#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ooy n ASP 3 N 0.00 -0.00 0.28 3.17 2.03 -1.26 -4.58 116.55 116.18 2ooy n ASP 3 Ca 0.00 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.20 2ooy n ASP 3 Cb 0.00 0.01 -0.05 0.00 -0.72 0.00 0.00 41.12 40.36 2ooy n ASP 3 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2ooy h VAL 4 N 0.00 0.00 -0.96 5.18 2.07 -2.00 -2.69 116.25 117.85 2ooy h VAL 4 Ca 0.00 -0.34 0.40 0.00 0.82 0.00 0.00 66.70 67.58 2ooy h VAL 4 Cb 0.00 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 29.60 2ooy h VAL 4 CO 0.00 0.00 0.53 1.67 0.02 0.00 0.00 177.57 179.79 2ooy n GLN 5 N -4.93 -0.05 -0.00 1.57 -0.06 -1.26 -1.12 117.38 111.53 2ooy n GLN 5 Ca -0.09 1.28 -0.07 0.00 -2.00 0.00 0.00 57.00 56.12 2ooy n GLN 5 Cb 0.29 -2.32 -0.13 0.00 -4.06 0.00 0.00 30.24 24.02 2ooy n GLN 5 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 2ooy h GLU 6 N 0.00 0.00 -0.43 3.69 3.07 -1.81 -3.24 114.58 115.86 2ooy h GLU 6 Ca 0.80 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 59.58 2ooy h GLU 6 Cb 2.15 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 30.04 2ooy h GLU 6 CO -0.70 0.51 -0.03 1.15 -1.40 0.00 0.00 179.01 178.53 2ooy h THR 7 N 0.00 1.24 0.78 1.13 2.02 -0.76 -2.56 112.91 114.76 2ooy h THR 7 Ca -0.23 -1.01 -0.04 0.00 0.77 0.00 0.00 66.41 65.89 2ooy h THR 7 Cb 1.91 0.95 0.01 0.00 -1.74 0.00 0.00 68.15 69.27 2ooy h THR 7 CO 0.08 0.35 -0.40 -0.61 0.37 0.00 0.00 175.52 175.31 2ooy h GLN 8 N 0.68 -1.04 -0.75 6.66 5.75 -1.62 0.15 115.11 124.94 2ooy h GLN 8 Ca 0.13 0.07 0.12 0.00 -0.15 0.00 0.00 58.65 58.82 2ooy h GLN 8 Cb 0.47 0.24 -0.12 0.00 1.07 0.00 0.00 27.48 29.13 2ooy h GLN 8 CO 0.02 -0.69 -0.27 1.17 -2.65 0.00 0.00 178.83 176.41 2ooy n LYS 9 N -4.97 -0.15 0.04 1.69 0.00 -1.16 0.07 118.16 113.67 2ooy n LYS 9 Ca -0.13 1.15 -0.18 0.00 0.00 0.00 0.00 58.31 59.15 2ooy n LYS 9 Cb 0.43 -1.71 -0.09 0.00 0.00 0.00 0.00 35.03 33.66 2ooy n LYS 9 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 2ooy h GLY 10 N 0.00 0.74 0.01 3.14 0.00 -1.27 -2.47 103.07 103.22 2ooy h GLY 10 Ca 0.28 -1.25 0.00 0.00 0.00 0.00 0.00 47.33 46.37 2ooy h GLY 10 CO -0.75 1.10 -0.12 0.00 0.00 0.00 0.00 176.54 176.77 2ooy h ALA 11 N 0.50 -0.63 -0.85 3.60 0.00 0.14 -2.19 119.26 119.83 2ooy h ALA 11 Ca -0.11 -0.02 0.22 0.00 0.00 0.00 0.00 54.91 55.00 2ooy h ALA 11 Cb 1.63 0.58 -0.14 0.00 0.00 0.00 0.00 17.79 19.86 2ooy h ALA 11 CO 0.19 -0.66 0.21 -0.07 0.00 0.00 0.00 179.25 178.92 2ooy h LEU 12 N -0.16 -0.03 -0.32 0.00 3.38 -0.34 0.22 115.31 118.06 2ooy h LEU 12 Ca 0.00 0.19 0.05 0.00 0.09 0.00 0.00 57.88 58.22 2ooy h LEU 12 Cb 0.17 0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 2ooy h LEU 12 CO -0.07 -0.14 0.01 0.11 0.09 0.00 0.00 178.44 178.43 2ooy h LYS 13 N 0.21 0.10 -0.56 1.13 1.57 -1.38 1.06 116.57 118.71 2ooy h LYS 13 Ca 0.52 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.31 2ooy h LYS 13 Cb 1.02 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.27 2ooy h LYS 13 CO -0.64 0.07 0.35 0.93 -0.57 0.00 0.00 179.45 179.59 2ooy h GLU 14 N 0.10 0.68 0.93 3.15 4.39 -0.35 0.08 114.58 123.57 2ooy h GLU 14 Ca 0.15 -0.04 -0.05 0.00 0.34 0.00 0.00 59.36 59.77 2ooy h GLU 14 Cb 0.20 -0.15 0.01 0.00 -0.10 0.00 0.00 28.75 28.71 2ooy h GLU 14 CO -0.25 0.45 -0.45 0.82 -1.16 0.00 0.00 179.01 178.42 2ooy h ILE 15 N 0.70 0.08 0.00 3.13 2.04 -0.53 -0.22 117.51 122.71 2ooy h ILE 15 Ca 0.22 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 66.07 2ooy h ILE 15 Cb -0.02 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.14 2ooy h ILE 15 CO -0.08 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.08 2ooy n GLN 16 N -5.63 0.00 -0.31 2.37 6.02 0.36 0.27 117.38 120.46 2ooy n GLN 16 Ca -0.16 0.76 0.18 0.00 -0.01 0.00 0.00 57.00 57.76 2ooy n GLN 16 Cb 0.50 -1.18 0.37 0.00 1.02 0.00 0.00 30.24 30.95 2ooy n GLN 16 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ooy h ALA 17 N -1.02 1.54 0.12 -1.58 0.00 -0.94 0.31 119.26 117.69 2ooy h ALA 17 Ca 0.00 0.22 0.01 0.00 0.00 0.00 0.00 54.91 55.15 2ooy h ALA 17 Cb 0.00 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 2ooy h ALA 17 CO 0.00 -0.53 -0.21 0.35 0.00 0.00 0.00 179.25 178.86 2ooy h PHE 18 N 0.23 -0.55 -0.64 0.00 3.04 0.12 0.53 116.94 119.67 2ooy h PHE 18 Ca 0.63 0.01 0.13 0.00 3.98 0.00 0.00 57.97 62.73 2ooy h PHE 18 Cb 1.37 0.23 -0.11 0.00 2.56 0.00 0.00 35.95 39.99 2ooy h PHE 18 CO -0.18 -0.30 -0.03 0.82 -2.02 0.00 0.00 178.31 176.60 2ooy h ILE 19 N -0.40 0.45 0.00 1.41 1.08 0.36 0.20 117.51 120.61 2ooy h ILE 19 Ca 0.02 -0.03 -0.03 0.00 -0.39 0.00 0.00 64.86 64.43 2ooy h ILE 19 Cb 0.41 0.35 -0.00 0.00 -3.07 0.00 0.00 36.82 34.51 2ooy h ILE 19 CO -0.11 0.02 -0.15 0.03 -0.69 0.00 0.00 178.15 177.25 2ooy h ARG 20 N 0.09 0.00 -0.01 2.37 3.08 -0.50 -2.77 114.38 116.64 2ooy h ARG 20 Ca 0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.38 2ooy h ARG 20 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 2ooy h ARG 20 CO -0.57 0.15 0.00 -1.13 -1.07 0.00 0.00 179.97 177.35 2ooy n SER 21 N -3.47 0.50 -4.38 7.04 3.41 0.11 -4.70 113.62 112.13 2ooy n SER 21 Ca -0.01 -1.19 -0.29 0.00 -0.26 0.00 0.00 58.87 57.13 2ooy n SER 21 Cb 0.31 -0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.13 2ooy n SER 21 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2ooy s ARG 22 N -2.00 1.44 0.02 4.33 1.81 -1.04 -5.03 118.95 118.48 2ooy s ARG 22 Ca 0.44 -1.31 -0.01 0.00 -1.72 0.00 0.00 55.73 53.13 2ooy s ARG 22 Cb 0.21 -1.89 -0.04 0.00 -0.45 0.00 0.00 34.95 32.79 2ooy s ARG 22 CO 0.35 0.45 0.17 0.95 -0.68 0.00 0.00 175.30 176.55 2ooy s THR 23 N -1.03 5.28 0.33 0.02 -4.23 -1.26 0.25 115.64 115.00 2ooy s THR 23 Ca 0.13 -0.31 0.13 0.00 -1.18 0.00 0.00 61.69 60.46 2ooy s THR 23 Cb -0.10 -3.50 0.32 0.00 1.34 0.00 0.00 72.50 70.56 2ooy s THR 23 CO 0.05 0.25 1.67 0.28 -0.54 0.00 0.00 174.62 176.34 2ooy h SER 24 N 3.56 0.52 -0.58 3.99 0.02 -1.16 0.78 113.55 120.68 2ooy h SER 24 Ca -0.47 0.18 0.10 0.00 -0.84 0.00 0.00 61.79 60.75 2ooy h SER 24 Cb 1.18 0.13 -0.11 0.00 0.14 0.00 0.00 62.40 63.73 2ooy h SER 24 CO 0.70 -0.09 -0.38 0.22 -1.14 0.00 0.00 176.83 176.14 2ooy h TYR 25 N 0.36 -1.07 0.00 3.45 5.03 -0.93 0.01 116.97 123.82 2ooy h TYR 25 Ca 0.71 0.08 0.00 0.00 2.58 0.00 0.00 58.73 62.09 2ooy h TYR 25 Cb 1.56 0.55 0.00 0.00 1.55 0.00 0.00 36.73 40.40 2ooy h TYR 25 CO -0.02 -0.40 0.45 -0.25 -1.32 0.00 0.00 178.16 176.61 2ooy n ASP 26 N -5.42 0.05 0.00 -2.11 8.00 0.27 0.88 116.55 118.22 2ooy n ASP 26 Ca 0.03 0.21 0.11 0.00 0.71 0.00 0.00 54.79 55.86 2ooy n ASP 26 Cb 0.35 -0.15 0.07 0.00 -0.02 0.00 0.00 41.12 41.38 2ooy n ASP 26 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2ooy n VAL 27 N -1.40 0.01 -2.74 2.53 0.31 -0.01 -4.93 118.33 112.11 2ooy n VAL 27 Ca -0.00 -0.02 -0.36 0.00 -0.01 0.00 0.00 64.34 63.95 2ooy n VAL 27 Cb 0.45 0.56 -0.06 0.00 -0.91 0.00 0.00 33.84 33.88 2ooy n VAL 27 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2ooy s LEU 28 N -3.08 4.17 1.32 7.52 1.43 0.25 -5.02 118.68 125.27 2ooy s LEU 28 Ca 0.09 1.83 -0.18 0.00 -1.03 0.00 0.00 54.13 54.85 2ooy s LEU 28 Cb 0.17 -4.22 0.34 0.00 0.03 0.00 0.00 46.19 42.50 2ooy s LEU 28 CO 0.78 -0.25 0.93 -2.65 0.23 0.00 0.00 176.35 175.38 2ooy n PRO 29 N 0.05 -3.59 0.13 1.29 -0.02 -1.26 -4.86 135.00 126.74 2ooy n PRO 29 Ca 0.04 -1.04 0.12 0.00 -2.02 0.00 0.00 63.50 60.60 2ooy n PRO 29 Cb 0.51 -2.04 0.18 0.00 -0.02 0.00 0.00 33.50 32.13 2ooy n PRO 29 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ooy h THR 30 N -3.13 0.00 -2.34 3.45 1.03 -1.99 -3.42 112.91 106.51 2ooy h THR 30 Ca -0.54 -0.77 -0.04 0.00 -0.01 0.00 0.00 66.41 65.05 2ooy h THR 30 Cb 1.34 1.55 -0.24 0.00 -1.07 0.00 0.00 68.15 69.72 2ooy h THR 30 CO 0.39 0.00 -0.24 -0.55 -0.01 0.00 0.00 175.52 175.11 2ooy s SER 31 N -5.20 -0.63 0.02 0.00 0.15 -1.26 -5.17 113.70 101.61 2ooy s SER 31 Ca 0.06 1.20 0.00 0.00 0.70 0.00 0.00 55.95 57.91 2ooy s SER 31 Cb 0.10 1.50 -0.00 0.00 -1.71 0.00 0.00 66.02 65.90 2ooy s SER 31 CO 0.70 -0.22 0.02 2.22 1.20 0.00 0.00 173.24 177.15 2ooy n PHE 32 N 5.06 -0.11 -3.83 3.44 1.16 -1.26 -5.14 117.46 116.77 2ooy n PHE 32 Ca -0.14 -0.14 -0.29 0.00 -1.87 0.00 0.00 57.45 55.02 2ooy n PHE 32 Cb 0.52 0.02 -0.16 0.00 -1.61 0.00 0.00 39.48 38.24 2ooy n PHE 32 CO 0.00 0.00 0.00 0.50 -1.87 0.00 0.00 176.76 175.39 2ooy s ARG 33 N -2.06 1.10 -0.40 3.97 3.52 -1.26 -5.10 118.95 118.73 2ooy s ARG 33 Ca 0.02 -0.70 -0.13 0.00 -0.13 0.00 0.00 55.73 54.79 2ooy s ARG 33 Cb 0.00 -2.34 0.03 0.00 -1.56 0.00 0.00 34.95 31.08 2ooy s ARG 33 CO 0.01 -0.63 0.26 -1.17 -0.81 0.00 0.00 175.30 172.97 2ooy s LEU 34 N 1.64 4.98 0.01 -0.88 2.96 -1.26 -5.09 118.68 121.03 2ooy s LEU 34 Ca -0.03 -1.00 -0.19 0.00 -0.22 0.00 0.00 54.13 52.69 2ooy s LEU 34 Cb -0.18 -2.09 -0.06 0.00 0.50 0.00 0.00 46.19 44.36 2ooy s LEU 34 CO -0.07 -0.44 0.55 -0.63 -1.32 0.00 0.00 176.35 174.44 2ooy s ILE 35 N 1.61 4.90 0.03 6.68 1.09 -1.26 -5.06 121.20 129.19 2ooy s ILE 35 Ca 0.03 1.15 0.04 0.00 -1.10 0.00 0.00 60.65 60.78 2ooy s ILE 35 Cb -0.20 -3.88 -0.02 0.00 -1.06 0.00 0.00 42.46 37.30 2ooy s ILE 35 CO 0.08 0.47 -0.13 -0.69 -0.10 0.00 0.00 174.94 174.57 2ooy s VAL 36 N -0.48 1.02 -0.04 2.92 1.01 -1.26 -4.24 120.40 119.33 2ooy s VAL 36 Ca 0.29 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.39 2ooy s VAL 36 Cb -0.18 -0.92 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 2ooy s VAL 36 CO 0.16 0.03 -0.04 -0.36 0.00 0.00 0.00 175.10 174.90 2ooy s PHE 37 N -0.75 3.01 -0.20 5.22 2.99 -0.36 -5.01 117.98 122.87 2ooy s PHE 37 Ca 0.01 0.06 -0.29 0.00 0.00 0.00 0.00 56.93 56.71 2ooy s PHE 37 Cb -0.07 -1.70 -0.02 0.00 0.00 0.00 0.00 43.02 41.23 2ooy s PHE 37 CO 0.01 0.40 1.47 0.34 -0.00 0.00 0.00 175.22 177.44 2ooy s ASP 38 N -1.12 6.62 0.27 1.36 3.68 -1.26 0.03 116.67 126.25 2ooy s ASP 38 Ca 0.15 1.64 0.14 0.00 2.13 0.00 0.00 52.55 56.61 2ooy s ASP 38 Cb -0.11 -2.54 0.96 0.00 -1.45 0.00 0.00 42.92 39.78 2ooy s ASP 38 CO 0.05 -1.05 1.18 1.33 0.13 0.00 0.00 175.17 176.81 2ooy n VAL 39 N 5.98 -0.31 1.38 1.11 0.24 -0.49 0.73 118.33 126.96 2ooy n VAL 39 Ca 0.16 1.53 0.06 0.00 -2.04 0.00 0.00 64.34 64.05 2ooy n VAL 39 Cb 0.45 -2.45 0.34 0.00 -1.47 0.00 0.00 33.84 30.71 2ooy n VAL 39 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2ooy n THR 40 N -4.72 0.00 -2.29 3.34 -2.24 -1.26 -1.73 114.28 105.38 2ooy n THR 40 Ca 0.27 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.73 2ooy n THR 40 Cb 0.92 -0.42 -0.02 0.00 -2.10 0.00 0.00 70.33 68.71 2ooy n THR 40 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2ooy s LEU 41 N -1.52 3.59 0.43 3.22 1.43 0.22 -4.70 118.68 121.35 2ooy s LEU 41 Ca 0.17 1.64 -0.22 0.00 -1.03 0.00 0.00 54.13 54.69 2ooy s LEU 41 Cb 0.08 -4.52 -0.09 0.00 0.03 0.00 0.00 46.19 41.69 2ooy s LEU 41 CO 0.13 -0.76 1.01 -0.36 0.23 0.00 0.00 176.35 176.60 2ooy s PHE 42 N -2.57 3.23 0.10 0.29 2.99 -1.26 -0.42 117.98 120.33 2ooy s PHE 42 Ca 0.60 1.63 -0.25 0.00 0.00 0.00 0.00 56.93 58.91 2ooy s PHE 42 Cb -0.12 -3.00 -0.12 0.00 0.00 0.00 0.00 43.02 39.77 2ooy s PHE 42 CO 0.33 -0.46 1.70 0.28 -0.00 0.00 0.00 175.22 177.07 2ooy h VAL 43 N 1.94 0.74 -0.83 -0.44 2.07 -0.63 -0.15 116.25 118.94 2ooy h VAL 43 Ca -0.49 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.23 2ooy h VAL 43 Cb 1.20 0.74 -0.15 0.00 -1.52 0.00 0.00 31.29 31.57 2ooy h VAL 43 CO 0.61 0.00 0.01 0.50 0.02 0.00 0.00 177.57 178.71 2ooy h LYS 44 N -0.25 0.08 -0.54 