#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ktx h GLN 2 N 0.00 0.67 0.06 -1.46 5.75 -1.99 -1.50 115.11 116.65 3ktx h GLN 2 Ca 0.00 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.46 3ktx h GLN 2 Cb 0.00 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 28.40 3ktx h GLN 2 CO 0.00 0.45 -0.03 1.25 -2.65 0.00 0.00 178.83 177.85 3ktx h LEU 3 N 0.70 -0.07 -0.91 -2.39 6.46 -2.00 0.22 115.31 117.32 3ktx h LEU 3 Ca 0.25 -0.06 -0.03 0.00 -0.12 0.00 0.00 57.88 57.92 3ktx h LEU 3 Cb 0.14 0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 40.05 3ktx h LEU 3 CO -0.07 0.01 0.39 0.00 -0.62 0.00 0.00 178.44 178.15 3ktx h ALA 4 N 0.79 1.14 -0.77 1.25 0.00 -2.00 -2.52 119.26 117.15 3ktx h ALA 4 Ca -0.01 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 3ktx h ALA 4 Cb 0.12 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 3ktx h ALA 4 CO 0.01 0.65 0.27 1.25 0.00 0.00 0.00 179.25 181.43 3ktx h HIS 5 N 1.16 1.21 -0.82 0.00 -0.00 -0.59 -2.15 115.15 113.97 3ktx h HIS 5 Ca 0.28 -0.11 0.19 0.00 -0.00 0.00 0.00 60.37 60.73 3ktx h HIS 5 Cb 0.12 -0.36 -0.05 0.00 -0.00 0.00 0.00 27.41 27.12 3ktx h HIS 5 CO 0.01 0.94 0.55 -0.91 -0.00 0.00 0.00 177.93 178.52 3ktx h ASN 6 N 1.14 0.32 0.32 3.26 2.35 -0.15 -2.27 115.58 120.55 3ktx h ASN 6 Ca 0.25 0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.99 3ktx h ASN 6 Cb 0.27 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 3ktx h ASN 6 CO -0.01 0.15 -0.20 -0.07 -1.65 0.00 0.00 177.43 175.64 3ktx h LEU 7 N 0.33 0.00 -0.82 1.61 3.38 -1.21 -2.61 115.31 115.98 3ktx h LEU 7 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 3ktx h LEU 7 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3ktx h LEU 7 CO -0.12 0.20 -0.31 0.35 0.09 0.00 0.00 178.44 178.65 3ktx n THR 8 N -3.96 0.00 -2.88 0.22 -2.24 -0.86 -4.96 114.28 99.60 3ktx n THR 8 Ca -0.02 -0.21 -0.30 0.00 -2.27 0.00 0.00 64.05 61.25 3ktx n THR 8 Cb 0.28 0.81 -0.03 0.00 -2.10 0.00 0.00 70.33 69.29 3ktx n THR 8 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3ktx s LEU 9 N -2.42 3.85 -0.04 3.22 1.43 -0.99 -5.08 118.68 118.64 3ktx s LEU 9 Ca 0.23 1.12 0.00 0.00 -1.03 0.00 0.00 54.13 54.46 3ktx s LEU 9 Cb 0.19 -4.00 0.02 0.00 0.03 0.00 0.00 46.19 42.44 3ktx s LEU 9 CO 0.51 -0.39 -0.02 -0.55 0.23 0.00 0.00 176.35 176.14 3ktx s SER 10 N -3.14 0.91 0.00 2.29 0.15 -1.26 -5.02 113.70 107.64 3ktx s SER 10 Ca 0.51 -0.08 0.14 0.00 0.70 0.00 0.00 55.95 57.21 3ktx s SER 10 Cb -0.10 -0.37 0.63 0.00 -1.71 0.00 0.00 66.02 64.46 3ktx s SER 10 CO 0.31 -0.10 1.41 2.30 1.20 0.00 0.00 173.24 178.36 3ktx n ILE 11 N 4.32 0.90 1.33 6.45 -5.35 -1.26 -1.80 119.36 123.95 3ktx n ILE 11 Ca -0.21 0.23 0.13 0.00 -0.27 0.00 0.00 62.75 62.62 3ktx n ILE 11 Cb 0.50 -0.99 0.38 0.00 -1.74 0.00 0.00 39.64 37.79 3ktx n ILE 11 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3ktx n PHE 12 N -1.42 0.00 -1.90 4.28 3.72 -1.26 -4.91 117.46 115.96 3ktx n PHE 12 Ca 0.04 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.13 3ktx n PHE 12 Cb 0.14 -0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.70 3ktx n PHE 12 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3ktx s ASP 13 N -2.01 5.74 0.56 4.37 1.01 -0.75 -5.03 116.67 120.57 3ktx s ASP 13 Ca 0.34 1.70 -0.19 0.00 0.71 0.00 0.00 52.55 55.12 3ktx s ASP 13 Cb 0.21 -2.51 -0.05 0.00 1.01 0.00 0.00 42.92 41.57 3ktx s ASP 13 CO 0.33 -1.19 1.14 -2.16 0.21 0.00 0.00 175.17 173.49 3ktx s PRO 14 N -4.47 3.23 0.73 8.23 0.05 -1.26 -5.02 135.00 136.49 3ktx s PRO 14 Ca 0.61 1.63 -0.12 0.00 0.05 0.00 0.00 61.00 63.16 3ktx s PRO 14 Cb -0.14 -1.99 0.03 0.00 0.05 0.00 0.00 34.50 32.45 3ktx s PRO 14 CO 0.43 -0.95 1.10 0.14 0.05 0.00 0.00 177.00 177.77 3ktx s VAL 15 N -1.80 3.31 0.83 -0.36 -7.23 -1.26 -5.01 120.40 108.88 3ktx s VAL 15 Ca 0.73 0.49 -0.15 0.00 -1.81 0.00 0.00 61.98 61.24 3ktx s VAL 15 Cb -0.25 -3.00 -0.03 0.00 0.56 0.00 0.00 36.38 33.66 3ktx s VAL 15 CO 0.29 -0.49 0.27 0.00 -0.31 0.00 0.00 175.10 174.86 3ktx n ALA 16 N -3.07 -2.53 1.36 1.32 0.00 -1.26 -4.90 120.51 111.42 3ktx n ALA 16 Ca 0.10 -0.42 0.04 0.00 0.00 0.00 0.00 53.44 53.16 3ktx n ALA 16 Cb 0.53 -1.71 0.15 0.00 0.00 0.00 0.00 19.45 18.41 3ktx n ALA 16 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3ktx n ASN 17 N 0.02 1.11 -3.74 0.00 2.04 -1.26 -4.87 115.26 108.56 3ktx n ASN 17 Ca 0.07 -1.94 -0.12 0.00 -0.44 0.00 0.00 54.58 52.16 3ktx n ASN 17 Cb 0.52 -0.13 -0.07 0.00 -2.53 0.00 0.00 39.78 37.57 3ktx n ASN 17 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 3ktx s TYR 18 N -1.74 -0.13 -0.16 -2.53 -0.85 -1.26 -5.02 117.35 105.66 3ktx s TYR 18 Ca 0.17 0.02 -0.02 0.00 -0.52 0.00 0.00 57.07 56.71 3ktx s TYR 18 Cb 0.09 0.11 -0.01 0.00 0.38 0.00 0.00 41.96 42.52 3ktx s TYR 18 CO 0.12 -0.51 -0.09 0.50 -1.52 0.00 0.00 175.55 174.05 3ktx s ARG 19 N -2.48 3.43 -0.10 -3.49 3.52 -1.26 -4.98 118.95 113.59 3ktx s ARG 19 Ca -0.05 -0.64 -0.14 0.00 -0.13 0.00 0.00 55.73 54.77 3ktx s ARG 19 Cb -0.01 -2.79 -0.27 0.00 -1.56 0.00 0.00 34.95 30.32 3ktx s ARG 19 CO -0.03 0.10 0.53 0.00 -0.81 0.00 0.00 175.30 175.09 3ktx h ALA 20 N 7.11 0.22 -2.59 6.12 0.00 -1.95 -3.44 119.26 124.73 3ktx h ALA 20 Ca -0.31 -1.16 -0.53 0.00 0.00 0.00 0.00 54.91 52.91 3ktx h ALA 20 Cb 1.19 0.52 0.15 0.00 0.00 0.00 0.00 17.79 19.65 3ktx h ALA 20 CO 0.59 0.94 0.37 0.00 0.00 0.00 0.00 179.25 181.15 3ktx s ALA 21 N -2.51 2.15 0.02 0.00 0.00 -1.26 -0.98 121.76 119.19 3ktx s ALA 21 Ca -0.20 0.76 0.06 0.00 0.00 0.00 0.00 51.96 52.58 3ktx s ALA 21 Cb 0.05 -3.43 -0.03 0.00 0.00 0.00 0.00 23.12 19.71 3ktx s ALA 21 CO 0.78 -1.81 -0.17 1.03 0.00 0.00 0.00 175.76 175.59 3ktx s ARG 22 N -4.04 2.16 -0.18 0.00 1.81 -0.06 -4.91 118.95 113.73 3ktx s ARG 22 Ca 0.72 -0.92 -0.03 0.00 -1.72 0.00 0.00 55.73 53.77 3ktx s ARG 22 Cb -0.26 -2.22 -0.02 0.00 -0.45 0.00 0.00 34.95 32.00 3ktx s ARG 22 CO 0.46 0.56 -0.05 0.42 -0.68 0.00 0.00 175.30 176.00 3ktx s ILE 23 N -0.88 3.52 -0.16 1.52 1.01 -1.26 -1.35 121.20 123.60 3ktx s ILE 23 Ca 0.14 -0.47 -0.05 0.00 0.00 0.00 0.00 60.65 60.27 3ktx s ILE 23 Cb -0.10 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.77 3ktx s ILE 23 CO 0.04 0.46 0.00 -0.63 0.00 0.00 0.00 174.94 174.82 3ktx s ILE 24 N 0.91 4.27 -0.04 2.92 1.01 -0.69 -0.71 121.20 128.88 3ktx s ILE 24 Ca -0.01 -0.23 0.06 0.00 0.00 0.00 0.00 60.65 60.48 3ktx s ILE 24 Cb -0.15 -2.88 -0.01 0.00 0.01 0.00 0.00 42.46 39.43 3ktx s ILE 24 CO 0.01 0.49 -0.23 0.00 0.00 0.00 0.00 174.94 175.21 3ktx s THR 26 N -0.30 4.96 0.09 0.00 2.01 -0.84 0.91 115.64 122.48 3ktx s THR 26 Ca 0.02 1.59 -0.24 0.00 0.31 0.00 0.00 61.69 63.37 3ktx s THR 26 Cb -0.11 -4.11 -0.07 0.00 0.01 0.00 0.00 72.50 68.22 3ktx s THR 26 CO 0.01 0.16 0.72 -0.63 -0.69 0.00 0.00 174.62 174.19 3ktx s ILE 27 N 1.34 4.61 0.00 1.82 -1.09 -0.09 -2.87 121.20 124.91 3ktx s ILE 27 Ca 0.40 1.55 0.00 0.00 -2.23 0.00 0.00 60.65 60.36 3ktx s ILE 27 Cb -0.18 -4.07 0.00 0.00 -1.58 0.00 0.00 42.46 36.64 3ktx s ILE 27 CO 0.17 0.47 0.00 0.61 -1.23 0.00 0.00 174.94 174.96 3ktx n GLY 28 N 1.96 3.92 0.22 6.18 0.00 -1.22 -4.64 105.19 111.62 3ktx n GLY 28 Ca -0.06 -0.98 0.05 0.00 0.00 0.00 0.00 46.02 45.04 3ktx n GLY 28 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ktx h PRO 29 N 0.00 0.00 0.00 1.61 0.11 -1.84 0.33 132.00 132.21 3ktx h PRO 29 Ca 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 3ktx h PRO 29 Cb 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.11 3ktx h PRO 29 CO 0.00 0.18 -0.09 0.77 -0.21 0.00 0.00 178.00 178.65 3ktx h SER 30 N 0.00 0.00 0.00 -2.05 0.02 -1.72 -3.37 113.55 106.43 3ktx h SER 30 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3ktx h SER 30 Cb 0.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.86 3ktx h SER 30 CO 0.02 0.09 0.00 0.35 -1.14 0.00 0.00 176.83 176.15 3ktx n THR 31 N -3.56 0.19 0.29 -2.27 -2.24 0.95 -4.79 114.28 102.85 3ktx n THR 31 Ca -0.02 -0.35 0.14 0.00 -2.27 0.00 0.00 64.05 61.56 3ktx n THR 31 Cb 0.21 1.21 0.44 0.00 -2.10 0.00 0.00 70.33 70.09 3ktx n THR 31 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 3ktx h GLN 32 N 0.00 0.00 -7.20 -0.78 4.15 -1.18 -3.31 115.11 106.80 3ktx h GLN 32 Ca 0.00 0.00 -0.48 0.00 0.77 0.00 0.00 58.65 58.94 3ktx h GLN 32 Cb 0.44 0.00 0.03 0.00 0.21 0.00 0.00 27.48 28.16 3ktx h GLN 32 CO 0.00 0.00 0.38 -1.54 -1.93 0.00 0.00 178.83 175.74 3ktx s SER 33 N -5.70 6.38 0.28 -0.69 1.04 -1.26 -4.81 113.70 108.93 3ktx s SER 33 Ca 0.04 1.64 0.01 0.00 0.48 0.00 0.00 55.95 58.13 3ktx s SER 33 Cb 0.08 -2.51 0.59 0.00 0.10 0.00 0.00 66.02 64.27 3ktx s SER 33 CO 0.59 -0.76 1.78 -0.37 0.98 0.00 0.00 173.24 175.46 3ktx h VAL 34 N 0.75 0.77 -0.39 5.02 -1.51 -1.89 -0.75 116.25 118.24 3ktx h VAL 34 Ca -0.47 -0.26 -0.09 0.00 -1.23 0.00 0.00 66.70 64.65 3ktx h VAL 34 Cb 1.19 -0.05 -0.02 0.00 -2.13 0.00 0.00 31.29 30.29 3ktx h VAL 34 CO 0.60 0.14 -0.14 -0.33 -1.23 0.00 0.00 177.57 176.61 3ktx h GLU 35 N 0.76 0.72 -0.05 5.19 4.39 -1.95 -0.68 114.58 122.95 3ktx h GLU 35 Ca 0.50 -0.25 -0.19 0.00 0.34 0.00 0.00 59.36 59.77 3ktx h GLU 35 Cb 0.68 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.27 3ktx h GLU 35 CO -0.34 0.83 -0.76 0.00 -1.16 0.00 0.00 179.01 177.57 3ktx h ALA 36 N 1.20 0.59 -0.59 3.43 0.00 -1.65 -1.36 119.26 120.89 3ktx h ALA 36 Ca 0.11 -0.63 -0.08 0.00 0.00 0.00 0.00 54.91 54.30 3ktx h ALA 36 Cb 0.61 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 3ktx h ALA 36 CO 0.04 0.79 0.05 -0.07 0.00 0.00 0.00 179.25 180.06 3ktx h LEU 37 N 0.22 0.95 -0.53 0.00 3.38 -0.86 -0.51 115.31 117.96 3ktx h LEU 37 Ca -0.03 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 3ktx h LEU 37 Cb 1.34 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.82 3ktx h LEU 37 CO 0.13 0.98 0.22 0.11 0.09 0.00 0.00 178.44 179.97 3ktx h LYS 38 N 0.92 0.79 -0.81 1.13 1.57 -0.87 -0.49 116.57 118.81 3ktx h LYS 38 Ca 0.18 -0.14 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 3ktx h LYS 38 Cb 0.47 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.61 3ktx h LYS 38 CO 0.02 0.68 0.52 0.78 -0.57 0.00 0.00 179.45 180.89 3ktx h GLY 39 N 0.72 1.14 0.61 3.86 0.00 -0.95 -1.23 103.07 107.23 3ktx h GLY 39 Ca 0.18 -0.44 0.04 0.00 0.00 0.00 0.00 47.33 47.11 3ktx h GLY 39 CO -0.02 0.43 -0.01 1.41 0.00 0.00 0.00 176.54 178.35 3ktx h LEU 40 N 1.10 -0.12 0.33 3.11 4.07 -0.50 -0.34 115.31 122.96 3ktx h LEU 40 Ca 0.29 0.06 -0.01 0.00 0.08 0.00 0.00 57.88 58.31 3ktx h LEU 40 Cb -0.11 0.11 -0.01 0.00 1.08 0.00 0.00 40.66 41.73 3ktx h LEU 40 CO -0.06 -0.03 -0.26 0.40 -1.08 0.00 0.00 178.44 177.41 3ktx h ILE 41 N 0.06 0.46 -0.02 1.22 2.04 -0.85 -0.51 117.51 119.91 3ktx h ILE 41 Ca 0.11 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.95 3ktx h ILE 41 Cb 0.15 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.69 3ktx h ILE 41 CO -0.20 0.00 -0.08 1.56 0.00 0.00 0.00 178.15 179.42 3ktx h GLN 42 N -0.59 0.03 0.00 2.37 4.20 -1.23 -1.11 115.11 118.78 3ktx h GLN 42 Ca -0.02 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3ktx h GLN 42 Cb 0.52 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.29 3ktx h GLN 42 CO -0.01 0.12 0.00 0.77 -0.67 0.00 0.00 178.83 179.04 3ktx h SER 43 N 0.03 0.00 0.00 1.46 0.02 -0.50 -3.47 113.55 111.10 3ktx h SER 43 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 3ktx h SER 43 Cb 0.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.71 3ktx h SER 43 CO 0.01 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.31 3ktx n GLY 44 N 0.73 0.18 3.72 -3.77 0.00 -0.42 -3.61 105.19 102.01 3ktx n GLY 44 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3ktx n GLY 44 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3ktx s MET 45 N 0.00 4.41 -0.07 1.61 -2.45 -0.32 -4.22 119.30 118.26 3ktx s MET 45 Ca 0.00 1.84 0.12 0.00 -1.25 0.00 0.00 55.69 56.40 3ktx s MET 45 Cb 0.00 -3.32 -0.17 0.00 1.25 0.00 0.00 34.83 32.59 3ktx s MET 45 CO 0.00 -0.28 0.15 0.43 1.05 0.00 0.00 175.02 176.36 3ktx n SER 46 N 3.81 2.07 -3.97 1.11 7.64 0.11 -4.56 113.62 119.83 3ktx n SER 46 Ca 0.09 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.76 3ktx n SER 46 Cb 0.45 1.14 -0.16 0.00 -1.01 0.00 0.00 64.21 64.63 3ktx n SER 46 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3ktx s VAL 47 N -2.55 0.80 -0.34 0.44 1.01 -1.09 -2.07 120.40 116.61 3ktx s VAL 47 Ca -0.05 -0.31 -0.15 0.00 0.00 0.00 0.00 61.98 61.47 3ktx s VAL 47 Cb 0.06 -0.76 -0.01 0.00 0.00 0.00 0.00 36.38 35.66 3ktx s VAL 47 CO 0.51 0.27 0.36 0.00 0.00 0.00 0.00 175.10 176.24 3ktx s ALA 48 N 0.61 3.50 -0.16 5.51 0.00 0.28 -0.04 121.76 131.45 3ktx s ALA 48 Ca -0.10 -1.19 -0.15 0.00 0.00 0.00 0.00 51.96 50.52 3ktx s ALA 48 Cb -0.13 -2.81 -0.04 0.00 0.00 0.00 0.00 23.12 20.14 3ktx s ALA 48 CO 0.01 -1.04 0.36 0.50 0.00 0.00 0.00 175.76 175.60 3ktx s ARG 49 N 2.01 4.25 -0.29 0.00 3.52 0.26 -1.12 118.95 127.59 3ktx s ARG 49 Ca 0.12 0.20 -0.13 0.00 -0.13 0.00 0.00 55.73 55.78 3ktx s ARG 49 Cb -0.16 -3.46 -0.04 0.00 -1.56 0.00 0.00 34.95 29.73 3ktx s ARG 49 CO 0.12 0.13 0.30 -1.64 -0.81 0.00 0.00 175.30 173.40 3ktx s MET 50 N 0.77 3.88 -0.62 5.12 -1.94 0.17 -0.92 119.30 125.76 3ktx s MET 50 Ca 0.19 -0.21 -0.22 0.00 -1.71 0.00 0.00 55.69 53.75 3ktx s MET 50 Cb -0.14 -3.69 0.07 0.00 2.01 0.00 0.00 34.83 33.08 3ktx s MET 50 CO 0.06 -0.30 0.89 1.21 -0.01 0.00 0.00 175.02 176.88 3ktx s ASN 51 N 1.70 6.20 0.00 3.03 2.47 -1.26 -1.55 114.94 125.53 3ktx s ASN 51 Ca 0.11 -0.98 0.08 0.00 0.42 0.00 0.00 52.86 52.49 3ktx s ASN 51 Cb -0.16 -2.39 0.47 0.00 -1.45 0.00 0.00 41.25 37.72 3ktx s ASN 51 CO 0.11 -1.32 1.12 0.49 -3.72 0.00 0.00 177.10 173.78 3ktx n PHE 52 N 7.34 0.00 0.27 0.43 3.01 -0.38 -2.26 117.46 125.87 3ktx n PHE 52 Ca -0.04 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.57 3ktx n PHE 52 Cb 0.45 0.00 0.76 0.00 -0.01 0.00 0.00 39.48 40.68 3ktx n PHE 52 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 3ktx h SER 53 N 0.00 0.00 -4.28 4.37 0.02 -1.85 -3.37 113.55 108.44 3ktx h SER 53 Ca 0.00 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.66 3ktx h SER 53 Cb 0.00 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 62.38 3ktx h SER 53 CO 0.00 0.08 -0.72 -1.00 -1.14 0.00 0.00 176.83 174.06 3ktx s HIS 54 N -3.96 1.09 0.02 3.45 3.76 -0.96 -5.02 115.29 113.67 3ktx s HIS 54 Ca -0.02 -0.77 0.00 0.00 -0.15 0.00 0.00 55.06 54.13 3ktx s HIS 54 Cb 0.11 -0.58 0.00 0.00 1.11 0.00 0.00 32.58 33.22 3ktx s HIS 54 CO 0.55 -0.01 0.00 0.41 -0.85 0.00 0.00 174.74 174.84 3ktx n GLY 55 N 0.11 -2.64 3.98 -2.22 0.00 -1.26 -4.87 105.19 98.28 3ktx n GLY 55 Ca -0.13 -1.44 -0.20 0.00 0.00 0.00 0.00 46.02 44.25 3ktx n GLY 55 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ktx s SER 56 N -4.08 5.71 0.28 1.61 1.04 -1.26 -4.92 113.70 112.09 3ktx s SER 56 Ca 0.00 -0.09 0.02 0.00 0.48 0.00 0.00 55.95 56.36 3ktx s SER 56 Cb 0.00 -1.10 0.57 0.00 0.10 0.00 0.00 66.02 65.59 3ktx s SER 56 CO 0.00 -0.73 1.83 0.45 0.98 0.00 0.00 173.24 175.77 3ktx h HIS 57 N 0.53 1.14 -0.82 5.02 -0.00 -1.99 -0.30 115.15 118.75 3ktx h HIS 57 Ca -0.44 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 59.96 3ktx h HIS 57 Cb 1.27 -0.36 -0.04 0.00 -0.00 0.00 0.00 27.41 28.28 3ktx h HIS 57 CO 0.41 0.44 0.48 1.49 -0.00 0.00 0.00 177.93 180.75 3ktx h GLU 58 N 0.98 1.12 -0.26 2.45 4.81 -1.99 0.36 114.58 122.05 3ktx h GLU 58 Ca 0.50 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.62 3ktx h GLU 58 Cb 0.52 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 3ktx h GLU 58 CO -0.27 0.80 0.13 -0.92 -0.73 0.00 0.00 179.01 178.01 3ktx h TYR 59 N 1.12 0.37 -0.30 0.92 3.20 -1.48 -2.18 116.97 118.62 3ktx h TYR 59 Ca 0.29 -0.02 -0.12 0.00 3.14 0.00 0.00 58.73 62.02 3ktx h TYR 59 Cb -0.02 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.12 3ktx h TYR 59 CO -0.00 0.35 -0.30 0.45 -1.64 0.00 0.00 178.16 177.01 3ktx h HIS 60 N 0.29 0.74 -0.68 -3.82 3.86 -0.95 -2.54 115.15 112.05 3ktx h HIS 60 Ca 0.09 -0.18 0.12 0.00 -1.16 0.00 0.00 60.37 59.23 3ktx h HIS 60 Cb 0.12 -0.17 -0.09 0.00 1.06 0.00 0.00 27.41 28.33 3ktx h HIS 60 CO -0.02 0.87 0.24 0.37 0.86 0.00 0.00 177.93 180.25 3ktx h GLN 61 N 0.55 0.39 -0.86 2.45 5.75 -0.21 0.68 115.11 123.86 3ktx h GLN 61 Ca 0.07 -0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.51 3ktx h GLN 61 Cb 0.79 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 29.22 3ktx h GLN 61 CO 0.07 0.26 0.43 1.15 -2.65 0.00 0.00 178.83 178.09 3ktx h THR 62 N 0.40 1.26 -0.41 2.39 2.02 -1.08 0.37 112.91 117.85 3ktx h THR 62 Ca 0.36 -0.71 -0.00 0.00 0.77 0.00 0.00 66.41 66.83 3ktx h THR 62 Cb 0.50 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 3ktx h THR 62 CO -0.37 0.31 0.24 0.74 0.37 