#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k2l s ASP 61 N 0.00 4.29 0.48 6.55 2.15 -1.26 -4.94 116.67 123.93 3k2l s ASP 61 Ca 0.00 -3.07 0.29 0.00 0.43 0.00 0.00 52.55 50.20 3k2l s ASP 61 Cb 0.00 -1.58 0.90 0.00 -0.30 0.00 0.00 42.92 41.94 3k2l s ASP 61 CO 0.00 -0.22 1.81 -0.07 -0.17 0.00 0.00 175.17 176.52 3k2l h LEU 62 N 6.40 0.00 -0.43 -1.34 3.38 -1.86 -3.23 115.31 118.23 3k2l h LEU 62 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3k2l h LEU 62 Cb 0.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.63 3k2l h LEU 62 CO 0.67 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.81 3k2l n GLY 63 N 0.53 -0.48 2.82 0.83 0.00 -1.26 -0.35 105.19 107.28 3k2l n GLY 63 Ca 0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 46.02 45.83 3k2l n GLY 63 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k2l n THR 64 N -0.30 1.26 -0.01 2.61 -2.24 -1.22 -3.54 114.28 110.83 3k2l n THR 64 Ca 0.12 -2.94 -0.10 0.00 -2.27 0.00 0.00 64.05 58.86 3k2l n THR 64 Cb 0.15 1.25 -0.14 0.00 -2.10 0.00 0.00 70.33 69.49 3k2l n THR 64 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 3k2l h GLU 65 N 2.64 0.04 -6.47 -0.78 4.57 -1.18 -3.43 114.58 109.97 3k2l h GLU 65 Ca -0.13 -0.07 -0.63 0.00 -1.18 0.00 0.00 59.36 57.34 3k2l h GLU 65 Cb 1.26 0.03 -0.14 0.00 -0.16 0.00 0.00 28.75 29.74 3k2l h GLU 65 CO 0.21 0.65 -0.72 -0.80 -1.18 0.00 0.00 179.01 177.17 3k2l s ASN 66 N -6.30 4.32 -0.30 1.04 0.01 0.17 -4.94 114.94 108.94 3k2l s ASN 66 Ca -0.06 -0.52 -0.10 0.00 -0.71 0.00 0.00 52.86 51.46 3k2l s ASN 66 Cb 0.08 -0.77 -0.03 0.00 0.41 0.00 0.00 41.25 40.94 3k2l s ASN 66 CO 0.82 0.12 0.17 -0.76 -1.51 0.00 0.00 177.10 175.94 3k2l s LEU 67 N -2.69 4.06 -0.22 0.60 1.43 -1.26 -0.39 118.68 120.21 3k2l s LEU 67 Ca 0.24 -0.26 -0.05 0.00 -1.03 0.00 0.00 54.13 53.02 3k2l s LEU 67 Cb -0.09 -2.06 -0.02 0.00 0.03 0.00 0.00 46.19 44.04 3k2l s LEU 67 CO 0.15 -0.13 0.01 -0.47 0.23 0.00 0.00 176.35 176.14 3k2l s TYR 68 N 1.69 3.03 0.62 0.29 5.04 0.07 -4.97 117.35 123.12 3k2l s TYR 68 Ca 0.06 -0.61 0.04 0.00 -2.44 0.00 0.00 57.07 54.13 3k2l s TYR 68 Cb -0.16 -2.14 0.09 0.00 0.35 0.00 0.00 41.96 40.10 3k2l s TYR 68 CO 0.09 -0.38 0.85 -0.06 -1.34 0.00 0.00 175.55 174.71 3k2l s PHE 69 N 1.35 1.81 -0.96 4.97 0.08 -1.26 -0.50 117.98 123.47 3k2l s PHE 69 Ca 0.04 -0.41 -0.11 0.00 0.12 0.00 0.00 56.93 56.57 3k2l s PHE 69 Cb -0.15 -2.63 0.25 0.00 -0.57 0.00 0.00 43.02 39.92 3k2l s PHE 69 CO 0.01 -1.28 0.92 -1.64 -0.10 0.00 0.00 175.22 173.13 3k2l s MET 73 N -4.85 3.86 0.00 0.44 1.00 -1.26 -4.96 119.30 113.53 3k2l s MET 73 Ca 0.62 -2.84 0.00 0.00 0.00 0.00 0.00 55.69 53.47 3k2l s MET 73 Cb -0.07 -4.46 0.00 0.00 0.00 0.00 0.00 34.83 30.30 3k2l s MET 73 CO 0.41 -1.26 0.00 0.41 0.00 0.00 0.00 175.02 174.57 3k2l n GLY 74 N 3.33 5.40 3.73 -0.03 0.00 -1.26 -5.14 105.19 111.23 3k2l n GLY 74 Ca 0.19 -1.24 -0.42 0.00 0.00 0.00 0.00 46.02 44.55 3k2l n GLY 74 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3k2l n LYS 75 N 0.00 2.34 -1.93 1.61 4.76 -1.26 -4.97 118.16 118.72 3k2l n LYS 75 Ca 0.00 0.82 -0.42 0.00 -2.87 0.00 0.00 58.31 55.85 3k2l n LYS 75 Cb 0.00 -2.49 -0.02 0.00 -1.84 0.00 0.00 35.03 30.68 3k2l n LYS 75 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3k2l s VAL 76 N -1.12 2.48 0.24 -0.18 1.01 -1.26 -4.86 120.40 116.70 3k2l s VAL 76 Ca 0.55 0.39 0.11 0.00 0.00 0.00 0.00 61.98 63.03 3k2l s VAL 76 Cb -0.52 -3.25 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 3k2l s VAL 76 CO 0.62 0.06 -0.16 -0.54 0.00 0.00 0.00 175.10 175.08 3k2l s LYS 77 N -0.10 1.79 -0.20 2.72 1.02 0.35 -4.98 119.74 120.33 3k2l s LYS 77 Ca 0.63 -1.57 -0.05 0.00 0.02 0.00 0.00 55.97 54.99 3k2l s LYS 77 Cb -0.44 -1.91 -0.02 0.00 -0.52 0.00 0.00 37.83 34.94 3k2l s LYS 77 CO 0.42 0.37 -0.01 0.00 -0.92 0.00 0.00 175.35 175.21 3k2l s ALA 78 N -2.14 2.98 0.38 5.17 0.00 -1.26 -0.75 121.76 126.15 3k2l s ALA 78 Ca 0.27 -1.03 0.08 0.00 0.00 0.00 0.00 51.96 51.28 3k2l s ALA 78 Cb -0.07 -1.76 -0.07 0.00 0.00 0.00 0.00 23.12 21.23 3k2l s ALA 78 CO 0.14 -0.21 0.02 0.95 0.00 0.00 0.00 175.76 176.67 3k2l s THR 79 N 1.11 2.26 0.69 0.00 -4.23 0.48 -4.71 115.64 111.25 3k2l s THR 79 Ca 0.02 -1.97 -0.11 0.00 -1.18 0.00 0.00 61.69 58.45 3k2l s THR 79 Cb -0.14 -2.88 0.01 0.00 1.34 0.00 0.00 72.50 70.82 3k2l s THR 79 CO 0.01 -0.09 1.06 -2.84 -0.54 0.00 0.00 174.62 172.22 3k2l s PRO 80 N -3.73 2.95 0.55 3.99 0.02 -1.23 -0.66 135.00 136.89 3k2l s PRO 80 Ca 0.36 0.77 -0.20 0.00 0.02 0.00 0.00 61.00 61.95 3k2l s PRO 80 Cb 0.05 -2.01 -0.08 0.00 0.02 0.00 0.00 34.50 32.49 3k2l s PRO 80 CO 0.19 -1.04 0.82 -0.12 -0.33 0.00 0.00 177.00 176.52 3k2l n MET 81 N -3.06 0.86 -3.89 5.54 0.00 0.53 -4.51 117.12 112.58 3k2l n MET 81 Ca 0.07 0.33 -0.23 0.00 -0.00 0.00 0.00 57.70 57.86 3k2l n MET 81 Cb 0.55 -1.97 -0.02 0.00 0.00 0.00 0.00 33.22 31.78 3k2l n MET 81 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 3k2l s THR 82 N -1.52 5.26 0.26 1.12 -4.23 -1.26 -1.75 115.64 113.51 3k2l s THR 82 Ca 0.70 -0.81 -0.02 0.00 -1.18 0.00 0.00 61.69 60.39 3k2l s THR 82 Cb -0.46 -3.82 0.24 0.00 1.34 0.00 0.00 72.50 69.79 3k2l s THR 82 CO 0.52 -0.28 1.76 -0.65 -0.54 0.00 0.00 174.62 175.43 3k2l h PRO 83 N 1.45 0.60 -0.41 3.99 0.11 -1.79 0.64 132.00 136.58 3k2l h PRO 83 Ca -0.51 -0.04 0.07 0.00 0.11 0.00 0.00 66.00 65.64 3k2l h PRO 83 Cb 1.22 -0.14 -0.06 0.00 0.11 0.00 0.00 31.00 32.13 3k2l h PRO 83 CO 0.64 0.40 0.03 0.93 -0.21 0.00 0.00 178.00 179.79 3k2l h GLU 84 N 0.62 0.14 -0.33 1.05 3.07 -1.95 0.28 114.58 117.47 3k2l h GLU 84 Ca 0.45 -0.01 -0.14 0.00 -0.50 0.00 0.00 59.36 59.16 3k2l h GLU 84 Cb 0.62 -0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.50 3k2l h GLU 84 CO -0.35 0.09 -0.34 1.96 -1.40 0.00 0.00 179.01 178.97 3k2l h GLN 85 N 0.15 0.81 -0.44 2.33 4.20 -1.71 -0.44 115.11 120.01 3k2l h GLN 85 Ca 0.20 -0.43 -0.01 0.00 0.06 0.00 0.00 58.65 58.47 3k2l h GLN 85 Cb 0.28 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 3k2l h GLN 85 CO -0.31 1.07 0.25 0.00 -0.67 0.00 0.00 178.83 179.16 3k2l h ALA 86 N 0.73 0.56 -0.01 3.87 0.00 -0.53 -2.41 119.26 121.47 3k2l h ALA 86 Ca 0.05 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3k2l h ALA 86 Cb 0.93 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3k2l h ALA 86 CO 0.08 0.08 0.00 1.98 0.00 0.00 0.00 179.25 181.39 3k2l h MET 87 N 0.57 0.02 -0.94 0.00 1.85 -0.31 0.73 114.93 116.86 3k2l h MET 87 Ca 0.15 -0.01 0.24 0.00 -0.61 0.00 0.00 59.70 59.48 3k2l h MET 87 Cb 0.04 -0.00 -0.06 0.00 0.43 0.00 0.00 31.60 32.01 3k2l h MET 87 CO -0.03 0.25 0.64 0.87 -0.40 0.00 0.00 176.91 178.24 3k2l h LYS 88 N -0.21 0.26 0.00 0.39 1.57 -0.98 -1.84 116.57 115.75 3k2l h LYS 88 Ca 0.00 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.71 3k2l h LYS 88 Cb 0.24 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 3k2l h LYS 88 CO 0.00 0.17 -1.86 0.94 -0.57 0.00 0.00 179.45 178.13 3k2l n GLN 89 N -4.44 0.69 0.00 3.15 7.27 -0.92 -4.69 117.38 118.44 3k2l n GLN 89 Ca 0.20 -0.13 0.00 0.00 0.07 0.00 0.00 57.00 57.14 3k2l n GLN 89 Cb 0.84 -1.41 0.00 0.00 2.41 0.00 0.00 30.24 32.07 3k2l n GLN 89 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 3k2l n TYR 90 N -2.20 0.00 -0.29 3.69 4.01 0.22 -4.87 117.16 117.72 3k2l n TYR 90 Ca -0.08 -0.11 0.02 0.00 -0.16 0.00 0.00 57.90 57.57 3k2l n TYR 90 Cb 0.57 -0.01 0.07 0.00 -0.31 0.00 0.00 39.34 39.66 3k2l n TYR 90 CO 0.00 0.00 0.00 -0.12 -0.46 0.00 0.00 176.86 176.28 3k2l n MET 91 N -0.11 -0.12 0.18 -0.72 1.56 -0.70 -0.77 117.12 116.44 3k2l n MET 91 Ca 0.00 1.22 0.13 0.00 -0.27 0.00 0.00 57.70 58.78 3k2l n MET 91 Cb 0.36 -1.82 0.63 0.00 2.15 0.00 0.00 33.22 34.54 3k2l n MET 91 CO 0.00 0.00 0.00 1.96 -0.73 0.00 0.00 175.97 177.20 3k2l h GLN 92 N 0.00 0.00 -0.08 2.12 7.50 -1.89 -1.98 115.11 120.78 3k2l h GLN 92 Ca 0.33 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.48 3k2l h GLN 92 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.06 3k2l h GLN 92 CO -0.80 0.00 0.00 0.36 -1.50 0.00 0.00 178.83 176.89 3k2l n LYS 93 N -2.43 0.96 -3.95 1.46 2.85 0.05 -4.97 118.16 112.13 3k2l n LYS 93 Ca 0.00 -1.31 -0.31 0.00 -1.05 0.00 0.00 58.31 55.64 3k2l n LYS 93 Cb 0.15 -1.21 -0.05 0.00 -0.65 0.00 0.00 35.03 33.27 3k2l n LYS 93 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 3k2l s LEU 94 N -0.90 4.24 1.06 -5.58 1.43 -0.75 -4.82 118.68 113.36 3k2l s LEU 94 Ca 0.14 0.23 -0.15 0.00 -1.03 0.00 0.00 54.13 53.31 3k2l s LEU 94 Cb 0.09 -2.78 0.22 0.00 0.03 0.00 0.00 46.19 43.75 3k2l s LEU 94 CO 0.13 0.19 1.14 0.42 0.23 0.00 0.00 176.35 178.46 3k2l s THR 95 N -1.44 1.85 0.16 5.49 -4.23 -1.26 -4.89 115.64 111.32 3k2l s THR 95 Ca 0.32 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.75 3k2l s THR 95 Cb -0.13 -2.61 -0.05 0.00 1.34 0.00 0.00 72.50 71.06 3k2l s THR 95 CO 0.25 0.00 1.48 0.00 -0.54 0.00 0.00 174.62 175.81 3k2l h ALA 96 N -2.05 0.61 -0.40 3.99 0.00 -1.95 -2.52 119.26 116.94 3k2l h ALA 96 Ca -0.49 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 53.92 3k2l h ALA 96 Cb 1.31 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 3k2l h ALA 96 CO 0.47 0.68 0.15 0.35 0.00 0.00 0.00 179.25 180.90 3k2l h PHE 97 N 0.65 0.62 -0.51 0.00 3.57 -1.94 -2.71 116.94 116.61 3k2l h PHE 97 Ca 0.04 -0.05 0.03 0.00 3.53 0.00 0.00 57.97 61.51 3k2l h PHE 97 Cb 1.02 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.55 3k2l h PHE 97 CO 0.06 0.56 0.34 0.93 -2.23 0.00 0.00 178.31 177.97 3k2l h GLU 98 N 0.50 0.59 -0.00 1.11 5.08 -1.87 -1.91 114.58 118.08 3k2l h GLU 98 Ca 0.13 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3k2l h GLU 98 Cb 0.21 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 3k2l h GLU 98 CO -0.01 0.39 0.02 0.45 -1.00 0.00 0.00 179.01 178.86 3k2l h HIS 99 N 0.60 0.00 0.00 4.33 3.86 -1.11 -0.37 115.15 122.46 3k2l h HIS 99 Ca 0.20 0.00 -0.33 0.00 -1.16 0.00 0.00 60.37 59.08 3k2l h HIS 99 Cb 0.06 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.47 3k2l h HIS 99 CO -0.00 0.00 -2.24 0.72 0.86 0.00 0.00 177.93 177.27 3k2l n HIS 100 N -3.16 0.00 0.07 2.45 8.25 -0.80 -4.65 115.22 117.38 3k2l n HIS 100 Ca -0.03 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.29 3k2l n HIS 100 Cb 0.09 -0.87 -0.06 0.00 1.12 0.00 0.00 29.99 30.27 3k2l n HIS 100 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 3k2l h GLU 101 N 0.00 0.39 -0.22 -0.41 4.81 -0.70 -3.29 114.58 115.16 3k2l h GLU 101 Ca -0.49 -0.45 -0.00 0.00 -0.13 0.00 0.00 59.36 58.29 3k2l h GLU 101 Cb 1.96 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 31.46 3k2l h GLU 101 CO -0.02 1.13 0.13 0.97 -0.73 0.00 0.00 179.01 180.48 3k2l h ILE 102 N 0.20 1.07 0.00 2.32 2.10 -1.35 -1.16 117.51 120.68 3k2l h ILE 102 Ca -0.09 -0.17 0.00 0.00 1.08 0.00 0.00 64.86 65.68 3k2l h ILE 102 Cb 1.65 0.77 0.00 0.00 -1.09 0.00 0.00 36.82 38.14 3k2l h ILE 102 CO 0.17 0.07 0.00 0.49 -1.08 0.00 0.00 178.15 177.80 3k2l n PHE 103 N -4.48 0.00 -0.66 2.19 3.72 -1.24 -1.07 117.46 115.92 3k2l n PHE 103 Ca 0.00 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.48 3k2l n PHE 103 Cb 0.09 -0.15 0.26 0.00 -0.94 0.00 0.00 39.48 38.73 3k2l n PHE 103 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3k2l n SER 104 N -1.15 3.87 -3.91 4.37 3.41 -0.44 -4.66 113.62 115.11 3k2l n SER 104 Ca 0.07 -2.57 -0.30 0.00 -0.26 0.00 0.00 58.87 55.80 3k2l n SER 104 Cb 0.06 -0.46 -0.14 0.00 -0.26 0.00 0.00 64.21 63.41 3k2l n SER 104 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3k2l s TYR 105 N -2.05 3.00 0.60 7.33 2.02 -0.23 -4.99 117.35 123.04 3k2l s TYR 105 Ca 0.39 -2.81 0.30 0.00 -0.37 0.00 0.00 57.07 54.58 3k2l s TYR 105 Cb 0.27 -2.56 1.77 0.00 -0.40 0.00 0.00 41.96 41.05 3k2l s TYR 105 CO 0.15 -0.84 2.18 -1.00 -1.57 0.00 0.00 175.55 174.47 3k2l h PRO 106 N 7.14 0.00 -4.70 -1.71 0.13 -1.83 -3.40 132.00 127.64 3k2l h PRO 106 Ca -0.06 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.45 3k2l h PRO 106 Cb 0.96 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 31.73 3k2l h PRO 106 CO 0.57 0.00 -0.83 -1.21 -0.23 0.00 0.00 178.00 176.30 3k2l s GLU 107 N -4.60 2.31 -0.22 0.86 2.02 -1.26 -4.52 118.70 113.29 3k2l s GLU 107 Ca -0.05 -0.70 -0.06 0.00 0.02 0.00 0.00 54.97 54.18 3k2l s GLU 107 Cb 0.15 -2.29 -0.02 0.00 0.10 0.00 0.00 34.13 32.07 3k2l s GLU 107 CO 0.53 -0.30 0.01 0.42 0.02 0.00 0.00 175.26 175.95 3k2l s ILE 108 N 1.42 3.95 -0.02 -1.63 -1.09 -0.72 -4.89 121.20 118.22 3k2l s ILE 108 Ca 0.03 -0.31 0.05 0.00 -2.23 0.00 0.00 60.65 58.19 3k2l s ILE 108 Cb -0.14 -2.81 -0.07 0.00 -1.58 0.00 0.00 42.46 37.86 3k2l s ILE 108 CO -0.10 0.40 0.07 -1.22 -1.23 0.00 0.00 174.94 172.86 3k2l n TYR 109 N 4.58 0.00 -3.63 3.97 4.01 0.27 -3.37 117.16 122.99 3k2l n TYR 109 Ca -0.17 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.44 3k2l n TYR 109 Cb 0.51 -0.16 -0.07 0.00 -0.31 0.00 0.00 39.34 39.31 3k2l n TYR 109 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 3k2l s PHE 110 N -2.25 -0.74 -0.04 -0.72 2.19 -0.34 -4.32 117.98 111.75 3k2l s PHE 110 Ca -0.02 1.81 0.00 0.00 0.33 0.00 0.00 56.93 59.05 3k2l s PHE 110 Cb 0.02 0.29 0.00 0.00 -1.31 0.00 0.00 43.02 42.02 3k2l s PHE 110 CO 0.20 -0.36 0.42 1.28 1.83 0.00 0.00 175.22 178.58 3k2l n LEU 111 N 2.59 0.84 -2.06 6.12 4.77 -1.26 -3.94 117.00 124.06 3k2l n LEU 111 Ca -0.14 -0.90 -0.19 0.00 -0.03 0.00 0.00 56.01 54.75 3k2l n LEU 111 Cb 0.55 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.60 3k2l n LEU 111 CO 0.03 0.21 -0.22 0.61 -1.33 0.00 0.00 177.39 176.69 3k2l n GLY 112 N 0.21 0.46 3.72 -0.72 0.00 -1.26 -4.67 105.19 102.93 3k2l n GLY 112 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3k2l n GLY 112 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3k2l n LEU 113 N -2.68 3.91 -0.14 0.99 4.77 -1.26 -0.31 117.00 122.28 3k2l n LEU 113 Ca -0.21 1.15 -0.02 0.00 -0.03 0.00 0.00 56.01 56.90 3k2l n LEU 113 Cb 0.65 -1.53 -0.01 0.00 -2.33 0.00 0.00 43.42 40.20 3k2l n LEU 113 CO 0.28 -0.09 -0.02 -0.46 -1.33 0.00 0.00 177.39 175.77 3k2l n ASN 114 N 2.07 -3.81 -4.84 -1.43 0.23 -1.26 -5.01 115.26 101.21 3k2l n ASN 114 Ca 0.09 0.05 -0.32 0.00 -0.53 0.00 0.00 54.58 53.87 3k2l n ASN 114 Cb 0.35 -1.47 -0.00 0.00 -2.08 0.00 0.00 39.78 36.57 3k2l n ASN 114 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3k2l s ALA 115 N -1.87 2.98 -0.70 -2.53 0.00 0.57 -4.97 121.76 115.24 3k2l s ALA 115 Ca 0.00 0.13 -0.20 0.00 0.00 0.00 0.00 51.96 51.89 3k2l s ALA 115 Cb 0.00 -3.13 0.10 0.00 0.00 0.00 0.00 23.12 20.09 3k2l s ALA 115 CO 0.00 -0.57 0.91 0.15 0.00 0.00 0.00 175.76 176.25 3k2l s LYS 116 N -4.49 3.21 0.19 0.00 3.01 -1.26 -5.01 119.74 115.40 3k2l s LYS 116 Ca 0.59 -1.25 -0.28 0.00 -1.01 0.00 0.00 55.97 54.01 3k2l s LYS 116 Cb -0.12 -4.40 -0.08 0.00 -1.01 0.00 0.00 37.83 32.22 3k2l s LYS 116 CO 0.41 -1.70 0.88 -1.59 0.51 0.00 0.00 175.35 173.86 3k2l s LYS 117 N 3.18 4.73 -0.00 1.68 -2.85 -1.26 -4.99 119.74 120.23 3k2l s LYS 117 Ca 0.21 1.36 -0.30 0.00 -1.00 0.00 0.00 55.97 56.24 3k2l s LYS 117 Cb -0.16 -3.29 -0.06 0.00 -2.06 0.00 0.00 37.83 32.26 3k2l s LYS 117 CO 0.04 0.50 1.59 1.03 0.10 0.00 0.00 175.35 178.60 3k2l s ARG 118 N -1.00 4.21 -0.76 1.78 3.00 -1.26 -4.93 118.95 119.99 3k2l s ARG 118 Ca 0.40 2.17 -0.26 0.00 0.00 0.00 0.00 55.73 58.04 3k2l s ARG 118 Cb -0.25 -3.77 0.00 0.00 0.00 0.00 0.00 34.95 30.94 3k2l s ARG 118 CO 0.30 -0.75 1.60 -1.14 0.00 0.00 0.00 175.30 175.31 3k2l s GLN 119 N 3.21 2.96 0.35 3.54 2.00 -1.26 -4.95 119.66 125.52 3k2l s GLN 119 Ca 0.71 -0.08 0.07 0.00 -2.00 0.00 0.00 55.36 54.06 3k2l s GLN 119 Cb -0.35 -4.55 -0.01 0.00 0.80 0.00 0.00 33.01 28.91 3k2l s GLN 119 CO 0.29 -2.53 0.48 0.20 -0.50 0.00 0.00 175.29 173.23 3k2l s GLY 120 N 6.04 1.66 0.32 2.59 0.00 -1.26 -4.94 107.32 111.73 3k2l s GLY 120 Ca 0.53 -1.50 0.03 0.00 0.00 0.00 0.00 44.72 43.78 3k2l s GLY 120 CO 0.11 -1.40 0.08 1.06 0.00 0.00 0.00 173.10 172.95 3k2l s MET 121 N -4.20 1.63 0.00 2.90 -1.94 0.22 -4.07 119.30 113.85 3k2l s MET 121 Ca 0.46 -1.91 0.25 0.00 -1.71 0.00 0.00 55.69 52.78 3k2l s MET 121 Cb -0.09 -0.70 0.51 0.00 2.01 0.00 0.00 34.83 36.55 3k2l s MET 121 CO 0.31 -0.25 1.41 2.41 -0.01 0.00 0.00 175.02 178.90 3k2l n THR 122 N -0.66 0.00 0.00 2.05 -1.04 -1.26 -4.06 114.28 109.31 3k2l n THR 122 Ca -0.02 -0.22 0.00 0.00 -2.04 0.00 0.00 64.05 61.77 3k2l n THR 122 Cb 0.66 0.77 0.00 0.00 -1.82 0.00 0.00 70.33 69.95 3k2l n THR 122 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3k2l n GLY 124 N 1.34 1.52 3.79 3.41 0.00 -1.26 -4.89 105.19 109.12 3k2l n GLY 124 Ca 0.12 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 45.27 3k2l n GLY 124 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k2l s PRO 125 N 0.00 3.83 -1.30 1.61 0.05 -1.26 -1.86 135.00 136.07 3k2l s PRO 125 Ca 0.00 1.39 -0.02 0.00 0.05 0.00 0.00 61.00 62.42 3k2l s PRO 125 Cb 0.00 -2.15 0.01 0.00 0.05 0.00 0.00 34.50 32.41 3k2l s PRO 125 CO 0.00 -0.41 0.87 0.09 0.05 0.00 0.00 177.00 177.60 3k2l n ASN 126 N -0.86 -2.27 -1.06 6.66 4.13 -1.26 -2.28 115.26 118.31 3k2l n ASN 126 Ca 0.09 -0.73 -0.12 0.00 1.68 0.00 0.00 54.58 55.50 3k2l n ASN 126 Cb 0.52 -4.47 -0.04 0.00 -1.54 0.00 0.00 39.78 34.25 3k2l n ASN 126 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 3k2l n ASN 127 N -3.05 -4.21 -3.23 6.41 5.15 -1.24 -2.03 115.26 113.06 3k2l n ASN 127 Ca -0.23 0.19 -0.22 0.00 -0.60 0.00 0.00 54.58 53.71 3k2l n ASN 127 Cb 0.65 -2.99 0.06 0.00 -0.53 0.00 0.00 39.78 36.97 3k2l n ASN 127 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3k2l n GLY 128 N -1.35 -0.46 0.35 8.20 0.00 -0.78 -3.38 105.19 107.78 3k2l n GLY 128 Ca -0.13 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3k2l n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k2l n GLY 129 N -1.78 0.88 0.01 -0.02 0.00 -0.86 0.70 105.19 104.11 3k2l n GLY 129 Ca -0.03 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.08 3k2l n GLY 129 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3k2l n TYR 130 N -2.14 0.00 -3.94 1.61 4.01 -0.97 -4.89 117.16 110.83 3k2l n TYR 130 Ca 0.00 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.52 3k2l n TYR 130 Cb 0.00 -0.30 -0.05 0.00 -0.31 0.00 0.00 39.34 38.68 3k2l n TYR 130 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3k2l s ASP 131 N -3.69 5.08 0.24 7.72 1.01 -0.95 -1.19 116.67 124.89 3k2l s ASP 131 Ca -0.03 -0.58 0.00 0.00 0.71 0.00 0.00 52.55 52.65 3k2l s ASP 131 Cb 0.12 -0.91 0.00 0.00 1.01 0.00 0.00 42.92 43.14 3k2l s ASP 131 CO 0.74 -0.31 0.00 -0.90 0.21 0.00 0.00 175.17 174.91 3k2l n ASP 132 N -1.27 0.00 0.05 0.27 5.68 -0.92 -4.83 116.55 115.52 3k2l n ASP 132 Ca -0.03 -0.27 0.11 0.00 -0.50 0.00 0.00 54.79 54.10 3k2l n ASP 132 Cb 0.60 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.59 3k2l n ASP 132 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 3k2l n ASP 133 N -0.81 0.61 0.00 -1.12 5.75 -1.26 -3.68 116.55 116.03 3k2l n ASP 133 Ca 0.00 -0.01 0.14 0.00 -0.01 0.00 0.00 54.79 54.91 3k2l n ASP 133 Cb 0.00 0.80 0.70 0.00 -1.03 0.00 0.00 41.12 41.58 3k2l n ASP 133 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3k2l n GLN 134 N -2.21 0.37 -0.04 0.11 3.00 -1.26 -4.93 117.38 112.42 3k2l n GLN 134 Ca 0.01 0.02 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 3k2l n GLN 134 Cb 0.48 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.22 3k2l n GLN 134 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3k2l n GLY 135 N 1.12 0.98 3.91 1.08 0.00 -1.24 -5.03 105.19 106.01 3k2l n GLY 135 Ca 0.13 -0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 3k2l n GLY 135 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k2l s SER 136 N -2.00 6.41 0.16 1.61 0.01 -1.26 -3.06 113.70 115.57 3k2l s SER 136 Ca 0.00 0.41 -0.31 0.00 1.31 0.00 0.00 55.95 57.36 3k2l s SER 136 Cb 0.00 -2.01 -0.09 0.00 0.21 0.00 0.00 66.02 64.12 3k2l s SER 136 CO 0.00 0.08 1.47 -0.47 0.41 0.00 0.00 173.24 174.73 3k2l s TYR 137 N -1.64 3.14 -1.15 2.43 5.04 -1.26 -2.17 117.35 121.73 3k2l s TYR 137 Ca 0.38 0.84 -0.21 0.00 -2.44 0.00 0.00 57.07 55.64 3k2l s TYR 137 Cb -0.12 -3.80 0.04 0.00 0.35 0.00 0.00 41.96 38.43 3k2l s TYR 137 CO 0.27 -2.84 1.65 0.08 -1.34 0.00 0.00 175.55 173.37 3k2l s VAL 138 N 0.91 3.95 0.11 3.14 1.01 -0.33 -4.90 120.40 124.29 3k2l s VAL 138 Ca 0.66 -1.26 -0.33 0.00 0.00 0.00 0.00 61.98 61.05 3k2l s VAL 138 Cb -0.40 -5.01 -0.12 0.00 0.00 0.00 0.00 36.38 30.84 3k2l s VAL 138 CO 0.33 -1.84 1.75 0.00 0.00 0.00 0.00 175.10 175.34 3k2l n GLN 139 N 8.62 2.50 -3.94 2.72 0.00 -1.26 -4.98 117.38 121.03 3k2l n GLN 139 Ca 0.42 0.91 -0.35 0.00 0.00 0.00 0.00 57.00 57.98 3k2l n GLN 139 Cb 0.48 -2.75 -0.14 0.00 0.00 0.00 0.00 30.24 27.83 3k2l n GLN 139 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 3k2l s VAL 140 N 2.21 2.97 0.35 -0.39 1.01 -1.26 -5.10 120.40 120.19 3k2l s VAL 140 Ca 0.82 -1.06 -0.28 0.00 0.00 0.00 0.00 61.98 61.46 3k2l s VAL 140 Cb -0.58 -2.54 -0.11 0.00 0.00 0.00 0.00 36.38 33.15 3k2l s VAL 140 CO 0.39 0.14 1.45 -2.84 0.00 0.00 0.00 175.10 174.24 3k2l s PRO 141 N 1.32 4.18 0.00 2.72 0.02 -1.26 -2.29 135.00 139.70 3k2l s PRO 141 Ca -0.01 2.47 0.00 0.00 0.02 0.00 0.00 61.00 63.48 3k2l s PRO 141 Cb -0.17 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.34 3k2l s PRO 141 CO -0.03 -0.45 0.00 0.72 -0.33 0.00 0.00 177.00 176.91 3k2l n HIS 142 N 0.74 0.00 -2.33 6.54 8.25 0.68 -4.66 115.22 124.44 3k2l n HIS 142 Ca 0.01 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.23 3k2l n HIS 142 Cb 0.40 -0.96 0.06 0.00 1.12 0.00 0.00 29.99 30.61 3k2l n HIS 142 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3k2l s ASP 143 N -2.07 4.91 0.25 0.41 2.15 -0.97 -4.34 116.67 117.01 3k2l s ASP 143 Ca 0.00 0.30 -0.05 0.00 0.43 0.00 0.00 52.55 53.23 3k2l s ASP 143 Cb 0.00 -1.00 -0.05 0.00 -0.30 0.00 0.00 42.92 41.57 3k2l s ASP 143 CO 0.00 -1.49 0.51 -1.38 -0.17 0.00 0.00 175.17 172.63 3k2l s HIS 144 N -3.12 3.47 -0.16 -5.34 -3.43 -1.26 -2.39 115.29 103.05 3k2l s HIS 144 Ca 0.60 0.63 0.00 0.00 -0.80 0.00 0.00 55.06 55.49 3k2l s HIS 144 Cb -0.10 -2.08 0.00 0.00 -1.43 0.00 0.00 32.58 28.97 3k2l s HIS 144 CO 0.43 0.25 -0.16 0.08 -2.00 0.00 0.00 174.74 173.34 3k2l s VAL 145 N -1.95 2.51 -1.46 -5.38 1.01 0.83 -4.75 120.40 111.20 3k2l s VAL 145 Ca 0.43 -0.81 -0.08 0.00 0.00 0.00 0.00 61.98 61.52 3k2l s VAL 145 Cb -0.11 -2.06 0.03 0.00 0.00 0.00 0.00 36.38 34.24 3k2l s VAL 145 CO 0.28 0.52 0.87 0.00 0.00 0.00 0.00 175.10 176.77 3k2l n ALA 146 N 4.24 -1.16 -2.53 5.51 0.00 -1.26 -1.51 120.51 123.81 3k2l n ALA 146 Ca -0.20 0.30 -0.11 0.00 0.00 0.00 0.00 53.44 53.44 3k2l n ALA 146 Cb 0.51 -4.50 -0.00 0.00 0.00 0.00 0.00 19.45 15.46 3k2l n ALA 146 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3k2l n TYR 147 N -4.67 -1.56 0.00 0.00 4.01 -1.26 -4.65 117.16 109.02 3k2l n TYR 147 Ca -0.03 0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 3k2l n TYR 147 Cb 0.57 -2.41 0.00 0.00 -0.31 0.00 0.00 39.34 37.20 3k2l n TYR 147 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 3k2l n ARG 148 N -2.81 0.00 -3.74 -0.72 0.63 -0.70 -0.56 116.66 108.75 3k2l n ARG 148 Ca -0.11 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.46 3k2l n ARG 148 Cb 0.58 -0.01 -0.07 0.00 0.45 0.00 0.00 32.46 33.41 3k2l n ARG 148 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 3k2l s TYR 149 N -1.97 3.50 -0.24 -0.14 2.02 -0.57 -1.77 117.35 118.17 3k2l s TYR 149 Ca 0.00 0.47 -0.17 0.00 -0.37 0.00 0.00 57.07 56.99 3k2l s TYR 149 Cb 0.00 -2.12 -0.03 0.00 -0.40 0.00 0.00 41.96 39.41 3k2l s TYR 149 CO 0.00 0.45 0.48 -2.00 -1.57 0.00 0.00 175.55 172.91 3k2l s GLU 150 N -0.17 4.11 -0.08 -0.62 2.12 0.77 -0.12 118.70 124.71 3k2l s GLU 150 Ca 0.12 0.29 -0.29 0.00 0.36 0.00 0.00 54.97 55.45 3k2l s GLU 150 Cb -0.12 -3.61 -0.02 0.00 0.26 0.00 0.00 34.13 30.64 3k2l s GLU 150 CO 0.02 -0.24 0.97 0.08 -0.54 0.00 0.00 175.26 175.55 3k2l s VAL 151 N 1.93 4.82 -0.10 3.70 1.01 -1.01 -0.62 120.40 130.15 3k2l s VAL 151 Ca 0.21 1.99 -0.08 0.00 0.00 0.00 0.00 61.98 64.10 3k2l s VAL 151 Cb -0.15 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 31.89 3k2l s VAL 151 CO 0.09 0.06 -0.18 0.18 0.00 0.00 0.00 175.10 175.25 3k2l n LEU 152 N 4.69 1.22 -3.70 3.92 4.77 -0.59 -0.23 117.00 127.08 3k2l n LEU 152 Ca 0.07 0.20 -0.11 0.00 -0.03 0.00 0.00 56.01 56.14 3k2l n LEU 152 Cb 0.49 -0.47 -0.11 0.00 -2.33 0.00 0.00 43.42 41.00 3k2l n LEU 152 CO 0.51 -0.06 0.00 -0.54 -1.33 0.00 0.00 177.39 175.98 3k2l s LYS 153 N -2.34 0.33 0.25 3.23 1.02 -1.23 -4.70 119.74 116.30 3k2l s LYS 153 Ca -0.17 0.73 -0.30 0.00 0.02 0.00 0.00 55.97 56.25 3k2l s LYS 153 Cb 0.05 -0.03 -0.10 0.00 -0.52 0.00 0.00 37.83 37.23 3k2l s LYS 153 CO 0.23 -0.17 1.51 0.08 -0.92 0.00 0.00 175.35 176.08 3k2l s VAL 154 N 1.47 2.46 0.00 3.17 1.01 -1.26 -1.22 120.40 126.02 3k2l s VAL 154 Ca -0.09 0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.27 3k2l s VAL 154 Cb -0.09 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.05 3k2l s VAL 154 CO -0.12 0.06 0.00 2.30 0.00 0.00 0.00 175.10 177.34 3k2l n ILE 155 N 2.53 0.00 -3.60 2.22 -5.35 -0.07 -4.86 119.36 110.24 3k2l n ILE 155 Ca 0.08 -0.07 -0.18 0.00 -0.27 0.00 0.00 62.75 62.31 3k2l n ILE 155 Cb 0.39 0.53 -0.15 0.00 -1.74 0.00 0.00 39.64 38.68 3k2l n ILE 155 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3k2l s GLY 156 N -1.62 0.06 -0.08 3.28 0.00 -0.76 -4.98 107.32 103.23 3k2l s GLY 156 