1.57 1.63 -1.80 0.53 116.57 117.79 2ooy h LYS 44 Ca 0.00 -0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 59.75 2ooy h LYS 44 Cb 0.24 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.83 2ooy h LYS 44 CO -0.03 0.05 0.13 1.15 -3.45 0.00 0.00 179.45 177.30 2ooy h THR 45 N 0.08 1.24 -0.96 1.00 2.02 -1.66 -2.45 112.91 112.19 2ooy h THR 45 Ca 0.47 -0.87 0.07 0.00 0.77 0.00 0.00 66.41 66.85 2ooy h THR 45 Cb 0.86 0.78 -0.07 0.00 -1.74 0.00 0.00 68.15 67.99 2ooy h THR 45 CO -0.75 0.32 0.61 0.28 0.37 0.00 0.00 175.52 176.35 2ooy h SER 46 N 0.76 0.96 0.78 4.18 0.02 0.18 0.30 113.55 120.73 2ooy h SER 46 Ca 0.17 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.10 2ooy h SER 46 Cb 0.34 -0.18 0.01 0.00 0.14 0.00 0.00 62.40 62.71 2ooy h SER 46 CO 0.00 0.59 -0.38 -0.07 -1.14 0.00 0.00 176.83 175.84 2ooy h LEU 47 N 1.08 -0.89 -0.91 5.07 3.38 -1.04 -1.00 115.31 121.00 2ooy h LEU 47 Ca 0.43 0.02 0.24 0.00 0.09 0.00 0.00 57.88 58.66 2ooy h LEU 47 Cb 0.23 0.23 -0.13 0.00 0.09 0.00 0.00 40.66 41.07 2ooy h LEU 47 CO -0.19 -0.54 0.38 0.28 0.09 0.00 0.00 178.44 178.45 2ooy h SER 48 N -1.23 0.26 0.52 -0.43 0.02 -0.51 0.41 113.55 112.60 2ooy h SER 48 Ca -0.11 0.18 -0.09 0.00 -0.84 0.00 0.00 61.79 60.93 2ooy h SER 48 Cb 0.82 0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.52 2ooy h SER 48 CO 0.18 -0.08 -0.43 -0.07 -1.14 0.00 0.00 176.83 175.29 2ooy h LEU 49 N 0.33 0.00 -0.82 5.07 3.38 -0.32 -0.51 115.31 122.43 2ooy h LEU 49 Ca 0.59 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.44 2ooy h LEU 49 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2ooy h LEU 49 CO -0.58 0.43 -0.45 -0.07 0.09 0.00 0.00 178.44 177.85 2ooy h LEU 50 N 0.00 0.33 0.00 1.67 3.38 0.11 -2.82 115.31 117.99 2ooy h LEU 50 Ca -0.00 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 2ooy h LEU 50 Cb 0.80 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 2ooy h LEU 50 CO 0.06 0.74 -0.32 0.00 0.09 0.00 0.00 178.44 179.01 2ooy h THR 51 N 0.25 0.01 -0.05 0.22 1.03 -0.55 0.10 112.91 113.92 2ooy h THR 51 Ca 0.02 -1.01 0.00 0.00 -0.01 0.00 0.00 66.41 65.41 2ooy h THR 51 Cb 0.89 0.03 -0.01 0.00 -1.07 0.00 0.00 68.15 68.00 2ooy h THR 51 CO 0.07 0.00 -0.03 0.18 -0.01 0.00 0.00 175.52 175.74 2ooy n LEU 52 N -4.68 -0.05 -0.93 0.00 4.32 -0.26 -0.35 117.00 115.05 2ooy n LEU 52 Ca -0.05 0.11 0.04 0.00 -0.02 0.00 0.00 56.01 56.09 2ooy n LEU 52 Cb 0.17 -0.02 0.17 0.00 -1.62 0.00 0.00 43.42 42.11 2ooy n LEU 52 CO 0.07 -0.08 0.56 0.59 -1.22 0.00 0.00 177.39 177.30 2ooy n ASN 53 N -3.42 2.61 -4.02 -1.43 4.13 -1.06 -4.91 115.26 107.17 2ooy n ASN 53 Ca 0.00 -2.27 -0.26 0.00 1.68 0.00 0.00 54.58 53.73 2ooy n ASN 53 Cb 0.01 -0.45 -0.04 0.00 -1.54 0.00 0.00 39.78 37.76 2ooy n ASN 53 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2ooy n ASN 54 N 0.34 -0.08 -4.14 6.41 5.15 0.53 -4.95 115.26 118.52 2ooy n ASN 54 Ca 0.12 -1.06 -0.11 0.00 -0.60 0.00 0.00 54.58 52.93 2ooy n ASN 54 Cb 0.53 -2.79 -0.09 0.00 -0.53 0.00 0.00 39.78 36.90 2ooy n ASN 54 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2ooy s ILE 55 N -4.04 0.05 0.00 -1.44 -4.36 -0.00 -5.04 121.20 106.37 2ooy s ILE 55 Ca 0.00 -1.86 0.00 0.00 -0.26 0.00 0.00 60.65 58.53 2ooy s ILE 55 Cb -0.00 -2.23 0.00 0.00 1.25 0.00 0.00 42.46 41.48 2ooy s ILE 55 CO 0.91 -0.22 0.47 1.33 0.24 0.00 0.00 174.94 177.67 2ooy n VAL 56 N -0.20 0.16 -3.95 8.37 0.24 -1.26 -4.34 118.33 117.34 2ooy n VAL 56 Ca -0.02 -0.44 -0.09 0.00 -2.04 0.00 0.00 64.34 61.75 2ooy n VAL 56 Cb 0.64 1.14 -0.04 0.00 -1.47 0.00 0.00 33.84 34.12 2ooy n VAL 56 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2ooy s SER 57 N -0.16 -0.03 -0.29 -1.34 1.04 -1.26 -3.52 113.70 108.14 2ooy s SER 57 Ca 0.00 -0.92 -0.20 0.00 0.48 0.00 0.00 55.95 55.31 2ooy s SER 57 Cb 0.00 0.66 0.13 0.00 0.10 0.00 0.00 66.02 66.91 2ooy s SER 57 CO 0.00 -1.26 1.00 0.00 0.98 0.00 0.00 173.24 173.96 2ooy s ALA 58 N -3.74 -2.12 0.37 5.32 0.00 -0.82 -4.99 121.76 115.78 2ooy s ALA 58 Ca 0.20 2.05 -0.26 0.00 0.00 0.00 0.00 51.96 53.94 2ooy s ALA 58 Cb -0.02 -1.58 -0.12 0.00 0.00 0.00 0.00 23.12 21.40 2ooy s ALA 58 CO 0.10 -0.29 1.12 -2.30 0.00 0.00 0.00 175.76 174.39 2ooy n PRO 59 N 2.97 1.65 -4.02 0.00 -0.02 -1.26 -0.87 135.00 133.45 2ooy n PRO 59 Ca -0.16 0.58 -0.28 0.00 -2.02 0.00 0.00 63.50 61.62 2ooy n PRO 59 Cb 0.57 -2.13 -0.05 0.00 -0.02 0.00 0.00 33.50 31.87 2ooy n PRO 59 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2ooy s LEU 60 N -0.62 3.98 -0.03 2.45 1.43 0.16 -1.23 118.68 124.81 2ooy s LEU 60 Ca 0.60 0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.74 2ooy s LEU 60 Cb -0.58 -2.61 0.01 0.00 0.03 0.00 0.00 46.19 43.04 2ooy s LEU 60 CO 0.59 0.12 -0.06 0.86 0.23 0.00 0.00 176.35 178.09 2ooy s TRP 61 N -1.58 0.78 -0.42 0.29 -0.00 0.10 -0.91 118.94 117.20 2ooy s TRP 61 Ca 0.32 -0.20 0.03 0.00 -0.00 0.00 0.00 56.10 56.24 2ooy s TRP 61 Cb -0.11 -0.62 0.12 0.00 -0.00 0.00 0.00 33.47 32.85 2ooy s TRP 61 CO 0.24 -0.13 0.16 0.34 -0.00 0.00 0.00 176.95 177.56 2ooy s ASP 62 N 0.52 4.31 0.05 5.86 3.68 -1.02 -1.39 116.67 128.68 2ooy s ASP 62 Ca -0.07 -2.48 -0.27 0.00 2.13 0.00 0.00 52.55 51.86 2ooy s ASP 62 Cb -0.11 -1.43 -0.14 0.00 -1.45 0.00 0.00 42.92 39.79 2ooy s ASP 62 CO 0.00 -0.31 1.40 0.28 0.13 0.00 0.00 175.17 176.67 2ooy h SER 63 N 7.12 -0.86 0.00 -0.34 0.02 -1.96 0.56 113.55 118.09 2ooy h SER 63 Ca -0.06 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2ooy h SER 63 Cb 0.96 0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.73 2ooy h SER 63 CO 0.57 -0.56 0.00 -0.62 -1.14 0.00 0.00 176.83 175.07 2ooy n GLU 64 N -4.60 0.00 -0.00 3.45 4.71 -1.26 0.11 120.64 123.05 2ooy n GLU 64 Ca -0.11 0.00 0.09 0.00 -0.01 0.00 0.00 57.16 57.12 2ooy n GLU 64 Cb 0.37 0.00 -0.10 0.00 -1.01 0.00 0.00 31.44 30.70 2ooy n GLU 64 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2ooy n ALA 65 N -0.01 4.38 -3.36 0.62 0.00 -0.81 -5.02 120.51 116.31 2ooy n ALA 65 Ca 0.00 -0.52 -0.19 0.00 0.00 0.00 0.00 53.44 52.74 2ooy n ALA 65 Cb 0.00 -0.66 0.06 0.00 0.00 0.00 0.00 19.45 18.85 2ooy n ALA 65 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2ooy n ASN 66 N -1.43 -5.98 -3.98 0.00 4.13 0.29 -4.90 115.26 103.39 2ooy n ASN 66 Ca 0.03 -0.77 -0.12 0.00 1.68 0.00 0.00 54.58 55.41 2ooy n ASN 66 Cb 0.28 -4.79 -0.12 0.00 -1.54 0.00 0.00 39.78 33.61 2ooy n ASN 66 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2ooy s LYS 67 N -4.82 0.32 0.23 3.52 1.02 -1.15 -2.60 119.74 116.25 2ooy s LYS 67 Ca 0.43 -0.47 -0.31 0.00 0.02 0.00 0.00 55.97 55.64 2ooy s LYS 67 Cb -0.08 -0.08 -0.11 0.00 -0.52 0.00 0.00 37.83 37.04 2ooy s LYS 67 CO 0.77 0.01 1.63 0.12 -0.92 0.00 0.00 175.35 176.96 2ooy s PHE 68 N -0.97 2.89 -0.18 3.18 5.36 -1.26 -2.42 117.98 124.58 2ooy s PHE 68 Ca -0.09 0.58 0.17 0.00 -0.96 0.00 0.00 56.93 56.63 2ooy s PHE 68 Cb -0.07 -4.06 0.49 0.00 -0.34 0.00 0.00 43.02 39.05 2ooy s PHE 68 CO -0.00 -3.81 1.38 0.00 -1.46 0.00 0.00 175.22 171.33 2ooy n ALA 69 N 3.27 2.88 0.00 11.12 0.00 -0.09 -4.93 120.51 132.77 2ooy n ALA 69 Ca 0.12 -2.34 0.00 0.00 0.00 0.00 0.00 53.44 51.23 2ooy n ALA 69 Cb 0.37 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.15 2ooy n ALA 69 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ooy n GLY 70 N -0.62 0.88 3.01 0.00 0.00 -1.26 -4.74 105.19 102.46 2ooy n GLY 70 Ca 0.20 -2.07 -0.31 0.00 0.00 0.00 0.00 46.02 43.85 2ooy n GLY 70 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ooy s LEU 71 N 0.00 4.50 0.23 0.99 2.96 -1.26 0.37 118.68 126.47 2ooy s LEU 71 Ca 0.00 -2.05 -0.31 0.00 -0.22 0.00 0.00 54.13 51.55 2ooy s LEU 71 Cb 0.00 -1.58 -0.10 0.00 0.50 0.00 0.00 46.19 45.00 2ooy s LEU 71 CO 0.00 -0.36 1.52 -0.22 -1.32 0.00 0.00 176.35 175.97 2ooy s LEU 72 N 0.96 4.37 0.18 -0.68 2.96 -0.05 -4.85 118.68 121.56 2ooy s LEU 72 Ca 0.09 2.72 -0.03 0.00 -0.22 0.00 0.00 54.13 56.69 2ooy s LEU 72 Cb -0.19 -3.62 -0.03 0.00 0.50 0.00 0.00 46.19 42.85 2ooy s LEU 72 CO -0.09 -0.79 0.15 -0.89 -1.32 0.00 0.00 176.35 173.42 2ooy s THR 73 N 0.37 0.04 0.09 3.68 2.01 -1.26 -1.93 115.64 118.63 2ooy s THR 73 Ca 0.64 -1.86 0.33 0.00 0.31 0.00 0.00 61.69 61.11 2ooy s THR 73 Cb -0.44 -2.26 0.37 0.00 0.01 0.00 0.00 72.50 70.17 2ooy s THR 73 CO 0.40 -0.18 1.99 0.24 -0.69 0.00 0.00 174.62 176.39 2ooy h MET 74 N 2.66 0.00 -0.02 4.92 0.00 -1.88 -2.67 114.93 117.94 2ooy h MET 74 Ca -0.34 0.00 -0.00 0.00 0.00 0.00 0.00 59.70 59.35 2ooy h MET 74 Cb 1.23 0.00 -0.00 0.00 0.00 0.00 0.00 31.60 32.83 2ooy h MET 74 CO 0.53 0.00 0.00 0.00 0.00 0.00 0.00 176.91 177.44 2ooy h ALA 75 N 2.05 0.03 -0.69 6.32 0.00 -1.92 0.22 119.26 125.27 2ooy h ALA 75 Ca 0.00 -0.14 0.13 0.00 0.00 0.00 0.00 54.91 54.90 2ooy h ALA 75 Cb 0.35 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 18.00 2ooy h ALA 75 CO 0.00 -0.33 -0.20 -0.25 0.00 0.00 0.00 179.25 178.47 2ooy n ASP 76 N -4.93 -0.31 -0.02 0.00 9.92 -1.01 0.27 116.55 120.46 2ooy n ASP 76 Ca -0.07 1.19 -0.15 0.00 -0.53 0.00 0.00 54.79 55.22 2ooy n ASP 76 Cb 0.16 -0.33 -0.10 0.00 -0.64 0.00 0.00 41.12 40.21 2ooy n ASP 76 CO 0.00 0.00 0.00 -0.26 0.13 0.00 0.00 177.20 177.07 2ooy h PHE 77 N 0.00 0.46 -0.82 1.24 -1.00 -0.72 -2.11 116.94 114.00 2ooy h PHE 77 Ca 0.30 -0.22 0.20 0.00 2.81 0.00 0.00 57.97 61.06 2ooy h PHE 77 Cb 0.47 -0.07 -0.13 0.00 3.61 0.00 0.00 35.95 39.84 2ooy h PHE 77 CO -0.56 0.97 0.19 0.28 -1.61 0.00 0.00 178.31 177.59 2ooy h VAL 78 N -0.18 0.39 0.77 -0.55 2.07 0.56 -1.55 116.25 117.77 2ooy h VAL 78 Ca -0.03 -0.08 -0.04 0.00 0.82 0.00 0.00 66.70 67.37 2ooy h VAL 78 Cb 1.03 0.15 0.01 0.00 -1.52 0.00 0.00 31.29 30.96 2ooy h VAL 78 CO 0.07 0.04 -0.37 0.78 0.02 0.00 0.00 177.57 178.11 2ooy h ASN 79 N 0.22 -0.88 -0.48 0.57 2.35 0.45 0.52 115.58 118.34 2ooy h ASN 79 Ca 0.49 0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 56.21 2ooy h ASN 79 Cb 0.92 0.23 -0.02 0.00 0.05 0.00 0.00 38.32 39.49 2ooy h ASN 79 CO -0.60 -0.53 0.13 -0.37 -1.65 0.00 0.00 177.43 174.41 2ooy h VAL 80 N -1.23 1.22 -0.33 2.81 -1.51 -1.49 -2.41 116.25 113.32 2ooy h VAL 80 Ca -0.11 -0.80 0.01 0.00 -1.23 0.00 0.00 66.70 64.58 2ooy h VAL 80 Cb 0.81 0.67 -0.02 0.00 -2.13 0.00 0.00 31.29 30.61 2ooy h VAL 80 CO 0.17 0.30 0.19 -0.29 -1.23 0.00 0.00 177.57 176.71 2ooy h ILE 81 N 0.79 1.03 -0.59 7.19 -0.00 -1.02 0.25 117.51 125.16 2ooy h ILE 81 Ca 0.18 -0.13 0.11 0.00 -0.00 0.00 0.00 64.86 65.02 2ooy h ILE 81 Cb 0.28 0.61 -0.09 0.00 -0.00 0.00 0.00 36.82 37.63 2ooy h ILE 81 CO -0.00 0.07 0.09 0.50 -0.00 0.00 0.00 178.15 178.81 2ooy h LYS 82 N 0.38 0.21 -0.84 2.19 3.64 0.25 -2.65 116.57 119.75 2ooy h LYS 82 Ca 0.13 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2ooy h LYS 82 Cb 0.01 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.74 2ooy h LYS 82 CO -0.06 0.14 0.49 -0.92 -2.27 0.00 0.00 179.45 176.82 2ooy h TYR 83 N 0.22 1.12 -0.31 1.91 5.03 -0.10 -2.27 116.97 122.56 2ooy h TYR 83 Ca 0.31 -0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.56 2ooy h TYR 83 Cb 0.46 -0.36 -0.01 0.00 1.55 0.00 0.00 36.73 38.37 2ooy h TYR 83 CO -0.27 0.76 0.03 1.88 -1.32 0.00 0.00 178.16 179.24 2ooy h TYR 84 N 1.15 0.56 -0.11 -3.82 -1.99 -0.64 -3.01 116.97 109.11 2ooy h TYR 84 Ca 0.30 -0.09 0.03 0.00 2.00 0.00 0.00 58.73 60.97 2ooy h TYR 84 Cb -0.02 -0.15 -0.00 0.00 2.00 0.00 0.00 36.73 38.56 2ooy h TYR 84 CO 0.00 0.63 0.09 1.88 -0.00 0.00 0.00 178.16 180.75 2ooy h TYR 85 N 0.33 0.00 -0.24 4.88 0.05 -1.25 -0.88 116.97 119.87 2ooy h TYR 85 Ca 0.09 