0.00 0.00 175.52 176.82 3ktx h THR 63 N 1.23 1.14 -0.28 3.16 2.02 -0.93 -0.35 112.91 118.90 3ktx h THR 63 Ca 0.30 -0.32 0.03 0.00 0.77 0.00 0.00 66.41 67.19 3ktx h THR 63 Cb 0.09 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 3ktx h THR 63 CO -0.04 0.14 0.09 0.40 0.37 0.00 0.00 175.52 176.48 3ktx h ILE 64 N 0.54 0.92 -0.43 3.11 2.04 -0.50 -0.10 117.51 123.08 3ktx h ILE 64 Ca 0.15 -0.07 -0.12 0.00 1.00 0.00 0.00 64.86 65.82 3ktx h ILE 64 Cb 0.01 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 3ktx h ILE 64 CO -0.03 0.04 -0.20 0.78 0.00 0.00 0.00 178.15 178.74 3ktx h ASN 65 N 0.21 0.92 0.12 1.72 2.35 -0.77 -2.15 115.58 117.99 3ktx h ASN 65 Ca 0.12 -0.40 -0.18 0.00 -0.55 0.00 0.00 56.30 55.30 3ktx h ASN 65 Cb 0.10 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.21 3ktx h ASN 65 CO -0.13 1.12 -0.65 0.78 -1.65 0.00 0.00 177.43 176.89 3ktx h ASN 66 N 0.72 0.57 0.18 5.81 4.21 -0.77 -1.20 115.58 125.11 3ktx h ASN 66 Ca 0.10 -0.34 -0.01 0.00 1.21 0.00 0.00 56.30 57.26 3ktx h ASN 66 Cb 0.77 -0.17 -0.00 0.00 -1.12 0.00 0.00 38.32 37.80 3ktx h ASN 66 CO 0.06 1.07 -0.09 0.58 -1.29 0.00 0.00 177.43 177.76 3ktx h VAL 67 N 0.36 0.80 -0.69 2.81 2.07 -0.88 0.11 116.25 120.84 3ktx h VAL 67 Ca -0.02 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.57 3ktx h VAL 67 Cb 1.22 0.80 -0.06 0.00 -1.52 0.00 0.00 31.29 31.73 3ktx h VAL 67 CO 0.12 0.00 0.37 0.03 0.02 0.00 0.00 177.57 178.11 3ktx h ARG 68 N -0.25 0.65 -0.27 1.57 3.08 -1.32 0.23 114.38 118.07 3ktx h ARG 68 Ca -0.02 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 3ktx h ARG 68 Cb 0.20 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 3ktx h ARG 68 CO 0.03 0.43 -0.03 0.37 -1.07 0.00 0.00 179.97 179.71 3ktx h GLN 69 N 0.67 0.49 -0.43 0.04 5.75 -0.99 0.30 115.11 120.94 3ktx h GLN 69 Ca 0.32 -0.17 -0.00 0.00 -0.15 0.00 0.00 58.65 58.64 3ktx h GLN 69 Cb 0.24 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.73 3ktx h GLN 69 CO -0.21 0.67 0.25 0.00 -2.65 0.00 0.00 178.83 176.90 3ktx h ALA 70 N 0.80 0.55 -0.63 3.38 0.00 -0.35 -1.92 119.26 121.09 3ktx h ALA 70 Ca 0.07 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3ktx h ALA 70 Cb 0.47 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3ktx h ALA 70 CO 0.02 0.05 0.31 0.00 0.00 0.00 0.00 179.25 179.63 3ktx h ALA 71 N 1.11 0.81 -0.63 0.00 0.00 -0.48 -1.66 119.26 118.40 3ktx h ALA 71 Ca 0.15 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3ktx h ALA 71 Cb 0.02 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 3ktx h ALA 71 CO -0.03 0.37 0.21 0.00 0.00 0.00 0.00 179.25 179.80 3ktx h ALA 72 N 1.14 1.19 0.00 0.00 0.00 -0.75 0.29 119.26 121.14 3ktx h ALA 72 Ca 0.22 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 3ktx h ALA 72 Cb 0.11 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3ktx h ALA 72 CO -0.03 0.57 -0.50 0.93 0.00 0.00 0.00 179.25 180.22 3ktx h GLU 73 N 0.92 0.00 -0.01 0.00 5.08 -1.04 -2.56 114.58 116.97 3ktx h GLU 73 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 3ktx h GLU 73 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3ktx h GLU 73 CO -0.01 0.50 -0.25 1.28 -1.00 0.00 0.00 179.01 179.53 3ktx n LEU 74 N -3.58 1.10 -3.12 1.33 4.77 -0.65 -4.99 117.00 111.85 3ktx n LEU 74 Ca -0.00 -0.30 -0.17 0.00 -0.03 0.00 0.00 56.01 55.51 3ktx n LEU 74 Cb 0.59 -0.11 0.07 0.00 -2.33 0.00 0.00 43.42 41.64 3ktx n LEU 74 CO 0.39 0.20 0.14 0.61 -1.33 0.00 0.00 177.39 177.41 3ktx n GLY 75 N 1.33 -0.28 3.26 -0.72 0.00 0.00 -5.03 105.19 103.76 3ktx n GLY 75 Ca 0.13 0.06 -0.14 0.00 0.00 0.00 0.00 46.02 46.06 3ktx n GLY 75 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ktx s VAL 76 N -3.30 0.31 -0.13 1.61 -7.23 -0.90 -5.04 120.40 105.72 3ktx s VAL 76 Ca 0.20 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.38 3ktx s VAL 76 Cb -0.09 -2.56 -0.01 0.00 0.56 0.00 0.00 36.38 34.29 3ktx s VAL 76 CO 0.63 -0.02 -0.17 0.20 -0.31 0.00 0.00 175.10 175.42 3ktx s ASN 77 N -3.24 3.60 -0.05 4.85 0.01 -1.26 -4.36 114.94 114.49 3ktx s ASN 77 Ca 0.38 -0.45 0.05 0.00 -0.71 0.00 0.00 52.86 52.13 3ktx s ASN 77 Cb 0.07 -1.53 -0.01 0.00 0.41 0.00 0.00 41.25 40.20 3ktx s ASN 77 CO 0.12 0.14 -0.21 -0.63 -1.51 0.00 0.00 177.10 175.02 3ktx s ILE 78 N 0.49 1.72 0.49 0.60 -1.09 -1.26 -4.78 121.20 117.37 3ktx s ILE 78 Ca -0.12 -0.88 -0.20 0.00 -2.23 0.00 0.00 60.65 57.23 3ktx s ILE 78 Cb -0.16 -1.47 -0.08 0.00 -1.58 0.00 0.00 42.46 39.16 3ktx s ILE 78 CO 0.05 0.49 1.04 0.00 -1.23 0.00 0.00 174.94 175.28 3ktx s ALA 79 N -0.02 2.87 -0.18 9.38 0.00 -0.88 -4.91 121.76 128.02 3ktx s ALA 79 Ca -0.05 0.59 0.00 0.00 0.00 0.00 0.00 51.96 52.51 3ktx s ALA 79 Cb -0.13 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 19.75 3ktx s ALA 79 CO 0.03 -0.33 -0.17 0.42 0.00 0.00 0.00 175.76 175.71 3ktx s ILE 80 N -2.01 2.35 -0.07 0.00 1.01 -1.26 -0.56 121.20 120.67 3ktx s ILE 80 Ca 0.67 -0.85 0.03 0.00 0.00 0.00 0.00 60.65 60.50 3ktx s ILE 80 Cb -0.16 -2.00 -0.02 0.00 0.01 0.00 0.00 42.46 40.28 3ktx s ILE 80 CO 0.21 0.52 -0.14 0.00 0.00 0.00 0.00 174.94 175.53 3ktx s ALA 81 N 1.20 2.66 -0.31 9.38 0.00 -0.27 -1.27 121.76 133.15 3ktx s ALA 81 Ca 0.02 -0.96 -0.09 0.00 0.00 0.00 0.00 51.96 50.94 3ktx s ALA 81 Cb -0.14 -1.03 0.00 0.00 0.00 0.00 0.00 23.12 21.96 3ktx s ALA 81 CO -0.08 0.49 0.13 -1.17 0.00 0.00 0.00 175.76 175.12 3ktx s LEU 82 N -0.48 4.06 -0.34 0.00 0.20 -0.50 -0.65 118.68 120.97 3ktx s LEU 82 Ca 0.06 -0.65 -0.13 0.00 0.69 0.00 0.00 54.13 54.10 3ktx s LEU 82 Cb -0.12 -1.95 -0.02 0.00 -0.43 0.00 0.00 46.19 43.67 3ktx s LEU 82 CO 0.02 -0.21 0.24 -0.62 -0.29 0.00 0.00 176.35 175.48 3ktx s ASP 83 N 1.56 6.06 0.41 3.68 -1.08 -0.60 -0.91 116.67 125.78 3ktx s ASP 83 Ca 0.03 -0.40 -0.24 0.00 -0.52 0.00 0.00 52.55 51.43 3ktx s ASP 83 Cb -0.17 -2.14 -0.09 0.00 -1.46 0.00 0.00 42.92 39.06 3ktx s ASP 83 CO 0.05 -0.23 1.04 0.42 0.52 0.00 0.00 175.17 176.97 3ktx s THR 84 N 1.72 3.75 0.17 1.71 -4.23 -0.55 -1.25 115.64 116.97 3ktx s THR 84 Ca 0.06 1.31 -0.14 0.00 -1.18 0.00 0.00 61.69 61.74 3ktx s THR 84 Cb -0.17 -3.66 0.06 0.00 1.34 0.00 0.00 72.50 70.06 3ktx s THR 84 CO 0.11 -0.02 1.80 0.50 -0.54 0.00 0.00 174.62 176.46 3ktx h LYS 85 N 2.41 0.51 -0.13 3.99 3.64 -1.92 -3.39 116.57 121.68 3ktx h LYS 85 Ca -0.48 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 58.88 3ktx h LYS 85 Cb 1.21 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.91 3ktx h LYS 85 CO 0.62 0.34 -0.03 0.41 -2.27 0.00 0.00 179.45 178.52 3ktx n GLY 86 N -1.24 -1.54 3.84 5.01 0.00 -1.26 -4.90 105.19 105.10 3ktx n GLY 86 Ca 0.03 -1.51 -0.32 0.00 0.00 0.00 0.00 46.02 44.22 3ktx n GLY 86 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ktx s PRO 87 N -1.41 3.92 0.08 1.61 0.04 -1.26 -4.74 135.00 133.24 3ktx s PRO 87 Ca 0.00 0.98 -0.06 0.00 0.04 0.00 0.00 61.00 61.96 3ktx s PRO 87 Cb 0.00 -2.13 -0.01 0.00 0.04 0.00 0.00 34.50 32.40 3ktx s PRO 87 CO 0.00 -0.29 0.13 -1.21 0.04 0.00 0.00 177.00 175.67 3ktx s GLU 88 N -4.01 0.80 -0.38 4.56 2.02 -1.26 -5.05 118.70 115.38 3ktx s GLU 88 Ca 0.59 -1.05 -0.03 0.00 0.02 0.00 0.00 54.97 54.50 3ktx s GLU 88 Cb -0.10 0.31 0.09 0.00 0.10 0.00 0.00 34.13 34.52 3ktx s GLU 88 CO 0.30 -0.24 0.15 0.42 0.02 0.00 0.00 175.26 175.92 3ktx s ILE 89 N -3.89 3.31 -0.11 -1.63 1.01 -1.26 -4.87 121.20 113.75 3ktx s ILE 89 Ca 0.07 -1.78 -0.15 0.00 0.00 0.00 0.00 60.65 58.78 3ktx s ILE 89 Cb 0.06 -3.14 -0.05 0.00 0.01 0.00 0.00 42.46 39.34 3ktx s ILE 89 CO -0.10 -0.50 0.37 -0.13 0.00 0.00 0.00 174.94 174.58 3ktx s ARG 90 N 1.20 4.19 0.85 2.79 0.52 -1.26 -3.01 118.95 124.24 3ktx s ARG 90 Ca 0.04 0.27 -0.10 0.00 -0.52 0.00 0.00 55.73 55.41 3ktx s ARG 90 Cb -0.22 -3.38 0.11 0.00 0.52 0.00 0.00 34.95 31.98 3ktx s ARG 90 CO -0.03 0.31 1.13 0.95 0.02 0.00 0.00 175.30 177.69 3ktx s THR 91 N 0.18 2.53 0.00 0.02 -4.23 -1.21 -2.47 115.64 110.46 3ktx s THR 91 Ca 0.21 0.18 0.00 0.00 -1.18 0.00 0.00 61.69 60.90 3ktx s THR 91 Cb -0.14 -2.39 0.00 0.00 1.34 0.00 0.00 72.50 71.31 3ktx s THR 91 CO 0.08 -0.22 0.00 0.61 -0.54 0.00 0.00 174.62 174.55 3ktx n GLY 92 N -0.29 0.94 3.80 3.99 0.00 -0.96 -3.21 105.19 109.46 3ktx n GLY 92 Ca 0.11 -0.65 -0.22 0.00 0.00 0.00 0.00 46.02 45.26 3ktx n GLY 92 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ktx s GLN 93 N 1.01 2.73 0.00 1.61 -0.21 -0.37 -2.11 119.66 122.32 3ktx s GLN 93 Ca 0.00 -1.22 0.00 0.00 0.02 0.00 0.00 55.36 54.16 3ktx s GLN 93 Cb 0.00 -2.45 0.00 0.00 1.00 0.00 0.00 33.01 31.56 3ktx s GLN 93 CO 0.00 0.29 0.00 1.19 -2.12 0.00 0.00 175.29 174.65 3ktx n PHE 94 N -1.19 -0.16 -2.71 0.91 3.72 -1.23 -3.06 117.46 113.75 3ktx n PHE 94 Ca -0.06 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.92 3ktx n PHE 94 Cb 0.59 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.10 3ktx n PHE 94 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3ktx s VAL 95 N 0.27 4.45 0.00 -4.37 1.01 -0.46 -3.94 120.40 117.35 3ktx s VAL 95 Ca 0.00 1.30 0.00 0.00 0.00 0.00 0.00 61.98 63.28 3ktx s VAL 95 Cb 0.00 -4.44 0.00 0.00 0.00 0.00 0.00 36.38 31.94 3ktx s VAL 95 CO 0.00 -0.68 0.00 0.61 0.00 0.00 0.00 175.10 175.03 3ktx n GLY 96 N 4.43 0.31 0.00 4.51 0.00 -1.26 -2.04 105.19 111.14 3ktx n GLY 96 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3ktx n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ktx n GLY 97 N -2.00 0.69 2.57 -0.02 0.00 -1.25 -5.08 105.19 100.10 3ktx n GLY 97 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 3ktx n GLY 97 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3ktx n ASP 98 N 0.00 1.74 -3.62 1.61 2.03 -0.86 -3.28 116.55 114.17 3ktx n ASP 98 Ca 0.00 -2.64 0.03 0.00 0.52 0.00 0.00 54.79 52.70 3ktx n ASP 98 Cb 0.00 0.62 -0.00 0.00 -0.72 0.00 0.00 41.12 41.02 3ktx n ASP 98 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3ktx s ALA 99 N -2.77 -2.42 -0.17 -1.67 0.00 -1.26 -3.85 121.76 109.63 3ktx s ALA 99 Ca 0.11 0.76 0.01 0.00 0.00 0.00 0.00 51.96 52.84 3ktx s ALA 99 Cb 0.01 0.36 0.02 0.00 0.00 0.00 0.00 23.12 23.50 3ktx s ALA 99 CO 0.08 -1.07 -0.17 0.08 0.00 0.00 0.00 175.76 174.67 3ktx s VAL 100 N -2.18 1.85 -0.02 0.00 1.01 -1.26 -4.07 120.40 115.72 3ktx s VAL 100 Ca 0.16 -0.82 -0.18 0.00 0.00 0.00 0.00 61.98 61.14 3ktx s VAL 100 Cb 0.06 -1.70 -0.05 0.00 0.00 0.00 0.00 36.38 34.68 3ktx s VAL 100 CO -0.05 0.49 0.51 -0.04 0.00 0.00 0.00 175.10 176.01 3ktx s MET 101 N 1.37 4.20 0.21 2.72 -1.94 0.21 -4.94 119.30 121.13 3ktx s MET 101 Ca 0.05 0.57 0.05 0.00 -1.71 0.00 0.00 55.69 54.64 3ktx s MET 101 Cb -0.13 -3.32 -0.05 0.00 2.01 0.00 0.00 34.83 33.34 3ktx s MET 101 CO -0.12 0.44 -0.05 -1.21 -0.01 0.00 0.00 175.02 174.07 3ktx s GLU 102 N -0.36 1.28 0.47 2.03 8.01 -1.26 -1.51 118.70 127.36 3ktx s GLU 102 Ca 0.27 -1.61 -0.23 0.00 0.01 0.00 0.00 54.97 53.41 3ktx s GLU 102 Cb -0.17 -0.73 -0.09 0.00 -4.31 0.00 0.00 34.13 28.83 3ktx s GLU 102 CO 0.15 -0.00 0.97 -2.13 0.01 0.00 0.00 175.26 174.25 3ktx n ARG 103 N -0.37 1.21 0.00 1.61 0.63 -1.22 -3.07 116.66 115.45 3ktx n ARG 103 Ca -0.07 0.44 0.00 0.00 -0.92 0.00 0.00 57.85 57.30 3ktx n ARG 103 Cb 0.62 -2.05 0.00 0.00 0.45 0.00 0.00 32.46 31.48 3ktx n ARG 103 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3ktx n GLY 104 N 1.24 1.30 3.51 5.14 0.00 -0.87 -4.97 105.19 110.55 3ktx n GLY 104 Ca 0.10 -0.02 -0.52 0.00 0.00 0.00 0.00 46.02 45.59 3ktx n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ktx n ALA 105 N 0.00 -2.17 -2.71 4.61 0.00 -1.17 -4.46 120.51 114.61 3ktx n ALA 105 Ca 0.00 0.50 -0.41 0.00 0.00 0.00 0.00 53.44 53.53 3ktx n ALA 105 Cb 0.00 -1.85 -0.03 0.00 0.00 0.00 0.00 19.45 17.56 3ktx n ALA 105 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3ktx s THR 106 N -0.28 4.91 0.05 0.00 2.01 -1.26 -2.88 115.64 118.18 3ktx s THR 106 Ca 0.77 1.91 0.07 0.00 0.31 0.00 0.00 61.69 64.76 3ktx s THR 106 Cb -1.01 -4.25 -0.03 0.00 0.01 0.00 0.00 72.50 67.22 3ktx s THR 106 CO 0.54 0.17 -0.21 0.00 -0.69 0.00 0.00 174.62 174.44 3ktx s TYR 108 N -0.84 2.59 0.01 0.00 1.51 -0.05 -1.28 117.35 119.28 3ktx s TYR 108 Ca 0.07 -1.74 -0.12 0.00 -1.01 0.00 0.00 57.07 54.27 3ktx s TYR 108 Cb -0.09 -1.70 -0.05 0.00 -0.11 0.00 0.00 41.96 40.01 3ktx s TYR 108 CO 0.02 -0.78 0.36 0.14 -1.11 0.00 0.00 175.55 174.18 3ktx s VAL 109 N 1.34 5.13 -0.02 0.71 -7.23 -1.18 -1.55 120.40 117.61 3ktx s VAL 109 Ca -0.03 0.58 0.08 0.00 -1.81 0.00 0.00 61.98 60.80 3ktx s VAL 109 Cb -0.17 -3.64 -0.02 0.00 0.56 0.00 0.00 36.38 33.11 3ktx s VAL 109 CO -0.08 0.48 -0.25 0.28 -0.31 0.00 0.00 175.10 175.22 3ktx s THR 110 N -1.19 2.12 -2.14 5.32 -1.32 -0.75 -2.63 115.64 115.05 3ktx s THR 110 Ca 0.26 -1.11 0.24 0.00 -1.21 0.00 0.00 61.69 59.86 3ktx s THR 110 Cb -0.15 -1.74 0.10 0.00 -1.51 0.00 0.00 72.50 69.20 3ktx s THR 110 CO 0.14 0.56 1.24 0.35 -2.21 0.00 0.00 174.62 174.70 3ktx n THR 111 N 2.37 0.00 -2.42 5.08 -2.24 -0.12 -2.38 114.28 114.57 3ktx n THR 111 Ca -0.16 -0.27 -0.41 0.00 -2.27 0.00 0.00 64.05 60.94 3ktx n THR 111 Cb 0.51 1.08 -0.03 0.00 -2.10 0.00 0.00 70.33 69.79 3ktx n THR 111 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3ktx s ASP 112 N -2.39 7.12 0.29 3.42 2.15 -1.26 -4.94 116.67 121.05 3ktx s ASP 112 Ca 0.22 2.15 0.15 0.00 0.43 0.00 0.00 52.55 55.50 3ktx s ASP 112 Cb 0.19 -2.60 0.25 0.00 -0.30 0.00 0.00 42.92 40.46 3ktx s ASP 112 CO 0.51 -0.36 1.53 1.55 -0.17 0.00 0.00 175.17 178.23 3ktx h PRO 113 N 5.58 0.00 0.00 4.34 0.14 -1.97 -3.29 132.00 136.80 3ktx h PRO 113 Ca -0.44 0.00 -0.01 0.00 0.14 0.00 0.00 66.00 65.69 3ktx h PRO 113 Cb 1.21 0.00 -0.00 0.00 0.14 0.00 0.00 31.00 32.35 3ktx h PRO 113 CO 0.76 0.55 -0.04 0.00 0.14 0.00 0.00 178.00 179.41 3ktx h ALA 114 N 1.45 1.62 -0.27 -0.56 0.00 -2.02 -2.24 119.26 117.24 3ktx h ALA 114 Ca -0.01 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 3ktx h ALA 114 Cb 1.26 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 3ktx h ALA 114 CO 0.07 0.04 0.06 1.19 0.00 0.00 0.00 179.25 180.61 3ktx n PHE 115 N -4.03 0.95 -0.09 0.00 3.72 -1.24 -4.34 117.46 112.43 3ktx n PHE 115 Ca -0.03 -0.45 -0.03 0.00 -0.05 0.00 0.00 57.45 56.89 3ktx n PHE 115 Cb 0.12 -0.33 0.19 0.00 -0.94 0.00 0.00 39.48 38.53 3ktx n PHE 115 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3ktx h ALA 116 N 2.58 1.17 0.00 4.37 0.00 -1.64 -3.35 119.26 122.40 3ktx h ALA 116 Ca 0.05 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3ktx h ALA 116 Cb 1.25 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3ktx h ALA 116 CO 0.26 0.54 -0.36 -0.40 0.00 0.00 0.00 179.25 179.29 3ktx n ASP 117 N -4.24 1.21 -4.57 0.00 5.68 -1.26 -1.24 116.55 112.14 3ktx n ASP 117 Ca 0.03 0.49 -0.40 0.00 -0.50 0.00 0.00 54.79 54.41 3ktx n ASP 117 Cb 0.28 -0.74 -0.03 0.00 -1.14 0.00 0.00 41.12 39.49 3ktx n ASP 117 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 3ktx s LYS 118 N -1.85 3.54 0.45 0.11 -2.85 -1.26 -3.52 119.74 114.37 3ktx s LYS 118 Ca -0.10 -1.23 0.07 0.00 -1.00 0.00 0.00 55.97 53.70 3ktx s LYS 118 Cb 0.01 -5.37 -0.02 0.00 -2.06 0.00 0.00 37.83 30.40 3ktx s LYS 118 CO 0.15 -2.40 0.29 0.20 0.10 0.00 0.00 175.35 173.70 3ktx s GLY 119 N 5.17 2.32 0.01 0.59 0.00 -1.17 -4.81 107.32 109.42 3ktx s GLY 119 Ca 0.51 -1.76 -0.00 0.00 0.00 0.00 0.00 44.72 43.46 3ktx s GLY 119 CO -0.04 -1.87 0.02 -1.30 0.00 0.00 0.00 173.10 169.91 3ktx n THR 120 N -1.47 0.00 0.21 0.90 -2.24 -0.59 -1.36 114.28 109.73 3ktx n THR 120 Ca -0.00 -0.07 0.11 0.00 -2.27 0.00 0.00 64.05 61.81 3ktx n THR 120 Cb 0.64 0.04 0.18 0.00 -2.10 0.00 0.00 70.33 69.09 3ktx n THR 120 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 3ktx h LYS 121 N 0.00 0.00 0.00 -0.78 2.10 -1.92 -3.40 116.57 112.57 3ktx h LYS 121 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3ktx h LYS 121 Cb 0.05 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.38 3ktx h LYS 121 CO 0.01 0.10 0.00 -0.25 -2.00 0.00 0.00 179.45 177.31 3ktx n ASP 122 N -3.13 0.00 -4.02 7.07 8.00 -1.26 -4.75 116.55 118.46 3ktx n ASP 122 Ca 0.03 0.40 -0.25 0.00 0.71 0.00 0.00 54.79 55.69 3ktx n ASP 122 Cb 0.55 -0.33 -0.17 0.00 -0.02 0.00 0.00 41.12 41.16 3ktx n ASP 122 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3ktx s LYS 123 N -0.90 1.72 0.00 -1.24 2.20 -1.26 -0.87 119.74 119.39 3ktx s LYS 123 Ca 0.00 -0.42 0.00 0.00 -0.36 0.00 0.00 55.97 55.19 3ktx s LYS 123 Cb 0.00 -1.43 0.00 0.00 -1.51 0.00 0.00 37.83 34.89 3ktx s LYS 123 CO 0.00 0.02 0.00 1.97 -0.36 0.00 0.00 175.35 176.98 3ktx n PHE 124 N 3.84 0.00 -4.16 4.03 -1.74 -0.59 -1.55 117.46 117.28 3ktx n PHE 124 Ca -0.23 0.00 -0.17 0.00 -0.56 0.00 0.00 57.45 56.49 3ktx n PHE 124 Cb 0.52 0.00 -0.12 0.00 1.52 0.00 0.00 39.48 41.40 3ktx n PHE 124 CO 0.00 0.00 0.00 -0.47 -0.56 0.00 0.00 176.76 175.73 