#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dxl s LEU 2 N 0.00 1.22 -0.09 -0.89 2.96 -1.26 -1.17 118.68 119.46 2dxl s LEU 2 Ca 0.00 -0.32 0.03 0.00 -0.22 0.00 0.00 54.13 53.62 2dxl s LEU 2 Cb 0.00 -0.87 -0.01 0.00 0.50 0.00 0.00 46.19 45.81 2dxl s LEU 2 CO 0.00 -0.11 -0.18 -0.76 -1.32 0.00 0.00 176.35 173.97 2dxl s LEU 3 N 1.68 2.44 -0.35 -0.68 1.02 0.15 0.78 118.68 123.72 2dxl s LEU 3 Ca 0.05 -0.39 -0.14 0.00 0.02 0.00 0.00 54.13 53.66 2dxl s LEU 3 Cb -0.13 -1.50 -0.01 0.00 0.02 0.00 0.00 46.19 44.57 2dxl s LEU 3 CO -0.08 0.22 0.31 0.00 0.02 0.00 0.00 176.35 176.82 2dxl s ALA 4 N 0.01 3.50 -0.29 4.21 0.00 -0.75 -0.51 121.76 127.92 2dxl s ALA 4 Ca -0.06 -1.31 -0.02 0.00 0.00 0.00 0.00 51.96 50.57 2dxl s ALA 4 Cb -0.15 -2.77 0.04 0.00 0.00 0.00 0.00 23.12 20.24 2dxl s ALA 4 CO 0.05 -1.06 0.00 -1.58 0.00 0.00 0.00 175.76 173.17 2dxl s HIS 5 N 1.89 3.22 0.35 0.00 2.46 0.14 -0.57 115.29 122.78 2dxl s HIS 5 Ca 0.09 -1.72 0.09 0.00 0.47 0.00 0.00 55.06 53.99 2dxl s HIS 5 Cb -0.17 -2.12 -0.06 0.00 -0.13 0.00 0.00 32.58 30.10 2dxl s HIS 5 CO 0.11 -0.77 -0.05 0.96 -2.47 0.00 0.00 174.74 172.52 2dxl s ILE 6 N 1.29 2.36 0.10 0.89 -4.36 0.31 -1.39 121.20 120.41 2dxl s ILE 6 Ca -0.04 -2.10 -0.15 0.00 -0.26 0.00 0.00 60.65 58.10 2dxl s ILE 6 Cb -0.19 -2.73 0.03 0.00 1.25 0.00 0.00 42.46 40.82 2dxl s ILE 6 CO -0.01 -0.19 0.37 -0.55 0.24 0.00 0.00 174.94 174.81 2dxl s SER 7 N -3.66 -0.20 -1.21 4.36 0.15 -1.26 -2.06 113.70 109.83 2dxl s SER 7 Ca 0.34 -0.28 -0.06 0.00 0.70 0.00 0.00 55.95 56.65 2dxl s SER 7 Cb 0.02 0.44 -0.02 0.00 -1.71 0.00 0.00 66.02 64.75 2dxl s SER 7 CO 0.18 -0.78 0.79 0.47 1.20 0.00 0.00 173.24 175.10 2dxl n ASP 8 N 0.01 -3.30 0.10 5.45 8.00 -1.26 -2.27 116.55 123.27 2dxl n ASP 8 Ca -0.17 -0.82 -0.02 0.00 0.71 0.00 0.00 54.79 54.49 2dxl n ASP 8 Cb 0.62 -4.25 0.22 0.00 -0.02 0.00 0.00 41.12 37.69 2dxl n ASP 8 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 2dxl h THR 9 N -1.71 1.33 -6.23 -3.53 1.35 -1.77 -3.34 112.91 99.01 2dxl h THR 9 Ca -0.62 -1.62 -0.45 0.00 -0.55 0.00 0.00 66.41 63.17 2dxl h THR 9 Cb 1.35 1.77 0.01 0.00 -1.73 0.00 0.00 68.15 69.54 2dxl h THR 9 CO 0.51 0.48 -0.82 1.41 -0.25 0.00 0.00 175.52 176.85 2dxl n HIS 10 N -3.99 -1.97 -1.61 4.73 8.25 -0.30 -4.83 115.22 115.49 2dxl n HIS 10 Ca -0.02 0.84 -0.38 0.00 -0.26 0.00 0.00 57.72 57.91 2dxl n HIS 10 Cb 0.50 -4.14 0.05 0.00 1.12 0.00 0.00 29.99 27.53 2dxl n HIS 10 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2dxl n PHE 11 N -4.41 0.78 -4.64 4.41 3.01 -0.32 -4.02 117.46 112.27 2dxl n PHE 11 Ca -0.20 0.43 -0.31 0.00 1.01 0.00 0.00 57.45 58.38 2dxl n PHE 11 Cb 0.63 -2.13 -0.08 0.00 -0.01 0.00 0.00 39.48 37.90 2dxl n PHE 11 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2dxl s ARG 12 N -2.79 2.16 1.07 -1.08 1.81 -1.26 -1.19 118.95 117.67 2dxl s ARG 12 Ca 0.76 -2.29 -0.12 0.00 -1.72 0.00 0.00 55.73 52.36 2dxl s ARG 12 Cb -0.41 -1.62 0.23 0.00 -0.45 0.00 0.00 34.95 32.70 2dxl s ARG 12 CO 0.46 -0.31 1.06 -1.12 -0.68 0.00 0.00 175.30 174.71 2dxl s SER 13 N -3.88 1.82 0.13 0.23 0.01 -1.26 -4.54 113.70 106.20 2dxl s SER 13 Ca 0.15 1.47 -0.30 0.00 1.31 0.00 0.00 55.95 58.58 2dxl s SER 13 Cb 0.03 -2.18 -0.07 0.00 0.21 0.00 0.00 66.02 64.01 2dxl s SER 13 CO 0.08 -3.67 1.58 -0.09 0.41 0.00 0.00 173.24 171.54 2dxl h ARG 14 N -2.26 -0.51 -0.94 12.44 2.43 -1.96 -2.16 114.38 121.42 2dxl h ARG 14 Ca -0.57 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 2dxl h ARG 14 Cb 1.32 0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 30.94 2dxl h ARG 14 CO 0.52 -0.34 0.61 0.78 -1.51 0.00 0.00 179.97 180.03 2dxl h GLY 15 N -0.53 1.34 -1.56 2.80 0.00 -1.98 -3.47 103.07 99.66 2dxl h GLY 15 Ca 0.06 -0.52 -0.48 0.00 0.00 0.00 0.00 47.33 46.39 2dxl h GLY 15 CO -0.39 0.50 0.22 -0.54 0.00 0.00 0.00 176.54 176.33 2dxl s GLU 16 N -6.02 3.08 0.10 4.80 0.41 -0.81 -5.11 118.70 115.16 2dxl s GLU 16 Ca -0.13 0.16 0.08 0.00 -0.41 0.00 0.00 54.97 54.68 2dxl s GLU 16 Cb 0.18 -2.24 -0.04 0.00 -1.78 0.00 0.00 34.13 30.25 2dxl s GLU 16 CO 0.81 -0.65 -0.21 0.15 -0.49 0.00 0.00 175.26 174.88 2dxl s LYS 17 N -5.01 1.13 0.08 1.61 1.02 -1.26 -4.68 119.74 112.62 2dxl s LYS 17 Ca 0.53 -1.17 -0.32 0.00 0.02 0.00 0.00 55.97 55.03 2dxl s LYS 17 Cb -0.11 -1.38 -0.12 0.00 -0.52 0.00 0.00 37.83 35.71 2dxl s LYS 17 CO 0.47 0.32 1.80 -0.11 -0.92 0.00 0.00 175.35 176.91 2dxl n LEU 18 N 1.05 3.70 -0.20 3.17 0.00 -0.02 -1.37 117.00 123.34 2dxl n LEU 18 Ca -0.19 1.00 -0.02 0.00 0.00 0.00 0.00 56.01 56.79 2dxl n LEU 18 Cb 0.54 -1.48 -0.01 0.00 0.00 0.00 0.00 43.42 42.47 2dxl n LEU 18 CO 0.23 0.02 -0.02 -1.22 0.00 0.00 0.00 177.39 176.39 2dxl n TYR 19 N 5.49 -0.01 0.00 1.96 0.53 -1.26 -1.38 117.16 122.49 2dxl n TYR 19 Ca 0.19 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 57.07 2dxl n TYR 19 Cb 0.34 -2.08 0.00 0.00 -1.03 0.00 0.00 39.34 36.57 2dxl n TYR 19 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2dxl n GLY 20 N 0.77 1.55 0.00 2.72 0.00 -0.47 -4.81 105.19 104.95 2dxl n GLY 20 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2dxl n GLY 20 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2dxl n PHE 21 N -2.00 0.00 -3.07 1.61 -1.74 -0.86 -4.79 117.46 106.61 2dxl n PHE 21 Ca 0.00 0.00 -0.42 0.00 -0.56 0.00 0.00 57.45 56.47 2dxl n PHE 21 Cb 0.00 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 40.94 2dxl n PHE 21 CO 0.00 0.00 0.00 0.42 -0.56 0.00 0.00 176.76 176.62 2dxl s ILE 22 N -0.04 4.87 -1.31 1.97 1.01 -0.48 -4.92 121.20 122.30 2dxl s ILE 22 Ca 0.00 0.77 -0.13 0.00 0.00 0.00 0.00 60.65 61.29 2dxl s ILE 22 Cb 0.00 -4.08 0.12 0.00 0.01 0.00 0.00 42.46 38.51 2dxl s ILE 22 CO 0.00 -0.28 1.82 -0.67 0.00 0.00 0.00 174.94 175.82 2dxl n ASP 23 N 6.07 4.81 -0.12 3.58 -0.08 -1.26 -0.84 116.55 128.71 2dxl n ASP 23 Ca -0.00 -2.97 0.03 0.00 -1.51 0.00 0.00 54.79 50.34 2dxl n ASP 23 Cb 0.49 -1.60 0.34 0.00 2.34 0.00 0.00 41.12 42.69 2dxl n ASP 23 CO 0.00 0.00 0.00 -0.37 0.12 0.00 0.00 177.20 176.95 2dxl h VAL 24 N 4.41 1.12 0.06 5.18 -1.51 -1.91 -0.91 116.25 122.68 2dxl h VAL 24 Ca 0.43 -0.26 -0.00 0.00 -1.23 0.00 0.00 66.70 65.63 2dxl h VAL 24 Cb 0.74 0.28 0.00 0.00 -2.13 0.00 0.00 31.29 30.18 2dxl h VAL 24 CO 1.56 0.14 -0.03 0.78 -1.23 0.00 0.00 177.57 178.79 2dxl h ASN 25 N 0.77 -0.07 0.11 4.19 2.35 -1.88 0.80 115.58 121.85 2dxl h ASN 25 Ca 0.23 -0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2dxl h ASN 25 Cb -0.01 0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 2dxl h ASN 25 CO -0.06 0.11 -0.10 0.00 -1.65 0.00 0.00 177.43 175.73 2dxl h ALA 26 N 0.69 -0.21 -0.60 -0.83 0.00 -1.87 -0.25 119.26 116.19 2dxl h ALA 26 Ca -0.01 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.96 2dxl h ALA 26 Cb 0.21 0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.08 2dxl h ALA 26 CO 0.01 -0.63 0.23 0.00 0.00 0.00 0.00 179.25 178.86 2dxl h ALA 27 N 0.64 0.77 -0.45 0.00 0.00 -1.04 0.59 119.26 119.76 2dxl h ALA 27 Ca 0.00 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 2dxl h ALA 27 Cb 0.22 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2dxl h ALA 27 CO -0.03 -0.19 -0.11 -0.91 0.00 0.00 0.00 179.25 178.01 2dxl h ASN 28 N 0.41 0.81 -0.76 0.00 -0.26 -0.60 0.95 115.58 116.13 2dxl h ASN 28 Ca 0.30 -0.25 -0.01 0.00 -0.56 0.00 0.00 56.30 55.78 2dxl h ASN 28 Cb 0.36 -0.22 -0.04 0.00 -1.06 0.00 0.00 38.32 37.37 2dxl h ASN 28 CO -0.30 0.94 0.44 0.00 -1.06 0.00 0.00 177.43 177.45 2dxl h ALA 29 N 1.13 1.32 0.48 -0.83 0.00 0.30 0.58 119.26 122.25 2dxl h ALA 29 Ca 0.12 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2dxl h ALA 29 Cb 0.61 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2dxl h ALA 29 CO 0.04 0.56 -0.23 0.22 0.00 0.00 0.00 179.25 179.84 2dxl h ASP 30 N 1.07 -0.55 -0.83 0.00 1.82 -0.53 -0.83 116.42 116.57 2dxl h ASP 30 Ca 0.27 -0.08 0.20 0.00 -0.39 0.00 0.00 57.03 57.04 2dxl h ASP 30 Cb -0.00 0.14 -0.15 0.00 0.68 0.00 0.00 39.33 40.00 2dxl h ASP 30 CO -0.05 -0.18 0.03 0.58 -1.61 0.00 0.00 179.24 178.01 2dxl h VAL 31 N -0.96 0.25 0.46 2.25 2.07 -0.37 0.45 116.25 120.39 2dxl h VAL 31 Ca -0.07 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 2dxl h VAL 31 Cb 0.59 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 2dxl h VAL 31 CO 0.11 0.02 -0.29 0.58 0.02 0.00 0.00 177.57 178.00 2dxl h VAL 32 N 0.10 0.39 -0.41 2.57 2.07 0.37 0.13 116.25 121.46 2dxl h VAL 32 Ca 0.47 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.99 2dxl h VAL 32 Cb 0.89 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 2dxl h VAL 32 CO -0.73 0.00 0.23 0.28 0.02 0.00 0.00 177.57 177.36 2dxl h SER 33 N -0.72 0.50 -0.03 0.57 0.02 0.03 0.09 113.55 114.01 2dxl h SER 33 Ca -0.05 -0.03 0.03 0.00 -0.84 0.00 0.00 61.79 60.90 2dxl h SER 33 Cb 0.60 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.97 2dxl h SER 33 CO 0.04 0.40 -0.19 -0.61 -1.14 0.00 0.00 176.83 175.33 2dxl h GLN 34 N 0.57 -0.28 0.23 3.45 4.15 0.25 -2.35 115.11 121.13 2dxl h GLN 34 Ca 0.15 0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.58 2dxl h GLN 34 Cb 0.02 