#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d3f n THR 3 N 0.00 0.00 -3.89 0.52 -2.24 -1.26 -5.00 114.28 102.41 3d3f n THR 3 Ca 0.00 -0.49 -0.09 0.00 -2.27 0.00 0.00 64.05 61.20 3d3f n THR 3 Cb 0.00 1.00 -0.01 0.00 -2.10 0.00 0.00 70.33 69.22 3d3f n THR 3 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3d3f s SER 4 N -0.83 -0.03 0.53 3.42 1.04 -1.26 -4.93 113.70 111.64 3d3f s SER 4 Ca 0.00 -0.92 0.23 0.00 0.48 0.00 0.00 55.95 55.74 3d3f s SER 4 Cb 0.00 0.73 1.47 0.00 0.10 0.00 0.00 66.02 68.33 3d3f s SER 4 CO 0.00 -1.41 2.15 -0.07 0.98 0.00 0.00 173.24 174.89 3d3f h LEU 5 N 2.06 0.00 -0.55 2.42 3.38 -1.90 -2.84 115.31 117.88 3d3f h LEU 5 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 3d3f h LEU 5 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 3d3f h LEU 5 CO 0.32 0.06 0.00 0.11 0.09 0.00 0.00 178.44 179.02 3d3f h LYS 6 N 0.00 0.00 -7.14 1.13 1.57 -1.96 -3.44 116.57 106.72 3d3f h LYS 6 Ca -0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 3d3f h LYS 6 Cb 0.12 0.00 0.13 0.00 0.08 0.00 0.00 32.23 32.57 3d3f h LYS 6 CO 0.01 0.00 0.43 -0.51 -0.57 0.00 0.00 179.45 178.81 3d3f s ASP 7 N -5.51 4.71 0.09 0.86 1.11 -1.07 -4.86 116.67 112.00 3d3f s ASP 7 Ca 0.05 2.36 0.02 0.00 0.18 0.00 0.00 52.55 55.17 3d3f s ASP 7 Cb 0.08 -2.59 -0.04 0.00 1.07 0.00 0.00 42.92 41.44 3d3f s ASP 7 CO 0.58 -1.92 -0.07 0.42 1.18 0.00 0.00 175.17 175.36 3d3f s THR 8 N -1.81 0.72 -0.06 -1.27 -4.23 -1.26 -2.41 115.64 105.31 3d3f s THR 8 Ca 0.76 -1.80 0.02 0.00 -1.18 0.00 0.00 61.69 59.49 3d3f s THR 8 Cb -0.30 -1.51 -0.03 0.00 1.34 0.00 0.00 72.50 72.00 3d3f s THR 8 CO 0.40 -0.77 -0.09 0.54 -0.54 0.00 0.00 174.62 174.16 3d3f s VAL 9 N -3.19 3.54 -0.32 2.29 0.11 0.97 -4.76 120.40 119.03 3d3f s VAL 9 Ca 0.08 -0.54 -0.25 0.00 -2.93 0.00 0.00 61.98 58.34 3d3f s VAL 9 Cb 0.02 -2.43 0.01 0.00 -1.53 0.00 0.00 36.38 32.45 3d3f s VAL 9 CO -0.03 0.60 0.90 -0.75 -3.33 0.00 0.00 175.10 172.48 3d3f s LYS 10 N -0.79 3.96 0.89 1.54 2.20 -1.26 -0.55 119.74 125.73 3d3f s LYS 10 Ca 0.12 0.72 -0.11 0.00 -0.36 0.00 0.00 55.97 56.33 3d3f s LYS 10 Cb -0.11 -3.75 0.12 0.00 -1.51 0.00 0.00 37.83 32.59 3d3f s LYS 10 CO 0.01 -0.80 1.09 -0.51 -0.36 0.00 0.00 175.35 174.79 3d3f s LEU 11 N 3.25 2.32 0.58 5.43 1.43 0.84 -4.90 118.68 127.63 3d3f s LEU 11 Ca 0.37 1.53 0.38 0.00 -1.03 0.00 0.00 54.13 55.38 3d3f s LEU 11 Cb -0.13 -3.97 1.87 0.00 0.03 0.00 0.00 46.19 43.99 3d3f s LEU 11 CO 0.14 -2.62 2.14 1.12 0.23 0.00 0.00 176.35 177.37 3d3f h HIS 12 N -1.53 0.00 -0.40 0.29 2.07 -1.85 0.12 115.15 113.84 3d3f h HIS 12 Ca -0.49 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.03 3d3f h HIS 12 Cb 1.28 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.26 3d3f h HIS 12 CO 0.44 0.00 0.00 0.27 -3.07 0.00 0.00 177.93 175.57 3d3f n ASN 13 N -2.97 2.52 0.00 3.10 6.94 -1.26 -4.93 115.26 118.66 3d3f n ASN 13 Ca -0.01 -2.10 0.00 0.00 -0.02 0.00 0.00 54.58 52.44 3d3f n ASN 13 Cb 0.16 -0.34 0.00 0.00 -2.36 0.00 0.00 39.78 37.24 3d3f n ASN 13 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3d3f n GLY 14 N 1.01 1.73 3.77 4.83 0.00 0.40 -5.02 105.19 111.92 3d3f n GLY 14 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3d3f n GLY 14 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d3f s VAL 15 N -3.54 2.11 -0.32 1.61 1.01 -1.26 -4.71 120.40 115.31 3d3f s VAL 15 Ca 0.00 0.11 -0.06 0.00 0.00 0.00 0.00 61.98 62.03 3d3f s VAL 15 Cb 0.00 -3.07 0.03 0.00 0.00 0.00 0.00 36.38 33.35 3d3f s VAL 15 CO 0.00 0.02 0.07 -1.61 0.00 0.00 0.00 175.10 173.59 3d3f s GLU 16 N -2.18 2.74 -0.21 2.72 2.02 -1.26 -0.11 118.70 122.42 3d3f s GLU 16 Ca 0.55 -1.09 -0.06 0.00 0.02 0.00 0.00 54.97 54.39 3d3f s GLU 16 Cb -0.45 -3.37 -0.03 0.00 0.10 0.00 0.00 34.13 30.38 3d3f s GLU 16 CO 0.60 -0.58 0.02 1.41 0.02 0.00 0.00 175.26 176.73 3d3f s MET 17 N 1.40 3.65 0.15 1.61 -2.45 0.28 -4.86 119.30 119.08 3d3f s MET 17 Ca -0.01 -0.50 -0.34 0.00 -1.25 0.00 0.00 55.69 53.59 3d3f s MET 17 Cb -0.19 -3.13 -0.14 0.00 1.25 0.00 0.00 34.83 32.63 3d3f s MET 17 CO 0.02 0.01 1.57 -2.30 1.05 0.00 0.00 175.02 175.37 3d3f n PRO 18 N 4.28 2.08 -0.18 4.11 -0.02 -1.26 -0.02 135.00 143.99 3d3f n PRO 18 Ca -0.17 0.75 0.29 0.00 -2.02 0.00 0.00 63.50 62.36 3d3f n PRO 18 Cb 0.52 -2.51 0.64 0.00 -0.02 0.00 0.00 33.50 32.13 3d3f n PRO 18 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 3d3f h TRP 19 N 5.94 0.00 -3.63 6.00 4.06 -1.77 -3.43 115.95 123.11 3d3f h TRP 19 Ca -0.45 0.00 -0.55 0.00 2.06 0.00 0.00 58.89 59.94 3d3f h TRP 19 Cb 1.26 0.00 -0.32 0.00 -1.00 0.00 0.00 29.16 29.10 3d3f h TRP 19 CO 0.63 0.00 -0.83 0.12 -3.56 0.00 0.00 178.44 174.80 3d3f s PHE 20 N -4.64 1.69 0.20 0.49 5.36 -1.26 -0.60 117.98 119.22 3d3f s PHE 20 Ca -0.04 -0.57 -0.02 0.00 -0.96 0.00 0.00 56.93 55.34 3d3f s PHE 20 Cb 0.17 -1.17 -0.04 0.00 -0.34 0.00 0.00 43.02 41.64 3d3f s PHE 20 CO 0.60 -0.24 0.15 0.20 -1.46 0.00 0.00 175.22 174.48 3d3f s GLY 21 N 0.33 1.31 -0.28 13.12 0.00 0.50 -4.00 107.32 118.30 3d3f s GLY 21 Ca -0.10 -1.60 -0.19 0.00 0.00 0.00 0.00 44.72 42.83 3d3f s GLY 21 CO 0.04 -1.33 0.56 -2.27 0.00 0.00 0.00 173.10 170.10 3d3f s LEU 22 N -3.14 4.11 0.10 0.66 2.96 0.50 -3.07 118.68 120.81 3d3f s LEU 22 Ca 0.36 0.45 -0.16 0.00 -0.22 0.00 0.00 54.13 54.56 3d3f s LEU 22 Cb 0.06 -2.71 -0.07 0.00 0.50 0.00 0.00 46.19 43.97 3d3f s LEU 22 CO 0.11 -0.37 0.53 -0.83 -1.32 0.00 0.00 176.35 174.46 3d3f s GLY 23 N 1.59 2.53 -0.05 7.98 0.00 -0.82 -0.30 107.32 118.25 3d3f s GLY 23 Ca 0.22 -0.10 0.08 0.00 0.00 0.00 0.00 44.72 44.92 3d3f s GLY 23 CO 0.10 0.23 1.00 1.55 0.00 0.00 0.00 173.10 175.98 3d3f n VAL 24 N 1.25 1.03 -1.66 1.40 3.14 -0.96 -4.22 118.33 118.31 3d3f n VAL 24 Ca -0.08 -1.19 -0.46 0.00 -2.96 0.00 0.00 64.34 59.64 3d3f n VAL 24 Cb 0.52 0.26 -0.04 0.00 -1.06 0.00 0.00 33.84 33.52 3d3f n VAL 24 CO 0.00 0.00 0.00 0.33 -6.46 0.00 0.00 176.83 170.70 3d3f n PHE 25 N -0.72 2.12 -1.58 1.45 -0.00 -1.26 -2.61 117.46 114.86 3d3f n PHE 25 Ca 0.07 0.37 -0.16 0.00 -0.00 0.00 0.00 57.45 57.73 3d3f n PHE 25 Cb 0.53 -2.49 -0.06 0.00 -0.00 0.00 0.00 39.48 37.47 3d3f n PHE 25 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 3d3f n LYS 26 N 2.91 -1.11 -4.03 -4.13 5.02 -1.26 -5.01 118.16 110.55 3d3f n LYS 26 Ca 0.16 1.00 -0.36 0.00 -2.02 0.00 0.00 58.31 57.09 3d3f n LYS 26 Cb 0.28 -5.19 -0.08 0.00 -0.02 0.00 0.00 35.03 30.02 3d3f n LYS 26 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3d3f s VAL 27 N -2.61 5.03 0.23 -0.18 1.01 -1.07 -5.09 120.40 117.72 3d3f s VAL 27 Ca 0.00 0.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.72 3d3f s VAL 27 Cb 0.00 -3.19 -0.09 0.00 0.00 0.00 0.00 36.38 33.10 3d3f s VAL 27 CO 0.00 0.57 1.07 -1.61 0.00 0.00 0.00 175.10 175.13 3d3f s GLU 28 N -0.60 4.66 0.81 2.72 2.02 -1.26 -4.62 118.70 122.43 3d3f s GLU 28 Ca 0.12 1.71 -0.14 0.00 0.02 0.00 0.00 54.97 56.68 3d3f s GLU 28 Cb -0.12 -3.24 0.03 0.00 0.10 0.00 0.00 34.13 30.90 3d3f s GLU 28 CO 0.02 0.22 0.82 -1.71 0.02 0.00 0.00 175.26 174.63 3d3f n ASN 29 N 1.69 -0.32 0.00 -0.19 5.15 -1.26 -1.55 115.26 118.78 3d3f n ASN 29 Ca 0.00 0.54 0.00 0.00 -0.60 0.00 0.00 54.58 54.52 3d3f n ASN 29 Cb 0.46 -1.35 0.00 0.00 -0.53 0.00 0.00 39.78 38.35 3d3f n ASN 29 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3d3f n GLY 30 N 1.11 2.36 0.33 8.20 0.00 -1.26 -4.34 105.19 111.59 3d3f n GLY 30 Ca 0.11 -0.50 0.01 0.00 0.00 0.00 0.00 46.02 45.64 3d3f n GLY 30 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3d3f n ASN 31 N 1.65 -0.50 -0.08 1.61 4.13 -1.26 0.52 115.26 121.33 3d3f n ASN 31 Ca 0.00 1.52 -0.07 0.00 1.68 0.00 0.00 54.58 57.71 3d3f n ASN 31 Cb 0.00 -0.38 -0.01 0.00 -1.54 0.00 0.00 39.78 37.86 3d3f n ASN 31 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 3d3f h GLU 32 N 0.00 0.00 0.28 3.52 4.81 -1.76 0.16 114.58 121.59 3d3f h GLU 32 Ca 0.33 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.55 3d3f h GLU 32 Cb 0.55 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.93 3d3f h GLU 32 CO -0.88 0.00 -0.14 0.00 -0.73 0.00 0.00 179.01 177.27 3d3f h ALA 33 N 1.30 -0.85 -0.59 2.92 0.00 0.11 -0.65 119.26 121.50 3d3f h ALA 33 Ca 0.15 -0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.08 3d3f h ALA 33 Cb 0.22 0.15 -0.11 0.00 0.00 0.00 0.00 17.79 18.05 3d3f h ALA 33 CO -0.31 -0.82 -0.18 2.41 0.00 0.00 0.00 179.25 180.34 3d3f n THR 34 N -3.27 -0.27 -0.08 0.00 -1.04 -0.61 -0.98 114.28 108.03 3d3f n THR 34 Ca -0.05 1.37 -0.14 0.00 -2.04 0.00 0.00 64.05 63.19 3d3f n THR 34 Cb 0.15 -1.86 -0.05 0.00 -1.82 0.00 0.00 70.33 66.75 3d3f n THR 34 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 3d3f h GLU 35 N 0.00 0.66 -0.06 -2.82 4.39 -0.68 -2.79 114.58 113.27 3d3f h GLU 35 Ca 0.25 -0.37 0.03 0.00 0.34 0.00 0.00 59.36 59.61 3d3f h GLU 35 Cb 0.40 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.04 3d3f h GLU 35 CO -0.60 0.98 -0.12 0.77 -1.16 0.00 0.00 179.01 178.89 3d3f h SER 36 N 0.37 -0.35 0.29 1.42 0.02 0.57 -2.10 113.55 113.78 3d3f h SER 36 Ca 0.03 0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3d3f h SER 36 Cb 0.89 0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.58 3d3f h SER 36 CO 0.08 -0.16 -0.23 0.58 -1.14 0.00 0.00 176.83 175.95 3d3f h VAL 37 N -0.17 0.51 0.00 2.27 2.07 -1.13 -2.31 116.25 117.49 3d3f h VAL 37 Ca 0.06 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.58 3d3f h VAL 37 Cb 0.25 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 3d3f h VAL 37 CO -0.16 0.00 0.00 0.07 0.02 0.00 0.00 177.57 177.50 