Ca 0.00 0.36 -0.01 0.00 0.00 0.00 0.00 44.72 45.08 3k2l s GLY 156 CO 0.00 1.87 -0.03 0.54 0.00 0.00 0.00 173.10 175.49 3k2l s LYS 157 N 2.29 2.89 0.00 2.90 3.01 -1.26 -0.28 119.74 129.28 3k2l s LYS 157 Ca 0.04 -0.46 0.00 0.00 -1.01 0.00 0.00 55.97 54.54 3k2l s LYS 157 Cb -0.14 -2.71 0.00 0.00 -1.01 0.00 0.00 37.83 33.97 3k2l s LYS 157 CO -0.09 0.69 0.00 0.41 0.51 0.00 0.00 175.35 176.87 3k2l n GLY 158 N 2.16 0.97 4.22 -3.33 0.00 -1.26 -5.01 105.19 102.95 3k2l n GLY 158 Ca -0.18 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.24 3k2l n GLY 158 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3k2l n PHE 160 N 0.00 0.00 0.00 1.61 -0.00 -1.26 -4.71 117.46 113.10 3k2l n PHE 160 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 3k2l n PHE 160 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.48 3k2l n PHE 160 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3k2l n GLY 161 N 0.00 -0.63 3.13 4.97 0.00 -1.26 -2.33 105.19 109.07 3k2l n GLY 161 Ca 0.00 0.22 -0.12 0.00 0.00 0.00 0.00 46.02 46.12 3k2l n GLY 161 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3k2l s GLN 162 N 0.00 0.44 -0.09 1.61 -0.44 -0.99 -4.66 119.66 115.54 3k2l s GLN 162 Ca 0.00 -0.10 0.04 0.00 -2.50 0.00 0.00 55.36 52.80 3k2l s GLN 162 Cb 0.00 0.19 -0.00 0.00 -1.64 0.00 0.00 33.01 31.56 3k2l s GLN 162 CO 0.00 -0.10 -0.23 0.08 0.50 0.00 0.00 175.29 175.54 3k2l s VAL 163 N -0.83 1.96 0.13 1.34 1.01 0.61 -0.38 120.40 124.24 3k2l s VAL 163 Ca -0.09 -0.97 0.08 0.00 0.00 0.00 0.00 61.98 61.00 3k2l s VAL 163 Cb -0.05 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 3k2l s VAL 163 CO 0.02 0.54 -0.20 0.68 0.00 0.00 0.00 175.10 176.14 3k2l s VAL 164 N 0.25 1.76 0.16 2.92 -7.23 0.97 -0.89 120.40 118.34 3k2l s VAL 164 Ca -0.15 -1.73 -0.30 0.00 -1.81 0.00 0.00 61.98 58.00 3k2l s VAL 164 Cb -0.17 -1.70 -0.07 0.00 0.56 0.00 0.00 36.38 35.00 3k2l s VAL 164 CO 0.07 -0.18 1.14 -0.75 -0.31 0.00 0.00 175.10 175.07 3k2l s LYS 165 N -2.34 4.54 0.00 4.82 2.20 -0.36 -0.51 119.74 128.09 3k2l s LYS 165 Ca 0.11 1.77 -0.04 0.00 -0.36 0.00 0.00 55.97 57.44 3k2l s LYS 165 Cb -0.08 -3.28 -0.00 0.00 -1.51 0.00 0.00 37.83 32.96 3k2l s LYS 165 CO 0.05 -0.02 0.08 0.00 -0.36 0.00 0.00 175.35 175.11 3k2l s ALA 166 N -0.01 -0.18 -0.27 3.13 0.00 -0.45 -1.54 121.76 122.44 3k2l s ALA 166 Ca 0.51 -0.20 -0.13 0.00 0.00 0.00 0.00 51.96 52.15 3k2l s ALA 166 Cb -0.30 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 22.85 3k2l s ALA 166 CO 0.35 -0.16 0.29 -0.47 0.00 0.00 0.00 175.76 175.76 3k2l s TYR 167 N -1.15 3.24 -0.65 0.00 5.04 0.21 -0.21 117.35 123.83 3k2l s TYR 167 Ca -0.12 0.28 -0.25 0.00 -2.44 0.00 0.00 57.07 54.53 3k2l s TYR 167 Cb -0.07 -2.48 0.04 0.00 0.35 0.00 0.00 41.96 39.81 3k2l s TYR 167 CO 0.01 -0.19 1.11 0.34 -1.34 0.00 0.00 175.55 175.47 3k2l s ASP 168 N 1.67 6.25 0.00 4.32 -1.08 -0.22 -0.17 116.67 127.44 3k2l s ASP 168 Ca 0.11 -0.50 0.21 0.00 -0.52 0.00 0.00 52.55 51.86 3k2l s ASP 168 Cb -0.16 -2.49 1.25 0.00 -1.46 0.00 0.00 42.92 40.06 3k2l s ASP 168 CO 0.10 -1.54 1.64 1.41 0.52 0.00 0.00 175.17 177.30 3k2l n HIS 169 N 8.36 0.00 -0.06 -5.34 8.25 -0.73 -0.40 115.22 125.29 3k2l n HIS 169 Ca 0.02 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.43 3k2l n HIS 169 Cb 0.48 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.56 3k2l n HIS 169 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 3k2l h LYS 170 N 0.00 0.00 -0.00 -0.41 3.64 -1.91 -3.41 116.57 114.48 3k2l h LYS 170 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3k2l h LYS 170 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 3k2l h LYS 170 CO 0.00 0.17 -0.40 0.28 -2.27 0.00 0.00 179.45 177.23 3k2l n VAL 171 N -4.69 0.00 -3.91 2.00 0.31 -1.19 -4.97 118.33 105.89 3k2l n VAL 171 Ca -0.05 -0.04 -0.30 0.00 -0.01 0.00 0.00 64.34 63.93 3k2l n VAL 171 Cb 0.17 0.25 0.02 0.00 -0.91 0.00 0.00 33.84 33.38 3k2l n VAL 171 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3k2l n HIS 172 N -1.24 -2.25 -4.39 3.52 8.25 0.46 -5.02 115.22 114.55 3k2l n HIS 172 Ca 0.08 0.88 -0.20 0.00 -0.26 0.00 0.00 57.72 58.22 3k2l n HIS 172 Cb 0.34 -3.87 -0.10 0.00 1.12 0.00 0.00 29.99 27.47 3k2l n HIS 172 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 3k2l s GLN 173 N -6.62 1.47 0.39 -0.41 -2.07 -1.22 -4.96 119.66 106.24 3k2l s GLN 173 Ca 0.66 -1.74 -0.17 0.00 -1.82 0.00 0.00 55.36 52.30 3k2l s GLN 173 Cb -0.34 -0.98 -0.09 0.00 -1.09 0.00 0.00 33.01 30.52 3k2l s GLN 173 CO 0.82 -0.00 0.84 -1.01 -1.32 0.00 0.00 175.29 174.62 3k2l s HIS 174 N -3.14 3.37 0.22 9.60 3.76 -1.26 -1.05 115.29 126.78 3k2l s HIS 174 Ca 0.29 1.36 -0.00 0.00 -0.15 0.00 0.00 55.06 56.56 3k2l s HIS 174 Cb 0.04 -2.66 -0.04 0.00 1.11 0.00 0.00 32.58 31.03 3k2l s HIS 174 CO 0.10 -0.05 0.14 0.14 -0.85 0.00 0.00 174.74 174.22 3k2l s VAL 175 N -2.17 0.05 -0.19 -0.90 -7.23 0.71 -4.50 120.40 106.17 3k2l s VAL 175 Ca 0.57 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 58.58 3k2l s VAL 175 Cb -0.10 -2.51 -0.04 0.00 0.56 0.00 0.00 36.38 34.29 3k2l s VAL 175 CO 0.19 0.00 0.39 0.00 -0.31 0.00 0.00 175.10 175.38 3k2l s ALA 176 N -4.06 3.55 -0.22 1.32 0.00 0.51 -1.34 121.76 121.52 3k2l s ALA 176 Ca 0.39 -0.48 -0.03 0.00 0.00 0.00 0.00 51.96 51.85 3k2l s ALA 176 Cb 0.07 -2.61 0.00 0.00 0.00 0.00 0.00 23.12 20.58 3k2l s ALA 176 CO 0.14 -0.22 -0.07 -1.17 0.00 0.00 0.00 175.76 174.44 3k2l s LEU 177 N 1.13 2.85 -0.14 0.00 2.96 0.33 0.45 118.68 126.25 3k2l s LEU 177 Ca 0.20 -0.54 -0.04 0.00 -0.22 0.00 0.00 54.13 53.53 3k2l s LEU 177 Cb -0.15 -1.68 -0.03 0.00 0.50 0.00 0.00 46.19 44.83 3k2l s LEU 177 CO 0.08 -0.04 -0.00 -0.75 -1.32 0.00 0.00 176.35 174.31 3k2l s LYS 178 N 1.42 3.55 -0.25 1.98 2.20 0.14 -0.02 119.74 128.76 3k2l s LYS 178 Ca 0.05 -0.44 -0.00 0.00 -0.36 0.00 0.00 55.97 55.21 3k2l s LYS 178 Cb -0.15 -2.95 0.07 0.00 -1.51 0.00 0.00 37.83 33.30 3k2l s LYS 178 CO -0.05 0.38 0.02 -1.64 -0.36 0.00 0.00 175.35 173.70 3k2l s MET 179 N 0.01 1.14 0.12 4.03 -1.94 0.49 -1.36 119.30 121.79 3k2l s MET 179 Ca 0.02 -0.94 -0.24 0.00 -1.71 0.00 0.00 55.69 52.82 3k2l s MET 179 Cb -0.13 -2.37 -0.07 0.00 2.01 0.00 0.00 34.83 34.27 3k2l s MET 179 CO 0.02 -0.73 0.73 0.08 -0.01 0.00 0.00 175.02 175.11 3k2l s VAL 180 N 1.53 4.53 0.50 -6.03 1.01 -0.61 -2.33 120.40 118.99 3k2l s VAL 180 Ca 0.01 1.58 -0.23 0.00 0.00 0.00 0.00 61.98 63.33 3k2l s VAL 180 Cb -0.18 -4.08 -0.07 0.00 0.00 0.00 0.00 36.38 32.05 3k2l s VAL 180 CO -0.12 0.49 1.39 -2.11 0.00 0.00 0.00 175.10 174.76 3k2l n ARG 181 N 1.92 1.97 -2.03 2.72 0.00 -0.98 -3.97 116.66 116.28 3k2l n ARG 181 Ca -0.06 0.71 -0.42 0.00 -0.00 0.00 0.00 57.85 58.08 3k2l n ARG 181 Cb 0.49 -2.60 -0.00 0.00 -0.00 0.00 0.00 32.46 30.36 3k2l n ARG 181 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 3k2l n ASN 182 N -0.59 5.26 -3.32 2.89 4.13 -1.17 -4.42 115.26 118.04 3k2l n ASN 182 Ca 0.08 -2.99 -0.11 0.00 1.68 0.00 0.00 54.58 53.24 3k2l n ASN 182 Cb 0.43 -1.53 0.01 0.00 -1.54 0.00 0.00 39.78 37.15 3k2l n ASN 182 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 3k2l n GLU 183 N 4.33 0.99 0.04 3.52 0.28 -1.26 -5.01 120.64 123.53 3k2l n GLU 183 Ca 0.49 -1.51 -0.20 0.00 -0.16 0.00 0.00 57.16 55.77 3k2l n GLU 183 Cb 0.35 0.05 -0.14 0.00 1.43 0.00 0.00 31.44 33.12 3k2l n GLU 183 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 177.13 178.54 3k2l h LYS 184 N 0.00 0.30 0.00 3.44 2.10 -2.02 -3.34 116.57 117.06 3k2l h LYS 184 Ca -0.14 -0.52 -0.09 0.00 -2.00 0.00 0.00 60.65 57.90 3k2l h LYS 184 Cb 0.58 0.19 -0.01 0.00 -0.90 0.00 0.00 32.23 32.09 3k2l h LYS 184 CO 0.22 1.20 -0.42 0.07 -2.00 0.00 0.00 179.45 178.51 3k2l h ARG 185 N 0.08 0.00 0.06 0.07 0.11 -1.97 -3.35 114.38 109.38 3k2l h ARG 185 Ca -0.35 0.00 -0.32 0.00 0.10 0.00 0.00 59.98 59.42 3k2l h ARG 185 Cb 2.06 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 33.11 3k2l h ARG 185 CO 0.14 0.42 -1.77 0.74 0.10 0.00 0.00 179.97 179.61 3k2l h PHE 186 N 0.00 0.23 -0.66 4.08 0.04 -1.85 -3.23 116.94 115.54 3k2l h PHE 186 Ca -0.00 -0.17 0.11 0.00 2.80 0.00 0.00 57.97 60.71 3k2l h PHE 186 Cb 0.87 -0.01 -0.08 0.00 2.20 0.00 0.00 35.95 38.92 3k2l h PHE 186 CO 0.00 1.33 0.24 0.45 -0.60 0.00 0.00 178.31 179.73 3k2l h HIS 187 N 0.03 0.41 -0.14 -0.55 3.86 -1.70 -1.84 115.15 115.22 3k2l h HIS 187 Ca -0.32 0.03 0.05 0.00 -1.16 0.00 0.00 60.37 58.97 3k2l h HIS 187 Cb 2.02 -0.08 -0.06 0.00 1.06 0.00 0.00 27.41 30.34 3k2l h HIS 187 CO 0.04 0.07 -0.24 0.00 0.86 0.00 0.00 177.93 178.66 3k2l h ARG 188 N 0.40 -0.29 0.07 2.45 -0.00 -1.68 -2.80 114.38 112.53 3k2l h ARG 188 Ca 0.35 0.02 -0.25 0.00 -0.50 0.00 0.00 59.98 59.60 3k2l h ARG 188 Cb 0.48 0.07 0.00 0.00 0.00 0.00 0.00 29.97 30.51 3k2l h ARG 188 CO -0.36 -0.19 -1.10 1.96 0.00 0.00 0.00 179.97 180.28 3k2l h GLN 189 N -0.30 0.30 -0.32 0.04 4.20 -1.51 -2.75 115.11 114.77 3k2l h GLN 189 Ca 0.11 -0.42 0.04 0.00 0.06 0.00 0.00 58.65 58.44 3k2l h GLN 189 Cb 0.46 0.14 -0.04 0.00 0.30 0.00 0.00 27.48 28.34 3k2l h GLN 189 CO -0.32 1.15 0.09 0.00 -0.67 0.00 0.00 178.83 179.08 3k2l h ALA 190 N 0.69 0.35 -0.79 3.87 0.00 -1.35 0.15 119.26 122.17 3k2l h ALA 190 Ca -0.10 0.05 0.15 0.00 0.00 0.00 0.00 54.91 55.00 3k2l h ALA 190 Cb 1.79 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 19.53 3k2l h ALA 190 CO 0.18 -0.32 0.35 0.00 0.00 0.00 0.00 179.25 179.46 3k2l h ALA 191 N 1.22 1.15 -0.37 0.00 0.00 -1.40 -0.32 119.26 119.55 3k2l h ALA 191 Ca 0.15 0.11 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 3k2l h ALA 191 Cb 0.14 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3k2l h ALA 191 CO -0.17 -0.18 -0.21 0.93 0.00 0.00 0.00 179.25 179.62 3k2l h GLU 192 N 0.50 0.71 -0.81 0.00 4.39 -0.93 -1.05 114.58 117.39 3k2l h GLU 192 Ca 0.44 -0.27 -0.02 0.00 0.34 0.00 0.00 59.36 59.84 3k2l h GLU 192 Cb 0.66 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.23 3k2l h GLU 192 CO -0.40 0.86 0.42 1.49 -1.16 0.00 0.00 179.01 180.22 3k2l h GLU 193 N 0.62 1.15 0.01 2.33 4.81 0.37 -0.89 114.58 122.97 3k2l h GLU 193 Ca 0.09 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3k2l h GLU 193 Cb 0.69 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.86 3k2l h GLU 193 CO 0.05 0.87 -0.00 0.82 -0.73 0.00 0.00 179.01 180.02 3k2l h ILE 194 N 1.14 1.19 -0.59 2.32 2.04 -0.77 -0.87 117.51 121.97 3k2l h ILE 194 Ca 0.28 -0.59 0.02 0.00 1.00 0.00 0.00 64.86 65.57 3k2l h ILE 194 Cb 0.08 1.59 -0.04 0.00 -0.74 0.00 0.00 36.82 37.71 3k2l h ILE 194 CO -0.04 0.15 0.37 0.03 0.00 0.00 0.00 178.15 178.66 3k2l h ARG 195 N -0.26 0.71 -0.36 2.37 3.08 -1.06 -0.30 114.38 118.56 3k2l h ARG 195 Ca -0.00 -0.04 -0.12 0.00 0.07 0.00 0.00 59.98 59.89 3k2l h ARG 195 Cb 0.26 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 3k2l h ARG 195 CO 0.00 0.47 -0.23 0.82 -1.07 0.00 0.00 179.97 179.97 3k2l h ILE 196 N 0.74 1.29 -0.45 2.04 2.04 -1.08 -0.70 117.51 121.38 3k2l h ILE 196 Ca 0.23 -1.37 -0.09 0.00 1.00 0.00 0.00 64.86 64.63 3k2l h ILE 196 Cb -0.01 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 3k2l h ILE 196 CO -0.09 0.45 -0.07 -0.07 0.00 0.00 0.00 178.15 178.38 3k2l h LEU 197 N 0.57 0.83 -0.54 1.44 3.38 -1.02 -0.80 115.31 119.17 3k2l h LEU 197 Ca 0.07 -0.34 0.10 0.00 0.09 0.00 0.00 57.88 57.80 3k2l h LEU 197 Cb 0.79 -0.23 -0.11 0.00 0.09 0.00 0.00 40.66 41.20 3k2l h LEU 197 CO 0.06 0.98 -0.28 -0.33 0.09 0.00 0.00 178.44 178.96 3k2l h GLU 198 N 0.67 -0.14 -0.45 1.13 4.39 -0.92 0.54 114.58 119.79 3k2l h GLU 198 Ca 0.12 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.79 3k2l h GLU 198 Cb 0.59 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.26 3k2l h GLU 198 CO 0.04 -0.09 0.12 1.25 -1.16 0.00 0.00 179.01 179.16 3k2l h HIS 199 N -0.15 0.74 -0.57 4.33 -0.00 -0.90 -2.89 115.15 115.72 3k2l h HIS 199 Ca 0.23 -0.09 -0.07 0.00 -0.00 0.00 0.00 60.37 60.45 3k2l h HIS 199 Cb 0.52 -0.21 -0.02 0.00 -0.00 0.00 0.00 27.41 27.70 3k2l h HIS 199 CO -0.57 0.68 0.09 -0.07 -0.00 0.00 0.00 177.93 178.06 3k2l h LEU 200 N 0.59 0.86 -0.35 0.26 3.38 -0.55 -3.29 115.31 116.21 3k2l h LEU 200 Ca 0.14 -0.19 -0.18 0.00 0.09 0.00 0.00 57.88 57.74 3k2l h LEU 200 Cb 0.31 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 3k2l h LEU 200 CO 0.00 0.88 -0.58 -0.09 0.09 0.00 0.00 178.44 178.73 3k2l h ARG 201 N 0.86 0.76 -0.42 1.13 2.43 -0.70 -0.75 114.38 117.69 3k2l h ARG 201 Ca 0.18 -0.50 0.12 0.00 -0.81 0.00 0.00 59.98 58.97 3k2l h ARG 201 Cb 0.39 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.99 3k2l h ARG 201 CO 0.01 1.12 0.72 0.87 -1.51 0.00 0.00 179.97 181.18 3k2l h LYS 202 N 0.57 0.00 -0.51 0.20 1.57 -1.61 0.71 116.57 117.51 3k2l h LYS 202 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3k2l