3ktx s TYR 125 N -0.80 1.08 -0.11 2.97 5.04 -1.26 -1.81 117.35 122.46 3ktx s TYR 125 Ca 0.00 -0.45 -0.06 0.00 -2.44 0.00 0.00 57.07 54.12 3ktx s TYR 125 Cb 0.00 -0.62 0.05 0.00 0.35 0.00 0.00 41.96 41.74 3ktx s TYR 125 CO 0.00 0.02 0.26 0.42 -1.34 0.00 0.00 175.55 174.92 3ktx s ILE 126 N -1.24 -0.09 -1.98 3.14 1.01 -1.00 -2.27 121.20 118.77 3ktx s ILE 126 Ca -0.03 0.16 0.30 0.00 0.00 0.00 0.00 60.65 61.07 3ktx s ILE 126 Cb -0.10 -0.41 0.67 0.00 0.01 0.00 0.00 42.46 42.63 3ktx s ILE 126 CO 0.02 0.07 2.00 -0.90 0.00 0.00 0.00 174.94 176.12 3ktx n ASP 127 N 4.37 0.49 -4.53 3.58 5.68 -1.03 -4.50 116.55 120.61 3ktx n ASP 127 Ca -0.23 -0.95 -0.42 0.00 -0.50 0.00 0.00 54.79 52.69 3ktx n ASP 127 Cb 0.53 -0.04 -0.04 0.00 -1.14 0.00 0.00 41.12 40.43 3ktx n ASP 127 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 3ktx s TYR 128 N -2.17 2.68 0.38 2.11 5.04 -1.26 -4.90 117.35 119.22 3ktx s TYR 128 Ca 0.39 0.03 0.12 0.00 -2.44 0.00 0.00 57.07 55.17 3ktx s TYR 128 Cb 0.21 -4.27 0.75 0.00 0.35 0.00 0.00 41.96 39.00 3ktx s TYR 128 CO 0.40 -1.52 1.85 1.96 -1.34 0.00 0.00 175.55 176.90 3ktx h GLN 129 N 9.47 0.04 0.00 4.97 4.20 -1.92 -1.83 115.11 130.03 3ktx h GLN 129 Ca -0.26 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.43 3ktx h GLN 129 Cb 1.07 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.84 3ktx h GLN 129 CO 1.14 0.36 0.00 0.09 -0.67 0.00 0.00 178.83 179.76 3ktx n ASN 130 N -4.14 0.00 0.09 1.46 4.13 -1.26 -4.32 115.26 111.22 3ktx n ASN 130 Ca -0.02 -1.37 -0.16 0.00 1.68 0.00 0.00 54.58 54.71 3ktx n ASN 130 Cb 0.38 0.00 -0.10 0.00 -1.54 0.00 0.00 39.78 38.52 3ktx n ASN 130 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 3ktx h LEU 131 N 0.00 -1.61 -0.51 3.41 5.85 -1.74 -1.92 115.31 118.79 3ktx h LEU 131 Ca 0.00 0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 3ktx h LEU 131 Cb 0.00 0.60 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 3ktx h LEU 131 CO 0.00 -0.54 0.25 0.28 -0.34 0.00 0.00 178.44 178.09 3ktx h SER 132 N -0.72 0.65 0.26 1.25 0.02 -1.84 -1.58 113.55 111.59 3ktx h SER 132 Ca 0.00 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 3ktx h SER 132 Cb 0.75 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.12 3ktx h SER 132 CO -0.32 0.59 0.00 2.29 -1.14 0.00 0.00 176.83 178.25 3ktx n LYS 133 N -4.61 0.61 -0.09 3.45 2.85 -1.15 -3.72 118.16 115.50 3ktx n LYS 133 Ca 0.02 0.02 -0.18 0.00 -1.05 0.00 0.00 58.31 57.12 3ktx n LYS 133 Cb 0.11 -1.50 -0.06 0.00 -0.65 0.00 0.00 35.03 32.93 3ktx n LYS 133 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 3ktx n VAL 134 N -1.15 1.28 -2.12 0.58 0.31 -0.73 -4.98 118.33 111.52 3ktx n VAL 134 Ca 0.16 -0.15 -0.43 0.00 -0.01 0.00 0.00 64.34 63.92 3ktx n VAL 134 Cb 0.16 -1.92 -0.03 0.00 -0.91 0.00 0.00 33.84 31.14 3ktx n VAL 134 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3ktx s VAL 135 N -2.50 3.76 0.62 2.52 1.01 -0.62 -4.94 120.40 120.25 3ktx s VAL 135 Ca -0.28 0.91 -0.04 0.00 0.00 0.00 0.00 61.98 62.56 3ktx s VAL 135 Cb 0.09 -3.62 0.03 0.00 0.00 0.00 0.00 36.38 32.88 3ktx s VAL 135 CO 0.37 -0.12 0.91 -0.13 0.00 0.00 0.00 175.10 176.13 3ktx s ARG 136 N 4.03 2.59 -0.28 2.72 1.81 -1.26 -4.85 118.95 123.71 3ktx s ARG 136 Ca 0.69 -0.27 -0.28 0.00 -1.72 0.00 0.00 55.73 54.15 3ktx s ARG 136 Cb -0.29 -2.29 -0.04 0.00 -0.45 0.00 0.00 34.95 31.88 3ktx s ARG 136 CO 0.26 -0.88 2.09 -2.14 -0.68 0.00 0.00 175.30 173.96 3ktx s PRO 137 N -5.02 3.11 0.00 3.54 0.02 -1.26 -2.47 135.00 132.92 3ktx s PRO 137 Ca 0.56 1.77 0.00 0.00 0.02 0.00 0.00 61.00 63.35 3ktx s PRO 137 Cb -0.11 -4.33 0.00 0.00 0.02 0.00 0.00 34.50 30.08 3ktx s PRO 137 CO 0.43 -2.12 0.00 0.41 -0.33 0.00 0.00 177.00 175.39 3ktx n GLY 138 N 5.67 1.38 3.41 0.52 0.00 0.41 -4.98 105.19 111.60 3ktx n GLY 138 Ca 0.28 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.00 3ktx n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ktx s ASN 139 N -1.94 -0.04 -0.12 1.61 0.01 -1.03 -4.65 114.94 108.77 3ktx s ASN 139 Ca 0.00 1.06 -0.01 0.00 -0.71 0.00 0.00 52.86 53.20 3ktx s ASN 139 Cb 0.00 -1.58 -0.02 0.00 0.41 0.00 0.00 41.25 40.06 3ktx s ASN 139 CO 0.00 -4.77 -0.10 -0.31 -1.51 0.00 0.00 177.10 170.42 3ktx s TYR 140 N -2.45 2.88 -0.40 2.20 2.02 -1.26 -1.80 117.35 118.54 3ktx s TYR 140 Ca 0.69 -0.42 -0.11 0.00 -0.37 0.00 0.00 57.07 56.86 3ktx s TYR 140 Cb -0.17 -1.84 0.05 0.00 -0.40 0.00 0.00 41.96 39.59 3ktx s TYR 140 CO 0.60 -0.06 0.24 0.42 -1.57 0.00 0.00 175.55 175.19 3ktx s ILE 141 N 0.12 4.51 0.21 2.71 1.01 0.13 -4.18 121.20 125.72 3ktx s ILE 141 Ca -0.04 -1.08 -0.22 0.00 0.00 0.00 0.00 60.65 59.32 3ktx s ILE 141 Cb -0.14 -3.62 -0.08 0.00 0.01 0.00 0.00 42.46 38.62 3ktx s ILE 141 CO 0.04 -0.37 0.75 -0.31 0.00 0.00 0.00 174.94 175.05 3ktx s TYR 142 N 1.52 3.72 -0.35 3.97 1.51 0.05 0.25 117.35 128.02 3ktx s TYR 142 Ca 0.02 1.48 0.02 0.00 -1.01 0.00 0.00 57.07 57.59 3ktx s TYR 142 Cb -0.21 -2.68 0.15 0.00 -0.11 0.00 0.00 41.96 39.11 3ktx s TYR 142 CO 0.05 0.38 0.35 0.42 -1.11 0.00 0.00 175.55 175.64 3ktx s ILE 143 N -1.42 -0.30 0.00 2.71 1.01 0.75 0.23 121.20 124.18 3ktx s ILE 143 Ca 0.41 -0.97 0.00 0.00 0.00 0.00 0.00 60.65 60.09 3ktx s ILE 143 Cb -0.19 -0.77 0.00 0.00 0.01 0.00 0.00 42.46 41.52 3ktx s ILE 143 CO 0.22 -0.60 0.00 -0.67 0.00 0.00 0.00 174.94 173.89 3ktx n ASP 144 N 4.41 0.00 -0.88 3.58 2.03 0.16 -3.78 116.55 122.07 3ktx n ASP 144 Ca 0.09 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.29 3ktx n ASP 144 Cb 0.45 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.80 3ktx n ASP 144 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3ktx n ASP 145 N 0.00 -5.56 0.00 1.67 8.00 -1.25 -0.87 116.55 118.54 3ktx n ASP 145 Ca 0.00 0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.78 3ktx n ASP 145 Cb 0.00 -4.15 0.00 0.00 -0.02 0.00 0.00 41.12 36.95 3ktx n ASP 145 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ktx n GLY 146 N 0.22 0.83 0.23 0.44 0.00 -1.26 -4.90 105.19 100.75 3ktx n GLY 146 Ca -0.11 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.74 3ktx n GLY 146 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3ktx h ILE 147 N 0.00 1.28 -3.42 -0.61 2.04 -1.27 -3.39 117.51 112.13 3ktx h ILE 147 Ca 0.00 -1.87 -0.60 0.00 1.00 0.00 0.00 64.86 63.39 3ktx h ILE 147 Cb 0.00 1.86 -0.10 0.00 -0.74 0.00 0.00 36.82 37.84 3ktx h ILE 147 CO 0.00 0.60 0.20 -0.22 0.00 0.00 0.00 178.15 178.73 3ktx s LEU 148 N -8.53 4.10 -0.05 1.44 2.96 -1.25 -4.89 118.68 112.45 3ktx s LEU 148 Ca -0.11 0.81 -0.03 0.00 -0.22 0.00 0.00 54.13 54.59 3ktx s LEU 148 Cb 0.09 -2.92 -0.04 0.00 0.50 0.00 0.00 46.19 43.82 3ktx s LEU 148 CO 0.90 -0.36 0.08 -0.63 -1.32 0.00 0.00 176.35 175.02 3ktx s ILE 149 N 2.34 4.86 0.01 6.68 1.01 -1.26 -0.18 121.20 134.67 3ktx s ILE 149 Ca 0.29 -0.20 0.02 0.00 0.00 0.00 0.00 60.65 60.76 3ktx s ILE 149 Cb -0.16 -3.16 -0.01 0.00 0.01 0.00 0.00 42.46 39.14 3ktx s ILE 149 CO 0.09 0.48 -0.08 -0.76 0.00 0.00 0.00 174.94 174.67 3ktx s LEU 150 N -1.36 2.10 -0.27 2.97 1.43 0.14 -3.32 118.68 120.38 3ktx s LEU 150 Ca 0.19 -0.28 -0.07 0.00 -1.03 0.00 0.00 54.13 52.94 3ktx s LEU 150 Cb -0.12 -0.33 -0.01 0.00 0.03 0.00 0.00 46.19 45.76 3ktx s LEU 150 CO 0.09 -0.00 0.06 -1.58 0.23 0.00 0.00 176.35 175.15 3ktx s GLN 151 N -0.68 3.36 -0.11 1.70 0.74 0.97 0.19 119.66 125.83 3ktx s GLN 151 Ca -0.01 -0.67 -0.29 0.00 0.05 0.00 0.00 55.36 54.44 3ktx s GLN 151 Cb -0.05 -3.30 -0.06 0.00 1.10 0.00 0.00 33.01 30.69 3ktx s GLN 151 CO 0.00 -0.31 2.03 0.08 -0.55 0.00 0.00 175.29 176.55 3ktx s VAL 152 N 1.54 3.10 0.00 1.34 1.01 -0.75 -1.59 120.40 125.06 3ktx s VAL 152 Ca 0.05 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.14 3ktx s VAL 152 Cb -0.16 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 33.12 3ktx s VAL 152 CO 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 175.10 175.08 3ktx n GLN 153 N 8.10 0.00 -4.28 2.72 1.13 0.16 0.15 117.38 125.36 3ktx n GLN 153 Ca 0.24 0.01 -0.15 0.00 -1.94 0.00 0.00 57.00 55.16 3ktx n GLN 153 Cb 0.43 -0.36 -0.10 0.00 0.11 0.00 0.00 30.24 30.32 3ktx n GLN 153 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 3ktx s SER 154 N -1.05 1.25 -0.62 1.08 1.04 -1.19 -3.73 113.70 110.48 3ktx s SER 154 Ca 0.00 -1.26 -0.27 0.00 0.48 0.00 0.00 55.95 54.90 3ktx s SER 154 Cb 0.00 0.13 -0.01 0.00 0.10 0.00 0.00 66.02 66.24 3ktx s SER 154 CO 0.00 -0.63 1.76 -1.00 0.98 0.00 0.00 173.24 174.35 3ktx s HIS 155 N -3.68 1.78 0.32 5.02 3.76 -1.26 0.22 115.29 121.46 3ktx s HIS 155 Ca 0.30 0.65 0.05 0.00 -0.15 0.00 0.00 55.06 55.90 3ktx s HIS 155 Cb 0.07 -4.18 0.68 0.00 1.11 0.00 0.00 32.58 30.26 3ktx s HIS 155 CO 0.08 -2.28 1.87 1.49 -0.85 0.00 0.00 174.74 175.05 3ktx h GLU 156 N 14.02 0.82 0.00 1.40 4.57 -1.83 -3.46 114.58 130.10 3ktx h GLU 156 Ca -0.27 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.87 3ktx h GLU 156 Cb 1.14 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.55 3ktx h GLU 156 CO 1.22 0.54 0.00 -0.40 -1.18 0.00 0.00 179.01 179.19 3ktx n ASP 157 N -4.56 0.00 0.26 1.04 5.68 -1.22 -4.97 116.55 112.78 3ktx n ASP 157 Ca 0.17 0.00 -0.16 0.00 -0.50 0.00 0.00 54.79 54.30 3ktx n ASP 157 Cb 0.37 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.27 3ktx n ASP 157 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 3ktx h GLU 158 N 0.00 -0.59 -0.67 0.11 4.81 -2.03 -3.27 114.58 112.94 3ktx h GLU 158 Ca 0.00 0.04 -0.19 0.00 -0.13 0.00 0.00 59.36 59.08 3ktx h GLU 158 Cb 0.00 0.13 -0.11 0.00 0.63 0.00 0.00 28.75 29.40 3ktx h GLU 158 CO 0.00 -0.38 0.22 1.04 -0.73 0.00 0.00 179.01 179.16 3ktx n GLN 159 N -5.35 3.61 -4.04 1.92 6.02 -1.26 -4.80 117.38 113.49 3ktx n GLN 159 Ca -0.11 -3.09 -0.08 0.00 -0.01 0.00 0.00 57.00 53.71 3ktx n GLN 159 Cb 0.26 -2.17 -0.11 0.00 1.02 0.00 0.00 30.24 29.25 3ktx n GLN 159 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3ktx s THR 160 N -2.99 0.18 -0.06 5.09 2.01 -1.24 -0.94 115.64 117.69 3ktx s THR 160 Ca 0.54 -1.35 0.02 0.00 0.31 0.00 0.00 61.69 61.20 3ktx s THR 160 Cb 0.43 -0.88 0.01 0.00 0.01 0.00 0.00 72.50 72.08 3ktx s THR 160 CO 0.12 -0.74 -0.10 -0.76 -0.69 0.00 0.00 174.62 172.45 3ktx s LEU 161 N -2.17 1.58 -0.28 4.42 1.43 -1.08 -3.01 118.68 119.58 3ktx s LEU 161 Ca -0.05 -0.25 -0.22 0.00 -1.03 0.00 0.00 54.13 52.58 3ktx s LEU 161 Cb -0.01 -0.72 -0.01 0.00 0.03 0.00 0.00 46.19 45.48 3ktx s LEU 161 CO -0.05 0.02 0.73 -0.70 0.23 0.00 0.00 176.35 176.58 3ktx s GLU 162 N 0.69 4.05 -0.07 1.70 -6.30 0.13 -3.10 118.70 115.81 3ktx s GLU 162 Ca -0.13 0.63 0.03 0.00 -2.50 0.00 0.00 54.97 53.00 3ktx s GLU 162 Cb -0.15 -3.69 0.01 0.00 0.00 0.00 0.00 34.13 30.30 3ktx s GLU 162 CO 0.03 -0.55 -0.16 0.00 0.02 0.00 0.00 175.26 174.60 3ktx s THR 164 N 0.44 3.16 -0.45 0.00 2.01 -0.62 -1.47 115.64 118.71 3ktx s THR 164 Ca -0.13 0.93 -0.26 0.00 0.31 0.00 0.00 61.69 62.54 3ktx s THR 164 Cb -0.15 -3.59 0.03 0.00 0.01 0.00 0.00 72.50 68.79 3ktx s THR 164 CO 0.05 0.13 0.93 -0.69 -0.69 0.00 0.00 174.62 174.34 3ktx s VAL 165 N 0.31 4.48 -2.14 3.82 1.01 -1.14 -0.02 120.40 126.73 3ktx s VAL 165 Ca 0.59 0.82 0.16 0.00 0.00 0.00 0.00 61.98 63.55 3ktx s VAL 165 Cb -0.37 -4.43 0.40 0.00 0.00 0.00 0.00 36.38 31.98 3ktx s VAL 165 CO 0.37 -0.80 1.47 0.35 0.00 0.00 0.00 175.10 176.49 3ktx n THR 166 N 6.38 0.21 -3.82 3.92 -2.24 -1.21 -2.05 114.28 115.47 3ktx n THR 166 Ca 0.06 -0.27 -0.06 0.00 -2.27 0.00 0.00 64.05 61.51 3ktx n THR 166 Cb 0.48 0.18 -0.01 0.00 -2.10 0.00 0.00 70.33 68.88 3ktx n THR 166 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3ktx s ASN 167 N -1.40 -0.18 -0.62 3.42 4.22 -1.26 -4.87 114.94 114.25 3ktx s ASN 167 Ca 0.27 -0.64 -0.20 0.00 -2.14 0.00 0.00 52.86 50.15 3ktx s ASN 167 Cb 0.14 0.66 0.10 0.00 1.28 0.00 0.00 41.25 43.43 3ktx s ASN 167 CO 0.21 -1.24 0.79 -0.44 -2.04 0.00 0.00 177.10 174.37 3ktx s SER 168 N -2.98 6.20 0.03 3.54 0.01 -1.26 -3.42 113.70 115.82 3ktx s SER 168 Ca 0.13 -1.36 0.08 0.00 1.31 0.00 0.00 55.95 56.11 3ktx s SER 168 Cb -0.04 -2.33 -0.02 0.00 0.21 0.00 0.00 66.02 63.83 3ktx s SER 168 CO 0.06 -1.19 -0.23 -2.28 0.41 0.00 0.00 173.24 170.00 3ktx s HIS 169 N 3.01 2.06 -0.64 2.43 5.04 -0.57 -4.97 115.29 121.66 3ktx s HIS 169 Ca 0.15 -0.39 -0.04 0.00 -1.54 0.00 0.00 55.06 53.24 3ktx s HIS 169 Cb -0.22 -1.26 0.16 0.00 0.04 0.00 0.00 32.58 31.31 3ktx s HIS 169 CO 0.07 0.07 0.46 0.99 -2.34 0.00 0.00 174.74 173.99 3ktx s THR 170 N -0.73 3.85 0.84 0.89 2.01 -1.26 -0.62 115.64 120.62 3ktx s THR 170 Ca 0.09 -2.90 -0.09 0.00 0.31 0.00 0.00 61.69 59.10 3ktx s THR 170 Cb -0.09 -3.50 0.15 0.00 0.01 0.00 0.00 72.50 69.07 3ktx s THR 170 CO 0.01 -0.88 1.16 0.27 -0.69 0.00 0.00 174.62 174.49 3ktx s ILE 171 N -0.02 2.08 0.20 1.82 -4.36 -1.26 -4.98 121.20 114.69 3ktx s ILE 171 Ca 0.17 -0.26 -0.16 0.00 -0.26 0.00 0.00 60.65 60.13 3ktx s ILE 171 Cb -0.20 -2.82 0.02 0.00 1.25 0.00 0.00 42.46 40.71 3ktx s ILE 171 CO -0.04 0.00 0.51 -0.94 0.24 0.00 0.00 174.94 174.71 3ktx s SER 172 N -4.78 -0.22 0.05 4.36 1.04 -1.26 -4.17 113.70 108.72 3ktx s SER 172 Ca 0.69 -0.57 -0.31 0.00 0.48 0.00 0.00 55.95 56.25 3ktx s SER 172 Cb -0.05 0.58 -0.16 0.00 0.10 0.00 0.00 66.02 66.48 3ktx s SER 172 CO 0.49 -1.07 0.76 0.47 0.98 0.00 0.00 173.24 174.87 3ktx n ASP 173 N -0.34 -0.32 -2.98 7.02 9.92 -1.21 -4.39 116.55 124.25 3ktx n ASP 173 Ca -0.09 0.97 -0.13 0.00 -0.53 0.00 0.00 54.79 55.01 3ktx n ASP 173 Cb 0.62 -0.78 0.01 0.00 -0.64 0.00 0.00 41.12 40.34 3ktx n ASP 173 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 3ktx n ARG 174 N 1.13 -2.36 -4.17 -1.24 3.00 -0.90 -5.00 116.66 107.13 3ktx n ARG 174 Ca 0.16 2.02 -0.24 0.00 -0.01 0.00 0.00 57.85 59.78 3ktx n ARG 174 Cb 0.11 -4.79 -0.06 0.00 0.00 0.00 0.00 32.46 27.72 3ktx n ARG 174 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 3ktx s ARG 175 N -2.42 2.63 -0.66 5.56 6.06 -1.26 -4.72 118.95 124.14 3ktx s ARG 175 Ca 0.24 -1.10 -0.26 0.00 -2.50 0.00 0.00 55.73 52.11 3ktx s ARG 175 Cb -0.05 -2.44 -0.03 0.00 0.06 0.00 0.00 34.95 32.49 3ktx s ARG 175 CO 0.77 0.43 1.89 0.20 -2.50 0.00 0.00 175.30 176.09 3ktx s GLY 176 N -3.37 0.18 0.10 8.12 0.00 -1.26 -3.35 107.32 107.74 3ktx s GLY 176 Ca 0.30 -0.80 -0.14 0.00 0.00 0.00 0.00 44.72 44.09 3ktx s GLY 176 CO 0.22 3.45 0.50 -1.34 0.00 0.00 0.00 173.10 175.92 3ktx s VAL 177 N 9.33 4.92 -0.09 1.40 -7.23 -1.17 0.36 120.40 127.92 3ktx s VAL 177 Ca 0.68 0.79 -0.02 0.00 -1.81 0.00 0.00 61.98 61.62 3ktx s VAL 177 Cb -0.12 -3.73 0.04 0.00 0.56 0.00 0.00 36.38 33.13 3ktx s VAL 177 CO 0.17 0.33 0.03 0.20 -0.31 0.00 0.00 175.10 175.52 3ktx s ASN 178 N -1.58 1.76 -0.75 4.85 0.01 0.63 -4.77 114.94 115.08 3ktx s ASN 178 Ca 0.34 -0.22 -0.04 0.00 -0.71 0.00 0.00 52.86 52.23 3ktx s ASN 178 Cb -0.15 -0.35 0.19 0.00 0.41 0.00 0.00 41.25 41.34 3ktx s ASN 178 CO 0.18 -0.25 0.61 -0.76 -1.51 0.00 0.00 177.10 175.38 3ktx s LEU 179 N 2.03 5.56 0.17 0.60 1.02 -1.26 -0.77 118.68 126.03 3ktx s LEU 179 Ca 0.04 -3.15 0.02 0.00 0.02 0.00 0.00 54.13 51.05 3ktx s LEU 179 Cb -0.13 -1.93 0.03 0.00 0.02 0.00 0.00 46.19 44.18 3ktx s LEU 179 CO -0.06 -0.33 1.40 -0.65 0.02 0.00 0.00 176.35 176.74 3ktx h PRO 180 N 6.76 0.23 -0.46 1.29 0.11 -1.96 -2.55 132.00 135.42 3ktx h PRO 180 Ca 0.06 -0.23 0.00 0.00 0.11 0.00 0.00 66.00 65.94 3ktx h PRO 180 Cb 0.91 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.09 3ktx h PRO 180 CO 0.77 0.94 0.00 0.41 -0.21 0.00 0.00 178.00 179.91 3ktx n GLY 181 N 0.76 1.34 3.48 -0.55 0.00 -1.26 -4.87 105.19 104.10 3ktx n GLY 181 Ca -0.04 -0.57 -0.35 0.00 0.00 0.00 0.00 46.02 45.06 3ktx n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ktx s ASP 183 N 0.94 6.40 0.14 0.00 1.01 -1.26 -4.88 116.67 119.01 3ktx s ASP 183 Ca 0.02 -1.32 -0.31 0.00 0.71 0.00 0.00 52.55 51.65 3ktx s ASP 183 Cb -0.14 -2.57 -0.11 0.00 1.01 0.00 0.00 42.92 41.11 3ktx s ASP 183 CO 0.02 -1.60 1.81 0.52 0.21 0.00 0.00 175.17 176.13 3ktx n VAL 184 N 6.90 0.29 -1.19 -1.27 0.31 -1.26 -4.94 118.33 117.16 3ktx n VAL 184 Ca 0.31 -0.05 0.08 0.00 -0.01 0.00 0.00 64.34 64.66 3ktx n VAL 184 Cb 0.51 -2.09 0.18 0.00 -0.91 0.00 0.00 33.84 31.53 3ktx n VAL 184 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 3ktx n ASP 185 N 5.27 2.51 -4.29 4.52 3.85 -1.26 -5.02 116.55 122.13 3ktx n ASP 185 Ca 0.18 -3.29 -0.39 0.00 -0.71 0.00 0.00 54.79 50.57 3ktx n ASP 185 Cb 0.37 -0.49 0.01 0.00 -1.35 0.00 0.00 41.12 39.66 3ktx n ASP 185 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 3ktx n LEU 186 N -1.19 -2.77 -4.64 -2.12 4.77 -1.26 -4.91 117.00 104.87 3ktx n LEU 186 Ca 0.19 0.69 -0.29 0.00 -0.03 0.00 0.00 56.01 56.57 3ktx n LEU 186 Cb 0.73 -0.91 0.20 0.00 -2.33 0.00 0.00 43.42 41.10 3ktx n LEU 186 CO 0.04 -4.41 0.63 -2.16 -1.33 0.00 0.00 177.39 170.15 3ktx s PRO 187 N -1.20 -0.13 0.12 3.23 0.04 -1.26 -4.94 135.00 130.86 3ktx s PRO 187 Ca 0.59 0.36 -0.23 0.00 0.04 0.00 0.00 61.00 61.77 3ktx s PRO 187 Cb -0.50 -1.68 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 3ktx s PRO 187 CO 0.64 -3.08 1.68 0.00 0.04 0.00 0.00 177.00 176.28 3ktx h ALA 188 N -2.14 -0.10 -4.04 8.56 0.00 -1.91 -3.44 119.26 116.19 3ktx h ALA 188 Ca -0.53 0.03 -0.49 0.00 0.00 0.00 0.00 54.91 53.92 3ktx h ALA 188 Cb 1.33 0.26 -0.27 0.00 0.00 0.00 0.00 17.79 19.11 3ktx h ALA 188 CO 0.52 -0.61 -0.81 0.14 0.00 0.00 0.00 179.25 178.49 3ktx s VAL 189 N -6.15 1.20 0.96 0.00 -7.23 -1.26 -4.60 120.40 103.32 3ktx s VAL 189 Ca -0.14 -0.82 -0.15 0.00 -1.81 0.00 0.00 61.98 59.06 3ktx s VAL 189 Cb 0.09 -1.03 0.17 0.00 0.56 0.00 0.00 36.38 36.17 3ktx s VAL 189 CO 0.67 0.20 1.20 -0.94 -0.31 0.00 0.00 175.10 175.92 3ktx s SER 190 N -0.71 3.08 0.10 4.85 1.04 -1.26 -4.88 113.70 115.92 3ktx s SER 190 Ca 0.04 0.66 -0.21 0.00 0.48 0.00 0.00 55.95 56.92 3ktx s SER 190 Cb -0.07 -1.00 -0.10 0.00 0.10 0.00 0.00 66.02 64.95 3ktx s SER 190 CO 0.00 -2.79 1.71 0.00 0.98 0.00 0.00 173.24 173.14 3ktx h ALA 191 N -1.67 0.17 -0.61 5.32 0.00 -1.99 -0.60 119.26 119.88 3ktx h ALA 191 Ca -0.47 -0.04 0.13 0.00 0.00 0.00 0.00 54.91 54.52 3ktx h ALA 191 Cb 1.29 -0.