3d3f h LYS 38 N -0.53 0.00 -0.23 1.57 2.10 -1.48 0.10 116.57 118.10 3d3f h LYS 38 Ca -0.02 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.52 3d3f h LYS 38 Cb 0.47 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.80 3d3f h LYS 38 CO -0.01 0.00 -0.27 0.00 -2.00 0.00 0.00 179.45 177.16 3d3f h ALA 39 N 2.05 0.35 0.05 0.07 0.00 -1.25 0.52 119.26 121.05 3d3f h ALA 39 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3d3f h ALA 39 Cb 0.65 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3d3f h ALA 39 CO 0.00 0.35 -0.06 0.00 0.00 0.00 0.00 179.25 179.54 3d3f h ALA 40 N 0.66 -0.11 -0.50 0.00 0.00 -0.98 -2.23 119.26 116.10 3d3f h ALA 40 Ca 0.03 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 3d3f h ALA 40 Cb 0.84 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 3d3f h ALA 40 CO 0.07 -0.57 -0.07 0.82 0.00 0.00 0.00 179.25 179.50 3d3f h ILE 41 N -0.13 1.27 -0.49 0.00 2.04 -0.82 -0.92 117.51 118.45 3d3f h ILE 41 Ca 0.01 -1.19 0.14 0.00 1.00 0.00 0.00 64.86 64.82 3d3f h ILE 41 Cb 0.14 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 3d3f h ILE 41 CO -0.03 0.41 0.38 0.50 0.00 0.00 0.00 178.15 179.42 3d3f h LYS 42 N 0.78 0.00 -0.94 2.37 3.64 -0.88 -0.59 116.57 120.95 3d3f h LYS 42 Ca 0.13 0.00 -0.63 0.00 -1.27 0.00 0.00 60.65 58.88 3d3f h LYS 42 Cb 0.61 0.00 -0.31 0.00 -0.41 0.00 0.00 32.23 32.12 3d3f h LYS 42 CO 0.04 0.00 0.55 0.09 -2.27 0.00 0.00 179.45 177.86 3d3f n ASN 43 N -4.23 6.76 0.00 4.20 3.02 -0.81 -4.95 115.26 119.25 3d3f n ASN 43 Ca 0.09 -3.77 0.00 0.00 -0.03 0.00 0.00 54.58 50.87 3d3f n ASN 43 Cb 0.59 -0.85 0.00 0.00 -0.61 0.00 0.00 39.78 38.91 3d3f n ASN 43 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d3f n GLY 44 N -0.91 2.38 3.76 7.41 0.00 -0.23 -4.99 105.19 112.60 3d3f n GLY 44 Ca 0.59 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.21 3d3f n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d3f s TYR 45 N -2.55 2.43 0.00 1.61 1.51 -0.41 -4.58 117.35 115.35 3d3f s TYR 45 Ca 0.00 1.32 0.00 0.00 -1.01 0.00 0.00 57.07 57.38 3d3f s TYR 45 Cb 0.00 -3.85 0.00 0.00 -0.11 0.00 0.00 41.96 38.00 3d3f s TYR 45 CO 0.00 -2.84 0.33 0.54 -1.11 0.00 0.00 175.55 172.48 3d3f n ARG 46 N -0.47 0.17 -4.35 -0.62 5.12 -1.26 -4.29 116.66 110.95 3d3f n ARG 46 Ca 0.07 -0.38 -0.21 0.00 -1.93 0.00 0.00 57.85 55.40 3d3f n ARG 46 Cb 0.43 -0.58 -0.16 0.00 -1.16 0.00 0.00 32.46 30.99 3d3f n ARG 46 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3d3f s SER 47 N -0.08 1.26 -0.03 0.55 0.15 -1.26 -0.14 113.70 114.15 3d3f s SER 47 Ca 0.00 -0.20 0.02 0.00 0.70 0.00 0.00 55.95 56.48 3d3f s SER 47 Cb 0.00 -0.54 0.01 0.00 -1.71 0.00 0.00 66.02 63.77 3d3f s SER 47 CO 0.00 0.00 -0.08 -0.63 1.20 0.00 0.00 173.24 173.73 3d3f s ILE 48 N 0.67 0.76 -0.18 6.45 -1.09 -0.59 -0.37 121.20 126.85 3d3f s ILE 48 Ca -0.11 -0.32 -0.00 0.00 -2.23 0.00 0.00 60.65 57.98 3d3f s ILE 48 Cb -0.14 -0.70 0.01 0.00 -1.58 0.00 0.00 42.46 40.05 3d3f s ILE 48 CO 0.01 0.25 -0.15 -0.62 -1.23 0.00 0.00 174.94 173.21 3d3f s ASP 49 N 0.37 3.58 0.39 3.58 2.15 0.59 -2.43 116.67 124.90 3d3f s ASP 49 Ca -0.06 -0.53 0.05 0.00 0.43 0.00 0.00 52.55 52.43 3d3f s ASP 49 Cb -0.10 -1.57 -0.02 0.00 -0.30 0.00 0.00 42.92 40.92 3d3f s ASP 49 CO 0.01 0.02 0.17 0.28 -0.17 0.00 0.00 175.17 175.48 3d3f s THR 50 N 1.22 0.40 0.03 1.71 -1.32 -0.74 -2.27 115.64 114.68 3d3f s THR 50 Ca 0.02 -2.00 -0.07 0.00 -1.21 0.00 0.00 61.69 58.44 3d3f s THR 50 Cb -0.14 -2.36 -0.01 0.00 -1.51 0.00 0.00 72.50 68.48 3d3f s THR 50 CO -0.07 0.00 0.13 0.00 -2.21 0.00 0.00 174.62 172.47 3d3f s ALA 51 N -3.26 -0.17 0.39 11.08 0.00 -1.26 -3.74 121.76 124.79 3d3f s ALA 51 Ca 0.27 -0.44 0.18 0.00 0.00 0.00 0.00 51.96 51.98 3d3f s ALA 51 Cb 0.02 0.24 1.10 0.00 0.00 0.00 0.00 23.12 24.49 3d3f s ALA 51 CO 0.18 -0.32 1.75 0.00 0.00 0.00 0.00 175.76 177.37 3d3f h ALA 52 N 3.68 2.21 0.00 0.00 0.00 -1.91 -2.44 119.26 120.80 3d3f h ALA 52 Ca -0.32 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3d3f h ALA 52 Cb 1.19 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3d3f h ALA 52 CO 0.49 -0.65 -0.63 0.97 0.00 0.00 0.00 179.25 179.43 3d3f h ILE 53 N 0.39 0.00 -0.64 0.00 -0.00 -1.97 -3.23 117.51 112.06 3d3f h ILE 53 Ca 0.62 -0.81 0.02 0.00 -0.00 0.00 0.00 64.86 64.69 3d3f h ILE 53 Cb 1.56 1.46 -0.04 0.00 -0.00 0.00 0.00 36.82 39.80 3d3f h ILE 53 CO -0.34 0.00 0.41 1.88 -0.00 0.00 0.00 178.15 180.10 3d3f h TYR 54 N 0.00 0.77 -3.03 2.19 0.99 -1.84 -3.47 116.97 112.58 3d3f h TYR 54 Ca 0.00 0.02 -0.29 0.00 2.00 0.00 0.00 58.73 60.46 3d3f h TYR 54 Cb 0.90 -0.26 0.03 0.00 1.00 0.00 0.00 36.73 38.41 3d3f h TYR 54 CO 0.00 0.46 -0.42 1.17 -0.00 0.00 0.00 178.16 179.37 3d3f n LYS 55 N -4.67 -2.95 -0.23 4.88 3.00 -1.22 -4.89 118.16 112.07 3d3f n LYS 55 Ca 0.06 0.67 0.09 0.00 -0.00 0.00 0.00 58.31 59.12 3d3f n LYS 55 Cb 0.05 -4.99 0.18 0.00 0.00 0.00 0.00 35.03 30.26 3d3f n LYS 55 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 3d3f n ASN 56 N -1.18 2.65 0.26 3.14 2.04 -1.26 -4.15 115.26 116.76 3d3f n ASN 56 Ca -0.10 -3.17 0.11 0.00 -0.44 0.00 0.00 54.58 50.97 3d3f n ASN 56 Cb 0.60 -0.47 0.68 0.00 -2.53 0.00 0.00 39.78 38.06 3d3f n ASN 56 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 3d3f h GLU 57 N 0.54 0.00 -0.01 -3.83 5.08 -1.90 0.57 114.58 115.02 3d3f h GLU 57 Ca 0.01 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.12 3d3f h GLU 57 Cb 1.13 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.39 3d3f h GLU 57 CO 0.07 0.13 -0.98 0.93 -1.00 0.00 0.00 179.01 178.16 3d3f h GLU 58 N 0.00 0.60 -0.01 2.33 5.08 -1.89 -2.56 114.58 118.14 3d3f h GLU 58 Ca -0.00 -0.63 -0.16 0.00 -1.00 0.00 0.00 59.36 57.57 3d3f h GLU 58 Cb 0.32 0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 3d3f h GLU 58 CO 0.02 1.24 -0.72 0.78 -1.00 0.00 0.00 179.01 179.32 3d3f h GLY 59 N 0.73 0.07 0.71 -3.84 0.00 -1.68 -2.01 103.07 97.06 3d3f h GLY 59 Ca -0.10 -0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.08 3d3f h GLY 59 CO 0.19 0.09 -0.34 -2.08 0.00 0.00 0.00 176.54 174.40 3d3f h VAL 60 N 0.04 0.00 -0.94 4.60 2.07 -0.95 -1.42 116.25 119.65 3d3f h VAL 60 Ca -0.01 -0.19 0.25 0.00 0.82 0.00 0.00 66.70 67.57 3d3f h VAL 60 Cb 1.28 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.91 3d3f h VAL 60 CO 0.10 0.00 0.43 1.23 0.02 0.00 0.00 177.57 179.35 3d3f h GLY 61 N -1.14 1.69 1.01 2.17 0.00 -1.51 0.35 103.07 105.64 3d3f h GLY 61 Ca -0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 3d3f h GLY 61 CO 0.16 -0.35 0.40 -2.22 0.00 0.00 0.00 176.54 174.53 3d3f h ILE 62 N 0.36 1.23 0.00 2.60 2.04 -1.35 -2.53 117.51 119.86 3d3f h ILE 62 Ca 0.62 -0.60 -0.15 0.00 1.00 0.00 0.00 64.86 65.73 3d3f h ILE 62 Cb 1.26 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 3d3f h ILE 62 CO -0.57 0.26 -0.70 1.23 0.00 0.00 0.00 178.15 178.37 3d3f h GLY 63 N 1.04 0.00 0.99 5.37 0.00 0.31 -0.29 103.07 110.49 3d3f h GLY 63 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.60 3d3f h GLY 63 CO -0.04 0.00 0.12 -2.22 0.00 0.00 0.00 176.54 174.40 3d3f h ILE 64 N 0.00 1.04 -0.02 2.60 2.04 -0.50 -0.76 117.51 121.91 3d3f h ILE 64 Ca -0.01 -0.08 -0.18 0.00 1.00 0.00 0.00 64.86 65.59 3d3f h ILE 64 Cb 1.31 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 38.14 3d3f h ILE 64 CO 0.09 0.04 -0.77 0.11 0.00 0.00 0.00 178.15 177.62 3d3f h LYS 65 N 0.25 0.19 0.00 2.37 1.57 -1.29 -3.23 116.57 116.42 3d3f h LYS 65 Ca 0.07 -0.17 -0.13 0.00 -1.87 0.00 0.00 60.65 58.55 3d3f h LYS 65 Cb -0.02 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 3d3f h LYS 65 CO -0.02 0.87 -0.62 0.93 -0.57 0.00 0.00 179.45 180.04 3d3f h GLU 66 N 0.12 0.00 0.00 3.15 5.08 -0.86 -3.07 114.58 118.99 3d3f h GLU 66 Ca -0.03 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 3d3f h GLU 66 Cb 1.35 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.60 3d3f h GLU 66 CO 0.12 0.62 -0.07 0.66 -1.00 0.00 0.00 179.01 179.33 3d3f h SER 67 N 0.00 0.00 0.00 1.42 4.64 -1.15 -3.47 113.55 114.99 3d3f h SER 67 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3d3f h SER 67 Cb 1.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 3d3f h SER 67 CO 0.08 0.07 0.00 0.61 -0.87 0.00 0.00 176.83 176.72 3d3f n GLY 68 N -1.26 1.65 3.78 -0.77 0.00 -1.16 -4.93 105.19 102.50 3d3f n GLY 68 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 3d3f n GLY 68 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d3f s VAL 69 N -2.62 3.96 0.11 1.61 -7.23 -1.26 -4.97 120.40 110.00 3d3f s VAL 69 Ca 0.00 1.61 -0.34 0.00 -1.81 0.00 0.00 61.98 61.44 3d3f s VAL 69 Cb 0.00 -3.88 -0.13 0.00 0.56 0.00 0.00 36.38 32.93 3d3f s VAL 69 CO 0.00 0.11 1.67 0.00 -0.31 0.00 0.00 175.10 176.57 3d3f n ALA 70 N 0.39 1.45 -0.22 1.32 0.00 -1.26 -4.85 120.51 117.34 3d3f n ALA 70 Ca 0.03 0.40 0.02 0.00 0.00 0.00 0.00 53.44 53.89 3d3f n ALA 70 Cb 0.49 -2.41 0.07 0.00 0.00 0.00 0.00 19.45 17.60 3d3f n ALA 70 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3d3f n ARG 71 N 4.28 -0.08 0.24 0.00 3.00 -1.26 -0.42 116.66 122.42 3d3f n ARG 71 Ca 0.18 0.92 0.16 0.00 -0.00 0.00 0.00 57.85 59.11 3d3f n ARG 71 Cb 0.30 -1.38 0.62 0.00 0.00 0.00 0.00 32.46 32.00 3d3f n ARG 71 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.63 178.68 3d3f h GLU 72 N 0.00 0.00 -0.02 -0.14 9.09 -2.04 -1.13 114.58 120.34 3d3f h GLU 72 Ca 0.26 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.67 3d3f h GLU 72 Cb 0.41 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.51 3d3f h GLU 72 CO -0.61 0.00 -0.04 0.39 0.05 0.00 0.00 