0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.77 2dxl h GLN 34 CO -0.03 -0.19 -0.11 -0.07 -1.93 0.00 0.00 178.83 176.51 2dxl h LEU 35 N -0.29 -0.26 -0.02 -2.39 3.38 0.88 -2.22 115.31 114.38 2dxl h LEU 35 Ca 0.07 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2dxl h LEU 35 Cb 0.38 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2dxl h LEU 35 CO -0.20 0.02 0.00 -0.46 0.09 0.00 0.00 178.44 177.89 2dxl n ASN 36 N -5.12 0.02 -0.51 -0.43 0.23 -0.38 -1.05 115.26 108.01 2dxl n ASN 36 Ca -0.09 -1.67 0.10 0.00 -0.53 0.00 0.00 54.58 52.39 2dxl n ASN 36 Cb 0.22 -0.01 0.01 0.00 -2.08 0.00 0.00 39.78 37.92 2dxl n ASN 36 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2dxl n ALA 37 N -0.49 3.23 -1.67 -2.53 0.00 -0.85 -4.98 120.51 113.22 2dxl n ALA 37 Ca 0.00 -0.61 -0.41 0.00 0.00 0.00 0.00 53.44 52.42 2dxl n ALA 37 Cb 0.00 -0.70 0.01 0.00 0.00 0.00 0.00 19.45 18.77 2dxl n ALA 37 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dxl n LEU 38 N 0.16 3.60 -0.03 0.00 4.77 -0.22 -4.94 117.00 120.35 2dxl n LEU 38 Ca 0.09 1.08 -0.15 0.00 -0.03 0.00 0.00 56.01 57.00 2dxl n LEU 38 Cb 0.43 -1.45 -0.11 0.00 -2.33 0.00 0.00 43.42 39.96 2dxl n LEU 38 CO 0.23 -0.94 0.42 -0.09 -1.33 0.00 0.00 177.39 175.69 2dxl h ARG 39 N 1.86 0.17 -5.21 3.23 2.43 -1.94 -3.38 114.38 111.54 2dxl h ARG 39 Ca -0.47 -0.17 -0.66 0.00 -0.81 0.00 0.00 59.98 57.88 2dxl h ARG 39 Cb 1.31 0.04 -0.16 0.00 -0.42 0.00 0.00 29.97 30.74 2dxl h ARG 39 CO 0.59 0.88 0.29 -1.21 -1.51 0.00 0.00 179.97 179.01 2dxl s GLU 40 N -3.26 3.15 -0.05 0.20 2.02 -1.26 -5.03 118.70 114.47 2dxl s GLU 40 Ca -0.16 -0.83 -0.27 0.00 0.02 0.00 0.00 54.97 53.73 2dxl s GLU 40 Cb 0.01 -4.16 -0.03 0.00 0.10 0.00 0.00 34.13 30.06 2dxl s GLU 40 CO 0.74 -1.49 0.87 1.03 0.02 0.00 0.00 175.26 176.43 2dxl s ARG 41 N 3.27 4.48 0.83 1.61 0.52 -1.26 -5.04 118.95 123.37 2dxl s ARG 41 Ca 0.19 1.19 -0.11 0.00 -0.52 0.00 0.00 55.73 56.49 2dxl s ARG 41 Cb -0.18 -3.47 0.09 0.00 0.52 0.00 0.00 34.95 31.91 2dxl s ARG 41 CO 0.12 -0.05 1.11 -1.25 0.02 0.00 0.00 175.30 175.24 2dxl s PRO 42 N 1.10 1.74 0.28 3.54 0.04 -1.26 -4.92 135.00 135.51 2dxl s PRO 42 Ca 0.45 1.23 0.15 0.00 0.04 0.00 0.00 61.00 62.88 2dxl s PRO 42 Cb -0.19 -1.83 0.06 0.00 0.04 0.00 0.00 34.50 32.58 2dxl s PRO 42 CO 0.22 -2.03 1.42 -0.44 0.04 0.00 0.00 177.00 176.22 2dxl h ASP 43 N -1.41 0.00 -4.94 6.66 3.32 -0.02 -3.48 116.42 116.54 2dxl h ASP 43 Ca -0.44 0.00 0.08 0.00 0.02 0.00 0.00 57.03 56.69 2dxl h ASP 43 Cb 1.25 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.68 2dxl h ASP 43 CO 0.49 0.49 0.37 0.00 -1.72 0.00 0.00 179.24 178.87 2dxl s ALA 44 N -2.97 -1.64 -0.12 3.45 0.00 -1.21 -4.41 121.76 114.86 2dxl s ALA 44 Ca 0.04 0.50 0.03 0.00 0.00 0.00 0.00 51.96 52.53 2dxl s ALA 44 Cb 0.07 0.66 0.00 0.00 0.00 0.00 0.00 23.12 23.86 2dxl s ALA 44 CO 0.75 -0.83 -0.22 0.08 0.00 0.00 0.00 175.76 175.53 2dxl s VAL 45 N -3.45 2.13 -0.17 0.00 1.01 -0.09 -1.81 120.40 118.02 2dxl s VAL 45 Ca 0.06 -0.98 -0.08 0.00 0.00 0.00 0.00 61.98 60.99 2dxl s VAL 45 Cb -0.02 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 2dxl s VAL 45 CO -0.06 0.55 0.09 -0.69 0.00 0.00 0.00 175.10 175.00 2dxl s VAL 46 N 0.55 5.08 -0.33 2.92 1.01 0.27 -0.49 120.40 129.41 2dxl s VAL 46 Ca -0.13 0.06 0.02 0.00 0.00 0.00 0.00 61.98 61.93 2dxl s VAL 46 Cb -0.17 -3.27 0.10 0.00 0.00 0.00 0.00 36.38 33.04 2dxl s VAL 46 CO 0.04 0.50 0.07 -0.69 0.00 0.00 0.00 175.10 175.02 2dxl s VAL 47 N -0.02 1.70 -0.31 2.92 1.01 0.07 -0.53 120.40 125.25 2dxl s VAL 47 Ca 0.08 -1.94 0.02 0.00 0.00 0.00 0.00 61.98 60.13 2dxl s VAL 47 Cb -0.12 -2.26 0.20 0.00 0.00 0.00 0.00 36.38 34.20 2dxl s VAL 47 CO 0.00 -0.62 1.15 -1.54 0.00 0.00 0.00 175.10 174.09 2dxl n SER 48 N 4.50 2.98 -4.35 3.32 3.41 -0.87 -1.98 113.62 120.62 2dxl n SER 48 Ca 0.01 -2.40 -0.18 0.00 -0.26 0.00 0.00 58.87 56.04 2dxl n SER 48 Cb 0.42 -0.58 0.03 0.00 -0.26 0.00 0.00 64.21 63.82 2dxl n SER 48 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dxl n GLY 49 N 0.07 2.30 3.46 5.00 0.00 -1.03 -4.18 105.19 110.82 2dxl n GLY 49 Ca 0.14 -2.24 -0.43 0.00 0.00 0.00 0.00 46.02 43.49 2dxl n GLY 49 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dxl s ASP 50 N -3.80 6.57 0.23 1.61 1.01 -1.26 -0.72 116.67 120.30 2dxl s ASP 50 Ca 0.39 -1.87 -0.08 0.00 0.71 0.00 0.00 52.55 51.71 2dxl s ASP 50 Cb -0.03 -2.42 0.23 0.00 1.01 0.00 0.00 42.92 41.71 2dxl s ASP 50 CO 0.25 -1.15 1.88 0.40 0.21 0.00 0.00 175.17 176.76 2dxl h ILE 51 N 5.96 1.15 -2.01 0.77 5.03 -1.92 -0.76 117.51 125.74 2dxl h ILE 51 Ca 0.12 -0.37 -0.60 0.00 -0.12 0.00 0.00 64.86 63.89 2dxl h ILE 51 Cb 1.03 -0.00 -0.12 0.00 -3.03 0.00 0.00 36.82 34.69 2dxl h ILE 51 CO 1.15 0.19 -0.67 0.68 -0.68 0.00 0.00 178.15 178.82 2dxl s VAL 52 N -6.11 2.50 -0.06 1.67 -7.23 -1.26 -1.17 120.40 108.73 2dxl s VAL 52 Ca -0.13 -2.15 -0.05 0.00 -1.81 0.00 0.00 61.98 57.83 2dxl s VAL 52 Cb 0.17 -2.64 -0.28 0.00 0.56 0.00 0.00 36.38 34.19 2dxl s VAL 52 CO 0.79 -0.26 0.61 -1.13 -0.31 0.00 0.00 175.10 174.80 2dxl h ASN 53 N 2.00 0.44 -0.01 4.85 -0.73 -1.29 -3.40 115.58 117.44 2dxl h ASN 53 Ca -0.42 -0.76 0.00 0.00 1.87 0.00 0.00 56.30 56.99 2dxl h ASN 53 Cb 1.25 -0.14 0.00 0.00 0.27 0.00 0.00 38.32 39.70 2dxl h ASN 53 CO 0.66 1.66 -0.09 0.00 -0.37 0.00 0.00 177.43 179.30 2dxl n GLY 55 N 0.64 0.56 3.90 0.00 0.00 -1.05 -4.96 105.19 104.28 2dxl n GLY 55 Ca 0.04 -0.75 -0.31 0.00 0.00 0.00 0.00 46.02 45.00 2dxl n GLY 55 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dxl s ARG 56 N -3.15 3.60 0.13 1.61 0.52 -1.26 -4.63 118.95 115.76 2dxl s ARG 56 Ca 0.00 -0.13 -0.19 0.00 -0.52 0.00 0.00 55.73 54.89 2dxl s ARG 56 Cb 0.00 -2.86 -0.06 0.00 0.52 0.00 0.00 34.95 32.55 2dxl s ARG 56 CO 0.00 0.48 1.77 -1.35 0.02 0.00 0.00 175.30 176.22 2dxl h PRO 57 N 2.81 0.31 0.00 3.54 0.11 -1.98 -2.29 132.00 134.50 2dxl h PRO 57 Ca -0.46 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2dxl h PRO 57 Cb 1.16 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2dxl h PRO 57 CO 0.73 0.22 -0.04 1.05 -0.21 0.00 0.00 178.00 179.75 2dxl h GLU 58 N 0.31 0.00 -0.23 1.05 9.09 -1.97 0.20 114.58 123.03 2dxl h GLU 58 Ca 0.09 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.40 2dxl h GLU 58 Cb -0.02 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.07 2dxl h GLU 58 CO -0.02 0.04 -0.25 0.93 0.05 0.00 0.00 179.01 179.76 2dxl h GLU 59 N 0.00 0.57 -0.19 1.06 5.08 -1.68 -2.84 114.58 116.58 2dxl h GLU 59 Ca -0.00 -0.31 -0.06 0.00 -1.00 0.00 0.00 59.36 57.99 2dxl h GLU 59 Cb 0.31 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2dxl h GLU 59 CO 0.01 0.90 -0.14 1.88 -1.00 0.00 0.00 179.01 180.66 2dxl h TYR 60 N 0.26 0.32 -0.34 4.33 0.05 -0.52 -0.41 116.97 120.65 2dxl h TYR 60 Ca 0.03 -0.04 0.04 0.00 0.05 0.00 0.00 58.73 58.82 2dxl h TYR 60 Cb 0.81 -0.09 -0.04 0.00 1.01 0.00 0.00 36.73 38.42 2dxl h TYR 60 CO 0.08 0.43 0.09 1.96 -1.05 0.00 0.00 178.16 179.68 2dxl h GLN 61 N 0.28 0.22 -0.14 4.88 4.20 -0.66 0.16 115.11 124.05 2dxl h GLN 61 Ca 0.06 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 2dxl h GLN 61 Cb 0.42 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2dxl h GLN 61 CO 0.02 0.15 0.03 0.28 -0.67 0.00 0.00 178.83 178.64 2dxl h VAL 62 N 0.23 1.21 -0.36 -0.54 2.07 -1.18 -2.59 116.25 115.09 2dxl h VAL 62 Ca 0.16 -0.66 0.01 0.00 0.82 0.00 0.00 66.70 67.03 2dxl h VAL 62 Cb 0.16 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 2dxl h VAL 62 CO -0.18 0.19 0.22 0.00 0.02 0.00 0.00 177.57 177.82 2dxl h ALA 63 N 0.82 0.45 -0.90 1.67 0.00 -0.91 -1.12 119.26 119.28 2dxl h ALA 63 Ca 0.04 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.03 2dxl h ALA 63 Cb 0.27 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.87 2dxl h ALA 63 CO 0.00 -0.11 0.54 -0.09 0.00 0.00 0.00 179.25 179.59 2dxl h ARG 64 N 0.45 0.90 -0.05 0.00 2.43 -0.63 0.22 114.38 117.71 2dxl h ARG 64 Ca 0.14 -0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.19 2dxl h ARG 64 Cb -0.02 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.33 2dxl h ARG 64 CO -0.05 0.59 -0.19 0.37 -1.51 0.00 0.00 179.97 179.18 2dxl h GLN 65 N 0.92 0.22 0.18 0.20 4.15 -1.01 0.39 115.11 120.17 2dxl h GLN 65 Ca 0.42 -0.17 -0.01 0.00 0.77 0.00 0.00 58.65 59.66 2dxl h GLN 65 Cb 0.33 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.06 2dxl h GLN 65 CO -0.23 0.81 -0.09 0.82 -1.93 0.00 0.00 178.83 178.21 2dxl h ILE 66 N -0.32 0.92 -0.17 2.39 2.04 -1.01 -2.15 117.51 119.20 2dxl h ILE 66 Ca -0.01 -0.85 -0.02 0.00 1.00 0.00 0.00 64.86 64.97 2dxl h ILE 66 Cb 0.84 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 38.31 2dxl h ILE 66 CO 0.04 0.18 -0.00 -0.07 0.00 0.00 0.00 178.15 178.30 2dxl h LEU 67 N -0.69 0.22 -1.93 1.44 3.38 -0.70 -1.12 115.31 115.91 2dxl h LEU 67 Ca -0.03 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2dxl h LEU 67 Cb 0.49 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 2dxl h LEU 67 CO 0.04 0.27 -0.12 1.23 0.09 0.00 0.00 178.44 179.95 2dxl h GLY 68 N 0.50 0.00 1.77 0.83 0.00 -0.81 -2.59 103.07 102.78 2dxl h GLY 