 -0.50 0.00 -1.45 0.00 0.00 58.65 56.23 2gna h GLN 292 Cb 1.18 0.00 -0.40 0.00 -0.05 0.00 0.00 27.48 28.21 2gna h GLN 292 CO 0.62 0.00 -0.76 -0.08 -0.95 0.00 0.00 178.83 177.66 2gna s THR 293 N -4.04 0.05 0.75 -0.54 -1.32 -1.26 -5.15 115.64 104.13 2gna s THR 293 Ca -0.03 -0.53 -0.16 0.00 -1.21 0.00 0.00 61.69 59.77 2gna s THR 293 Cb 0.07 -0.86 -0.02 0.00 -1.51 0.00 0.00 72.50 70.18 2gna s THR 293 CO 0.23 -0.48 0.56 -2.65 -2.21 0.00 0.00 174.62 170.06 2gna n PRO 294 N 5.22 0.24 -4.10 7.08 -0.02 -1.24 -5.05 135.00 137.12 2gna n PRO 294 Ca -0.06 0.13 -0.14 0.00 -2.02 0.00 0.00 63.50 61.40 2gna n PRO 294 Cb 0.45 -1.87 -0.12 0.00 -0.02 0.00 0.00 33.50 31.95 2gna n PRO 294 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2gna s LYS 295 N -2.93 0.59 -0.61 -0.52 -0.14 -1.26 -5.08 119.74 109.79 2gna s LYS 295 Ca 0.65 -0.75 -0.06 0.00 -1.36 0.00 0.00 55.97 54.45 2gna s LYS 295 Cb -0.33 -0.42 0.16 0.00 -1.68 0.00 0.00 37.83 35.56 2gna s LYS 295 CO 0.58 0.09 0.46 0.34 -0.76 0.00 0.00 175.35 176.06 2gna s ASP 296 N -1.48 5.62 0.00 2.83 2.15 -1.26 -4.92 116.67 119.61 2gna s ASP 296 Ca -0.07 -2.55 0.20 0.00 0.43 0.00 0.00 52.55 50.56 2gna s ASP 296 Cb -0.09 -1.95 1.15 0.00 -0.30 0.00 0.00 42.92 41.73 2gna s ASP 296 CO 0.01 -0.49 1.61 -1.22 -0.17 0.00 0.00 175.17 174.91 2gna n TYR 297 N 3.98 0.00 1.61 -5.34 4.01 -1.26 -2.74 117.16 117.43 2gna n TYR 297 Ca 0.05 0.00 0.15 0.00 -0.16 0.00 0.00 57.90 57.94 2gna n TYR 297 Cb 0.40 -0.09 0.78 0.00 -0.31 0.00 0.00 39.34 40.12 2gna n TYR 297 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 2gna n THR 298 N -1.09 0.00 -3.55 -0.72 -2.24 -1.26 -4.55 114.28 100.87 2gna n THR 298 Ca 0.13 -0.03 -0.25 0.00 -2.27 0.00 0.00 64.05 61.64 2gna n THR 298 Cb 0.10 -0.36 -0.15 0.00 -2.10 0.00 0.00 70.33 67.82 2gna n THR 298 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2gna s LEU 299 N -2.34 0.27 1.26 3.22 2.96 -1.11 -1.34 118.68 121.61 2gna s LEU 299 Ca 0.35 -0.76 -0.19 0.00 -0.22 0.00 0.00 54.13 53.31 2gna s LEU 299 Cb 0.21 -0.10 0.31 0.00 0.50 0.00 0.00 46.19 47.11 2gna s LEU 299 CO 0.43 -0.38 1.04 0.42 -1.32 0.00 0.00 176.35 176.55 2gna s THR 300 N 2.18 1.53 -0.68 3.68 -4.23 -0.86 -4.82 115.64 112.44 2gna s THR 300 Ca 0.06 0.00 0.23 0.00 -1.18 0.00 0.00 61.69 60.79 2gna s THR 300 Cb -0.16 -2.32 0.23 0.00 1.34 0.00 0.00 72.50 71.59 2gna s THR 300 CO -0.20 0.00 1.69 0.29 -0.54 0.00 0.00 174.62 175.86 2gna n LYS 301 N -5.03 0.15 -0.75 3.99 4.76 -0.58 -1.46 118.16 119.25 2gna n LYS 301 Ca 0.11 0.31 0.08 0.00 -2.87 0.00 0.00 58.31 55.95 2gna n LYS 301 Cb 0.59 -1.75 0.38 0.00 -1.84 0.00 0.00 35.03 32.40 2gna n LYS 301 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2gna n LEU 302 N -2.03 5.17 -3.30 -0.35 4.77 -1.26 -4.94 117.00 115.06 2gna n LEU 302 Ca 0.03 -2.61 -0.24 0.00 -0.03 0.00 0.00 56.01 53.16 