179.01 178.80 3d3f n GLU 73 N -2.87 1.63 -4.21 1.06 1.02 0.45 -4.91 120.64 112.80 3d3f n GLU 73 Ca 0.01 -1.02 -0.29 0.00 -0.02 0.00 0.00 57.16 55.84 3d3f n GLU 73 Cb 0.30 -1.48 -0.09 0.00 -0.02 0.00 0.00 31.44 30.15 3d3f n GLU 73 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3d3f s LEU 74 N -2.07 3.12 -0.25 -4.62 1.43 -0.43 -4.84 118.68 111.02 3d3f s LEU 74 Ca 0.35 -0.38 0.01 0.00 -1.03 0.00 0.00 54.13 53.09 3d3f s LEU 74 Cb 0.21 -1.88 0.06 0.00 0.03 0.00 0.00 46.19 44.61 3d3f s LEU 74 CO 0.36 0.16 -0.06 0.12 0.23 0.00 0.00 176.35 177.16 3d3f s PHE 75 N -1.31 2.65 -0.12 0.29 5.36 0.81 -4.94 117.98 120.72 3d3f s PHE 75 Ca 0.23 -1.94 0.00 0.00 -0.96 0.00 0.00 56.93 54.26 3d3f s PHE 75 Cb -0.11 -1.71 -0.02 0.00 -0.34 0.00 0.00 43.02 40.85 3d3f s PHE 75 CO 0.15 -0.81 -0.12 0.42 -1.46 0.00 0.00 175.22 173.40 3d3f s ILE 76 N 1.31 3.14 -0.03 3.12 -1.09 -1.26 -1.54 121.20 124.85 3d3f s ILE 76 Ca -0.06 -0.64 0.07 0.00 -2.23 0.00 0.00 60.65 57.78 3d3f s ILE 76 Cb -0.19 -2.31 -0.01 0.00 -1.58 0.00 0.00 42.46 38.37 3d3f s ILE 76 CO -0.06 0.53 -0.23 -0.89 -1.23 0.00 0.00 174.94 173.06 3d3f s THR 77 N 0.16 1.84 0.02 2.92 2.01 -1.02 -1.61 115.64 119.96 3d3f s THR 77 Ca -0.07 -0.98 0.01 0.00 0.31 0.00 0.00 61.69 60.96 3d3f s THR 77 Cb -0.15 -1.54 -0.00 0.00 0.01 0.00 0.00 72.50 70.82 3d3f s THR 77 CO 0.05 0.52 0.02 -0.24 -0.69 0.00 0.00 174.62 174.27 3d3f n SER 78 N 2.67 0.01 -3.84 3.53 2.88 -0.52 -1.79 113.62 116.56 3d3f n SER 78 Ca -0.16 -1.16 -0.12 0.00 -1.33 0.00 0.00 58.87 56.10 3d3f n SER 78 Cb 0.52 0.12 -0.10 0.00 -0.75 0.00 0.00 64.21 64.00 3d3f n SER 78 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 3d3f s LYS 79 N -2.10 0.51 -0.22 -1.46 1.02 -1.25 -1.48 119.74 114.77 3d3f s LYS 79 Ca 0.03 -0.31 -0.16 0.00 0.02 0.00 0.00 55.97 55.54 3d3f s LYS 79 Cb 0.00 0.22 -0.04 0.00 -0.52 0.00 0.00 37.83 37.49 3d3f s LYS 79 CO 0.02 -0.13 0.42 0.54 -0.92 0.00 0.00 175.35 175.29 3d3f s VAL 80 N -1.29 5.17 0.47 3.17 0.11 -0.23 -3.11 120.40 124.69 3d3f s VAL 80 Ca -0.14 0.73 -0.19 0.00 -2.93 0.00 0.00 61.98 59.46 3d3f s VAL 80 Cb -0.07 -3.75 -0.09 0.00 -1.53 0.00 0.00 36.38 30.94 3d3f s VAL 80 CO 0.02 0.21 0.97 0.86 -3.33 0.00 0.00 175.10 173.83 3d3f s TRP 81 N 1.61 3.32 0.35 1.54 -0.00 -1.26 -2.63 118.94 121.86 3d3f s TRP 81 Ca 0.19 1.56 0.16 0.00 -0.00 0.00 0.00 56.10 58.00 3d3f s TRP 81 Cb -0.15 -2.85 1.17 0.00 -0.00 0.00 0.00 33.47 31.63 3d3f s TRP 81 CO 0.09 -0.29 1.60 -0.91 -0.00 0.00 0.00 176.95 177.44 3d3f h ASN 82 N 1.50 0.23 0.66 5.86 2.35 -1.97 -0.94 115.58 123.27 3d3f h ASN 82 Ca -0.48 0.24 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 3d3f h ASN 82 Cb 1.19 0.27 0.00 0.00 0.05 0.00 0.00 38.32 39.83 3d3f h ASN 82 CO 0.61 -0.34 0.00 -0.08 -1.65 0.00 0.00 177.43 175.97 3d3f h GLU 83 N 0.09 0.00 0.00 0.81 4.81 -2.01 -3.17 114.58 115.11 3d3f h GLU 83 Ca 0.77 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 60.00 3d3f h GLU 83 Cb 1.91 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.29 3d3f h GLU 83 CO -0.75 0.00 -0.01 -0.25 -0.73 0.00 0.00 179.01 177.27 3d3f n ASP 84 N -2.47 2.11 -4.81 1.04 8.00 -0.36 -5.02 116.55 115.04 3d3f n ASP 84 Ca 0.01 -2.57 -0.32 0.00 0.71 0.00 0.00 54.79 52.62 3d3f n ASP 84 Cb 0.21 -0.23 0.03 0.00 -0.02 0.00 0.00 41.12 41.10 3d3f n ASP 84 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3d3f s GLN 85 N -1.97 3.18 0.00 -1.24 -0.21 -1.20 -2.59 119.66 115.62 3d3f s GLN 85 Ca 0.17 1.07 0.00 0.00 0.02 0.00 0.00 55.36 56.62 3d3f s GLN 85 Cb 0.15 -2.02 0.00 0.00 1.00 0.00 0.00 33.01 32.14 3d3f s GLN 85 CO 0.02 -0.91 0.00 0.41 -2.12 0.00 0.00 175.29 172.68 3d3f n GLY 86 N -1.50 3.12 0.20 3.09 0.00 -1.25 -4.82 105.19 104.03 3d3f n GLY 86 Ca 0.08 -1.70 -0.14 0.00 0.00 0.00 0.00 46.02 44.26 3d3f n GLY 86 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3d3f h TYR 87 N 0.00 -0.40 -0.12 1.61 5.03 -1.89 -0.97 116.97 120.22 3d3f h TYR 87 Ca 0.00 -0.00 -0.17 0.00 2.58 0.00 0.00 58.73 61.14 3d3f h TYR 87 Cb 0.00 0.15 0.01 0.00 1.55 0.00 0.00 36.73 38.44 3d3f h TYR 87 CO 0.00 -0.24 -0.57 1.49 -1.32 0.00 0.00 178.16 177.52 3d3f h GLU 88 N -0.38 0.61 -0.22 1.82 4.57 -1.93 -2.85 114.58 116.19 3d3f h GLU 88 Ca -0.02 -0.49 -0.12 0.00 -1.18 0.00 0.00 59.36 57.56 3d3f h GLU 88 Cb 0.33 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.00 3d3f h GLU 88 CO 0.01 1.11 -0.35 1.79 -1.18 0.00 0.00 179.01 180.38 3d3f h THR 89 N 0.25 1.29 -0.47 0.32 1.35 -1.79 -2.01 112.91 111.84 3d3f h THR 89 Ca -0.04 -1.46 -0.03 0.00 -0.55 0.00 0.00 66.41 64.33 3d3f h THR 89 Cb 1.21 1.50 -0.02 0.00 -1.73 0.00 0.00 68.15 69.11 3d3f h THR 89 CO 0.12 0.46 0.18 0.74 -0.25 0.00 0.00 175.52 176.77 3d3f h THR 90 N 0.41 1.21 0.21 6.82 2.02 -0.90 0.47 112.91 123.15 3d3f h THR 90 Ca 0.05 -0.66 0.01 0.00 0.77 0.00 0.00 66.41 66.57 3d3f h THR 90 Cb 0.81 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.95 3d3f h THR 90 CO 0.07 0.25 -0.27 -0.07 0.37 0.00 0.00 175.52 175.86 3d3f h LEU 91 N 0.63 -0.74 -0.11 2.58 3.38 -1.32 -0.09 115.31 119.64 3d3f h LEU 91 Ca 0.16 0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.24 3d3f h LEU 91 Cb 0.21 0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 3d3f h LEU 91 CO -0.01 -0.38 -0.13 0.00 0.09 0.00 0.00 178.44 178.01 3d3f h ALA 92 N 0.12 -0.06 -0.86 1.53 0.00 -1.30 -0.81 119.26 117.89 3d3f h ALA 92 Ca 0.01 0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.99 3d3f h ALA 92 Cb 0.52 0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 3d3f h ALA 92 CO -0.10 -0.59 0.56 0.00 0.00 0.00 0.00 179.25 179.12 3d3f h ALA 93 N 0.89 1.12 -0.30 0.00 0.00 0.03 -1.88 119.26 119.12 3d3f h ALA 93 Ca 0.08 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.98 3d3f h ALA 93 Cb 0.29 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3d3f h ALA 93 CO -0.21 0.43 0.12 0.35 0.00 0.00 0.00 179.25 179.93 3d3f h PHE 94 N 1.10 0.22 -0.53 0.00 3.57 -0.75 -2.28 116.94 118.28 3d3f h PHE 94 Ca 0.33 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.90 3d3f h PHE 94 Cb -0.04 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.62 3d3f h PHE 94 CO -0.02 0.11 0.35 0.93 -2.23 0.00 0.00 178.31 177.45 3d3f h GLU 95 N 0.26 0.50 -0.36 1.11 4.39 -0.37 -2.02 114.58 118.09 3d3f h GLU 95 Ca 0.13 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.78 3d3f h GLU 95 Cb 0.08 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 3d3f h GLU 95 CO -0.12 0.33 0.17 0.87 -1.16 0.00 0.00 179.01 179.10 3d3f h LYS 96 N 0.51 0.53 -0.96 2.33 1.57 -1.18 -1.81 116.57 117.56 3d3f h LYS 96 Ca 0.22 -0.08 0.03 0.00 -1.87 0.00 0.00 60.65 58.95 3d3f h LYS 96 Cb 0.24 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.40 3d3f h LYS 96 CO -0.06 0.49 0.63 0.77 -0.57 0.00 0.00 179.45 180.71 3d3f h SER 97 N 0.45 1.05 -0.13 0.86 0.02 -0.90 -2.43 113.55 112.47 3d3f h SER 97 Ca 0.12 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 3d3f h SER 97 Cb 0.14 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.43 3d3f h SER 97 CO -0.01 0.72 -0.01 -0.07 -1.14 0.00 0.00 176.83 176.32 3d3f h LEU 98 N 1.22 0.24 -0.54 5.07 3.38 -1.20 -1.81 115.31 121.67 3d3f h LEU 98 Ca 0.38 -0.33 0.06 0.00 0.09 0.00 0.00 57.88 58.08 3d3f h LEU 98 Cb -0.01 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.62 3d3f h LEU 98 CO -0.11 0.51 0.24 -0.08 0.09 0.00 0.00 178.44 179.09 3d3f h GLU 99 N -0.04 0.44 0.00 1.13 4.81 -1.24 0.20 114.58 119.89 3d3f h GLU 99 Ca 0.04 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 3d3f h GLU 99 Cb 0.39 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.67 3d3f h GLU 99 CO 0.01 0.29 -1.14 2.89 -0.73 0.00 0.00 179.01 180.33 3d3f n ARG 100 N -4.93 0.57 0.24 1.92 1.85 -0.92 -3.04 116.66 112.35 3d3f n ARG 100 Ca 0.06 0.06 0.14 0.00 -1.00 0.00 0.00 57.85 57.12 3d3f n ARG 100 Cb 0.19 -1.76 0.43 0.00 -1.05 0.00 0.00 32.46 30.27 3d3f n ARG 100 CO 0.00 0.00 0.00 -0.07 -0.01 0.00 0.00 177.63 177.55 3d3f h LEU 101 N 0.00 0.00 -1.19 2.89 3.38 -1.06 -3.28 115.31 116.04 3d3f h LEU 101 Ca 0.00 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.59 3d3f h LEU 101 Cb 0.97 0.00 0.14 0.00 0.09 0.00 0.00 40.66 41.86 3d3f h LEU 101 CO 0.00 0.00 -0.72 0.00 0.09 0.00 0.00 178.44 177.81 3d3f n GLN 102 N -3.01 -7.24 -4.24 1.13 6.02 0.59 -4.25 117.38 106.38 3d3f n GLN 102 Ca 0.02 0.82 -0.25 0.00 -0.01 0.00 0.00 57.00 57.58 3d3f n GLN 102 Cb 0.41 -5.83 -0.07 0.00 1.02 0.00 0.00 30.24 25.76 3d3f n GLN 102 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3d3f s LEU 103 N -6.93 3.28 0.09 1.08 1.43 -0.59 -5.02 118.68 112.01 3d3f s LEU 103 Ca 0.35 -0.49 0.22 0.00 -1.03 0.00 0.00 54.13 53.18 3d3f s LEU 103 Cb -0.16 -1.88 -0.15 0.00 0.03 0.00 0.00 46.19 44.03 3d3f s LEU 103 CO 0.74 0.05 0.77 0.47 0.23 0.00 0.00 176.35 178.61 3d3f n ASP 104 N -0.47 0.51 -3.67 2.29 8.00 -1.26 -4.67 116.55 117.28 3d3f n ASP 104 Ca -0.08 0.20 -0.11 0.00 0.71 0.00 0.00 54.79 55.51 3d3f n ASP 104 Cb 0.57 1.00 -0.05 0.00 -0.02 0.00 0.00 41.12 42.62 3d3f n ASP 104 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3d3f s TYR 105 N -3.34 -0.18 0.06 1.24 -0.85 -1.26 -4.86 117.35 108.17 3d3f s TYR 105 Ca -0.04 -0.07 0.02 0.00 -0.52 0.00 0.00 57.07 56.46 3d3f s TYR 105 Cb 0.11 0.21 -0.04 0.00 0.38 0.00 0.00 41.96 42.62 3d3f s TYR 105 CO 0.84 -0.64 0.10 -0.51 -1.52 0.00 0.00 175.55 173.82 3d3f s LEU 106 N -2.57 3.92 0.07 -3.49 1.43 -0.21 -4.98 118.68 112.85 3d3f s LEU 106 Ca 0.01 0.07 -0.17 0.00 -1.03 0.00 0.00 54.13 53.01 3d3f s LEU 106 Cb 0.01 -2.53 -0.14 0.00 0.03 0.00 