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.87 2ooy h TYR 85 Cb 0.38 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.12 2ooy h TYR 85 CO 0.03 0.00 0.00 0.00 -1.05 0.00 0.00 178.16 177.14 2ooy n GLN 86 N -4.40 2.17 -3.01 4.88 10.64 -1.20 -4.75 117.38 121.70 2ooy n GLN 86 Ca -0.00 -1.77 -0.15 0.00 -1.83 0.00 0.00 57.00 53.25 2ooy n GLN 86 Cb 0.20 -1.25 0.01 0.00 -0.86 0.00 0.00 30.24 28.35 2ooy n GLN 86 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 2ooy n SER 87 N 0.52 -0.59 0.00 2.61 3.41 -0.34 -5.06 113.62 114.18 2ooy n SER 87 Ca 0.10 -3.20 0.00 0.00 -0.26 0.00 0.00 58.87 55.50 2ooy n SER 87 Cb 0.38 0.39 0.00 0.00 -0.26 0.00 0.00 64.21 64.72 2ooy n SER 87 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2ooy n SER 88 N 0.60 0.00 -1.15 4.04 2.88 -1.22 -4.80 113.62 113.97 2ooy n SER 88 Ca 0.17 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.82 2ooy n SER 88 Cb 0.65 0.00 0.23 0.00 -0.75 0.00 0.00 64.21 64.34 2ooy n SER 88 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2ooy n SER 89 N 0.00 3.50 -4.12 -3.46 7.64 -1.26 -4.83 113.62 111.09 2ooy n SER 89 Ca 0.00 -1.98 -0.32 0.00 1.01 0.00 0.00 58.87 57.58 2ooy n SER 89 Cb 0.00 -0.30 -0.16 0.00 -1.01 0.00 0.00 64.21 62.74 2ooy n SER 89 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2ooy s PHE 90 N -1.32 2.58 0.00 1.43 0.40 -1.26 -5.05 117.98 114.76 2ooy s PHE 90 Ca 0.39 -1.40 0.00 0.00 -0.60 0.00 0.00 56.93 55.32 2ooy s PHE 90 Cb 0.22 -1.79 0.00 0.00 0.51 0.00 0.00 43.02 41.97 2ooy s PHE 90 CO 0.30 -0.68 0.87 -2.30 0.70 0.00 0.00 175.22 174.11 2ooy n PRO 91 N 4.37 0.00 -1.71 0.24 -0.02 -1.26 -4.20 135.00 132.42 2ooy n PRO 91 Ca -0.20 0.47 -0.43 0.00 -2.02 0.00 0.00 63.50 61.32 2ooy n PRO 91 Cb 0.51 -1.37 -0.02 0.00 -0.02 0.00 0.00 33.50 32.61 2ooy n PRO 91 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2ooy n GLU 92 N -1.77 2.28 0.00 -0.52 -0.58 -1.26 -4.16 120.64 114.62 2ooy n GLU 92 Ca 0.00 0.81 0.00 0.00 -0.42 0.00 0.00 57.16 57.55 2ooy n GLU 92 Cb 0.00 -2.48 0.00 0.00 -0.57 0.00 0.00 31.44 28.39 2ooy n GLU 92 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ooy n ALA 93 N 1.38 0.00 0.00 0.62 0.00 -1.26 -4.87 120.51 116.38 2ooy n ALA 93 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2ooy n ALA 93 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.80 2ooy n ALA 93 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 2ooy n ILE 94 N 0.00 0.00 -0.03 0.00 3.06 -1.26 -4.80 119.36 116.33 2ooy n ILE 94 Ca 0.00 0.00 -0.00 0.00 -2.50 0.00 0.00 62.75 60.25 2ooy n ILE 94 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 2ooy n ILE 94 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2ooy n ALA 95 N -1.53 -0.02 -0.23 1.51 0.00 -1.26 0.43 120.51 119.40 2ooy n ALA 95 Ca 0.00 0.08 0.21 0.00 0.00 0.00 0.00 53.44 53.73 2ooy n ALA 95 Cb 0.00 -0.03 0.39 0.00 0.00 0.00 0.00 19.45 19.81 2ooy n ALA 95 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2ooy n GLU 96 N -4.12 -0.05 -0.14 0.00 1.02 -1.26 -0.31 120.64 115.78 2ooy n GLU 96 Ca 0.01 1.01 -0.03 0.00 -0.02 0.00 0.00 57.16 58.13 2ooy n GLU 96 Cb 0.03 -1.78 -0.03 0.00 -0.02 0.00 0.00 31.44 29.64 2ooy n GLU 96 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2ooy n ILE 97 N -4.70 -0.23 -0.36 -3.67 2.08 1.49 0.13 119.36 114.10 2ooy n ILE 97 Ca 0.26 0.84 0.02 0.00 0.56 0.00 0.00 62.75 64.43 2ooy n ILE 97 Cb 0.87 -1.05 0.08 0.00 -0.75 0.00 0.00 39.64 38.79 2ooy n ILE 97 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 2ooy n ASP 98 N -4.45 -0.50 -0.19 4.38 9.92 0.58 -1.04 116.55 125.26 2ooy n ASP 98 Ca 0.01 1.65 -0.01 0.00 -0.53 0.00 0.00 54.79 55.91 2ooy n ASP 98 Cb 0.10 -0.43 0.08 0.00 -0.64 0.00 0.00 41.12 40.23 2ooy n ASP 98 CO 0.00 0.00 0.00 0.07 0.13 0.00 0.00 177.20 177.40 2ooy h LYS 99 N 0.00 0.08 -6.43 -1.24 2.10 0.89 -3.21 116.57 108.75 2ooy h LYS 99 Ca 0.38 -0.00 -0.60 0.00 -2.00 0.00 0.00 60.65 58.43 2ooy h LYS 99 Cb 0.62 -0.02 0.13 0.00 -0.90 0.00 0.00 32.23 32.07 2ooy h LYS 99 CO -0.96 0.05 -0.14 1.19 -2.00 0.00 0.00 179.45 177.60 2ooy n PHE 100 N -5.30 0.35 -2.94 0.07 3.01 -0.20 -4.65 117.46 107.79 2ooy n PHE 100 Ca 0.07 0.63 -0.30 0.00 1.01 0.00 0.00 57.45 58.86 2ooy n PHE 100 Cb 0.32 -2.11 -0.04 0.00 -0.01 0.00 0.00 39.48 37.64 2ooy n PHE 100 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2ooy s ARG 101 N -1.68 3.80 0.55 -1.08 0.52 -1.26 -0.12 118.95 119.68 2ooy s ARG 101 Ca 0.63 0.45 0.36 0.00 -0.52 0.00 0.00 55.73 56.65 2ooy s ARG 101 Cb -0.63 -2.42 1.52 0.00 0.52 0.00 0.00 34.95 33.94 2ooy s ARG 101 CO 0.58 0.02 1.76 -0.07 0.02 0.00 0.00 175.30 177.61 2ooy h LEU 102 N 1.45 0.00 0.50 2.53 4.07 -0.54 0.17 115.31 123.49 2ooy h LEU 102 Ca -0.47 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.46 2ooy h LEU 102 Cb 1.19 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.93 2ooy h LEU 102 CO 0.64 0.00 -0.24 0.25 -1.08 0.00 0.00 178.44 178.01 2ooy h LEU 103 N 0.00 -0.57 -1.30 1.67 5.85 -1.60 0.52 115.31 119.88 2ooy h LEU 103 Ca 0.55 0.02 0.24 0.00 0.84 0.00 0.00 57.88 59.53 2ooy h LEU 103 Cb 2.31 0.15 -0.09 0.00 0.37 0.00 0.00 40.66 43.39 2ooy h LEU 103 CO -0.01 -0.37 0.64 1.23 -0.34 0.00 0.00 178.44 179.60 2ooy h GLY 104 N -0.75 1.29 0.81 3.75 0.00 -1.08 -0.34 103.07 106.75 2ooy h GLY 104 Ca -0.07 -0.24 -0.04 0.00 0.00 0.00 0.00 47.33 46.98 2ooy h GLY 104 CO 0.11 -0.10 -0.39 -2.00 0.00 0.00 0.00 176.54 174.16 2ooy h LEU 105 N 0.48 -0.92 0.00 3.11 5.85 -0.95 -2.69 115.31 120.20 2ooy h LEU 105 Ca 0.57 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.32 2ooy h LEU 105 Cb 1.31 0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.57 2ooy h LEU 105 CO -0.30 -0.58 0.00 -2.11 -0.34 0.00 0.00 178.44 175.11 2ooy n ARG 106 N -5.34 0.82 0.07 1.25 1.85 0.17 -0.92 116.66 114.56 2ooy n ARG 106 Ca -0.13 0.00 0.12 0.00 -1.00 0.00 0.00 57.85 56.83 2ooy n ARG 106 Cb 0.43 -1.47 0.03 0.00 -1.05 0.00 0.00 32.46 30.39 2ooy n ARG 106 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77 2ooy n GLU 107 N -0.97 0.49 0.09 2.89 0.28 -0.32 -1.29 120.64 121.80 2ooy n GLU 107 Ca 0.19 0.07 -0.09 0.00 -0.16 0.00 0.00 57.16 57.17 2ooy n GLU 107 Cb 0.09 -1.74 -0.03 0.00 1.43 0.00 0.00 31.44 31.18 2ooy n GLU 107 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 2ooy h VAL 108 N 0.00 1.53 -0.02 3.84 2.07 -0.68 0.53 116.25 123.51 2ooy h VAL 108 Ca 0.00 -2.79 -0.21 0.00 0.82 0.00 0.00 66.70 64.52 2ooy h VAL 108 Cb 0.90 2.57 -0.00 0.00 -1.52 0.00 0.00 31.29 33.24 2ooy h VAL 108 CO 0.00 0.81 -0.87 -0.33 0.02 0.00 0.00 177.57 177.20 2ooy h GLU 109 N 0.08 0.39 0.43 1.57 5.08 -1.45 -1.47 114.58 119.21 2ooy h GLU 109 Ca -0.05 -0.39 -0.01 0.00 -1.00 0.00 0.00 59.36 57.91 2ooy h GLU 109 Cb 1.59 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.92 2ooy h GLU 109 CO 0.14 1.05 -0.35 -0.09 -1.00 0.00 0.00 179.01 178.77 2ooy h ARG 110 N 0.24 -0.75 -1.10 2.33 9.65 -1.07 0.36 114.38 124.04 2ooy h ARG 110 Ca -0.06 0.05 0.30 0.00 -1.10 0.00 0.00 59.98 59.17 2ooy h ARG 110 Cb 1.49 0.17 -0.07 0.00 -1.39 0.00 0.00 29.97 30.16 2ooy h ARG 110 CO 0.15 -0.50 0.75 0.87 2.80 0.00 0.00 179.97 184.04 2ooy h LYS 111 N -0.77 0.20 -0.41 0.20 1.57 -0.68 -2.40 116.57 114.28 2ooy h LYS 111 Ca -0.04 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2ooy h LYS 111 Cb 0.67 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.93 2ooy h LYS 111 CO -0.02 0.13 0.00 0.44 -0.57 0.00 0.00 179.45 179.44 2ooy n ILE 112 N -4.44 0.73 -0.90 1.86 -5.35 -0.57 -4.94 119.36 105.75 2ooy n ILE 112 Ca 0.25 -0.87 0.00 0.00 -0.27 0.00 0.00 62.75 61.87 2ooy n ILE 112 Cb 1.05 0.73 0.00 0.00 -1.74 0.00 0.00 39.64 39.68 2ooy n ILE 112 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ooy n GLY 113 N 1.07 0.50 0.26 3.28 0.00 -0.81 -4.95 105.19 104.55 2ooy n GLY 113 Ca 0.16 -0.89 0.14 0.00 0.00 0.00 0.00 46.02 45.43 2ooy n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ooy n ALA 114 N 0.34 2.83 -3.32 4.61 0.00 0.12 -4.81 120.51 120.28 2ooy n ALA 114 Ca 0.00 -0.37 -0.13 0.00 0.00 0.00 0.00 53.44 52.94 2ooy n ALA 114 Cb 0.04 -1.22 -0.10 0.00 0.00 0.00 0.00 19.45 18.17 2ooy n ALA 114 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2ooy s ILE 115 N -2.33 0.00 0.88 0.00 1.10 -1.23 -4.77 121.20 114.86 2ooy s ILE 115 Ca 0.31 -0.04 -0.12 0.00 -0.51 0.00 0.00 60.65 60.29 2ooy s ILE 115 Cb 0.20 -0.61 0.12 0.00 0.15 0.00 0.00 42.46 42.32 2ooy s ILE 115 CO 0.45 -0.02 1.14 -2.16 -2.11 0.00 0.00 174.94 172.24 2ooy s PRO 116 N 0.08 1.41 0.00 3.50 0.04 -1.26 -4.69 135.00 134.08 2ooy s PRO 116 Ca -0.01 0.30 0.00 0.00 0.04 0.00 0.00 61.00 61.33 2ooy s PRO 116 Cb -0.03 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.64 2ooy s PRO 116 CO 0.01 -2.01 0.75 -0.35 0.04 0.00 0.00 177.00 175.44 2ooy n PRO 117 N -3.64 0.00 -2.02 0.56 -0.04 -1.26 -4.67 135.00 123.93 2ooy n PRO 117 Ca 0.07 0.37 -0.31 0.00 -0.04 0.00 0.00 63.50 63.59 2ooy n PRO 117 Cb 0.59 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 32.81 2ooy n PRO 117 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2ooy s GLU 118 N -1.99 3.63 0.08 0.54 4.04 -1.26 -5.11 118.70 118.62 2ooy s GLU 118 Ca 0.00 0.71 0.04 0.00 0.04 0.00 0.00 54.97 55.76 2ooy s GLU 118 Cb 0.00 -2.12 -0.04 0.00 0.02 0.00 0.00 34.13 31.99 2ooy s GLU 118 CO 0.00 -0.49 0.01 0.99 -1.84 0.00 0.00 175.26 173.93 2ooy s THR 119 N -3.07 4.10 0.02 1.83 2.01 -1.26 -5.08 115.64 114.19 2ooy s THR 119 Ca 0.55 -0.91 -0.26 0.00 0.31 0.00 0.00 61.69 61.37 2ooy s THR 119 Cb -0.11 -2.94 -0.05 0.00 0.01 0.00 0.00 72.50 69.41 2ooy s THR 119 CO 0.50 0.15 0.80 -0.51 -0.69 0.00 0.00 174.62 174.88 2ooy s ILE 120 N -1.29 4.80 0.15 1.82 -1.16 -1.26 -5.01 121.20 119.25 2ooy s ILE 120 Ca 0.25 1.69 -0.08 0.00 -0.51 0.00 0.00 60.65 62.00 2ooy s ILE 120 Cb -0.12 -4.15 -0.01 0.00 0.61 0.00 0.00 42.46 38.79 2ooy s ILE 120 CO 0.18 0.30 0.26 -0.72 -2.81 0.00 0.00 174.94 172.15 2ooy s TYR 121 N 0.30 0.40 0.09 3.50 1.13 -1.26 -4.29 117.35 117.22 2ooy s TYR 121 Ca 0.41 -0.77 -0.05 0.00 -1.41 0.00 0.00 57.07 55.24 2ooy s TYR 121 Cb -0.20 -0.08 -0.02 0.00 -1.10 0.00 0.00 41.96 40.56 2ooy s TYR 121 CO 0.23 -0.69 0.11 0.14 -2.51 0.00 0.00 175.55 172.84 2ooy s VAL 122 N -3.96 0.16 -0.08 -3.49 -7.23 -1.12 -5.00 120.40 99.67 2ooy s VAL 122 Ca 0.16 -1.47 -0.30 0.00 -1.81 0.00 0.00 61.98 58.56 2ooy s VAL 122 Cb 0.04 -1.51 -0.02 0.00 0.56 0.00 0.00 36.38 35.44 2ooy s VAL 122 CO -0.01 -0.72 1.16 -2.28 -0.31 0.00 0.00 175.10 172.94 2ooy s HIS 123 N -3.91 3.24 0.38 2.82 2.46 -1.26 -2.28 115.29 116.74 2ooy s HIS 123 Ca 0.08 1.29 0.26 0.00 0.47 0.00 0.00 55.06 57.16 2ooy s HIS 123 Cb 0.06 -3.37 1.31 0.00 -0.13 0.00 0.00 32.58 30.45 2ooy s HIS 123 CO -0.09 -1.07 1.42 -2.30 -2.47 0.00 0.00 174.74 170.23 2ooy n PRO 124 N 5.31 -0.04 -0.06 2.88 -0.02 -1.26 -0.37 135.00 141.44 2ooy n PRO 124 Ca 0.11 1.17 0.12 0.00 -2.02 0.00 0.00 63.50 62.88 2ooy n PRO 124 Cb 0.47 -2.24 0.34 0.00 -0.02 0.00 0.00 33.50 32.05 2ooy n PRO 124 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2ooy n MET 125 N -4.69 1.96 -2.04 -0.52 2.81 -1.26 -0.29 117.12 113.08 2ooy n MET 125 Ca 0.36 -1.42 -0.32 0.00 -1.81 0.00 0.00 57.70 54.51 2ooy n MET 125 Cb 1.33 -1.45 0.00 0.00 -0.71 0.00 0.00 33.22 32.39 2ooy n MET 125 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 2ooy s HIS 126 N -1.85 3.24 0.44 2.03 3.76 0.50 -4.80 115.29 118.61 2ooy s HIS 126 Ca 0.34 1.45 -0.24 0.00 -0.15 0.00 0.00 55.06 56.47 2ooy s HIS 126 Cb 0.20 -2.88 -0.10 0.00 