h LYS 202 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 3k2l h LYS 202 CO 0.12 0.00 0.00 1.04 -0.57 0.00 0.00 179.45 180.04 3k2l n GLN 203 N -3.19 3.37 -2.65 3.15 6.02 -0.30 -4.58 117.38 119.19 3k2l n GLN 203 Ca 0.08 -2.69 -0.13 0.00 -0.01 0.00 0.00 57.00 54.25 3k2l n GLN 203 Cb 0.87 -1.74 0.02 0.00 1.02 0.00 0.00 30.24 30.42 3k2l n GLN 203 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 3k2l n ASP 204 N 0.68 2.05 -0.07 1.08 2.03 0.25 -4.91 116.55 117.66 3k2l n ASP 204 Ca 0.22 -2.92 -0.09 0.00 0.52 0.00 0.00 54.79 52.52 3k2l n ASP 204 Cb 0.78 -0.52 0.07 0.00 -0.72 0.00 0.00 41.12 40.73 3k2l n ASP 204 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 3k2l h LYS 205 N 2.92 0.75 -0.50 -0.67 5.09 -1.81 -2.99 116.57 119.36 3k2l h LYS 205 Ca -0.01 -0.35 0.00 0.00 0.09 0.00 0.00 60.65 60.38 3k2l h LYS 205 Cb 1.12 -0.01 0.00 0.00 0.10 0.00 0.00 32.23 33.44 3k2l h LYS 205 CO 0.57 0.96 0.00 -0.40 -2.09 0.00 0.00 179.45 178.49 3k2l n ASP 206 N -4.07 2.68 -3.27 7.07 5.68 -1.26 -4.97 116.55 118.41 3k2l n ASP 206 Ca -0.01 -2.01 -0.23 0.00 -0.50 0.00 0.00 54.79 52.03 3k2l n ASP 206 Cb 0.49 -0.34 0.02 0.00 -1.14 0.00 0.00 41.12 40.15 3k2l n ASP 206 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 3k2l n ASN 207 N 0.93 -4.95 -0.67 -1.12 5.15 -1.13 -4.85 115.26 108.63 3k2l n ASN 207 Ca 0.17 -0.38 0.08 0.00 -0.60 0.00 0.00 54.58 53.85 3k2l n ASN 207 Cb 0.43 -4.03 0.07 0.00 -0.53 0.00 0.00 39.78 35.73 3k2l n ASN 207 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 3k2l n THR 208 N -4.29 0.03 0.18 -0.44 -2.24 -1.26 -4.34 114.28 101.93 3k2l n THR 208 Ca -0.05 -0.52 0.06 0.00 -2.27 0.00 0.00 64.05 61.27 3k2l n THR 208 Cb 0.58 1.31 0.26 0.00 -2.10 0.00 0.00 70.33 70.38 3k2l n THR 208 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 3k2l h MET 209 N 3.23 0.00 -3.59 -0.78 1.85 -1.89 -3.46 114.93 110.28 3k2l h MET 209 Ca 0.00 0.00 -0.19 0.00 -0.61 0.00 0.00 59.70 58.90 3k2l h MET 209 Cb 0.69 0.00 0.08 0.00 0.43 0.00 0.00 31.60 32.80 3k2l h MET 209 CO 0.00 0.35 -0.36 0.09 -0.40 0.00 0.00 176.91 176.59 3k2l n ASN 210 N -3.34 -3.35 -4.13 1.39 3.02 -1.26 -2.13 115.26 105.45 3k2l n ASN 210 Ca 0.01 -0.29 -0.28 0.00 -0.03 0.00 0.00 54.58 53.99 3k2l n ASN 210 Cb 0.57 -2.80 -0.17 0.00 -0.61 0.00 0.00 39.78 36.77 3k2l n ASN 210 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3k2l s VAL 211 N -3.17 1.58 0.34 2.41 1.01 -1.26 -1.43 120.40 119.87 3k2l s VAL 211 Ca 0.18 -0.75 -0.27 0.00 0.00 0.00 0.00 61.98 61.14 3k2l s VAL 211 Cb -0.08 -1.39 -0.13 0.00 0.00 0.00 0.00 36.38 34.79 3k2l s VAL 211 CO 0.37 0.45 1.02 0.00 0.00 0.00 0.00 175.10 176.94 3k2l n ILE 212 N 3.55 2.11 -3.56 2.22 0.13 -0.81 -4.92 119.36 118.07 3k2l n ILE 212 Ca -0.20 -0.50 -0.38 0.00 -1.10 0.00 0.00 62.75 60.56 3k2l n ILE 212 Cb 0.52 -1.08 -0.11 0.00 -0.84 0.00 0.00 39.64 38.13 3k2l n ILE 212 CO 0.00 0.00 0.00 -1.00 2.80 0.00 0.00 176.55 178.35 3k2l s HIS 213 N -1.14 3.22 0.23 9.51 3.76 -1.26 -5.05 115.29 124.56 3k2l s HIS 213 Ca 0.60 0.15 -0.30 0.00 -0.15 0.00 0.00 55.06 55.36 3k2l s HIS 213 Cb -0.64 -2.41 -0.09 0.00 1.11 0.00 0.00 32.58 30.56 3k2l s HIS 213 CO 0.59 -0.17 1.16 1.41 -0.85 0.00 0.00 174.74 176.89 3k2l s MET 214 N 1.80 4.54 -0.23 1.40 1.75 -1.26 -2.77 119.30 124.53 3k2l s MET 214 Ca 0.08 1.87 -0.15 0.00 -1.25 0.00 0.00 55.69 56.24 3k2l s MET 214 Cb -0.16 -3.21 -0.09 0.00 2.84 0.00 0.00 34.83 34.21 3k2l s MET 214 CO 0.11 0.02 -0.34 1.28 -0.65 0.00 0.00 175.02 175.44 3k2l n LEU 215 N 1.90 1.89 -4.12 4.11 4.77 0.78 -4.95 117.00 121.38 3k2l n LEU 215 Ca 0.02 0.32 -0.08 0.00 -0.03 0.00 0.00 56.01 56.24 3k2l n LEU 215 Cb 0.45 -0.76 -0.10 0.00 -2.33 0.00 0.00 43.42 40.67 3k2l n LEU 215 CO 0.55 0.22 -0.36 -1.61 -1.33 0.00 0.00 177.39 174.87 3k2l s GLU 216 N -2.64 0.72 0.03 3.23 0.41 -1.23 -4.99 118.70 114.23 3k2l s GLU 216 Ca -0.34 -1.28 -0.02 0.00 -0.41 0.00 0.00 54.97 52.92 3k2l s GLU 216 Cb 0.10 0.11 -0.02 0.00 -1.78 0.00 0.00 34.13 32.54 3k2l s GLU 216 CO 0.45 -0.11 0.02 0.54 -0.49 0.00 0.00 175.26 175.66 3k2l s ASN 217 N -2.97 0.27 0.10 -0.19 2.20 -1.26 -1.17 114.94 111.92 3k2l s ASN 217 Ca 0.11 -0.62 -0.25 0.00 -0.94 0.00 0.00 52.86 51.16 3k2l s ASN 217 Cb 0.07 0.17 0.09 0.00 -2.00 0.00 0.00 41.25 39.58 3k2l s ASN 217 CO -0.07 -0.44 1.13 0.72 -2.94 0.00 0.00 177.10 175.50 3k2l s PHE 218 N -2.41 0.03 0.15 1.54 -0.71 -0.73 -5.00 117.98 110.85 3k2l s PHE 218 Ca -0.07 -0.31 0.09 0.00 -1.04 0.00 0.00 56.93 55.60 3k2l s PHE 218 Cb -0.03 0.64 -0.04 0.00 -1.21 0.00 0.00 43.02 42.38 3k2l s PHE 218 CO -0.04 -0.66 -0.17 0.95 -1.34 0.00 0.00 175.22 173.96 3k2l s THR 219 N -2.22 2.85 -0.21 -4.49 -4.23 -1.26 -0.26 115.64 105.82 3k2l s THR 219 Ca 0.23 -1.66 -0.08 0.00 -1.18 0.00 0.00 61.69 59.00 3k2l s THR 219 Cb -0.01 -2.35 0.09 0.00 1.34 0.00 0.00 72.50 71.57 3k2l s THR 219 CO 0.02 -0.01 0.46 0.12 -0.54 0.00 0.00 174.62 174.67 3k2l s PHE 220 N -1.43 -0.85 -1.21 3.99 5.99 -0.34 -4.91 117.98 119.22 3k2l s PHE 220 Ca 0.21 1.62 -0.18 0.00 0.00 0.00 0.00 56.93 58.57 3k2l s PHE 220 Cb -0.09 0.37 0.00 0.00 0.00 0.00 0.00 43.02 43.30 3k2l s PHE 220 CO 0.12 -0.49 0.69 0.54 -0.00 0.00 0.00 175.22 176.08 3k2l n ARG 221 N 5.22 -1.54 -3.40 10.12 1.74 -1.26 -1.32 116.66 126.23 3k2l n ARG 221 Ca -0.11 0.39 -0.23 0.00 -0.77 0.00 0.00 57.85 57.13 3k2l n ARG 221 Cb 0.50 -3.97 -0.02 0.00 -1.02 0.00 0.00 32.46 27.95 3k2l n ARG 221 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3k2l n ASN 222 N -2.67 -3.05 -4.25 0.55 0.23 -1.26 -4.97 115.26 99.84 3k2l n ASN 222 Ca -0.14 -0.38 -0.30 0.00 -0.53 0.00 0.00 54.58 53.22 3k2l n ASN 222 Cb 0.61 -2.56 -0.16 0.00 -2.08 0.00 0.00 39.78 35.58 3k2l n ASN 222 CO 0.00 0.00 0.00 -1.00 -0.93 0.00 0.00 177.26 175.33 3k2l s HIS 223 N -2.84 2.24 0.31 -2.53 4.02 -0.44 -4.51 115.29 111.55 3k2l s HIS 223 Ca 0.40 -0.58 -0.28 0.00 1.02 0.00 0.00 55.06 55.62 3k2l s HIS 223 Cb -0.22 -1.47 -0.09 0.00 -1.02 0.00 0.00 32.58 29.78 3k2l s HIS 223 CO 0.49 -0.15 1.11 0.42 1.02 0.00 0.00 174.74 177.64 3k2l s ILE 224 N -0.28 3.42 -0.04 0.60 1.01 -1.25 -1.20 121.20 123.45 3k2l s ILE 224 Ca 0.01 1.37 0.02 0.00 0.00 0.00 0.00 60.65 62.05 3k2l s ILE 224 Cb -0.12 -3.84 0.01 0.00 0.01 0.00 0.00 42.46 38.52 3k2l s ILE 224 CO 0.02 0.28 -0.08 0.00 0.00 0.00 0.00 174.94 175.15 3k2l s MET 226 N 0.46 1.61 -0.04 0.00 1.00 -0.46 -1.78 119.30 120.10 3k2l s MET 226 Ca -0.08 -0.58 -0.02 0.00 0.00 0.00 0.00 55.69 55.02 3k2l s MET 226 Cb -0.11 -1.44 -0.04 0.00 0.00 0.00 0.00 34.83 33.24 3k2l s MET 226 CO 0.01 0.26 0.09 0.95 0.00 0.00 0.00 175.02 176.33 3k2l s THR 227 N -0.05 4.86 0.11 2.05 -4.23 -0.32 0.25 115.64 118.32 3k2l s THR 227 Ca -0.01 -0.26 0.03 0.00 -1.18 0.00 0.00 61.69 60.27 3k2l s THR 227 Cb -0.10 -3.18 -0.04 0.00 1.34 0.00 0.00 72.50 70.52 3k2l s THR 227 CO 0.01 0.43 -0.09 -0.36 -0.54 0.00 0.00 174.62 174.08 3k2l s PHE 228 N -1.13 1.02 0.45 3.99 0.08 0.17 -0.16 117.98 122.40 3k2l s PHE 228 Ca 0.21 -0.78 -0.23 0.00 0.12 0.00 0.00 56.93 56.25 3k2l s PHE 228 Cb -0.12 -0.56 -0.10 0.00 -0.57 0.00 0.00 43.02 41.68 3k2l s PHE 228 CO 0.11 -0.05 1.00 -0.85 -0.10 0.00 0.00 175.22 175.34 3k2l n GLU 229 N 0.18 1.29 -3.31 0.44 0.28 -1.11 -0.36 120.64 118.05 3k2l n GLU 229 Ca -0.13 0.47 -0.39 0.00 -0.16 0.00 0.00 57.16 56.94 3k2l n GLU 229 Cb 0.59 -2.07 -0.08 0.00 1.43 0.00 0.00 31.44 31.31 3k2l n GLU 229 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 3k2l s LEU 230 N -0.78 4.05 0.00 -1.84 2.96 -1.26 -4.32 118.68 117.49 3k2l s LEU 230 Ca 0.65 0.42 0.00 0.00 -0.22 0.00 0.00 54.13 54.98 3k2l s LEU 230 Cb -0.53 -2.55 0.00 0.00 0.50 0.00 0.00 46.19 43.61 3k2l s LEU 230 CO 0.55 -0.23 0.00 0.18 -1.32 0.00 0.00 176.35 175.53 3k2l n LEU 231 N 5.38 0.00 0.00 -0.68 4.77 -1.26 -5.01 117.00 120.20 3k2l n LEU 231 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 3k2l n LEU 231 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 3k2l n LEU 231 CO 0.39 -0.09 0.00 -0.24 -1.33 0.00 0.00 177.39 176.12 3k2l n SER 232 N -0.70 0.22 -4.77 -1.43 2.88 -0.18 -4.98 113.62 104.65 3k2l n SER 232 Ca 0.00 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.20 3k2l n SER 232 Cb 0.00 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 63.49 3k2l n SER 232 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3k2l s MET 233 N 2.79 3.06 0.75 -1.46 0.23 -1.26 -4.39 119.30 119.02 3k2l s MET 233 Ca 0.00 1.57 -0.10 0.00 -1.03 0.00 0.00 55.69 56.13 3k2l s MET 233 Cb 0.00 -1.97 0.06 0.00 -1.53 0.00 0.00 34.83 31.39 3k2l s MET 233 CO 0.00 -1.08 1.10 0.54 -2.03 0.00 0.00 175.02 173.55 3k2l s ASN 234 N -2.03 4.77 0.37 -1.18 2.20 -1.26 -1.07 114.94 116.74 3k2l s ASN 234 Ca 0.72 0.72 0.17 0.00 -0.94 0.00 0.00 52.86 53.53 3k2l s ASN 234 Cb -0.24 -1.33 0.71 0.00 -2.00 0.00 0.00 41.25 38.39 3k2l s ASN 234 CO 0.33 -1.70 1.76 -0.07 -2.94 0.00 0.00 177.10 174.49 3k2l h LEU 235 N -0.82 0.00 -0.63 3.54 3.38 -0.72 -1.59 115.31 118.48 3k2l h LEU 235 Ca -0.45 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.41 3k2l h LEU 235 Cb 1.31 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.05 3k2l h LEU 235 CO 0.64 0.39 -0.13 0.22 0.09 0.00 0.00 178.44 179.65 3k2l h TYR 236 N 0.00 1.06 -0.23 1.13 3.20 -1.86 -1.12 116.97 119.16 3k2l h TYR 236 Ca -0.00 -0.22 -0.04 0.00 3.14 0.00 0.00 58.73 61.61 3k2l h TYR 236 Cb 0.83 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.83 3k2l h TYR 236 CO 0.00 1.01 -0.02 0.93 -1.64 0.00 0.00 178.16 178.44 3k2l h GLU 237 N 0.84 0.34 -0.38 1.82 4.39 -1.67 -1.55 114.58 118.37 3k2l h GLU 237 Ca 0.13 -0.06 -0.06 0.00 0.34 0.00 0.00 59.36 59.71 3k2l h GLU 237 Cb 0.67 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.25 3k2l h GLU 237 CO 0.05 0.39 0.01 1.25 -1.16 0.00 0.00 179.01 179.55 3k2l h LEU 238 N 0.33 0.66 -1.23 1.33 5.85 -0.76 0.12 115.31 121.61 3k2l h LEU 238 Ca 0.08 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.49 3k2l h LEU 238 Cb 0.26 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 3k2l h LEU 238 CO 0.01 0.80 0.46 0.40 -0.34 0.00 0.00 178.44 179.76 3k2l h ILE 239 N 0.50 1.20 -0.02 4.05 2.04 -0.79 -1.43 117.51 123.06 3k2l h ILE 239 Ca 0.11 -0.40 -0.21 0.00 1.00 0.00 0.00 64.86 65.36 3k2l h ILE 239 Cb 0.46 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.68 3k2l h ILE 239 CO 0.02 0.20 -0.87 0.50 0.00 0.00 0.00 178.15 178.00 3k2l h LYS 240 N 1.00 0.33 -0.02 2.37 3.64 -0.91 -1.21 116.57 121.76 3k2l h LYS 240 Ca 0.26 -0.34 -0.08 0.00 -1.27 0.00 0.00 60.65 59.23 3k2l h LYS 240 Cb -0.07 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 3k2l h LYS 240 CO -0.05 1.02 -0.37 -0.22 -2.27 0.00 0.00 179.45 177.55 3k2l h LYS 241 N 0.20 0.05 -0.47 1.90 1.63 -0.12 -0.07 116.57 119.68 3k2l h LYS 241 Ca -0.06 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 3k2l h LYS 241 Cb 1.48 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.11 3k2l h LYS 241 CO 0.14 0.42 0.00 -1.71 -3.45 0.00 0.00 179.45 174.85 3k2l n ASN 242 N -4.09 1.72 -3.06 4.20 5.15 -0.60 -4.91 115.26 113.68 3k2l n ASN 242 Ca -0.02 -2.11 -0.23 0.00 -0.60 0.00 0.00 54.58 51.63 3k2l n ASN 242 Cb 0.42 -0.31 0.03 0.00 -0.53 0.00 0.00 39.78 39.39 3k2l n ASN 242 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3k2l n LYS 243 N 0.19 -4.89 -2.26 1.20 5.02 -0.04 -2.18 118.16 115.20 3k2l n LYS 243 Ca 0.08 0.88 -0.19 0.00 -2.02 0.00 0.00 58.31 57.06 3k2l n LYS 243 Cb 0.33 -5.74 -0.02 0.00 -0.02 0.00 0.00 35.03 29.57 3k2l n LYS 243 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3k2l n PHE 244 N -4.50 -0.90 1.16 2.13 3.72 -0.47 -4.88 117.46 113.73 3k2l n PHE 244 Ca -0.10 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.43 3k2l n PHE 244 Cb 0.61 -3.70 0.44 0.00 -0.94 0.00 0.00 39.48 35.90 3k2l n PHE 244 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3k2l n GLN 245 N -2.86 0.35 0.00 -1.08 6.02 -0.93 -4.48 117.38 114.40 3k2l n GLN 245 Ca -0.23 -0.16 0.00 0.00 -0.01 0.00 0.00 57.00 56.61 3k2l n GLN 245 Cb 0.67 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.43 3k2l n GLN 245 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3k2l n GLY 246 N 1.41 1.35 3.70 1.08 0.00 -1.26 -4.85 105.19 106.62 3k2l n GLY 246 Ca 0.10 -1.80 -0.34 0.00 0.00 0.00 0.00 46.02 43.97 3k2l n GLY 246 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3k2l s PHE 247 N -2.94 3.15 0.74 1.61 0.08 -0.16 -4.98 117.98 115.47 3k2l s PHE 247 Ca 0.00 0.16 -0.15 0.00 0.12 0.00 0.00 56.93 57.05 3k2l s PHE 247 Cb 0.00 -1.74 0.03 0.00 -0.57 0.00 0.00 43.02 40.75 3k2l s PHE 247 CO 0.00 0.48 1.17 -1.13 -0.10 0.00 0.00 175.22 175.64 3k2l n SER 248 N 1.72 1.20 -0.30 1.36 3.41 -1.26 -4.38 113.62 115.37 3k2l n SER 248 Ca -0.16 0.68 -0.05 0.00 -0.26 0.00 0.00 58.87 59.08 3k2l n SER 248 Cb 0.53 -1.50 0.07 0.00 -0.26 0.00 0.00 64.21 63.06 3k2l n SER 248 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3k2l h LEU 249 N -0.30 1.05 -1.88 1.04 5.85 -1.97 -1.60 115.31 117.50 3k2l h LEU 249 Ca -0.48 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.11 3k2l h LEU 249 Cb 1.32 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 42.08 3k2l h LEU 249 CO 0.48 0.87 -0.10 -0.65 -0.34 0.00 0.00 178.44 178.70 3k2l h PRO 250 N 1.16 0.00 -0.26 5.25 0.11 -1.98 0.88 132.00 137.15 3k2l h PRO 250 Ca 0.29 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 66.20 3k2l h PRO 250 Cb 0.