0.00 46.19 43.57 3d3f s LEU 106 CO -0.09 0.19 1.32 0.44 0.23 0.00 0.00 176.35 178.44 3d3f h ASP 107 N 3.40 0.65 -3.54 2.29 3.32 -1.79 0.16 116.42 120.91 3d3f h ASP 107 Ca -0.47 -0.55 -0.33 0.00 0.02 0.00 0.00 57.03 55.70 3d3f h ASP 107 Cb 1.17 -0.19 -0.33 0.00 0.22 0.00 0.00 39.33 40.20 3d3f h ASP 107 CO 0.67 1.09 -0.74 -0.22 -1.72 0.00 0.00 179.24 178.31 3d3f s LEU 108 N -8.80 1.27 -0.07 1.55 2.96 -0.63 -0.57 118.68 114.39 3d3f s LEU 108 Ca -0.13 -0.02 0.04 0.00 -0.22 0.00 0.00 54.13 53.81 3d3f s LEU 108 Cb 0.07 -0.19 -0.00 0.00 0.50 0.00 0.00 46.19 46.57 3d3f s LEU 108 CO 0.82 -0.09 -0.21 -0.47 -1.32 0.00 0.00 176.35 175.09 3d3f s TYR 109 N 0.87 2.15 0.06 5.38 5.04 -1.03 -1.44 117.35 128.39 3d3f s TYR 109 Ca -0.09 -0.75 0.09 0.00 -2.44 0.00 0.00 57.07 53.89 3d3f s TYR 109 Cb -0.12 -1.45 -0.03 0.00 0.35 0.00 0.00 41.96 40.71 3d3f s TYR 109 CO -0.02 -0.28 -0.24 -0.51 -1.34 0.00 0.00 175.55 173.17 3d3f s LEU 110 N 0.17 2.36 -0.36 6.97 1.43 -0.55 -2.09 118.68 126.62 3d3f s LEU 110 Ca -0.10 -0.57 -0.29 0.00 -1.03 0.00 0.00 54.13 52.14 3d3f s LEU 110 Cb -0.15 -1.36 0.00 0.00 0.03 0.00 0.00 46.19 44.71 3d3f s LEU 110 CO 0.05 0.24 1.44 -0.63 0.23 0.00 0.00 176.35 177.68 3d3f s ILE 111 N -0.91 3.90 0.16 -0.59 1.01 -1.00 -1.06 121.20 122.70 3d3f s ILE 111 Ca 0.13 0.95 -0.19 0.00 0.00 0.00 0.00 60.65 61.54 3d3f s ILE 111 Cb -0.10 -4.09 0.06 0.00 0.01 0.00 0.00 42.46 38.34 3d3f s ILE 111 CO 0.04 -0.61 1.65 -0.74 0.00 0.00 0.00 174.94 175.28 3d3f h HIS 112 N 10.58 -0.38 -3.68 3.97 2.76 -1.76 0.29 115.15 126.94 3d3f h HIS 112 Ca -0.28 0.04 -0.17 0.00 -2.20 0.00 0.00 60.37 57.75 3d3f h HIS 112 Cb 1.11 0.22 -0.22 0.00 1.55 0.00 0.00 27.41 30.07 3d3f h HIS 112 CO 0.94 -0.23 -0.60 -1.58 -1.30 0.00 0.00 177.93 175.17 3d3f s TRP 113 N -6.16 0.08 0.07 5.26 0.52 -1.25 -4.31 118.94 113.15 3d3f s TRP 113 Ca -0.14 -0.18 -0.18 0.00 0.02 0.00 0.00 56.10 55.62 3d3f s TRP 113 Cb 0.13 -0.08 -0.11 0.00 -1.15 0.00 0.00 33.47 32.26 3d3f s TRP 113 CO 0.69 -0.19 1.40 -1.00 0.02 0.00 0.00 176.95 177.87 3d3f h PRO 114 N 4.84 0.48 0.00 4.98 0.13 -1.81 -3.47 132.00 137.17 3d3f h PRO 114 Ca -0.30 -0.23 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 3d3f h PRO 114 Cb 1.20 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3d3f h PRO 114 CO 0.42 0.80 0.00 0.41 -0.23 0.00 0.00 178.00 179.39 3d3f n GLY 115 N 0.09 2.72 0.03 1.56 0.00 -1.26 -4.32 105.19 104.00 3d3f n GLY 115 Ca -0.05 -0.33 -0.02 0.00 0.00 0.00 0.00 46.02 45.62 3d3f n GLY 115 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3d3f n LYS 116 N 13.57 2.84 0.00 1.61 5.02 -1.26 -4.84 118.16 135.10 3d3f n LYS 116 Ca 0.00 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 3d3f n LYS 116 Cb 0.00 -1.15 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 3d3f n LYS 116 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3d3f n ASP 117 N -2.17 0.47 -0.42 4.39 10.43 -1.26 -4.96 116.55 123.03 3d3f n ASP 117 Ca -0.09 0.00 0.05 0.00 2.57 0.00 0.00 54.79 57.32 3d3f n ASP 117 Cb 0.65 0.04 0.07 0.00 1.84 0.00 0.00 41.12 43.72 3d3f n ASP 117 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3d3f n LYS 118 N -0.84 1.20 0.05 -1.24 4.76 -1.26 -4.61 118.16 116.20 3d3f n LYS 118 Ca 0.00 -1.37 -0.16 0.00 -2.87 0.00 0.00 58.31 53.92 3d3f n LYS 118 Cb 0.05 -1.19 -0.06 0.00 -1.84 0.00 0.00 35.03 31.99 3d3f n LYS 118 CO 0.00 0.00 0.00 0.10 -1.37 0.00 0.00 177.40 176.13 3d3f h TYR 119 N 1.75 0.80 -0.32 2.13 -0.00 -1.93 -1.56 116.97 117.83 3d3f h TYR 119 Ca 0.00 -0.42 -0.00 0.00 -0.00 0.00 0.00 58.73 58.31 3d3f h TYR 119 Cb 0.49 -0.10 -0.02 0.00 -0.00 0.00 0.00 36.73 37.11 3d3f h TYR 119 CO 0.07 1.24 0.20 0.87 -0.00 0.00 0.00 178.16 180.54 3d3f h LYS 120 N 0.33 0.43 0.00 0.10 1.57 -1.94 0.33 116.57 117.39 3d3f h LYS 120 Ca -0.09 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 3d3f h LYS 120 Cb 1.57 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.78 3d3f h LYS 120 CO 0.17 0.30 -1.18 -0.40 -0.57 0.00 0.00 179.45 177.77 3d3f n ASP 121 N -4.47 0.96 -0.20 0.86 5.68 -1.23 -2.81 116.55 115.34 3d3f n ASP 121 Ca 0.02 -0.50 -0.01 0.00 -0.50 0.00 0.00 54.79 53.80 3d3f n ASP 121 Cb 0.08 1.32 0.10 0.00 -1.14 0.00 0.00 41.12 41.47 3d3f n ASP 121 CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 3d3f h THR 122 N 0.00 0.81 -0.74 2.12 2.02 -1.02 -2.69 112.91 113.41 3d3f h THR 122 Ca 0.00 -0.15 -0.03 0.00 0.77 0.00 0.00 66.41 67.00 3d3f h THR 122 Cb 0.54 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 67.25 3d3f h THR 122 CO 0.00 0.08 0.35 -0.25 0.37 0.00 0.00 175.52 176.07 3d3f h TRP 123 N 0.43 1.05 -0.75 3.16 2.91 -0.38 -1.90 115.95 120.46 3d3f h TRP 123 Ca 0.29 -0.05 0.05 0.00 1.13 0.00 0.00 58.89 60.32 3d3f h TRP 123 Cb 0.33 -0.33 -0.05 0.00 -0.51 0.00 0.00 29.16 28.60 3d3f h TRP 123 CO -0.15 0.77 0.49 0.00 -1.03 0.00 0.00 178.44 178.52 3d3f h ARG 124 N 1.05 0.82 -0.41 2.65 3.08 -1.33 0.18 114.38 120.42 3d3f h ARG 124 Ca 0.25 -0.05 -0.15 0.00 0.07 0.00 0.00 59.98 60.10 3d3f h ARG 124 Cb 0.11 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 3d3f h ARG 124 CO -0.03 0.54 -0.34 0.00 -1.07 0.00 0.00 179.97 179.08 3d3f h ALA 125 N 1.58 0.62 0.30 0.04 0.00 -1.10 -1.35 119.26 119.34 3d3f h ALA 125 Ca 0.31 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3d3f h ALA 125 Cb 0.17 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3d3f h ALA 125 CO -0.10 0.68 -0.14 -0.07 0.00 0.00 0.00 179.25 179.61 3d3f h LEU 126 N 0.79 -0.34 -0.93 0.00 3.38 -0.47 -2.35 115.31 115.39 3d3f h LEU 126 Ca 0.08 -0.06 0.20 0.00 0.09 0.00 0.00 57.88 58.19 3d3f h LEU 126 Cb 0.93 0.09 -0.11 0.00 0.09 0.00 0.00 40.66 41.65 3d3f h LEU 126 CO 0.09 -0.16 0.48 -0.33 0.09 0.00 0.00 178.44 178.61 3d3f h GLU 127 N -0.51 0.54 0.37 1.13 5.08 -0.59 0.04 114.58 120.64 3d3f h GLU 127 Ca -0.04 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 3d3f h GLU 127 Cb 0.38 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.51 3d3f h GLU 127 CO 0.07 0.36 -0.18 -0.22 -1.00 0.00 0.00 179.01 178.04 3d3f h LYS 128 N 0.56 -0.48 -0.93 2.33 3.64 -0.93 -2.06 116.57 118.69 3d3f h LYS 128 Ca 0.56 0.03 0.15 0.00 -1.27 0.00 0.00 60.65 60.12 3d3f h LYS 128 Cb 0.97 0.11 -0.08 0.00 -0.41 0.00 0.00 32.23 32.82 3d3f h LYS 128 CO -0.45 -0.21 0.59 -0.07 -2.27 0.00 0.00 179.45 177.05 3d3f h LEU 129 N -0.70 0.72 -1.34 5.20 3.38 -0.85 0.39 115.31 122.10 3d3f h LEU 129 Ca -0.05 0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.04 3d3f h LEU 129 Cb 0.49 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.10 3d3f h LEU 129 CO 0.08 0.35 0.50 0.22 0.09 0.00 0.00 178.44 179.68 3d3f h TYR 130 N 0.75 0.80 0.00 1.13 5.03 -0.69 -1.76 116.97 122.24 3d3f h TYR 130 Ca 0.48 0.02 -0.13 0.00 2.58 0.00 0.00 58.73 61.68 3d3f h TYR 130 Cb 0.72 -0.26 -0.02 0.00 1.55 0.00 0.00 36.73 38.71 3d3f h TYR 130 CO -0.00 0.41 -0.98 0.87 -1.32 0.00 0.00 178.16 177.14 3d3f h LYS 131 N 0.78 0.00 0.00 1.82 1.57 0.41 -2.63 116.57 118.53 3d3f h LYS 131 Ca 0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 3d3f h LYS 131 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 3d3f h LYS 131 CO -0.12 0.38 0.00 -0.25 -0.57 0.00 0.00 179.45 178.89 3d3f n ASP 132 N -3.04 0.00 -0.92 0.86 8.00 -0.37 -4.91 116.55 116.17 3d3f n ASP 132 Ca -0.04 0.20 -0.09 0.00 0.71 0.00 0.00 54.79 55.57 3d3f n ASP 132 Cb 0.78 -0.37 -0.01 0.00 -0.02 0.00 0.00 41.12 41.50 3d3f n ASP 132 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d3f n GLY 133 N 0.51 0.25 0.11 0.44 0.00 -0.91 -4.93 105.19 100.66 3d3f n GLY 133 Ca 0.08 -0.55 0.11 0.00 0.00 0.00 0.00 46.02 45.66 3d3f n GLY 133 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3d3f n LYS 134 N -2.05 0.31 -3.88 1.61 5.02 -0.71 -4.88 118.16 113.57 3d3f n LYS 134 Ca -0.10 -0.22 -0.18 0.00 -2.02 0.00 0.00 58.31 55.79 3d3f n LYS 134 Cb 0.51 -1.50 -0.16 0.00 -0.02 0.00 0.00 35.03 33.86 3d3f n LYS 134 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3d3f s ILE 135 N -2.85 0.16 -0.22 -0.18 1.01 -1.24 -1.04 121.20 116.86 3d3f s ILE 135 Ca 0.13 0.13 0.17 0.00 0.00 0.00 0.00 60.65 61.08 3d3f s ILE 135 Cb 0.17 -0.28 0.09 0.00 0.01 0.00 0.00 42.46 42.45 3d3f s ILE 135 CO 0.71 0.16 1.39 0.03 0.00 0.00 0.00 174.94 177.23 3d3f h ARG 136 N 7.50 0.00 -2.85 2.79 3.08 -0.92 -3.42 114.38 120.56 3d3f h ARG 136 Ca -0.37 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.55 3d3f h ARG 136 Cb 1.13 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 30.94 3d3f h ARG 136 CO 0.42 0.35 -0.27 0.00 -1.07 0.00 0.00 179.97 179.39 3d3f s ALA 137 N -3.03 -0.91 0.06 0.04 0.00 0.26 -4.91 121.76 113.27 3d3f s ALA 137 Ca 0.04 0.94 0.08 0.00 0.00 0.00 0.00 51.96 53.01 3d3f s ALA 137 Cb 0.07 -0.49 -0.03 0.00 0.00 0.00 0.00 23.12 22.67 3d3f s ALA 137 CO 0.74 -0.19 -0.21 0.96 0.00 0.00 0.00 175.76 177.05 3d3f s ILE 138 N -0.07 1.74 0.00 0.00 -4.36 -1.26 -2.46 121.20 114.78 3d3f s ILE 138 Ca -0.02 -1.33 0.00 0.00 -0.26 0.00 0.00 60.65 59.04 3d3f s ILE 138 Cb -0.03 -1.53 0.00 0.00 1.25 0.00 0.00 42.46 42.15 3d3f s ILE 138 CO 0.01 0.14 0.00 0.61 0.24 0.00 0.00 174.94 175.95 3d3f n GLY 139 N 1.61 2.63 3.44 6.27 0.00 -0.89 -1.82 105.19 116.44 3d3f n GLY 139 Ca -0.18 -0.57 -0.10 0.00 0.00 0.00 0.00 46.02 45.18 3d3f n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d3f s VAL 140 N -1.89 0.04 -0.14 1.61 0.11 0.60 -2.38 120.40 118.36 3d3f s VAL 140 Ca 0.00 -0.94 -0.08 0.00 -2.93 0.00 0.00 61.98 58.03 3d3f s VAL 140 Cb 0.00 -1.61 0.05 0.00 -1.53 0.00 0.00 36.38 33.29 3d3f s VAL 140 CO 0.00 -0.20 