68 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 2dxl h GLY 68 CO 0.00 0.00 -0.01 -1.14 0.00 0.00 0.00 176.54 175.39 2dxl n SER 69 N -3.85 0.02 -4.77 0.19 3.41 -0.42 -4.81 113.62 103.39 2dxl n SER 69 Ca -0.02 0.18 -0.41 0.00 -0.26 0.00 0.00 58.87 58.37 2dxl n SER 69 Cb 0.22 -0.39 -0.00 0.00 -0.26 0.00 0.00 64.21 63.78 2dxl n SER 69 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2dxl s LEU 70 N -2.80 4.30 -0.95 1.04 1.43 -0.98 -4.93 118.68 115.79 2dxl s LEU 70 Ca 0.21 2.91 -0.02 0.00 -1.03 0.00 0.00 54.13 56.20 2dxl s LEU 70 Cb 0.20 -3.73 0.31 0.00 0.03 0.00 0.00 46.19 43.00 2dxl s LEU 70 CO 0.50 -0.85 1.97 0.59 0.23 0.00 0.00 176.35 178.80 2dxl n ASN 71 N 0.39 7.44 -3.69 2.29 3.02 -1.26 -4.92 115.26 118.52 2dxl n ASN 71 Ca 0.02 -3.71 -0.14 0.00 -0.03 0.00 0.00 54.58 50.71 2dxl n ASN 71 Cb 0.41 -1.14 -0.08 0.00 -0.61 0.00 0.00 39.78 38.36 2dxl n ASN 71 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2dxl s TYR 72 N -4.00 -0.30 0.50 3.10 2.02 -1.26 -5.05 117.35 112.37 2dxl s TYR 72 Ca 0.46 0.46 -0.23 0.00 -0.37 0.00 0.00 57.07 57.39 2dxl s TYR 72 Cb 0.30 0.18 -0.07 0.00 -0.40 0.00 0.00 41.96 41.97 2dxl s TYR 72 CO -0.25 -0.46 1.21 -0.35 -1.57 0.00 0.00 175.55 174.13 2dxl n PRO 73 N 1.10 1.58 -4.44 -1.71 -0.04 -1.26 -4.82 135.00 125.40 2dxl n PRO 73 Ca -0.21 0.58 -0.29 0.00 -0.04 0.00 0.00 63.50 63.54 2dxl n PRO 73 Cb 0.57 -2.38 -0.13 0.00 -0.04 0.00 0.00 33.50 31.52 2dxl n PRO 73 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2dxl s LEU 74 N -2.28 2.42 -0.16 1.53 1.43 -1.26 -0.91 118.68 119.45 2dxl s LEU 74 Ca 0.68 -0.66 0.00 0.00 -1.03 0.00 0.00 54.13 53.12 2dxl s LEU 74 Cb -0.46 -1.33 0.03 0.00 0.03 0.00 0.00 46.19 44.46 2dxl s LEU 74 CO 0.52 0.19 -0.12 -0.31 0.23 0.00 0.00 176.35 176.87 2dxl s TYR 75 N -1.04 2.20 -0.14 0.29 2.02 0.36 -4.68 117.35 116.35 2dxl s TYR 75 Ca 0.15 -1.32 0.02 0.00 -0.37 0.00 0.00 57.07 55.55 2dxl s TYR 75 Cb -0.10 -1.58 0.01 0.00 -0.40 0.00 0.00 41.96 39.89 2dxl s TYR 75 CO 0.07 -0.69 -0.22 -0.51 -1.57 0.00 0.00 175.55 172.63 2dxl s LEU 76 N 1.47 2.10 0.06 -1.29 1.43 -1.26 -0.75 118.68 120.44 2dxl s LEU 76 Ca 0.03 -0.61 0.08 0.00 -1.03 0.00 0.00 54.13 52.60 2dxl s LEU 76 Cb -0.14 -1.44 -0.03 0.00 0.03 0.00 0.00 46.19 44.61 2dxl s LEU 76 CO -0.10 0.07 -0.22 0.27 0.23 0.00 0.00 176.35 176.60 2dxl s ILE 77 N 0.87 1.79 0.68 -0.59 -4.36 -0.84 -5.01 121.20 113.75 2dxl s ILE 77 Ca -0.06 -1.34 -0.11 0.00 -0.26 0.00 0.00 60.65 58.88 2dxl s ILE 77 Cb -0.15 -1.57 0.00 0.00 1.25 0.00 0.00 42.46 41.99 2dxl s ILE 77 CO -0.03 0.17 1.07 -2.16 0.24 0.00 0.00 174.94 174.23 2dxl s PRO 78 N -1.39 3.05 0.48 0.37 0.04 -1.26 -2.47 135.00 133.81 2dxl s PRO 78 Ca 0.08 0.67 0.02 0.00 0.04 0.00 0.00 61.00 61.81 2dxl s PRO 78 Cb -0.09 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.41 2dxl s PRO 78 CO 0.03 -0.95 0.07 0.20 0.04 0.00 0.00 177.00 176.39 2dxl s GLY 79 N -4.15 2.94 0.65 0.56 0.00 0.10 -4.49 107.32 102.92 2dxl s GLY 79 Ca 0.57 -0.55 0.38 0.00 0.00 0.00 0.00 44.72 45.12 2dxl s GLY 79 CO 0.53 -2.04 2.25 3.45 0.00 0.00 0.00 173.10 177.30 2dxl h ASN 80 N 1.48 0.00 0.57 1.64 -1.07 -1.87 0.33 115.58 116.66 2dxl h ASN 80 Ca -0.39 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.98 2dxl h ASN 80 Cb 1.30 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.55 2dxl h ASN 80 CO 0.64 0.00 -0.07 1.41 0.07 0.00 0.00 177.43 179.48 2dxl n HIS 81 N -3.24 0.00 -3.23 4.14 8.25 -1.26 -4.89 115.22 114.99 2dxl n HIS 81 Ca -0.02 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.19 2dxl n HIS 81 Cb 0.15 -0.29 -0.01 0.00 1.12 0.00 0.00 29.99 30.97 2dxl n HIS 81 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2dxl s ASP 82 N -2.64 6.26 -0.28 0.41 1.01 0.10 -2.54 116.67 118.98 2dxl s ASP 82 Ca 0.25 0.51 -0.06 0.00 0.71 0.00 0.00 52.55 53.96 2dxl s ASP 82 Cb 0.20 -2.03 0.00 0.00 1.01 0.00 0.00 42.92 42.10 2dxl s ASP 82 CO 0.50 -0.37 0.07 -0.62 0.21 0.00 0.00 175.17 174.95 2dxl s ASP 83 N -4.06 5.04 0.17 0.27 2.15 -1.26 -4.86 116.67 114.12 2dxl s ASP 83 Ca 0.42 -0.64 -0.24 0.00 0.43 0.00 0.00 52.55 52.52 2dxl s ASP 83 Cb -0.10 -1.87 0.06 0.00 -0.30 0.00 0.00 42.92 40.72 2dxl s ASP 83 CO 0.38 -0.16 1.58 0.11 -0.17 0.00 0.00 175.17 176.91 2dxl h LYS 84 N 8.22 -0.23 -0.57 4.34 1.57 -1.94 0.38 116.57 128.34 2dxl h LYS 84 Ca -0.33 0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.49 2dxl h LYS 84 Cb 1.13 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.46 2dxl h LYS 84 CO 0.60 -0.15 0.35 0.00 -0.57 0.00 0.00 179.45 179.68 2dxl h ALA 85 N 0.73 0.73 0.04 3.86 0.00 -1.96 -2.22 119.26 120.43 2dxl h ALA 85 Ca 0.18 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.84 2dxl h ALA 85 Cb 0.56 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2dxl h ALA 85 CO -0.61 0.09 -1.00 -0.07 0.00 0.00 0.00 179.25 177.65 2dxl h LEU 86 N 0.70 0.40 -0.41 0.00 3.38 -1.73 -1.87 115.31 115.78 2dxl h LEU 86 Ca 0.22 -0.35 0.05 0.00 0.09 0.00 0.00 57.88 57.89 2dxl h LEU 86 Cb -0.00 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.58 2dxl h LEU 86 CO -0.09 1.19 0.14 0.15 0.09 0.00 0.00 178.44 179.92 2dxl h PHE 87 N 0.14 0.25 -0.66 1.13 3.57 -0.16 -0.88 116.94 120.34 2dxl h PHE 87 Ca -0.08 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.36 2dxl h PHE 87 Cb 1.67 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 40.33 2dxl h PHE 87 CO 0.05 0.09 0.11 1.25 -2.23 0.00 0.00 178.31 177.58 2dxl h LEU 88 N 0.30 1.03 -0.53 0.59 5.85 -1.33 -0.37 115.31 120.85 2dxl h LEU 88 Ca 0.19 -0.24 -0.11 0.00 0.84 0.00 0.00 57.88 58.55 2dxl h LEU 88 Cb 0.18 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 2dxl h LEU 88 CO -0.20 1.02 -0.11 -0.08 -0.34 0.00 0.00 178.44 178.73 2dxl h GLU 89 N 1.01 1.02 0.00 1.25 4.81 -0.73 -2.86 114.58 119.08 2dxl h GLU 89 Ca 0.20 -0.38 -0.34 0.00 -0.13 0.00 0.00 59.36 58.71 2dxl h GLU 89 Cb 0.43 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.68 2dxl h GLU 89 CO 0.01 1.07 -2.10 0.66 -0.73 0.00 0.00 179.01 177.92 2dxl n TYR 90 N -4.16 0.43 -0.02 0.92 4.02 -0.39 -4.64 117.16 113.31 2dxl n TYR 90 Ca 0.01 0.16 0.03 0.00 -0.01 0.00 0.00 57.90 58.09 2dxl n TYR 90 Cb 0.40 -1.08 -0.10 0.00 -0.02 0.00 0.00 39.34 38.54 2dxl n TYR 90 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2dxl n LEU 91 N -2.88 0.00 -0.31 7.72 4.77 -0.15 -4.49 117.00 121.65 2dxl n LEU 91 Ca -0.26 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 55.80 2dxl n LEU 91 Cb 1.11 0.08 0.29 0.00 -2.33 0.00 0.00 43.42 42.58 2dxl n LEU 91 CO 0.44 0.08 1.23 -0.61 -1.33 0.00 0.00 177.39 177.20 2dxl h GLN 92 N 0.00 0.86 -0.07 3.23 -0.00 -1.53 0.14 115.11 117.74 2dxl h GLN 92 Ca -0.09 -0.05 0.02 0.00 -0.00 0.00 0.00 58.65 58.53 2dxl h GLN 92 Cb 0.92 -0.19 -0.00 0.00 0.00 0.00 0.00 27.48 28.21 2dxl h GLN 92 CO 0.01 0.57 0.07 -1.35 0.00 0.00 0.00 178.83 178.13 2dxl h PRO 93 N 0.89 0.00 -0.23 -2.39 0.11 -1.80 -0.80 132.00 127.78 2dxl h PRO 93 Ca 0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.57 2dxl h PRO 93 Cb 0.51 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.62 2dxl h PRO 93 CO -0.22 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.85 2dxl n LEU 94 N -3.90 1.81 -2.71 2.35 4.77 0.46 -4.48 117.00 115.30 2dxl n LEU 94 Ca -0.01 -0.80 -0.07 0.00 -0.03 0.00 0.00 56.01 55.10 2dxl n LEU 94 Cb 0.17 -0.15 0.08 0.00 -2.33 0.00 0.00 43.42 41.19 2dxl n LEU 94 CO 0.28 0.40 0.43 0.00 -1.33 0.00 0.00 177.39 177.17 2dxl h PRO 96 N 3.19 0.16 0.00 0.00 0.11 -1.57 -2.47 132.00 131.42 2dxl h PRO 96 Ca -0.19 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.91 2dxl h PRO 96 Cb 1.12 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2dxl h PRO 96 CO 0.10 0.11 0.00 0.00 -0.21 0.00 0.00 178.00 177.99 2dxl n GLN 97 N -4.38 0.76 0.25 1.05 0.00 -1.26 -2.53 117.38 111.26 2dxl n GLN 97 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 57.00 57.30 2dxl n GLN 97 Cb 0.80 -1.04 0.60 0.00 0.00 0.00 0.00 30.24 30.60 2dxl n GLN 97 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 2dxl h LEU 98 N 0.00 0.00 0.00 2.61 3.38 -1.69 -3.40 115.31 116.21 2dxl h LEU 98 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2dxl h LEU 98 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2dxl h LEU 98 CO 0.00 0.16 0.00 0.61 0.09 0.00 0.00 178.44 179.30 2dxl n GLY 99 N -0.17 -1.88 0.85 0.83 0.00 -1.05 -3.44 105.19 100.34 2dxl n GLY 99 Ca -0.01 -2.01 0.03 0.00 0.00 0.00 0.00 46.02 44.03 2dxl n GLY 99 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dxl n SER 100 N 0.00 0.86 -4.07 1.61 3.41 -1.26 -4.98 113.62 109.18 2dxl n SER 100 Ca 0.00 -2.35 -0.32 0.00 -0.26 0.00 0.00 58.87 55.94 2dxl n SER 100 Cb 0.00 -0.30 -0.15 0.00 -0.26 0.00 0.00 64.21 63.50 2dxl n SER 100 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2dxl s ASP 101 N -1.86 4.57 0.60 4.04 -1.08 -1.26 -5.00 116.67 116.67 2dxl s ASP 101 Ca 0.21 -1.55 0.32 0.00 -0.52 0.00 0.00 52.55 51.02 2dxl s ASP 101 Cb 0.23 -1.59 1.90 0.00 -1.46 0.00 0.00 42.92 42.00 2dxl s ASP 101 CO -0.07 -0.24 2.27 0.00 0.52 0.00 0.00 175.17 177.65 2dxl h ALA 102 N 7.77 