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.18 3k2l h PRO 250 CO -0.04 0.10 -0.60 1.25 -0.21 0.00 0.00 178.00 178.50 3k2l h LEU 251 N 0.00 0.98 -0.61 2.35 5.85 -1.73 -0.68 115.31 121.47 3k2l h LEU 251 Ca -0.00 -0.55 -0.02 0.00 0.84 0.00 0.00 57.88 58.15 3k2l h LEU 251 Cb 0.18 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 3k2l h LEU 251 CO 0.01 1.35 0.31 0.58 -0.34 0.00 0.00 178.44 180.35 3k2l h VAL 252 N 0.65 1.21 -0.48 1.05 2.07 -0.39 0.10 116.25 120.46 3k2l h VAL 252 Ca -0.00 -0.56 0.04 0.00 0.82 0.00 0.00 66.70 67.00 3k2l h VAL 252 Cb 1.21 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 3k2l h VAL 252 CO 0.13 0.23 0.23 -0.09 0.02 0.00 0.00 177.57 178.10 3k2l h ARG 253 N 0.82 0.45 -0.50 1.57 2.43 0.91 0.57 114.38 120.63 3k2l h ARG 253 Ca 0.21 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.31 3k2l h ARG 253 Cb 0.09 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 3k2l h ARG 253 CO -0.03 0.30 0.15 -0.22 -1.51 0.00 0.00 179.97 178.66 3k2l h LYS 254 N 0.46 0.79 -0.46 0.20 1.63 -0.57 -1.96 116.57 116.65 3k2l h LYS 254 Ca 0.21 -0.17 -0.03 0.00 -0.85 0.00 0.00 60.65 59.81 3k2l h LYS 254 Cb 0.13 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.63 3k2l h LYS 254 CO -0.16 0.74 0.18 0.74 -3.45 0.00 0.00 179.45 177.50 3k2l h PHE 255 N 0.68 0.71 -0.15 1.91 0.04 -0.46 -2.70 116.94 116.98 3k2l h PHE 255 Ca 0.16 -0.06 0.05 0.00 2.80 0.00 0.00 57.97 60.92 3k2l h PHE 255 Cb 0.29 -0.21 -0.07 0.00 2.20 0.00 0.00 35.95 38.16 3k2l h PHE 255 CO 0.02 0.61 -0.35 0.00 -0.60 0.00 0.00 178.31 177.99 3k2l h ALA 256 N 1.02 -0.43 -0.60 2.45 0.00 -0.54 -0.93 119.26 120.24 3k2l h ALA 256 Ca 0.15 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.17 3k2l h ALA 256 Cb 0.21 0.67 -0.07 0.00 0.00 0.00 0.00 17.79 18.60 3k2l h ALA 256 CO -0.01 -0.83 0.21 1.25 0.00 0.00 0.00 179.25 179.86 3k2l h HIS 257 N -0.42 0.36 0.03 0.00 -0.00 -1.35 0.47 115.15 114.24 3k2l h HIS 257 Ca 0.09 0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.49 3k2l h HIS 257 Cb 0.57 -0.07 0.00 0.00 -0.00 0.00 0.00 27.41 27.91 3k2l h HIS 257 CO -0.44 0.08 -0.01 0.77 -0.00 0.00 0.00 177.93 178.33 3k2l h SER 258 N 0.38 -0.03 -0.55 3.26 0.02 -1.13 -2.69 113.55 112.82 3k2l h SER 258 Ca 0.30 -0.11 0.01 0.00 -0.84 0.00 0.00 61.79 61.15 3k2l h SER 258 Cb 0.38 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.90 3k2l h SER 258 CO -0.31 0.09 0.36 0.40 -1.14 0.00 0.00 176.83 176.23 3k2l h ILE 259 N -0.15 1.13 -0.05 3.27 2.04 -0.78 -1.03 117.51 121.93 3k2l h ILE 259 Ca -0.00 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.62 3k2l h ILE 259 Cb 0.14 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 36.56 3k2l h ILE 259 CO 0.01 0.13 0.05 -0.07 0.00 0.00 0.00 178.15 178.27 3k2l h LEU 260 N 0.73 0.00 -1.08 1.44 3.38 -0.85 -0.94 115.31 118.00 3k2l h LEU 260 Ca 0.20 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.23 3k2l h LEU 260 Cb -0.08 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.61 3k2l h LEU 260 CO -0.05 0.00 0.62 1.56 0.09 0.00 0.00 178.44 180.66 3k2l h GLN 261 N 0.00 1.09 0.60 1.13 1.08 -0.83 0.26 115.11 118.44 3k2l h GLN 261 Ca 0.03 -0.07 -0.03 0.00 -1.45 0.00 0.00 58.65 57.13 3k2l h GLN 261 Cb 0.12 -0.25 0.01 0.00 -0.05 0.00 0.00 27.48 27.31 3k2l h GLN 261 CO -0.00 0.72 -0.29 0.00 -0.95 0.00 0.00 178.83 178.31 3k2l h LEU 263 N -1.03 0.89 -1.25 0.00 3.38 -0.94 -0.58 115.31 115.78 3k2l h LEU 263 Ca -0.08 -0.09 0.19 0.00 0.09 0.00 0.00 57.88 57.99 3k2l h LEU 263 Cb 0.67 -0.23 -0.09 0.00 0.09 0.00 0.00 40.66 41.11 3k2l h LEU 263 CO 0.14 0.72 0.61 -0.78 0.09 0.00 0.00 178.44 179.22 3k2l h ASP 264 N 0.98 0.62 0.76 -0.43 3.58 -0.59 0.01 116.42 121.36 3k2l h ASP 264 Ca 0.25 0.07 -0.25 0.00 0.42 0.00 0.00 57.03 57.52 3k2l h ASP 264 Cb 0.03 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.02 3k2l h ASP 264 CO -0.04 0.25 -1.18 0.00 -2.88 0.00 0.00 179.24 175.39 3k2l h ALA 265 N 1.62 0.22 -0.46 -0.78 0.00 -1.13 -1.90 119.26 116.82 3k2l h ALA 265 Ca 0.52 -0.92 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 3k2l h ALA 265 Cb 0.99 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 3k2l h ALA 265 CO -0.27 1.10 0.06 -0.07 0.00 0.00 0.00 179.25 180.08 3k2l h LEU 266 N 0.04 0.68 -0.04 0.00 3.38 -0.39 -2.55 115.31 116.43 3k2l h LEU 266 Ca -0.10 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 3k2l h LEU 266 Cb 1.90 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.47 3k2l h LEU 266 CO 0.17 0.70 -0.08 -0.74 0.09 0.00 0.00 178.44 178.59 3k2l h HIS 267 N 0.69 0.16 -0.18 1.13 2.76 -0.81 0.35 115.15 119.25 3k2l h HIS 267 Ca 0.15 -0.06 0.05 0.00 -2.20 0.00 0.00 60.37 58.31 3k2l h HIS 267 Cb 0.33 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.25 3k2l h HIS 267 CO 0.02 0.66 0.20 0.87 -1.30 0.00 0.00 177.93 178.38 3k2l h LYS 268 N -0.38 0.00 -0.04 5.26 6.56 -1.34 -1.62 116.57 125.01 3k2l h LYS 268 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 3k2l h LYS 268 Cb 0.65 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.31 3k2l h LYS 268 CO 0.02 0.00 0.00 0.09 -2.06 0.00 0.00 179.45 177.50 3k2l n ASN 269 N -3.80 2.92 -3.32 0.86 3.02 -0.74 -4.98 115.26 109.23 3k2l n ASN 269 Ca 0.02 -1.97 -0.16 0.00 -0.03 0.00 0.00 54.58 52.44 3k2l n ASN 269 Cb 0.32 -0.01 0.08 0.00 -0.61 0.00 0.00 39.78 39.56 3k2l n ASN 269 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3k2l n ARG 270 N 1.28 -3.65 -4.59 3.52 5.12 0.37 -4.97 116.66 113.74 3k2l n ARG 270 Ca 0.14 0.86 -0.24 0.00 -1.93 0.00 0.00 57.85 56.69 3k2l n ARG 270 Cb 0.59 -5.82 -0.16 0.00 -1.16 0.00 0.00 32.46 25.90 3k2l n ARG 270 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3k2l s ILE 271 N -3.38 1.10 -0.14 0.55 1.01 0.95 -2.74 121.20 118.55 3k2l s ILE 271 Ca 0.31 -0.51 -0.06 0.00 0.00 0.00 0.00 60.65 60.40 3k2l s ILE 271 Cb -0.04 -0.98 -0.04 0.00 0.01 0.00 0.00 42.46 41.41 3k2l s ILE 271 CO 0.74 0.33 0.05 -0.63 0.00 0.00 0.00 174.94 175.44 3k2l s ILE 272 N 0.33 4.74 -0.12 2.92 1.01 -0.46 -4.41 121.20 125.21 3k2l s ILE 272 Ca -0.07 -0.07 -0.27 0.00 0.00 0.00 0.00 60.65 60.24 3k2l s ILE 272 Cb -0.12 -3.08 -0.27 0.00 0.01 0.00 0.00 42.46 38.99 3k2l s ILE 272 CO 0.02 0.53 0.78 -0.74 0.00 0.00 0.00 174.94 175.54 3k2l h HIS 273 N 5.97 0.15 0.00 3.97 -0.00 -1.90 -2.23 115.15 121.10 3k2l h HIS 273 Ca -0.44 -0.11 0.00 0.00 -0.00 0.00 0.00 60.37 59.83 3k2l h HIS 273 Cb 1.19 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 28.59 3k2l h HIS 273 CO 0.61 1.10 0.00 0.00 -0.00 0.00 0.00 177.93 179.64 3k2l n ASP 275 N 0.00 0.48 -4.68 0.00 2.03 -1.26 -2.27 116.55 110.85 3k2l n ASP 275 Ca 0.00 -2.09 -0.42 0.00 0.52 0.00 0.00 54.79 52.80 3k2l n ASP 275 Cb 0.00 -0.06 -0.03 0.00 -0.72 0.00 0.00 41.12 40.31 3k2l n ASP 275 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 3k2l s LEU 276 N -3.85 4.31 0.18 -2.67 2.96 -1.26 -4.76 118.68 113.59 3k2l s LEU 276 Ca 0.21 2.16 -0.23 0.00 -0.22 0.00 0.00 54.13 56.04 3k2l s LEU 276 Cb 0.36 -3.55 0.05 0.00 0.50 0.00 0.00 46.19 43.56 3k2l s LEU 276 CO -0.07 -0.80 0.75 -1.59 -1.32 0.00 0.00 176.35 173.31 3k2l s LYS 277 N 2.92 1.40 0.28 1.98 -2.85 -1.26 -4.85 119.74 117.36 3k2l s LYS 277 Ca 0.67 -0.68 0.02 0.00 -1.00 0.00 0.00 55.97 54.98 3k2l s LYS 277 Cb -0.32 0.54 0.63 0.00 -2.06 0.00 0.00 37.83 36.61 3k2l s LYS 277 CO 0.27 -0.63 1.76 -1.35 0.10 0.00 0.00 175.35 175.50 3k2l h PRO 278 N 2.00 0.62 -0.11 1.78 0.11 -1.93 0.47 132.00 134.93 3k2l h PRO 278 Ca -0.25 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.86 3k2l h PRO 278 Cb 1.26 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3k2l h PRO 278 CO 0.29 0.41 0.13 0.93 -0.21 0.00 0.00 178.00 179.55 3k2l h GLU 279 N 0.64 0.00 -0.62 1.05 3.07 -1.93 -1.60 114.58 115.19 3k2l h GLU 279 Ca 0.51 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 59.35 3k2l h GLU 279 Cb 0.79 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.68 3k2l h GLU 279 CO -0.39 0.00 0.03 0.09 -1.40 0.00 0.00 179.01 177.34 3k2l n ASN 280 N -3.78 5.49 -4.03 1.42 3.02 0.16 -4.74 115.26 112.80 3k2l n ASN 280 Ca -0.00 -2.93 -0.29 0.00 -0.03 0.00 0.00 54.58 51.32 3k2l n ASN 280 Cb 0.24 -0.69 -0.17 0.00 -0.61 0.00 0.00 39.78 38.55 3k2l n ASN 280 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3k2l s ILE 281 N -2.73 1.53 -0.13 2.41 1.01 -0.63 -1.02 121.20 121.64 3k2l s ILE 281 Ca 0.53 -0.62 -0.00 0.00 0.00 0.00 0.00 60.65 60.55 3k2l s ILE 281 Cb 0.40 -1.43 -0.01 0.00 0.01 0.00 0.00 42.46 41.43 3k2l s ILE 281 CO 0.15 0.45 -0.13 -0.76 0.00 0.00 0.00 174.94 174.65 3k2l s LEU 282 N 1.35 2.68 0.20 2.97 1.02 0.73 -1.07 118.68 126.56 3k2l s LEU 282 Ca 0.02 -0.35 -0.32 0.00 0.02 0.00 0.00 54.13 53.50 3k2l s LEU 282 Cb -0.13 -1.60 -0.15 0.00 0.02 0.00 0.00 46.19 44.32 3k2l s LEU 282 CO -0.08 0.16 1.21 0.18 0.02 0.00 0.00 176.35 177.84 3k2l n LEU 283 N 3.59 1.96 0.03 1.79 4.77 -0.23 -0.81 117.00 128.09 3k2l n LEU 283 Ca -0.18 1.15 -0.05 0.00 -0.03 0.00 0.00 56.01 56.89 3k2l n LEU 283 Cb 0.53 -1.28 0.16 0.00 -2.33 0.00 0.00 43.42 40.50 3k2l n LEU 283 CO 0.30 -1.10 0.63 0.11 -1.33 0.00 0.00 177.39 176.00 3k2l h LYS 284 N 3.45 0.44 -3.05 3.23 1.57 -0.70 -0.46 116.57 121.06 3k2l h LYS 284 Ca -0.43 -0.21 -0.16 0.00 -1.87 0.00 0.00 60.65 57.97 3k2l h LYS 284 Cb 1.33 -0.00 -0.26 0.00 0.08 0.00 0.00 32.23 33.37 3k2l h LYS 284 CO 0.71 0.76 -0.41 -0.65 -0.57 0.00 0.00 179.45 179.28 3k2l s GLN 285 N -4.24 0.30 0.40 3.15 -0.21 -1.26 -3.79 119.66 114.00 3k2l s GLN 285 Ca -0.06 0.43 -0.27 0.00 0.02 0.00 0.00 55.36 55.47 3k2l s GLN 285 Cb 0.13 0.09 -0.10 0.00 1.00 0.00 0.00 33.01 34.12 3k2l s GLN 285 CO 0.80 -0.07 1.47 0.00 -2.12 0.00 0.00 175.29 175.37 3k2l n GLN 286 N 3.26 2.56 -0.66 2.91 0.00 -1.26 -2.47 117.38 121.72 3k2l n GLN 286 Ca -0.16 0.90 0.00 0.00 0.00 0.00 0.00 57.00 57.74 3k2l n GLN 286 Cb 0.57 -2.65 0.00 0.00 0.00 0.00 0.00 30.24 28.16 3k2l n GLN 286 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3k2l n GLY 287 N 0.49 0.77 3.10 2.61 0.00 -1.26 -5.01 105.19 105.89 3k2l n GLY 287 Ca 0.02 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.97 3k2l n GLY 287 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k2l s ARG 288 N -0.34 0.64 0.22 1.61 0.52 -1.03 -5.07 118.95 115.50 3k2l s ARG 288 Ca 0.00 -1.23 0.22 0.00 -0.52 0.00 0.00 55.73 54.20 3k2l s ARG 288 Cb 0.00 0.16 0.03 0.00 0.52 0.00 0.00 34.95 35.66 3k2l s ARG 288 CO 0.00 -0.10 1.09 0.66 0.02 0.00 0.00 175.30 176.97 3k2l h SER 289 N 3.13 0.00 -2.40 0.23 4.64 -1.95 -3.42 113.55 113.77 3k2l h SER 289 Ca -0.34 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.38 3k2l h SER 289 Cb 1.14 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.31 3k2l h SER 289 CO 0.66 0.02 0.63 0.61 -0.87 0.00 0.00 176.83 177.87 3k2l n GLY 290 N 1.18 0.80 3.34 -0.77 0.00 -1.26 -4.86 105.19 103.62 3k2l n GLY 290 Ca 0.00 0.57 -0.17 0.00 0.00 0.00 0.00 46.02 46.41 3k2l n GLY 290 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3k2l s ILE 291 N 0.28 0.86 0.02 -0.61 -5.25 -1.26 0.00 121.20 115.24 3k2l s ILE 291 Ca 0.73 -2.01 0.01 0.00 -0.99 0.00 0.00 60.65 58.39 3k2l s ILE 291 Cb -0.70 -2.51 -0.01 0.00 2.95 0.00 0.00 42.46 42.18 3k2l s ILE 291 CO 0.46 -0.16 -0.04 -0.54 -1.79 0.00 0.00 174.94 172.86 3k2l s LYS 292 N -3.93 0.33 0.10 0.37 1.02 0.01 -4.80 119.74 112.84 3k2l s LYS 292 Ca 0.33 -0.41 -0.27 0.00 0.02 0.00 0.00 55.97 55.64 3k2l s LYS 292 Cb 0.07 -0.16 -0.06 0.00 -0.52 0.00 0.00 37.83 37.16 3k2l s LYS 292 CO 0.11 0.03 0.84 0.08 -0.92 0.00 0.00 175.35 175.49 3k2l s VAL 293 N -0.79 4.54 0.44 3.17 1.01 -0.52 -0.20 120.40 128.07 3k2l s VAL 293 Ca -0.06 1.80 0.03 0.00 0.00 0.00 0.00 61.98 63.75 3k2l s VAL 293 Cb -0.06 -4.19 -0.02 0.00 0.00 0.00 0.00 36.38 32.11 3k2l s VAL 293 CO -0.00 0.39 0.10 0.27 0.00 0.00 0.00 175.10 175.86 3k2l s ILE 294 N -0.34 0.72 -0.29 2.22 -4.36 -0.19 -1.93 121.20 117.03 3k2l s ILE 294 Ca 0.40 -2.00 -0.00 0.00 -0.26 0.00 0.00 60.65 58.79 3k2l s ILE 294 Cb -0.22 -2.27 0.00 0.00 1.25 0.00 0.00 42.46 41.22 3k2l s ILE 294 CO 0.26 0.00 0.02 -0.67 0.24 