2gna n LEU 302 Cb 0.26 -0.63 0.02 0.00 -2.33 0.00 0.00 43.42 40.74 2gna n LEU 302 CO 0.21 0.71 -0.00 1.41 -1.33 0.00 0.00 177.39 178.39 2gna n HIS 303 N 0.87 -1.93 -3.40 -1.77 8.25 -0.53 -4.97 115.22 111.74 2gna n HIS 303 Ca 0.26 0.54 -0.38 0.00 -0.26 0.00 0.00 57.72 57.89 2gna n HIS 303 Cb 1.03 -3.66 -0.06 0.00 1.12 0.00 0.00 29.99 28.42 2gna n HIS 303 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2gna s GLU 304 N -5.97 4.07 -0.15 -0.41 2.02 -1.26 -4.83 118.70 112.18 2gna s GLU 304 Ca 0.40 0.51 -0.10 0.00 0.02 0.00 0.00 54.97 55.79 2gna s GLU 304 Cb -0.20 -3.26 -0.05 0.00 0.10 0.00 0.00 34.13 30.72 2gna s GLU 304 CO 0.49 0.58 0.20 0.21 0.02 0.00 0.00 175.26 176.76 2gna s LYS 305 N -0.78 3.95 0.09 1.61 2.47 -1.26 -2.04 119.74 123.78 2gna s LYS 305 Ca 0.26 -0.06 0.10 0.00 -1.56 0.00 0.00 55.97 54.70 2gna s LYS 305 Cb -0.17 -3.33 -0.04 0.00 -1.46 0.00 0.00 37.83 32.83 2gna s LYS 305 CO 0.14 0.47 -0.26 0.20 0.16 0.00 0.00 175.35 176.06 2gna s GLY 306 N -0.17 1.52 0.16 5.54 0.00 -0.45 -4.76 107.32 109.16 2gna s GLY 306 Ca 0.14 -1.38 0.10 0.00 0.00 0.00 0.00 44.72 43.58 2gna s GLY 306 CO 0.03 -1.32 -0.19 -0.86 0.00 0.00 0.00 173.10 170.75 2gna s GLN 307 N -1.73 1.70 1.09 2.90 -2.07 0.52 -4.80 119.66 117.26 2gna s GLN 307 Ca 0.13 -1.35 -0.12 0.00 -1.82 0.00 0.00 55.36 52.20 2gna s GLN 307 Cb -0.10 -2.00 0.24 0.00 -1.09 0.00 0.00 33.01 30.06 2gna s GLN 307 CO 0.05 0.44 1.06 0.15 -1.32 0.00 0.00 175.29 175.66 2gna s LYS 308 N -2.49 -0.31 0.38 9.60 1.02 -1.26 0.18 119.74 126.86 2gna s LYS 308 Ca 0.20 1.00 0.08 0.00 0.02 0.00 0.00 55.97 57.27 2gna s LYS 308 Cb -0.09 -1.61 -0.04 0.00 -0.52 0.00 0.00 37.83 35.56 2gna s LYS 308 CO 0.11 -3.36 0.20 0.14 -0.92 0.00 0.00 175.35 171.51 2gna s VAL 309 N -2.55 2.67 0.53 3.17 -7.23 -1.26 -4.59 120.40 111.14 2gna s VAL 309 Ca 0.68 -1.63 -0.22 0.00 -1.81 0.00 0.00 61.98 58.99 2gna s VAL 309 Cb -0.24 -2.99 -0.06 0.00 0.56 0.00 0.00 36.38 33.66 2gna s VAL 309 CO 0.62 -0.08 1.37 0.00 -0.31 0.00 0.00 175.10 176.71 2gna s ALA 310 N -2.50 2.90 0.00 1.32 0.00 -1.26 -4.92 121.76 117.30 2gna s ALA 310 Ca 0.41 1.35 0.00 0.00 0.00 0.00 0.00 51.96 53.72 2gna s ALA 310 Cb -0.00 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.55 2gna s ALA 310 CO 0.24 -1.33 0.51 -2.30 0.00 0.00 0.00 175.76 172.87 2gna n PRO 311 N -0.86 0.00 -1.75 0.00 -0.02 -1.26 -1.83 135.00 129.29 2gna n PRO 311 Ca 0.09 0.51 -0.33 0.00 -2.02 0.00 0.00 63.50 61.75 2gna n PRO 311 Cb 0.44 -0.79 -0.02 0.00 -0.02 0.00 0.00 33.50 33.11 2gna n PRO 311 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2gna n ASP 312 N -2.19 7.02 -4.88 2.55 5.75 -1.26 -4.46 116.55 119.08 2gna n ASP 312 Ca 0.00 -3.43 -0.30 0.00 -0.01 0.00 0.00 54.79 51.05 2gna n ASP 312 Cb 0.00 -1.19 0.03 0.00 -1.03 0.00 0.00 41.12 38.92 2gna n ASP 312 