1.43 0.00 3.66 0.00 -1.94 -2.44 119.26 127.73 2dxl h ALA 102 Ca -0.16 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.57 2dxl h ALA 102 Cb 1.04 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 2dxl h ALA 102 CO 0.48 0.01 -1.07 -0.91 0.00 0.00 0.00 179.25 177.76 2dxl h ASN 103 N 0.00 0.00 -2.29 0.00 -0.26 -1.94 -3.36 115.58 107.73 2dxl h ASN 103 Ca -0.00 0.00 -0.61 0.00 -0.56 0.00 0.00 56.30 55.13 2dxl h ASN 103 Cb 0.02 0.00 -0.40 0.00 -1.06 0.00 0.00 38.32 36.88 2dxl h ASN 103 CO 0.00 0.71 -0.47 0.59 -1.06 0.00 0.00 177.43 177.20 2dxl n ASN 104 N -3.12 4.78 -4.66 5.81 4.13 -0.93 -5.03 115.26 116.24 2dxl n ASN 104 Ca -0.05 -3.69 -0.43 0.00 1.68 0.00 0.00 54.58 52.10 2dxl n ASN 104 Cb 0.86 -0.62 -0.02 0.00 -1.54 0.00 0.00 39.78 38.45 2dxl n ASN 104 CO 0.00 0.00 0.00 -0.04 0.28 0.00 0.00 177.26 177.50 2dxl s MET 105 N -3.56 4.25 -0.27 3.52 -1.94 -1.16 -4.81 119.30 115.32 2dxl s MET 105 Ca 0.48 1.63 -0.30 0.00 -1.71 0.00 0.00 55.69 55.78 2dxl s MET 105 Cb 0.27 -3.73 0.18 0.00 2.01 0.00 0.00 34.83 33.56 2dxl s MET 105 CO -0.14 -0.67 1.33 -0.98 -0.01 0.00 0.00 175.02 174.54 2dxl s ARG 106 N 3.35 0.11 -0.12 2.03 3.03 -1.22 -3.40 118.95 122.73 2dxl s ARG 106 Ca 0.54 0.02 -0.30 0.00 2.03 0.00 0.00 55.73 58.01 2dxl s ARG 106 Cb -0.21 0.05 0.12 0.00 -1.03 0.00 0.00 34.95 33.88 2dxl s ARG 106 CO 0.14 -0.04 0.95 0.00 -1.13 0.00 0.00 175.30 175.23 2dxl s ALA 108 N -1.48 3.90 -0.10 0.00 0.00 -1.26 -0.90 121.76 121.91 2dxl s ALA 108 Ca -0.01 -0.67 0.02 0.00 0.00 0.00 0.00 51.96 51.31 2dxl s ALA 108 Cb -0.01 -1.99 0.01 0.00 0.00 0.00 0.00 23.12 21.14 2dxl s ALA 108 CO 0.00 0.71 -0.17 0.08 0.00 0.00 0.00 175.76 176.38 2dxl s VAL 109 N -1.38 1.62 -0.27 0.00 1.01 0.91 -4.97 120.40 117.33 2dxl s VAL 109 Ca 0.30 -0.73 0.09 0.00 0.00 0.00 0.00 61.98 61.64 2dxl s VAL 109 Cb -0.13 -1.45 0.21 0.00 0.00 0.00 0.00 36.38 35.01 2dxl s VAL 109 CO 0.19 0.46 1.15 -0.67 0.00 0.00 0.00 175.10 176.24 2dxl n ASP 110 N 3.98 2.55 0.13 3.32 4.64 -1.26 -0.96 116.55 128.94 2dxl n ASP 110 Ca -0.20 -2.37 0.01 0.00 -1.38 0.00 0.00 54.79 50.85 2dxl n ASP 110 Cb 0.52 -0.22 0.00 0.00 -1.04 0.00 0.00 41.12 40.38 2dxl n ASP 110 CO 0.00 0.00 0.00 0.44 -0.82 0.00 0.00 177.20 176.82 2dxl h ASP 111 N 0.72 0.00 -1.41 1.67 3.45 -1.96 -3.47 116.42 115.42 2dxl h ASP 111 Ca 0.00 0.00 -0.51 0.00 0.43 0.00 0.00 57.03 56.95 2dxl h ASP 111 Cb 0.79 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.52 2dxl h ASP 111 CO 0.03 0.60 -0.37 -0.36 -1.57 0.00 0.00 179.24 177.56 2dxl s PHE 112 N -2.92 2.57 0.53 4.55 0.08 -1.26 -5.01 117.98 116.51 2dxl s PHE 112 Ca 0.03 -0.54 0.21 0.00 0.12 0.00 0.00 56.93 56.76 2dxl s PHE 112 Cb 0.08 -2.13 1.37 0.00 -0.57 0.00 0.00 43.02 41.76 2dxl s PHE 112 CO 0.76 -0.16 2.08 0.00 -0.10 0.00 0.00 175.22 177.81 2dxl h ALA 113 N 1.01 2.18 -3.33 5.36 0.00 -1.98 -3.39 119.26 119.12 2dxl h ALA 113 Ca -0.41 -0.01 -0.64 0.00 0.00 0.00 0.00 54.91 53.85 2dxl h ALA 113 Cb 1.27 0.02 -0.20 0.00 0.00 0.00 0.00 17.79 18.88 2dxl h ALA 113 CO 0.58 -0.30 -0.65 0.99 0.00 0.00 0.00 179.25 179.87 2dxl s THR 114 N -5.00 4.01 0.21 0.00 2.01 -1.26 -4.26 115.64 111.35 2dxl s THR 114 Ca -0.05 -0.33 -0.30 0.00 0.31 0.00 0.00 61.69 61.33 2dxl s THR 114 Cb 0.18 -2.74 -0.09 0.00 0.01 0.00 0.00 72.50 69.86 2dxl s THR 114 CO 0.68 0.51 1.21 -0.60 -0.69 0.00 0.00 174.62 175.74 2dxl s ARG 115 N 0.12 4.48 -0.16 4.92 3.52 0.67 -4.84 118.95 127.67 2dxl s ARG 115 Ca -0.00 1.92 -0.07 0.00 -0.13 0.00 0.00 55.73 57.46 2dxl s ARG 115 Cb -0.13 -3.21 -0.04 0.00 -1.56 0.00 0.00 34.95 30.01 2dxl s ARG 115 CO 0.02 -0.08 0.07 -0.51 -0.81 0.00 0.00 175.30 173.99 2dxl s LEU 116 N -0.53 3.87 -0.15 -0.88 1.43 -0.14 -0.85 118.68 121.44 2dxl s LEU 116 Ca 0.52 0.15 0.01 0.00 -1.03 0.00 0.00 54.13 53.78 2dxl s LEU 116 Cb -0.34 -1.96 0.02 0.00 0.03 0.00 0.00 46.19 43.94 2dxl s LEU 116 CO 0.39 0.24 -0.15 -0.76 0.23 0.00 0.00 176.35 176.30 2dxl s LEU 117 N -0.03 1.75 -0.18 1.79 1.43 0.82 -0.06 118.68 124.20 2dxl s LEU 117 Ca 0.06 -0.50 -0.02 0.00 -1.03 0.00 0.00 54.13 52.64 2dxl s LEU 117 Cb -0.12 -1.21 -0.01 0.00 0.03 0.00 0.00 46.19 44.88 2dxl s LEU 117 CO 0.01 -0.04 -0.08 -0.36 0.23 0.00 0.00 176.35 176.11 2dxl s PHE 118 N 1.39 2.91 0.23 0.29 0.08 -0.08 -0.09 117.98 122.72 2dxl s PHE 118 Ca 0.03 -0.79 0.01 0.00 0.12 0.00 0.00 56.93 56.31 2dxl s PHE 118 Cb -0.13 -1.99 -0.05 0.00 -0.57 0.00 0.00 43.02 40.28 2dxl s PHE 118 CO -0.10 -0.38 0.07 0.96 -0.10 0.00 0.00 175.22 175.68 2dxl s ILE 119 N 0.96 0.55 -0.36 0.64 -4.36 -0.92 -0.77 121.20 116.95 2dxl s ILE 119 Ca -0.01 -1.99 0.00 0.00 -0.26 0.00 0.00 60.65 58.39 2dxl s ILE 119 Cb -0.15 -2.50 0.09 0.00 1.25 0.00 0.00 42.46 41.16 2dxl s ILE 119 CO -0.00 -0.12 0.10 -0.62 0.24 0.00 0.00 174.94 174.54 2dxl s ASP 120 N -3.27 4.97 0.00 4.36 3.68 -1.22 -4.56 116.67 120.64 2dxl s ASP 120 Ca 0.34 -1.91 0.27 0.00 2.13 0.00 0.00 52.55 53.39 2dxl s ASP 120 Cb 0.07 -1.72 0.95 0.00 -1.45 0.00 0.00 42.92 40.77 2dxl s ASP 120 CO 0.11 -0.42 1.70 -1.54 0.13 0.00 0.00 175.17 175.15 2dxl n SER 121 N 4.47 0.55 -4.79 -0.34 3.41 -1.26 -4.80 113.62 110.85 2dxl n SER 121 Ca -0.03 -0.43 -0.34 0.00 -0.26 0.00 0.00 58.87 57.81 2dxl n SER 121 Cb 0.42 -0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.36 2dxl n SER 121 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dxl s SER 122 N -2.67 5.85 -0.03 4.04 1.04 -1.26 -0.10 113.70 120.57 2dxl s SER 122 Ca 0.22 1.99 -0.00 0.00 0.48 0.00 0.00 55.95 58.64 2dxl s SER 122 Cb 0.19 -2.56 0.03 0.00 0.10 0.00 0.00 66.02 63.78 2dxl s SER 122 CO 0.54 -1.12 0.03 -0.60 0.98 0.00 0.00 173.24 173.07 2dxl s ARG 123 N -3.55 0.06 0.19 4.02 3.52 -1.26 -4.72 118.95 117.20 2dxl s ARG 123 Ca 0.68 0.18 -0.33 0.00 -0.13 0.00 0.00 55.73 56.13 2dxl s ARG 123 Cb -0.19 -0.37 -0.14 0.00 -1.56 0.00 0.00 34.95 32.69 2dxl s ARG 123 CO 0.29 -0.19 1.50 0.00 -0.81 0.00 0.00 175.30 176.09 2dxl n ALA 124 N 4.35 1.15 -1.22 6.12 0.00 -1.26 -3.10 120.51 126.56 2dxl n ALA 124 Ca -0.24 0.44 -0.04 0.00 0.00 0.00 0.00 53.44 53.60 2dxl n ALA 124 Cb 0.50 -2.31 -0.02 0.00 0.00 0.00 0.00 19.45 17.63 2dxl n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dxl n GLY 125 N 2.88 0.67 3.39 0.00 0.00 -1.26 -5.03 105.19 105.84 2dxl n GLY 125 Ca 0.15 -0.85 -0.15 0.00 0.00 0.00 0.00 46.02 45.17 2dxl n GLY 125 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2dxl s THR 126 N -2.17 0.03 -0.34 2.61 -1.32 -1.18 -5.03 115.64 108.25 2dxl s THR 126 Ca 0.00 -0.25 0.21 0.00 -1.21 0.00 0.00 61.69 60.44 2dxl s THR 126 Cb 0.00 -0.91 0.22 0.00 -1.51 0.00 0.00 72.50 70.30 2dxl s THR 126 CO 0.00 -0.14 1.48 0.28 -2.21 0.00 0.00 174.62 174.03 2dxl h SER 127 N 3.07 0.00 -3.88 8.08 0.02 -1.92 -3.42 113.55 115.50 2dxl h SER 127 Ca -0.30 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.09 2dxl h SER 127 Cb 1.19 0.00 0.15 0.00 0.14 0.00 0.00 62.40 63.88 2dxl h SER 127 CO 0.41 0.14 0.45 0.29 -1.14 0.00 0.00 176.83 176.98 2dxl n LYS 128 N -3.07 1.35 -2.36 3.45 5.02 -1.26 -4.81 118.16 116.47 2dxl n LYS 128 Ca 0.03 0.51 -0.28 0.00 -2.02 0.00 0.00 58.31 56.54 2dxl n LYS 128 Cb 0.59 -2.44 0.01 0.00 -0.02 0.00 0.00 35.03 33.17 2dxl n LYS 128 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2dxl s GLY 129 N -1.09 1.56 -0.28 0.72 0.00 -0.51 -4.21 107.32 103.51 2dxl s GLY 129 Ca 0.75 -0.42 -0.19 0.00 0.00 0.00 0.00 44.72 44.86 2dxl s GLY 129 CO 0.47 -0.20 0.72 0.86 0.00 0.00 0.00 173.10 174.95 2dxl s TRP 130 N -2.92 -0.96 -0.39 1.90 -0.11 0.86 -1.13 118.94 116.18 2dxl s TRP 130 Ca 0.51 2.02 -0.16 0.00 1.22 0.00 0.00 56.10 59.69 2dxl s TRP 130 Cb -0.11 0.52 0.01 0.00 -1.50 0.00 0.00 33.47 32.39 2dxl s TRP 130 CO 0.48 -0.47 0.38 -0.51 -4.62 0.00 0.00 176.95 172.20 2dxl s LEU 131 N 1.27 4.73 0.53 5.86 1.43 -1.26 -4.41 118.68 126.81 2dxl s LEU 131 Ca -0.07 -0.53 -0.22 0.00 -1.03 0.00 0.00 54.13 52.28 2dxl s LEU 131 Cb -0.05 -2.32 -0.05 0.00 0.03 0.00 0.00 46.19 43.80 2dxl s LEU 131 CO -0.14 -0.45 1.30 0.42 0.23 0.00 0.00 176.35 177.71 2dxl s THR 132 N 2.00 2.37 0.15 5.49 -4.23 -1.26 -4.74 115.64 115.40 2dxl s THR 132 Ca 0.10 0.27 -0.08 0.00 -1.18 0.00 0.00 61.69 60.80 2dxl s THR 132 Cb -0.17 -3.14 0.19 0.00 1.34 0.00 0.00 72.50 70.72 2dxl s THR 132 CO 0.12 -0.01 0.92 -0.67 -0.54 0.00 0.00 174.62 174.45 2dxl n ASP 133 N -0.91 -0.32 -0.21 3.99 2.03 -1.26 -0.26 116.55 119.61 2dxl n ASP 133 Ca 0.10 1.03 0.12 0.00 0.52 0.00 0.00 54.79 56.55 2dxl n ASP 133 Cb 0.46 -0.26 0.16 0.00 -0.72 0.00 0.00 41.12 40.76 2dxl n ASP 133 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 2dxl n GLU 134 N -4.91 0.59 0.16 -0.67 0.28 -1.26 -2.39 120.64 112.44 2dxl n GLU 134 Ca 0.07 -0.42 -0.14 0.00 -0.16 0.00 0.00 57.16 56.51 2dxl n GLU 134 Cb 0.26 -1.49 -0.08 0.00 1.43 0.00 0.00 31.44 31.56 2dxl n GLU 134 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 177.13 178.12 2dxl h THR 135 N 1.02 0.75 -0.35 3.84 2.02 -0.96 -0.57 112.91 118.66 2dxl h THR 135 Ca 0.00 -0.29 0.07 0.00 0.77 0.00 0.00 66.41 66.96 2dxl h THR 135 Cb 0.57 0.91 -0.07 0.00 -1.74 0.00 0.00 68.15 67.82 2dxl h THR 135 CO 0.00 0.06 -0.14 0.40 0.37 0.00 0.00 175.52 176.21 2dxl h ILE 136 N -0.54 0.55 -0.92 3.11 2.04 -1.34 0.24 117.51 120.65 2dxl h ILE 136 Ca -0.04 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.83 2dxl h ILE 136 Cb 0.40 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 36.98 2dxl h ILE 136 CO 0.06 0.00 0.61 -1.28 0.00 0.00 0.00 178.15 177.54 2dxl h SER 137 N -0.07 1.05 -0.29 1.72 0.87 -1.50 -1.10 113.55 114.23 2dxl h SER 137 Ca 0.18 -0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.66 2dxl h SER 137 Cb 0.34 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 2dxl h SER 137 CO -0.40 0.75 -0.03 -0.25 -0.53 0.00 0.00 176.83 176.37 2dxl h TRP 138 N 1.23 0.59 -0.34 2.24 7.01 0.16 -0.39 115.95 126.45 2dxl h TRP 138 Ca 0.34 -0.11 0.07 0.00 2.11 0.00 0.00 58.89 61.30 2dxl h TRP 138 Cb -0.13 -0.15 -0.08 0.00 -2.10 0.00 0.00 29.16 26.70 2dxl h TRP 138 CO -0.01 0.70 -0.33 -0.07 -2.79 0.00 0.00 178.44 175.95 2dxl h LEU 139 N 0.31 -1.07 -1.52 0.65 4.07 -0.32 -1.57 115.31 115.86 2dxl h LEU 139 Ca 0.08 0.18 -0.04 0.00 0.08 0.00 0.00 57.88 58.18 2dxl h LEU 139 Cb 0.48 0.49 -0.01 0.00 1.08 0.00 0.00 40.66 42.70 2dxl h LEU 139 CO 0.02 -0.33 -0.14 -0.08 -1.08 0.00 0.00 178.44 176.83 2dxl h GLU 140 N -0.28 0.13 -0.72 1.13 4.81 -0.99 -2.21 114.58 116.45 2dxl h GLU 140 Ca 0.15 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.30 2dxl h GLU 140 Cb 0.54 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.87 2dxl h GLU 140 CO -0.50 0.28 0.23 0.00 -0.73 0.00 0.00 179.01 178.29 2dxl h ALA 141 N 1.73 0.95 -0.40 2.92 0.00 -0.52 0.09 119.26 124.03 2dxl h ALA 141 Ca 0.03 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.63 2dxl h ALA 141 Cb 0.33 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2dxl h ALA 141 CO 0.02 0.63 -0.07 1.96 0.00 0.00 0.00 179.25 181.79 2dxl h GLN 142 N 1.07 0.75 -0.16 0.00 1.08 -0.70 -1.32 115.11 115.82 2dxl h GLN 142 Ca 0.23 -0.27 -0.15 0.00 -1.45 0.00 0.00 58.65 57.01 2dxl h GLN 142 Cb 0.30 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.69 2dxl h GLN 142 CO -0.01 0.87 -0.48 -0.07 -0.95 0.00 0.00 178.83 178.20 2dxl h LEU 143 N 0.57 0.70 -0.12 1.46 3.38 -1.46 -2.01 115.31 117.83 2dxl h LEU 143 Ca 0.10 -0.59 -0.00 0.00 0.09 0.00 0.00 57.88 57.48 2dxl h LEU 143 Cb 0.58 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2dxl h LEU 143 CO 0.03 1.17 0.07 0.15 0.09 0.00 0.00 178.44 179.96 2dxl h PHE 144 N 0.27 0.15 -0.08 1.13 3.57 -0.97 -2.95 116.94 118.08 2dxl h PHE 144 Ca -0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.49 2dxl h PHE 144 Cb 1.10 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.79 2dxl h PHE 144 CO 0.10 0.14 0.00 0.39 -2.23 0.00 0.00 178.31 176.70 2dxl n GLU 145 N -4.98 1.44 0.02 1.11 1.02 -0.50 -4.08 120.64 114.67 2dxl n GLU 145 Ca -0.05 -0.66 0.11 0.00 -0.02 0.00 0.00 57.16 56.54 2dxl n GLU 145 Cb 0.05 -1.39 0.03 0.00 -0.02 0.00 0.00 31.44 30.11 2dxl n GLU 145 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dxl n GLY 146 N 1.03 -1.19 7.00 0.62 0.00 -0.76 -5.05 105.19 106.85 2dxl n GLY 146 Ca 0.17 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2dxl n GLY 146 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dxl n GLY 147 N 1.40 3.10 0.09 -0.02 0.00 -1.25 -3.41 105.19 105.09 2dxl n GLY 147 Ca 0.03 -0.20 -0.04 0.00 0.00 0.00 0.00 46.02 45.80 2dxl n GLY 147 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2dxl h ASP 148 N 3.66 0.00 -1.57 1.61 3.32 -1.97 -3.46 116.42 118.02 2dxl h ASP 148 Ca 0.00 0.00 -0.73 0.00 0.02 0.00 0.00 57.03 56.32 2dxl h ASP 148 Cb 0.00 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.57 2dxl h ASP 148 CO 0.00 0.84 0.91 1.17 -1.72 0.00 0.00 179.24 180.44 2dxl n LYS 149 N -3.49 1.20 -1.30 3.56 4.81 -1.22 -4.87 118.16 116.86 2dxl n LYS 149 Ca -0.00 0.44 -0.33 0.00 -0.87 0.00 0.00 58.31 57.55 2dxl n LYS 149 Cb 0.82 -2.13 0.10 0.00 0.02 0.00 0.00 35.03 33.84 2dxl n LYS 149 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 2dxl s PRO 150 N 3.54 1.99 0.01 1.64 0.02 -1.26 -4.74 135.00 136.20 2dxl s PRO 150 Ca 0.98 1.61 0.06 0.00 0.02 0.00 0.00 61.00 63.67 2dxl s PRO 150 Cb -1.05 -1.83 -0.02 0.00 0.02 0.00 0.00 34.50 31.62 2dxl s PRO 150 CO 0.65 -1.92 -0.19 0.00 -0.33 0.00 0.00 177.00 175.22 2dxl s ALA 151 N -2.26 1.57 0.02 -1.55 0.00 -0.21 -0.24 121.76 119.09 2dxl s ALA 151 Ca 0.70 -0.88 0.06 0.00 0.00 0.00 0.00 51.96 51.84 2dxl s ALA 151 Cb -0.25 -0.36 -0.02 0.00 0.00 0.00 0.00 23.12 22.49 2dxl s ALA 151 CO 0.49 0.37 -0.17 0.95 0.00 0.00 0.00 175.76 177.40 2dxl s THR 152 N -0.58 1.33 -0.09 0.00 -4.23 -0.03 -1.56 115.64 110.47 2dxl s THR 152 Ca 0.07 -0.90 0.01 0.00 -1.18 0.00 0.00 61.69 59.69 2dxl s THR 152 Cb -0.08 -1.14 -0.02 0.00 1.34 0.00 0.00 72.50 72.60 2dxl s THR 152 CO 0.00 0.23 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.56 2dxl s ILE 153 N -0.61 3.24 -0.20 2.99 1.01 -0.32 -0.13 121.20 127.18 2dxl s ILE 153 Ca 0.05 -0.63 -0.02 0.00 0.00 0.00 0.00 60.65 60.05 2dxl s ILE 153 Cb -0.07 -2.33 -0.01 0.00 0.01 0.00 0.00 42.46 40.06 2dxl s ILE 153 CO 0.00 0.56 -0.08 -0.36 0.00 0.00 0.00 174.94 175.06 2dxl s PHE 154 N -0.24 2.91 0.04 3.97 0.08 0.87 -0.30 117.98 125.31 2dxl s PHE 154 Ca 0.02 -0.95 -0.03 0.00 0.12 0.00 0.00 56.93 56.08 2dxl s PHE 154 Cb -0.13 -2.03 -0.02 0.00 -0.57 0.00 0.00 43.02 40.28 2dxl s PHE 154 CO 0.03 -0.50 0.04 0.00 -0.10 0.00 0.00 175.22 174.69 2dxl s MET 155 N 1.20 0.54 0.00 0.44 0.23 -0.80 -2.16 119.30 118.75 2dxl s MET 155 Ca 0.02 -0.83 -0.23 0.00 -1.03 0.00 0.00 55.69 53.62 2dxl s MET 155 Cb -0.14 0.20 -0.18 0.00 -1.53 0.00 0.00 34.83 33.18 2dxl s MET 155 CO -0.03 -0.12 1.24 1.25 -2.03 0.00 0.00 175.02 175.33 2dxl h HIS 156 N 3.73 0.28 -3.25 3.16 2.76 -1.79 -3.17 115.15 116.87 2dxl h HIS 156 Ca -0.33 -0.10 -0.58 0.00 -2.20 0.00 0.00 60.37 57.16 2dxl h HIS 156 Cb 1.18 -0.05 -0.06 0.00 1.55 0.00 0.00 27.41 30.03 2dxl h HIS 156 CO 0.56 0.75 -0.08 -1.01 -1.30 0.00 0.00 177.93 176.85 2dxl s HIS 157 N -3.96 3.66 0.17 5.26 3.76 -1.26 -1.14 115.29 121.79 2dxl s HIS 157 Ca -0.15 1.09 -0.32 0.00 -0.15 0.00 0.00 55.06 55.54 2dxl s HIS 157 Cb 0.03 -2.53 -0.11 0.00 1.11 0.00 0.00 32.58 31.09 2dxl s HIS 157 CO 0.73 0.38 1.62 -1.25 -0.85 0.00 0.00 174.74 175.38 2dxl s PRO 158 N -0.23 4.19 0.00 8.40 0.04 -1.26 -4.67 135.00 141.46 2dxl s PRO 158 Ca 0.28 2.44 0.17 0.00 0.04 0.00 0.00 61.00 63.93 2dxl s PRO 158 Cb -0.17 -3.16 1.02 0.00 0.04 0.00 0.00 34.50 32.22 2dxl s PRO 158 CO 0.15 -0.66 1.50 -0.35 0.04 0.00 0.00 177.00 177.68 2dxl n PRO 159 N 4.10 0.76 -3.74 0.56 -0.04 -1.26 -1.48 135.00 133.90 2dxl n PRO 159 Ca 0.15 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.50 2dxl n PRO 159 Cb 0.38 -1.35 -0.06 0.00 -0.04 0.00 0.00 33.50 32.42 2dxl n PRO 159 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2dxl s LEU 160 N -1.70 0.85 0.51 1.53 2.34 -1.26 -3.81 118.68 117.14 2dxl s LEU 160 Ca 0.26 -0.32 -0.23 0.00 0.06 0.00 0.00 54.13 53.90 2dxl s LEU 160 Cb 0.12 1.43 -0.06 0.00 -0.56 0.00 0.00 46.19 47.12 2dxl s LEU 160 CO 0.20 -0.71 1.39 -2.16 -1.06 0.00 0.00 176.35 174.01 2dxl s PRO 161 N -3.18 3.36 0.00 1.48 0.04 -1.26 -4.92 135.00 130.52 2dxl s PRO 161 Ca -0.01 2.32 0.02 0.00 0.04 0.00 0.00 61.00 63.37 2dxl s PRO 161 Cb 0.01 -2.42 0.02 0.00 0.04 0.00 0.00 34.50 32.15 2dxl s PRO 161 CO -0.07 -1.04 0.71 1.28 0.04 0.00 0.00 177.00 177.91 2dxl n LEU 162 N -0.69 1.45 0.00 -3.56 4.77 -1.26 -4.98 117.00 112.74 2dxl n LEU 162 Ca 0.08 -1.32 0.00 0.00 -0.03 0.00 0.00 56.01 54.74 2dxl n LEU 162 Cb 0.44 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 2dxl n LEU 162 CO 0.55 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.58 2dxl n GLY 163 N -0.05 0.70 3.56 -0.72 0.00 -1.26 -5.03 105.19 102.38 2dxl n GLY 163 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 2dxl n GLY 163 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2dxl s ASN 164 N -2.05 6.48 0.23 1.61 3.04 -1.26 -4.27 114.94 118.71 2dxl s ASN 164 Ca 0.00 0.07 -0.08 0.00 0.04 0.00 0.00 52.86 52.88 2dxl s ASN 164 Cb 0.00 -2.48 0.38 0.00 -1.54 0.00 0.00 41.25 37.61 2dxl s ASN 164 CO 0.00 -1.18 1.65 0.00 -3.04 0.00 0.00 177.10 174.53 2dxl h ALA 165 N 9.22 0.72 -0.07 1.71 0.00 -0.42 -0.03 119.26 130.40 2dxl h ALA 165 Ca -0.24 0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2dxl h ALA 165 Cb 1.07 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 2dxl h ALA 165 CO 1.08 -0.40 -0.09 0.37 0.00 0.00 0.00 179.25 180.21 2dxl h GLN 166 N 0.13 0.18 0.00 0.00 4.15 -1.77 -3.39 115.11 114.41 2dxl h GLN 166 Ca 0.37 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.69 2dxl h GLN 166 Cb 0.63 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.33 2dxl h GLN 166 CO -0.59 0.65 -0.92 0.52 -1.93 0.00 0.00 178.83 176.56 2dxl h MET 167 N -0.27 0.00 -0.10 1.69 2.86 -1.77 -3.39 114.93 113.95 2dxl h MET 167 Ca 0.01 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.61 2dxl h MET 167 Cb 0.62 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.28 2dxl h MET 167 CO 0.02 0.00 -0.08 -0.44 1.06 0.00 0.00 176.91 177.47 2dxl h ASP 168 N 0.00 