0.34 -0.55 -3.33 0.00 0.00 175.10 171.36 3d3f s SER 141 N -2.89 -0.40 -1.55 3.54 0.15 0.09 -0.15 113.70 112.49 3d3f s SER 141 Ca 0.11 0.72 0.00 0.00 0.70 0.00 0.00 55.95 57.48 3d3f s SER 141 Cb 0.01 0.63 0.00 0.00 -1.71 0.00 0.00 66.02 64.95 3d3f s SER 141 CO -0.03 -0.17 0.00 0.59 1.20 0.00 0.00 173.24 174.83 3d3f n ASN 142 N 3.97 -4.88 -4.77 5.45 3.02 0.76 -3.79 115.26 115.02 3d3f n ASN 142 Ca -0.22 0.20 -0.38 0.00 -0.03 0.00 0.00 54.58 54.15 3d3f n ASN 142 Cb 0.55 -3.90 -0.06 0.00 -0.61 0.00 0.00 39.78 35.76 3d3f n ASN 142 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3d3f s PHE 143 N -2.70 3.81 0.29 3.10 2.99 -1.26 -4.57 117.98 119.63 3d3f s PHE 143 Ca 0.00 1.76 0.06 0.00 0.00 0.00 0.00 56.93 58.75 3d3f s PHE 143 Cb 0.00 -2.88 -0.02 0.00 0.00 0.00 0.00 43.02 40.11 3d3f s PHE 143 CO 0.00 0.34 0.36 -0.65 -0.00 0.00 0.00 175.22 175.28 3d3f s GLN 144 N -1.65 3.16 0.29 0.44 -1.52 -1.26 -4.99 119.66 114.14 3d3f s GLN 144 Ca 0.45 -0.96 -0.00 0.00 -1.95 0.00 0.00 55.36 52.89 3d3f s GLN 144 Cb -0.21 -2.76 0.68 0.00 -0.22 0.00 0.00 33.01 30.49 3d3f s GLN 144 CO 0.26 0.26 1.59 0.28 -0.25 0.00 0.00 175.29 177.43 3d3f h VAL 145 N 1.14 0.11 -0.25 1.09 2.07 -1.98 -2.43 116.25 116.00 3d3f h VAL 145 Ca -0.48 -0.02 -0.05 0.00 0.82 0.00 0.00 66.70 66.97 3d3f h VAL 145 Cb 1.24 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 3d3f h VAL 145 CO 0.58 0.01 -0.04 1.12 0.02 0.00 0.00 177.57 179.26 3d3f h HIS 146 N 0.05 0.51 -1.29 1.57 2.07 -1.98 -0.11 115.15 115.96 3d3f h HIS 146 Ca 0.55 -0.10 0.37 0.00 -2.85 0.00 0.00 60.37 58.35 3d3f h HIS 146 Cb 1.11 -0.13 -0.05 0.00 2.57 0.00 0.00 27.41 30.91 3d3f h HIS 146 CO -0.47 0.66 1.02 0.45 -3.07 0.00 0.00 177.93 176.52 3d3f h HIS 147 N 0.21 0.00 0.00 6.12 3.86 -1.89 -0.49 115.15 122.96 3d3f h HIS 147 Ca 0.07 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.13 3d3f h HIS 147 Cb 0.48 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.93 3d3f h HIS 147 CO 0.05 0.00 -0.92 -0.07 0.86 0.00 0.00 177.93 177.84 3d3f h LEU 148 N 0.00 0.00 -0.97 2.43 3.38 -0.96 -2.22 115.31 116.97 3d3f h LEU 148 Ca 0.61 -0.36 0.26 0.00 0.09 0.00 0.00 57.88 58.48 3d3f h LEU 148 Cb 2.64 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 43.21 3d3f h LEU 148 CO -0.01 1.21 -0.01 -0.62 0.09 0.00 0.00 178.44 179.10 3d3f n GLU 149 N -4.51 -0.08 -0.09 1.13 1.02 -0.10 -1.19 120.64 116.81 3d3f n GLU 149 Ca -0.22 1.45 -0.11 0.00 -0.02 0.00 0.00 57.16 58.26 3d3f n GLU 149 Cb 0.52 -2.29 -0.04 0.00 -0.02 0.00 0.00 31.44 29.61 3d3f n GLU 149 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 3d3f h GLU 150 N 0.00 0.49 0.18 3.49 4.57 -1.17 -2.88 114.58 119.26 3d3f h GLU 150 Ca 0.57 -0.16 0.00 0.00 -1.18 0.00 0.00 59.36 58.59 3d3f h GLU 150 Cb 1.15 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.68 3d3f h GLU 150 CO -0.92 0.66 -0.15 1.25 -1.18 0.00 0.00 179.01 178.66 3d3f h LEU 151 N 0.27 -0.41 -2.13 1.64 5.85 -0.77 -2.85 115.31 116.91 3d3f h LEU 151 Ca 0.08 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.87 3d3f h LEU 151 Cb 0.44 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 3d3f h LEU 151 CO 0.02 -0.24 0.31 -0.07 -0.34 0.00 0.00 178.44 178.11 3d3f h LEU 152 N -0.35 0.00 -2.27 2.25 3.38 -1.13 -1.71 115.31 115.47 3d3f h LEU 152 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3d3f h LEU 152 Cb 0.32 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 3d3f h LEU 152 CO -0.03 0.00 -0.04 0.11 0.09 0.00 0.00 178.44 178.58 3d3f h LYS 153 N 0.00 0.00 0.00 1.13 1.57 -1.27 -3.30 116.57 114.69 3d3f h LYS 153 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3d3f h LYS 153 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.98 3d3f h LYS 153 CO -0.00 0.04 0.00 -0.25 -0.57 0.00 0.00 179.45 178.67 3d3f n ASP 154 N -3.31 0.05 -4.77 0.86 10.43 -0.88 -5.09 116.55 113.85 3d3f n ASP 154 Ca -0.02 -0.79 -0.38 0.00 2.57 0.00 0.00 54.79 56.17 3d3f n ASP 154 Cb 0.18 0.02 0.00 0.00 1.84 0.00 0.00 41.12 43.15 3d3f n ASP 154 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3d3f s ALA 155 N -0.02 3.03 -0.08 2.24 0.00 -0.70 -4.94 121.76 121.30 3d3f s ALA 155 Ca 0.00 1.08 0.15 0.00 0.00 0.00 0.00 51.96 53.19 3d3f s ALA 155 Cb 0.00 -3.44 -0.16 0.00 0.00 0.00 0.00 23.12 19.52 3d3f s ALA 155 CO 0.00 -0.82 0.84 0.93 0.00 0.00 0.00 175.76 176.71 3d3f h GLU 156 N 2.14 0.00 -4.59 0.00 5.08 -1.93 -3.47 114.58 111.81 3d3f h GLU 156 Ca -0.50 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.37 3d3f h GLU 156 Cb 1.26 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 30.18 3d3f h GLU 156 CO 0.60 0.42 -0.81 0.42 -1.00 0.00 0.00 179.01 178.65 3d3f s ILE 157 N -2.80 1.04 0.23 3.13 1.01 -1.26 -5.13 121.20 117.42 3d3f s ILE 157 Ca -0.03 -0.45 -0.30 0.00 0.00 0.00 0.00 60.65 59.88 3d3f s ILE 157 Cb 0.08 -0.95 -0.09 0.00 0.01 0.00 0.00 42.46 41.52 3d3f s ILE 157 CO 0.81 0.33 1.01 -0.75 0.00 0.00 0.00 174.94 176.34 3d3f s LYS 158 N 0.52 4.74 0.22 2.79 2.20 -1.26 -5.00 119.74 123.96 3d3f s LYS 158 Ca -0.11 1.61 -0.30 0.00 -0.36 0.00 0.00 55.97 56.81 3d3f s LYS 158 Cb -0.14 -3.26 -0.15 0.00 -1.51 0.00 0.00 37.83 32.77 3d3f s LYS 158 CO 0.03 0.34 1.00 -2.30 -0.36 0.00 0.00 175.35 174.05 3d3f n PRO 159 N 1.67 1.04 -0.03 4.03 -0.02 -1.26 -4.89 135.00 135.54 3d3f n PRO 159 Ca -0.01 0.37 0.01 0.00 -2.02 0.00 0.00 63.50 61.85 3d3f n PRO 159 Cb 0.46 -1.73 -0.14 0.00 -0.02 0.00 0.00 33.50 32.07 3d3f n PRO 159 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3d3f n MET 160 N 1.17 0.66 -4.26 -0.52 2.81 -0.76 -4.64 117.12 111.60 3d3f n MET 160 Ca 0.13 -0.02 -0.19 0.00 -1.81 0.00 0.00 57.70 55.81 3d3f n MET 160 Cb 0.28 -1.59 -0.15 0.00 -0.71 0.00 0.00 33.22 31.04 3d3f n MET 160 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3d3f s VAL 161 N -2.99 0.60 -0.29 2.03 1.01 -1.26 -1.30 120.40 118.19 3d3f s VAL 161 Ca -0.07 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.67 3d3f s VAL 161 Cb 0.10 -0.56 0.07 0.00 0.00 0.00 0.00 36.38 35.98 3d3f s VAL 161 CO 0.85 0.20 -0.03 0.21 0.00 0.00 0.00 175.10 176.34 3d3f s ASN 162 N 0.34 4.69 -0.39 3.32 3.04 -0.50 -0.29 114.94 125.15 3d3f s ASN 162 Ca -0.05 -1.52 -0.18 0.00 0.04 0.00 0.00 52.86 51.15 3d3f s ASN 162 Cb -0.09 -1.63 0.01 0.00 -1.54 0.00 0.00 41.25 38.00 3d3f s ASN 162 CO 0.00 -0.26 0.52 -1.58 -3.04 0.00 0.00 177.10 172.73 3d3f s GLN 163 N 1.12 3.39 0.24 0.43 0.74 0.79 -2.07 119.66 124.30 3d3f s GLN 163 Ca -0.04 -0.39 0.01 0.00 0.05 0.00 0.00 55.36 55.00 3d3f s GLN 163 Cb -0.20 -3.89 -0.05 0.00 1.10 0.00 0.00 33.01 29.97 3d3f s GLN 163 CO -0.04 -0.78 0.07 0.14 -0.55 0.00 0.00 175.29 174.13 3d3f s VAL 164 N 2.41 0.61 0.09 1.34 -7.23 -0.26 -0.17 120.40 117.19 3d3f s VAL 164 Ca 0.17 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.05 3d3f s VAL 164 Cb -0.16 -2.53 -0.05 0.00 0.56 0.00 0.00 36.38 34.20 3d3f s VAL 164 CO 0.15 -0.10 1.03 -0.70 -0.31 0.00 0.00 175.10 175.16 3d3f s GLU 165 N -4.00 4.61 -0.28 4.82 2.12 -1.26 -0.93 118.70 123.77 3d3f s GLU 165 Ca 0.35 1.54 -0.12 0.00 0.36 0.00 0.00 54.97 57.10 3d3f s GLU 165 Cb 0.07 -3.37 0.11 0.00 0.26 0.00 0.00 34.13 31.20 3d3f s GLU 165 CO 0.12 0.05 0.64 0.12 -0.54 0.00 0.00 175.26 175.65 3d3f s PHE 166 N 0.35 -1.18 -0.10 5.30 2.19 -1.08 -4.86 117.98 118.61 3d3f s PHE 166 Ca 0.50 2.16 -0.33 0.00 0.33 0.00 0.00 56.93 59.60 3d3f s PHE 166 Cb -0.25 0.69 0.13 0.00 -1.31 0.00 0.00 43.02 42.28 3d3f s PHE 166 CO 0.30 -0.59 1.23 -3.38 1.83 0.00 0.00 175.22 174.61 3d3f s HIS 167 N 2.34 -0.10 0.54 10.12 -3.43 -1.08 -4.28 115.29 119.40 3d3f s HIS 167 Ca -0.07 0.01 0.31 0.00 -0.80 0.00 0.00 55.06 54.51 3d3f s HIS 167 Cb -0.09 0.53 1.47 0.00 -1.43 0.00 0.00 32.58 33.06 3d3f s HIS 167 CO -0.19 -0.27 1.89 -1.35 -2.00 0.00 0.00 174.74 172.83 3d3f h PRO 168 N 2.00 0.00 0.00 -0.38 0.11 -1.88 0.82 132.00 132.67 3d3f h PRO 168 Ca -0.19 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.89 3d3f h PRO 168 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 3d3f h PRO 168 CO 0.25 0.00 -0.16 0.00 -0.21 0.00 0.00 178.00 177.89 3d3f h ARG 169 N 0.00 0.00 -2.04 1.05 2.47 -1.88 -0.72 114.38 113.26 3d3f h ARG 169 Ca 0.39 0.00 -0.48 0.00 -1.26 0.00 0.00 59.98 58.62 3d3f h ARG 169 Cb 1.60 0.00 -0.33 0.00 -1.65 0.00 0.00 29.97 29.59 3d3f h ARG 169 CO -0.00 0.16 -0.86 -1.17 0.56 0.00 0.00 179.97 178.66 3d3f s LEU 170 N -6.79 0.68 0.00 3.04 2.96 0.29 0.97 118.68 119.82 3d3f s LEU 170 Ca -0.00 -2.70 0.21 0.00 -0.22 0.00 0.00 54.13 51.41 3d3f s LEU 170 Cb 0.11 0.14 0.54 0.00 0.50 0.00 0.00 46.19 47.48 3d3f s LEU 170 CO 0.60 -0.15 1.46 0.35 -1.32 0.00 0.00 176.35 177.30 3d3f n THR 171 N 2.92 0.71 -3.85 3.68 -2.24 -1.19 -2.65 114.28 111.66 3d3f n THR 171 Ca 0.26 -0.79 -0.24 0.00 -2.27 0.00 0.00 64.05 61.01 3d3f n THR 171 Cb 0.50 0.58 0.00 0.00 -2.10 0.00 0.00 70.33 69.31 3d3f n THR 171 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d3f n GLN 172 N 1.33 -4.13 0.27 -0.78 1.13 -1.26 -4.86 117.38 109.09 3d3f n GLN 172 Ca 0.21 0.51 -0.11 0.00 -1.94 0.00 0.00 57.00 55.67 3d3f n GLN 172 Cb 0.54 -4.89 -0.05 0.00 0.11 0.00 0.00 30.24 25.96 3d3f n GLN 172 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 3d3f h LYS 173 N -1.85 -0.66 -0.26 -1.09 1.63 -2.00 -2.18 116.57 110.15 3d3f h LYS 173 Ca -0.62 0.05 0.05 0.00 -0.85 0.00 0.00 60.65 59.27 3d3f h LYS 173 Cb 1.37 0.15 -0.08 0.00 -0.60 0.00 0.00 32.23 33.07 3d3f h LYS 173 CO 0.61 -0.44 -0.50 0.93 -3.45 0.00 0.00 179.45 176.60 3d3f h GLU 174 N -0.77 -0.45 -0.67 1.90 5.08 -2.00 -2.37 114.58 115.29 3d3f h GLU 174 Ca -0.07 0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.43 3d3f h GLU 174 Cb 0.53 0.10 -0.08 0.00 0.50 0.00 0.00 28.75 29.80 3d3f h GLU 174 CO 0.12 -0.30 0.27 1.25 -1.00 0.00 0.00 179.01 179.35 3d3f h LEU 175 N -0.46 0.28 -0.60 1.33 5.85 -1.95 -0.81 115.31 118.94 3d3f h LEU 175 Ca 0.08 0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.95 3d3f h LEU 175 Cb 0.63 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.66 3d3f h LEU 175 CO -0.50 0.15 0.28 0.03 -0.34 0.00 0.00 178.44 178.06 3d3f h ARG 176 N 0.46 0.51 -0.63 1.25 3.08 -1.17 -0.37 114.38 117.51 3d3f h ARG 176 Ca 0.35 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.40 3d3f h ARG 176 Cb 0.45 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.35 3d3f h ARG 176 CO -0.33 0.33 0.38 -0.44 -1.07 0.00 0.00 179.97 178.85 3d3f h ASP 177 N 0.52 0.62 -0.29 7.04 3.32 -0.65 -2.04 116.42 124.94 3d3f h ASP 177 Ca 0.29 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.28 3d3f h ASP 177 Cb 0.26 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 3d3f h ASP 177 CO -0.23 0.43 -0.06 0.22 -1.72 0.00 0.00 179.24 177.88 3d3f h TYR 178 N 0.75 0.62 -0.20 4.55 3.20 -0.93 -2.32 116.97 122.64 3d3f h TYR 178 Ca 0.26 -0.13 -0.08 0.00 3.14 0.00 0.00 58.73 61.92 3d3f h TYR 178 Cb 0.04 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.15 3d3f h TYR 178 CO -0.05 0.74 -0.17 0.00 -1.64 0.00 0.00 178.16 177.04 3d3f h LYS 180 N 0.15 -0.27 -0.02 0.00 1.63 -1.44 0.68 116.57 117.30 3d3f h LYS 180 Ca 0.04 0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.85 3d3f h LYS 180 Cb 0.70 0.06 -0.00 0.00 -0.60 0.00 0.00 32.23 32.39 3d3f h LYS 180 CO 0.04 -0.18 -0.03 0.78 -3.45 0.00 0.00 179.45 176.61 3d3f h GLY 181 N -0.28 0.03 -0.78 5.01 0.00 -1.36 -2.52 103.07 103.17 3d3f h GLY 181 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.46 3d3f h GLY 181 CO -0.65 0.01 0.00 -1.06 0.00 0.00 0.00 176.54 174.84 3d3f n GLN 182 N -4.49 1.80 -2.19 4.80 1.13 -0.15 -4.90 117.38 113.39 3d3f n GLN 182 Ca -0.03 -1.17 -0.10 0.00 -1.94 0.00 0.00 57.00 53.77 3d3f n GLN 182 Cb 0.12 -1.47 -0.00 0.00 0.11 0.00 0.00 30.24 29.00 3d3f n GLN 182 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3d3f n GLY 183 N 1.21 -0.04 3.41 1.08 0.00 0.65 -5.00 105.19 106.50 3d3f n GLY 183 Ca 0.18 -0.47 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 3d3f n GLY 183 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d3f s ILE 184 N -2.50 4.07 -0.34 -0.61 1.01 0.21 -4.45 121.20 118.59 3d3f s ILE 184 Ca 0.00 -0.25 -0.29 0.00 0.00 0.00 0.00 60.65 60.11 3d3f s ILE 184 Cb 0.00 -2.89 0.01 0.00 0.01 0.00 0.00 42.46 39.59 3d3f s ILE 184 CO 0.00 0.36 1.23 -1.58 0.00 0.00 0.00 174.94 174.95 3d3f s GLN 185 N 1.57 3.90 0.44 2.79 2.00 -0.42 -3.89 119.66 126.05 3d3f s GLN 185 Ca 0.06 1.08 -0.24 0.00 -2.00 0.00 0.00 55.36 54.26 3d3f s GLN 185 Cb -0.15 -3.86 -0.08 0.00 0.80 0.00 0.00 33.01 29.73 3d3f s GLN 185 CO 0.02 -1.14 1.26 -1.17 -0.50 0.00 0.00 175.29 173.76 3d3f s LEU 186 N 4.29 4.11 -0.01 3.68 2.96 -1.26 -1.41 118.68 131.03 3d3f s LEU 186 Ca 0.53 2.53 0.00 0.00 -0.22 0.00 0.00 54.13 56.97 3d3f s LEU 186 Cb -0.14 -4.06 0.01 0.00 0.50 0.00 0.00 46.19 42.50 3d3f s LEU 186 CO 0.23 -0.95 0.01 -0.70 -1.32 0.00 0.00 176.35 173.62 3d3f s GLU 187 N -2.46 0.04 -0.27 1.98 2.12 -0.88 -2.38 118.70 116.85 3d3f s GLU 187 Ca 0.61 0.06 -0.18 0.00 0.36 0.00 0.00 54.97 55.82 3d3f s GLU 187 Cb -0.35 -0.16 -0.02 0.00 0.26 0.00 0.00 34.13 33.86 3d3f s GLU 187 CO 0.43 -0.07 0.54 0.00 -0.54 0.00 0.00 175.26 175.63 3d3f s ALA 188 N 0.47 3.58 0.30 6.30 0.00 0.12 -1.10 121.76 131.42 3d3f s ALA 188 Ca -0.04 -0.63 0.04 0.00 0.00 0.00 0.00 51.96 51.33 3d3f s ALA 188 Cb -0.06 -2.94 -0.03 0.00 0.00 0.00 0.00 23.12 20.10 3d3f s ALA 188 CO -0.01 -0.83 0.45 1.67 0.00 0.00 0.00 175.76 177.03 3d3f s TRP 189 N 2.37 3.39 -1.72 0.00 1.48 -0.10 -3.68 118.94 120.68 3d3f s TRP 189 Ca 0.22 0.05 -0.20 0.00 -1.06 0.00 0.00 56.10 55.11 3d3f s TRP 189 Cb -0.15 -1.77 0.19 0.00 -1.16 0.00 0.00 33.47 30.57 3d3f s TRP 189 CO 0.10 0.23 0.66 0.43 -4.06 0.00 0.00 176.95 174.31 3d3f n SER 190 N -1.59 -2.55 -0.10 -2.66 7.64 -1.26 -2.64 113.62 110.47 3d3f n SER 190 Ca -0.06 -1.05 0.26 0.00 1.01 0.00 0.00 58.87 59.03 3d3f n SER 190 Cb 0.57 -2.14 0.72 0.00 -1.01 0.00 0.00 64.21 62.35 3d3f n SER 190 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3d3f h PRO 191 N -1.11 0.00 -0.67 1.43 0.13 -1.81 0.87 132.00 130.84 3d3f h PRO 191 Ca -0.57 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.56 3d3f h PRO 191 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 3d3f h PRO 191 CO 0.80 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.85 3d3f n LEU 192 N -4.16 4.46 -3.77 1.56 4.77 -1.26 -4.67 117.00 113.94 3d3f n LEU 192 Ca 0.15 -2.25 -0.28 0.00 -0.03 0.00 0.00 56.01 53.61 3d3f n LEU 192 Cb 0.85 -0.55 0.04 0.00 -2.33 0.00 0.00 43.42 41.43 3d3f n LEU 192 CO 0.36 0.82 0.15 0.80 -1.33 0.00 0.00 177.39 178.19 3d3f n MET 193 N 1.20 -6.34 -1.83 3.23 0.00 0.30 -1.69 117.12 111.99 3d3f n MET 193 Ca 0.25 0.69 -0.17 0.00 -0.00 0.00 0.00 57.70 58.47 3d3f n MET 193 Cb 0.81 -5.63 -0.05 0.00 0.00 0.00 0.00 33.22 28.35 3d3f n MET 193 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 3d3f n GLN 194 N -4.77 -1.58 0.00 2.12 6.02 -1.24 -2.03 117.38 115.90 3d3f n GLN 194 Ca 0.03 0.91 0.00 0.00 -0.01 0.00 0.00 57.00 57.93 3d3f n GLN 194 Cb 0.54 -5.34 0.00 0.00 1.02 0.00 0.00 30.24 26.46 3d3f n GLN 194 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3d3f n GLY 195 N -0.53 0.36 0.31 1.08 0.00 -0.68 -4.99 105.19 100.74 3d3f n GLY 195 Ca -0.18 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.03 3d3f n GLY 195 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3d3f h GLN 196 N 4.16 0.00 -0.01 1.61 4.20 -1.44 -3.13 115.11 120.51 3d3f h GLN 196 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3d3f h GLN 196 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 3d3f h GLN 196 CO 0.00 0.02 -0.20 1.28 -0.67 0.00 0.00 178.83 179.26 3d3f n LEU 197 N -3.35 1.02 0.00 1.46 4.77 -1.26 -4.61 117.00 115.04 3d3f n LEU 197 Ca -0.02 -0.73 0.01 0.00 -0.03 0.00 0.00 56.01 55.23 3d3f n LEU 197 Cb 0.13 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.28 3d3f n LEU 197 CO 0.24 0.21 0.40 0.18 -1.33 0.00 0.00 177.39 177.10 3d3f n LEU 198 N -0.39 0.00 0.00 2.23 4.77 -1.18 0.30 117.00 122.72 3d3f n LEU 198 Ca 0.03 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 3d3f n LEU 198 Cb 0.17 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 3d3f n LEU 198 CO 0.11 -0.18 0.30 -0.67 -1.33 0.00 0.00 177.39 175.63 3d3f n ASP 199 N -1.20 0.95 -4.78 -1.43 2.03 -1.26 -4.75 116.55 106.12 3d3f n ASP 199 Ca 0.01 -1.37 -0.41 0.00 0.52 0.00 0.00 54.79 53.54 3d3f n ASP 199 Cb 0.02 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.41 3d3f n ASP 199 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 3d3f s ASN 200 N -0.37 6.50 0.20 1.67 3.84 0.15 -4.92 114.94 122.01 3d3f s ASN 200 Ca 0.00 2.91 -0.08 0.00 0.21 0.00 0.00 52.86 55.90 3d3f s ASN 200 Cb 0.00 -2.66 0.13 0.00 -0.55 0.00 0.00 41.25 38.17 3d3f s ASN 200 CO 0.00 -0.75 1.73 -0.08 -2.79 0.00 0.00 177.10 175.21 3d3f h GLU 201 N 3.13 1.15 0.12 0.43 4.81 -1.96 -2.31 114.58 119.95 3d3f h GLU 201 Ca -0.50 -0.26 -0.27 0.00 -0.13 0.00 0.00 59.36 58.20 3d3f h GLU 201 Cb 1.23 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 30.46 3d3f h GLU 201 CO 0.65 0.99 -1.21 0.28 -0.73 0.00 0.00 179.01 178.99 3d3f h VAL 202 N 1.10 1.47 0.00 0.32 2.07 -1.97 -2.82 116.25 116.42 3d3f h VAL 202 Ca 0.23 -2.94 -0.05 0.00 0.82 0.00 0.00 66.70 64.76 3d3f h VAL 202 Cb 0.33 2.87 -0.01 0.00 -1.52 0.00 0.00 31.29 32.96 3d3f h VAL 202 CO -0.00 0.86 -0.22 -0.07 0.02 0.00 0.00 177.57 178.16 3d3f h LEU 203 N 0.10 0.00 0.01 2.57 3.38 -1.92 -3.08 115.31 116.38 3d3f h LEU 203 Ca -0.13 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 3d3f h LEU 203 Cb 1.92 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.67 3d3f h LEU 203 CO 0.20 0.22 -0.01 0.74 0.09 0.00 0.00 178.44 179.68 3d3f h THR 204 N 0.00 1.47 -0.42 0.22 2.02 -1.25 0.17 112.91 115.12 3d3f h THR 204 Ca -0.00 -1.53 -0.04 0.00 0.77 0.00 0.00 66.41 65.61 3d3f h THR 204 Cb 0.86 2.49 -0.02 0.00 -1.74 0.00 0.00 68.15 69.74 3d3f h THR 204 CO 0.03 0.39 0.10 1.56 0.37 0.00 0.00 175.52 177.97 3d3f h GLN 205 N -0.68 0.62 -0.21 6.66 4.20 -1.54 0.45 115.11 124.61 3d3f h GLN 205 Ca -0.00 -0.11 -0.13 0.00 0.06 0.00 0.00 58.65 58.47 3d3f h GLN 205 Cb 0.65 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.33 3d3f h GLN 205 CO 0.00 0.57 -0.38 0.82 -0.67 0.00 0.00 178.83 179.17 3d3f h ILE 206 N 0.61 1.32 -0.11 2.54 2.04 -1.57 -2.04 117.51 120.29 3d3f h ILE 206 Ca 0.14 -1.60 0.02 0.00 1.00 0.00 0.00 64.86 64.41 3d3f h ILE 206 Cb 0.23 1.83 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 3d3f h ILE 206 CO -0.00 0.50 0.01 0.00 0.00 0.00 0.00 178.15 178.66 3d3f h ALA 207 N 0.61 0.11 0.22 1.87 0.00 0.06 -2.97 119.26 119.15 3d3f h ALA 207 Ca 0.01 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.96 3d3f h ALA 207 Cb 0.98 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 3d3f h ALA 207 CO 0.09 -0.44 -0.36 0.93 0.00 0.00 0.00 179.25 179.46 3d3f h GLU 208 N 0.06 -0.63 -0.95 0.00 5.08 -0.94 -0.01 114.58 117.19 3d3f h GLU 208 Ca 0.05 0.04 0.29 0.00 -1.00 0.00 0.00 59.36 58.75 3d3f h GLU 208 Cb 0.05 0.14 -0.16 0.00 0.50 0.00 0.00 28.75 29.28 3d3f h GLU 208 CO -0.08 -0.42 0.29 -0.22 -1.00 0.00 0.00 179.01 177.58 3d3f h LYS 209 