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 2gna s PHE 313 N -2.56 3.49 -0.30 2.11 5.36 -0.76 -5.02 117.98 120.31 2gna s PHE 313 Ca 0.55 1.17 -0.16 0.00 -0.96 0.00 0.00 56.93 57.53 2gna s PHE 313 Cb 0.37 -2.86 0.17 0.00 -0.34 0.00 0.00 43.02 40.36 2gna s PHE 313 CO -0.27 -0.89 1.05 -2.00 -1.46 0.00 0.00 175.22 171.66 2gna s GLU 314 N -5.24 0.27 -0.72 10.12 2.12 -1.26 -4.04 118.70 119.94 2gna s GLU 314 Ca 0.56 0.54 -0.19 0.00 0.36 0.00 0.00 54.97 56.25 2gna s GLU 314 Cb -0.11 0.18 0.12 0.00 0.26 0.00 0.00 34.13 34.58 2gna s GLU 314 CO 0.53 -0.07 0.85 -0.47 -0.54 0.00 0.00 175.26 175.56 2gna s TYR 315 N 1.71 3.11 0.30 5.30 6.04 -0.75 -4.94 117.35 128.13 2gna s TYR 315 Ca -0.06 -1.18 0.09 0.00 0.04 0.00 0.00 57.07 55.96 2gna s TYR 315 Cb -0.04 -4.09 -0.05 0.00 -1.04 0.00 0.00 41.96 36.75 2gna s TYR 315 CO -0.15 -1.34 0.02 -1.12 -1.54 0.00 0.00 175.55 171.42 2gna s SER 316 N 3.41 4.43 0.00 4.32 0.01 -1.26 0.03 113.70 124.64 2gna s SER 316 Ca 0.19 -0.78 0.27 0.00 1.31 0.00 0.00 55.95 56.94 2gna s SER 316 Cb -0.16 -0.71 1.56 0.00 0.21 0.00 0.00 66.02 66.91 2gna s SER 316 CO 0.00 -0.12 2.01 -1.54 0.41 0.00 0.00 173.24 174.01 2gna n SER 317 N -0.95 0.11 -0.05 2.44 3.41 -0.80 -3.32 113.62 114.45 2gna n SER 317 Ca -0.05 -1.19 -0.06 0.00 -0.26 0.00 0.00 58.87 57.31 2gna n SER 317 Cb 0.60 -0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.49 2gna n SER 317 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gna n HIS 318 N -0.84 0.00 -1.29 7.33 1.44 -1.26 -4.48 115.22 116.12 2gna n HIS 318 Ca 0.20 0.00 -0.25 0.00 -2.01 0.00 0.00 57.72 55.66 2gna n HIS 318 Cb 0.11 -0.44 0.15 0.00 0.12 0.00 0.00 29.99 29.93 2gna n HIS 318 CO 0.00 0.00 0.00 0.27 -2.81 0.00 0.00 176.34 173.80 2gna n ASN 319 N -2.61 4.69 -4.87 4.39 6.94 -1.24 -4.94 115.26 117.61 2gna n ASN 319 Ca -0.18 -3.67 -0.33 0.00 -0.02 0.00 0.00 54.58 50.38 2gna n ASN 319 Cb 0.75 -0.85 -0.05 0.00 -2.36 0.00 0.00 39.78 37.26 2gna n ASN 319 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 2gna s ASN 320 N -1.57 6.62 0.00 0.53 2.47 -1.21 -4.75 114.94 117.02 2gna s ASN 320 Ca 0.58 0.80 0.24 0.00 0.42 0.00 0.00 52.86 54.90 2gna s ASN 320 Cb 0.48 -2.18 0.32 0.00 -1.45 0.00 0.00 41.25 38.43 2gna s ASN 320 CO 0.07 0.08 1.29 -0.46 -3.72 0.00 0.00 177.10 174.35 2gna n ASN 321 N 0.44 0.89 -4.48 -4.21 6.94 -1.26 -4.84 115.26 108.75 2gna n ASN 321 Ca -0.04 -0.70 -0.35 0.00 -0.02 0.00 0.00 54.58 53.46 2gna n ASN 321 Cb 0.52 0.43 -0.12 0.00 -2.36 0.00 0.00 39.78 38.25 2gna n ASN 321 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 2gna s GLN 322 N -2.84 3.69 0.13 -3.83 -0.21 -1.26 -5.07 119.66 110.28 2gna s GLN 322 Ca 0.14 -0.47 0.06 0.00 0.02 0.00 0.00 55.36 55.10 2gna s GLN 322 Cb 0.18 -3.19 -0.04 0.00 1.00 0.00 0.00 33.01 30.95 2gna s GLN 322 CO 0.69 -0.01 -0.13 -1.58 -2.12 0.00 0.00 175.29 