1.11 0.00 0.00 32.58 30.91 2ooy s HIS 126 CO 0.30 -0.85 1.07 0.45 -0.85 0.00 0.00 174.74 174.85 2ooy n SER 127 N -2.20 1.51 -0.11 1.40 2.88 -1.26 -1.89 113.62 113.96 2ooy n SER 127 Ca 0.07 1.03 0.18 0.00 -1.33 0.00 0.00 58.87 58.83 2ooy n SER 127 Cb 0.53 -1.39 0.59 0.00 -0.75 0.00 0.00 64.21 63.20 2ooy n SER 127 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 2ooy h LEU 128 N 1.56 0.21 -1.47 2.46 5.85 0.32 -1.52 115.31 122.72 2ooy h LEU 128 Ca -0.46 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.27 2ooy h LEU 128 Cb 1.33 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.31 2ooy h LEU 128 CO 0.57 0.11 0.23 -0.03 -0.34 0.00 0.00 178.44 178.97 2ooy h MET 129 N 0.22 0.58 -0.42 1.25 4.05 -1.76 -1.73 114.93 117.13 2ooy h MET 129 Ca 0.33 -0.06 -0.04 0.00 -0.28 0.00 0.00 59.70 59.66 2ooy h MET 129 Cb 1.00 -0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 31.66 2ooy h MET 129 CO -0.07 0.44 0.09 -0.44 0.23 0.00 0.00 176.91 177.16 2ooy h ASP 130 N 0.59 0.64 -0.24 1.39 5.19 -1.61 -1.50 116.42 120.88 2ooy h ASP 130 Ca 0.15 -0.24 0.01 0.00 -0.62 0.00 0.00 57.03 56.33 2ooy h ASP 130 Cb 0.03 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 39.36 2ooy h ASP 130 CO -0.02 0.72 0.16 0.00 -3.12 0.00 0.00 179.24 176.97 2ooy h ALA 131 N 0.95 1.87 0.00 3.45 0.00 -1.35 0.36 119.26 124.54 2ooy h ALA 131 Ca 0.13 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2ooy h ALA 131 Cb 0.33 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2ooy h ALA 131 CO 0.00 0.11 -0.61 0.00 0.00 0.00 0.00 179.25 178.75 2ooy h LEU 133 N 0.00 -0.00 -0.35 0.00 3.38 -0.43 -1.87 115.31 116.04 2ooy h LEU 133 Ca -0.03 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 57.94 2ooy h LEU 133 Cb 1.32 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.02 2ooy h LEU 133 CO 0.04 0.51 -0.19 0.00 0.09 0.00 0.00 178.44 178.90 2ooy n ALA 134 N -2.77 -0.18 0.17 1.53 0.00 0.12 0.18 120.51 119.55 2ooy n ALA 134 Ca -0.00 0.31 0.03 0.00 0.00 0.00 0.00 53.44 53.77 2ooy n ALA 134 Cb 0.02 -0.07 0.27 0.00 0.00 0.00 0.00 19.45 19.66 2ooy n ALA 134 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2ooy h MET 135 N 0.00 0.00 0.09 0.00 2.86 -1.45 -1.53 114.93 114.90 2ooy h MET 135 Ca 0.07 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.50 2ooy h MET 135 Cb 0.16 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.84 2ooy h MET 135 CO -0.33 0.48 -0.89 1.03 1.06 0.00 0.00 176.91 178.25 2ooy h SER 136 N 0.00 0.62 -0.01 1.22 0.87 0.28 -2.49 113.55 114.04 2ooy h SER 136 Ca -0.00 -0.85 -0.04 0.00 -1.23 0.00 0.00 61.79 59.67 2ooy h SER 136 Cb 0.97 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.72 2ooy h SER 136 CO 0.06 1.41 -0.08 0.50 -0.53 0.00 0.00 176.83 178.19 2ooy h LYS 137 N -0.08 0.23 -0.11 2.24 3.64 0.68 -3.23 116.57 119.94 2ooy h LYS 137 Ca -0.14 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 2ooy h LYS 137 Cb 1.63 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.41 2ooy h LYS 137 CO 0.17 0.32 0.00 -1.13 -2.27 0.00 0.00 179.45 176.54 2ooy n SER 138 N -4.32 2.38 0.00 4.20 3.41 -0.59 -4.61 113.62 114.08 2ooy n SER 138 Ca -0.01 -2.16 0.00 0.00 -0.26 0.00 0.00 58.87 56.44 2ooy n SER 138 Cb 0.23 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 2ooy n SER 138 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2ooy n ARG 139 N -0.32 -1.14 -2.82 4.33 0.00 -1.01 -4.90 116.66 110.80 2ooy n ARG 139 Ca 0.06 0.18 -0.41 0.00 -0.00 0.00 0.00 57.85 57.68 2ooy n ARG 139 Cb 0.37 -3.73 -0.04 0.00 -0.00 0.00 0.00 32.46 29.07 2ooy n ARG 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2ooy s ALA 140 N -0.64 3.23 -2.04 2.89 0.00 -0.97 -4.57 121.76 119.65 2ooy s ALA 140 Ca 0.00 0.41 0.20 0.00 0.00 0.00 0.00 51.96 52.57 2ooy s ALA 140 Cb 0.00 -3.21 1.12 0.00 0.00 0.00 0.00 23.12 21.04 2ooy s ALA 140 CO 0.00 -0.17 1.73 0.54 0.00 0.00 0.00 175.76 177.87 2ooy n ARG 141 N 3.75 1.10 -3.63 0.00 1.74 -0.67 -4.59 116.66 114.36 2ooy n ARG 141 Ca 0.03 -0.15 -0.05 0.00 -0.77 0.00 0.00 57.85 56.91 2ooy n ARG 141 Cb 0.51 -1.32 -0.05 0.00 -1.02 0.00 0.00 32.46 30.57 2ooy n ARG 141 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2ooy s ARG 142 N -1.97 0.25 -0.02 5.56 1.70 -1.26 -2.88 118.95 120.32 2ooy s ARG 142 Ca 0.30 0.12 0.01 0.00 -0.47 0.00 0.00 55.73 55.69 2ooy s ARG 142 Cb 0.14 0.12 0.01 0.00 -0.57 0.00 0.00 34.95 34.65 2ooy s ARG 142 CO 0.23 -0.07 -0.04 -1.50 -1.08 0.00 0.00 175.30 172.85 2ooy s ILE 143 N -0.72 0.40 0.67 4.99 2.07 -0.93 -4.91 121.20 122.77 2ooy s ILE 143 Ca 0.05 -0.11 -0.17 0.00 -1.41 0.00 0.00 60.65 59.01 2ooy s ILE 143 Cb -0.02 -0.41 0.00 0.00 0.13 0.00 0.00 42.46 42.16 2ooy s ILE 143 CO -0.07 0.16 1.20 -2.16 -1.91 0.00 0.00 174.94 172.17 2ooy s PRO 144 N 0.53 2.55 -0.17 3.50 0.04 -1.26 -1.66 135.00 138.53 2ooy s PRO 144 Ca -0.06 1.76 0.00 0.00 0.04 0.00 0.00 61.00 62.73 2ooy s PRO 144 Cb -0.10 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.56 2ooy s PRO 144 CO -0.00 -1.52 -0.16 -0.51 0.04 0.00 0.00 177.00 174.85 2ooy s LEU 145 N -4.67 2.40 -0.01 -3.56 1.43 0.21 -2.78 118.68 111.69 2ooy s LEU 145 Ca 0.75 -0.52 0.00 0.00 -1.03 0.00 0.00 54.13 53.33 2ooy s LEU 145 Cb -0.29 -1.55 0.02 0.00 0.03 0.00 0.00 46.19 44.39 2ooy s LEU 145 CO 0.40 0.05 0.01 -0.63 0.23 0.00 0.00 176.35 176.40 2ooy s ILE 146 N 1.03 0.06 0.08 -0.59 -1.09 -0.97 -0.54 121.20 119.17 2ooy s ILE 146 Ca -0.01 0.07 0.01 0.00 -2.23 0.00 0.00 60.65 58.49 2ooy s ILE 146 Cb -0.15 -0.12 0.01 0.00 -1.58 0.00 0.00 42.46 40.62 2ooy s ILE 146 CO -0.04 0.07 0.05 -0.67 -1.23 0.00 0.00 174.94 173.12 2ooy n ASP 147 N 3.68 1.38 -3.77 3.58 -0.08 -1.07 -4.12 116.55 116.15 2ooy n ASP 147 Ca -0.21 -1.28 -0.21 0.00 -1.51 0.00 0.00 54.79 51.58 2ooy n ASP 147 Cb 0.54 0.00 -0.17 0.00 2.34 0.00 0.00 41.12 43.83 2ooy n ASP 147 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 2ooy s VAL 148 N -0.50 0.29 -0.82 5.18 -7.23 -1.26 -2.37 120.40 113.68 2ooy s VAL 148 Ca 0.04 0.15 -0.25 0.00 -1.81 0.00 0.00 61.98 60.10 2ooy s VAL 148 Cb -0.00 -0.44 -0.01 0.00 0.56 0.00 0.00 36.38 36.48 2ooy s VAL 148 CO 0.02 0.23 1.76 -0.62 -0.31 0.00 0.00 175.10 176.18 2ooy s ASP 149 N 1.79 5.53 0.37 4.85 -1.08 0.57 -4.89 116.67 123.82 2ooy s ASP 149 Ca 0.02 -0.50 0.12 0.00 -0.52 0.00 0.00 52.55 51.67 2ooy s ASP 149 Cb -0.13 -2.55 0.91 0.00 -1.46 0.00 0.00 42.92 39.69 2ooy s ASP 149 CO -0.04 -2.32 1.85 1.23 0.52 0.00 0.00 175.17 176.42 2ooy h GLY 150 N 16.01 1.15 0.92 2.66 0.00 -1.92 2.42 103.07 124.30 2ooy h GLY 150 Ca -0.03 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 2ooy h GLY 150 CO 1.26 0.04 -0.06 -2.09 0.00 0.00 0.00 176.54 175.68 2ooy h GLU 151 N 0.59 -0.16 0.00 4.80 4.57 -1.97 -3.21 114.58 119.20 2ooy h GLU 151 Ca 0.47 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.66 2ooy h GLU 151 Cb 0.90 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.53 2ooy h GLU 151 CO -0.22 -0.03 -1.27 0.25 -1.18 0.00 0.00 179.01 176.56 2ooy n THR 152 N -5.12 0.44 -0.99 0.32 -2.24 -0.98 -4.96 114.28 100.76 2ooy n THR 152 Ca -0.08 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 2ooy n THR 152 Cb 0.13 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.12 2ooy n THR 152 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ooy n GLY 153 N 1.21 0.49 3.87 3.38 0.00 0.81 -5.03 105.19 109.92 2ooy n GLY 153 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 2ooy n GLY 153 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ooy s SER 154 N -2.13 6.52 -0.35 1.61 0.15 -1.09 -4.76 113.70 113.65 2ooy s SER 154 Ca 0.00 1.23 -0.20 0.00 0.70 0.00 0.00 55.95 57.68 2ooy s SER 154 Cb 0.00 -2.37 -0.00 0.00 -1.71 0.00 0.00 66.02 61.94 2ooy s SER 154 CO 0.00 -0.47 0.61 -1.61 1.20 0.00 0.00 173.24 172.97 2ooy s GLU 155 N -4.00 3.70 -0.44 5.44 2.02 -1.07 -0.31 118.70 124.04 2ooy s GLU 155 Ca 0.53 0.04 -0.19 0.00 0.02 0.00 0.00 54.97 55.37 2ooy s GLU 155 Cb -0.10 -3.80 0.03 0.00 0.10 0.00 0.00 34.13 30.36 2ooy s GLU 155 CO 0.33 -0.69 0.52 1.41 0.02 0.00 0.00 175.26 176.86 2ooy s MET 156 N 2.62 3.15 0.08 1.61 -2.45 -1.00 -4.65 119.30 118.65 2ooy s MET 156 Ca 0.23 -0.67 -0.31 0.00 -1.25 0.00 0.00 55.69 53.69 2ooy s MET 156 Cb -0.15 -3.98 -0.07 0.00 1.25 0.00 0.00 34.83 31.88 2ooy s MET 156 CO 0.14 -0.96 1.42 0.42 1.05 0.00 0.00 175.02 177.10 2ooy s ILE 157 N 2.40 3.40 -0.26 10.11 1.09 -1.26 -2.58 121.20 134.09 2ooy s ILE 157 Ca 0.15 0.93 -0.11 0.00 -1.10 0.00 0.00 60.65 60.53 2ooy s ILE 157 Cb -0.17 -3.60 -0.12 0.00 -1.06 0.00 0.00 42.46 37.51 2ooy s ILE 157 CO 0.15 0.04 -0.32 0.52 -0.10 0.00 0.00 174.94 175.23 2ooy n VAL 158 N 4.25 1.44 -2.52 2.92 0.31 0.30 -4.99 118.33 120.04 2ooy n VAL 158 Ca 0.12 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 2ooy n VAL 158 Cb 0.42 -1.78 0.00 0.00 -0.91 0.00 0.00 33.84 31.57 2ooy n VAL 158 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2ooy n SER 159 N -4.04 0.00 -3.74 4.52 2.88 -1.17 -4.85 113.62 107.22 2ooy n SER 159 Ca -0.51 -0.48 -0.13 0.00 -1.33 0.00 0.00 58.87 56.42 2ooy n SER 159 Cb 0.88 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 64.20 2ooy n SER 159 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2ooy s VAL 160 N -2.93 -0.05 -0.13 2.46 1.01 -1.26 0.65 120.40 120.15 2ooy s VAL 160 Ca 0.00 0.18 -0.14 0.00 0.00 0.00 0.00 61.98 62.02 2ooy s VAL 160 Cb 0.00 -0.26 -0.05 0.00 0.00 0.00 0.00 36.38 36.07 2ooy s VAL 160 CO 0.00 0.07 0.32 -0.76 0.00 0.00 0.00 175.10 174.73 2ooy s LEU 161 N 1.18 4.28 0.65 3.92 1.02 -0.67 -4.90 118.68 124.17 2ooy s LEU 161 Ca -0.09 0.59 -0.08 0.00 0.02 0.00 0.00 54.13 54.57 2ooy s LEU 161 Cb -0.11 -2.42 0.02 0.00 0.02 0.00 0.00 46.19 43.70 2ooy s LEU 161 CO -0.06 0.13 0.98 0.42 0.02 0.00 0.00 176.35 177.84 2ooy s THR 162 N 0.22 3.30 0.14 5.49 -4.23 -1.26 -2.20 115.64 117.10 2ooy s THR 162 Ca 0.18 0.08 -0.01 0.00 -1.18 0.00 0.00 61.69 60.76 2ooy s THR 162 Cb -0.14 -3.36 -0.17 0.00 1.34 0.00 0.00 72.50 70.17 2ooy s THR 162 CO 0.06 -0.41 1.33 1.56 -0.54 0.00 0.00 174.62 176.62 2ooy h GLN 163 N -0.41 0.31 -0.12 3.99 4.20 -1.93 -3.01 115.11 118.14 2ooy h GLN 163 Ca -0.45 -0.34 0.04 0.00 0.06 0.00 0.00 58.65 57.96 2ooy h GLN 163 Cb 1.27 0.10 -0.05 0.00 0.30 0.00 0.00 27.48 29.10 2ooy h GLN 163 CO 0.62 1.04 -0.16 -0.92 -0.67 0.00 0.00 178.83 178.73 2ooy h TYR 164 N 0.17 -0.42 -0.41 2.96 5.03 -1.92 -0.03 116.97 122.34 2ooy h TYR 164 Ca -0.06 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.26 2ooy h TYR 164 Cb 1.56 0.20 -0.02 0.00 1.55 0.00 0.00 36.73 40.02 2ooy h TYR 164 CO 0.05 -0.24 0.21 -0.09 -1.32 0.00 0.00 178.16 176.77 2ooy h ARG 165 N -0.21 0.57 -0.07 1.82 2.43 -1.93 0.11 114.38 117.10 2ooy h ARG 165 Ca 0.09 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 2ooy h ARG 165 Cb 0.34 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 2ooy h ARG 165 CO -0.24 0.44 -0.14 0.97 -1.51 0.00 0.00 179.97 179.49 2ooy h ILE 166 N 0.58 1.42 -0.04 1.20 -0.00 -1.13 0.63 117.51 120.16 2ooy h ILE 166 Ca 0.15 -1.45 0.03 0.00 -0.00 0.00 0.00 64.86 63.58 2ooy h ILE 166 Cb 0.05 2.22 -0.04 0.00 -0.00 0.00 0.00 36.82 39.05 2ooy h ILE 166 CO -0.02 0.41 -0.15 -0.07 -0.00 0.00 0.00 178.15 178.31 2ooy h LEU 167 N -0.28 -0.46 -1.66 2.19 3.38 -0.61 -1.27 115.31 116.59 2ooy h LEU 167 Ca 0.00 0.07 0.09 0.00 0.09 0.00 0.00 57.88 58.14 2ooy h LEU 167 Cb 0.72 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.64 2ooy h LEU 167 CO 0.03 -0.21 0.39 0.50 0.09 0.00 0.00 178.44 179.24 2ooy h LYS 168 N -0.24 