N -0.65 0.13 -0.00 2.33 3.64 -1.42 -1.92 116.57 118.68 3d3f h LYS 209 Ca 0.01 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3d3f h LYS 209 Cb 0.64 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 3d3f h LYS 209 CO -0.15 0.09 -0.45 0.72 -2.27 0.00 0.00 179.45 177.39 3d3f n HIS 210 N -5.27 0.00 -3.32 1.91 8.25 -0.59 -4.96 115.22 111.24 3d3f n HIS 210 Ca 0.26 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.55 3d3f n HIS 210 Cb 0.86 -0.25 0.07 0.00 1.12 0.00 0.00 29.99 31.79 3d3f n HIS 210 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3d3f n ASN 211 N -1.41 -4.56 -4.20 0.41 5.03 -0.13 -5.04 115.26 105.36 3d3f n ASN 211 Ca 0.06 -0.45 -0.21 0.00 0.87 0.00 0.00 54.58 54.85 3d3f n ASN 211 Cb 0.34 -4.17 -0.09 0.00 -1.02 0.00 0.00 39.78 34.83 3d3f n ASN 211 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 3d3f s LYS 212 N -5.79 1.67 0.45 3.52 -0.14 -0.53 -5.03 119.74 113.89 3d3f s LYS 212 Ca 0.34 -1.96 -0.08 0.00 -1.36 0.00 0.00 55.97 52.91 3d3f s LYS 212 Cb -0.15 -0.46 -0.05 0.00 -1.68 0.00 0.00 37.83 35.49 3d3f s LYS 212 CO 0.59 -0.36 0.80 -1.54 -0.76 0.00 0.00 175.35 174.07 3d3f s SER 213 N -3.45 6.39 0.30 2.83 1.04 -1.26 -4.16 113.70 115.39 3d3f s SER 213 Ca 0.33 1.07 0.06 0.00 0.48 0.00 0.00 55.95 57.89 3d3f s SER 213 Cb 0.06 -2.30 0.80 0.00 0.10 0.00 0.00 66.02 64.67 3d3f s SER 213 CO 0.15 -0.51 1.69 0.58 0.98 0.00 0.00 173.24 176.14 3d3f h VAL 214 N 0.63 0.44 -0.96 5.02 2.07 -1.85 -1.47 116.25 120.12 3d3f h VAL 214 Ca -0.47 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 66.92 3d3f h VAL 214 Cb 1.19 0.01 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 3d3f h VAL 214 CO 0.63 0.07 0.61 0.00 0.02 0.00 0.00 177.57 178.90 3d3f h ALA 215 N 1.74 1.26 -0.38 1.67 0.00 -1.94 -0.29 119.26 121.33 3d3f h ALA 215 Ca 0.59 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 55.28 3d3f h ALA 215 Cb 1.17 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3d3f h ALA 215 CO -0.55 0.66 -0.30 1.96 0.00 0.00 0.00 179.25 181.02 3d3f h GLN 216 N 1.31 0.82 0.35 0.00 4.20 -1.64 -2.20 115.11 117.95 3d3f h GLN 216 Ca 0.35 -0.38 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 3d3f h GLN 216 Cb -0.11 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.66 3d3f h GLN 216 CO -0.07 1.01 -0.17 0.28 -0.67 0.00 0.00 178.83 179.22 3d3f h VAL 217 N 0.69 0.67 -0.52 -0.54 2.07 -0.47 0.11 116.25 118.26 3d3f h VAL 217 Ca 0.08 -0.09 0.09 0.00 0.82 0.00 0.00 66.70 67.60 3d3f h VAL 217 Cb 0.85 0.72 -0.08 0.00 -1.52 0.00 0.00 31.29 31.26 3d3f h VAL 217 CO 0.07 0.02 0.08 0.40 0.02 0.00 0.00 177.57 178.16 3d3f h ILE 218 N -0.51 0.67 -0.82 4.57 2.04 -1.11 -0.79 117.51 121.56 3d3f h ILE 218 Ca -0.05 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 3d3f h ILE 218 Cb 0.39 0.45 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 3d3f h ILE 218 CO 0.08 0.04 0.48 -0.07 0.00 0.00 0.00 178.15 178.68 3d3f h LEU 219 N 0.21 1.00 -1.32 1.44 3.38 -1.15 -0.91 115.31 117.95 3d3f h LEU 219 Ca 0.26 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 58.09 3d3f h LEU 219 Cb 0.37 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3d3f h LEU 219 CO -0.36 0.78 -0.32 -0.09 0.09 0.00 0.00 178.44 178.54 3d3f h ARG 220 N 1.13 0.03 -0.21 1.13 9.65 -0.30 -2.95 114.38 122.86 3d3f h ARG 220 Ca 0.29 -0.01 -0.12 0.00 -1.10 0.00 0.00 59.98 59.05 3d3f h ARG 220 Cb -0.02 -0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.55 3d3f h ARG 220 CO -0.05 0.35 -0.32 2.35 2.80 0.00 0.00 179.97 185.09 3d3f h TRP 221 N 0.03 0.73 -0.74 2.20 7.01 -0.65 -0.98 115.95 123.54 3d3f h TRP 221 Ca 0.00 -0.25 0.13 0.00 2.11 0.00 0.00 58.89 60.88 3d3f h TRP 221 Cb 0.58 -0.14 -0.09 0.00 -2.10 0.00 0.00 29.16 27.41 3d3f h TRP 221 CO 0.00 0.98 0.32 -0.44 -2.79 0.00 0.00 178.44 176.51 3d3f h ASP 222 N 0.27 0.34 0.05 2.65 3.32 -1.09 -2.26 116.42 119.70 3d3f h ASP 222 Ca 0.02 0.09 -0.21 0.00 0.02 0.00 0.00 57.03 56.95 3d3f h ASP 222 Cb 0.91 0.05 0.02 0.00 0.22 0.00 0.00 39.33 40.53 3d3f h ASP 222 CO 0.07 0.16 -0.87 -0.07 -1.72 0.00 0.00 179.24 176.81 3d3f h LEU 223 N 0.50 0.67 -1.69 1.55 3.38 -1.35 -0.96 115.31 117.42 3d3f h LEU 223 Ca 0.40 -0.80 0.00 0.00 0.09 0.00 0.00 57.88 57.56 3d3f h LEU 223 Cb 0.55 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3d3f h LEU 223 CO -0.36 1.40 0.00 1.56 0.09 0.00 0.00 178.44 181.13 3d3f h GLN 224 N 0.03 0.00 -0.00 1.13 4.20 -1.16 0.48 115.11 119.79 3d3f h GLN 224 Ca -0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.59 3d3f h GLN 224 Cb 1.58 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.36 3d3f h GLN 224 CO 0.17 0.00 -0.43 0.72 -0.67 0.00 0.00 178.83 178.62 3d3f n HIS 225 N -2.67 0.00 -2.81 2.96 8.25 -0.86 -4.97 115.22 115.13 3d3f n HIS 225 Ca -0.01 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.38 3d3f n HIS 225 Cb 0.15 -0.25 0.02 0.00 1.12 0.00 0.00 29.99 31.04 3d3f n HIS 225 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3d3f n GLY 226 N 1.47 0.48 3.34 -1.41 0.00 0.17 -5.05 105.19 104.20 3d3f n GLY 226 Ca 0.07 -0.39 -0.34 0.00 0.00 0.00 0.00 46.02 45.35 3d3f n GLY 226 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d3f s VAL 227 N -3.10 3.37 0.39 1.61 1.01 -0.40 -4.75 120.40 118.53 3d3f s VAL 227 Ca 0.17 -0.51 -0.27 0.00 0.00 0.00 0.00 61.98 61.37 3d3f s VAL 227 Cb -0.07 -2.50 -0.10 0.00 0.00 0.00 0.00 36.38 33.70 3d3f s VAL 227 CO 0.22 0.45 1.43 0.52 0.00 0.00 0.00 175.10 177.72 3d3f n VAL 228 N 4.39 2.24 -4.01 2.92 0.31 -1.00 -4.19 118.33 118.99 3d3f n VAL 228 Ca -0.18 -0.50 -0.11 0.00 -0.01 0.00 0.00 64.34 63.54 3d3f n VAL 228 Cb 0.51 -1.85 -0.12 0.00 -0.91 0.00 0.00 33.84 31.48 3d3f n VAL 228 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3d3f s THR 229 N -1.14 0.25 -0.40 2.52 -1.32 0.23 -0.70 115.64 115.08 3d3f s THR 229 Ca 0.56 -0.81 0.10 0.00 -1.21 0.00 0.00 61.69 60.34 3d3f s THR 229 Cb -0.49 -0.34 0.32 0.00 -1.51 0.00 0.00 72.50 70.48 3d3f s THR 229 CO 0.62 -0.36 0.68 2.30 -2.21 0.00 0.00 174.62 175.64 3d3f n ILE 230 N 1.83 -0.09 -1.65 5.08 -5.35 -1.24 -0.37 119.36 117.57 3d3f n ILE 230 Ca -0.21 -4.48 -0.38 0.00 -0.27 0.00 0.00 62.75 57.40 3d3f n ILE 230 Cb 0.56 -0.90 0.05 0.00 -1.74 0.00 0.00 39.64 37.60 3d3f n ILE 230 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 3d3f n PRO 231 N 0.62 1.09 -4.19 6.28 -0.04 -1.17 -2.48 135.00 135.11 3d3f n PRO 231 Ca 0.24 0.42 -0.34 0.00 -0.04 0.00 0.00 63.50 63.77 3d3f n PRO 231 Cb 0.60 -2.26 -0.10 0.00 -0.04 0.00 0.00 33.50 31.70 3d3f n PRO 231 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 3d3f s LYS 232 N -2.77 3.65 -0.12 0.54 2.36 -1.26 -1.94 119.74 120.20 3d3f s LYS 232 Ca 0.75 -0.40 -0.14 0.00 -2.55 0.00 0.00 55.97 53.63 3d3f s LYS 232 Cb -0.43 -3.04 0.04 0.00 -1.05 0.00 0.00 37.83 33.35 3d3f s LYS 232 CO 0.48 0.39 0.38 0.45 1.55 0.00 0.00 175.35 178.59 3d3f s SER 233 N 0.02 -0.37 0.00 1.43 0.15 -1.26 -5.00 113.70 108.66 3d3f s SER 233 Ca 0.04 0.66 0.19 0.00 0.70 0.00 0.00 55.95 57.54 3d3f s SER 233 Cb -0.13 0.71 0.54 0.00 -1.71 0.00 0.00 66.02 65.43 3d3f s SER 233 CO 0.02 -0.20 1.43 2.30 1.20 0.00 0.00 173.24 177.99 3d3f n ILE 234 N 2.55 0.46 -4.04 6.45 -5.35 -1.26 -4.85 119.36 113.32 3d3f n ILE 234 Ca -0.15 -0.55 -0.34 0.00 -0.27 0.00 0.00 62.75 61.44 3d3f n ILE 234 Cb 0.57 0.47 -0.15 0.00 -1.74 0.00 0.00 39.64 38.79 3d3f n ILE 234 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 3d3f s LYS 235 N -1.54 3.21 0.45 6.28 1.02 -1.26 -4.91 119.74 122.98 3d3f s LYS 235 Ca 0.33 -0.72 0.18 0.00 0.02 0.00 0.00 55.97 55.78 3d3f s LYS 235 Cb 0.18 -2.80 1.13 0.00 -0.52 0.00 0.00 37.83 35.81 3d3f s LYS 235 CO 0.25 -0.19 1.94 1.49 -0.92 0.00 0.00 175.35 177.92 3d3f h GLU 236 N 7.98 0.32 -0.25 1.68 4.81 -1.96 -0.13 114.58 127.03 3d3f h GLU 236 Ca -0.43 -0.02 -0.20 0.00 -0.13 0.00 0.00 59.36 58.59 3d3f h GLU 236 Cb 1.15 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.47 3d3f h GLU 236 CO 0.62 0.21 -0.61 1.12 -0.73 0.00 0.00 179.01 179.62 3d3f h HIS 237 N 0.33 1.09 -0.65 0.92 2.07 -1.99 -1.69 115.15 115.23 3d3f h HIS 237 Ca 0.34 -0.41 -0.02 0.00 -2.85 0.00 0.00 60.37 57.44 3d3f h HIS 237 Cb 0.88 -0.20 -0.03 0.00 2.57 0.00 0.00 27.41 30.63 3d3f h HIS 237 CO -0.00 1.25 0.35 0.00 -3.07 0.00 0.00 177.93 176.45 3d3f h ARG 238 N 0.64 0.91 0.13 5.12 -0.00 -1.51 0.35 114.38 120.02 3d3f h ARG 238 Ca -0.00 -0.11 0.01 0.00 -0.50 0.00 0.00 59.98 59.37 3d3f h ARG 238 Cb 1.22 -0.18 -0.01 0.00 0.00 0.00 0.00 29.97 31.00 3d3f h ARG 238 CO 0.13 0.70 -0.14 0.82 0.00 0.00 0.00 179.97 181.48 3d3f h ILE 239 N 0.89 0.69 -0.01 2.04 2.04 -1.05 0.33 117.51 122.42 3d3f h ILE 239 Ca 0.23 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.10 3d3f h ILE 239 Cb 0.06 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 3d3f h ILE 239 CO -0.03 0.00 -0.08 0.40 0.00 0.00 0.00 178.15 178.44 3d3f h ILE 240 N -0.30 0.80 0.17 -0.67 2.04 -1.29 -2.97 117.51 115.29 3d3f h ILE 240 Ca 0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.87 3d3f h ILE 240 Cb 0.29 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 3d3f h ILE 240 CO -0.05 0.00 -0.42 -0.08 0.00 0.00 0.00 178.15 177.61 3d3f h GLU 241 N -0.12 -0.62 -1.00 2.37 4.81 -0.67 -2.67 114.58 116.67 3d3f h GLU 241 Ca 0.04 0.04 0.40 0.00 -0.13 0.00 0.00 59.36 59.70 3d3f h GLU 241 Cb 0.17 0.14 -0.18 0.00 0.63 0.00 0.00 28.75 29.51 3d3f h GLU 241 CO -0.09 -0.41 0.50 -0.91 -0.73 0.00 0.00 179.01 177.36 3d3f h ASN 242 N -0.65 0.27 1.02 1.04 2.35 -0.39 0.13 115.58 119.35 3d3f h ASN 242 Ca -0.02 0.25 