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.92 3ktx h ALA 191 CO 0.50 -0.30 -0.09 -0.22 0.00 0.00 0.00 179.25 179.13 3ktx h LYS 192 N 0.13 0.04 -0.09 0.00 3.64 -1.98 -1.20 116.57 117.11 3ktx h LYS 192 Ca 0.05 -0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.44 3ktx h LYS 192 Cb 0.05 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 3ktx h LYS 192 CO -0.01 0.03 -0.02 -0.44 -2.27 0.00 0.00 179.45 176.74 3ktx h ASP 193 N 0.04 -0.07 -0.58 4.20 3.32 -1.80 0.86 116.42 122.39 3ktx h ASP 193 Ca 0.31 0.03 0.03 0.00 0.02 0.00 0.00 57.03 57.42 3ktx h ASP 193 Cb 0.48 0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.05 3ktx h ASP 193 CO -0.59 -0.02 0.38 0.03 -1.72 0.00 0.00 179.24 177.32 3ktx h ARG 194 N 0.01 0.64 -0.04 3.56 3.08 -0.51 0.30 114.38 121.42 3ktx h ARG 194 Ca 0.04 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 59.99 3ktx h ARG 194 Cb 0.06 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 29.97 3ktx h ARG 194 CO -0.09 0.43 -0.24 0.28 -1.07 0.00 0.00 179.97 179.28 3ktx h VAL 195 N 0.66 1.47 -0.85 2.04 2.07 -0.17 -2.68 116.25 118.79 3ktx h VAL 195 Ca 0.23 -1.74 -0.01 0.00 0.82 0.00 0.00 66.70 66.01 3ktx h VAL 195 Cb 0.10 2.48 -0.04 0.00 -1.52 0.00 0.00 31.29 32.31 3ktx h VAL 195 CO -0.06 0.48 0.49 0.44 0.02 0.00 0.00 177.57 178.95 3ktx h ASP 196 N -0.34 1.04 -0.61 0.57 3.32 0.15 -2.37 116.42 118.18 3ktx h ASP 196 Ca -0.02 -0.08 -0.04 0.00 0.02 0.00 0.00 57.03 56.91 3ktx h ASP 196 Cb 0.91 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.17 3ktx h ASP 196 CO 0.05 0.82 0.24 -0.07 -1.72 0.00 0.00 179.24 178.56 3ktx h LEU 197 N 1.18 0.84 -1.20 1.55 3.38 -0.49 -0.03 115.31 120.54 3ktx h LEU 197 Ca 0.30 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3ktx h LEU 197 Cb -0.01 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 3ktx h LEU 197 CO -0.05 0.79 0.49 -0.61 0.09 0.00 0.00 178.44 179.14 3ktx h GLN 198 N 0.85 1.03 -0.64 1.13 5.75 -1.37 -0.86 115.11 121.00 3ktx h GLN 198 Ca 0.20 -0.07 -0.02 0.00 -0.15 0.00 0.00 58.65 58.61 3ktx h GLN 198 Cb 0.21 -0.22 -0.03 0.00 1.07 0.00 0.00 27.48 28.50 3ktx h GLN 198 CO -0.02 0.70 0.31 0.35 -2.65 0.00 0.00 178.83 177.52 3ktx h PHE 199 N 1.05 0.92 -0.45 3.99 3.57 -0.81 -1.35 116.94 123.85 3ktx h PHE 199 Ca 0.28 -0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.79 3ktx h PHE 199 Cb -0.09 -0.29 -0.05 0.00 2.79 0.00 0.00 35.95 38.32 3ktx h PHE 199 CO 0.00 0.69 0.19 0.78 -2.23 0.00 0.00 178.31 177.74 3ktx h GLY 200 N 0.88 0.61 0.76 2.40 0.00 -0.25 0.24 103.07 107.72 3ktx h GLY 200 Ca 0.22 -0.12 -0.00 0.00 0.00 0.00 0.00 47.33 47.43 3ktx h GLY 200 CO -0.03 0.06 0.00 -2.08 0.00 0.00 0.00 176.54 174.49 3ktx h VAL 201 N 0.39 1.19 -0.93 4.60 2.07 -1.02 -0.49 116.25 122.06 3ktx h VAL 201 Ca 0.21 -0.56 0.17 0.00 0.82 0.00 0.00 66.70 67.34 3ktx h VAL 201 Cb 0.17 1.56 -0.10 0.00 -1.52 0.00 0.00 31.29 31.40 3ktx h VAL 201 CO -0.18 0.15 0.52 -0.33 0.02 0.00 0.00 177.57 177.74 3ktx h GLU 202 N -0.23 0.66 -0.01 1.57 5.08 -0.78 -1.26 114.58 119.60 3ktx h GLU 202 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3ktx h GLU 202 Cb 0.24 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3ktx h GLU 202 CO 0.00 0.43 -0.00 1.04 -1.00 0.00 0.00 179.01 179.48 3ktx n GLN 203 N -4.83 1.54 -2.93 2.33 1.13 0.82 -4.96 117.38 110.48 3ktx n GLN 203 Ca 0.21 -0.79 -0.11 0.00 -1.94 0.00 0.00 57.00 54.37 3ktx n GLN 203 Cb 0.52 -1.48 0.04 0.00 0.11 0.00 0.00 30.24 29.43 3ktx n GLN 203 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3ktx n GLY 204 N 1.14 0.11 3.77 1.08 0.00 -0.25 -5.03 105.19 106.02 3ktx n GLY 204 Ca 0.20 -0.19 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 3ktx n GLY 204 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3ktx s VAL 205 N -3.17 3.26 -0.13 1.61 -7.23 -0.88 -4.97 120.40 108.89 3ktx s VAL 205 Ca 0.18 0.56 0.17 0.00 -1.81 0.00 0.00 61.98 61.07 3ktx s VAL 205 Cb -0.08 -3.07 -0.12 0.00 0.56 0.00 0.00 36.38 33.67 3ktx s VAL 205 CO 0.38 -0.40 0.87 0.44 -0.31 0.00 0.00 175.10 176.08 3ktx h ASP 206 N -0.16 0.00 -4.88 4.85 3.32 -1.55 -3.47 116.42 114.53 3ktx h ASP 206 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 3ktx h ASP 206 Cb 1.24 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.65 3ktx h ASP 206 CO 0.54 0.53 0.28 0.00 -1.72 0.00 0.00 179.24 178.87 3ktx s MET 207 N -2.96 1.11 -0.09 3.56 0.23 -1.17 -2.24 119.30 117.74 3ktx s MET 207 Ca -0.02 -0.27 0.02 0.00 -1.03 0.00 0.00 55.69 54.39 3ktx s MET 207 Cb 0.09 0.51 -0.02 0.00 -1.53 0.00 0.00 34.83 33.88 3ktx s MET 207 CO 0.81 -0.46 -0.13 0.42 -2.03 0.00 0.00 175.02 173.63 3ktx s ILE 208 N -3.00 3.13 -0.42 3.16 -1.09 0.43 -1.40 121.20 122.01 3ktx s ILE 208 Ca -0.01 -0.67 -0.12 0.00 -2.23 0.00 0.00 60.65 57.62 3ktx s ILE 208 Cb -0.01 -2.27 0.06 0.00 -1.58 0.00 0.00 42.46 38.66 3ktx s ILE 208 CO -0.07 0.56 0.29 -0.36 -1.23 0.00 0.00 174.94 174.13 3ktx s PHE 209 N -0.26 3.27 -0.29 3.97 0.08 -0.09 -0.66 117.98 124.00 3ktx s PHE 209 Ca 0.02 -1.07 -0.16 0.00 0.12 0.00 0.00 56.93 55.85 3ktx s PHE 209 Cb -0.13 -2.83 -0.03 0.00 -0.57 0.00 0.00 43.02 39.46 3ktx s PHE 209 CO 0.03 -0.75 0.40 0.00 -0.10 0.00 0.00 175.22 174.80 3ktx s ALA 210 N 1.56 3.54 0.41 5.36 0.00 0.13 -1.47 121.76 131.29 3ktx s ALA 210 Ca 0.03 -0.88 -0.25 0.00 0.00 0.00 0.00 51.96 50.86 3ktx s ALA 210 Cb -0.22 -2.78 -0.08 0.00 0.00 0.00 0.00 23.12 20.04 3ktx s ALA 210 CO 0.06 -0.80 1.20 -1.12 0.00 0.00 0.00 175.76 175.10 3ktx s SER 211 N 1.66 6.40 -1.34 0.00 0.01 -1.26 -1.09 113.70 118.08 3ktx s SER 211 Ca 0.15 2.41 -0.07 0.00 1.31 0.00 0.00 55.95 59.75 3ktx s SER 211 Cb -0.16 -2.62 0.01 0.00 0.21 0.00 0.00 66.02 63.46 3ktx s SER 211 CO 0.11 -0.77 0.92 0.33 0.41 0.00 0.00 173.24 174.23 3ktx n PHE 212 N -0.02 -2.39 -2.36 2.43 7.35 -1.21 -4.83 117.46 116.42 3ktx n PHE 212 Ca 0.05 0.79 -0.42 0.00 -0.76 0.00 0.00 57.45 57.10 3ktx n PHE 212 Cb 0.46 -4.60 -0.03 0.00 0.35 0.00 0.00 39.48 35.66 3ktx n PHE 212 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 3ktx s ILE 213 N -3.24 3.94 -0.01 -2.13 -1.09 -0.87 -4.89 121.20 112.92 3ktx s ILE 213 Ca 0.45 1.36 0.02 0.00 -2.23 0.00 0.00 60.65 60.25 3ktx s ILE 213 Cb -0.20 -3.87 -0.03 0.00 -1.58 0.00 0.00 42.46 36.78 3ktx s ILE 213 CO 0.56 0.05 0.03 0.54 -1.23 0.00 0.00 174.94 174.90 3ktx n ARG 214 N 4.57 1.56 -3.85 2.79 1.74 -1.26 -4.20 116.66 118.00 3ktx n ARG 214 Ca 0.11 -0.01 -0.09 0.00 -0.77 0.00 0.00 57.85 57.08 3ktx n ARG 214 Cb 0.45 -1.05 -0.05 0.00 -1.02 0.00 0.00 32.46 30.79 3ktx n ARG 214 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3ktx s SER 215 N -2.65 -0.12 0.13 0.55 1.04 -1.26 -3.85 113.70 107.54 3ktx s SER 215 Ca -0.01 -0.68 -0.13 0.00 0.48 0.00 0.00 55.95 55.61 3ktx s SER 215 Cb 0.01 0.52 -0.01 0.00 0.10 0.00 0.00 66.02 66.64 3ktx s SER 215 CO 0.08 -1.00 1.56 0.00 0.98 0.00 0.00 173.24 174.87 3ktx h ALA 216 N 2.34 0.58 -0.87 5.32 0.00 -1.88 -2.71 119.26 122.04 3ktx h ALA 216 Ca -0.30 -0.29 0.14 0.00 0.00 0.00 0.00 54.91 54.46 3ktx h ALA 216 Cb 1.25 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 3ktx h ALA 216 CO 0.41 0.41 0.56 1.49 0.00 0.00 0.00 179.25 182.13 3ktx h GLU 217 N 0.62 0.63 -0.09 0.00 4.81 -1.97 0.11 114.58 118.70 3ktx h GLU 217 Ca 0.12 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 3ktx h GLU 217 Cb 0.56 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 3ktx h GLU 217 CO 0.03 0.42 0.00 1.96 -0.73 0.00 0.00 179.01 180.69 3ktx h GLN 218 N 0.65 0.12 -0.66 1.92 4.20 -1.90 0.43 115.11 119.86 3ktx h GLN 218 Ca 0.44 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 59.12 3ktx h GLN 218 Cb 0.74 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.46 3ktx h GLN 218 CO -0.19 0.13 0.35 0.28 -0.67 0.00 0.00 178.83 178.73 3ktx h VAL 219 N 0.12 1.20 -0.66 -0.54 2.07 -0.80 -2.33 116.25 115.30 3ktx h VAL 219 Ca 0.03 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 3ktx h VAL 219 Cb 0.08 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.14 3ktx h VAL 219 CO 0.00 0.22 0.39 1.23 0.02 0.00 0.00 177.57 179.43 3ktx h GLY 220 N 0.98 0.97 0.66 2.17 0.00 -0.87 -1.66 103.07 105.32 3ktx h GLY 220 Ca 0.23 -0.42 0.07 0.00 0.00 0.00 0.00 47.33 47.21 3ktx h GLY 220 CO -0.04 0.40 0.45 -0.55 0.00 0.00 0.00 176.54 176.81 3ktx h ASP 221 N 0.90 0.68 -0.27 0.19 3.32 -1.22 0.36 116.42 120.38 3ktx h ASP 221 Ca 0.24 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.30 3ktx h ASP 221 Cb -0.00 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 3ktx h ASP 221 CO -0.04 0.43 0.13 0.58 -1.72 0.00 0.00 179.24 178.61 3ktx h VAL 222 N 0.81 1.15 -0.79 -1.35 2.07 -1.09 -1.34 116.25 115.71 3ktx h VAL 222 Ca 0.35 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 3ktx h VAL 222 Cb 0.22 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 3ktx h VAL 222 CO -0.19 0.16 0.46 -0.09 0.02 0.00 0.00 177.57 177.93 3ktx h ARG 223 N 0.30 1.08 -0.59 1.57 9.65 -0.31 -1.52 114.38 124.56 3ktx h ARG 223 Ca 0.09 -0.11 -0.08 0.00 -1.10 0.00 0.00 59.98 58.79 3ktx h ARG 223 Cb 0.13 -0.22 -0.02 0.00 -1.39 0.00 0.00 29.97 28.47 3ktx h ARG 223 CO -0.01 0.78 0.06 0.87 2.80 0.00 0.00 179.97 184.46 3ktx h LYS 224 N 1.09 1.01 0.00 0.20 1.57 -0.16 -1.75 116.57 118.52 3ktx h LYS 224 Ca 0.28 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 3ktx h LYS 224 Cb -0.02 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.18 3ktx h LYS 224 CO -0.05 0.97 -0.05 0.00 -0.57 0.00 0.00 179.45 179.75 3ktx h ALA 225 N 1.00 1.60 0.00 3.86 0.00 -0.84 -0.27 119.26 124.61 3ktx h ALA 225 Ca 0.18 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 3ktx h ALA 225 Cb 0.48 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3ktx h ALA 225 CO 0.02 0.07 -0.41 -0.07 0.00 0.00 0.00 179.25 178.85 3ktx h LEU 226 N 0.00 0.00 -0.25 0.00 3.38 -0.45 -3.40 115.31 114.60 3ktx h LEU 226 Ca -0.00 0.00 0.30 0.00 0.09 0.00 0.00 57.88 58.27 3ktx h LEU 226 Cb 0.12 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.78 3ktx h LEU 226 CO 0.01 0.41 -0.50 0.61 0.09 0.00 0.00 178.44 179.06 3ktx n GLY 227 N 0.97 -1.98 0.41 0.83 0.00 -0.11 -2.84 105.19 102.46 3ktx n GLY 227 Ca 0.02 -1.23 0.22 0.00 0.00 0.00 0.00 46.02 45.03 3ktx n GLY 227 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ktx h PRO 228 N -1.05 0.38 0.00 1.61 0.11 -1.88 0.96 132.00 132.13 3ktx h PRO 228 Ca -0.01 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.08 3ktx h PRO 228 Cb 1.03 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.06 3ktx h PRO 228 CO 0.02 0.25 -0.15 1.63 -0.21 0.00 0.00 178.00 179.54 3ktx n LYS 229 N -4.58 0.15 -0.88 1.05 5.02 -1.26 -3.50 118.16 114.16 3ktx n LYS 229 Ca 0.24 0.10 0.07 0.00 -2.02 0.00 0.00 58.31 56.70 3ktx n LYS 229 Cb 0.84 -1.65 0.40 0.00 -0.02 0.00 0.00 35.03 34.60 3ktx n LYS 229 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3ktx n GLY 230 N 1.40 3.00 0.16 0.72 0.00 0.33 -4.72 105.19 106.08 3ktx n GLY 230 Ca 0.06 -0.93 0.02 0.00 0.00 0.00 0.00 46.02 45.17 3ktx n GLY 230 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3ktx h ARG 231 N 4.00 0.00 -0.07 1.61 0.11 -1.59 -2.51 114.38 115.93 3ktx h ARG 231 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3ktx h ARG 231 Cb 1.95 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.03 3ktx h ARG 231 CO 0.47 0.50 0.00 -0.25 0.10 0.00 0.00 179.97 180.79 3ktx n ASP 232 N -3.69 0.74 -4.76 0.08 8.00 -1.26 -4.89 116.55 110.76 3ktx n ASP 232 Ca -0.01 -1.51 -0.38 0.00 0.71 0.00 0.00 54.79 53.60 3ktx n ASP 232 Cb 0.56 -0.04 -0.06 0.00 -0.02 0.00 0.00 41.12 41.56 3ktx n ASP 232 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3ktx s ILE 233 N -1.92 5.04 0.27 0.53 1.01 -0.95 -5.00 121.20 120.19 3ktx s ILE 233 Ca 0.31 1.06 -0.30 0.00 0.00 0.00 0.00 60.65 61.72 3ktx s ILE 233 Cb 0.16 -3.85 -0.09 0.00 0.01 0.00 0.00 42.46 38.69 3ktx s ILE 233 CO 0.25 0.41 1.06 -0.04 0.00 0.00 0.00 174.94 176.62 3ktx s MET 234 N -0.01 4.69 -0.30 2.79 -1.94 -0.95 -4.89 119.30 118.69 3ktx s MET 234 Ca 0.28 1.72 -0.08 0.00 -1.71 0.00 0.00 55.69 55.89 3ktx s MET 234 Cb -0.17 -3.22 -0.01 0.00 2.01 0.00 0.00 34.83 33.45 3ktx s MET 234 CO 0.14 0.28 0.12 0.42 -0.01 0.00 0.00 175.02 175.97 3ktx s ILE 235 N -1.13 4.36 -0.30 2.53 1.01 -1.26 -0.42 121.20 125.99 3ktx s ILE 235 Ca 0.44 -0.47 -0.10 0.00 0.00 0.00 0.00 60.65 60.52 3ktx s ILE 235 Cb -0.30 -3.21 -0.01 0.00 0.01 0.00 0.00 42.46 38.95 3ktx s ILE 235 CO 0.39 0.11 0.15 -0.63 0.00 0.00 0.00 174.94 174.96 3ktx s ILE 236 N 1.58 4.65 -0.08 2.92 -1.09 0.16 -1.18 121.20 128.16 3ktx s ILE 236 Ca 0.04 -0.35 -0.22 0.00 -2.23 0.00 0.00 60.65 57.89 3ktx s ILE 236 Cb -0.17 -3.34 -0.04 0.00 -1.58 0.00 0.00 42.46 37.33 3ktx s ILE 236 CO 0.05 0.10 0.64 0.00 -1.23 0.00 0.00 174.94 174.50 3ktx s LYS 238 N 0.77 4.14 -0.29 0.00 1.02 -0.25 -0.76 119.74 124.37 3ktx s LYS 238 Ca 0.34 0.68 -0.14 0.00 0.02 0.00 0.00 55.97 56.87 3ktx s LYS 238 Cb -0.17 -3.64 -0.03 0.00 -0.52 0.00 0.00 37.83 33.46 3ktx s LYS 238 CO 0.16 -0.43 0.33 0.42 -0.92 0.00 0.00 175.35 174.91 3ktx s ILE 239 N 2.57 5.20 0.00 2.17 -1.09 -0.48 -2.04 121.20 127.53 3ktx s ILE 239 Ca 0.29 0.35 0.00 0.00 -2.23 0.00 0.00 60.65 59.06 3ktx s ILE 239 Cb -0.15 -3.69 0.00 0.00 -1.58 0.00 0.00 42.46 37.03 3ktx s ILE 239 CO 0.08 0.11 0.00 -0.62 -1.23 0.00 0.00 174.94 173.28 3ktx n GLU 240 N 5.29 2.84 -4.13 2.79 1.02 -1.26 -2.51 120.64 124.67 3ktx n GLU 240 Ca -0.10 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 56.89 3ktx n GLU 240 Cb 0.51 -0.23 -0.05 0.00 -0.02 0.00 0.00 31.44 31.65 3ktx n GLU 240 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3ktx s ASN 241 N -0.42 1.00 0.41 1.62 4.22 -1.26 -2.47 114.94 118.04 3ktx s ASN 241 Ca 0.00 -1.52 0.16 0.00 -2.14 0.00 0.00 52.86 49.36 3ktx s ASN 241 Cb 0.00 0.63 1.04 0.00 1.28 0.00 0.00 41.25 44.20 3ktx s ASN 241 CO 0.00 -1.23 1.86 1.12 -2.04 0.00 0.00 177.10 176.81 3ktx h HIS 242 N 2.14 0.58 -0.31 1.54 2.07 -1.90 -2.57 115.15 116.70 3ktx h HIS 242 Ca -0.28 0.02 -0.12 0.00 -2.85 0.00 0.00 60.37 57.14 3ktx h HIS 242 Cb 1.24 -0.18 -0.01 0.00 2.57 0.00 0.00 27.41 31.04 3ktx h HIS 242 CO 1.45 0.17 -0.27 1.96 -3.07 0.00 0.00 177.93 178.16 3ktx h GLN 243 N 0.45 0.73 -0.58 5.12 4.20 -1.94 0.15 115.11 123.24 3ktx h GLN 243 Ca 0.46 -0.37 -0.02 0.00 0.06 0.00 0.00 58.65 58.78 3ktx h GLN 243 Cb 1.08 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.84 3ktx h GLN 243 CO -0.18 0.99 0.27 0.78 -0.67 0.00 0.00 178.83 180.02 3ktx h GLY 244 N 0.49 0.88 0.66 3.46 0.00 -1.59 0.19 103.07 107.16 3ktx h GLY 244 Ca 0.05 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 46.93 3ktx h GLY 244 CO 0.07 0.39 -0.09 -2.08 0.00 0.00 0.00 176.54 174.83 3ktx h VAL 245 N 0.82 1.36 -0.59 4.60 2.07 -1.12 -2.03 116.25 121.37 3ktx h VAL 245 Ca 0.20 -1.24 0.07 0.00 0.82 0.00 0.00 66.70 66.55 3ktx h VAL 245 Cb 0.09 1.98 -0.06 0.00 -1.52 0.00 0.00 31.29 31.79 3ktx h VAL 245 CO -0.03 0.35 0.27 1.56 0.02 0.00 0.00 177.57 179.75 3ktx h GLN 246 N -0.19 0.49 -0.40 1.57 4.20 -0.50 -1.97 115.11 118.31 3ktx h GLN 246 Ca 0.01 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.70 3ktx h GLN 246 Cb 0.60 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.27 3ktx h GLN 246 CO 0.02 0.32 0.00 0.09 -0.67 0.00 0.00 178.83 178.60 3ktx n ASN 247 N -4.91 1.91 -0.32 1.46 3.02 0.66 -4.61 115.26 112.47 3ktx n ASN 247 Ca 0.07 -2.07 0.16 0.00 -0.03 0.00 0.00 54.58 52.71 3ktx n ASN 247 Cb 0.20 -0.27 0.40 0.00 -0.61 0.00 0.00 39.78 39.50 3ktx n ASN 247 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3ktx h ILE 248 N 1.80 0.67 -0.26 2.41 6.09 -0.59 -2.51 117.51 125.13 3ktx h ILE 248 Ca 0.00 -0.21 -0.02 0.00 -1.37 0.00 0.00 64.86 63.26 3ktx h ILE 248 Cb 0.54 0.01 -0.01 0.00 0.47 0.00 0.00 36.82 37.83 3ktx h ILE 248 CO 0.04 0.11 0.08 0.44 -3.07 0.00 0.00 178.15 175.75 3ktx h ASP 249 N 0.61 0.38 0.18 2.19 3.32 -1.85 -0.79 116.42 120.45 3ktx h ASP 249 Ca 0.55 -0.20 -0.19 0.00 0.02 0.00 0.00 57.03 57.21 3ktx h ASP 249 Cb 1.07 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 40.52 3ktx h ASP 249 CO -0.31 0.48 -0.73 0.77 -1.72 0.00 0.00 179.24 177.73 3ktx h SER 250 N 0.25 0.57 -0.08 6.45 4.64 -1.85 -2.01 113.55 121.52 3ktx h SER 250 Ca 0.08 -0.37 0.02 0.00 -0.47 0.00 0.00 61.79 61.05 3ktx h SER 250 Cb 0.24 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 3ktx h SER 250 CO -0.00 1.12 -0.02 0.40 -0.87 0.00 0.00 176.83 177.46 3ktx h ILE 251 N 0.33 0.92 -0.52 0.95 2.04 -1.28 -2.41 117.51 117.54 3ktx h ILE 251 Ca -0.03 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.88 3ktx h ILE 251 Cb 1.32 0.92 -0.05 0.00 -0.74 0.00 0.00 36.82 38.26 3ktx h ILE 251 CO 0.13 0.00 0.23 0.40 0.00 0.00 0.00 178.15 178.91 3ktx h ILE 252 N -0.00 0.89 -0.82 -0.67 2.04 -1.07 -0.70 117.51 117.18 3ktx h ILE 252 Ca 0.04 -0.15 0.11 0.00 1.00 0.00 0.00 64.86 65.86 3ktx h ILE 252 Cb 0.06 0.41 -0.08 0.00 -0.74 0.00 0.00 36.82 36.47 3ktx h ILE 252 CO -0.08 0.08 0.44 -0.08 0.00 0.00 0.00 178.15 178.51 3ktx h GLU 253 N 0.44 0.68 0.00 2.37 4.81 -1.01 -2.42 114.58 119.45 3ktx h GLU 253 Ca 0.24 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.36 3ktx h GLU 253 Cb 0.21 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 3ktx h GLU 253 CO -0.20 0.45 -0.32 0.93 -0.73 0.00 0.00 179.01 179.14 3ktx h GLU 254 N 0.70 0.00 -6.81 1.92 4.39 -0.95 -3.47 114.58 110.36 3ktx h GLU 254 Ca 0.42 0.00 -0.46 0.00 0.34 0.00 0.00 59.36 59.66 3ktx h GLU 254 Cb 0.47 0.00 0.05 0.00 -0.10 0.00 0.00 28.75 29.17 3ktx h GLU 254 CO -0.29 0.32 -0.04 -1.54 -1.16 0.00 0.00 179.01 176.29 3ktx s SER 255 N -6.35 4.99 0.00 1.42 1.04 -0.32 -4.98 113.70 109.50 3ktx s SER 255 Ca 0.05 -0.42 0.24 0.00 0.48 0.00 0.00 55.95 56.29 3ktx s SER 255 Cb 0.07 -0.24 0.25 0.00 0.10 0.00 0.00 66.02 66.20 3ktx s SER 255 CO 0.71 -1.37 1.29 0.47 0.98 0.00 0.00 173.24 175.33 3ktx n ASP 256 N -2.39 3.11 0.00 7.02 8.00 -0.32 -4.94 116.55 127.02 3ktx n ASP 256 Ca 0.12 -1.99 0.00 0.00 0.71 0.00 0.00 54.79 53.63 3ktx n ASP 256 Cb 0.60 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 3ktx n ASP 256 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ktx n GLY 257 N 1.38 -0.24 2.96 0.44 0.00 -1.22 -3.98 105.19 104.54 3ktx n GLY 257 Ca 0.15 -1.25 -0.14 0.00 0.00 0.00 0.00 46.02 44.79 3ktx n GLY 257 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ktx s ILE 258 N -2.00 0.31 -0.16 -0.61 -1.09 -0.74 -1.35 121.20 115.56 3ktx s ILE 258 Ca 0.00 -0.40 -0.01 0.00 -2.23 0.00 0.00 60.65 58.00 3ktx s ILE 258 Cb 0.00 -0.31 -0.01 0.00 -1.58 0.00 0.00 42.46 40.56 3ktx s ILE 258 CO 0.00 -0.07 -0.10 -0.32 -1.23 0.00 0.00 174.94 173.22 3ktx s MET 259 N -0.51 3.38 -0.49 2.79 -2.45 0.06 -0.62 119.30 121.46 3ktx s MET 259 Ca -0.03 -0.66 -0.22 0.00 -1.25 0.00 0.00 55.69 53.53 3ktx s MET 259 Cb -0.04 -2.76 0.04 0.00 1.25 0.00 0.00 34.83 33.32 3ktx s MET 259 CO -0.00 0.07 0.78 0.08 1.05 0.00 0.00 175.02 177.00 3ktx s VAL 260 N 0.73 4.64 -1.18 10.11 1.01 0.21 -1.38 120.40 134.55 3ktx s VAL 260 Ca -0.05 0.14 -0.11 0.00 0.00 0.00 0.00 61.98 61.96 3ktx s VAL 260 Cb -0.15 -4.37 0.22 0.00 0.00 0.00 0.00 36.38 32.08 3ktx s VAL 260 CO 0.02 -0.84 1.36 0.00 0.00 0.00 0.00 175.10 175.63 3ktx n ALA 261 N 6.77 4.22 -0.24 5.51 0.00 -1.05 -2.08 120.51 133.64 3ktx n ALA 261 Ca -0.00 -4.44 0.04 0.00 0.00 0.00 0.00 53.44 49.03 3ktx n ALA 261 Cb 0.47 -2.78 0.15 0.00 0.00 0.00 0.00 19.45 17.29 3ktx n ALA 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ktx h ARG 262 N 6.73 0.14 -0.78 0.00 -0.00 -1.80 -1.70 114.38 116.97 3ktx h ARG 262 Ca 0.27 -0.01 0.05 0.00 -0.50 0.00 0.00 59.98 59.78 3ktx h ARG 262 Cb 0.83 -0.03 -0.05 0.00 0.00 0.00 0.00 29.97 30.72 3ktx h ARG 262 CO 1.20 0.09 0.48 0.78 0.00 0.00 0.00 179.97 182.52 3ktx h GLY 263 N 0.14 1.15 0.51 0.04 0.00 -1.84 -0.39 103.07 102.68 3ktx h GLY 263 Ca 0.39 -0.35 -0.07 0.00 0.00 0.00 0.00 47.33 47.30 3ktx h GLY 263 CO -0.59 0.27 -0.26 -0.55 0.00 0.00 0.00 176.54 175.41 3ktx h ASP 264 N 0.91 0.26 -0.76 0.19 3.32 -1.73 -2.69 116.42 115.91 3ktx h ASP 264 Ca 0.33 -0.73 0.17 0.00 0.02 0.00 0.00 57.03 56.82 3ktx h ASP 264 Cb 0.10 -0.08 -0.11 0.00 0.22 0.00 0.00 39.33 39.45 3ktx h ASP 264 CO -0.14 0.95 0.19 -0.07 -1.72 0.00 0.00 179.24 178.45 3ktx h LEU 265 N -0.41 0.02 -0.37 1.55 3.38 -0.99 -0.27 115.31 118.20 3ktx h LEU 265 Ca -0.03 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3ktx h LEU 265 Cb 0.98 0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.93 3ktx h LEU 265 CO 0.05 -0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.14 3ktx n GLY 266 N -1.36 -0.80 0.28 0.83 0.00 -0.16 -1.84 105.19 102.14 3ktx n GLY 266 Ca 0.15 0.04 -0.12 0.00 0.00 0.00 0.00 46.02 46.10 3ktx n GLY 266 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3ktx h VAL 267 N 0.00 1.27 -0.00 1.61 2.07 -0.93 -3.35 116.25 116.92 3ktx h VAL 267 Ca 0.00 -1.43 0.00 0.00 0.82 0.00 0.00 66.70 66.09 3ktx h VAL 267 Cb 0.11 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 3ktx h VAL 267 CO 0.00 0.49 -0.20 -1.84 0.02 0.00 0.00 177.57 176.04 3ktx n GLU 268 N -4.10 4.31 -4.80 1.57 0.28 -1.09 -4.88 120.64 111.94 3ktx n GLU 268 Ca -0.00 -0.15 -0.33 0.00 -0.16 0.00 0.00 57.16 56.51 3ktx n GLU 268 Cb 0.48 -0.81 -0.15 0.00 1.43 0.00 0.00 31.44 32.39 3ktx n GLU 268 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 3ktx s ILE 269 N -1.31 2.98 0.40 3.84 1.01 -0.77 -5.00 121.20 122.36 3ktx s ILE 269 Ca 0.03 -0.69 -0.25 0.00 0.00 0.00 0.00 60.65 59.75 3ktx s ILE 269 Cb 0.04 -2.24 -0.11 0.00 0.01 0.00 0.00 42.46 40.15 3ktx s ILE 269 CO 0.19 0.53 0.95 -2.65 0.00 0.00 0.00 174.94 173.95 3ktx n PRO 270 N 3.54 1.24 -0.34 2.79 -0.02 -1.26 -4.26 135.00 136.69 3ktx n PRO 270 Ca -0.18 0.45 0.06 0.00 -2.02 0.00 0.00 63.50 61.80 3ktx n PRO 270 Cb 0.53 -1.94 0.24 0.00 -0.02 0.00 0.00 33.50 32.30 3ktx n PRO 270 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ktx h ALA 271 N 1.50 1.52 -0.14 3.55 0.00 -1.96 -0.92 119.26 122.82 3ktx h ALA 271 Ca -0.43 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 3ktx h ALA 271 Cb 1.35 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 3ktx h ALA 271 CO 0.57 0.28 -0.21 1.05 0.00 0.00 0.00 179.25 180.93 3ktx h GLU 272 N 1.02 0.24 -0.07 0.00 9.09 -2.01 -1.83 114.58 121.02 3ktx h GLU 272 Ca 0.45 -0.07 -0.17 0.00 0.05 0.00 0.00 59.36 59.62 3ktx h GLU 272 Cb 0.37 -0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 27.44 3ktx h GLU 272 CO -0.21 0.45 -0.71 0.87 0.05 0.00 0.00 179.01 179.46 3ktx h LYS 273 N 0.22 0.34 -0.79 1.06 1.57 -1.55 -3.07 116.57 114.35 3ktx h LYS 273 Ca 0.04 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.54 3ktx h LYS 273 Cb 0.51 0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.83 3ktx h LYS 273 CO 0.03 0.91 0.46 0.28 -0.57 0.00 0.00 179.45 180.56 3ktx h VAL 274 N 0.23 1.23 -0.78 0.50 2.07 -0.72 0.12 116.25 118.90 3ktx h VAL 274 Ca -0.02 -0.53 0.08 0.00 0.82 0.00 0.00 66.70 67.04 3ktx h VAL 274 Cb 1.27 0.13 -0.07 0.00 -1.52 0.00 0.00 31.29 31.10 3ktx h VAL 274 CO 0.12 0.25 0.44 0.58 0.02 0.00 0.00 177.57 178.98 3ktx h VAL 275 N 1.10 0.94 -0.16 2.57 2.07 -1.30 0.19 116.25 121.66 3ktx h VAL 275 Ca 0.28 -0.27 -0.16 0.00 0.82 0.00 0.00 66.70 67.38 3ktx h VAL 275 Cb -0.01 0.09 0.01 0.00 -1.52 0.00 0.00 31.29 29.86 3ktx h VAL 275 CO -0.05 0.14 -0.53 0.58 0.02 0.00 0.00 177.57 177.74 3ktx h VAL 276 N 0.77 1.33 -0.85 2.57 2.07 -1.39 -2.62 116.25 118.13 3ktx h VAL 276 Ca 0.37 -1.78 0.10 0.00 0.82 0.00 0.00 66.70 66.21 3ktx h VAL 276 Cb 0.29 1.99 -0.06 0.00 -1.52 0.00 0.00 31.29 31.99 3ktx h VAL 276 CO -0.22 0.55 0.55 0.00 0.02 0.00 0.00 177.57 178.47 3ktx h ALA 277 N 0.55 1.71 -0.39 1.67 0.00 -0.41 -0.01 119.26 122.37 3ktx h ALA 277 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3ktx h ALA 277 Cb 1.15 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 3ktx h ALA 277 CO 0.11 0.12 0.25 0.37 0.00 0.00 0.00 179.25 180.10 3ktx h GLN 278 N 0.80 0.52 -0.61 0.00 4.15 -0.77 -0.65 115.11 118.55 3ktx h GLN 278 Ca 0.40 -0.04 0.02 0.00 0.77 0.00 0.00 58.65 59.79 3ktx h GLN 278 Cb 0.45 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 27.99 3ktx h GLN 278 CO -0.16 0.36 0.39 0.87 -1.93 0.00 0.00 178.83 178.37 3ktx h LYS 279 N 0.53 0.77 -0.11 1.69 1.57 -0.73 -1.33 116.57 118.95 3ktx h LYS 279 Ca 0.14 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 3ktx h LYS 279 Cb -0.04 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.10 3ktx h LYS 279 CO -0.03 0.51 0.02 0.82 -0.57 0.00 0.00 179.45 180.20 3ktx h ILE 280 N 0.79 1.21 -0.52 1.86 2.04 -0.72 -2.39 117.51 119.78 3ktx h ILE 280 Ca 0.23 -0.66 -0.11 0.00 1.00 0.00 0.00 64.86 65.33 3ktx h ILE 280 Cb -0.05 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.45 3ktx h ILE 280 CO -0.07 0.19 -0.11 -0.07 0.00 0.00 0.00 178.15 178.09 3ktx h LEU 281 N -0.04 0.98 -0.05 1.44 4.07 -1.03 0.27 115.31 120.94 3ktx h LEU 281 Ca 0.03 -0.32 -0.00 0.00 0.08 0.00 0.00 57.88 57.67 3ktx h LEU 281 Cb 0.28 -0.27 -0.00 0.00 1.08 0.00 0.00 40.66 41.75 3ktx h LEU 281 CO 0.00 1.09 0.02 0.40 -1.08 0.00 0.00 178.44 178.87 3ktx h ILE 282 N 0.87 1.15 -0.64 1.22 2.04 -1.20 -1.62 117.51 119.34 3ktx h ILE 282 Ca 0.14 -0.46 0.01 0.00 1.00 0.00 0.00 64.86 65.55 3ktx h ILE 282 Cb 0.66 1.37 -0.03 0.00 -0.74 0.00 0.00 36.82 38.08 3ktx h ILE 282 CO 0.05 0.13 0.42 0.28 0.00 0.00 0.00 178.15 179.02 3ktx h SER 283 N -0.10 0.72 -0.79 1.72 0.02 -1.14 0.13 113.55 114.11 3ktx h SER 283 Ca 0.02 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 3ktx h SER 283 Cb 0.19 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 62.51 3ktx h SER 283 CO -0.00 0.52 0.50 0.11 -1.14 0.00 0.00 176.83 176.82 3ktx h LYS 284 N 0.85 0.95 -0.30 3.45 1.57 -0.90 -0.01 116.57 122.18 3ktx h LYS 284 Ca 0.24 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.83 3ktx h LYS 284 Cb -0.08 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.01 3ktx h LYS 284 CO -0.06 0.63 -0.34 0.00 -0.57 0.00 0.00 179.45 179.11 3ktx h ASN 286 N 0.55 0.50 -0.40 0.00 -0.26 -0.15 -0.71 115.58 115.10 3ktx h ASN 286 Ca 0.06 0.02 -0.10 0.00 -0.56 0.00 0.00 56.30 55.73 3ktx h ASN 286 Cb 0.84 -0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 38.02 3ktx h ASN 286 CO 0.07 0.33 -0.13 0.58 -1.06 0.00 0.00 177.43 177.22 3ktx h VAL 287 N 0.63 1.28 0.00 2.81 2.07 -0.84 -2.11 116.25 120.08 3ktx h VAL 287 Ca 0.26 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.54 3ktx h VAL 287 Cb 0.14 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 3ktx h VAL 287 CO -0.16 0.42 0.00 0.00 0.02 0.00 0.00 177.57 177.85 3ktx h ALA 288 N 0.83 1.00 -2.79 1.67 0.00 -0.69 -3.46 119.26 115.82 3ktx h ALA 288 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.75 3ktx h ALA 288 Cb 0.67 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.49 3ktx h ALA 288 CO 0.05 0.00 -0.38 0.41 0.00 0.00 0.00 179.25 179.33 3ktx n GLY 289 N -0.97 -0.09 3.27 0.00 0.00 -0.33 -5.04 105.19 102.03 3ktx n GLY 289 Ca -0.01 -0.23 -0.27 0.00 0.00 0.00 0.00 46.02 45.51 3ktx n GLY 289 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ktx s LYS 290 N -5.15 1.55 0.52 1.61 1.02 -0.82 -4.82 119.74 113.64 3ktx s LYS 290 Ca 0.16 -0.97 -0.22 0.00 0.02 0.00 0.00 55.97 54.96 3ktx s LYS 290 Cb -0.07 -1.66 -0.06 0.00 -0.52 0.00 0.00 37.83 35.53 3ktx s LYS 290 CO 0.19 0.43 1.29 -2.14 -0.92 0.00 0.00 175.35 174.21 3ktx s PRO 291 N -1.10 3.34 -0.03 -1.68 0.01 -1.26 -4.46 135.00 129.82 3ktx s PRO 291 Ca 0.09 2.08 0.01 0.00 0.01 0.00 0.00 61.00 63.19 3ktx s PRO 291 Cb -0.09 -2.30 0.01 0.00 0.01 0.00 0.00 34.50 32.13 3ktx s PRO 291 CO 0.01 -0.98 -0.04 0.54 0.01 0.00 0.00 177.00 176.54 3ktx s VAL 292 N -1.38 0.45 -0.12 3.83 0.11 -1.26 -1.79 120.40 120.23 3ktx s VAL 292 Ca 0.69 -0.14 0.01 0.00 -2.93 0.00 0.00 61.98 59.61 3ktx s VAL 292 Cb -0.36 -0.44 -0.01 0.00 -1.53 0.00 0.00 36.38 34.03 3ktx s VAL 292 CO 0.43 0.17 -0.14 -0.63 -3.33 0.00 0.00 175.10 171.60 3ktx s ILE 293 N 0.50 2.93 -0.31 7.04 1.01 0.21 -1.21 121.20 131.37 3ktx s ILE 293 Ca -0.06 -0.71 -0.15 0.00 0.00 0.00 0.00 60.65 59.73 3ktx s ILE 293 Cb -0.10 -2.22 -0.02 0.00 0.01 0.00 0.00 42.46 40.14 3ktx s ILE 293 CO -0.00 0.53 0.37 0.00 0.00 0.00 0.00 174.94 175.84 3ktx s ALA 295 N 2.06 1.47 0.17 0.00 0.00 -0.88 -1.16 121.76 123.42 3ktx s ALA 295 Ca 0.13 -1.39 0.00 0.00 0.00 0.00 0.00 51.96 50.70 3ktx s ALA 295 Cb -0.16 -0.01 0.00 0.00 0.00 0.00 0.00 23.12 22.95 3ktx s ALA 295 CO 0.11 -0.01 0.00 0.25 0.00 0.00 0.00 175.76 176.11 3ktx n THR 296 N 0.15 -1.55 -3.85 0.00 -2.24 -1.26 -2.73 114.28 102.80 3ktx n THR 296 Ca -0.13 0.58 -0.24 0.00 -2.27 0.00 0.00 64.05 62.00 3ktx n THR 296 Cb 0.59 -0.87 0.00 0.00 -2.10 0.00 0.00 70.33 67.95 3ktx n THR 296 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ktx n GLN 297 N -1.45 -3.98 -0.05 -0.78 6.02 -1.26 -4.71 117.38 111.18 3ktx n GLN 297 Ca 0.00 0.49 -0.04 0.00 -0.01 0.00 0.00 57.00 57.45 3ktx n GLN 297 Cb 0.08 -4.81 -0.01 0.00 1.02 0.00 0.00 30.24 26.52 3ktx n GLN 297 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 3ktx n MET 298 N -4.35 0.31 -2.49 -1.09 2.81 -1.26 -4.67 117.12 106.38 3ktx n MET 298 Ca -0.30 0.38 -0.17 0.00 -1.81 0.00 0.00 57.70 55.80 3ktx n MET 298 Cb 0.68 -1.33 0.02 0.00 -0.71 0.00 0.00 33.22 31.89 3ktx n MET 298 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3ktx n LEU 299 N -3.81 3.32 -0.35 4.03 4.77 -1.26 -4.68 117.00 119.02 3ktx n LEU 299 Ca -0.06 -4.32 0.11 0.00 -0.03 0.00 0.00 56.01 51.72 3ktx n LEU 299 Cb 0.21 -0.03 0.30 0.00 -2.33 0.00 0.00 43.42 41.57 3ktx n LEU 299 CO 0.08 1.81 1.21 -0.08 -1.33 0.00 0.00 177.39 179.09 3ktx h GLU 300 N 2.61 0.81 0.00 3.23 4.81 -1.98 0.10 114.58 124.16 3ktx h GLU 300 Ca 0.13 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 3ktx h GLU 300 Cb 1.19 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.39 3ktx h GLU 300 CO 0.62 0.53 0.00 0.66 -0.73 0.00 0.00 179.01 180.09 3ktx h SER 301 N 0.83 0.00 -0.01 1.04 4.64 -1.93 0.23 113.55 118.34 3ktx h SER 301 Ca 0.54 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 3ktx h SER 301 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 3ktx h SER 301 CO -0.32 0.00 0.00 0.80 -0.87 0.00 0.00 176.83 176.44 3ktx n MET 302 N -2.53 1.06 -0.25 4.77 1.56 0.36 -1.38 117.12 120.71 3ktx n MET 302 Ca 0.01 -0.09 -0.07 0.00 -0.27 0.00 0.00 57.70 57.29 3ktx n MET 302 Cb 0.25 -1.30 0.05 0.00 2.15 0.00 0.00 33.22 34.37 3ktx n MET 302 CO 0.00 0.00 0.00 1.15 -0.73 0.00 0.00 175.97 176.39 3ktx h THR 303 N 0.17 1.25 0.00 1.12 2.02 -1.08 -3.37 112.91 113.03 3ktx h THR 303 Ca 0.00 -0.85 0.00 0.00 0.77 0.00 0.00 66.41 66.33 3ktx h THR 303 Cb 0.04 0.49 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 3ktx h THR 303 CO 0.00 0.33 -0.29 -1.22 0.37 0.00 0.00 175.52 174.72 3ktx n TYR 304 N -4.33 0.00 -4.04 3.16 4.01 -1.20 -0.67 117.16 114.09 3ktx n TYR 304 Ca 0.05 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.49 3ktx n TYR 304 Cb 0.21 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.17 3ktx n TYR 304 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 3ktx s ASN 305 N -1.04 5.60 0.30 7.72 0.02 -0.48 -4.94 114.94 122.11 3ktx s ASN 305 Ca 0.00 0.02 0.24 0.00 -1.02 0.00 0.00 52.86 52.10 3ktx s ASN 305 Cb 0.00 -1.53 1.09 0.00 0.02 0.00 0.00 41.25 40.84 3ktx s ASN 305 CO 0.00 0.18 1.73 1.55 0.02 0.00 0.00 177.10 180.57 3ktx h PRO 306 N 3.30 0.00 -4.16 -0.60 0.13 -1.87 -3.39 132.00 125.41 3ktx h PRO 306 Ca -0.47 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.49 3ktx h PRO 306 Cb 1.16 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.10 3ktx h PRO 306 CO 0.67 0.00 -0.70 1.03 -0.23 0.00 0.00 178.00 178.77 3ktx s ARG 307 N -3.42 0.45 0.69 0.86 0.52 -1.26 -4.99 118.95 111.80 3ktx s ARG 307 Ca 0.02 -0.85 0.00 0.00 -0.52 0.00 0.00 55.73 54.38 3ktx s ARG 307 Cb 0.08 0.07 0.11 0.00 0.52 0.00 0.00 34.95 35.74 3ktx s ARG 307 CO 0.34 -0.05 0.95 -1.25 0.02 0.00 0.00 175.30 175.31 3ktx s PRO 308 N -2.34 1.82 0.67 3.54 0.04 -1.26 -4.47 135.00 133.00 3ktx s PRO 308 Ca -0.07 -1.13 -0.11 0.00 0.04 0.00 0.00 61.00 59.73 3ktx s PRO 308 