0.37 0.19 1.13 3.64 -0.42 0.70 116.57 121.95 2ooy h LYS 168 Ca 0.06 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.43 2ooy h LYS 168 Cb 0.32 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.02 2ooy h LYS 168 CO -0.18 0.25 -0.43 0.35 -2.27 0.00 0.00 179.45 177.17 2ooy h PHE 169 N 0.39 -1.21 -0.22 1.91 3.04 0.12 -0.35 116.94 120.60 2ooy h PHE 169 Ca 0.26 0.03 0.06 0.00 3.98 0.00 0.00 57.97 62.29 2ooy h PHE 169 Cb 0.53 0.50 -0.06 0.00 2.56 0.00 0.00 35.95 39.48 2ooy h PHE 169 CO -0.00 -0.54 -0.16 0.82 -2.02 0.00 0.00 178.31 176.41 2ooy h ILE 170 N -0.72 0.55 0.00 1.41 1.08 0.96 -1.94 117.51 118.85 2ooy h ILE 170 Ca 0.00 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.43 2ooy h ILE 170 Cb 0.71 0.55 -0.01 0.00 -3.07 0.00 0.00 36.82 35.00 2ooy h ILE 170 CO -0.20 0.00 -0.19 0.77 -0.69 0.00 0.00 178.15 177.83 2ooy h SER 171 N -0.16 0.00 1.54 1.72 4.64 0.54 0.28 113.55 122.11 2ooy h SER 171 Ca 0.13 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.40 2ooy h SER 171 Cb 0.35 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 2ooy h SER 171 CO -0.32 0.19 -0.23 0.24 -0.87 0.00 0.00 176.83 175.85 2ooy h MET 172 N 0.00 0.00 0.00 4.77 2.86 -0.37 -3.37 114.93 118.82 2ooy h MET 172 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2ooy h MET 172 Cb 0.34 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.00 2ooy h MET 172 CO 0.03 0.23 -1.27 0.09 1.06 0.00 0.00 176.91 177.04 2ooy n ASN 173 N -3.20 2.21 -4.05 1.22 3.02 0.21 -4.79 115.26 109.88 2ooy n ASN 173 Ca 0.02 -0.15 -0.34 0.00 -0.03 0.00 0.00 54.58 54.08 2ooy n ASN 173 Cb 0.57 1.38 -0.11 0.00 -0.61 0.00 0.00 39.78 41.01 2ooy n ASN 173 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ooy n LYS 175 N 3.38 -0.04 0.13 0.00 0.00 -1.26 -1.12 118.16 119.25 2ooy n LYS 175 Ca 0.07 0.86 0.07 0.00 0.00 0.00 0.00 58.31 59.31 2ooy n LYS 175 Cb 0.36 -1.51 0.36 0.00 0.00 0.00 0.00 35.03 34.25 2ooy n LYS 175 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2ooy n GLU 176 N -4.48 0.09 0.24 1.64 4.71 -1.26 -1.79 120.64 119.79 2ooy n GLU 176 Ca 0.21 0.55 0.11 0.00 -0.01 0.00 0.00 57.16 58.03 2ooy n GLU 176 Cb 0.72 -1.97 0.58 0.00 -1.01 0.00 0.00 31.44 29.76 2ooy n GLU 176 CO 0.00 0.00 0.00 1.79 0.09 0.00 0.00 177.13 179.01 2ooy h THR 177 N 0.00 0.55 -0.04 2.62 1.35 -1.48 -2.52 112.91 113.39 2ooy h THR 177 Ca 0.00 -0.88 0.01 0.00 -0.55 0.00 0.00 66.41 64.99 2ooy h THR 177 Cb 0.35 1.59 -0.00 0.00 -1.73 0.00 0.00 68.15 68.36 2ooy h THR 177 CO 0.00 0.18 0.07 0.00 -0.25 0.00 0.00 175.52 175.52 2ooy h ALA 178 N 1.82 1.40 -0.62 6.62 0.00 -1.58 -2.42 119.26 124.48 2ooy h ALA 178 Ca -0.00 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.69 2ooy h ALA 178 Cb 0.58 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.24 2ooy h ALA 178 CO 0.02 -0.09 0.21 -1.33 0.00 0.00 0.00 179.25 178.06 2ooy n MET 179 N -3.51 3.07 -3.73 0.00 2.81 -0.95 -4.77 117.12 110.04 2ooy n MET 179 Ca -0.02 -3.06 -0.35 0.00 -1.81 0.00 0.00 57.70 52.45 2ooy n MET 179 Cb 0.15 -2.08 -0.09 0.00 -0.71 0.00 0.00 33.22 30.49 2ooy n MET 179 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2ooy s LEU 180 N -3.06 5.21 -0.09 4.03 1.43 -0.91 -3.94 118.68 121.35 2ooy s LEU 180 Ca 0.51 -3.12 0.13 0.00 -1.03 0.00 0.00 54.13 50.63 2ooy s LEU 180 Cb 0.42 -1.84 0.20 0.00 0.03 0.00 0.00 46.19 45.01 2ooy s LEU 180 CO 0.10 -0.30 1.09 0.54 0.23 0.00 0.00 176.35 178.01 2ooy n ARG 181 N 3.11 1.60 -2.94 1.70 5.12 -1.26 -0.62 116.66 123.37 2ooy n ARG 181 Ca 0.11 -2.20 -0.43 0.00 -1.93 0.00 0.00 57.85 53.40 2ooy n ARG 181 Cb 0.37 -1.31 -0.05 0.00 -1.16 0.00 0.00 32.46 30.31 2ooy n ARG 181 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2ooy s VAL 182 N -2.23 4.56 0.69 1.55 1.01 -1.26 -4.97 120.40 119.74 2ooy s VAL 182 Ca 0.22 0.08 -0.17 0.00 0.00 0.00 0.00 61.98 62.12 2ooy s VAL 182 Cb 0.19 -4.44 -0.10 0.00 0.00 0.00 0.00 36.38 32.03 2ooy s VAL 182 CO 0.02 -0.98 0.08 -2.65 0.00 0.00 0.00 175.10 171.57 2ooy n PRO 183 N 7.01 0.16 0.00 2.72 -0.01 -1.24 -4.51 135.00 139.12 2ooy n PRO 183 Ca -0.01 0.07 -0.11 0.00 -0.01 0.00 0.00 63.50 63.45 2ooy n PRO 183 Cb 0.47 -1.41 -0.07 0.00 -0.01 0.00 0.00 33.50 32.48 2ooy n PRO 183 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 175.50 175.42 2ooy h LEU 184 N -0.34 -1.21 -1.42 2.45 4.07 -1.59 -3.01 115.31 114.26 2ooy h LEU 184 Ca -0.44 0.14 0.00 0.00 0.08 0.00 0.00 57.88 57.66 2ooy h LEU 184 Cb 1.38 0.47 0.00 0.00 1.08 0.00 0.00 40.66 43.59 2ooy h LEU 184 CO 0.39 -0.35 0.47 -0.55 -1.08 0.00 0.00 178.44 177.32 2ooy h ASN 185 N -0.43 0.00 0.00 -0.43 -0.00 -1.78 -1.12 115.58 111.82 2ooy h ASN 185 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.32 2ooy h ASN 185 Cb 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.81 2ooy h ASN 185 CO -0.30 0.00 -0.01 1.56 -0.00 0.00 0.00 177.43 178.68 2ooy h GLN 186 N 0.00 0.00 -5.12 4.14 4.20 -1.86 -3.46 115.11 113.01 2ooy h GLN 186 Ca 0.00 0.00 -0.68 0.00 0.06 0.00 0.00 58.65 58.03 2ooy h GLN 186 Cb 0.93 0.00 0.04 0.00 0.30 0.00 0.00 27.48 28.75 2ooy h GLN 186 CO 0.00 0.00 0.09 -1.33 -0.67 0.00 0.00 178.83 176.92 2ooy n MET 187 N -2.39 0.00 -2.64 1.46 2.81 -0.42 -4.94 117.12 111.00 2ooy n MET 187 Ca -0.00 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.47 2ooy n MET 187 Cb 0.01 -1.28 -0.03 0.00 -0.71 0.00 0.00 33.22 31.21 2ooy n MET 187 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 2ooy s THR 188 N 0.20 4.02 -0.17 2.03 -1.32 -1.26 -4.86 115.64 114.28 2ooy s THR 188 Ca 0.79 0.56 -0.29 0.00 -1.21 0.00 0.00 61.69 61.54 2ooy s THR 188 Cb -1.10 -4.75 0.10 0.00 -1.51 0.00 0.00 72.50 65.24 2ooy s THR 188 CO 0.50 -1.46 0.88 -0.51 -2.21 0.00 0.00 174.62 171.82 2ooy s ILE 189 N 4.95 0.00 0.34 5.08 2.07 -1.26 -5.11 121.20 127.26 2ooy s ILE 189 Ca 0.37 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.61 2ooy s ILE 189 Cb -0.09 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.50 2ooy s ILE 189 CO 0.20 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 173.84 2ooy n GLY 190 N 1.31 -3.93 3.77 1.50 0.00 -1.26 -4.86 105.19 101.71 2ooy n GLY 190 Ca -0.14 -0.91 -0.37 0.00 0.00 0.00 0.00 46.02 44.61 2ooy n GLY 190 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ooy s THR 191 N -3.37 2.90 0.00 2.61 2.01 -1.10 -4.81 115.64 113.88 2ooy s THR 191 Ca 0.00 0.65 0.00 0.00 0.31 0.00 0.00 61.69 62.65 2ooy s THR 191 Cb 0.00 -3.32 0.00 0.00 0.01 0.00 0.00 72.50 69.19 2ooy s THR 191 CO 0.00 -0.03 0.05 0.79 -0.69 0.00 0.00 174.62 174.74 2ooy n TRP 192 N -0.76 0.00 -3.97 4.92 7.02 -1.26 -0.64 117.44 122.74 2ooy n TRP 192 Ca 0.09 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.49 2ooy n TRP 192 Cb 0.48 0.00 -0.09 0.00 -2.42 0.00 0.00 31.31 29.28 2ooy n TRP 192 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 2ooy s SER 193 N -0.02 0.30 -0.76 -0.99 1.04 -1.26 -4.60 113.70 107.40 2ooy s SER 193 Ca 0.00 -0.81 -0.05 0.00 0.48 0.00 0.00 55.95 55.57 2ooy s SER 193 Cb 0.00 0.27 0.01 0.00 0.10 0.00 0.00 66.02 66.39 2ooy s SER 193 CO 0.00 -0.66 0.60 -3.20 0.98 0.00 0.00 173.24 170.96 2ooy n ASN 194 N 0.06 -4.36 -4.68 7.02 5.15 -1.26 -4.95 115.26 112.24 2ooy n ASN 194 Ca -0.15 -0.27 -0.41 0.00 -0.60 0.00 0.00 54.58 53.15 2ooy n ASN 194 Cb 0.62 -2.98 -0.04 0.00 -0.53 0.00 0.00 39.78 36.84 2ooy n ASN 194 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2ooy s LEU 195 N -4.37 4.20 0.09 1.20 1.43 -1.26 -5.01 118.68 114.96 2ooy s LEU 195 Ca 0.30 1.24 -0.31 0.00 -1.03 0.00 0.00 54.13 54.32 2ooy s LEU 195 Cb -0.13 -3.28 -0.08 0.00 0.03 0.00 0.00 46.19 42.73 2ooy s LEU 195 CO 0.37 -0.38 1.50 0.00 0.23 0.00 0.00 176.35 178.07 2ooy s ALA 196 N 2.01 3.66 -0.17 4.21 0.00 -1.26 -5.02 121.76 125.18 2ooy s ALA 196 Ca 0.40 1.15 -0.12 0.00 0.00 0.00 0.00 51.96 53.39 2ooy s ALA 196 Cb -0.17 -3.61 0.05 0.00 0.00 0.00 0.00 23.12 19.39 2ooy s ALA 196 CO 0.14 -0.84 0.44 0.95 0.00 0.00 0.00 175.76 176.45 2ooy s THR 197 N 1.77 -0.01 0.45 0.00 -4.23 -1.26 -4.39 115.64 107.96 2ooy s THR 197 Ca 0.68 0.04 0.07 0.00 -1.18 0.00 0.00 61.69 61.30 2ooy s THR 197 Cb -0.38 -0.63 0.02 0.00 1.34 0.00 0.00 72.50 72.85 2ooy s THR 197 CO 0.30 0.02 0.61 0.00 -0.54 0.00 0.00 174.62 175.01 2ooy s ALA 198 N 0.85 4.41 0.15 3.99 0.00 -1.11 -4.92 121.76 125.13 2ooy s ALA 198 Ca -0.05 -1.62 0.02 0.00 0.00 0.00 0.00 51.96 50.32 2ooy s ALA 198 Cb -0.06 -1.71 0.02 0.00 0.00 0.00 0.00 23.12 21.37 2ooy s ALA 198 CO -0.07 -0.38 0.17 -1.13 0.00 0.00 0.00 175.76 174.35 2ooy n SER 199 N -1.95 0.92 -0.79 0.00 3.41 -1.26 -1.90 113.62 112.04 2ooy n SER 199 Ca 0.08 -1.44 0.08 0.00 -0.26 0.00 0.00 58.87 57.33 2ooy n SER 199 Cb 0.59 -0.07 0.24 0.00 -0.26 0.00 0.00 64.21 64.71 2ooy n SER 199 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 2ooy n MET 200 N -1.13 2.00 -0.01 4.33 1.56 -1.26 -2.91 117.12 119.70 2ooy n MET 200 Ca 0.02 -1.54 0.04 0.00 -0.27 0.00 0.00 57.70 55.95 2ooy n MET 200 Cb 0.16 -1.37 0.03 0.00 2.15 0.00 0.00 33.22 34.19 2ooy n MET 200 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 2ooy n GLU 201 N 0.75 0.13 -2.58 2.12 4.71 -1.26 -0.67 120.64 123.84 2ooy n GLU 201 Ca 0.16 -0.97 -0.42 0.00 -0.01 0.00 0.00 57.16 55.92 2ooy n GLU 201 Cb 0.39 -1.14 -0.03 0.00 -1.01 0.00 0.00 31.44 29.65 2ooy n GLU 201 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 2ooy s THR 202 N -0.61 4.50 0.50 2.62 2.01 -1.15 -4.70 115.64 118.82 2ooy s THR 202 Ca 0.09 1.79 -0.22 0.00 0.31 0.00 0.00 61.69 63.66 2ooy s THR 202 Cb 0.06 -4.15 -0.06 0.00 0.01 0.00 0.00 72.50 68.36 2ooy s THR 202 CO 0.09 0.12 1.25 -0.54 -0.69 0.00 0.00 174.62 174.85 2ooy s LYS 203 N 1.22 3.49 0.43 4.92 -0.14 -1.26 -0.19 119.74 128.21 2ooy s LYS 203 Ca 0.55 1.99 0.17 0.00 -1.36 0.00 0.00 55.97 57.31 2ooy s LYS 203 Cb -0.24 -2.35 0.99 0.00 -1.68 0.00 0.00 37.83 34.55 2ooy s LYS 203 CO 0.27 -0.83 1.94 0.28 -0.76 0.00 0.00 175.35 176.25 2ooy h VAL 204 N 1.69 1.05 -0.10 3.17 2.07 -0.76 -2.37 116.25 120.99 2ooy h VAL 204 Ca -0.50 -0.87 -0.18 0.00 0.82 0.00 0.00 66.70 65.97 2ooy h VAL 204 Cb 1.27 1.49 -0.00 0.00 -1.52 0.00 0.00 31.29 32.52 2ooy h VAL 204 CO 0.59 0.24 -0.70 0.10 0.02 0.00 0.00 177.57 177.82 2ooy h TYR 205 N 0.00 0.61 -0.58 1.57 -0.00 -1.73 -2.22 116.97 114.61 2ooy h TYR 205 Ca -0.00 -0.26 -0.00 0.00 -0.00 0.00 0.00 58.73 58.47 2ooy h TYR 205 Cb 0.47 -0.10 -0.03 0.00 -0.00 0.00 0.00 36.73 37.07 2ooy h TYR 205 CO 0.00 1.01 0.35 -0.44 -0.00 0.00 0.00 178.16 179.08 2ooy h ASP 206 N 0.32 0.70 0.04 0.10 3.32 -1.77 0.65 116.42 119.79 2ooy h ASP 206 Ca -0.02 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.97 2ooy h ASP 206 Cb 1.27 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.63 2ooy h ASP 206 CO 0.12 0.56 -0.05 0.58 -1.72 0.00 0.00 179.24 178.73 2ooy h VAL 207 N 0.79 0.88 -0.71 -1.35 2.07 -1.52 0.19 116.25 116.59 2ooy h VAL 207 Ca 0.21 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.88 2ooy h VAL 207 Cb -0.01 0.88 -0.12 0.00 -1.52 0.00 0.00 31.29 30.51 2ooy h VAL 207 CO -0.04 0.00 -0.02 0.40 0.02 0.00 0.00 177.57 177.93 2ooy h ILE 208 N -0.11 0.38 0.03 4.57 1.08 -1.14 0.14 117.51 122.46 2ooy h ILE 208 Ca 0.01 -0.03 0.00 0.00 -0.39 0.00 0.00 64.86 64.44 2ooy h ILE 208 Cb 0.11 0.28 -0.00 0.00 -3.07 0.00 0.00 36.82 34.14 2ooy h ILE 208 CO -0.02 0.02 -0.07 0.50 -0.69 0.00 0.00 178.15 177.89 2ooy h LYS 209 N 0.09 -0.10 -1.10 2.37 3.64 0.19 -2.53 116.57 119.13 2ooy h LYS 209 Ca 0.38 0.01 0.32 0.00 -1.27 0.00 0.00 60.65 60.08 2ooy h LYS 209 Cb 0.64 0.02 -0.12 0.00 -0.41 