172.14 2gna s TRP 323 N 1.11 1.37 -0.31 0.91 0.52 -1.26 -0.46 118.94 120.82 2gna s TRP 323 Ca 0.03 -0.61 -0.00 0.00 0.02 0.00 0.00 56.10 55.53 2gna s TRP 323 Cb -0.14 -0.70 0.06 0.00 -1.15 0.00 0.00 33.47 31.54 2gna s TRP 323 CO 0.02 0.14 0.01 -1.17 0.02 0.00 0.00 176.95 175.97 2gna s LEU 324 N -2.72 4.07 0.71 2.99 2.96 -0.79 -4.90 118.68 121.00 2gna s LEU 324 Ca 0.12 -1.48 -0.09 0.00 -0.22 0.00 0.00 54.13 52.46 2gna s LEU 324 Cb -0.02 -1.69 0.05 0.00 0.50 0.00 0.00 46.19 45.03 2gna s LEU 324 CO 0.03 -0.30 1.06 -1.61 -1.32 0.00 0.00 176.35 174.21 2gna s GLU 325 N 1.18 2.37 0.00 1.98 8.01 -1.26 -4.69 118.70 126.28 2gna s GLU 325 Ca -0.03 0.01 0.00 0.00 0.01 0.00 0.00 54.97 54.97 2gna s GLU 325 Cb -0.20 -2.10 0.00 0.00 -4.31 0.00 0.00 34.13 27.52 2gna s GLU 325 CO -0.03 -1.21 0.56 -2.30 0.01 0.00 0.00 175.26 172.29 2gna n PRO 326 N -2.99 0.00 -0.31 0.39 -0.02 -1.26 -1.12 135.00 129.69 2gna n PRO 326 Ca 0.07 0.56 0.13 0.00 -2.02 0.00 0.00 63.50 62.24 2gna n PRO 326 Cb 0.60 -0.94 0.27 0.00 -0.02 0.00 0.00 33.50 33.41 2gna n PRO 326 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 2gna h ASP 327 N 0.00 -0.27 -0.94 2.55 2.03 -1.92 0.23 116.42 118.09 2gna h ASP 327 Ca 0.00 0.24 0.26 0.00 -0.73 0.00 0.00 57.03 56.80 2gna h ASP 327 Cb 0.00 0.38 -0.05 0.00 -0.83 0.00 0.00 39.33 38.83 2gna h ASP 327 CO 0.00 -0.26 0.67 0.44 -1.03 0.00 0.00 179.24 179.06 2gna h ASP 328 N 0.09 0.09 0.00 4.15 3.32 -1.49 -3.14 116.42 119.44 2gna h ASP 328 Ca 0.55 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.62 2gna h ASP 328 Cb 1.13 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.67 2gna h ASP 328 CO -0.78 0.03 0.00 -0.11 -1.72 0.00 0.00 179.24 176.66 2gna n LEU 329 N -4.32 0.29 -0.00 1.55 7.94 0.82 -3.95 117.00 119.33 2gna n LEU 329 Ca 0.20 0.67 -0.00 0.00 -1.11 0.00 0.00 56.01 55.77 2gna n LEU 329 Cb 0.96 -0.39 0.00 0.00 0.53 0.00 0.00 43.42 44.52 2gna n LEU 329 CO 0.37 -0.39 0.00 0.18 -1.11 0.00 0.00 177.39 176.44 2gna n LEU 330 N -1.67 -0.00 -0.40 -1.96 7.99 -1.19 0.27 117.00 120.05 2gna n LEU 330 Ca 0.00 0.00 0.32 0.00 -0.01 0.00 0.00 56.01 56.32 2gna n LEU 330 Cb 0.00 -0.00 0.51 0.00 -0.11 0.00 0.00 43.42 43.82 2gna n LEU 330 CO 0.00 -0.00 0.92 0.29 -1.51 0.00 0.00 177.39 177.09 2gna n LYS 331 N -4.00 -0.01 0.00 3.23 5.02 -1.25 -2.17 118.16 118.97 2gna n LYS 331 Ca 0.00 0.80 0.00 0.00 -2.02 0.00 0.00 58.31 57.09 2gna n LYS 331 Cb 0.00 -1.70 0.00 0.00 -0.02 0.00 0.00 35.03 33.31 2gna n LYS 331 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2gna n LEU 332 N -3.70 0.58 0.00 -0.35 4.77 0.14 -5.20 117.00 113.25 2gna n LEU 332 Ca 0.29 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 2gna n LEU 332 Cb 1.22 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 42.07 2gna n LEU 332 CO 0.21 -0.25 0.00 -0.11 -1.33 0.00 0.00 177.39 175.91