Cb -0.04 -2.37 -0.01 0.00 0.04 0.00 0.00 34.50 32.12 3ktx s PRO 308 CO -0.04 -1.32 1.06 0.95 0.04 0.00 0.00 177.00 177.69 3ktx s THR 309 N -3.06 4.05 0.33 1.26 -4.23 -1.26 -4.94 115.64 107.80 3ktx s THR 309 Ca 0.65 0.67 0.03 0.00 -1.18 0.00 0.00 61.69 61.85 3ktx s THR 309 Cb -0.06 -3.62 0.19 0.00 1.34 0.00 0.00 72.50 70.35 3ktx s THR 309 CO 0.43 -0.87 1.91 -0.09 -0.54 0.00 0.00 174.62 175.46 3ktx h ARG 310 N -0.54 0.67 -0.09 3.99 2.43 -2.00 -2.16 114.38 116.68 3ktx h ARG 310 Ca -0.45 -0.10 -0.15 0.00 -0.81 0.00 0.00 59.98 58.47 3ktx h ARG 310 Cb 1.22 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.64 3ktx h ARG 310 CO 0.62 0.58 -0.58 0.00 -1.51 0.00 0.00 179.97 179.08 3ktx h ALA 311 N 1.51 0.83 -0.75 2.80 0.00 -2.00 -2.28 119.26 119.37 3ktx h ALA 311 Ca 0.16 -0.53 0.01 0.00 0.00 0.00 0.00 54.91 54.54 3ktx h ALA 311 Cb 0.18 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 3ktx h ALA 311 CO -0.01 0.71 0.49 0.93 0.00 0.00 0.00 179.25 181.37 3ktx h GLU 312 N 0.23 1.00 -0.51 0.00 5.08 -1.76 -1.10 114.58 117.51 3ktx h GLU 312 Ca -0.00 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 3ktx h GLU 312 Cb 1.09 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 3ktx h GLU 312 CO 0.09 0.67 0.29 0.28 -1.00 0.00 0.00 179.01 179.34 3ktx h VAL 313 N 1.02 1.17 -0.27 3.13 2.07 -0.93 -2.46 116.25 119.97 3ktx h VAL 313 Ca 0.28 -0.41 -0.07 0.00 0.82 0.00 0.00 66.70 67.32 3ktx h VAL 313 Cb -0.11 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 3ktx h VAL 313 CO -0.06 0.18 -0.11 0.77 0.02 0.00 0.00 177.57 178.36 3ktx h SER 314 N 0.68 0.44 -0.04 0.57 4.64 -1.16 -0.99 113.55 117.69 3ktx h SER 314 Ca 0.18 -0.11 0.01 0.00 -0.47 0.00 0.00 61.79 61.41 3ktx h SER 314 Cb 0.03 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 3ktx h SER 314 CO -0.03 0.59 -0.03 -0.78 -0.87 0.00 0.00 176.83 175.71 3ktx h ASP 315 N 0.43 -0.08 -0.04 4.97 3.58 -0.88 0.54 116.42 124.94 3ktx h ASP 315 Ca 0.08 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.55 3ktx h ASP 315 Cb 0.46 0.04 -0.00 0.00 1.72 0.00 0.00 39.33 41.55 3ktx h ASP 315 CO 0.03 -0.04 0.01 0.58 -2.88 0.00 0.00 179.24 176.94 3ktx h VAL 316 N -0.03 1.16 -0.96 2.25 2.07 -1.02 -1.41 116.25 118.32 3ktx h VAL 316 Ca 0.02 -0.49 0.05 0.00 0.82 0.00 0.00 66.70 67.10 3ktx h VAL 316 Cb 0.07 1.43 -0.06 0.00 -1.52 0.00 0.00 31.29 31.21 3ktx h VAL 316 CO -0.06 0.13 0.63 0.00 0.02 0.00 0.00 177.57 178.29 3ktx h ALA 317 N 0.82 1.41 0.00 1.67 0.00 -1.02 -2.10 119.26 120.04 3ktx h ALA 317 Ca 0.01 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3ktx h ALA 317 Cb 0.20 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3ktx h ALA 317 CO -0.00 0.47 -0.35 -0.91 0.00 0.00 0.00 179.25 178.46 3ktx h ASN 318 N 1.16 0.00 -0.28 0.00 2.35 -0.64 0.14 115.58 118.31 3ktx h ASN 318 Ca 0.40 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 56.17 3ktx h ASN 318 Cb 0.09 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 3ktx h ASN 318 CO -0.14 0.35 0.13 0.00 -1.65 0.00 0.00 177.43 176.12 3ktx h ALA 319 N 1.65 0.33 -0.35 -0.83 0.00 -0.56 0.13 119.26 119.63 3ktx h ALA 319 Ca -0.00 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3ktx h ALA 319 Cb 0.87 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 3ktx h ALA 319 CO 0.05 -0.27 0.13 0.28 0.00 0.00 0.00 179.25 179.44 3ktx h VAL 320 N 0.27 1.19 -0.33 0.00 2.07 -1.23 -1.63 116.25 116.60 3ktx h VAL 320 Ca 0.12 -0.60 -0.05 0.00 0.82 0.00 0.00 66.70 66.99 3ktx h VAL 320 Cb 0.05 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 3ktx h VAL 320 CO -0.09 0.21 -0.00 -0.26 0.02 0.00 0.00 177.57 177.44 3ktx h PHE 321 N 0.42 0.52 0.00 1.57 0.04 -0.64 -0.93 116.94 117.91 3ktx h PHE 321 Ca 0.12 -0.05 -0.02 0.00 2.80 0.00 0.00 57.97 60.82 3ktx h PHE 321 Cb 0.20 -0.15 -0.00 0.00 2.20 0.00 0.00 35.95 38.20 3ktx h PHE 321 CO -0.00 0.52 -0.08 -0.91 -0.60 0.00 0.00 178.31 177.23 3ktx h ASN 322 N 0.48 0.00 0.00 2.17 -0.26 -0.59 -3.46 115.58 113.92 3ktx h ASN 322 Ca 0.10 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.84 3ktx h ASN 322 Cb 0.32 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.58 3ktx h ASN 322 CO 0.01 0.08 0.00 0.61 -1.06 0.00 0.00 177.43 177.07 3ktx n GLY 323 N -0.94 1.42 3.76 2.83 0.00 -0.35 -4.54 105.19 107.37 3ktx n GLY 323 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 3ktx n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ktx n ALA 324 N -0.54 1.98 0.05 4.61 0.00 -0.64 -4.91 120.51 121.06 3ktx n ALA 324 Ca 0.00 0.27 -0.11 0.00 0.00 0.00 0.00 53.44 53.60 3ktx n ALA 324 Cb 0.00 -2.38 0.01 0.00 0.00 0.00 0.00 19.45 17.09 3ktx n ALA 324 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3ktx h ASP 325 N 2.37 0.52 -4.02 0.00 5.19 -1.48 -3.45 116.42 115.54 3ktx h ASP 325 Ca -0.50 -0.35 -0.24 0.00 -0.62 0.00 0.00 57.03 55.32 3ktx h ASP 325 Cb 1.27 -0.15 -0.27 0.00 0.18 0.00 0.00 39.33 40.36 3ktx h ASP 325 CO 0.61 1.09 -0.72 0.00 -3.12 0.00 0.00 179.24 177.10 3ktx s VAL 327 N -0.34 3.06 -0.01 0.00 -7.23 -0.46 -0.83 120.40 114.59 3ktx s VAL 327 Ca -0.03 -1.15 0.05 0.00 -1.81 0.00 0.00 61.98 59.04 3ktx s VAL 327 Cb -0.03 -2.33 -0.01 0.00 0.56 0.00 0.00 36.38 34.57 3ktx s VAL 327 CO -0.00 0.29 -0.17 -0.32 -0.31 0.00 0.00 175.10 174.59 3ktx s MET 328 N -1.63 1.37 -0.12 4.82 0.00 -0.31 -1.70 119.30 121.73 3ktx s MET 328 Ca 0.17 -0.60 -0.05 0.00 0.00 0.00 0.00 55.69 55.21 3ktx s MET 328 Cb -0.11 -1.32 -0.04 0.00 0.00 0.00 0.00 34.83 33.37 3ktx s MET 328 CO 0.08 0.35 0.05 -0.51 0.00 0.00 0.00 175.02 174.99 3ktx s LEU 329 N -0.37 3.84 0.00 4.11 1.43 -0.42 -4.32 118.68 122.95 3ktx s LEU 329 Ca 0.06 0.21 0.00 0.00 -1.03 0.00 0.00 54.13 53.37 3ktx s LEU 329 Cb -0.07 -1.92 0.00 0.00 0.03 0.00 0.00 46.19 44.23 3ktx s LEU 329 CO -0.01 0.33 0.00 -1.20 0.23 0.00 0.00 176.35 175.71 3ktx n SER 330 N 2.48 0.00 0.26 2.29 7.64 -1.26 -1.98 113.62 123.05 3ktx n SER 330 Ca -0.18 0.00 0.11 0.00 1.01 0.00 0.00 58.87 59.80 3ktx n SER 330 Cb 0.54 0.00 0.73 0.00 -1.01 0.00 0.00 64.21 64.46 3ktx n SER 330 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3ktx h GLY 331 N 0.00 0.00 1.25 0.23 0.00 -1.97 -1.71 103.07 100.87 3ktx h GLY 331 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.41 3ktx h GLY 331 CO 0.00 0.00 0.31 0.83 0.00 0.00 0.00 176.54 177.68 3ktx h GLU 332 N 0.00 0.24 0.00 4.80 3.07 -1.89 -1.82 114.58 118.99 3ktx h GLU 332 Ca 0.01 -0.01 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 3ktx h GLU 332 Cb 0.04 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 27.89 3ktx h GLU 332 CO -0.00 0.16 -1.59 0.25 -1.40 0.00 0.00 179.01 176.43 3ktx n THR 333 N -4.46 0.17 -0.04 1.13 -2.24 -0.97 -3.79 114.28 104.09 3ktx n THR 333 Ca 0.07 -0.32 -0.15 0.00 -2.27 0.00 0.00 64.05 61.39 3ktx n THR 333 Cb 0.35 0.01 -0.08 0.00 -2.10 0.00 0.00 70.33 68.51 3ktx n THR 333 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ktx h ALA 334 N 0.96 0.19 0.00 6.98 0.00 -0.98 -3.39 119.26 123.01 3ktx h ALA 334 Ca -0.07 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3ktx h ALA 334 Cb 0.80 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3ktx h ALA 334 CO 0.00 0.22 -0.29 0.36 0.00 0.00 0.00 179.25 179.54 3ktx n LYS 335 N -4.41 0.40 -2.24 0.00 2.85 -0.85 -2.23 118.16 111.69 3ktx n LYS 335 Ca -0.07 -1.23 -0.26 0.00 -1.05 0.00 0.00 58.31 55.70 3ktx n LYS 335 Cb 0.48 -0.71 0.10 0.00 -0.65 0.00 0.00 35.03 34.26 3ktx n LYS 335 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 3ktx s GLY 336 N -1.17 1.73 0.18 2.58 0.00 -0.74 -4.87 107.32 105.03 3ktx s GLY 336 Ca 0.06 -1.18 0.23 0.00 0.00 0.00 0.00 44.72 43.83 3ktx s GLY 336 CO 0.01 -0.66 1.02 0.28 0.00 0.00 0.00 173.10 173.75 3ktx n LYS 337 N -3.08 0.58 -2.74 2.90 5.02 0.15 -4.41 118.16 116.60 3ktx n LYS 337 Ca 0.11 0.10 -0.22 0.00 -2.02 0.00 0.00 58.31 56.28 3ktx n LYS 337 Cb 0.60 -1.80 -0.01 0.00 -0.02 0.00 0.00 35.03 33.81 3ktx n LYS 337 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3ktx n TYR 338 N -2.61 2.71 -0.27 2.13 4.01 -1.26 -4.92 117.16 116.95 3ktx n TYR 338 Ca -0.00 -3.39 -0.01 0.00 -0.16 0.00 0.00 57.90 54.34 3ktx n TYR 338 Cb 0.54 -0.30 0.19 0.00 -0.31 0.00 0.00 39.34 39.47 3ktx n TYR 338 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3ktx h PRO 339 N 2.83 1.11 -0.34 -0.72 0.13 -1.77 -1.01 132.00 132.23 3ktx h PRO 339 Ca 0.15 -0.08 -0.09 0.00 -0.87 0.00 0.00 66.00 65.11 3ktx h PRO 339 Cb 0.86 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 31.74 3ktx h PRO 339 CO 0.73 0.75 -0.15 -0.91 -0.23 0.00 0.00 178.00 178.18 3ktx h ASN 340 N 1.14 0.72 -0.12 1.44 2.35 -1.91 -2.86 115.58 116.34 3ktx h ASN 340 Ca 0.30 -0.40 -0.16 0.00 -0.55 0.00 0.00 56.30 55.49 3ktx h ASN 340 Cb -0.11 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.06 3ktx h ASN 340 CO -0.06 0.96 -0.49 -0.33 -1.65 0.00 0.00 177.43 175.86 3ktx h GLU 341 N 0.48 0.68 -0.56 0.81 3.07 -1.84 -1.60 114.58 115.62 3ktx h GLU 341 Ca 0.08 -0.40 -0.08 0.00 -0.50 0.00 0.00 59.36 58.46 3ktx h GLU 341 Cb 0.68 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.60 3ktx h GLU 341 CO 0.05 1.02 0.04 -0.24 -1.40 0.00 0.00 179.01 178.48 3ktx h VAL 342 N 0.54 1.26 -0.35 3.13 3.04 -1.24 0.04 116.25 122.68 3ktx h VAL 342 Ca 0.03 -1.05 -0.02 0.00 -1.01 0.00 0.00 66.70 64.65 3ktx h VAL 342 Cb 1.04 0.85 -0.02 0.00 -2.01 0.00 0.00 31.29 31.15 3ktx h VAL 342 CO 0.10 0.38 0.14 0.58 -1.01 0.00 0.00 177.57 177.76 3ktx h VAL 343 N 0.84 1.19 -0.49 1.51 2.07 -1.35 -0.59 116.25 119.43 3ktx h VAL 343 Ca 0.16 -0.57 -0.07 0.00 0.82 0.00 0.00 66.70 67.04 3ktx h VAL 343 Cb 0.48 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 3ktx h VAL 343 CO 0.02 0.20 0.02 1.56 0.02 0.00 0.00 177.57 179.39 3ktx h GLN 344 N 0.41 0.80 -0.17 1.57 4.20 -1.16 -0.28 115.11 120.48 3ktx h GLN 344 Ca 0.12 -0.21 -0.10 0.00 0.06 0.00 0.00 58.65 58.52 3ktx h GLN 344 Cb 0.18 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 3ktx h GLN 344 CO -0.01 0.80 -0.26 -0.92 -0.67 0.00 0.00 178.83 177.76 3ktx h TYR 345 N 0.75 0.60 -0.67 2.96 3.20 -0.84 -1.67 116.97 121.30 3ktx h TYR 345 Ca 0.15 -0.20 0.14 0.00 3.14 0.00 0.00 58.73 61.96 3ktx h TYR 345 Cb 0.43 -0.12 -0.11 0.00 1.54 0.00 0.00 36.73 38.47 3ktx h TYR 345 CO 0.02 0.90 0.01 1.98 -1.64 0.00 0.00 178.16 179.44 3ktx h MET 346 N 0.12 0.12 -0.83 1.82 4.05 -0.87 -0.18 114.93 119.17 3ktx h MET 346 Ca 0.02 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.42 3ktx h MET 346 Cb 0.84 -0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 31.57 3ktx h MET 346 CO 0.06 0.08 0.48 0.00 0.23 0.00 0.00 176.91 177.76 3ktx h ALA 347 N 1.61 1.06 -0.17 0.39 0.00 -0.93 -1.30 119.26 119.93 3ktx h ALA 347 Ca 0.36 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 3ktx h ALA 347 Cb 0.59 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3ktx h ALA 347 CO -0.57 0.54 -0.56 -0.09 0.00 0.00 0.00 179.25 178.57 3ktx h ARG 348 N 1.14 0.51 -0.41 0.00 2.43 -0.30 -1.39 114.38 116.36 3ktx h ARG 348 Ca 0.30 -0.32 -0.06 0.00 -0.81 0.00 0.00 59.98 59.08 3ktx h ARG 348 Cb -0.01 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 3ktx h ARG 348 CO -0.05 0.93 0.00 0.82 -1.51 0.00 0.00 179.97 180.16 3ktx h ILE 349 N 0.39 1.26 -0.06 1.20 2.04 -0.82 -1.27 117.51 120.24 3ktx h ILE 349 Ca 0.00 -1.01 0.02 0.00 1.00 0.00 0.00 64.86 64.88 3ktx h ILE 349 Cb 1.10 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 38.25 3ktx h ILE 349 CO 0.10 0.34 -0.07 0.00 0.00 0.00 0.00 178.15 178.53 3ktx h LEU 351 N -0.09 0.75 -0.31 0.00 5.85 -1.23 -0.26 115.31 120.02 3ktx h LEU 351 Ca 0.05 -0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.74 3ktx h LEU 351 Cb 0.16 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 3ktx h LEU 351 CO -0.12 0.62 0.03 -0.08 -0.34 0.00 0.00 178.44 178.55 3ktx h GLU 352 N 0.82 0.12 -0.64 1.25 4.57 -0.99 -2.44 114.58 117.28 3ktx h GLU 352 Ca 0.21 -0.01 -0.08 0.00 -1.18 0.00 0.00 59.36 58.31 3ktx h GLU 352 Cb 0.03 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 3ktx h GLU 352 CO -0.04 0.08 0.10 0.00 -1.18 0.00 0.00 179.01 177.97 3ktx h ALA 353 N 1.25 0.85 -0.61 2.92 0.00 -0.65 -2.57 119.26 120.44 3ktx h ALA 353 Ca 0.15 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3ktx h ALA 353 Cb 0.18 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3ktx h ALA 353 CO -0.22 0.61 0.32 0.37 0.00 0.00 0.00 179.25 180.33 3ktx h GLN 354 N 0.97 0.85 0.00 0.00 4.15 -0.93 0.56 115.11 120.72 3ktx h GLN 354 Ca 0.19 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.52 3ktx h GLN 354 Cb 0.44 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 27.96 3ktx h GLN 354 CO 0.01 0.64 0.00 0.77 -1.93 0.00 0.00 178.83 178.32 3ktx h SER 355 N 0.86 0.00 0.11 -0.69 0.02 -1.02 -2.19 113.55 110.64 3ktx h SER 355 Ca 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 3ktx h SER 355 Cb 0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.59 3ktx h SER 355 CO -0.03 0.00 -1.46 0.00 -1.14 0.00 0.00 176.83 174.20 3ktx n ALA 356 N -1.94 3.55 -2.54 3.77 0.00 0.08 -4.95 120.51 118.48 3ktx n ALA 356 Ca 0.00 -0.52 -0.41 0.00 0.00 0.00 0.00 53.44 52.52 3ktx n ALA 356 Cb 0.21 -0.81 -0.04 0.00 0.00 0.00 0.00 19.45 18.81 3ktx n ALA 356 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3ktx s LEU 357 N -3.93 4.40 -0.60 0.00 0.20 -0.58 -4.82 118.68 113.34 3ktx s LEU 357 Ca -0.00 1.49 -0.22 0.00 0.69 0.00 0.00 54.13 56.09 3ktx s LEU 357 Cb 0.15 -3.33 0.07 0.00 -0.43 0.00 0.00 46.19 42.64 3ktx s LEU 357 CO 0.87 -0.10 0.86 0.21 -0.29 0.00 0.00 176.35 177.90 3ktx s ASN 358 N 0.44 6.21 0.46 3.68 3.84 -1.26 -4.89 114.94 123.43 3ktx s ASN 358 Ca 0.43 -0.95 0.15 0.00 0.21 0.00 0.00 52.86 52.70 3ktx s ASN 358 Cb -0.20 -2.38 1.07 0.00 -0.55 0.00 0.00 41.25 39.18 3ktx s ASN 358 CO 0.24 -1.26 2.02 -0.33 -2.79 0.00 0.00 177.10 174.98 3ktx h GLU 359 N 9.36 0.00 -0.39 0.43 3.07 -1.93 -2.90 114.58 122.22 3ktx h GLU 359 Ca -0.28 0.00 0.04 0.00 -0.50 0.00 0.00 59.36 58.61 3ktx h GLU 359 Cb 1.08 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.97 3ktx h GLU 359 CO 1.12 0.15 0.26 -0.92 -1.40 0.00 0.00 179.01 178.22 3ktx h TYR 360 N 0.00 0.36 -0.61 4.33 3.20 -1.90 -0.76 116.97 121.59 3ktx h TYR 360 Ca -0.00 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 3ktx h TYR 360 Cb 0.27 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 3ktx h TYR 360 CO 0.00 0.21 0.11 0.28 -1.64 0.00 0.00 178.16 177.12 3ktx h VAL 361 N 0.38 1.26 0.67 1.81 2.07 -1.90 -0.00 116.25 120.53 3ktx h VAL 361 Ca 0.16 -0.99 -0.03 0.00 0.82 0.00 0.00 66.70 66.66 3ktx h VAL 361 Cb 0.17 0.71 0.01 0.00 -1.52 0.00 0.00 31.29 30.66 3ktx h VAL 361 CO -0.04 0.37 -0.33 -0.26 0.02 0.00 0.00 177.57 177.33 3ktx h PHE 362 N 0.92 -0.85 -0.51 1.57 -1.00 -1.31 0.06 116.94 115.83 3ktx h PHE 362 Ca 0.19 -0.02 0.10 0.00 2.81 0.00 0.00 57.97 61.05 3ktx h PHE 362 Cb 0.42 0.28 -0.10 0.00 3.61 0.00 0.00 35.95 40.16 3ktx h PHE 362 CO 0.03 -0.52 -0.15 0.35 -1.61 0.00 0.00 178.31 176.41 3ktx h PHE 363 N -0.91 -0.33 -0.26 -0.55 3.57 -0.88 -1.64 116.94 115.95 3ktx h PHE 363 Ca -0.09 0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.40 3ktx h PHE 363 Cb 0.70 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.65 3ktx h PHE 363 CO -0.03 -0.24 -0.06 -0.97 -2.23 0.00 0.00 178.31 174.79 3ktx h ASN 364 N -0.03 0.49 -0.55 0.41 -0.00 -0.99 0.03 115.58 114.95 3ktx h ASN 364 Ca 0.24 -0.36 0.00 0.00 -0.00 0.00 0.00 56.30 56.18 3ktx h ASN 364 Cb 0.40 -0.13 -0.03 0.00 -0.00 0.00 0.00 38.32 38.56 3ktx h ASN 364 CO -0.54 0.74 0.34 0.28 -0.00 0.00 0.00 177.43 178.25 3ktx h SER 365 N 0.24 0.65 0.03 1.15 0.02 -0.78 -1.25 113.55 113.59 3ktx h SER 365 Ca 0.07 -0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3ktx h SER 365 Cb 0.52 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.90 3ktx h SER 365 CO 0.02 0.50 -0.01 0.40 -1.14 0.00 0.00 176.83 176.60 3ktx h ILE 366 N 0.74 1.22 -0.54 3.27 2.04 -1.26 -3.14 117.51 119.84 3ktx h ILE 366 Ca 0.20 -0.76 0.11 0.00 1.00 0.00 0.00 64.86 65.40 3ktx h ILE 366 Cb -0.04 1.73 -0.09 0.00 -0.74 0.00 0.00 36.82 37.67 3ktx h ILE 366 CO -0.04 0.20 -0.03 0.50 0.00 0.00 0.00 178.15 178.78 3ktx h LYS 367 N -0.37 0.09 -0.02 2.37 3.64 -0.92 -1.97 116.57 119.39 3ktx h LYS 367 Ca -0.00 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.38 3ktx h LYS 367 Cb 0.35 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.15 3ktx h LYS 367 CO 0.01 0.06 0.06 0.87 -2.27 0.00 0.00 179.45 178.17 3ktx h LYS 368 N 0.09 0.00 -0.00 1.90 1.57 -1.23 -1.07 116.57 117.83 3ktx h LYS 368 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3ktx h LYS 368 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3ktx h LYS 368 CO -0.48 0.00 -0.29 1.28 -0.57 0.00 0.00 