0.00 0.00 32.23 32.36 2ooy h LYS 209 CO -0.63 -0.07 0.69 0.52 -2.27 0.00 0.00 179.45 177.69 2ooy h MET 210 N -0.10 0.31 0.00 1.90 2.86 -0.38 -3.20 114.93 116.31 2ooy h MET 210 Ca -0.00 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2ooy h MET 210 Cb 0.10 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.69 2ooy h MET 210 CO -0.03 0.20 0.00 1.28 1.06 0.00 0.00 176.91 179.43 2ooy n LEU 211 N -4.75 0.00 -4.45 1.22 4.77 0.01 -1.13 117.00 112.67 2ooy n LEU 211 Ca 0.30 0.69 -0.43 0.00 -0.03 0.00 0.00 56.01 56.54 2ooy n LEU 211 Cb 1.03 -0.19 -0.00 0.00 -2.33 0.00 0.00 43.42 41.92 2ooy n LEU 211 CO 0.20 -0.19 0.08 0.00 -1.33 0.00 0.00 177.39 176.14 2ooy n ALA 212 N -1.32 -1.64 0.00 -1.18 0.00 -1.13 0.70 120.51 115.94 2ooy n ALA 212 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.66 2ooy n ALA 212 Cb 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 19.45 17.69 2ooy n ALA 212 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2ooy n GLU 213 N 0.72 0.00 0.00 0.00 2.13 0.23 -4.15 120.64 119.58 2ooy n GLU 213 Ca 0.12 0.00 0.10 0.00 0.66 0.00 0.00 57.16 58.04 2ooy n GLU 213 Cb 0.37 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.03 2ooy n GLU 213 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2ooy n LYS 214 N 0.00 0.90 -3.54 5.31 4.76 -0.29 -4.05 118.16 121.25 2ooy n LYS 214 Ca 0.00 -0.59 -0.17 0.00 -2.87 0.00 0.00 58.31 54.68 2ooy n LYS 214 Cb 0.00 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 31.74 2ooy n LYS 214 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2ooy n ASN 215 N -0.60 -5.88 -4.14 4.39 2.85 0.22 -5.01 115.26 107.09 2ooy n ASN 215 Ca 0.07 -0.67 -0.11 0.00 -0.11 0.00 0.00 54.58 53.75 2ooy n ASN 215 Cb 0.40 -3.04 -0.10 0.00 1.24 0.00 0.00 39.78 38.27 2ooy n ASN 215 CO 0.00 0.00 0.00 0.27 -2.11 0.00 0.00 177.26 175.42 2ooy s ILE 216 N -3.04 0.65 -0.33 -1.44 -4.36 -0.40 -4.78 121.20 107.50 2ooy s ILE 216 Ca 0.05 -1.69 0.23 0.00 -0.26 0.00 0.00 60.65 58.97 2ooy s ILE 216 Cb -0.02 -1.38 -0.06 0.00 1.25 0.00 0.00 42.46 42.25 2ooy s ILE 216 CO 0.85 -0.74 1.00 -1.54 0.24 0.00 0.00 174.94 174.75 2ooy n SER 217 N 0.39 0.67 -3.87 4.36 3.41 -1.26 -4.55 113.62 112.77 2ooy n SER 217 Ca -0.15 0.16 -0.09 0.00 -0.26 0.00 0.00 58.87 58.52 2ooy n SER 217 Cb 0.59 0.69 -0.07 0.00 -0.26 0.00 0.00 64.21 65.16 2ooy n SER 217 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ooy s ALA 218 N -3.33 -0.20 -0.14 7.33 0.00 -1.26 -0.95 121.76 123.21 2ooy s ALA 218 Ca 0.00 -0.65 -0.06 0.00 0.00 0.00 0.00 51.96 51.25 2ooy s ALA 218 Cb 0.12 0.58 0.07 0.00 0.00 0.00 0.00 23.12 23.88 2ooy s ALA 218 CO 0.80 -0.55 0.30 0.08 0.00 0.00 0.00 175.76 176.39 2ooy s VAL 219 N -3.88 -0.36 0.36 0.00 1.01 0.23 -4.96 120.40 112.81 2ooy s VAL 219 Ca 0.08 0.22 -0.28 0.00 0.00 0.00 0.00 61.98 62.00 2ooy s VAL 219 Cb 0.04 -0.48 -0.10 0.00 0.00 0.00 0.00 36.38 35.84 2ooy s VAL 219 CO -0.09 0.09 1.33 -2.16 0.00 0.00 0.00 175.10 174.28 2ooy s PRO 220 N 2.16 4.18 -0.27 2.72 0.04 -1.26 -0.83 135.00 141.75 2ooy s PRO 220 Ca -0.02 2.26 -0.06 0.00 0.04 0.00 0.00 61.00 63.21 2ooy s PRO 220 Cb -0.11 -2.95 -0.00 0.00 0.04 0.00 0.00 34.50 31.48 2ooy s PRO 220 CO -0.10 -0.35 0.06 0.42 0.04 0.00 0.00 177.00 177.07 2ooy s ILE 221 N -1.18 3.93 0.00 0.56 1.01 0.78 -2.77 121.20 123.53 2ooy s ILE 221 Ca 0.52 -0.56 0.00 0.00 0.00 0.00 0.00 60.65 60.61 2ooy s ILE 221 Cb -0.40 -2.95 0.00 0.00 0.01 0.00 0.00 42.46 39.11 2ooy s ILE 221 CO 0.53 0.19 0.00 1.33 0.00 0.00 0.00 174.94 176.99 2ooy n VAL 222 N 4.86 0.00 -3.98 2.92 0.24 -0.80 -0.49 118.33 121.08 2ooy n VAL 222 Ca -0.15 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.05 2ooy n VAL 222 Cb 0.49 -0.56 -0.06 0.00 -1.47 0.00 0.00 33.84 32.24 2ooy n VAL 222 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2ooy s ASN 223 N -0.63 -0.06 0.07 -1.34 2.20 -1.24 -4.40 114.94 109.54 2ooy s ASN 223 Ca 0.00 -0.91 -0.13 0.00 -0.94 0.00 0.00 52.86 50.88 2ooy s ASN 223 Cb 0.00 0.54 -0.02 0.00 -2.00 0.00 0.00 41.25 39.77 2ooy s ASN 223 CO 0.00 -1.06 0.64 -1.20 -2.94 0.00 0.00 177.10 172.55 2ooy n SER 224 N -0.34 -0.43 -0.31 3.54 7.64 -1.26 0.51 113.62 122.97 2ooy n SER 224 Ca -0.03 0.74 0.00 0.00 1.01 0.00 0.00 58.87 60.59 2ooy n SER 224 Cb 0.62 -0.10 0.01 0.00 -1.01 0.00 0.00 64.21 63.73 2ooy n SER 224 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 2ooy n GLU 225 N -4.53 1.05 -0.71 1.43 0.00 -1.26 -4.85 120.64 111.77 2ooy n GLU 225 Ca 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 57.16 57.12 2ooy n GLU 225 Cb 0.11 -1.30 0.00 0.00 0.00 0.00 0.00 31.44 30.26 2ooy n GLU 225 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2ooy n GLY 226 N 0.23 1.48 3.68 -1.84 0.00 1.91 -4.96 105.19 105.68 2ooy n GLY 226 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2ooy n GLY 226 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ooy s THR 227 N -3.60 2.96 -0.10 2.61 2.01 -1.25 -3.83 115.64 114.45 2ooy s THR 227 Ca 0.00 0.25 -0.34 0.00 0.31 0.00 0.00 61.69 61.91 2ooy s THR 227 Cb 0.00 -3.16 -0.12 0.00 0.01 0.00 0.00 72.50 69.23 2ooy s THR 227 CO 0.00 -0.01 1.89 -0.11 -0.69 0.00 0.00 174.62 175.70 2ooy n LEU 228 N 6.43 3.41 -0.13 4.42 0.00 -0.20 -3.59 117.00 127.34 2ooy n LEU 228 Ca 0.18 0.96 -0.27 0.00 0.00 0.00 0.00 56.01 56.88 2ooy n LEU 228 Cb 0.40 -1.36 -0.09 0.00 0.00 0.00 0.00 43.42 42.37 2ooy n LEU 228 CO 0.65 -0.07 -1.34 0.18 0.00 0.00 0.00 177.39 176.81 2ooy n LEU 229 N 6.74 1.86 0.00 -1.96 4.77 0.36 -4.99 117.00 123.77 2ooy n LEU 229 Ca 0.23 0.32 -0.10 0.00 -0.03 0.00 0.00 56.01 56.44 2ooy n LEU 229 Cb 0.29 -0.77 0.00 0.00 -2.33 0.00 0.00 43.42 40.61 2ooy n LEU 229 CO 0.74 0.47 0.30 -3.20 -1.33 0.00 0.00 177.39 174.37 2ooy n ASN 230 N -4.20 -1.54 -3.92 -1.43 2.85 -1.07 -4.99 115.26 100.96 2ooy n ASN 230 Ca -0.49 -2.43 -0.22 0.00 -0.11 0.00 0.00 54.58 51.33 2ooy n ASN 230 Cb 0.84 2.66 -0.17 0.00 1.24 0.00 0.00 39.78 44.35 2ooy n ASN 230 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2ooy s VAL 231 N -2.49 0.76 -0.18 3.44 0.11 -1.26 -0.15 120.40 120.62 2ooy s VAL 231 Ca 0.18 -0.23 -0.24 0.00 -2.93 0.00 0.00 61.98 58.76 2ooy s VAL 231 Cb -0.03 -0.76 -0.02 0.00 -1.53 0.00 0.00 36.38 34.05 2ooy s VAL 231 CO 0.13 0.28 0.79 -0.47 -3.33 0.00 0.00 175.10 172.51 2ooy s TYR 232 N 1.03 3.40 0.13 1.54 6.14 -0.01 -4.87 117.35 124.73 2ooy s TYR 232 Ca -0.09 1.19 0.07 0.00 0.64 0.00 0.00 57.07 58.88 2ooy s TYR 232 Cb -0.14 -2.98 -0.04 0.00 0.42 0.00 0.00 41.96 39.22 2ooy s TYR 232 CO -0.00 -0.24 -0.07 -1.21 0.64 0.00 0.00 175.55 174.67 2ooy s GLU 233 N 2.15 2.20 0.52 4.97 2.02 -1.26 0.78 118.70 130.08 2ooy s GLU 233 Ca 0.36 -1.07 0.20 0.00 0.02 0.00 0.00 54.97 54.49 2ooy s GLU 233 Cb -0.16 -2.31 1.37 0.00 0.10 0.00 0.00 34.13 33.13 2ooy s GLU 233 CO 0.12 0.49 2.13 0.66 0.02 0.00 0.00 175.26 178.68 2ooy h SER 234 N 3.28 0.00 0.14 -0.19 4.64 -1.39 0.22 113.55 120.26 2ooy h SER 234 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2ooy h SER 234 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2ooy h SER 234 CO 0.54 0.05 0.00 1.33 -0.87 0.00 0.00 176.83 177.89 2ooy n VAL 235 N -4.22 0.99 1.84 0.95 0.24 -1.26 0.61 118.33 117.48 2ooy n VAL 235 Ca -0.03 0.25 0.09 0.00 -2.04 0.00 0.00 64.34 62.61 2ooy n VAL 235 Cb 0.14 -1.14 0.49 0.00 -1.47 0.00 0.00 33.84 31.86 2ooy n VAL 235 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2ooy n ASP 236 N -1.32 0.34 -0.09 -1.34 8.00 0.78 -3.81 116.55 119.11 2ooy n ASP 236 Ca 0.03 -1.50 -0.15 0.00 0.71 0.00 0.00 54.79 53.88 2ooy n ASP 236 Cb 0.06 -0.02 -0.06 0.00 -0.02 0.00 0.00 41.12 41.07 2ooy n ASP 236 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2ooy n VAL 237 N -0.55 1.48 -0.06 2.53 0.31 0.20 -2.76 118.33 119.49 2ooy n VAL 237 Ca 0.14 0.04 -0.01 0.00 -0.01 0.00 0.00 64.34 64.50 2ooy n VAL 237 Cb 0.12 -2.20 -0.01 0.00 -0.91 0.00 0.00 33.84 30.84 2ooy n VAL 237 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 2ooy n MET 238 N -4.48 -0.06 0.09 5.55 0.00 -1.25 0.62 117.12 117.59 2ooy n MET 238 Ca -0.23 0.22 0.01 0.00 -0.00 0.00 0.00 57.70 57.71 2ooy n MET 238 Cb 0.53 -0.33 0.36 0.00 0.00 0.00 0.00 33.22 33.77 2ooy n MET 238 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 2ooy h HIS 239 N 0.00 0.33 -0.43 1.12 -0.00 -1.72 0.24 115.15 114.70 2ooy h HIS 239 Ca 0.03 -0.04 -0.08 0.00 -0.00 0.00 0.00 60.37 60.28 2ooy h HIS 239 Cb 0.07 -0.09 -0.02 0.00 -0.00 0.00 0.00 27.41 27.36 2ooy h HIS 239 CO -0.15 0.43 -0.05 1.25 -0.00 0.00 0.00 177.93 179.41 2ooy h LEU 240 N 0.30 0.70 -2.64 2.43 5.85 1.86 -3.31 115.31 120.50 2ooy h LEU 240 Ca 0.06 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.60 2ooy h LEU 240 Cb 0.39 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.23 2ooy h LEU 240 CO 0.02 0.80 -0.11 2.30 -0.34 0.00 0.00 178.44 181.12 2ooy n ILE 241 N -4.20 1.19 0.30 4.05 -5.35 0.64 -4.64 119.36 111.34 2ooy n ILE 241 Ca 0.02 -1.39 0.19 0.00 -0.27 0.00 0.00 62.75 61.29 2ooy n ILE 241 Cb 0.32 0.14 0.83 0.00 -1.74 0.00 0.00 39.64 39.19 2ooy n ILE 241 CO 0.00 0.00 0.00 0.06 -1.76 0.00 0.00 176.55 174.85 2ooy h GLN 242 N 0.00 0.00 0.00 6.28 3.07 -0.62 -2.04 115.11 121.80 2ooy h GLN 242 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2ooy h GLN 242 Cb 0.99 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.55 2ooy h GLN 242 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 178.83 178.67 2ooy n ASP 243 N -3.07 0.31 -0.46 0.06 10.43 -1.26 -4.73 116.55 117.83 2ooy n ASP 243 Ca -0.00 0.54 -0.06 0.00 2.57 0.00 0.00 54.79 57.84 2ooy n ASP 243 Cb 0.24 -0.62 -0.03 0.00 1.84 0.00 0.00 41.12 42.55 2ooy n ASP 243 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2ooy n GLY 244 N 1.03 0.78 3.27 0.44 0.00 -0.77 -5.00 105.19 104.94 2ooy n GLY 244 Ca 0.05 -0.29 -0.44 0.00 0.00 0.00 0.00 46.02 45.35 2ooy n GLY 244 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2ooy s ASP 245 N -2.48 5.97 0.01 1.61 -1.08 -1.26 -4.90 116.67 114.54 2ooy s ASP 245 Ca 0.00 -1.81 0.27 0.00 -0.52 0.00 0.00 52.55 50.49 2ooy s ASP 245 Cb 0.00 -2.12 1.13 0.00 -1.46 0.00 0.00 42.92 40.48 2ooy s ASP 245 CO 0.00 -0.77 1.86 -1.22 0.52 0.00 0.00 175.17 175.56 2ooy n TYR 246 N 5.09 0.06 0.30 -5.34 4.02 -1.26 -2.59 117.16 117.44 2ooy n TYR 246 Ca -0.11 0.02 0.19 0.00 -0.01 0.00 0.00 57.90 57.98 2ooy n TYR 246 Cb 0.41 -0.53 0.86 0.00 -0.02 0.00 0.00 39.34 40.06 2ooy n TYR 246 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 2ooy h SER 247 N 0.00 0.00 0.00 7.72 4.64 -1.95 -2.36 113.55 121.60 2ooy h SER 247 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ooy h SER 247 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2ooy h SER 247 CO 0.00 0.01 0.03 0.59 -0.87 0.00 0.00 176.83 176.59 2ooy n ASN 248 N -3.11 0.14 0.01 4.97 4.13 -1.07 -1.46 115.26 118.87 2ooy n ASN 248 Ca -0.01 0.55 0.13 0.00 1.68 0.00 0.00 54.58 56.93 2ooy n ASN 248 Cb 0.23 -0.56 0.39 0.00 -1.54 0.00 0.00 39.78 38.30 2ooy n ASN 248 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2ooy n LEU 249 N -1.68 0.33 -0.81 3.41 4.77 -0.89 -3.36 117.00 118.78 2ooy n LEU 249 Ca -0.00 0.22 0.06 0.00 -0.03 0.00 0.00 56.01 56.26 2ooy n LEU 249 Cb 0.04 -0.34 0.18 0.00 -2.33 0.00 0.00 43.42 40.96 2ooy n LEU 249 CO 0.02 0.06 0.63 0.47 -1.33 0.00 0.00 177.39 177.24 2ooy n ASP 250 N -1.56 2.32 -4.75 -1.43 8.00 -0.53 -2.29 116.55 116.31 2ooy n ASP 250 Ca 0.06 -2.09 -0.40 0.00 0.71 0.00 0.00 54.79 53.06 2ooy n ASP 250 Cb 0.35 -0.32 -0.05 0.00 -0.02 0.00 0.00 41.12 41.07 2ooy