0.00 0.00 174.94 174.79 3k2l n ASP 295 N -1.34 -7.68 -1.40 4.36 2.03 -1.26 -4.86 116.55 106.41 3k2l n ASP 295 Ca -0.10 1.33 0.00 0.00 0.52 0.00 0.00 54.79 56.54 3k2l n ASP 295 Cb 0.65 -5.09 0.27 0.00 -0.72 0.00 0.00 41.12 36.23 3k2l n ASP 295 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3k2l n PHE 296 N 0.64 1.58 0.43 -0.67 3.72 -1.26 -4.59 117.46 117.31 3k2l n PHE 296 Ca 0.00 -1.17 0.13 0.00 -0.05 0.00 0.00 57.45 56.37 3k2l n PHE 296 Cb 0.01 -0.50 0.42 0.00 -0.94 0.00 0.00 39.48 38.47 3k2l n PHE 296 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3k2l h GLY 297 N 1.98 0.00 -1.59 1.37 0.00 -1.90 -2.70 103.07 100.22 3k2l h GLY 297 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 3k2l h GLY 297 CO 0.47 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.45 3k2l n SER 298 N -2.55 2.66 -4.76 0.19 7.64 -1.26 -4.72 113.62 110.82 3k2l n SER 298 Ca 0.04 -1.82 -0.32 0.00 1.01 0.00 0.00 58.87 57.77 3k2l n SER 298 Cb 0.38 -0.01 0.08 0.00 -1.01 0.00 0.00 64.21 63.65 3k2l n SER 298 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3k2l s SER 299 N -1.63 4.59 0.27 6.43 0.01 -1.02 -4.63 113.70 117.72 3k2l s SER 299 Ca 0.23 1.97 -0.19 0.00 1.31 0.00 0.00 55.95 59.28 3k2l s SER 299 Cb 0.16 -2.54 0.01 0.00 0.21 0.00 0.00 66.02 63.87 3k2l s SER 299 CO 0.25 -1.98 0.66 0.00 0.41 0.00 0.00 173.24 172.58 3k2l s TYR 301 N -3.94 3.49 0.36 0.00 1.51 -1.26 -1.36 117.35 116.15 3k2l s TYR 301 Ca 0.13 1.36 0.25 0.00 -1.01 0.00 0.00 57.07 57.80 3k2l s TYR 301 Cb -0.05 -2.63 1.26 0.00 -0.11 0.00 0.00 41.96 40.44 3k2l s TYR 301 CO 0.07 0.17 1.38 0.39 -1.11 0.00 0.00 175.55 176.45 3k2l n GLU 302 N 0.06 -0.04 0.00 -0.62 1.02 -1.11 0.58 120.64 120.54 3k2l n GLU 302 Ca 0.02 1.15 0.14 0.00 -0.02 0.00 0.00 57.16 58.45 3k2l n GLU 302 Cb 0.52 -2.18 0.62 0.00 -0.02 0.00 0.00 31.44 30.38 3k2l n GLU 302 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 3k2l n HIS 303 N -4.68 0.00 -2.04 -0.32 1.44 -1.26 -4.01 115.22 104.35 3k2l n HIS 303 Ca 0.35 0.00 -0.21 0.00 -2.01 0.00 0.00 57.72 55.85 3k2l n HIS 303 Cb 1.28 -0.10 0.03 0.00 0.12 0.00 0.00 29.99 31.32 3k2l n HIS 303 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 3k2l n GLN 304 N -0.67 3.36 -2.09 -1.40 3.00 0.20 -4.99 117.38 114.79 3k2l n GLN 304 Ca 0.17 -4.07 -0.42 0.00 -0.01 0.00 0.00 57.00 52.67 3k2l n GLN 304 Cb 0.27 -2.19 -0.03 0.00 0.00 0.00 0.00 30.24 28.30 3k2l n GLN 304 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 3k2l s ARG 305 N -3.57 4.23 -0.02 -1.09 0.52 -1.24 -4.72 118.95 113.05 3k2l s ARG 305 Ca 0.49 2.12 0.06 0.00 -0.52 0.00 0.00 55.73 57.87 3k2l s ARG 305 Cb 0.40 -3.67 -0.08 0.00 0.52 0.00 0.00 34.95 32.12 3k2l s ARG 305 CO 0.03 -0.69 0.09 0.28 0.02 0.00 0.00 175.30 175.03 3k2l n VAL 306 N 4.88 0.13 0.00 3.52 0.31 -1.26 -5.17 118.33 120.74 3k2l n VAL 306 Ca 0.15 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 3k2l n VAL 306 Cb 0.42 -0.06 0.00 0.00 -0.91 0.00 0.00 33.84 33.29 3k2l n VAL 306 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 3k2l n TYR 307 N -1.88 0.00 0.00 3.52 4.01 -1.26 -5.31 117.16 116.24 3k2l n TYR 307 Ca -0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 3k2l n TYR 307 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.37 3k2l n TYR 307 CO 0.00 0.00 0.00 0.44 -0.46 0.00 0.00 176.86 176.84 3k2l n ILE 310 N 0.00 0.00 -1.01 -0.72 -5.35 -1.26 -5.12 119.36 105.90 3k2l n ILE 310 Ca 0.00 0.00 0.13 0.00 -0.27 0.00 0.00 62.75 62.61 3k2l n ILE 310 Cb 0.00 0.00 -0.06 0.00 -1.74 0.00 0.00 39.64 37.84 3k2l n ILE 310 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3k2l n GLN 311 N -1.70 -2.27 -3.46 6.28 6.02 -0.96 -4.89 117.38 116.39 3k2l n GLN 311 Ca 0.00 1.79 -0.38 0.00 -0.01 0.00 0.00 57.00 58.40 3k2l n GLN 311 Cb 0.00 -2.68 -0.06 0.00 1.02 0.00 0.00 30.24 28.52 3k2l n GLN 311 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3k2l s SER 312 N -6.43 6.79 0.21 1.08 0.15 -1.26 -4.88 113.70 109.35 3k2l s SER 312 Ca 0.00 0.94 -0.12 0.00 0.70 0.00 0.00 55.95 57.47 3k2l s SER 312 Cb 0.00 -2.26 0.27 0.00 -1.71 0.00 0.00 66.02 62.32 3k2l s SER 312 CO 0.00 0.26 1.66 -0.09 1.20 0.00 0.00 173.24 176.27 3k2l h ARG 313 N 5.12 0.10 0.00 5.44 2.43 -1.96 0.46 114.38 125.98 3k2l h ARG 313 Ca -0.49 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 3k2l h ARG 313 Cb 1.21 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 3k2l h ARG 313 CO 0.65 0.07 0.00 0.74 -1.51 0.00 0.00 179.97 179.92 3k2l h PHE 314 N 0.11 0.00 -0.14 2.20 0.04 -1.89 -2.08 116.94 115.18 3k2l h PHE 314 Ca 0.31 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.08 3k2l h PHE 314 Cb 0.49 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.64 3k2l h PHE 314 CO -0.36 0.00 0.00 0.66 -0.60 0.00 0.00 178.31 178.01 3k2l n TYR 315 N -2.80 0.18 -2.68 -0.55 4.01 0.15 -4.71 117.16 110.77 3k2l n TYR 315 Ca -0.01 -0.27 -0.41 0.00 -0.16 0.00 0.00 57.90 57.05 3k2l n TYR 315 Cb 0.13 -0.02 -0.04 0.00 -0.31 0.00 0.00 39.34 39.10 3k2l n TYR 315 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 3k2l s ARG 316 N -0.84 4.67 0.54 -0.72 3.52 -0.78 -4.00 118.95 121.34 3k2l s ARG 316 Ca 0.13 1.51 -0.19 0.00 -0.13 0.00 0.00 55.73 57.06 3k2l s ARG 316 Cb 0.08 -3.36 -0.06 0.00 -1.56 0.00 0.00 34.95 30.05 3k2l s ARG 316 CO 0.11 0.18 1.07 0.00 -0.81 0.00 0.00 175.30 175.85 3k2l s ALA 317 N -0.04 2.77 0.28 6.12 0.00 -1.26 -4.96 121.76 124.67 3k2l s ALA 317 Ca 0.48 0.61 -0.02 0.00 0.00 0.00 0.00 51.96 53.02 3k2l s ALA 317 Cb -0.25 -3.28 0.40 0.00 0.00 0.00 0.00 23.12 20.00 3k2l s ALA 317 CO 0.31 -0.62 1.88 -1.00 0.00 0.00 0.00 175.76 176.33 3k2l h PRO 318 N 1.08 0.95 -0.61 0.00 0.13 -1.96 -1.76 132.00 129.84 3k2l h PRO 318 Ca -0.49 -0.13 0.09 0.00 -0.87 0.00 0.00 66.00 64.60 3k2l h PRO 318 Cb 1.23 -0.18 -0.04 0.00 0.13 0.00 0.00 31.00 32.15 3k2l h PRO 318 CO 0.58 0.75 0.41 1.05 -0.23 0.00 0.00 178.00 180.55 3k2l h GLU 319 N 0.95 0.46 -0.17 0.86 9.09 -1.93 0.40 114.58 124.24 3k2l h GLU 319 Ca 0.23 -0.03 -0.02 0.00 0.05 0.00 0.00 59.36 59.59 3k2l h GLU 319 Cb 0.12 -0.10 -0.01 0.00 -1.65 0.00 0.00 28.75 27.11 3k2l h GLU 319 CO -0.03 0.31 0.02 0.28 0.05 0.00 0.00 179.01 179.63 3k2l h VAL 320 N 0.48 1.24 -0.77 -1.06 2.07 -1.60 -0.64 116.25 115.96 3k2l h VAL 320 Ca 0.28 -0.77 -0.03 0.00 0.82 0.00 0.00 66.70 66.99 3k2l h VAL 320 Cb 0.47 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 3k2l h VAL 320 CO -0.08 0.23 0.35 0.40 0.02 0.00 0.00 177.57 178.49 3k2l h ILE 321 N 0.06 1.25 0.00 4.57 2.04 -1.16 -2.63 117.51 121.63 3k2l h ILE 321 Ca 0.05 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.19 3k2l h ILE 321 Cb 0.34 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 3k2l h ILE 321 CO 0.01 0.30 0.00 0.18 0.00 0.00 0.00 178.15 178.64 3k2l n LEU 322 N -4.36 0.00 -1.44 1.44 4.77 0.13 -4.88 117.00 112.66 3k2l n LEU 322 Ca 0.07 0.48 -0.11 0.00 -0.03 0.00 0.00 56.01 56.42 3k2l n LEU 322 Cb 0.15 -0.48 0.01 0.00 -2.33 0.00 0.00 43.42 40.77 3k2l n LEU 322 CO 0.40 -0.07 -0.07 0.61 -1.33 0.00 0.00 177.39 176.92 3k2l n GLY 323 N 1.04 -0.01 4.00 -0.72 0.00 -0.42 -1.72 105.19 107.34 3k2l n GLY 323 Ca 0.07 -0.38 -0.23 0.00 0.00 0.00 0.00 46.02 45.48 3k2l n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2l s ALA 324 N -2.69 3.89 -0.33 4.61 0.00 -0.38 -2.52 121.76 124.33 3k2l s ALA 324 Ca 0.07 -1.77 -0.29 0.00 0.00 0.00 0.00 51.96 49.97 3k2l s ALA 324 Cb -0.03 -1.92 -0.01 0.00 0.00 0.00 0.00 23.12 21.17 3k2l s ALA 324 CO 0.09 -1.31 1.52 0.50 0.00 0.00 0.00 175.76 176.56 3k2l s ARG 325 N -5.03 3.63 0.41 0.00 3.52 -1.26 -4.71 118.95 115.51 3k2l s ARG 325 Ca 0.65 1.25 0.04 0.00 -0.13 0.00 0.00 55.73 57.54 3k2l s ARG 325 Cb -0.06 -4.04 0.00 0.00 -1.56 0.00 0.00 34.95 29.30 3k2l s ARG 325 CO 0.43 -1.49 0.59 1.52 -0.81 0.00 0.00 175.30 175.54 3k2l s TYR 326 N 5.50 3.08 0.00 5.12 1.13 -1.26 -5.02 117.35 125.90 3k2l s TYR 326 Ca 0.66 -0.07 0.00 0.00 -1.41 0.00 0.00 57.07 56.25 3k2l s TYR 326 Cb -0.18 -2.24 0.00 0.00 -1.10 0.00 0.00 41.96 38.43 3k2l s TYR 326 CO 0.30 -0.28 0.00 0.41 -2.51 0.00 0.00 175.55 173.47 3k2l n GLY 327 N -1.90 2.84 0.42 5.49 0.00 -1.26 -5.01 105.19 105.78 3k2l n GLY 327 Ca 0.02 -0.56 0.23 0.00 0.00 0.00 0.00 46.02 45.71 3k2l n GLY 327 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3k2l h MET 328 N 0.00 0.00 0.00 1.61 2.86 -1.98 -1.57 114.93 115.84 3k2l h MET 328 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3k2l h MET 328 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3k2l h MET 328 CO 0.00 0.00 0.00 -2.30 1.06 0.00 0.00 176.91 175.67 3k2l n PRO 329 N -3.70 0.13 0.22 -0.22 -0.02 -1.26 -2.20 135.00 127.95 3k2l n PRO 329 Ca 0.11 0.35 0.06 0.00 -2.02 0.00 0.00 63.50 62.00 3k2l n PRO 329 Cb 0.80 -1.74 0.52 0.00 -0.02 0.00 0.00 33.50 33.06 3k2l n PRO 329 CO 0.00 0.00 0.00 -0.84 1.98 0.00 0.00 175.50 176.64 3k2l h ILE 330 N 0.00 1.11 0.00 4.25 3.07 -1.69 -2.12 117.51 122.13 3k2l h ILE 330 Ca 0.00 -0.54 -0.09 0.00 1.55 0.00 0.00 64.86 65.77 3k2l h ILE 330 Cb 0.34 1.28 -0.01 0.00 -0.27 0.00 0.00 36.82 38.16 3k2l h ILE 330 CO 0.00 0.16 -0.45 0.44 -1.05 0.00 0.00 178.15 177.24 3k2l h ASP 331 N 0.01 0.00 0.09 2.16 3.32 -1.67 -2.34 116.42 118.00 3k2l h ASP 331 Ca 0.00 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.80 3k2l h ASP 331 Cb 0.28 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.84 3k2l h ASP 331 CO 0.02 0.45 -0.99 -0.03 -1.72 0.00 0.00 179.24 176.98 3k2l h MET 332 N 0.00 0.62 -0.49 3.56 4.05 -1.54 -1.48 114.93 119.65 3k2l h MET 332 Ca -0.00 -0.65 0.06 0.00 -0.28 0.00 0.00 59.70 58.83 3k2l h MET 332 Cb 0.84 0.18 -0.05 0.00 -0.80 0.00 0.00 31.60 31.77 3k2l h MET 332 CO 0.06 1.25 0.19 2.35 0.23 0.00 0.00 176.91 180.99 3k2l h TRP 333 N 0.36 0.35 -0.76 1.39 2.91 -1.21 -2.08 115.95 116.91 3k2l h TRP 333 Ca -0.11 0.02 0.01 0.00 1.13 0.00 0.00 58.89 59.94 3k2l h TRP 333 Cb 1.63 -0.08 -0.04 0.00 -0.51 0.00 0.00 29.16 30.16 3k2l h TRP 333 CO 0.09 0.13 0.50 0.77 -1.03 0.00 0.00 178.44 178.90 3k2l h SER 334 N 0.39 0.87 -0.02 2.65 0.02 -1.26 -2.43 113.55 113.77 3k2l h SER 334 Ca 0.23 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.19 3k2l h SER 334 Cb 0.21 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.49 3k2l h SER 334 CO -0.21 0.63 -0.22 0.25 -1.14 0.00 0.00 176.83 176.14 3k2l h LEU 335 N 1.02 -0.64 -0.45 5.07 5.85 -0.88 0.42 115.31 125.71 3k2l h LEU 335 Ca 0.28 0.09 0.09 0.00 0.84 0.00 0.00 57.88 59.18 3k2l h LEU 335 Cb -0.12 0.27 -0.08 0.00 0.37 0.00 0.00 40.66 41.10 3k2l h LEU 335 CO -0.06 -0.28 -0.07 1.23 -0.34 0.00 0.00 178.44 178.92 3k2l h GLY 336 N -0.33 0.38 1.28 3.75 0.00 -1.10 -0.49 103.07 106.55 3k2l h GLY 336 Ca 0.07 0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.50 3k2l h GLY 336 CO -0.21 -0.15 0.40 0.00 0.00 0.00 0.00 176.54 176.57 3k2l h ILE 338 N 0.97 1.32 -0.84 0.00 2.04 0.30 -2.88 117.51 118.42 3k2l h ILE 338 Ca 0.25 -1.08 0.11 0.00 1.00 0.00 0.00 64.86 65.14 3k2l h ILE 338 Cb -0.00 1.85 -0.08 0.00 -0.74 0.00 0.00 36.82 37.84 3k2l h ILE 338 CO -0.04 0.30 0.48 -0.07 0.00 0.00 0.00 178.15 178.82 3k2l h LEU 339 N -0.17 0.67 -0.42 1.44 4.07 -0.82 0.52 115.31 120.61 3k2l h LEU 339 Ca 0.02 0.06 -0.00 0.00 0.08 0.00 0.00 57.88 58.03 3k2l h LEU 339 Cb 0.51 -0.07 -0.02 0.00 1.08 0.00 0.00 40.66 42.16 3k2l h LEU 339 CO 0.01 0.36 0.25 0.00 -1.08 0.00 0.00 178.44 177.98 3k2l h ALA 340 N 1.48 0.53 -0.89 1.53 0.00 -1.43 -2.14 119.26 118.33 3k2l h ALA 340 Ca 0.42 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 3k2l h ALA 340 Cb 0.43 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 3k2l h ALA 340 CO -0.27 0.03 0.49 1.49 0.00 0.00 0.00 179.25 180.99 3k2l h GLU 341 N 0.55 1.24 -0.76 0.00 4.81 -1.03 -0.25 114.58 119.13 3k2l h GLU 341 Ca 0.15 -0.14 -0.04 0.00 -0.13 0.00 0.00 59.36 59.20 3k2l h GLU 341 Cb 0.01 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.11 3k2l h GLU 341 CO -0.03 0.90 0.33 -0.07 -0.73 0.00 0.00 179.01 179.41 3k2l h LEU 342 N 1.24 1.03 0.14 1.64 3.38 -0.68 0.24 115.31 122.31 3k2l h LEU 342 Ca 0.31 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 3k2l h LEU 342 Cb 0.02 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.51 3k2l h LEU 342 CO -0.05 0.91 -0.07 0.25 0.09 0.00 0.00 178.44 179.57 3k2l h LEU 343 N 1.09 -0.16 0.00 1.67 5.85 -1.03 -0.41 115.31 122.32 3k2l h LEU 343 Ca 0.26 -0.37 -0.19 0.00 0.84 0.00 0.00 57.88 58.41 3k2l h LEU 343 Cb 0.18 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 3k2l h LEU 343 CO -0.03 0.34 -1.58 0.35 -0.34 0.00 0.00 178.44 177.19 3k2l n THR 344 N -4.94 1.19 0.00 1.05 -2.24 -0.14 -3.06 114.28 106.14 3k2l n THR 344 Ca -0.08 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 3k2l n THR 