0.24 0.33 1.22 5.19 -1.22 -2.58 116.42 119.61 2dxl h ASP 168 Ca 0.00 -0.46 0.00 0.00 -0.62 0.00 0.00 57.03 55.95 2dxl h ASP 168 Cb 1.00 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.44 2dxl h ASP 168 CO 0.00 0.65 0.00 1.55 -3.12 0.00 0.00 179.24 178.32 2dxl h PRO 169 N -0.16 0.00 -0.41 3.56 0.13 -1.79 -1.45 132.00 131.88 2dxl h PRO 169 Ca 0.02 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.98 2dxl h PRO 169 Cb 0.57 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.60 2dxl h PRO 169 CO 0.02 0.00 0.03 0.44 -0.23 0.00 0.00 178.00 178.26 2dxl n ILE 170 N -2.35 2.57 -1.04 -3.56 -5.35 -1.10 -4.83 119.36 103.70 2dxl n ILE 170 Ca -0.00 -2.42 -0.12 0.00 -0.27 0.00 0.00 62.75 59.94 2dxl n ILE 170 Cb 0.12 -0.32 0.09 0.00 -1.74 0.00 0.00 39.64 37.80 2dxl n ILE 170 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2dxl n ALA 171 N -0.95 -1.01 -2.30 -1.28 0.00 -0.55 -4.06 120.51 110.36 2dxl n ALA 171 Ca 0.33 -0.68 -0.41 0.00 0.00 0.00 0.00 53.44 52.68 2dxl n ALA 171 Cb 1.08 -0.04 -0.03 0.00 0.00 0.00 0.00 19.45 20.46 2dxl n ALA 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dxl h GLU 173 N 11.94 0.32 -0.85 0.00 4.81 -1.46 0.23 114.58 129.56 2dxl h GLU 173 Ca -0.27 -0.02 -0.24 0.00 -0.13 0.00 0.00 59.36 58.70 2dxl h GLU 173 Cb 1.11 -0.07 -0.14 0.00 0.63 0.00 0.00 28.75 30.27 2dxl h GLU 173 CO 1.18 0.21 0.31 0.27 -0.73 0.00 0.00 179.01 180.25 2dxl n ASN 174 N -5.06 4.21 0.14 1.04 2.04 -1.26 -4.67 115.26 111.70 2dxl n ASN 174 Ca 0.09 -3.09 0.19 0.00 -0.44 0.00 0.00 54.58 51.33 2dxl n ASN 174 Cb 0.31 -0.73 0.77 0.00 -2.53 0.00 0.00 39.78 37.59 2dxl n ASN 174 CO 0.00 0.00 0.00 1.23 -0.44 0.00 0.00 177.26 178.05 2dxl h GLY 175 N 2.69 0.00 1.85 4.83 0.00 -0.71 -0.36 103.07 111.37 2dxl h GLY 175 Ca 0.30 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.64 2dxl h GLY 175 CO 0.70 0.00 0.06 1.12 0.00 0.00 0.00 176.54 178.42 2dxl h HIS 176 N 0.00 0.00 0.00 5.60 2.07 -1.82 -0.61 115.15 120.38 2dxl h HIS 176 Ca 0.15 0.00 -0.07 0.00 -2.85 0.00 0.00 60.37 57.61 2dxl h HIS 176 Cb 0.94 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.92 2dxl h HIS 176 CO 0.00 0.00 -0.31 0.00 -3.07 0.00 0.00 177.93 174.55 2dxl h ARG 177 N 0.00 0.00 0.18 5.12 2.47 -1.41 -0.09 114.38 120.64 2dxl h ARG 177 Ca 0.02 0.00 -0.29 0.00 -1.26 0.00 0.00 59.98 58.46 2dxl h ARG 177 Cb 0.14 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 28.48 2dxl h ARG 177 CO -0.00 0.31 -1.33 1.25 0.56 0.00 0.00 179.97 180.76 2dxl h LEU 178 N 0.00 0.60 -1.11 3.04 5.85 -1.30 -3.20 115.31 119.20 2dxl h LEU 178 Ca -0.00 -0.92 0.22 0.00 0.84 0.00 0.00 57.88 58.01 2dxl h LEU 178 Cb 0.65 -0.19 -0.11 0.00 0.37 0.00 0.00 40.66 41.38 2dxl h LEU 178 CO 0.04 1.62 0.62 -0.07 -0.34 0.00 0.00 178.44 180.31 2dxl h LEU 179 N -0.11 0.67 -1.30 2.25 4.07 -1.29 0.67 115.31 120.28 2dxl h LEU 179 Ca -0.25 0.10 0.01 0.00 0.08 0.00 0.00 57.88 57.82 2dxl h LEU 179 Cb 1.92 -0.02 -0.04 0.00 1.08 0.00 0.00 40.66 43.61 2dxl h LEU 179 CO 0.18 0.20 0.48 0.00 -1.08 0.00 0.00 178.44 178.21 2dxl h ALA 180 N 1.66 1.50 -0.11 1.53 0.00 -1.05 -1.89 119.26 120.90 2dxl h ALA 180 Ca 0.59 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.35 2dxl h ALA 180 Cb 1.10 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2dxl h ALA 180 CO -0.37 0.45 -0.39 -0.07 0.00 0.00 0.00 179.25 178.87 2dxl h LEU 181 N 0.96 0.25 -0.37 0.00 4.07 -0.89 -2.86 115.31 116.47 2dxl h LEU 181 Ca 0.27 -0.10 -0.17 0.00 0.08 0.00 0.00 57.88 57.96 2dxl h LEU 181 Cb -0.08 -0.07 -0.02 0.00 1.08 0.00 0.00 40.66 41.56 2dxl h LEU 181 CO -0.06 0.63 -0.79 -0.37 -1.08 0.00 0.00 178.44 176.77 2dxl h VAL 182 N 0.21 1.54 0.00 1.22 -1.51 -0.92 -0.28 116.25 116.50 2dxl h VAL 182 Ca 0.02 -2.73 -0.04 0.00 -1.23 0.00 0.00 66.70 62.72 2dxl h VAL 182 Cb 0.79 2.49 -0.01 0.00 -2.13 0.00 0.00 31.29 32.43 2dxl h VAL 182 CO 0.06 0.77 -0.18 -0.33 -1.23 0.00 0.00 177.57 176.66 2dxl h GLU 183 N 0.00 0.00 0.00 5.19 5.08 -1.23 -3.22 114.58 120.40 2dxl h GLU 183 Ca -0.01 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 2dxl h GLU 183 Cb 1.42 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.66 2dxl h GLU 183 CO 0.10 0.18 -1.73 -2.13 -1.00 0.00 0.00 179.01 174.44 2dxl n ARG 184 N -3.62 0.75 -3.92 2.33 0.63 -1.09 -4.82 116.66 106.91 2dxl n ARG 184 Ca -0.01 -0.11 -0.30 0.00 -0.92 0.00 0.00 57.85 56.51 2dxl n ARG 184 Cb 0.31 -1.35 -0.15 0.00 0.45 0.00 0.00 32.46 31.73 2dxl n ARG 184 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2dxl s PHE 185 N -2.86 3.06 -0.49 -0.14 0.40 -0.13 -4.95 117.98 112.88 2dxl s PHE 185 Ca -0.06 -2.67 0.16 0.00 -0.60 0.00 0.00 56.93 53.76 2dxl s PHE 185 Cb 0.08 -2.54 0.82 0.00 0.51 0.00 0.00 43.02 41.89 2dxl s PHE 185 CO 0.60 -0.89 1.49 -0.35 0.70 0.00 0.00 175.22 176.76 2dxl n PRO 186 N 4.21 0.10 0.22 0.24 -0.04 -1.26 -2.07 135.00 136.40 2dxl n PRO 186 Ca 0.03 0.55 0.09 0.00 -0.04 0.00 0.00 63.50 64.14 2dxl n PRO 186 Cb 0.40 -1.81 0.48 0.00 -0.04 0.00 0.00 33.50 32.54 2dxl n PRO 186 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2dxl h SER 187 N 0.00 0.00 -3.29 3.54 0.87 -1.91 -3.42 113.55 109.34 2dxl h SER 187 Ca 0.00 0.00 -0.67 0.00 -1.23 0.00 0.00 61.79 59.89 2dxl h SER 187 Cb 0.06 0.00 -0.17 0.00 -0.44 0.00 0.00 62.40 61.86 2dxl h SER 187 CO 0.00 0.24 0.14 -0.22 -0.53 0.00 0.00 176.83 176.46 2dxl s LEU 188 N -6.96 4.76 0.00 2.23 2.96 -0.88 -1.04 118.68 119.75 2dxl s LEU 188 Ca -0.00 -0.74 0.00 0.00 -0.22 0.00 0.00 54.13 53.17 2dxl s LEU 188 Cb 0.11 -2.55 0.00 0.00 0.50 0.00 0.00 46.19 44.25 2dxl s LEU 188 CO 0.64 -0.93 0.00 0.35 -1.32 0.00 0.00 176.35 175.09 2dxl n THR 189 N 5.74 0.00 -4.62 3.68 -2.24 -0.60 -4.13 114.28 112.10 2dxl n THR 189 Ca -0.05 -0.45 -0.23 0.00 -2.27 0.00 0.00 64.05 61.05 2dxl n THR 189 Cb 0.46 0.97 -0.16 0.00 -2.10 0.00 0.00 70.33 69.51 2dxl n THR 189 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2dxl s ARG 190 N -1.01 1.36 -0.13 -0.78 1.81 -1.14 -0.89 118.95 118.17 2dxl s ARG 190 Ca 0.00 -0.47 0.00 0.00 -1.72 0.00 0.00 55.73 53.55 2dxl s ARG 190 Cb 0.00 -1.22 0.02 0.00 -0.45 0.00 0.00 34.95 33.30 2dxl s ARG 190 CO 0.00 0.19 -0.11 0.42 -0.68 0.00 0.00 175.30 175.13 2dxl s ILE 191 N 0.07 1.27 -0.09 1.52 1.01 0.55 -1.18 121.20 124.35 2dxl s ILE 191 Ca -0.02 -0.44 0.03 0.00 0.00 0.00 0.00 60.65 60.21 2dxl s ILE 191 Cb -0.10 -1.23 -0.02 0.00 0.01 0.00 0.00 42.46 41.13 2dxl s ILE 191 CO 0.01 0.41 -0.17 -0.36 0.00 0.00 0.00 174.94 174.83 2dxl s PHE 192 N 1.56 2.67 0.14 3.97 0.40 0.59 -1.54 117.98 125.77 2dxl s PHE 192 Ca 0.04 -0.54 0.04 0.00 -0.60 0.00 0.00 56.93 55.87 2dxl s PHE 192 Cb -0.13 -1.71 -0.04 0.00 0.51 0.00 0.00 43.02 41.65 2dxl s PHE 192 CO -0.09 -0.10 -0.10 0.00 0.70 0.00 0.00 175.22 175.63 2dxl n GLY 194 N -0.14 1.07 5.00 0.00 0.00 -0.29 -0.94 105.19 109.88 2dxl n GLY 194 Ca -0.11 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.21 2dxl n GLY 194 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2dxl n HIS 195 N 0.00 0.00 0.62 1.61 -0.00 -1.19 -4.48 115.22 111.78 2dxl n HIS 195 Ca 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.85 2dxl n HIS 195 Cb 0.00 0.00 0.45 0.00 -0.00 0.00 0.00 29.99 30.44 2dxl n HIS 195 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 2dxl n ASN 196 N 1.65 0.67 -3.96 0.26 4.13 -1.26 -4.94 115.26 111.80 2dxl n ASN 196 Ca 0.00 0.58 -0.33 0.00 1.68 0.00 0.00 54.58 56.51 2dxl n ASN 196 Cb 0.00 -0.75 -0.00 0.00 -1.54 0.00 0.00 39.78 37.48 2dxl n ASN 196 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2dxl n HIS 197 N -2.15 -1.60 -3.61 3.10 8.25 -1.21 -4.30 115.22 113.70 2dxl n HIS 197 Ca 0.05 0.47 -0.08 0.00 -0.26 0.00 0.00 57.72 57.90 2dxl n HIS 197 Cb 0.37 -3.27 -0.05 0.00 1.12 0.00 0.00 29.99 28.15 2dxl n HIS 197 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2dxl s SER 198 N -3.90 -0.27 -0.76 0.41 0.15 -0.35 -1.72 113.70 107.25 2dxl s SER 198 Ca 0.27 0.35 -0.20 0.00 0.70 0.00 0.00 55.95 57.06 2dxl s SER 198 Cb -0.12 0.30 0.10 0.00 -1.71 0.00 0.00 66.02 64.59 2dxl s SER 198 CO 0.92 -0.22 0.99 -0.22 1.20 0.00 0.00 173.24 175.92 2dxl s LEU 199 N -0.83 4.81 -0.02 3.45 0.20 -1.26 -2.37 118.68 122.67 2dxl s LEU 199 Ca 0.02 -1.49 0.07 0.00 0.69 0.00 0.00 54.13 53.42 2dxl s LEU 199 Cb -0.01 -2.39 -0.02 0.00 -0.43 0.00 0.00 46.19 43.34 2dxl s LEU 199 CO -0.03 -1.24 -0.23 0.42 -0.29 0.00 0.00 176.35 174.98 2dxl s THR 200 N 3.29 1.83 0.02 3.68 -4.23 -1.23 -4.97 115.64 114.02 2dxl s THR 200 Ca 0.25 -0.98 0.00 0.00 -1.18 0.00 0.00 61.69 59.78 2dxl s THR 200 Cb -0.13 -1.53 -0.01 0.00 1.34 0.00 0.00 72.50 72.17 2dxl s THR 200 CO 0.01 0.52 -0.03 0.00 -0.54 0.00 0.00 174.62 174.58 2dxl s MET 201 N -0.46 0.25 0.19 3.99 0.00 -1.26 -0.44 119.30 121.57 2dxl s MET 201 Ca 0.06 -0.43 -0.12 0.00 0.00 0.00 0.00 55.69 55.21 2dxl s MET 201 Cb -0.10 0.02 0.00 0.00 0.00 0.00 0.00 34.83 34.75 2dxl s MET 201 CO -0.00 -0.02 0.39 -0.08 0.00 0.00 0.00 175.02 175.31 2dxl s THR 202 N -0.97 0.04 0.04 3.16 -1.32 0.60 -5.00 115.64 112.19 2dxl s THR 202 Ca -0.10 -1.27 0.08 0.00 -1.21 0.00 0.00 61.69 59.20 2dxl s THR 202 Cb -0.07 -1.89 -0.03 0.00 -1.51 0.00 0.00 72.50 69.01 2dxl s THR 202 CO -0.01 -0.17 -0.23 -1.10 -2.21 0.00 0.00 174.62 170.90 2dxl s GLN 203 N -3.96 1.61 -0.19 7.08 -0.21 -1.26 -0.49 119.66 122.23 2dxl s GLN 203 Ca 0.17 -0.99 -0.01 0.00 0.02 0.00 0.00 55.36 54.56 2dxl s GLN 203 Cb 0.01 -1.72 0.05 0.00 1.00 0.00 0.00 33.01 32.36 2dxl s GLN 203 CO 0.02 0.45 -0.01 -0.47 -2.12 0.00 0.00 175.29 173.15 2dxl s TYR 204 N -0.76 1.59 0.00 0.91 5.04 -0.23 -4.98 117.35 118.92 2dxl s TYR 204 Ca 0.09 -1.16 0.00 0.00 -2.44 0.00 0.00 57.07 53.56 2dxl s TYR 204 Cb -0.09 -1.26 0.00 0.00 0.35 0.00 0.00 41.96 40.96 2dxl s TYR 204 CO 0.01 -0.65 0.00 0.54 -1.34 0.00 0.00 175.55 174.11 2dxl n ARG 205 N 4.90 0.00 0.03 4.97 5.12 -1.26 -1.34 116.66 129.08 2dxl n ARG 205 Ca -0.11 0.00 0.13 0.00 -1.93 0.00 0.00 57.85 55.94 2dxl n ARG 205 Cb 0.46 0.00 0.39 0.00 -1.16 0.00 0.00 32.46 32.15 2dxl n ARG 205 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2dxl n GLN 206 N 14.00 0.11 -2.99 5.56 3.00 -1.26 -4.86 117.38 130.93 2dxl n GLN 206 Ca 0.00 0.06 -0.41 0.00 -0.01 0.00 0.00 57.00 56.64 2dxl n GLN 206 Cb 0.00 -1.59 -0.05 0.00 0.00 0.00 0.00 30.24 28.60 2dxl n GLN 206 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2dxl s ALA 207 N -3.05 3.60 -0.18 -1.58 0.00 -0.45 -4.62 121.76 115.47 2dxl s ALA 207 Ca 0.11 -0.21 -0.29 0.00 0.00 0.00 0.00 51.96 51.57 2dxl s ALA 207 Cb 0.16 -3.15 -0.00 0.00 0.00 0.00 0.00 23.12 20.13 2dxl s ALA 207 CO 0.63 -0.77 1.12 -1.17 0.00 0.00 0.00 175.76 175.56 2dxl s LEU 208 N 2.45 4.16 -0.16 0.00 1.98 -0.07 -1.07 118.68 125.96 2dxl s LEU 208 Ca 0.32 1.53 0.00 0.00 -2.89 0.00 0.00 54.13 53.09 2dxl s LEU 208 Cb -0.16 -3.54 0.00 0.00 0.66 0.00 0.00 46.19 43.15 2dxl s LEU 208 CO 0.09 -0.66 -0.16 -0.63 -1.89 0.00 0.00 176.35 173.10 2dxl s ILE 209 N 3.06 2.58 -0.04 6.68 1.01 0.36 -0.33 121.20 134.52 2dxl s ILE 209 Ca 0.49 -0.79 -0.06 0.00 0.00 0.00 0.00 60.65 60.29 2dxl s ILE 209 Cb -0.18 -2.09 0.01 0.00 0.01 0.00 0.00 42.46 40.21 2dxl s ILE 209 CO 0.11 0.51 0.14 -0.55 0.00 0.00 0.00 174.94 175.16 2dxl s SER 210 N 0.95 -0.09 0.48 3.58 0.15 -0.59 -0.29 113.70 117.88 2dxl s SER 210 Ca -0.03 0.14 -0.01 0.00 0.70 0.00 0.00 55.95 56.74 2dxl s SER 210 Cb -0.15 0.27 -0.00 0.00 -1.71 0.00 0.00 66.02 64.43 2dxl s SER 210 CO -0.02 -0.15 0.73 0.42 1.20 0.00 0.00 173.24 175.41 2dxl s THR 211 N -0.38 3.99 0.04 6.45 -4.23 0.41 -1.22 115.64 120.70 2dxl s THR 211 Ca -0.05 -0.35 0.05 0.00 -1.18 0.00 0.00 61.69 60.17 2dxl s THR 211 Cb -0.03 -3.50 -0.03 0.00 1.34 0.00 0.00 72.50 70.27 2dxl s THR 211 CO 0.01 -0.40 -0.11 -0.76 -0.54 0.00 0.00 174.62 172.82 2dxl s LEU 212 N -4.66 2.96 0.83 4.79 1.02 -0.12 -3.53 118.68 119.98 2dxl s LEU 212 Ca 0.49 -0.29 -0.14 0.00 0.02 0.00 0.00 54.13 54.22 2dxl s LEU 212 Cb -0.10 -1.73 0.05 0.00 0.02 0.00 0.00 46.19 44.43 2dxl s LEU 212 CO 0.40 0.25 0.86 -0.81 0.02 0.00 0.00 176.35 177.07 2dxl n PRO 213 N 1.35 0.05 -2.09 1.29 -0.04 -1.11 -1.22 135.00 133.23 2dxl n PRO 213 Ca -0.15 0.08 -0.29 0.00 -0.04 0.00 0.00 63.50 63.10 2dxl n PRO 213 Cb 0.52 -2.16 0.04 0.00 -0.04 0.00 0.00 33.50 31.86 2dxl n PRO 213 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2dxl s GLY 214 N -1.99 1.62 0.45 0.55 0.00 -1.26 -4.40 107.32 102.29 2dxl s GLY 214 Ca 0.67 -0.47 0.25 0.00 0.00 0.00 0.00 44.72 45.18 2dxl s GLY 214 CO 0.57 -0.14 1.81 -0.91 0.00 0.00 0.00 173.10 174.43 2dxl h THR 215 N -0.45 0.39 0.00 0.90 1.35 -1.58 -3.34 112.91 110.18 2dxl h THR 215 Ca -0.45 -1.05 0.00 0.00 -0.55 0.00 0.00 66.41 64.36 2dxl h THR 215 Cb 1.25 1.78 0.00 0.00 -1.73 0.00 0.00 68.15 69.45 2dxl h THR 215 CO 0.63 0.17 0.00 0.52 -0.25 0.00 0.00 175.52 176.58 2dxl n VAL 216 N -3.28 0.00 -2.62 6.82 0.31 -1.26 -4.74 118.33 113.56 2dxl n VAL 216 Ca 0.01 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.03 2dxl n VAL 216 Cb 0.43 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.34 2dxl n VAL 216 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 2dxl s HIS 217 N 0.49 3.48 0.27 3.52 0.00 -1.26 -4.50 115.29 117.29 2dxl s HIS 217 Ca 0.00 1.19 0.12 0.00 -3.00 0.00 0.00 55.06 53.37 2dxl s HIS 217 Cb 0.00 -2.57 -0.05 0.00 -4.00 0.00 0.00 32.58 25.96 2dxl s HIS 217 CO 0.00 -0.24 -0.19 -0.65 -1.00 0.00 0.00 174.74 172.65 2dxl s GLN 218 N -4.06 1.69 -0.11 -0.38 -1.52 0.28 -4.25 119.66 111.32 2dxl s GLN 218 Ca 0.54 -1.72 0.03 0.00 -1.95 0.00 0.00 55.36 52.26 2dxl s GLN 218 Cb -0.10 -1.80 0.00 0.00 -0.22 0.00 0.00 33.01 30.89 2dxl s GLN 218 CO 0.34 0.34 -0.22 0.54 -0.25 0.00 0.00 175.29 176.04 2dxl s VAL 219 N -2.41 1.94 0.54 1.09 0.11 -0.70 -0.24 120.40 120.73 2dxl s VAL 219 Ca 0.29 -0.94 -0.17 0.00 -2.93 0.00 0.00 61.98 58.23 2dxl s VAL 219 Cb -0.05 -1.70 -0.06 0.00 -1.53 0.00 0.00 36.38 33.03 2dxl s VAL 219 CO 0.15 0.53 1.03 -2.16 -3.33 0.00 0.00 175.10 171.32 2dxl s PRO 220 N 0.53 3.65 -0.26 1.54 0.04 -1.26 -4.58 135.00 134.65 2dxl s PRO 220 Ca -0.15 1.15 -0.26 0.00 0.04 0.00 0.00 61.00 61.79 2dxl s PRO 220 Cb -0.17 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.29 2dxl s PRO 220 CO 0.05 -0.54 0.89 -0.47 0.04 0.00 0.00 177.00 176.97 2dxl s TYR 221 N -2.41 3.27 0.02 0.56 5.04 -1.26 -4.97 117.35 117.61 2dxl s TYR 221 Ca 0.63 1.13 0.09 0.00 -2.44 0.00 0.00 57.07 56.47 2dxl s TYR 221 Cb -0.14 -3.21 -0.03 0.00 0.35 0.00 0.00 41.96 38.94 2dxl s TYR 221 CO 0.31 -0.50 -0.25 0.00 -1.34 0.00 0.00 175.55 173.77 2dxl n HIS 223 N 1.98 0.48 -0.04 0.00 -0.00 -1.26 0.18 115.22 116.56 2dxl n HIS 223 Ca -0.17 0.12 -0.16 0.00 0.46 0.00 0.00 57.72 57.98 2dxl n HIS 223 Cb 0.52 -1.06 -0.14 0.00 -0.12 0.00 0.00 29.99 29.19 2dxl n HIS 223 CO 0.00 0.00 0.00 -1.91 0.46 0.00 0.00 176.34 174.89 2dxl n GLU 224 N -3.56 0.70 -3.12 1.57 0.00 -1.26 -4.11 120.64 110.85 2dxl n GLU 224 Ca -0.42 0.22 -0.40 0.00 0.00 0.00 0.00 57.16 56.56 2dxl n GLU 224 Cb 0.97 -1.68 -0.06 0.00 0.00 0.00 0.00 31.44 30.67 2dxl n GLU 224 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 2dxl s ASP 225 N -6.50 6.63 0.04 4.31 3.68 -1.26 -4.97 116.67 118.60 2dxl s ASP 225 Ca -0.18 0.77 0.23 0.00 2.13 0.00 0.00 52.55 55.50 2dxl s ASP 225 Cb 0.07 -2.34 0.12 0.00 -1.45 0.00 0.00 42.92 39.32 2dxl s ASP 225 CO 0.76 -0.30 1.10 0.35 0.13 0.00 0.00 175.17 177.21 2dxl n THR 226 N 4.88 0.14 -1.49 1.71 -2.24 -1.26 -4.26 114.28 111.76 2dxl n THR 226 Ca -0.01 -0.19 -0.58 0.00 -2.27 0.00 0.00 64.05 61.00 2dxl n THR 226 Cb 0.49 0.25 -0.08 0.00 -2.10 0.00 0.00 70.33 68.89 2dxl n THR 226 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2dxl n ASP 227 N -1.87 0.76 -3.81 3.42 9.92 -1.26 -4.67 116.55 119.04 2dxl n ASP 227 Ca 0.03 1.05 -0.42 0.00 -0.53 0.00 0.00 54.79 54.92 2dxl n ASP 227 Cb 0.41 -0.79 -0.03 0.00 -0.64 0.00 0.00 41.12 40.07 2dxl n ASP 227 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 2dxl n PRO 228 N 2.91 2.07 -2.13 -0.24 -0.04 -1.26 -4.92 135.00 131.38 2dxl n PRO 228 Ca 0.25 -2.25 -0.34 0.00 -0.04 0.00 0.00 63.50 61.12 2dxl n PRO 228 Cb -0.02 -3.15 0.01 0.00 -0.04 0.00 0.00 33.50 30.30 2dxl n PRO 228 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2dxl s TYR 229 N 4.91 2.72 0.07 0.54 2.02 -1.26 -5.08 117.35 121.27 2dxl s TYR 229 Ca 0.55 1.55 -0.07 0.00 -0.37 0.00 0.00 57.07 58.72 2dxl s TYR 229 Cb 0.12 -3.21 -0.01 0.00 -0.40 0.00 0.00 41.96 38.47 2dxl s TYR 229 CO 0.05 -1.49 0.15 1.52 -1.57 0.00 0.00 175.55 174.21 2dxl s TYR 230 N -2.01 0.19 0.30 2.71 1.13 -1.26 -4.61 117.35 113.80 2dxl s TYR 230 Ca 0.70 -0.58 -0.09 0.00 -1.41 0.00 0.00 57.07 55.69 2dxl s TYR 230 Cb -0.21 -0.11 0.00 0.00 -1.10 0.00 0.00 41.96 40.54 2dxl s TYR 230 CO 0.31 -0.48 0.50 0.16 -2.51 0.00 0.00 175.55 173.53 2dxl s ASP 231 N -2.64 0.34 -0.55 -0.18 1.47 0.66 -4.98 116.67 110.79 2dxl s ASP 231 Ca 0.02 -1.20 0.02 0.00 1.18 0.00 0.00 52.55 52.57 2dxl s ASP 231 Cb 0.04 0.64 0.44 0.00 -0.34 0.00 0.00 42.92 43.69 2dxl s ASP 231 CO -0.09 -1.26 1.66 0.18 0.68 0.00 0.00 175.17 176.34 2dxl n LEU 232 N -0.47 6.45 -4.63 2.11 4.77 -1.26 -0.56 117.00 123.42 2dxl n LEU 232 Ca -0.01 -4.63 -0.30 0.00 -0.03 0.00 0.00 56.01 51.05 2dxl n LEU 232 Cb 0.62 -0.73 0.18 0.00 -2.33 0.00 0.00 43.42 41.16 2dxl n LEU 232 CO 0.26 1.81 0.62 -0.94 -1.33 0.00 0.00 177.39 177.81 2dxl s SER 233 N -2.48 2.48 0.21 -1.43 1.04 -1.26 -4.87 113.70 107.38 2dxl s SER 233 Ca 0.57 1.67 -0.32 0.00 0.48 0.00 0.00 55.95 58.35 2dxl s SER 233 Cb 0.45 -2.31 -0.13 0.00 0.10 0.00 0.00 66.02 64.13 2dxl s SER 233 CO -0.07 -3.29 1.53 -2.65 0.98 0.00 0.00 173.24 169.74 2dxl n PRO 234 N -4.32 2.22 -3.10 4.02 -0.02 -1.26 -4.66 135.00 127.88 2dxl n PRO 234 Ca 0.07 0.80 -0.33 0.00 -2.02 0.00 0.00 63.50 62.01 2dxl n PRO 234 Cb 0.54 -2.53 -0.06 0.00 -0.02 0.00 0.00 33.50 31.42 2dxl n PRO 234 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2dxl s ALA 235 N 0.48 3.31 0.33 3.55 0.00 -1.26 -5.00 121.76 123.17 2dxl s ALA 235 Ca 0.73 0.10 -0.07 0.00 0.00 0.00 0.00 51.96 52.72 2dxl s ALA 235 Cb -0.63 -2.81 0.01 0.00 0.00 0.00 0.00 23.12 19.68 2dxl s ALA 235 CO 0.43 0.31 0.52 -1.54 0.00 0.00 0.00 175.76 175.48 2dxl s SER 236 N -2.16 0.55 0.33 0.00 1.04 -1.26 -0.97 113.70 111.24 2dxl s SER 236 Ca 0.53 -1.31 0.06 0.00 0.48 0.00 0.00 55.95 55.70 2dxl s SER 236 Cb -0.11 0.67 -0.02 0.00 0.10 0.00 0.00 66.02 66.66 2dxl s SER 236 CO 0.18 -1.32 0.21 0.00 0.98 0.00 0.00 173.24 173.28 2dxl s LEU 238 N 0.00 3.22 -0.21 0.00 2.96 -0.48 -0.40 118.68 123.77 2dxl s LEU 238 Ca 0.29 -0.13 -0.11 0.00 -0.22 0.00 0.00 54.13 53.97 2dxl s LEU 238 Cb 0.01 -1.77 -0.05 0.00 0.50 0.00 0.00 46.19 44.89 2dxl s LEU 238 CO 0.21 0.18 0.16 -0.04 -1.32 0.00 0.00 176.35 175.55 2dxl s MET 239 N 0.27 4.16 -0.23 1.98 -1.94 -0.28 0.27 119.30 123.52 2dxl s MET 239 Ca -0.03 -0.19 -0.06 0.00 -1.71 0.00 0.00 55.69 53.70 2dxl s MET 239 Cb -0.14 -3.46 -0.02 0.00 2.01 0.00 0.00 34.83 33.21 2dxl s MET 239 CO 0.03 0.20 0.02 -1.01 -0.01 0.00 0.00 175.02 174.26 2dxl s HIS 240 N 0.63 3.05 -0.01 -0.03 3.76 0.34 -1.43 115.29 121.60 2dxl s HIS 240 Ca 0.09 -0.53 0.05 0.00 -0.15 0.00 0.00 55.06 54.52 2dxl s HIS 240 Cb -0.12 -2.16 -0.01 0.00 1.11 0.00 0.00 32.58 31.39 2dxl s HIS 240 CO 0.01 -0.35 -0.17 0.50 -0.85 0.00 0.00 174.74 173.87 2dxl s ARG 241 N 1.38 1.38 -0.26 1.40 3.52 0.20 0.29 118.95 126.86 2dxl s ARG 241 Ca 0.05 -0.65 -0.24 0.00 -0.13 0.00 0.00 55.73 54.76 2dxl s ARG 241 Cb -0.15 -1.35 -0.00 0.00 -1.56 0.00 0.00 34.95 31.89 2dxl s ARG 241 CO 0.02 0.37 0.82 -1.14 -0.81 0.00 0.00 175.30 174.55 2dxl s GLN 242 N -0.49 4.14 -0.39 5.12 2.00 -0.31 -1.14 119.66 128.59 2dxl s GLN 242 Ca 0.06 0.86 0.03 0.00 -2.00 0.00 0.00 55.36 54.31 2dxl s GLN 242 Cb -0.07 -3.66 0.11 0.00 0.80 0.00 0.00 33.01 30.19 2dxl s GLN 242 CO -0.00 -0.55 0.14 0.08 -0.50 0.00 0.00 175.29 174.45 2dxl s VAL 243 N 2.87 1.93 0.00 1.34 1.01 0.81 -4.51 120.40 123.84 2dxl s VAL 243 Ca 0.34 -2.41 0.00 0.00 0.00 0.00 0.00 61.98 59.91 2dxl s VAL 243 Cb -0.15 -2.40 0.00 0.00 0.00 0.00 0.00 36.38 33.83 2dxl s VAL 243 CO 0.09 -0.71 0.00 0.61 0.00 0.00 0.00 175.10 175.09 2dxl n GLY 244 N 4.00 3.37 0.00 4.51 0.00 -1.26 -1.39 105.19 114.41 2dxl n GLY 244 Ca 0.04 -0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.14 2dxl n GLY 244 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dxl n GLU 245 N 14.00 0.45 -3.88 1.61 4.71 -1.26 -4.83 120.64 131.44 2dxl n GLU 245 Ca 0.00 0.04 -0.36 0.00 -0.01 0.00 0.00 57.16 56.83 2dxl n GLU 245 Cb 0.00 -1.50 -0.07 0.00 -1.01 0.00 0.00 31.44 28.86 2dxl n GLU 245 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 2dxl s GLN 246 N -2.47 3.68 -0.29 3.49 -1.52 -0.49 -5.07 119.66 117.00 2dxl s GLN 246 Ca 0.27 -0.19 -0.20 0.00 -1.95 0.00 0.00 55.36 53.29 2dxl s GLN 246 Cb 0.17 -3.23 -0.01 0.00 -0.22 0.00 0.00 33.01 29.72 2dxl s GLN 246 CO 0.38 0.59 0.60 -0.46 -0.25 0.00 0.00 175.29 176.14 2dxl s TRP 247 N -0.48 3.24 -0.04 0.91 -0.11 -1.26 -0.13 118.94 121.06 2dxl s TRP 247 Ca 0.12 0.61 0.05 0.00 1.22 0.00 0.00 56.10 58.11 2dxl s TRP 247 Cb -0.12 -2.90 -0.02 0.00 -1.50 0.00 0.00 33.47 28.94 2dxl s TRP 247 CO 0.02 -0.41 -0.20 0.14 -4.62 0.00 0.00 176.95 171.88 2dxl s VAL 248 N 2.51 2.57 -0.09 5.86 -7.23 -0.29 -4.99 120.40 118.75 2dxl s VAL 248 Ca 0.24 -0.90 0.04 0.00 -1.81 0.00 0.00 61.98 59.55 2dxl s VAL 248 Cb -0.15 -1.96 -0.01 0.00 0.56 0.00 0.00 36.38 34.82 2dxl s VAL 248 CO 0.11 0.58 -0.23 -0.44 -0.31 0.00 0.00 175.10 174.81 2dxl s SER 249 N -0.57 3.21 -0.00 4.85 0.01 -1.26 -0.63 113.70 119.31 2dxl s SER 249 Ca 0.08 -0.51 0.03 0.00 1.31 0.00 0.00 55.95 56.86 2dxl s SER 249 Cb -0.11 -1.21 -0.01 0.00 0.21 0.00 0.00 66.02 64.90 2dxl s SER 249 CO 0.01 0.20 -0.08 -0.72 0.41 0.00 0.00 173.24 173.05 2dxl s TYR 250 N 0.13 0.73 0.02 2.43 -0.85 -0.51 -4.97 117.35 114.32 2dxl s TYR 250 Ca -0.12 -0.16 -0.30 0.00 -0.52 0.00 0.00 57.07 55.97 2dxl s TYR 250 Cb -0.16 -0.47 -0.06 0.00 0.38 0.00 0.00 41.96 41.66 2dxl s TYR 250 CO 0.06 -0.01 1.34 -1.14 -1.52 0.00 0.00 175.55 174.28 2dxl s GLN 251 N -0.28 4.32 -0.32 -3.49 0.74 -1.26 -1.13 119.66 118.25 2dxl s GLN 251 Ca 0.03 1.91 -0.04 0.00 0.05 0.00 0.00 55.36 57.30 2dxl s GLN 251 Cb -0.04 -3.49 0.04 0.00 1.10 0.00 0.00 33.01 30.63 2dxl s GLN 251 CO -0.00 -0.49 0.05 -1.58 -0.55 0.00 0.00 175.29 172.72 2dxl s HIS 252 N 1.98 3.25 0.33 1.67 5.65 0.47 -4.95 115.29 123.70 2dxl s HIS 252 Ca 0.62 -1.62 -0.29 0.00 0.25 0.00 0.00 55.06 54.02 2dxl s HIS 252 Cb -0.31 -2.19 -0.11 0.00 -1.18 0.00 0.00 32.58 28.79 2dxl s HIS 252 CO 0.27 -0.76 1.45 0.45 -0.65 0.00 0.00 174.74 175.50 2dxl s SER 253 N 1.33 6.51 0.00 9.88 0.15 -1.26 -1.06 113.70 129.25 2dxl s SER 253 Ca -0.03 2.88 0.12 0.00 0.70 0.00 0.00 55.95 59.62 2dxl s SER 253 Cb -0.19 -2.65 0.34 0.00 -1.71 0.00 0.00 66.02 61.80 2dxl s SER 253 CO 0.01 -0.76 1.28 0.18 1.20 0.00 0.00 173.24 175.14 2dxl n LEU 254 N 1.09 3.02 -4.86 3.45 4.77 -0.14 -4.88 117.00 119.46 2dxl n LEU 254 Ca 0.03 -1.97 -0.30 0.00 -0.03 0.00 0.00 56.01 53.74 2dxl n LEU 254 Cb 0.40 -0.26 0.08 0.00 -2.33 0.00 0.00 43.42 41.31 2dxl n LEU 254 CO 0.62 0.75 0.75 0.00 -1.33 0.00 0.00 177.39 178.18 2dxl s ALA 255 N -1.00 2.57 -0.19 -1.18 0.00 -1.22 -4.90 121.76 115.84 2dxl s ALA 255 Ca 0.26 -0.41 -0.07 0.00 0.00 0.00 0.00 51.96 51.74 2dxl s ALA 255 Cb 0.14 -3.03 -0.04 0.00 0.00 0.00 0.00 23.12 20.19 2dxl s ALA 255 CO 0.18 -1.53 0.06 -1.01 0.00 0.00 0.00 175.76 173.46 2dxl s HIS 256 N -3.36 3.23 0.17 0.00 3.76 -1.26 -5.08 115.29 112.74 2dxl s HIS 256 Ca 0.60 0.02 -0.10 0.00 -0.15 0.00 0.00 55.06 55.44 2dxl s HIS 256 Cb -0.12 -2.08 -0.00 0.00 1.11 0.00 0.00 32.58 31.48 2dxl s HIS 256 CO 0.52 0.11 0.31 1.52 -0.85 0.00 0.00 174.74 176.34 2dxl s TYR 257 N 0.46 0.34 0.28 1.40 -0.85 -1.26 -5.14 117.35 112.58 2dxl s TYR 257 Ca 0.03 -0.70 -0.29 0.00 -0.52 0.00 0.00 57.07 55.59 2dxl s TYR 257 Cb -0.13 -0.01 -0.10 0.00 0.38 0.00 0.00 41.96 42.11 2dxl s TYR 257 CO 0.01 -0.74 1.23 0.00 -1.52 0.00 0.00 175.55 174.53 2dxl s ALA 258 N -3.96 3.47 0.00 9.51 0.00 -1.26 -4.90 121.76 124.63 2dxl s ALA 258 Ca 0.16 1.10 0.00 0.00 0.00 0.00 0.00 51.96 53.22 2dxl s ALA 258 Cb 0.03 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.72 2dxl s ALA 258 CO -0.01 -0.45 0.00 0.41 0.00 0.00 0.00 175.76 175.71 2dxl n GLY 259 N 1.29 -0.26 3.95 0.00 0.00 -1.26 -4.97 105.19 103.94 2dxl n GLY 259 Ca 0.01 -2.28 -0.23 0.00 0.00 0.00 0.00 46.02 43.52 2dxl n GLY 259 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dxl s PRO 260 N -0.89 2.94 0.44 1.61 0.04 -1.26 -5.22 135.00 132.67 2dxl s PRO 260 Ca 0.00 -0.44 0.05 0.00 0.04 0.00 0.00 61.00 60.65 2dxl s PRO 260 Cb 0.00 -2.49 -0.06 0.00 0.04 0.00 0.00 34.50 31.99 2dxl s PRO 260 CO 0.00 -0.43 0.02 -1.58 0.04 0.00 0.00 177.00 175.04 2dxl s TRP 261 N -2.68 2.32 -0.07 0.56 0.51 -1.26 -5.15 118.94 113.18 2dxl s TRP 261 Ca 0.51 -0.75 -0.06 0.00 -2.12 0.00 0.00 56.10 53.68 2dxl s TRP 261 Cb -0.10 -1.74 -0.04 0.00 -0.81 0.00 0.00 33.47 30.78 2dxl s TRP 261 CO 0.39 0.37 0.18 -0.51 -0.51 0.00 0.00 176.95 176.87 2dxl s LEU 262 N -3.77 4.39 -0.05 2.99 1.43 -1.26 -5.06 118.68 117.35 2dxl s LEU 262 Ca 0.27 0.47 -0.30 0.00 -1.03 0.00 0.00 54.13 53.53 2dxl s LEU 262 Cb 0.07 -2.30 -0.03 0.00 0.03 0.00 0.00 46.19 43.96 2dxl s LEU 262 CO 0.14 0.35 1.18 -0.47 0.23 0.00 0.00 176.35 177.78 2dxl s TYR 263 N -1.14 3.25 -0.15 0.29 5.04 -1.26 -5.01 117.35 118.38 2dxl s TYR 263 Ca 0.20 1.27 0.01 0.00 -2.44 0.00 0.00 57.07 56.11 2dxl s TYR 263 Cb -0.12 -3.39 0.02 0.00 0.35 0.00 0.00 41.96 38.81 2dxl s TYR 263 CO 0.10 -1.19 -0.17 0.34 -1.34 0.00 0.00 175.55 173.29 2dxl s ASP 264 N 1.39 2.79 0.35 4.32 -1.08 -1.26 -5.04 116.67 118.15 2dxl s ASP 264 Ca 0.55 -0.53 0.04 0.00 -0.52 0.00 0.00 52.55 52.10 2dxl s ASP 264 Cb -0.25 -1.26 0.68 0.00 -1.46 0.00 0.00 42.92 40.63 2dxl s ASP 264 CO 0.23 -0.02 1.97 -0.08 0.52 0.00 0.00 175.17 177.78 2dxl h GLU 265 N 7.85 0.80 -0.02 4.34 4.81 -1.99 -0.43 114.58 129.94 2dxl h GLU 265 Ca -0.38 -0.05 -0.15 0.00 -0.13 0.00 0.00 59.36 58.65 2dxl h GLU 265 Cb 1.15 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 30.33 2dxl h GLU 265 CO 0.55 0.53 -0.68 -0.97 -0.73 0.00 0.00 179.01 177.71 2dxl h ASN 266 N 0.83 0.12 0.38 1.04 -0.73 -1.96 -2.54 115.58 112.72 2dxl h ASN 266 Ca 0.30 -0.08 -0.17 0.00 1.87 0.00 0.00 56.30 58.23 2dxl h ASN 266 Cb 0.16 -0.03 -0.01 0.00 0.27 0.00 0.00 38.32 38.70 2dxl h ASN 266 CO -0.10 0.76 -0.72 0.40 -0.37 0.00 0.00 177.43 177.41 2dxl h ILE 267 N 0.07 1.41 -0.54 2.57 2.04 -1.82 -3.19 117.51 118.04 2dxl h ILE 267 Ca -0.01 -2.20 -0.09 0.00 1.00 0.00 0.00 64.86 63.56 2dxl h ILE 267 Cb 1.21 2.16 -0.02 0.00 -0.74 0.00 0.00 36.82 39.43 2dxl h ILE 267 CO 0.10 0.65 0.00 -1.28 0.00 0.00 0.00 178.15 177.62 2dxl h SER 268 N 0.19 0.94 -2.69 1.72 0.87 -0.89 -3.38 113.55 110.32 2dxl h SER 268 Ca -0.02 -0.30 -0.60 0.00 -1.23 0.00 0.00 61.79 59.64 2dxl h SER 268 Cb 1.28 -0.25 -0.39 0.00 -0.44 0.00 0.00 62.40 62.59 2dxl h SER 268 CO 0.11 1.02 -0.86 0.00 -0.53 0.00 0.00 176.83 176.57 2dxl s PRO 270 N 0.11 3.19 0.00 0.00 0.02 -1.21 -4.79 135.00 132.33 2dxl s PRO 270 Ca 0.26 1.35 0.09 0.00 0.02 0.00 0.00 61.00 62.72 2dxl s PRO 270 Cb -0.07 -2.01 0.07 0.00 0.02 0.00 0.00 34.50 32.51 2dxl s PRO 270 CO -0.12 -0.93 0.77 0.25 -0.33 0.00 0.00 177.00 176.65