179.45 179.39 3ktx n LEU 369 N -3.31 0.58 -4.73 2.94 4.77 -0.74 -4.90 117.00 111.61 3ktx n LEU 369 Ca -0.02 -0.01 -0.42 0.00 -0.03 0.00 0.00 56.01 55.53 3ktx n LEU 369 Cb 0.13 -0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 40.96 3ktx n LEU 369 CO 0.22 0.12 1.02 -1.10 -1.33 0.00 0.00 177.39 176.32 3ktx s GLN 370 N -2.75 4.35 0.07 3.23 -1.52 -0.41 -4.99 119.66 117.65 3ktx s GLN 370 Ca 0.19 2.10 -0.31 0.00 -1.95 0.00 0.00 55.36 55.39 3ktx s GLN 370 Cb 0.19 -3.19 -0.06 0.00 -0.22 0.00 0.00 33.01 29.72 3ktx s GLN 370 CO 0.58 -0.32 1.30 -1.58 -0.25 0.00 0.00 175.29 175.02 3ktx s HIS 371 N 0.33 3.28 -0.22 0.91 5.65 -1.26 -5.01 115.29 118.96 3ktx s HIS 371 Ca 0.59 1.10 -0.13 0.00 0.25 0.00 0.00 55.06 56.87 3ktx s HIS 371 Cb -0.37 -3.56 -0.05 0.00 -1.18 0.00 0.00 32.58 27.42 3ktx s HIS 371 CO 0.37 -1.87 0.25 0.42 -0.65 0.00 0.00 174.74 173.26 3ktx s ILE 372 N 1.29 5.30 0.47 0.89 1.01 -1.26 -2.86 121.20 126.04 3ktx s ILE 372 Ca 0.62 0.39 -0.19 0.00 0.00 0.00 0.00 60.65 61.46 3ktx s ILE 372 Cb -0.32 -3.59 -0.09 0.00 0.01 0.00 0.00 42.46 38.46 3ktx s ILE 372 CO 0.29 0.31 0.97 -2.16 0.00 0.00 0.00 174.94 174.36 3ktx s PRO 373 N 1.12 4.06 0.33 2.79 0.04 -1.26 -5.19 135.00 136.89 3ktx s PRO 373 Ca 0.12 1.10 -0.08 0.00 0.04 0.00 0.00 61.00 62.18 3ktx s PRO 373 Cb -0.14 -2.15 -0.06 0.00 0.04 0.00 0.00 34.50 32.19 3ktx s PRO 373 CO 0.06 -0.18 0.65 -1.64 0.04 0.00 0.00 177.00 175.93 3ktx s MET 374 N -3.50 3.72 0.78 4.56 -1.94 -1.13 -5.10 119.30 116.68 3ktx s MET 374 Ca 0.62 0.25 -0.11 0.00 -1.71 0.00 0.00 55.69 54.73 3ktx s MET 374 Cb -0.10 -2.53 0.06 0.00 2.01 0.00 0.00 34.83 34.27 3ktx s MET 374 CO 0.20 0.11 1.10 -1.54 -0.01 0.00 0.00 175.02 174.89 3ktx s SER 375 N -3.07 4.66 0.20 3.03 1.04 -1.26 -4.84 113.70 113.46 3ktx s SER 375 Ca 0.48 1.28 -0.11 0.00 0.48 0.00 0.00 55.95 58.08 3ktx s SER 375 Cb -0.11 -2.03 0.20 0.00 0.10 0.00 0.00 66.02 64.19 3ktx s SER 375 CO 0.29 -1.86 1.80 0.00 0.98 0.00 0.00 173.24 174.45 3ktx h ALA 376 N -1.01 0.81 -0.26 5.32 0.00 -1.98 -1.34 119.26 120.79 3ktx h ALA 376 Ca -0.47 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3ktx h ALA 376 Cb 1.27 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 3ktx h ALA 376 CO 0.60 -0.00 0.16 0.38 0.00 0.00 0.00 179.25 180.39 3ktx h ASP 377 N 0.62 0.31 -0.50 0.00 -0.00 -1.93 0.13 116.42 115.03 3ktx h ASP 377 Ca 0.27 -0.03 0.00 0.00 -0.00 0.00 0.00 57.03 57.27 3ktx h ASP 377 Cb 0.17 -0.08 -0.02 0.00 -0.00 0.00 0.00 39.33 39.40 3ktx h ASP 377 CO -0.17 0.25 0.32 -0.08 -0.00 0.00 0.00 179.24 179.55 3ktx h GLU 378 N 0.34 0.68 -0.46 4.15 4.57 -1.86 -1.64 114.58 120.36 3ktx h GLU 378 Ca 0.09 -0.05 -0.12 0.00 -1.18 0.00 0.00 59.36 58.10 3ktx h GLU 378 Cb -0.01 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.42 3ktx h GLU 378 CO -0.02 0.48 -0.19 0.00 -1.18 0.00 0.00 179.01 178.10 3ktx h ALA 379 N 1.16 0.64 -0.36 2.92 0.00 -1.05 -1.21 119.26 121.37 3ktx h ALA 379 Ca 0.18 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 3ktx h ALA 379 Cb -0.04 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3ktx h ALA 379 CO -0.04 0.61 0.00 0.28 0.00 0.00 0.00 179.25 180.10 3ktx h VAL 380 N 0.78 1.26 -0.07 0.00 2.07 -0.56 -1.70 116.25 118.03 3ktx h VAL 380 Ca 0.11 -0.98 -0.03 0.00 0.82 0.00 0.00 66.70 66.62 3ktx h VAL 380 Cb 0.76 1.18 -0.00 0.00 -1.52 0.00 0.00 31.29 31.70 3ktx h VAL 380 CO 0.06 0.32 -0.07 0.00 0.02 0.00 0.00 177.57 177.91 3ktx h SER 382 N -0.28 0.84 -0.33 0.00 4.64 -1.28 -2.33 113.55 114.81 3ktx h SER 382 Ca 0.01 0.01 -0.16 0.00 -0.47 0.00 0.00 61.79 61.17 3ktx h SER 382 Cb 0.58 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 3ktx h SER 382 CO 0.02 0.54 -0.42 0.28 -0.87 0.00 0.00 176.83 176.37 3ktx h SER 383 N 0.95 0.96 -0.49 4.97 0.02 -1.24 0.13 113.55 118.84 3ktx h SER 383 Ca 0.37 -0.45 -0.03 0.00 -0.84 0.00 0.00 61.79 60.83 3ktx h SER 383 Cb 0.21 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 3ktx h SER 383 CO -0.13 1.24 0.19 0.00 -1.14 0.00 0.00 176.83 176.99 3ktx h ALA 384 N 0.79 0.64 -0.45 3.77 0.00 -1.12 0.12 119.26 123.02 3ktx h ALA 384 Ca 0.05 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 3ktx h ALA 384 Cb 1.01 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 3ktx h ALA 384 CO 0.10 0.26 -0.00 0.28 0.00 0.00 0.00 179.25 179.89 3ktx h VAL 385 N 0.66 1.26 -0.52 0.00 2.07 -1.20 -1.98 116.25 116.54 3ktx h VAL 385 Ca 0.16 -1.04 0.10 0.00 0.82 0.00 0.00 66.70 66.74 3ktx h VAL 385 Cb 0.21 1.05 -0.08 0.00 -1.52 0.00 0.00 31.29 30.95 3ktx h VAL 385 CO -0.01 0.36 0.06 -1.13 0.02 0.00 0.00 177.57 176.87 3ktx h ASN 386 N 0.64 -0.10 -0.52 0.57 -0.73 -0.58 -1.09 115.58 113.77 3ktx h ASN 386 Ca 0.13 0.11 0.05 0.00 1.87 0.00 0.00 56.30 58.45 3ktx h ASN 386 Cb 0.50 0.17 -0.03 0.00 0.27 0.00 0.00 38.32 39.23 3ktx h ASN 386 CO 0.02 -0.03 0.35 0.28 -0.37 0.00 0.00 177.43 177.68 3ktx h SER 387 N 0.18 0.45 0.03 1.15 0.02 -0.76 -0.25 113.55 114.38 3ktx h SER 387 Ca 0.27 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.21 3ktx h SER 387 Cb 0.39 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.83 3ktx h SER 387 CO -0.39 0.30 -0.02 0.58 -1.14 0.00 0.00 176.83 176.17 3ktx h VAL 388 N 0.52 0.97 -0.70 2.27 2.07 -0.44 -0.03 116.25 120.92 3ktx h VAL 388 Ca 0.22 -0.02 -0.05 0.00 0.82 0.00 0.00 66.70 67.68 3ktx h VAL 388 Cb 0.21 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 3ktx h VAL 388 CO -0.06 0.00 0.26 1.88 0.02 0.00 0.00 177.57 179.67 3ktx h TYR 389 N -0.05 1.08 -0.41 1.57 0.05 -0.88 0.21 116.97 118.54 3ktx h TYR 389 Ca -0.00 -0.09 -0.10 0.00 0.05 0.00 0.00 58.73 58.59 3ktx h TYR 389 Cb 0.04 -0.32 -0.02 0.00 1.01 0.00 0.00 36.73 37.44 3ktx h TYR 389 CO -0.08 0.85 -0.14 0.93 -1.05 0.00 0.00 178.16 178.67 3ktx h GLU 390 N 1.00 0.75 -0.28 4.88 5.08 -0.96 -3.06 114.58 121.99 3ktx h GLU 390 Ca 0.23 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3ktx h GLU 390 Cb 0.24 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.44 3ktx h GLU 390 CO -0.01 0.85 0.00 0.25 -1.00 0.00 0.00 179.01 179.10 3ktx n THR 391 N -4.15 0.39 -4.12 1.13 -2.24 -0.04 -4.95 114.28 100.30 3ktx n THR 391 Ca 0.01 -0.69 -0.30 0.00 -2.27 0.00 0.00 64.05 60.80 3ktx n THR 391 Cb 0.38 1.08 -0.05 0.00 -2.10 0.00 0.00 70.33 69.64 3ktx n THR 391 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3ktx n LYS 392 N 1.31 -1.91 -1.51 -0.78 5.02 0.59 -4.89 118.16 115.99 3ktx n LYS 392 Ca 0.16 0.24 -0.35 0.00 -2.02 0.00 0.00 58.31 56.34 3ktx n LYS 392 Cb 0.56 -3.93 0.09 0.00 -0.02 0.00 0.00 35.03 31.72 3ktx n LYS 392 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ktx s ALA 393 N -4.11 2.18 -0.97 7.82 0.00 -0.39 -4.76 121.76 121.53 3ktx s ALA 393 Ca 0.06 1.04 0.16 0.00 0.00 0.00 0.00 51.96 53.21 3ktx s ALA 393 Cb -0.03 -3.52 -0.12 0.00 0.00 0.00 0.00 23.12 19.46 3ktx s ALA 393 CO 0.94 -1.84 0.73 1.63 0.00 0.00 0.00 175.76 177.22 3ktx n LYS 394 N -2.45 1.78 -3.62 0.00 4.76 -0.53 -4.81 118.16 113.29 3ktx n LYS 394 Ca 0.15 -0.25 -0.11 0.00 -2.87 0.00 0.00 58.31 55.24 3ktx n LYS 394 Cb 0.49 -1.25 -0.04 0.00 -1.84 0.00 0.00 35.03 32.38 3ktx n LYS 394 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3ktx s ALA 395 N -2.32 -0.96 0.07 7.82 0.00 -1.25 -4.27 121.76 120.85 3ktx s ALA 395 Ca 0.08 -0.02 0.08 0.00 0.00 0.00 0.00 51.96 52.10 3ktx s ALA 395 Cb 0.12 0.70 -0.03 0.00 0.00 0.00 0.00 23.12 23.90 3ktx s ALA 395 CO 0.57 -0.65 -0.18 -1.64 0.00 0.00 0.00 175.76 173.87 3ktx s MET 396 N -3.78 1.97 -0.14 0.00 -1.94 -0.52 -1.50 119.30 113.37 3ktx s MET 396 Ca 0.03 -1.05 0.02 0.00 -1.71 0.00 0.00 55.69 52.98 3ktx s MET 396 Cb 0.02 -2.16 0.01 0.00 2.01 0.00 0.00 34.83 34.71 3ktx s MET 396 CO -0.12 0.52 -0.20 0.08 -0.01 0.00 0.00 175.02 175.29 3ktx s VAL 397 N -1.00 1.94 -0.13 -6.03 1.01 0.26 -0.54 120.40 115.91 3ktx s VAL 397 Ca 0.16 -0.90 0.03 0.00 0.00 0.00 0.00 61.98 61.27 3ktx s VAL 397 Cb -0.11 -1.73 0.01 0.00 0.00 0.00 0.00 36.38 34.55 3ktx s VAL 397 CO 0.07 0.52 -0.22 -0.69 0.00 0.00 0.00 175.10 174.78 3ktx s VAL 398 N 0.97 2.05 -0.26 2.92 1.01 0.74 -0.15 120.40 127.68 3ktx s VAL 398 Ca -0.04 -0.98 -0.16 0.00 0.00 0.00 0.00 61.98 60.79 3ktx s VAL 398 Cb -0.15 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.40 3ktx s VAL 398 CO -0.04 0.55 0.44 -0.76 0.00 0.00 0.00 175.10 175.29 3ktx s LEU 399 N 0.66 4.06 -0.25 3.92 1.02 -0.35 -0.31 118.68 127.42 3ktx s LEU 399 Ca -0.11 0.42 -0.07 0.00 0.02 0.00 0.00 54.13 54.39 3ktx s LEU 399 Cb -0.16 -2.54 0.12 0.00 0.02 0.00 0.00 46.19 43.63 3ktx s LEU 399 CO 0.02 -0.22 0.52 -0.55 0.02 0.00 0.00 176.35 176.14 3ktx s SER 400 N 1.54 -0.69 -0.08 2.29 0.15 -0.79 -4.62 113.70 111.50 3ktx s SER 400 Ca 0.18 1.11 -0.23 0.00 0.70 0.00 0.00 55.95 57.72 3ktx s SER 400 Cb -0.16 1.79 -0.29 0.00 -1.71 0.00 0.00 66.02 65.66 3ktx s SER 400 CO 0.09 -0.24 0.80 0.78 1.20 0.00 0.00 173.24 175.88 3ktx h ASN 401 N 8.09 0.32 0.51 5.45 2.35 -1.96 -3.34 115.58 127.00 3ktx h ASN 401 Ca -0.18 -0.94 0.00 0.00 -0.55 0.00 0.00 56.30 54.63 3ktx h ASN 401 Cb 1.12 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.38 3ktx h ASN 401 CO 0.15 1.32 -0.43 0.35 -1.65 0.00 0.00 177.43 177.16 3ktx n THR 402 N -4.24 0.00 -0.00 2.81 -2.24 -1.26 -4.47 114.28 104.88 3ktx n THR 402 Ca -0.15 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 3ktx n THR 402 Cb 0.74 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 69.17 3ktx n THR 402 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ktx n GLY 403 N 1.48 1.79 0.16 3.38 0.00 -1.25 -4.87 105.19 105.88 3ktx n GLY 403 Ca 0.06 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.04 3ktx n GLY 403 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3ktx h ARG 404 N 2.81 0.14 0.04 1.61 2.43 -1.92 -1.26 114.38 118.22 3ktx h ARG 404 Ca 0.00 -0.01 -0.22 0.00 -0.81 0.00 0.00 59.98 58.94 3ktx h ARG 404 Cb 0.00 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 3ktx h ARG 404 CO 0.00 0.09 -1.00 0.66 -1.51 0.00 0.00 179.97 178.21 3ktx h SER 405 N 0.14 0.28 -0.71 -3.80 4.64 -1.92 -0.70 113.55 111.48 3ktx h SER 405 Ca 0.19 -0.26 0.13 0.00 -0.47 0.00 0.00 61.79 61.39 3ktx h SER 405 Cb 0.25 -0.09 -0.09 0.00 -0.31 0.00 0.00 62.40 62.16 3ktx h SER 405 CO -0.29 1.12 0.25 0.00 -0.87 0.00 0.00 176.83 177.04 3ktx h ALA 406 N 0.86 0.96 0.00 5.18 0.00 -1.84 0.40 119.26 124.81 3ktx h ALA 406 Ca -0.07 0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 3ktx h ALA 406 Cb 1.68 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.57 3ktx h ALA 406 CO 0.15 -0.24 -0.50 0.00 0.00 0.00 0.00 179.25 178.66 3ktx h ARG 407 N 0.39 0.00 -0.18 0.00 3.08 -0.71 -1.35 114.38 115.61 3ktx h ARG 407 Ca 0.38 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 60.23 3ktx h ARG 407 Cb 0.58 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.64 3ktx h ARG 407 CO -0.40 0.50 -0.72 1.25 -1.07 0.00 0.00 179.97 179.53 3ktx h LEU 408 N 0.00 0.89 -0.43 3.04 5.85 -0.17 -1.70 115.31 122.79 3ktx h LEU 408 Ca -0.01 -0.55 -0.03 0.00 0.84 0.00 0.00 57.88 58.13 3ktx h LEU 408 Cb 0.97 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 3ktx h LEU 408 CO 0.07 1.34 0.15 0.58 -0.34 0.00 0.00 178.44 180.24 3ktx h VAL 409 N 0.54 1.21 -0.56 1.05 2.07 -0.89 -3.05 116.25 116.62 3ktx h VAL 409 Ca -0.03 -0.69 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 3ktx h VAL 409 Cb 1.33 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.93 3ktx h VAL 409 CO 0.15 0.25 0.20 0.00 0.02 0.00 0.00 177.57 178.19 3ktx h ALA 410 N 0.99 1.31 -1.03 1.67 0.00 -1.20 -0.95 119.26 120.06 3ktx h ALA 410 Ca 0.14 -0.16 0.26 0.00 0.00 0.00 0.00 54.91 55.15 3ktx h ALA 410 Cb 0.24 -0.23 -0.10 0.00 0.00 0.00 0.00 17.79 17.70 3ktx h ALA 410 CO -0.01 0.50 0.66 -0.22 0.00 0.00 0.00 179.25 180.18 3ktx h LYS 411 N 0.80 0.42 -0.01 0.00 3.64 -1.19 -0.62 116.57 119.61 3ktx h LYS 411 Ca 0.19 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 3ktx h LYS 411 Cb 0.19 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3ktx h LYS 411 CO -0.01 0.28 -0.04 0.66 -2.27 0.00 0.00 179.45 178.06 3ktx n TYR 412 N -4.67 0.00 -3.39 1.91 4.01 -0.36 -4.85 117.16 109.81 3ktx n TYR 412 Ca 0.25 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.82 3ktx n TYR 412 Cb 0.85 -0.04 0.04 0.00 -0.31 0.00 0.00 39.34 39.87 3ktx n TYR 412 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 3ktx n ARG 413 N -0.41 -1.62 -1.15 -0.72 5.12 -0.24 -3.79 116.66 113.85 3ktx n ARG 413 Ca 0.19 0.88 -0.33 0.00 -1.93 0.00 0.00 57.85 56.65 3ktx n ARG 413 Cb 0.27 -4.96 0.12 0.00 -1.16 0.00 0.00 32.46 26.74 3ktx n ARG 413 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3ktx s PRO 414 N -4.61 1.69 -0.53 5.56 0.04 -1.26 -4.54 135.00 131.34 3ktx s PRO 414 Ca 0.32 1.76 -0.00 0.00 0.04 0.00 0.00 61.00 63.12 3ktx s PRO 414 Cb -0.08 -1.78 0.46 0.00 0.04 0.00 0.00 34.50 33.15 3ktx s PRO 414 CO 0.80 -2.18 1.96 0.27 0.04 0.00 0.00 177.00 177.89 3ktx n ASN 415 N -3.23 6.21 -4.02 6.66 6.94 -1.26 -4.86 115.26 121.70 3ktx n ASN 415 Ca 0.13 -3.57 -0.09 0.00 -0.02 0.00 0.00 54.58 51.04 3ktx n ASN 415 Cb 0.50 -0.93 -0.08 0.00 -2.36 0.00 0.00 39.78 36.91 3ktx n ASN 415 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3ktx s PRO 417 N -3.97 3.23 -0.17 0.00 0.02 -1.26 -4.83 135.00 128.02 3ktx s PRO 417 Ca 0.17 2.18 -0.05 0.00 0.02 0.00 0.00 61.00 63.32 3ktx s PRO 417 Cb 0.05 -2.29 -0.03 0.00 0.02 0.00 0.00 34.50 32.25 3ktx s PRO 417 CO -0.02 -1.10 0.01 0.42 -0.33 0.00 0.00 177.00 175.98 3ktx s ILE 418 N -1.33 4.24 -0.36 2.83 1.01 -0.27 -1.44 121.20 125.88 3ktx s ILE 418 Ca 0.70 -0.23 -0.07 0.00 0.00 0.00 0.00 60.65 61.05 3ktx s ILE 418 Cb -0.39 -2.89 0.05 0.00 0.01 0.00 0.00 42.46 39.23 3ktx s ILE 418 CO 0.46 0.47 0.14 -0.69 0.00 0.00 0.00 174.94 175.32 3ktx s VAL 419 N 0.50 3.89 -0.07 2.92 1.01 0.30 -0.19 120.40 128.77 3ktx s VAL 419 Ca -0.00 -1.18 -0.24 0.00 0.00 0.00 0.00 61.98 60.56 3ktx s VAL 419 Cb -0.14 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 3ktx s VAL 419 CO 0.02 -0.25 0.71 0.00 0.00 0.00 0.00 175.10 175.58 3ktx s VAL 421 N 0.82 4.29 0.04 0.00 1.01 0.58 0.03 120.40 127.17 3ktx s VAL 421 Ca 0.38 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.19 3ktx s VAL 421 Cb -0.18 -3.00 -0.02 0.00 0.00 0.00 0.00 36.38 33.18 3ktx s VAL 421 CO 0.18 0.35 -0.07 0.28 0.00 0.00 0.00 175.10 175.84 3ktx s THR 422 N 1.55 0.48 -2.60 3.92 -1.32 -0.59 -1.88 115.64 115.20 3ktx s THR 422 Ca 0.06 -1.11 0.25 0.00 -1.21 0.00 0.00 61.69 59.69 3ktx s THR 422 Cb -0.15 -0.62 0.42 0.00 -1.51 0.00 0.00 72.50 70.64 3ktx s THR 422 CO 0.03 -0.43 1.54 0.35 -2.21 0.00 0.00 174.62 173.90 3ktx n THR 423 N 1.39 0.08 -4.40 5.08 -2.24 -1.26 -0.29 114.28 112.64 3ktx n THR 423 Ca -0.22 -0.38 -0.30 0.00 -2.27 0.00 0.00 64.05 60.88 3ktx n THR 423 Cb 0.55 0.81 -0.17 0.00 -2.10 0.00 0.00 70.33 69.42 3ktx n THR 423 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3ktx s ARG 424 N -1.92 2.40 0.42 -0.78 0.52 -1.26 -4.76 118.95 113.57 3ktx s ARG 424 Ca 0.34 -0.62 0.14 0.00 -0.52 0.00 0.00 55.73 55.07 3ktx s ARG 424 Cb 0.20 -2.05 0.89 0.00 0.52 0.00 0.00 34.95 34.52 3ktx s ARG 424 CO 0.31 -0.09 1.93 -0.07 0.02 0.00 0.00 175.30 177.40 3ktx h LEU 425 N 7.54 0.00 -1.30 2.53 3.38 -1.95 -2.43 115.31 123.08 3ktx h LEU 425 Ca -0.33 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.58 3ktx h LEU 425 Cb 1.17 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 3ktx h LEU 425 CO 0.51 0.26 -0.30 -0.61 0.09 0.00 0.00 178.44 178.39 3ktx h GLN 426 N 0.00 0.00 -0.21 1.13 4.15 -1.96 -2.33 115.11 115.89 3ktx h GLN 426 Ca -0.00 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.35 3ktx h GLN 426 Cb 0.45 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.14 3ktx h GLN 426 CO 0.03 0.30 -0.14 1.15 -1.93 0.00 0.00 178.83 178.24 3ktx h THR 427 N 0.00 1.31 -0.90 2.39 2.02 -1.72 -0.19 112.91 115.83 3ktx h THR 427 Ca -0.00 -1.24 0.20 0.00 0.77 0.00 0.00 66.41 66.14 3ktx h THR 427 Cb 0.67 1.67 -0.12 0.00 -1.74 0.00 0.00 68.15 68.63 3ktx h THR 427 CO 0.04 0.38 0.43 0.00 0.37 0.00 0.00 175.52 176.74 3ktx h ARG 429 N 0.48 0.45 0.00 0.00 3.08 -1.36 -3.32 114.38 113.71 3ktx h ARG 429 Ca 0.55 -0.55 -0.07 0.00 0.07 0.00 0.00 59.98 59.97 3ktx h ARG 429 Cb 0.98 0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.19 3ktx h ARG 429 CO -0.48 1.20 -0.34 1.96 -1.07 0.00 0.00 179.97 181.25 3ktx h GLN 430 N -0.06 0.00 0.00 0.04 4.20 -0.58 -2.33 115.11 116.38 3ktx h GLN 430 Ca -0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.59 3ktx h GLN 430 Cb 1.53 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.31 3ktx h GLN 430 CO 0.15 0.34 0.00 1.28 -0.67 0.00 0.00 178.83 179.93 3ktx n LEU 431 N -4.04 0.00 0.16 1.46 4.77 -0.31 -2.72 117.00 116.32 3ktx n LEU 431 Ca -0.02 0.43 0.12 0.00 -0.03 0.00 0.00 56.01 56.52 3ktx n LEU 431 Cb 0.39 -0.43 0.58 0.00 -2.33 0.00 0.00 43.42 41.62 3ktx n LEU 431 CO 0.38 -0.19 0.85 0.78 -1.33 0.00 0.00 177.39 177.89 3ktx h ASN 432 N 0.00 0.00 -0.55 -1.43 2.35 -1.54 -0.97 115.58 113.43 3ktx h ASN 432 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3ktx h ASN 432 Cb 0.