344 Cb 0.27 -0.70 0.00 0.00 -2.10 0.00 0.00 70.33 67.79 3k2l n THR 344 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k2l n GLY 345 N 1.44 1.81 3.29 3.38 0.00 0.82 -4.37 105.19 111.57 3k2l n GLY 345 Ca -0.12 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.66 3k2l n GLY 345 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k2l s TYR 346 N -1.98 1.76 0.40 1.61 2.02 -1.24 -4.87 117.35 115.06 3k2l s TYR 346 Ca 0.00 -0.43 -0.26 0.00 -0.37 0.00 0.00 57.07 56.01 3k2l s TYR 346 Cb 0.00 -0.95 -0.10 0.00 -0.40 0.00 0.00 41.96 40.51 3k2l s TYR 346 CO 0.00 0.22 1.24 -2.30 -1.57 0.00 0.00 175.55 173.15 3k2l n PRO 347 N 0.92 1.90 -0.20 -1.71 -0.02 -1.26 -4.10 135.00 130.53 3k2l n PRO 347 Ca -0.18 0.67 -0.09 0.00 -2.02 0.00 0.00 63.50 61.88 3k2l n PRO 347 Cb 0.54 -2.33 0.02 0.00 -0.02 0.00 0.00 33.50 31.71 3k2l n PRO 347 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3k2l h LEU 348 N 2.12 0.92 -6.76 2.45 5.85 -1.91 -3.38 115.31 114.60 3k2l h LEU 348 Ca -0.47 -0.28 -0.61 0.00 0.84 0.00 0.00 57.88 57.37 3k2l h LEU 348 Cb 1.30 -0.24 -0.40 0.00 0.37 0.00 0.00 40.66 41.68 3k2l h LEU 348 CO 0.60 0.96 -0.76 -0.76 -0.34 0.00 0.00 178.44 178.15 3k2l s LEU 349 N -9.46 3.23 -1.37 2.25 1.43 -1.26 -5.04 118.68 108.46 3k2l s LEU 349 Ca -0.12 -3.46 -0.12 0.00 -1.03 0.00 0.00 54.13 49.40 3k2l s LEU 349 Cb 0.13 -1.08 0.10 0.00 0.03 0.00 0.00 46.19 45.36 3k2l s LEU 349 CO 0.83 -0.13 2.03 -0.81 0.23 0.00 0.00 176.35 178.50 3k2l n PRO 350 N 2.42 3.20 -2.53 1.29 -0.04 -1.26 -4.56 135.00 133.52 3k2l n PRO 350 Ca 0.24 -3.06 -0.32 0.00 -0.04 0.00 0.00 63.50 60.32 3k2l n PRO 350 Cb 0.41 -3.15 -0.04 0.00 -0.04 0.00 0.00 33.50 30.67 3k2l n PRO 350 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3k2l s GLY 351 N 2.33 2.18 0.00 0.55 0.00 -1.26 -4.96 107.32 106.16 3k2l s GLY 351 Ca 0.44 0.27 0.20 0.00 0.00 0.00 0.00 44.72 45.63 3k2l s GLY 351 CO -0.04 0.55 0.93 -1.84 0.00 0.00 0.00 173.10 172.70 3k2l n GLU 352 N -1.28 1.13 -3.78 2.90 0.28 -1.26 -4.83 120.64 113.80 3k2l n GLU 352 Ca 0.07 -0.58 -0.02 0.00 -0.16 0.00 0.00 57.16 56.47 3k2l n GLU 352 Cb 0.54 -1.40 -0.00 0.00 1.43 0.00 0.00 31.44 32.01 3k2l n GLU 352 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 177.13 177.13 3k2l s ASP 353 N -2.47 -0.09 0.24 -1.84 1.47 -1.26 -5.00 116.67 107.71 3k2l s ASP 353 Ca 0.13 -0.42 -0.06 0.00 1.18 0.00 0.00 52.55 53.37 3k2l s ASP 353 Cb 0.16 0.41 0.29 0.00 -0.34 0.00 0.00 42.92 43.43 3k2l s ASP 353 CO 0.62 -0.78 1.88 1.05 0.68 0.00 0.00 175.17 178.62 3k2l h GLU 354 N 2.00 1.08 -0.22 2.11 4.11 -1.99 0.28 114.58 121.95 3k2l h GLU 354 Ca -0.26 -0.06 -0.01 0.00 0.07 0.00 0.00 59.36 59.09 3k2l h GLU 354 Cb 1.22 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 3k2l h GLU 354 CO 0.29 0.71 0.10 0.78 0.07 0.00 0.00 179.01 180.96 3k2l h GLY 355 N 1.11 0.35 2.00 1.06 0.00 -1.98 -1.05 103.07 104.55 3k2l h GLY 355 Ca 0.36 -0.18 -0.06 0.00 0.00 0.00 0.00 47.33 47.45 3k2l h GLY 355 CO -0.13 0.17 -0.27 -1.80 0.00 0.00 0.00 176.54 174.52 3k2l h ASP 356 N 0.21 0.00 -0.29 0.19 3.58 -1.80 0.50 116.42 118.81 3k2l h ASP 356 Ca 0.07 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.49 3k2l h ASP 356 Cb 0.15 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.19 3k2l h ASP 356 CO -0.01 0.27 0.04 -0.61 -2.88 0.00 0.00 179.24 176.05 3k2l h GLN 357 N 0.00 0.48 -0.94 0.28 5.75 0.22 -1.47 115.11 119.42 3k2l h GLN 357 Ca -0.00 -0.13 0.00 0.00 -0.15 0.00 0.00 58.65 58.36 3k2l h GLN 357 Cb 0.70 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 29.15 3k2l h GLN 357 CO 0.03 0.59 0.59 1.25 -2.65 0.00 0.00 178.83 178.65 3k2l h LEU 358 N 0.30 1.11 -0.86 -2.39 5.85 -0.71 -1.64 115.31 116.97 3k2l h LEU 358 Ca 0.09 -0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.78 3k2l h LEU 358 Cb 0.35 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 3k2l h LEU 358 CO 0.01 0.84 0.56 0.00 -0.34 0.00 0.00 178.44 179.50 3k2l h ALA 359 N 1.36 1.13 -0.08 1.25 0.00 -0.64 0.19 119.26 122.47 3k2l h ALA 359 Ca 0.34 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 55.07 3k2l h ALA 359 Cb -0.09 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 3k2l h ALA 359 CO -0.07 0.41 -0.59 0.00 0.00 0.00 0.00 179.25 179.00 3k2l h MET 361 N 0.19 0.61 -0.15 0.00 2.07 -0.29 -2.88 114.93 114.50 3k2l h MET 361 Ca -0.00 -0.13 -0.16 0.00 -2.07 0.00 0.00 59.70 57.33 3k2l h MET 361 Cb 1.09 -0.09 -0.01 0.00 -1.87 0.00 0.00 31.60 30.73 3k2l h MET 361 CO 0.09 0.62 -0.57 0.82 1.07 0.00 0.00 176.91 178.94 3k2l h ILE 362 N 0.49 1.34 -0.86 -1.22 2.04 -0.94 0.83 117.51 119.19 3k2l h ILE 362 Ca 0.13 -1.86 0.02 0.00 1.00 0.00 0.00 64.86 64.15 3k2l h ILE 362 Cb 0.26 1.85 -0.05 0.00 -0.74 0.00 0.00 36.82 38.15 3k2l h ILE 362 CO -0.00 0.57 0.57 -0.08 0.00 0.00 0.00 178.15 179.20 3k2l h GLU 363 N 0.35 1.09 0.07 2.37 4.81 -1.31 0.17 114.58 122.13 3k2l h GLU 363 Ca 0.00 -0.07 -0.35 0.00 -0.13 0.00 0.00 59.36 58.81 3k2l h GLU 363 Cb 1.11 -0.25 -0.03 0.00 0.63 0.00 0.00 28.75 30.21 3k2l h GLU 363 CO 0.10 0.72 -1.98 -0.11 -0.73 0.00 0.00 179.01 177.01 3k2l n LEU 364 N -4.42 2.50 -0.00 1.64 7.94 -1.09 -1.04 117.00 122.52 3k2l n LEU 364 Ca 0.10 0.20 0.08 0.00 -1.11 0.00 0.00 56.01 55.28 3k2l n LEU 364 Cb 0.06 -1.04 -0.10 0.00 0.53 0.00 0.00 43.42 42.88 3k2l n LEU 364 CO 0.36 0.74 -0.09 0.18 -1.11 0.00 0.00 177.39 177.47 3k2l n LEU 365 N -3.68 0.71 0.00 -1.96 4.77 0.27 -4.58 117.00 112.53 3k2l n LEU 365 Ca -0.36 -0.46 0.00 0.00 -0.03 0.00 0.00 56.01 55.16 3k2l n LEU 365 Cb 0.96 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.05 3k2l n LEU 365 CO 0.33 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 3k2l n GLY 366 N 1.40 -0.58 3.75 -0.72 0.00 0.51 -4.85 105.19 104.70 3k2l n GLY 366 Ca 0.03 -1.76 -0.38 0.00 0.00 0.00 0.00 46.02 43.90 3k2l n GLY 366 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3k2l s MET 367 N -1.24 3.27 0.00 1.61 1.75 -1.26 -4.37 119.30 119.06 3k2l s MET 367 Ca 0.00 2.17 0.00 0.00 -1.25 0.00 0.00 55.69 56.61 3k2l s MET 367 Cb 0.00 -2.30 0.00 0.00 2.84 0.00 0.00 34.83 35.37 3k2l s MET 367 CO 0.00 -1.07 0.00 -0.35 -0.65 0.00 0.00 175.02 172.95 3k2l n PRO 368 N -0.90 0.00 -0.01 4.11 -0.04 -1.26 -5.08 135.00 131.82 3k2l n PRO 368 Ca 0.10 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.55 3k2l n PRO 368 Cb 0.45 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.89 3k2l n PRO 368 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3k2l n GLN 370 N 0.00 3.07 0.20 0.54 1.13 -1.26 -4.94 117.38 116.11 3k2l n GLN 370 Ca 0.00 -0.00 0.09 0.00 -1.94 0.00 0.00 57.00 55.15 3k2l n GLN 370 Cb 0.00 -1.07 0.22 0.00 0.11 0.00 0.00 30.24 29.50 3k2l n GLN 370 CO 0.00 0.00 0.00 1.57 -1.44 0.00 0.00 177.06 177.19 3k2l h LYS 371 N 0.00 0.00 0.00 -1.09 5.09 -2.03 -1.36 116.57 117.18 3k2l h LYS 371 Ca -0.06 0.00 -0.02 0.00 0.09 0.00 0.00 60.65 60.66 3k2l h LYS 371 Cb 1.01 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 33.33 3k2l h LYS 371 CO 0.00 0.20 -0.12 1.25 -2.09 0.00 0.00 179.45 178.70 3k2l h LEU 372 N 0.00 0.00 0.11 7.07 5.85 -1.93 0.47 115.31 126.87 3k2l h LEU 372 Ca -0.00 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.37 3k2l h LEU 372 Cb 1.04 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.05 3k2l h LEU 372 CO 0.03 0.12 -1.93 -0.07 -0.34 0.00 0.00 178.44 176.24 3k2l h LEU 373 N 0.00 0.36 -0.33 2.25 3.38 -1.89 -3.25 115.31 115.82 3k2l h LEU 373 Ca -0.00 -0.79 0.00 0.00 0.09 0.00 0.00 57.88 57.18 3k2l h LEU 373 Cb 0.48 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 3k2l h LEU 373 CO 0.02 1.71 0.21 0.44 0.09 0.00 0.00 178.44 180.91 3k2l h ASP 374 N 0.06 0.38 0.00 -0.43 5.19 -1.02 -2.34 116.42 118.26 3k2l h ASP 374 Ca -0.40 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 55.99 3k2l h ASP 374 Cb 2.03 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 41.45 3k2l h ASP 374 CO 0.09 0.28 0.00 0.00 -3.12 0.00 0.00 179.24 176.50 3k2l n ALA 375 N -2.19 2.00 -3.31 3.45 0.00 0.16 -4.70 120.51 115.92 3k2l n ALA 375 Ca -0.01 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.20 3k2l n ALA 375 Cb 0.03 -1.00 -0.16 0.00 0.00 0.00 0.00 19.45 18.32 3k2l n ALA 375 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3k2l s SER 376 N -0.11 1.56 0.56 0.00 0.01 -0.88 -4.63 113.70 110.21 3k2l s SER 376 Ca 0.00 -0.25 0.34 0.00 1.31 0.00 0.00 55.95 57.35 3k2l s SER 376 Cb 0.00 -0.62 1.56 0.00 0.21 0.00 0.00 66.02 67.17 3k2l s SER 376 CO 0.00 0.04 2.06 0.11 0.41 0.00 0.00 173.24 175.87 3k2l h LYS 377 N 6.76 0.00 -0.00 12.44 1.79 -1.39 -3.18 116.57 132.99 3k2l h LYS 377 Ca -0.33 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.14 3k2l h LYS 377 Cb 1.18 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.83 3k2l h LYS 377 CO 0.48 0.04 0.00 0.54 -1.08 0.00 0.00 179.45 179.43 3k2l n ARG 378 N -3.19 2.76 -0.24 3.15 1.74 -0.70 -4.73 116.66 115.45 3k2l n ARG 378 Ca -0.01 -1.45 -0.06 0.00 -0.77 0.00 0.00 57.85 55.57 3k2l n ARG 378 Cb 0.26 -1.00 -0.01 0.00 -1.02 0.00 0.00 32.46 30.69 3k2l n ARG 378 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k2l h ALA 379 N 0.02 -0.12 -0.67 7.54 0.00 -1.68 0.65 119.26 125.01 3k2l h ALA 379 Ca 0.00 0.16 0.19 0.00 0.00 0.00 0.00 54.91 55.27 3k2l h ALA 379 Cb 0.47 0.90 -0.03 0.00 0.00 0.00 0.00 17.79 19.14 3k2l h ALA 379 CO 0.00 -0.73 0.64 1.57 0.00 0.00 0.00 179.25 180.74 3k2l h LYS 380 N -0.15 0.00 -0.32 0.00 5.09 -1.85 0.90 116.57 120.23 3k2l h LYS 380 Ca 0.23 0.00 0.02 0.00 0.09 0.00 0.00 60.65 60.99 3k2l h LYS 380 Cb 0.56 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 32.87 3k2l h LYS 380 CO -0.74 0.00 0.22 -0.91 -2.09 0.00 0.00 179.45 175.92 3k2l h ASN 381 N 0.00 0.31 0.00 7.07 4.21 -1.21 -3.38 115.58 122.58 3k2l h ASN 381 Ca 0.32 -0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.82 3k2l h ASN 381 Cb 1.60 -0.07 0.00 0.00 -1.12 0.00 0.00 38.32 38.73 3k2l h ASN 381 CO -0.00 0.22 -0.73 0.49 -1.29 0.00 0.00 177.43 176.11 3k2l n PHE 382 N -4.49 0.00 -4.27 1.19 3.72 0.28 -4.94 117.46 108.95 3k2l n PHE 382 Ca 0.02 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.13 3k2l n PHE 382 Cb 0.13 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.56 3k2l n PHE 382 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 3k2l s VAL 383 N -1.57 3.21 0.00 -4.37 -7.23 0.51 -1.39 120.40 109.56 3k2l s VAL 383 Ca 0.00 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 58.85 3k2l s VAL 383 Cb 0.00 -2.48 0.00 0.00 0.56 0.00 0.00 36.38 34.46 3k2l s VAL 383 CO 0.00 0.12 0.00 -1.54 -0.31 0.00 0.00 175.10 173.37 3k2l n SER 384 N 0.78 0.00 0.00 4.85 3.41 0.22 -4.24 113.62 118.64 3k2l n SER 384 Ca -0.14 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 3k2l n SER 384 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 3k2l n SER 384 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 3k2l n LYS 386 N 0.00 0.00 -1.09 4.33 -0.00 -1.26 -3.82 118.16 116.32 3k2l n LYS 386 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 58.31 58.28 3k2l n LYS 386 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 35.03 35.02 3k2l n LYS 386 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3k2l n GLY 387 N 0.00 0.63 3.73 2.58 0.00 -1.26 -5.04 105.19 105.83 3k2l n GLY 387 Ca 0.00 -0.66 -0.39 0.00 0.00 0.00 0.00 46.02 44.97 3k2l n GLY 387 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3k2l s TYR 388 N -2.07 3.60 0.16 1.61 -0.85 -1.25 -5.07 117.35 113.49 3k2l s TYR 388 Ca 0.00 1.14 -0.30 0.00 -0.52 0.00 0.00 57.07 57.39 3k2l s TYR 388 Cb 0.00 -2.67 -0.07 0.00 0.38 0.00 0.00 41.96 39.59 3k2l s TYR 388 CO 0.00 0.20 1.05 -1.25 -1.52 0.00 0.00 175.55 174.03 3k2l s PRO 389 N 0.43 4.64 0.48 -3.49 0.04 -1.26 0.70 135.00 136.54 3k2l s PRO 389 Ca 0.32 1.63 0.28 0.00 0.04 0.00 0.00 61.00 63.27 3k2l s PRO 389 Cb -0.17 -3.31 0.89 0.00 0.04 0.00 0.00 34.50 31.95 3k2l s PRO 389 CO 0.16 0.14 1.81 0.00 0.04 0.00 0.00 177.00 179.15 3k2l h ARG 390 N 5.19 0.00 0.00 4.56 3.08 -1.58 -2.04 114.38 123.59 3k2l h ARG 390 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.61 3k2l h ARG 390 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.26 3k2l h ARG 390 CO 0.72 0.00 0.00 0.10 -1.07 0.00 0.00 179.97 179.72 3k2l h TYR 391 N 0.00 0.00 -3.29 3.04 -0.00 -1.93 -3.43 116.97 111.36 3k2l h TYR 391 Ca 0.00 0.00 -0.51 0.00 -0.00 0.00 0.00 58.73 58.22 3k2l h TYR 391 Cb 0.72 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.45 3k2l h TYR 391 CO 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 178.16 178.09 3k2l s THR 393 N -2.23 5.21 -0.49 0.00 2.01 -1.26 -4.89 115.64 113.99 3k2l s THR 393 Ca 0.45 0.72 -0.18 0.00 0.31 0.00 0.00 61.69 62.99 3k2l s THR 393 Cb -0.10 -3.73 0.06 0.00 0.01 0.00 