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 3d3f h ASN 242 Cb 0.62 0.28 0.00 0.00 0.05 0.00 0.00 38.32 39.27 3d3f h ASN 242 CO -0.19 -0.40 -0.08 0.00 -1.65 0.00 0.00 177.43 175.11 3d3f n ALA 243 N -2.34 2.49 -1.30 -0.83 0.00 -1.03 -4.43 120.51 113.07 3d3f n ALA 243 Ca 0.36 -0.12 -0.26 0.00 0.00 0.00 0.00 53.44 53.42 3d3f n ALA 243 Cb 1.21 -1.42 -0.09 0.00 0.00 0.00 0.00 19.45 19.16 3d3f n ALA 243 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3d3f n ASP 244 N -1.66 6.86 -0.03 0.00 2.03 0.44 -4.25 116.55 119.94 3d3f n ASP 244 Ca 0.06 -2.71 0.00 0.00 0.52 0.00 0.00 54.79 52.67 3d3f n ASP 244 Cb 0.36 -1.42 0.01 0.00 -0.72 0.00 0.00 41.12 39.34 3d3f n ASP 244 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 3d3f n ILE 245 N 2.47 0.80 0.23 5.18 -5.35 -1.26 -4.73 119.36 116.69 3d3f n ILE 245 Ca 0.57 -0.90 0.11 0.00 -0.27 0.00 0.00 62.75 62.27 3d3f n ILE 245 Cb 0.57 0.60 0.26 0.00 -1.74 0.00 0.00 39.64 39.33 3d3f n ILE 245 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3d3f n PHE 246 N -0.35 0.62 -1.44 4.28 3.01 -1.26 -4.27 117.46 118.04 3d3f n PHE 246 Ca 0.01 -0.31 0.07 0.00 1.01 0.00 0.00 57.45 58.23 3d3f n PHE 246 Cb 0.21 0.00 0.14 0.00 -0.01 0.00 0.00 39.48 39.82 3d3f n PHE 246 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 3d3f n ASP 247 N 1.40 1.80 -3.77 4.37 5.75 -1.26 -4.90 116.55 119.94 3d3f n ASP 247 Ca 0.20 -3.18 -0.06 0.00 -0.01 0.00 0.00 54.79 51.74 3d3f n ASP 247 Cb 0.57 -0.43 -0.01 0.00 -1.03 0.00 0.00 41.12 40.22 3d3f n ASP 247 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 3d3f s PHE 248 N -2.51 -0.15 -0.05 2.11 -0.12 -1.26 -5.18 117.98 110.81 3d3f s PHE 248 Ca 0.31 -0.29 -0.21 0.00 -0.05 0.00 0.00 56.93 56.70 3d3f s PHE 248 Cb 0.29 0.70 0.04 0.00 -0.63 0.00 0.00 43.02 43.42 3d3f s PHE 248 CO -0.02 -1.16 0.47 -1.83 -0.05 0.00 0.00 175.22 172.63 3d3f s GLU 249 N -3.63 0.79 0.09 1.99 -1.05 -1.26 -5.05 118.70 110.58 3d3f s GLU 249 Ca 0.12 0.09 -0.23 0.00 -0.15 0.00 0.00 54.97 54.80 3d3f s GLU 249 Cb -0.05 0.37 -0.07 0.00 -0.44 0.00 0.00 34.13 33.94 3d3f s GLU 249 CO 0.06 -0.22 0.70 -0.51 0.95 0.00 0.00 175.26 176.24 3d3f s LEU 250 N -1.05 4.52 0.00 1.83 1.02 -1.26 -5.09 118.68 118.66 3d3f s LEU 250 Ca -0.11 1.44 -0.13 0.00 0.02 0.00 0.00 54.13 55.35 3d3f s LEU 250 Cb -0.03 -3.13 0.18 0.00 0.02 0.00 0.00 46.19 43.23 3d3f s LEU 250 CO 0.06 0.17 1.04 -1.54 0.02 0.00 0.00 176.35 176.10 3d3f n SER 251 N 2.05 0.10 -0.09 2.29 3.41 -1.26 -4.82 113.62 115.30 3d3f n SER 251 Ca -0.06 -1.39 -0.13 0.00 -0.26 0.00 0.00 58.87 57.03 3d3f n SER 251 Cb 0.50 -0.80 -0.05 0.00 -0.26 0.00 0.00 64.21 63.61 3d3f n SER 251 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 3d3f h GLN 252 N 0.00 0.64 -0.04 4.33 5.75 -1.99 -1.73 115.11 122.07 3d3f h GLN 252 Ca -0.34 -0.33 0.02 0.00 -0.15 0.00 0.00 58.65 57.85 3d3f h GLN 252 Cb 0.93 0.01 -0.05 0.00 1.07 0.00 0.00 27.48 29.44 3d3f h GLN 252 CO 0.24 0.93 -0.45 0.93 -2.65 0.00 0.00 178.83 177.83 3d3f h GLU 253 N 0.37 -0.51 -0.47 1.69 5.08 -1.99 -1.67 114.58 117.08 3d3f h GLU 253 Ca 0.05 0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.49 3d3f h GLU 253 Cb 0.80 0.12 -0.07 0.00 0.50 0.00 0.00 28.75 30.10 3d3f h GLU 253 CO 0.06 -0.34 -0.39 -0.44 -1.00 0.00 0.00 179.01 176.90 3d3f h ASP 254 N -0.53 -1.36 -0.71 1.42 3.45 -1.92 0.52 116.42 117.29 3d3f h ASP 254 Ca 0.02 0.19 0.16 0.00 0.43 0.00 0.00 57.03 57.82 3d3f h ASP 254 Cb 0.59 0.58 -0.12 0.00 -0.56 0.00 0.00 39.33 39.82 3d3f h ASP 254 CO -0.32 -0.22 0.07 0.24 -1.57 0.00 0.00 179.24 177.44 3d3f h MET 255 N -0.14 0.16 -0.27 3.56 2.86 -1.08 0.13 114.93 120.14 3d3f h MET 255 Ca 0.08 -0.01 -0.12 0.00 -2.06 0.00 0.00 59.70 57.59 3d3f h MET 255 Cb 0.34 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 3d3f h MET 255 CO -0.51 0.11 -0.32 -0.44 1.06 0.00 0.00 176.91 176.80 3d3f h ASP 256 N 0.17 0.59 -0.30 1.22 3.32 -1.01 -0.95 116.42 119.46 3d3f h ASP 256 Ca 0.39 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3d3f h ASP 256 Cb 0.67 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 3d3f h ASP 256 CO -0.57 0.88 0.19 0.11 -1.72 0.00 0.00 179.24 178.13 3d3f h LYS 257 N 0.49 0.40 0.57 3.56 1.57 0.79 -0.66 116.57 123.30 3d3f h LYS 257 Ca 0.06 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 3d3f h LYS 257 Cb 0.79 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 33.02 3d3f h LYS 257 CO 0.06 0.28 -0.28 0.82 -0.57 0.00 0.00 179.45 179.77 3d3f h ILE 258 N 0.39 0.00 -0.50 1.86 2.04 -0.86 -2.88 117.51 117.56 3d3f h ILE 258 Ca 0.11 -0.30 0.09 0.00 1.00 0.00 0.00 64.86 65.76 3d3f h ILE 258 Cb -0.02 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 35.97 3d3f h ILE 258 CO -0.02 0.00 -0.17 0.47 0.00 0.00 0.00 178.15 178.43 3d3f n ASP 259 N -4.90 -0.27 0.15 1.72 9.92 -0.38 -0.32 116.55 122.47 3d3f n ASP 259 Ca -0.10 0.87 0.17 0.00 -0.53 0.00 0.00 54.79 55.21 3d3f n ASP 259 Cb 0.30 -0.23 0.77 0.00 -0.64 0.00 0.00 41.12 41.33 3d3f n ASP 259 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3d3f h ALA 260 N 0.82 2.01 -0.79 2.24 0.00 -0.89 -1.05 119.26 121.60 3d3f h ALA 260 Ca 0.20 -0.01 0.23 0.00 0.00 0.00 0.00 54.91 55.33 3d3f h ALA 260 Cb 0.33 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3d3f h ALA 260 CO -0.51 -0.40 1.07 -0.07 0.00 0.00 0.00 179.25 179.35 3d3f h LEU 261 N 0.00 0.00 -9.44 0.00 3.38 -0.63 -3.46 115.31 105.16 3d3f h LEU 261 Ca 0.13 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.52 3d3f h LEU 261 Cb 0.64 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.43 3d3f h LEU 261 CO -0.00 0.00 0.98 -3.20 0.09 0.00 0.00 178.44 176.31 3d3f n ASN 262 N -3.19 3.48 -0.12 -0.43 5.15 -0.28 -4.45 115.26 115.42 3d3f n ASN 262 Ca 0.17 1.02 0.08 0.00 -0.60 0.00 0.00 54.58 55.26 3d3f n ASN 262 Cb 1.32 -1.45 0.11 0.00 -0.53 0.00 0.00 39.78 39.24 3d3f n ASN 262 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3d3f n LYS 263 N 4.98 1.21 -3.54 1.20 5.02 0.27 -4.94 118.16 122.37 3d3f n LYS 263 Ca 0.19 -2.29 -0.26 0.00 -2.02 0.00 0.00 58.31 53.92 3d3f n LYS 263 Cb 0.31 -1.33 0.01 0.00 -0.02 0.00 0.00 35.03 34.00 3d3f n LYS 263 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3d3f n ASP 264 N -1.19 -4.44 -4.46 4.39 8.00 -0.39 -4.92 116.55 113.54 3d3f n ASP 264 Ca 0.13 -0.53 -0.35 0.00 0.71 0.00 0.00 54.79 54.74 3d3f n ASP 264 Cb 0.62 -3.61 -0.12 0.00 -0.02 0.00 0.00 41.12 37.99 3d3f n ASP 264 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3d3f s GLU 265 N -6.21 3.65 -0.09 -1.24 2.12 -0.86 -4.98 118.70 111.09 3d3f s GLU 265 Ca 0.49 -0.50 -0.04 0.00 0.36 0.00 0.00 54.97 55.29 3d3f s GLU 265 Cb -0.25 -3.16 -0.04 0.00 0.26 0.00 0.00 34.13 30.95 3d3f s GLU 265 CO 0.61 -0.03 0.07 1.03 -0.54 0.00 0.00 175.26 176.40 3d3f s ARG 266 N 1.13 3.18 0.09 4.30 0.52 -1.26 -4.24 118.95 122.67 3d3f s ARG 266 Ca 0.03 -0.30 0.24 0.00 -0.52 0.00 0.00 55.73 55.18 3d3f s ARG 266 Cb -0.14 -2.97 0.21 0.00 0.52 0.00 0.00 34.95 32.57 3d3f s ARG 266 CO 0.02 0.73 1.18 1.33 0.02 0.00 0.00 175.30 178.58 3d3f n VAL 267 N 1.96 0.26 -4.64 3.52 0.24 -1.26 -5.00 118.33 113.42 3d3f n VAL 267 Ca -0.19 -0.26 -0.31 0.00 -2.04 0.00 0.00 64.34 61.55 3d3f n VAL 267 Cb 0.54 0.03 -0.08 0.00 -1.47 0.00 0.00 33.84 32.86 3d3f n VAL 267 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3d3f s GLY 268 N -3.65 2.84 0.80 7.63 0.00 -1.26 -5.11 107.32 108.57 3d3f s GLY 268 Ca 0.05 -0.92 -0.14 0.00 0.00 0.00 0.00 44.72 43.70 3d3f s GLY 268 CO 0.76 -2.15 0.78 -1.05 0.00 0.00 0.00 173.10 171.44 3d3f n PRO 269 N -1.24 0.16 -3.01 2.90 -0.02 -1.26 -4.99 135.00 127.54 3d3f n PRO 269 Ca -0.14 0.11 -0.40 0.00 -2.02 0.00 0.00 63.50 61.05 3d3f n PRO 269 Cb 0.67 -2.08 -0.05 0.00 -0.02 0.00 0.00 33.50 32.01 3d3f n PRO 269 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3d3f s ASN 270 N -1.82 7.20 0.48 2.55 3.04 -1.26 -4.97 114.94 120.16 3d3f s ASN 270 Ca 0.67 1.43 0.14 0.00 0.04 0.00 0.00 52.86 55.14 3d3f s ASN 270 Cb -0.30 -2.46 1.13 0.00 -1.54 0.00 0.00 41.25 38.08 3d3f s ASN 270 CO 0.57 0.04 2.10 1.55 -3.04 0.00 0.00 177.10 178.33 3d3f h PRO 271 N 5.54 0.13 0.00 0.43 0.13 -1.94 -2.27 132.00 134.02 3d3f h PRO 271 Ca -0.44 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3d3f h PRO 271 Cb 1.20 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3d3f h PRO 271 CO 0.70 0.11 0.00 -0.44 -0.23 0.00 0.00 178.00 178.15 3d3f h ASP 272 N 0.13 0.00 0.13 1.44 3.32 -1.93 -3.30 116.42 116.21 3d3f h ASP 272 Ca 0.04 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.84 3d3f h ASP 272 Cb 0.03 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.54 3d3f h ASP 272 CO -0.00 0.00 -2.11 -0.62 -1.72 0.00 0.00 179.24 174.79 3d3f n GLU 273 N -2.86 0.67 -2.60 3.56 1.02 -0.91 -4.81 120.64 114.70 3d3f n GLU 273 Ca 0.03 -0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.74 3d3f n GLU 273 Cb 0.44 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 30.28 3d3f n GLU 273 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 3d3f n LEU 274 N -2.67 5.17 -4.30 -4.62 7.94 -0.90 -4.90 117.00 112.71 3d3f n LEU 274 Ca -0.22 -4.07 -0.45 0.00 -1.11 0.00 0.00 56.01 50.16 3d3f n LEU 274 Cb 0.97 -1.71 -0.03 0.00 0.53 0.00 0.00 43.42 43.18 3d3f n LEU 274 CO 0.44 0.37 0.40 -0.76 -1.11 0.00 0.00 177.39 176.73 3d3f s LEU 275 N 3.40 6.53 0.00 -1.96 1.43 -1.26 -4.37 118.68 122.44 3d3f s LEU 275 Ca 0.51 -2.80 0.25 0.00 -1.03 0.00 0.00 54.13 51.06 3d3f s LEU 275 Cb 0.03 -2.16 0.41 0.00 0.03 0.00 0.00 46.19 44.50 3d3f s LEU 275 CO 0.05 -0.52 1.39 2.22 0.23 0.00 0.00 176.35 179.72