n ASP 250 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2ooy s LEU 251 N -1.08 4.57 0.58 0.64 1.43 -1.21 -4.79 118.68 118.81 2ooy s LEU 251 Ca 0.26 1.77 -0.18 0.00 -1.03 0.00 0.00 54.13 54.95 2ooy s LEU 251 Cb 0.15 -3.49 -0.07 0.00 0.03 0.00 0.00 46.19 42.81 2ooy s LEU 251 CO 0.16 0.08 0.75 -1.54 0.23 0.00 0.00 176.35 176.03 2ooy n SER 252 N 2.09 -0.09 -0.31 2.29 3.41 -1.26 -0.42 113.62 119.32 2ooy n SER 252 Ca -0.01 0.78 0.14 0.00 -0.26 0.00 0.00 58.87 59.51 2ooy n SER 252 Cb 0.48 -1.28 0.32 0.00 -0.26 0.00 0.00 64.21 63.47 2ooy n SER 252 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2ooy h VAL 253 N 0.39 0.50 0.00 -3.33 2.07 -0.69 -2.04 116.25 113.16 2ooy h VAL 253 Ca -0.47 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 66.90 2ooy h VAL 253 Cb 1.38 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 2ooy h VAL 253 CO 0.49 0.08 0.00 0.61 0.02 0.00 0.00 177.57 178.77 2ooy n GLY 254 N -1.33 -1.92 0.33 2.17 0.00 0.16 -1.12 105.19 103.48 2ooy n GLY 254 Ca 0.23 0.40 -0.15 0.00 0.00 0.00 0.00 46.02 46.49 2ooy n GLY 254 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2ooy h GLU 255 N 0.00 -0.65 -0.06 1.61 4.11 -1.66 0.10 114.58 118.03 2ooy h GLU 255 Ca 0.00 0.04 0.02 0.00 0.07 0.00 0.00 59.36 59.49 2ooy h GLU 255 Cb 0.00 0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 2ooy h GLU 255 CO 0.00 -0.44 0.40 0.00 0.07 0.00 0.00 179.01 179.05 2ooy h ALA 256 N -0.16 1.49 0.06 1.06 0.00 -1.16 0.66 119.26 121.22 2ooy h ALA 256 Ca -0.03 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.60 2ooy h ALA 256 Cb 0.59 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.40 2ooy h ALA 256 CO -0.00 -0.43 -1.14 -0.07 0.00 0.00 0.00 179.25 177.61 2ooy h LEU 257 N 0.00 0.82 0.00 0.00 4.07 0.79 -2.52 115.31 118.47 2ooy h LEU 257 Ca 0.03 -0.71 0.00 0.00 0.08 0.00 0.00 57.88 57.28 2ooy h LEU 257 Cb 0.83 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 42.32 2ooy h LEU 257 CO -0.00 1.52 0.00 0.18 -1.08 0.00 0.00 178.44 179.06 2ooy n LEU 258 N -3.79 0.00 -0.43 1.67 4.77 0.23 -0.40 117.00 119.05 2ooy n LEU 258 Ca -0.11 0.05 0.12 0.00 -0.03 0.00 0.00 56.01 56.04 2ooy n LEU 258 Cb 0.93 -0.05 0.16 0.00 -2.33 0.00 0.00 43.42 42.13 2ooy n LEU 258 CO 0.56 -0.04 0.47 0.29 -1.33 0.00 0.00 177.39 177.34 2ooy n LYS 259 N -1.05 1.14 -2.29 3.23 5.02 -0.95 -4.94 118.16 118.33 2ooy n LYS 259 Ca 0.06 -0.86 -0.43 0.00 -2.02 0.00 0.00 58.31 55.06 2ooy n LYS 259 Cb 0.03 -1.48 -0.02 0.00 -0.02 0.00 0.00 35.03 33.54 2ooy n LYS 259 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2ooy s ARG 260 N -2.45 3.97 0.73 1.97 3.52 0.46 -4.95 118.95 122.20 2ooy s ARG 260 Ca 0.22 1.55 -0.12 0.00 -0.13 0.00 0.00 55.73 57.25 2ooy s ARG 260 Cb 0.19 -3.91 0.04 0.00 -1.56 0.00 0.00 34.95 29.70 2ooy s ARG 260 CO 0.53 -1.06 1.10 -1.25 -0.81 0.00 0.00 175.30 173.82 2ooy s PRO 261 N 4.17 2.44 0.00 5.12 0.04 -1.26 -4.86 135.00 140.65 2ooy s PRO 261 Ca 0.62 1.29 0.12 0.00 0.04 0.00 0.00 61.00 63.07 2ooy s PRO 261 Cb -0.22 -1.91 0.69 0.00 0.04 0.00 0.00 34.50 33.10 2ooy s PRO 261 CO 0.24 -1.51 1.20 0.00 0.04 0.00 0.00 177.00 176.96 2ooy n ALA 262 N -3.06 1.88 1.34 8.56 0.00 -1.26 -3.24 120.51 124.72 2ooy n ALA 262 Ca 0.10 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.59 2ooy n ALA 262 Cb 0.52 -1.20 0.68 0.00 0.00 0.00 0.00 19.45 19.46 2ooy n ALA 262 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2ooy n ASN 263 N -1.09 0.00 -4.11 0.00 0.23 -1.26 -4.92 115.26 104.11 2ooy n ASN 263 Ca 0.08 -0.35 -0.51 0.00 -0.53 0.00 0.00 54.58 53.27 2ooy n ASN 263 Cb 0.06 -0.18 -0.06 0.00 -2.08 0.00 0.00 39.78 37.52 2ooy n ASN 263 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 2ooy n PHE 264 N -1.18 0.24 -0.66 -2.53 7.35 -1.20 -5.01 117.46 114.48 2ooy n PHE 264 Ca 0.15 0.95 -0.01 0.00 -0.76 0.00 0.00 57.45 57.78 2ooy n PHE 264 Cb 0.16 -1.88 0.00 0.00 0.35 0.00 0.00 39.48 38.11 2ooy n PHE 264 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 2ooy n ASP 265 N 1.53 -0.72 -3.21 -2.13 8.00 -1.26 -5.03 116.55 113.74 2ooy n ASP 265 Ca 0.18 -0.66 -0.18 0.00 0.71 0.00 0.00 54.79 54.84 2ooy n ASP 265 Cb 0.13 -0.02 0.12 0.00 -0.02 0.00 0.00 41.12 41.33 2ooy n ASP 265 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ooy n GLY 266 N 3.09 -1.21 3.59 0.44 0.00 -1.26 -5.03 105.19 104.80 2ooy n GLY 266 Ca 0.00 -1.72 -0.39 0.00 0.00 0.00 0.00 46.02 43.92 2ooy n GLY 266 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ooy s VAL 267 N -2.73 5.25 -0.32 1.61 1.01 -1.26 -4.87 120.40 119.09 2ooy s VAL 267 Ca 0.46 0.28 -0.09 0.00 0.00 0.00 0.00 61.98 62.63 2ooy s VAL 267 Cb -0.01 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.75 2ooy s VAL 267 CO 0.32 0.18 0.14 -1.00 0.00 0.00 0.00 175.10 174.74 2ooy s HIS 268 N 1.89 3.18 0.45 5.22 3.76 -1.26 -5.00 115.29 123.53 2ooy s HIS 268 Ca 0.10 -0.77 0.06 0.00 -0.15 0.00 0.00 55.06 54.30 2ooy s HIS 268 Cb -0.16 -2.34 0.01 0.00 1.11 0.00 0.00 32.58 31.20 2ooy s HIS 268 CO 0.11 -0.53 0.62 0.95 -0.85 0.00 0.00 174.74 175.04 2ooy s THR 269 N 1.57 3.03 0.08 1.30 -4.23 -1.26 0.87 115.64 116.99 2ooy s THR 269 Ca 0.03 -0.88 -0.27 0.00 -1.18 0.00 0.00 61.69 59.39 2ooy s THR 269 Cb -0.18 -3.05 0.09 0.00 1.34 0.00 0.00 72.50 70.70 2ooy s THR 269 CO 0.05 -0.02 1.11 0.00 -0.54 0.00 0.00 174.62 175.22 2ooy s ARG 271 N -2.83 3.33 0.60 0.00 1.81 -1.26 -0.18 118.95 120.42 2ooy s ARG 271 Ca 0.14 -0.28 0.22 0.00 -1.72 0.00 0.00 55.73 54.09 2ooy s ARG 271 Cb 0.01 -3.07 1.17 0.00 -0.45 0.00 0.00 34.95 32.62 2ooy s ARG 271 CO -0.00 0.72 1.64 0.00 -0.68 0.00 0.00 175.30 176.97 2ooy h ALA 272 N 4.48 1.42 -0.32 2.13 0.00 -1.92 0.56 119.26 125.61 2ooy h ALA 272 Ca -0.52 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2ooy h ALA 272 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2ooy h ALA 272 CO 0.62 -0.42 0.00 0.25 0.00 0.00 0.00 179.25 179.70 2ooy n THR 273 N -2.65 0.50 0.00 0.00 -2.24 -1.26 -2.16 114.28 106.47 2ooy n THR 273 Ca -0.01 -0.75 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 2ooy n THR 273 Cb 0.48 0.96 0.00 0.00 -2.10 0.00 0.00 70.33 69.67 2ooy n THR 273 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2ooy n ASP 274 N 1.21 0.00 -3.65 3.42 10.43 0.19 -4.55 116.55 123.60 2ooy n ASP 274 Ca 0.16 0.00 -0.02 0.00 2.57 0.00 0.00 54.79 57.50 2ooy n ASP 274 Cb 0.53 0.00 -0.07 0.00 1.84 0.00 0.00 41.12 43.42 2ooy n ASP 274 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2ooy s ARG 275 N 0.00 0.15 0.31 -1.24 1.70 -1.26 -2.83 118.95 115.77 2ooy s ARG 275 Ca 0.00 0.20 0.23 0.00 -0.47 0.00 0.00 55.73 55.69 2ooy s ARG 275 Cb 0.00 0.06 1.06 0.00 -0.57 0.00 0.00 34.95 35.50 2ooy s ARG 275 CO 0.00 -0.02 1.10 1.28 -1.08 0.00 0.00 175.30 176.58 2ooy n LEU 276 N 2.23 0.14 0.17 -1.89 4.32 -1.14 0.14 117.00 120.97 2ooy n LEU 276 Ca -0.13 0.96 0.17 0.00 -0.02 0.00 0.00 56.01 56.99 2ooy n LEU 276 Cb 0.57 -0.47 0.78 0.00 -1.62 0.00 0.00 43.42 42.67 2ooy n LEU 276 CO 0.03 -1.05 1.15 -2.24 -1.22 0.00 0.00 177.39 174.06 2ooy h ASP 277 N 0.00 0.00 0.00 -1.43 -0.00 -0.95 2.15 116.42 116.20 2ooy h ASP 277 Ca 0.62 0.00 -0.37 0.00 -0.00 0.00 0.00 57.03 57.28 2ooy h ASP 277 Cb 2.03 0.00 -0.07 0.00 -0.00 0.00 0.00 39.33 41.29 2ooy h ASP 277 CO -0.31 0.00 -2.41 0.61 -0.00 0.00 0.00 179.24 177.13 2ooy n GLY 278 N -1.47 -0.47 0.14 7.15 0.00 0.37 -3.40 105.19 107.52 2ooy n GLY 278 Ca 0.03 -0.20 -0.07 0.00 0.00 0.00 0.00 46.02 45.78 2ooy n GLY 278 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2ooy h ILE 279 N 0.00 0.88 0.00 -0.61 1.08 -1.45 0.19 117.51 117.60 2ooy h ILE 279 Ca -0.55 -0.07 0.00 0.00 -0.39 0.00 0.00 64.86 63.85 2ooy h ILE 279 Cb 1.94 0.66 0.00 0.00 -3.07 0.00 0.00 36.82 36.35 2ooy h ILE 279 CO -0.06 0.04 0.00 0.49 -0.69 0.00 0.00 178.15 177.92 2ooy n PHE 280 N -5.06 0.00 0.00 1.37 3.01 0.72 -1.64 117.46 115.86 2ooy n PHE 280 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2ooy n PHE 280 Cb 0.12 -0.36 0.00 0.00 -0.01 0.00 0.00 39.48 39.24 2ooy n PHE 280 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 2ooy n ASP 281 N -1.36 0.33 0.19 4.37 5.75 -0.20 -3.10 116.55 122.52 2ooy n ASP 281 Ca 0.03 -0.37 -0.13 0.00 -0.01 0.00 0.00 54.79 54.32 2ooy n ASP 281 Cb 0.08 0.81 -0.07 0.00 -1.03 0.00 0.00 41.12 40.91 2ooy n ASP 281 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2ooy h ALA 282 N 0.00 -1.01 -0.69 2.12 0.00 -0.43 -2.35 119.26 116.91 2ooy h ALA 282 Ca 0.00 -0.13 0.12 0.00 0.00 0.00 0.00 54.91 54.90 2ooy h ALA 282 Cb 0.00 0.63 -0.12 0.00 0.00 0.00 0.00 17.79 18.30 2ooy h ALA 282 CO 0.00 -1.04 -0.22 -0.89 0.00 0.00 0.00 179.25 177.09 2ooy n ILE 283 N -4.58 -0.33 0.23 0.00 5.41 -0.65 0.77 119.36 120.21 2ooy n ILE 283 Ca -0.08 1.59 0.18 0.00 1.00 0.00 0.00 62.75 65.44 2ooy n ILE 283 Cb 0.32 -2.14 0.86 0.00 -0.71 0.00 0.00 39.64 37.97 2ooy n ILE 283 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 2ooy h LYS 284 N 0.00 0.00 0.00 0.38 3.64 -1.36 -3.36 116.57 115.87 2ooy h LYS 284 Ca 0.28 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 2ooy h LYS 284 Cb 0.45 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 2ooy h LYS 284 CO -0.69 0.00 -0.25 0.72 -2.27 0.00 0.00 179.45 176.95 2ooy n HIS 285 N -3.62 0.00 -1.10 1.91 8.25 0.23 -5.04 115.22 115.85 2ooy n HIS 285 Ca 0.01 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.45 2ooy n HIS 285 Cb 0.32 -0.13 0.02 0.00 1.12 0.00 0.00 29.99 31.32 2ooy n HIS 285 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2ooy n SER 286 N -3.28 0.01 -4.04 0.41 7.64 -0.62 -5.02 113.62 108.72 2ooy n SER 286 Ca -0.04 -1.04 -0.34 0.00 1.01 0.00 0.00 58.87 58.46 2ooy n SER 286 Cb 0.13 -0.08 -0.11 0.00 -1.01 0.00 0.00 64.21 63.14 2ooy n SER 286 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2ooy s ARG 287 N -3.22 2.39 -0.12 1.43 0.52 -1.26 -4.68 118.95 114.01 2ooy s ARG 287 Ca 0.06 -2.61 -0.23 0.00 -0.52 0.00 0.00 55.73 52.43 2ooy s ARG 287 Cb -0.00 -3.59 -0.03 0.00 0.52 0.00 0.00 34.95 31.85 2ooy s ARG 287 CO 0.04 -1.16 0.68 0.08 0.02 0.00 0.00 175.30 174.97 2ooy s VAL 288 N -0.23 5.03 -1.45 3.52 1.01 -1.26 -4.46 120.40 122.56 2ooy s VAL 288 Ca 0.18 1.36 0.21 0.00 0.00 0.00 0.00 61.98 63.73 2ooy s VAL 288 Cb -0.22 -4.01 -0.12 0.00 0.00 0.00 0.00 36.38 32.04 2ooy s VAL 288 CO -0.03 0.19 0.96 1.41 0.00 0.00 0.00 175.10 177.63 2ooy n HIS 289 N 4.32 0.00 -3.56 5.22 -0.00 -1.26 -4.97 115.22 114.97 2ooy n HIS 289 Ca -0.01 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.62 2ooy n HIS 289 Cb 0.51 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.48 2ooy n HIS 289 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.34 176.84 2ooy s ARG 290 N -2.66 1.23 -0.11 -0.41 3.52 -1.26 -4.48 118.95 114.79 2ooy s ARG 290 Ca 0.13 -0.54 -0.01 0.00 -0.13 0.00 0.00 55.73 55.17 2ooy s ARG 290 Cb 0.16 0.51 0.03 0.00 -1.56 0.00 0.00 34.95 34.10 2ooy s ARG 290 CO 0.69 -0.55 -0.01 -0.51 -0.81 0.00 0.00 175.30 174.11 2ooy s LEU 291 N -2.73 0.90 -0.71 -0.88 1.43 0.23 -4.34 118.68 112.58 2ooy s LEU 291 Ca 0.05 -0.30 -0.21 0.00 -1.03 0.00 0.00 54.13 52.64 2ooy s LEU 291 Cb -0.02 -0.59 0.09 0.00 0.03 0.00 0.00 46.19 45.70 2ooy s LEU 291 CO -0.07 -0.20 0.95 -0.36 0.23 0.00 0.00 176.35 176.91 2ooy s PHE 292 N 1.87 2.84 0.00 0.29 0.40 0.25 -0.82 117.98 122.81 2ooy s PHE 292 Ca 0.04 -0.83 -0.30 0.00 -0.60 0.00 0.00 56.93 55.24 2ooy s PHE 292 Cb -0.13 -4.24 -0.09 0.00 0.51 0.00 0.00 43.02 39.07 2ooy s PHE 292 CO -0.07 -1.54 2.01 0.28 0.70 0.00 0.00 175.22 