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.62 3ktx h ASN 432 CO 0.00 0.00 0.00 2.30 -1.65 0.00 0.00 177.43 178.08 3ktx n ILE 433 N -2.30 0.73 -3.88 2.81 -5.35 -1.10 -4.78 119.36 105.49 3ktx n ILE 433 Ca -0.00 -0.75 -0.35 0.00 -0.27 0.00 0.00 62.75 61.37 3ktx n ILE 433 Cb 0.11 0.42 -0.14 0.00 -1.74 0.00 0.00 39.64 38.29 3ktx n ILE 433 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 3ktx s THR 434 N -1.27 3.46 0.45 7.28 2.01 -0.37 -4.62 115.64 122.59 3ktx s THR 434 Ca 0.38 -0.56 -0.25 0.00 0.31 0.00 0.00 61.69 61.57 3ktx s THR 434 Cb 0.20 -2.63 -0.09 0.00 0.01 0.00 0.00 72.50 69.99 3ktx s THR 434 CO 0.27 0.34 1.42 0.00 -0.69 0.00 0.00 174.62 175.96 3ktx n GLN 435 N 4.80 2.24 -0.73 4.92 -0.00 -1.26 -3.62 117.38 123.73 3ktx n GLN 435 Ca -0.17 0.80 0.00 0.00 -0.00 0.00 0.00 57.00 57.63 3ktx n GLN 435 Cb 0.50 -2.61 0.00 0.00 -0.00 0.00 0.00 30.24 28.13 3ktx n GLN 435 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3ktx n GLY 436 N 0.59 0.70 3.45 2.61 0.00 -0.15 -4.89 105.19 107.49 3ktx n GLY 436 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 3ktx n GLY 436 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ktx s VAL 437 N -2.40 3.48 -0.06 1.61 1.01 -1.24 -1.11 120.40 121.69 3ktx s VAL 437 Ca 0.00 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 61.50 3ktx s VAL 437 Cb 0.00 -2.49 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 3ktx s VAL 437 CO 0.00 0.52 -0.13 -1.61 0.00 0.00 0.00 175.10 173.88 3ktx s GLU 438 N 0.23 2.64 -0.05 2.72 2.02 0.73 -4.92 118.70 122.07 3ktx s GLU 438 Ca -0.05 -0.67 -0.00 0.00 0.02 0.00 0.00 54.97 54.26 3ktx s GLU 438 Cb -0.15 -2.44 -0.03 0.00 0.10 0.00 0.00 34.13 31.61 3ktx s GLU 438 CO 0.04 0.58 -0.01 -1.12 0.02 0.00 0.00 175.26 174.77 3ktx s SER 439 N -0.61 5.12 -0.13 -0.19 0.01 -1.26 -0.52 113.70 116.12 3ktx s SER 439 Ca 0.09 0.07 0.02 0.00 1.31 0.00 0.00 55.95 57.44 3ktx s SER 439 Cb -0.11 -1.39 0.00 0.00 0.21 0.00 0.00 66.02 64.74 3ktx s SER 439 CO 0.01 0.34 -0.20 -0.69 0.41 0.00 0.00 173.24 173.11 3ktx s VAL 440 N -0.95 2.28 -0.08 3.43 1.01 0.10 -4.95 120.40 121.25 3ktx s VAL 440 Ca 0.15 -0.92 -0.20 0.00 0.00 0.00 0.00 61.98 61.02 3ktx s VAL 440 Cb -0.11 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 3ktx s VAL 440 CO 0.05 0.54 0.57 0.12 0.00 0.00 0.00 175.10 176.38 3ktx s PHE 441 N 0.68 3.57 -0.29 5.22 5.36 -1.26 -1.55 117.98 129.72 3ktx s PHE 441 Ca -0.09 1.06 -0.02 0.00 -0.96 0.00 0.00 56.93 56.92 3ktx s PHE 441 Cb -0.16 -2.64 0.04 0.00 -0.34 0.00 0.00 43.02 39.93 3ktx s PHE 441 CO 0.01 0.18 -0.02 0.12 -1.46 0.00 0.00 175.22 174.06 3ktx s PHE 442 N 0.50 3.22 -0.96 10.12 5.36 0.60 -4.92 117.98 131.90 3ktx s PHE 442 Ca 0.31 -1.81 -0.24 0.00 -0.96 0.00 0.00 56.93 54.23 3ktx s PHE 442 Cb -0.17 -2.09 0.05 0.00 -0.34 0.00 0.00 43.02 40.47 3ktx s PHE 442 CO 0.14 -0.79 1.40 0.34 -1.46 0.00 0.00 175.22 174.86 3ktx s ASP 443 N 1.27 6.43 0.27 6.13 -1.08 -1.26 -4.32 116.67 124.11 3ktx s ASP 443 Ca -0.04 -1.26 -0.01 0.00 -0.52 0.00 0.00 52.55 50.72 3ktx s ASP 443 Cb -0.19 -2.56 0.38 0.00 -1.46 0.00 0.00 42.92 39.09 3ktx s ASP 443 CO -0.02 -1.57 1.80 0.00 0.52 0.00 0.00 175.17 175.90 3ktx h ALA 444 N 9.82 1.17 -0.57 3.66 0.00 -1.86 0.46 119.26 131.95 3ktx h ALA 444 Ca 0.10 -0.23 0.09 0.00 0.00 0.00 0.00 54.91 54.86 3ktx h ALA 444 Cb 1.02 -0.20 -0.07 0.00 0.00 0.00 0.00 17.79 18.54 3ktx h ALA 444 CO 1.39 0.55 0.20 -0.44 0.00 0.00 0.00 179.25 180.95 3ktx h ASP 445 N 0.76 0.19 0.53 0.00 3.32 -1.90 0.83 116.42 120.15 3ktx h ASP 445 Ca 0.16 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.28 3ktx h ASP 445 Cb 0.37 0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.98 3ktx h ASP 445 CO 0.01 0.12 -0.70 1.17 -1.72 0.00 0.00 179.24 178.13 3ktx n LYS 446 N -5.01 0.14 0.00 3.56 4.81 -0.93 -4.38 118.16 116.34 3ktx n LYS 446 Ca 0.07 0.02 0.00 0.00 -0.87 0.00 0.00 58.31 57.53 3ktx n LYS 446 Cb 0.25 -1.56 0.00 0.00 0.02 0.00 0.00 35.03 33.73 3ktx n LYS 446 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3ktx n LEU 447 N -1.75 0.20 0.00 3.14 4.77 0.16 -5.06 117.00 118.45 3ktx n LEU 447 Ca 0.04 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 3ktx n LEU 447 Cb 0.38 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 3ktx n LEU 447 CO 0.37 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 3ktx n GLY 448 N 0.36 0.81 0.02 -0.72 0.00 0.28 -4.76 105.19 101.19 3ktx n GLY 448 Ca 0.00 -2.08 0.13 0.00 0.00 0.00 0.00 46.02 44.07 3ktx n GLY 448 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ktx n HIS 449 N 0.72 0.00 -4.15 1.61 8.25 -1.26 -4.27 115.22 116.13 3ktx n HIS 449 Ca 0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.08 3ktx n HIS 449 Cb 0.00 -0.33 -0.03 0.00 1.12 0.00 0.00 29.99 30.75 3ktx n HIS 449 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3ktx n ASP 450 N -1.40 -1.79 0.24 0.41 2.03 -1.26 -4.82 116.55 109.96 3ktx n ASP 450 Ca 0.08 -1.26 0.10 0.00 0.52 0.00 0.00 54.79 54.23 3ktx n ASP 450 Cb 0.33 -1.84 0.68 0.00 -0.72 0.00 0.00 41.12 39.57 3ktx n ASP 450 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 3ktx h GLU 451 N -2.20 0.00 0.00 -0.67 9.09 -2.01 -0.28 114.58 118.51 3ktx h GLU 451 Ca -0.68 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.73 3ktx h GLU 451 Cb 1.40 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.50 3ktx h GLU 451 CO 0.60 0.00 0.00 0.41 0.05 0.00 0.00 179.01 180.07 3ktx n GLY 452 N -1.52 -1.52 3.41 1.06 0.00 -1.26 -4.91 105.19 100.45 3ktx n GLY 452 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.92 3ktx n GLY 452 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ktx n LYS 453 N -1.64 0.00 -0.20 1.61 4.01 -0.12 -4.86 118.16 116.96 3ktx n LYS 453 Ca 0.07 0.00 -0.08 0.00 -0.51 0.00 0.00 58.31 57.79 3ktx n LYS 453 Cb 0.35 -1.84 0.06 0.00 -0.51 0.00 0.00 35.03 33.09 3ktx n LYS 453 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 3ktx h GLU 454 N 1.59 1.04 -0.43 1.97 3.07 -1.91 0.90 114.58 120.81 3ktx h GLU 454 Ca 0.00 -0.30 -0.06 0.00 -0.50 0.00 0.00 59.36 58.50 3ktx h GLU 454 Cb 0.00 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 27.78 3ktx h GLU 454 CO 0.00 1.00 0.04 0.45 -1.40 0.00 0.00 179.01 179.10 3ktx h HIS 455 N 0.97 0.79 -0.53 4.33 3.86 -1.90 -0.40 115.15 122.27 3ktx h HIS 455 Ca 0.18 -0.12 -0.02 0.00 -1.16 0.00 0.00 60.37 59.25 3ktx h HIS 455 Cb 0.50 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.73 3ktx h HIS 455 CO 0.03 0.77 0.25 0.00 0.86 0.00 0.00 177.93 179.84 3ktx h ARG 456 N 0.59 0.76 -0.06 2.45 3.08 -1.86 0.20 114.38 119.54 3ktx h ARG 456 Ca 0.13 -0.12 0.01 0.00 0.07 0.00 0.00 59.98 60.08 3ktx h ARG 456 Cb 0.42 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 3ktx h ARG 456 CO 0.01 0.64 -0.03 0.28 -1.07 0.00 0.00 179.97 179.81 3ktx h VAL 457 N 0.71 0.91 -0.51 2.04 2.07 -0.78 -0.65 116.25 120.04 3ktx h VAL 457 Ca 0.18 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.64 3ktx h VAL 457 Cb 0.13 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 3ktx h VAL 457 CO -0.02 0.00 0.08 0.00 0.02 0.00 0.00 177.57 177.64 3ktx h ALA 458 N 1.04 1.18 -0.90 1.67 0.00 -0.83 -1.04 119.26 120.37 3ktx h ALA 458 Ca 0.03 -0.23 0.06 0.00 0.00 0.00 0.00 54.91 54.77 3ktx h ALA 458 Cb 0.07 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 17.59 3ktx h ALA 458 CO -0.07 0.55 0.57 0.00 0.00 0.00 0.00 179.25 180.30 3ktx h ALA 459 N 1.32 1.23 0.12 0.00 0.00 -0.55 0.16 119.26 121.53 3ktx h ALA 459 Ca 0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3ktx h ALA 459 Cb 0.36 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3ktx h ALA 459 CO 0.01 0.36 -0.06 0.78 0.00 0.00 0.00 179.25 180.34 3ktx h GLY 460 N 1.06 -0.16 0.97 0.00 0.00 -0.52 -1.05 103.07 103.37 3ktx h GLY 460 Ca 0.38 0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.73 3ktx h GLY 460 CO -0.16 -0.06 0.14 -2.08 0.00 0.00 0.00 176.54 174.38 3ktx h VAL 461 N -0.16 1.23 -0.28 4.60 2.07 -0.73 -1.95 116.25 121.04 3ktx h VAL 461 Ca -0.02 -0.80 0.00 0.00 0.82 0.00 0.00 66.70 66.71 3ktx h VAL 461 Cb 0.12 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 3ktx h VAL 461 CO 0.03 0.29 0.17 -0.08 0.02 0.00 0.00 177.57 178.00 3ktx h GLU 462 N 0.68 0.37 -0.31 1.57 4.57 -0.56 -0.53 114.58 120.38 3ktx h GLU 462 Ca 0.16 -0.03 0.07 0.00 -1.18 0.00 0.00 59.36 58.38 3ktx h GLU 462 Cb 0.30 -0.08 -0.07 0.00 -0.16 0.00 0.00 28.75 28.74 3ktx h GLU 462 CO -0.00 0.28 -0.12 0.35 -1.18 0.00 0.00 179.01 178.33 3ktx h PHE 463 N 0.36 -0.29 -0.98 0.92 3.57 -1.00 0.30 116.94 119.83 3ktx h PHE 463 Ca 0.10 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.73 3ktx h PHE 463 Cb -0.01 0.18 -0.07 0.00 2.79 0.00 0.00 35.95 38.84 3ktx h PHE 463 CO -0.05 -0.19 0.63 0.00 -2.23 0.00 0.00 178.31 176.46 3ktx h ALA 464 N 1.21 1.51 -0.26 2.41 0.00 -0.98 -1.48 119.26 121.67 3ktx h ALA 464 Ca 0.16 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3ktx h ALA 464 Cb 0.31 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3ktx h ALA 464 CO -0.36 0.29 0.07 0.87 0.00 0.00 0.00 179.25 180.13 3ktx h LYS 465 N 1.03 0.41 0.00 0.00 1.57 0.00 -0.75 116.57 118.83 3ktx h LYS 465 Ca 0.45 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 59.11 3ktx h LYS 465 Cb 0.35 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.60 3ktx h LYS 465 CO -0.21 0.50 -0.13 0.66 -0.57 0.00 0.00 179.45 179.70 3ktx h SER 466 N 0.25 0.00 0.09 0.86 4.64 0.52 -2.18 113.55 117.73 3ktx h SER 466 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 3ktx h SER 466 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3ktx h SER 466 CO -0.00 0.13 -0.03 0.29 -0.87 0.00 0.00 176.83 176.35 3ktx n LYS 467 N -4.16 1.17 -1.17 4.77 4.76 -0.68 -4.93 118.16 117.92 3ktx n LYS 467 Ca -0.02 -0.44 -0.06 0.00 -2.87 0.00 0.00 58.31 54.92 3ktx n LYS 467 Cb 0.21 -1.49 -0.03 0.00 -1.84 0.00 0.00 35.03 31.88 3ktx n LYS 467 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3ktx n GLY 468 N 1.15 0.81 0.20 0.72 0.00 -0.82 -4.93 105.19 102.32 3ktx n GLY 468 Ca 0.19 -0.45 -0.12 0.00 0.00 0.00 0.00 46.02 45.64 3ktx n GLY 468 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3ktx h TYR 469 N 0.00 0.77 -3.96 1.61 0.05 -1.38 -3.46 116.97 110.61 3ktx h TYR 469 Ca -0.12 -0.21 -0.32 0.00 0.05 0.00 0.00 58.73 58.13 3ktx h TYR 469 Cb 0.51 -0.17 -0.23 0.00 1.01 0.00 0.00 36.73 37.86 3ktx h TYR 469 CO 0.25 0.92 -0.75 0.14 -1.05 0.00 0.00 178.16 177.66 3ktx s VAL 470 N -4.50 0.67 0.26 -2.88 -7.23 -1.22 -4.76 120.40 100.74 3ktx s VAL 470 Ca -0.13 -0.98 0.01 0.00 -1.81 0.00 0.00 61.98 59.08 3ktx s VAL 470 Cb 0.09 -0.69 -0.05 0.00 0.56 0.00 0.00 36.38 36.29 3ktx s VAL 470 CO 0.81 -0.24 0.10 0.00 -0.31 0.00 0.00 175.10 175.46 3ktx s GLN 471 N -1.34 1.42 -0.19 4.82 -2.07 -1.26 -4.29 119.66 116.75 3ktx s GLN 471 Ca -0.06 -1.77 -0.18 0.00 -1.82 0.00 0.00 55.36 51.53 3ktx s GLN 471 Cb -0.09 -0.26 -0.08 0.00 -1.09 0.00 0.00 33.01 31.50 3ktx s GLN 471 CO 0.01 -0.30 0.63 2.41 -1.32 0.00 0.00 175.29 176.71 3ktx n THR 472 N -0.47 0.00 -0.79 3.63 -1.04 -1.26 -1.43 114.28 112.91 3ktx n THR 472 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3ktx n THR 472 Cb 0.66 -0.19 0.00 0.00 -1.82 0.00 0.00 70.33 68.98 3ktx n THR 472 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3ktx n GLY 473 N 1.62 0.68 3.91 3.41 0.00 0.16 -4.97 105.19 109.99 3ktx n GLY 473 Ca 0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 3ktx n GLY 473 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ktx s ASP 474 N -2.25 6.17 0.11 1.61 1.01 -0.51 -4.79 116.67 118.02 3ktx s ASP 474 Ca 0.00 0.93 -0.11 0.00 0.71 0.00 0.00 52.55 54.08 3ktx s ASP 474 Cb 0.00 -2.19 -0.06 0.00 1.01 0.00 0.00 42.92 41.68 3ktx s ASP 474 CO 0.00 -0.66 0.45 -0.31 0.21 0.00 0.00 175.17 174.86 3ktx s TYR 475 N -2.80 3.57 -0.05 4.23 2.02 -1.26 0.25 117.35 123.31 3ktx s TYR 475 Ca 0.49 0.86 0.02 0.00 -0.37 0.00 0.00 57.07 58.06 3ktx s TYR 475 Cb -0.10 -2.22 0.01 0.00 -0.40 0.00 0.00 41.96 39.25 3ktx s TYR 475 CO 0.45 0.47 -0.09 0.00 -1.57 0.00 0.00 175.55 174.82 3ktx s VAL 477 N 0.66 5.13 -0.10 0.00 1.01 -0.57 -0.77 120.40 125.77 3ktx s VAL 477 Ca -0.12 0.81 0.01 0.00 0.00 0.00 0.00 61.98 62.69 3ktx s VAL 477 Cb -0.14 -3.79 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 3ktx s VAL 477 CO 0.02 0.17 -0.13 -0.69 0.00 0.00 0.00 175.10 174.46 3ktx s VAL 478 N 1.80 3.07 0.03 2.92 1.01 0.13 -0.58 120.40 128.78 3ktx s VAL 478 Ca 0.21 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.53 3ktx s VAL 478 Cb -0.15 -2.25 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 3ktx s VAL 478 CO 0.09 0.55 -0.10 -0.51 0.00 0.00 0.00 175.10 175.13 3ktx s ILE 479 N -0.12 0.79 0.05 2.22 -1.16 0.79 -0.37 121.20 123.40 3ktx s ILE 479 Ca -0.01 -0.83 -0.27 0.00 -0.51 0.00 0.00 60.65 59.03 3ktx s ILE 479 Cb -0.14 -0.74 0.10 0.00 0.61 0.00 0.00 42.46 42.29 3ktx s ILE 479 CO 0.03 -0.07 1.18 -1.38 -2.81 0.00 0.00 174.94 171.90 3ktx s HIS 480 N -0.81 -0.01 0.68 3.50 -3.43 -0.50 -1.21 115.29 113.51 3ktx s HIS 480 Ca -0.01 -0.19 -0.12 0.00 -0.80 0.00 0.00 55.06 53.94 3ktx s HIS 480 Cb -0.07 0.60 0.16 0.00 -1.43 0.00 0.00 32.58 31.84 3ktx s HIS 480 CO 0.01 -0.50 0.81 0.00 -2.00 0.00 0.00 174.74 173.05 3ktx n ALA 481 N -0.65 -1.38 0.00 -1.38 0.00 -1.26 -1.37 120.51 114.47 3ktx n ALA 481 Ca -0.04 -1.09 0.00 0.00 0.00 0.00 0.00 53.44 52.31 3ktx n ALA 481 Cb 0.61 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.99 3ktx n ALA 481 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 3ktx n TYR 488 N -3.45 0.00 -3.82 0.00 4.11 -1.26 -4.83 117.16 107.90 3ktx n TYR 488 Ca 0.10 0.00 -0.36 0.00 -0.00 0.00 0.00 57.90 57.64 3ktx n TYR 488 Cb 0.37 0.00 -0.13 0.00 -0.00 0.00 0.00 39.34 39.59 3ktx n TYR 488 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 3ktx s ALA 489 N 0.00 2.98 0.00 -3.48 0.00 -1.26 -4.91 121.76 115.09 3ktx s ALA 489 Ca 0.00 -1.96 0.00 0.00 0.00 0.00 0.00 51.96 50.00 3ktx s ALA 489 Cb 0.00 -2.17 0.00 0.00 0.00 0.00 0.00 23.12 20.95 3ktx s ALA 489 CO 0.00 -1.43 0.14 0.27 0.00 0.00 0.00 175.76 174.74 3ktx n ASN 490 N 4.68 0.28 -4.56 0.00 2.04 -0.64 -4.49 115.26 112.57 3ktx n ASN 490 Ca -0.10 -0.64 -0.34 0.00 -0.44 0.00 0.00 54.58 53.06 3ktx n ASN 490 Cb 0.43 0.30 -0.11 0.00 -2.53 0.00 0.00 39.78 37.86 3ktx n ASN 490 CO 0.00 0.00 0.00 -1.58 -0.44 0.00 0.00 177.26 175.24 3ktx s GLN 491 N -0.30 3.12 0.04 -3.83 0.74 -0.47 -5.00 119.66 113.96 3ktx s GLN 491 Ca 0.00 -0.53 0.04 0.00 0.05 0.00 0.00 55.36 54.93 3ktx s GLN 491 Cb 0.00 -2.73 -0.02 0.00 1.10 0.00 0.00 33.01 31.36 3ktx s GLN 491 CO 0.00 0.51 -0.13 0.99 -0.55 0.00 0.00 175.29 176.11 3ktx s THR 492 N -0.37 0.99 0.01 -0.34 2.01 -1.26 -1.40 115.64 115.27 3ktx s THR 492 Ca 0.06 -0.96 -0.02 0.00 0.31 0.00 0.00 61.69 61.08 3ktx s THR 492 Cb -0.12 -0.91 -0.01 0.00 0.01 0.00 0.00 72.50 71.47 3ktx s THR 492 CO 0.02 -0.04 0.02 -0.13 -0.69 0.00 0.00 174.62 173.81 3ktx s ARG 493 N -1.13 0.27 -0.29 4.92 0.52 0.50 -4.99 118.95 118.76 3ktx s ARG 493 Ca 0.00 -0.38 -0.03 0.00 -0.52 0.00 0.00 55.73 54.80 3ktx s ARG 493 Cb -0.08 0.11 0.03 0.00 0.52 0.00 0.00 34.95 35.53 3ktx s ARG 493 CO 0.01 -0.05 0.00 0.42 0.02 0.00 0.00 175.30 175.70 3ktx s ILE 494 N -1.04 3.19 -0.08 1.52 1.01 -1.26 0.19 121.20 124.74 3ktx s ILE 494 Ca -0.11 -1.13 0.00 0.00 0.00 0.00 0.00 60.65 59.41 3ktx s ILE 494 Cb -0.07 -2.73 -0.03 0.00 0.01 0.00 0.00 42.46 39.64 3ktx s ILE 494 CO -0.00 0.01 -0.07 -0.22 0.00 0.00 0.00 174.94 174.66 3ktx s LEU 495 N 1.33 3.14 -0.13 2.97 0.20 0.05 -4.96 118.68 121.28 3ktx s LEU 495 Ca -0.02 -0.05 -0.22 0.00 0.69 0.00 0.00 54.13 54.53 3ktx s LEU 495 Cb -0.18 -1.69 -0.03 0.00 -0.43 0.00 0.00 46.19 43.86 3ktx s LEU 495 CO -0.01 0.33 0.64 -0.22 -0.29 0.00 0.00 176.35 176.81 3ktx s LEU 496 N -0.63 4.24 0.11 -0.68 2.96 -1.26 -1.13 118.68 122.29 3ktx s LEU 496 Ca 0.10 1.00 -0.30 0.00 -0.22 0.00 0.00 54.13 54.70 3ktx s LEU 496 Cb -0.12 -2.96 -0.06 0.00 0.50 0.00 0.00 46.19 43.55 3ktx s LEU 496 CO 0.02 -0.17 1.17 -0.69 -1.32 0.00 0.00 176.35 175.36 3ktx s VAL 497 N 1.25 3.93 -2.00 1.68 1.01 0.14 -4.89 120.40 121.52 3ktx s VAL 497 Ca 0.32 1.49 0.30 0.00 0.00 0.00 0.00 61.98 64.09 3ktx s VAL 497 Cb -0.16 -3.95 0.85 0.00 0.00 0.00 0.00 36.38 33.11 3ktx s VAL 497 CO 0.14 0.17 2.11 -0.62 0.00 0.00 0.00 175.10 176.90