176.60 2ooy n VAL 293 N 5.74 0.71 -4.45 -0.44 0.31 -1.06 -2.90 118.33 116.25 2ooy n VAL 293 Ca 0.02 -0.18 -0.23 0.00 -0.01 0.00 0.00 64.34 63.93 2ooy n VAL 293 Cb 0.46 -2.34 -0.09 0.00 -0.91 0.00 0.00 33.84 30.97 2ooy n VAL 293 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2ooy s VAL 294 N 4.95 0.56 0.19 2.52 -7.23 0.75 -0.80 120.40 121.34 2ooy s VAL 294 Ca 0.91 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 59.09 2ooy s VAL 294 Cb -0.43 -2.44 0.01 0.00 0.56 0.00 0.00 36.38 34.08 2ooy s VAL 294 CO 0.42 0.00 0.10 -0.90 -0.31 0.00 0.00 175.10 174.40 2ooy n ASP 295 N -1.18 1.90 -0.37 4.85 5.75 -0.96 -3.75 116.55 122.78 2ooy n ASP 295 Ca -0.03 -1.70 0.32 0.00 -0.01 0.00 0.00 54.79 53.37 2ooy n ASP 295 Cb 0.65 0.03 0.65 0.00 -1.03 0.00 0.00 41.12 41.42 2ooy n ASP 295 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 2ooy h GLU 296 N 0.00 0.15 -0.44 0.11 -0.00 -1.98 -2.27 114.58 110.15 2ooy h GLU 296 Ca -0.13 -0.01 -0.08 0.00 -0.00 0.00 0.00 59.36 59.14 2ooy h GLU 296 Cb 0.45 -0.03 -0.05 0.00 -0.00 0.00 0.00 28.75 29.12 2ooy h GLU 296 CO 0.21 0.10 0.06 0.09 -0.00 0.00 0.00 179.01 179.47 2ooy n ASN 297 N -4.42 4.24 -3.88 3.06 4.13 -1.26 -4.93 115.26 112.20 2ooy n ASN 297 Ca 0.29 -3.16 -0.27 0.00 1.68 0.00 0.00 54.58 53.12 2ooy n ASN 297 Cb 1.21 -0.63 -0.00 0.00 -1.54 0.00 0.00 39.78 38.81 2ooy n ASN 297 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2ooy n LEU 298 N -0.33 -2.34 -4.29 3.41 4.77 -0.85 -4.86 117.00 112.51 2ooy n LEU 298 Ca 0.29 -1.01 -0.34 0.00 -0.03 0.00 0.00 56.01 54.92 2ooy n LEU 298 Cb 1.09 -2.26 -0.14 0.00 -2.33 0.00 0.00 43.42 39.77 2ooy n LEU 298 CO 0.26 0.45 -0.42 -0.54 -1.33 0.00 0.00 177.39 175.81 2ooy s LYS 299 N -6.43 3.31 0.33 3.23 3.01 -1.26 -1.03 119.74 120.90 2ooy s LYS 299 Ca 0.12 -0.67 -0.29 0.00 -1.01 0.00 0.00 55.97 54.12 2ooy s LYS 299 Cb -0.05 -2.85 -0.11 0.00 -1.01 0.00 0.00 37.83 33.82 2ooy s LYS 299 CO 0.88 -0.11 1.50 -1.17 0.51 0.00 0.00 175.35 176.97 2ooy s LEU 300 N 1.19 4.34 0.00 3.17 2.96 -1.25 -2.27 118.68 126.82 2ooy s LEU 300 Ca 0.02 2.94 0.00 0.00 -0.22 0.00 0.00 54.13 56.87 2ooy s LEU 300 Cb -0.14 -3.65 0.00 0.00 0.50 0.00 0.00 46.19 42.90 2ooy s LEU 300 CO -0.03 -0.84 0.00 -0.62 -1.32 0.00 0.00 176.35 173.54 2ooy n GLU 301 N 1.29 2.58 -1.05 1.98 1.02 0.02 -4.95 120.64 121.52 2ooy n GLU 301 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 2ooy n GLU 301 Cb 0.39 -0.87 0.00 0.00 -0.02 0.00 0.00 31.44 30.93 2ooy n GLU 301 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ooy n GLY 302 N 2.23 0.80 3.00 0.62 0.00 -1.09 -4.52 105.19 106.23 2ooy n GLY 302 Ca 0.00 -0.74 -0.04 0.00 0.00 0.00 0.00 46.02 45.24 2ooy n GLY 302 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ooy s ILE 303 N -2.15 -0.76 -0.06 -0.61 1.01 0.18 -2.57 121.20 116.25 2ooy s ILE 303 Ca 0.00 -0.14 -0.15 0.00 0.00 0.00 0.00 60.65 60.36 2ooy s ILE 303 Cb 0.00 -0.95 -0.05 0.00 0.01 0.00 0.00 42.46 41.47 2ooy s ILE 303 CO 0.00 -0.14 0.40 -0.22 0.00 0.00 0.00 174.94 174.98 2ooy s LEU 304 N 2.65 4.38 0.20 2.97 2.96 0.00 -2.69 118.68 129.16 2ooy s LEU 304 Ca 0.12 0.83 0.10 0.00 -0.22 0.00 0.00 54.13 54.96 2ooy s LEU 304 Cb -0.13 -2.56 -0.05 0.00 0.50 0.00 0.00 46.19 43.95 2ooy s LEU 304 CO -0.25 0.20 -0.19 -0.94 -1.32 0.00 0.00 176.35 173.86 2ooy s SER 305 N -0.36 2.99 0.43 3.68 1.04 -1.26 -0.60 113.70 119.61 2ooy s SER 305 Ca 0.23 -0.94 0.11 0.00 0.48 0.00 0.00 55.95 55.83 2ooy s SER 305 Cb -0.15 -0.20 0.97 0.00 0.10 0.00 0.00 66.02 66.74 2ooy s SER 305 CO 0.11 -0.02 2.02 -0.07 0.98 0.00 0.00 173.24 176.25 2ooy h LEU 306 N 2.86 0.39 0.29 2.42 4.07 -1.95 0.48 115.31 123.88 2ooy h LEU 306 Ca -0.41 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.53 2ooy h LEU 306 Cb 1.22 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.88 2ooy h LEU 306 CO 0.55 0.26 -0.14 0.00 -1.08 0.00 0.00 178.44 178.03 2ooy h ALA 307 N 1.73 -0.39 -0.17 1.53 0.00 -1.96 -0.17 119.26 119.83 2ooy h ALA 307 Ca 0.22 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2ooy h ALA 307 Cb 0.29 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2ooy h ALA 307 CO -0.06 -0.40 0.00 -0.25 0.00 0.00 0.00 179.25 178.54 2ooy n ASP 308 N -5.04 0.00 0.00 0.00 8.00 0.28 0.22 116.55 120.02 2ooy n ASP 308 Ca -0.07 0.37 0.00 0.00 0.71 0.00 0.00 54.79 55.80 2ooy n ASP 308 Cb 0.23 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.16 2ooy n ASP 308 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2ooy n ILE 309 N -2.16 0.00 -0.16 0.53 2.08 0.14 -0.06 119.36 119.73 2ooy n ILE 309 Ca 0.00 1.27 -0.04 0.00 0.56 0.00 0.00 62.75 64.55 2ooy n ILE 309 Cb 0.00 -1.81 0.03 0.00 -0.75 0.00 0.00 39.64 37.11 2ooy n ILE 309 CO 0.00 0.00 0.00 0.25 0.56 0.00 0.00 176.55 177.36 2ooy h LEU 310 N 0.00 -0.68 -0.82 1.39 6.46 0.57 0.85 115.31 123.09 2ooy h LEU 310 Ca 0.00 0.17 0.07 0.00 -0.12 0.00 0.00 57.88 58.01 2ooy h LEU 310 Cb 0.00 0.39 -0.07 0.00 -0.73 0.00 0.00 40.66 40.25 2ooy h LEU 310 CO 0.00 -0.22 0.49 0.78 -0.62 0.00 0.00 178.44 178.86 2ooy h ASN 311 N -0.08 0.74 -0.10 1.25 4.21 -0.12 -0.59 115.58 120.90 2ooy h ASN 311 Ca 0.24 0.03 -0.04 0.00 1.21 0.00 0.00 56.30 57.74 2ooy h ASN 311 Cb 0.45 -0.12 -0.00 0.00 -1.12 0.00 0.00 38.32 37.53 2ooy h ASN 311 CO -0.56 0.45 -0.10 0.22 -1.29 0.00 0.00 177.43 176.15 2ooy h TYR 312 N 0.86 0.29 0.00 1.19 5.03 0.35 -0.69 116.97 124.00 2ooy h TYR 312 Ca 0.37 -0.09 0.00 0.00 2.58 0.00 0.00 58.73 61.60 2ooy h TYR 312 Cb 0.25 -0.06 0.00 0.00 1.55 0.00 0.00 36.73 38.47 2ooy h TYR 312 CO -0.05 0.66 0.15 -0.89 -1.32 0.00 0.00 178.16 176.71 2ooy n ILE 313 N -4.65 1.29 -1.56 1.81 2.08 0.25 -3.57 119.36 115.00 2ooy n ILE 313 Ca -0.07 0.47 0.06 0.00 0.56 0.00 0.00 62.75 63.77 2ooy n ILE 313 Cb 0.32 -1.47 0.09 0.00 -0.75 0.00 0.00 39.64 37.84 2ooy n ILE 313 CO 0.00 0.00 0.00 -0.38 0.56 0.00 0.00 176.55 176.73 2ooy n ILE 314 N -1.31 1.16 -3.71 1.39 -0.00 -0.28 -4.55 119.36 112.06 2ooy n ILE 314 Ca 0.00 -1.56 -0.12 0.00 -0.00 0.00 0.00 62.75 61.08 2ooy n ILE 314 Cb 0.15 0.11 -0.10 0.00 -0.00 0.00 0.00 39.64 39.80 2ooy n ILE 314 CO 0.00 0.00 0.00 -0.31 -0.00 0.00 0.00 176.55 176.24 2ooy s TYR 315 N -1.75 -0.57 -0.10 1.39 4.12 -1.15 -4.96 117.35 114.33 2ooy s TYR 315 Ca 0.23 1.29 -0.12 0.00 0.02 0.00 0.00 57.07 58.49 2ooy s TYR 315 Cb 0.21 0.23 -0.04 0.00 -1.52 0.00 0.00 41.96 40.84 2ooy s TYR 315 CO -0.01 -0.29 -0.22 -0.40 0.02 0.00 0.00 175.55 174.64 2ooy n ASP 316 N 3.46 1.36 -0.03 2.29 5.68 -1.26 -4.90 116.55 123.15 2ooy n ASP 316 Ca -0.18 0.23 -0.02 0.00 -0.50 0.00 0.00 54.79 54.33 2ooy n ASP 316 Cb 0.56 -0.62 -0.01 0.00 -1.14 0.00 0.00 41.12 39.92 2ooy n ASP 316 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 2ooy h LYS 317 N -0.64 0.00 -7.32 0.11 1.63 -2.01 -3.50 116.57 104.84 2ooy h LYS 317 Ca 0.00 0.00 -0.51 0.00 -0.85 0.00 0.00 60.65 59.29 2ooy h LYS 317 Cb 0.64 0.00 0.08 0.00 -0.60 0.00 0.00 32.23 32.35 2ooy h LYS 317 CO 0.00 0.00 0.39 0.95 -3.45 0.00 0.00 179.45 177.34 2ooy s THR 318 N -1.51 4.25 0.25 1.00 -4.23 -1.26 -5.12 115.64 109.03 2ooy s THR 318 Ca -0.05 0.79 0.07 0.00 -1.18 0.00 0.00 61.69 61.32 2ooy s THR 318 Cb 0.01 -3.57 -0.04 0.00 1.34 0.00 0.00 72.50 70.24 2ooy s THR 318 CO 0.08 -0.90 0.18 0.42 -0.54 0.00 0.00 174.62 173.86 2ooy s THR 319 N -2.99 4.35 -0.93 3.99 -4.23 -1.26 -4.80 115.64 109.77 2ooy s THR 319 Ca 0.58 -1.45 -0.04 0.00 -1.18 0.00 0.00 61.69 59.60 2ooy s THR 319 Cb -0.13 -3.35 0.23 0.00 1.34 0.00 0.00 72.50 70.59 2ooy s THR 319 CO 0.51 -0.35 0.84 -0.89 -0.54 0.00 0.00 174.62 174.19 2ooy s THR 320 N -2.15 4.76 -0.14 3.99 2.01 -1.26 -5.02 115.64 117.83 2ooy s THR 320 Ca 0.33 -3.66 -0.29 0.00 0.31 0.00 0.00 61.69 58.38 2ooy s THR 320 Cb -0.08 -3.93 -0.34 0.00 0.01 0.00 0.00 72.50 68.16 2ooy s THR 320 CO 0.24 -1.10 1.65 -2.65 -0.69 0.00 0.00 174.62 172.08 2ooy n PRO 321 N 2.55 0.28 -1.94 4.92 -0.02 -1.26 -4.09 135.00 135.44 2ooy n PRO 321 Ca 0.21 -1.16 -0.36 0.00 -2.02 0.00 0.00 63.50 60.17 2ooy n PRO 321 Cb 0.38 -2.58 0.04 0.00 -0.02 0.00 0.00 33.50 31.32 2ooy n PRO 321 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ooy n GLY 322 N 4.91 5.72 2.72 -1.23 0.00 -1.26 -4.96 105.19 111.09 2ooy n GLY 322 Ca 0.47 -2.52 -0.19 0.00 0.00 0.00 0.00 46.02 43.78 2ooy n GLY 322 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ooy s VAL 323 N -5.11 -0.31 0.00 1.61 1.01 -1.26 -4.37 120.40 111.98 2ooy s VAL 323 Ca 0.53 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.20 2ooy s VAL 323 Cb 0.44 -0.81 0.00 0.00 0.00 0.00 0.00 36.38 36.01 2ooy s VAL 323 CO -0.29 -0.36 0.00 -0.81 0.00 0.00 0.00 175.10 173.65 2ooy n PRO 324 N 5.31 1.01 -0.06 2.72 -0.05 -1.26 -5.10 135.00 137.58 2ooy n PRO 324 Ca -0.05 0.00 -0.08 0.00 -0.05 0.00 0.00 63.50 63.33 2ooy n PRO 324 Cb 0.48 0.00 -0.05 0.00 -0.05 0.00 0.00 33.50 33.87 2ooy n PRO 324 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 175.50 174.60 2ooy n GLU 325 N -0.22 0.36 -3.85 0.54 0.28 -1.26 -5.07 120.64 111.43 2ooy n GLU 325 Ca 0.00 0.06 -0.07 0.00 -0.16 0.00 0.00 57.16 56.99 2ooy n GLU 325 Cb 0.00 -1.22 -0.01 0.00 1.43 0.00 0.00 31.44 31.63 2ooy n GLU 325 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 2ooy s GLN 326 N -2.22 1.81 0.86 3.44 1.11 -1.26 -5.18 119.66 118.22 2ooy s GLN 326 Ca -0.15 -1.03 -0.11 0.00 0.01 0.00 0.00 55.36 54.08 2ooy s GLN 326 Cb 0.04 0.60 0.11 0.00 -1.01 0.00 0.00 33.01 32.74 2ooy s GLN 326 CO 0.26 -0.83 1.09 -0.08 0.01 0.00 0.00 175.29 175.74 2ooy s THR 327 N -3.64 2.87 -1.00 -0.19 -1.32 -1.26 -4.40 115.64 106.69 2ooy s THR 327 Ca 0.12 0.28 -0.10 0.00 -1.21 0.00 0.00 61.69 60.78 2ooy s THR 327 Cb -0.06 -2.78 0.10 0.00 -1.51 0.00 0.00 72.50 68.25 2ooy s THR 327 CO 0.07 -0.37 0.24 -0.67 -2.21 0.00 0.00 174.62 171.69 2ooy n ASP 328 N -3.76 -0.59 -0.42 8.08 2.03 -1.26 -4.83 116.55 115.79 2ooy n ASP 328 Ca 0.08 -0.70 0.00 0.00 0.52 0.00 0.00 54.79 54.68 2ooy n ASP 328 Cb 0.55 -0.89 0.00 0.00 -0.72 0.00 0.00 41.12 40.05 2ooy n ASP 328 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2ooy n ASN 329 N -1.15 0.00 0.00 1.67 4.13 -1.26 -4.74 115.26 113.91 2ooy n ASN 329 Ca -0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 2ooy n ASN 329 Cb 0.29 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.53 2ooy n ASN 329 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2ooy n PHE 330 N 0.00 0.00 -3.78 3.10 3.01 -1.26 -2.22 117.46 116.31 2ooy n PHE 330 Ca 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.33 2ooy n PHE 330 Cb 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 39.48 39.34 2ooy n PHE 330 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 2ooy s GLU 331 N 3.81 0.14 0.00 -1.08 2.12 -1.26 0.78 118.70 123.21 2ooy s GLU 331 Ca 0.00 0.31 0.00 0.00 0.36 0.00 0.00 54.97 55.64 2ooy s GLU 331 Cb 0.00 -0.05 0.00 0.00 0.26 0.00 0.00 34.13 34.34 2ooy s GLU 331 CO 0.00 -0.10 0.73 0.43 -0.54 0.00 0.00 175.26 175.78 2ooy n SER 332 N 3.65 0.00 0.00 -1.70 7.64 -1.26 -4.84 113.62 117.11 2ooy n SER 332 Ca -0.20 0.73 0.00 0.00 1.01 0.00 0.00 58.87 60.41 2ooy n SER 332 Cb 0.55 -0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.52 2ooy n SER 332 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ooy n ALA 333 N -1.35 0.00 -0.61 -0.43 0.00 -1.26 -4.87 120.51 111.99 2ooy n ALA 333 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ooy n ALA 333 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2ooy n ALA 333 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78