0.00 72.50 68.73 3k2l s THR 393 CO 0.32 0.28 0.56 -0.69 -0.69 0.00 0.00 174.62 174.40 3k2l s VAL 394 N 1.12 4.97 -0.12 3.82 1.01 -1.26 -2.12 120.40 127.81 3k2l s VAL 394 Ca 0.20 -0.58 -0.22 0.00 0.00 0.00 0.00 61.98 61.37 3k2l s VAL 394 Cb -0.15 -4.24 -0.03 0.00 0.00 0.00 0.00 36.38 31.97 3k2l s VAL 394 CO 0.08 -0.72 0.65 0.42 0.00 0.00 0.00 175.10 175.53 3k2l s THR 395 N 2.38 5.05 -0.33 3.92 -4.23 -0.31 -4.97 115.64 117.15 3k2l s THR 395 Ca 0.13 1.29 -0.06 0.00 -1.18 0.00 0.00 61.69 61.87 3k2l s THR 395 Cb -0.20 -3.98 0.03 0.00 1.34 0.00 0.00 72.50 69.69 3k2l s THR 395 CO 0.11 0.21 0.10 0.42 -0.54 0.00 0.00 174.62 174.91 3k2l s THR 396 N 1.20 3.81 0.31 3.99 -4.23 -1.26 -1.74 115.64 117.73 3k2l s THR 396 Ca 0.33 -1.02 0.07 0.00 -1.18 0.00 0.00 61.69 59.89 3k2l s THR 396 Cb -0.17 -3.11 -0.02 0.00 1.34 0.00 0.00 72.50 70.54 3k2l s THR 396 CO 0.14 -0.11 0.33 -0.76 -0.54 0.00 0.00 174.62 173.69 3k2l s LEU 397 N 1.43 3.80 -0.40 4.79 1.43 -0.52 -5.06 118.68 124.15 3k2l s LEU 397 Ca -0.01 -0.32 0.07 0.00 -1.03 0.00 0.00 54.13 52.84 3k2l s LEU 397 Cb -0.19 -2.44 0.23 0.00 0.03 0.00 0.00 46.19 43.82 3k2l s LEU 397 CO 0.03 -0.30 0.48 -1.54 0.23 0.00 0.00 176.35 175.24 3k2l n SER 398 N -1.42 -0.08 -3.64 2.29 3.41 -1.26 -4.68 113.62 108.25 3k2l n SER 398 Ca -0.03 -2.62 -0.07 0.00 -0.26 0.00 0.00 58.87 55.89 3k2l n SER 398 Cb 0.59 -0.56 -0.07 0.00 -0.26 0.00 0.00 64.21 63.91 3k2l n SER 398 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3k2l s ASP 399 N -0.85 -0.64 0.00 4.04 3.68 -1.26 -5.18 116.67 116.47 3k2l s ASP 399 Ca 0.34 1.09 0.00 0.00 2.13 0.00 0.00 52.55 56.12 3k2l s ASP 399 Cb 0.14 1.20 0.00 0.00 -1.45 0.00 0.00 42.92 42.81 3k2l s ASP 399 CO -0.14 -0.18 0.00 0.61 0.13 0.00 0.00 175.17 175.60 3k2l n GLY 400 N 3.31 -0.39 0.09 2.66 0.00 -1.26 -5.15 105.19 104.44 3k2l n GLY 400 Ca -0.17 -0.39 -0.10 0.00 0.00 0.00 0.00 46.02 45.36 3k2l n GLY 400 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3k2l n SER 401 N 0.00 1.89 -4.84 1.61 2.88 -1.26 -4.92 113.62 108.99 3k2l n SER 401 Ca 0.00 0.44 -0.37 0.00 -1.33 0.00 0.00 58.87 57.61 3k2l n SER 401 Cb 0.00 -0.81 -0.06 0.00 -0.75 0.00 0.00 64.21 62.59 3k2l n SER 401 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3k2l s VAL 402 N -2.62 5.45 -0.11 2.46 1.01 -1.26 -1.43 120.40 123.90 3k2l s VAL 402 Ca -0.25 0.26 0.02 0.00 0.00 0.00 0.00 61.98 62.01 3k2l s VAL 402 Cb 0.04 -3.45 0.01 0.00 0.00 0.00 0.00 36.38 32.99 3k2l s VAL 402 CO 0.37 0.57 -0.16 -0.69 0.00 0.00 0.00 175.10 175.19 3k2l s VAL 403 N -0.65 1.53 -0.26 2.92 1.01 -0.71 -4.99 120.40 119.24 3k2l s VAL 403 Ca 0.14 -0.66 -0.11 0.00 0.00 0.00 0.00 61.98 61.35 3k2l s VAL 403 Cb -0.12 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.82 3k2l s VAL 403 CO 0.03 0.45 0.18 -0.76 0.00 0.00 0.00 175.10 174.99 3k2l s LEU 404 N 0.94 4.05 -0.03 3.92 1.43 -1.26 -1.17 118.68 126.56 3k2l s LEU 404 Ca -0.07 0.03 0.20 0.00 -1.03 0.00 0.00 54.13 53.26 3k2l s LEU 404 Cb -0.15 -2.11 -0.30 0.00 0.03 0.00 0.00 46.19 43.66 3k2l s LEU 404 CO -0.01 -0.00 0.42 0.59 0.23 0.00 0.00 176.35 177.58 3k2l n ASN 405 N 4.74 0.52 0.00 2.29 4.13 -0.90 -4.76 115.26 121.28 3k2l n ASN 405 Ca -0.14 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.12 3k2l n ASN 405 Cb 0.52 1.88 0.00 0.00 -1.54 0.00 0.00 39.78 40.64 3k2l n ASN 405 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3k2l n GLY 406 N 1.40 1.20 3.36 7.41 0.00 -1.26 -4.22 105.19 113.07 3k2l n GLY 406 Ca -0.04 -1.61 -0.10 0.00 0.00 0.00 0.00 46.02 44.27 3k2l n GLY 406 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3k2l s GLY 407 N -0.53 0.84 -0.15 -0.02 0.00 -0.45 -4.30 107.32 102.71 3k2l s GLY 407 Ca 0.00 -1.19 -0.15 0.00 0.00 0.00 0.00 44.72 43.38 3k2l s GLY 407 CO 0.00 -0.99 0.33 0.50 0.00 0.00 0.00 173.10 172.94 3k2l s ARG 408 N -4.05 4.28 1.13 2.90 0.52 -1.26 -1.04 118.95 121.43 3k2l s ARG 408 Ca 0.26 0.17 -0.17 0.00 -0.52 0.00 0.00 55.73 55.48 3k2l s ARG 408 Cb 0.04 -3.43 0.16 0.00 0.52 0.00 0.00 34.95 32.24 3k2l s ARG 408 CO 0.07 0.21 0.34 -1.13 0.02 0.00 0.00 175.30 174.81 3k2l n SER 409 N 3.62 -2.17 -0.05 0.23 3.41 -0.22 -4.83 113.62 113.61 3k2l n SER 409 Ca -0.11 -0.12 -0.02 0.00 -0.26 0.00 0.00 58.87 58.36 3k2l n SER 409 Cb 0.52 -1.06 0.23 0.00 -0.26 0.00 0.00 64.21 63.64 3k2l n SER 409 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3k2l h ARG 410 N -2.26 0.65 0.00 4.33 9.65 -1.98 -0.99 114.38 123.79 3k2l h ARG 410 Ca -0.56 -0.16 0.00 0.00 -1.10 0.00 0.00 59.98 58.16 3k2l h ARG 410 Cb 1.35 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.84 3k2l h ARG 410 CO 0.42 0.67 0.00 0.07 2.80 0.00 0.00 179.97 183.93 3k2l h ARG 411 N 0.62 0.00 0.00 0.20 0.11 -1.99 -3.46 114.38 109.86 3k2l h ARG 411 Ca 0.13 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.21 3k2l h ARG 411 Cb 0.39 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.47 3k2l h ARG 411 CO 0.01 0.00 0.00 0.41 0.10 0.00 0.00 179.97 180.49 3k2l n GLY 412 N -0.06 1.36 3.63 0.08 0.00 -0.38 -5.10 105.19 104.72 3k2l n GLY 412 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 3k2l n GLY 412 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3k2l s LYS 413 N -0.04 4.08 0.11 1.61 2.47 -1.26 -4.78 119.74 121.92 3k2l s LYS 413 Ca 0.00 0.16 -0.31 0.00 -1.56 0.00 0.00 55.97 54.26 3k2l s LYS 413 Cb 0.00 -3.62 -0.08 0.00 -1.46 0.00 0.00 37.83 32.67 3k2l s LYS 413 CO 0.00 -0.22 1.48 -1.17 0.16 0.00 0.00 175.35 175.60 3k2l s LEU 414 N 1.90 4.36 -0.18 5.43 2.96 -1.26 -1.05 118.68 130.83 3k2l s LEU 414 Ca 0.18 2.40 -0.03 0.00 -0.22 0.00 0.00 54.13 56.46 3k2l s LEU 414 Cb -0.15 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 42.94 3k2l s LEU 414 CO 0.09 -0.74 -0.07 -0.13 -1.32 0.00 0.00 176.35 174.18 3k2l s ARG 415 N 1.51 3.43 1.02 1.98 1.81 -0.21 -4.94 118.95 123.55 3k2l s ARG 415 Ca 0.67 -0.62 -0.12 0.00 -1.72 0.00 0.00 55.73 53.94 3k2l s ARG 415 Cb -0.38 -2.88 0.20 0.00 -0.45 0.00 0.00 34.95 31.43 3k2l s ARG 415 CO 0.30 0.00 1.08 0.20 -0.68 0.00 0.00 175.30 176.20 3k2l s GLY 416 N 0.94 1.59 1.16 -3.53 0.00 -1.26 -1.35 107.32 104.87 3k2l s GLY 416 Ca -0.01 -0.09 -0.14 0.00 0.00 0.00 0.00 44.72 44.49 3k2l s GLY 416 CO 0.00 0.50 1.03 2.56 0.00 0.00 0.00 173.10 177.20 3k2l s PRO 417 N -4.75 -0.86 0.06 2.90 0.04 -1.26 -4.63 135.00 126.51 3k2l s PRO 417 Ca 0.66 0.66 -0.37 0.00 0.04 0.00 0.00 61.00 61.99 3k2l s PRO 417 Cb -0.21 -1.57 -0.18 0.00 0.04 0.00 0.00 34.50 32.57 3k2l s PRO 417 CO 0.60 -3.64 1.12 -2.30 0.04 0.00 0.00 177.00 172.82 3k2l n PRO 418 N -4.83 0.50 -3.34 0.56 -0.02 -1.26 -2.18 135.00 124.43 3k2l n PRO 418 Ca 0.04 0.18 -0.24 0.00 -2.02 0.00 0.00 63.50 61.46 3k2l n PRO 418 Cb 0.56 -1.68 0.01 0.00 -0.02 0.00 0.00 33.50 32.36 3k2l n PRO 418 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3k2l n GLU 419 N 1.80 -3.93 0.07 -0.52 2.13 -0.58 -4.84 120.64 114.77 3k2l n GLU 419 Ca 0.19 0.58 0.11 0.00 0.66 0.00 0.00 57.16 58.71 3k2l n GLU 419 Cb 0.15 -5.34 0.01 0.00 0.27 0.00 0.00 31.44 26.52 3k2l n GLU 419 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 3k2l n SER 420 N -2.39 0.67 -4.47 4.31 2.88 -0.21 -4.83 113.62 109.58 3k2l n SER 420 Ca -0.03 0.13 -0.39 0.00 -1.33 0.00 0.00 58.87 57.25 3k2l n SER 420 Cb 0.56 0.68 -0.11 0.00 -0.75 0.00 0.00 64.21 64.58 3k2l n SER 420 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 3k2l s ARG 421 N -3.32 3.40 0.28 -1.46 3.52 -1.02 -5.00 118.95 115.35 3k2l s ARG 421 Ca 0.00 -0.69 -0.29 0.00 -0.13 0.00 0.00 55.73 54.63 3k2l s ARG 421 Cb 0.12 -3.63 -0.10 0.00 -1.56 0.00 0.00 34.95 29.78 3k2l s ARG 421 CO 0.80 -0.42 1.14 -1.21 -0.81 0.00 0.00 175.30 174.80 3k2l s GLU 422 N 1.65 4.58 0.28 5.12 2.02 -1.26 -4.69 118.70 126.40 3k2l s GLU 422 Ca 0.05 1.88 0.00 0.00 0.02 0.00 0.00 54.97 56.92 3k2l s GLU 422 Cb -0.17 -3.17 0.51 0.00 0.10 0.00 0.00 34.13 31.39 3k2l s GLU 422 CO 0.08 0.12 1.86 -1.49 0.02 0.00 0.00 175.26 175.84 3k2l h TRP 423 N 3.88 1.15 -0.88 1.61 4.06 -1.97 -0.65 115.95 123.15 3k2l h TRP 423 Ca -0.47 0.03 0.22 0.00 2.06 0.00 0.00 58.89 60.74 3k2l h TRP 423 Cb 1.21 -0.37 -0.13 0.00 -1.00 0.00 0.00 29.16 28.87 3k2l h TRP 423 CO 0.59 0.52 0.32 0.78 -3.56 0.00 0.00 178.44 177.08 3k2l h GLY 424 N 1.06 1.44 1.27 1.49 0.00 -1.92 -1.67 103.07 104.74 3k2l h GLY 424 Ca 0.46 -0.11 -0.30 0.00 0.00 0.00 0.00 47.33 47.38 3k2l h GLY 424 CO -0.22 -0.31 -1.29 3.43 0.00 0.00 0.00 176.54 178.16 3k2l h ASN 425 N 0.31 0.84 -0.23 0.19 -0.26 -1.54 -2.48 115.58 112.41 3k2l h ASN 425 Ca 0.55 -0.81 -0.04 0.00 -0.56 0.00 0.00 56.30 55.45 3k2l h ASN 425 Cb 1.07 -0.27 -0.02 0.00 -1.06 0.00 0.00 38.32 38.04 3k2l h ASN 425 CO -0.58 1.61 0.05 0.00 -1.06 0.00 0.00 177.43 177.45 3k2l h ALA 426 N 0.29 1.48 -0.56 -0.83 0.00 -0.61 -2.43 119.26 116.61 3k2l h ALA 426 Ca -0.20 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 3k2l h ALA 426 Cb 1.96 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.57 3k2l h ALA 426 CO 0.24 0.38 0.08 1.28 0.00 0.00 0.00 179.25 181.23 3k2l n LEU 427 N -4.33 5.51 -3.94 0.00 4.77 -0.69 -4.97 117.00 113.35 3k2l n LEU 427 Ca 0.01 -3.06 -0.29 0.00 -0.03 0.00 0.00 56.01 52.65 3k2l n LEU 427 Cb 0.20 -0.68 0.01 0.00 -2.33 0.00 0.00 43.42 40.62 3k2l n LEU 427 CO 0.38 0.70 -0.03 0.29 -1.33 0.00 0.00 177.39 177.41 3k2l n LYS 428 N 0.16 -4.47 -3.10 3.23 4.01 -0.91 -1.41 118.16 115.67 3k2l n LYS 428 Ca 0.31 0.52 -0.14 0.00 -0.51 0.00 0.00 58.31 58.49 3k2l n LYS 428 Cb 1.20 -5.15 0.05 0.00 -0.51 0.00 0.00 35.03 30.62 3k2l n LYS 428 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3k2l n GLY 429 N -1.67 0.04 3.70 0.72 0.00 -0.94 -5.02 105.19 102.02 3k2l n GLY 429 Ca -0.10 -0.12 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 3k2l n GLY 429 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2l n ASP 431 N 4.24 2.34 -4.63 0.00 9.92 -1.26 -4.93 116.55 122.23 3k2l n ASP 431 Ca -0.01 -1.66 -0.43 0.00 -0.53 0.00 0.00 54.79 52.16 3k2l n ASP 431 Cb 0.51 -0.04 -0.02 0.00 -0.64 0.00 0.00 41.12 40.93 3k2l n ASP 431 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3k2l s ASP 432 N -1.20 6.60 0.44 -2.24 3.68 -1.26 -4.90 116.67 117.80 3k2l s ASP 432 Ca 0.19 1.24 0.23 0.00 2.13 0.00 0.00 52.55 56.34 3k2l s ASP 432 Cb 0.13 -2.54 0.35 0.00 -1.45 0.00 0.00 42.92 39.41 3k2l s ASP 432 CO 0.19 -1.14 1.61 1.55 0.13 0.00 0.00 175.17 177.51 3k2l h PRO 433 N 9.63 0.00 -0.55 4.34 0.13 -2.00 -2.78 132.00 140.77 3k2l h PRO 433 Ca -0.27 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.79 3k2l h PRO 433 Cb 1.11 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 3k2l h PRO 433 CO 1.03 0.00 0.06 -0.07 -0.23 0.00 0.00 178.00 178.79 3k2l h LEU 434 N 0.00 0.85 0.00 1.56 3.38 -1.98 -2.75 115.31 116.37 3k2l h LEU 434 Ca -0.00 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.68 3k2l h LEU 434 Cb 0.99 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 41.53 3k2l h LEU 434 CO 0.00 0.88 -0.37 0.15 0.09 0.00 0.00 178.44 179.19 3k2l h PHE 435 N 0.84 0.37 -0.47 1.13 3.57 -1.93 -1.15 116.94 119.30 3k2l h PHE 435 Ca 0.17 -0.20 0.09 0.00 3.53 0.00 0.00 57.97 61.56 3k2l h PHE 435 Cb 0.42 -0.04 -0.09 0.00 2.79 0.00 0.00 35.95 39.03 3k2l h PHE 435 CO 0.03 1.02 -0.08 1.25 -2.23 0.00 0.00 178.31 178.29 3k2l h LEU 436 N -0.37 -0.37 0.02 0.59 5.85 -1.57 0.68 115.31 120.13 3k2l h LEU 436 Ca -0.05 0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 3k2l h LEU 436 Cb 1.12 0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.41 3k2l h LEU 436 CO 0.07 -0.13 -0.01 -0.78 -0.34 0.00 0.00 178.44 177.25 3k2l h ASP 437 N 0.03 -0.03 -0.96 1.25 3.58 -1.44 0.22 116.42 119.08 3k2l h ASP 437 Ca 0.23 -0.14 0.30 0.00 0.42 0.00 0.00 57.03 57.85 3k2l h ASP 437 Cb 0.35 0.01 -0.16 0.00 1.72 0.00 0.00 39.33 41.25 3k2l h ASP 437 CO -0.46 0.12 0.32 0.15 -2.88 0.00 0.00 179.24 176.49 3k2l h PHE 438 N -0.17 0.48 0.11 0.28 3.04 -0.78 -0.17 116.94 119.74 3k2l h PHE 438 Ca -0.00 0.05 -0.25 0.00 3.98 0.00 0.00 57.97 61.75 3k2l h PHE 438 Cb 0.16 -0.05 0.03 0.00 2.56 0.00 0.00 35.95 38.64 3k2l h PHE 438 CO -0.03 -0.32 -1.05 1.25 -2.02 0.00 0.00 178.31 176.14 3k2l h LEU 439 N 0.13 0.73 -1.40 0.59 5.85 0.52 -2.76 115.31 118.97 3k2l h LEU 439 Ca 0.67 -0.84 0.01 0.00 0.84 0.00 0.00 57.88 58.55 3k2l h LEU 439 Cb 1.52 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 42.29 3k2l h LEU 439 CO -0.74 1.50 0.41 0.11 -0.34 0.00 0.00 178.44 179.38 3k2l h LYS 440 N 0.06 0.80 -0.17 1.25 1.57 0.35 -1.57 116.57 118.88 3k2l h LYS 440 Ca -0.16 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.48 3k2l h LYS 440 Cb 1.77 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.88 3k2l h LYS 440 CO 0.20 0.53 -0.31 1.96 -0.57 0.00 0.00 179.45 181.26 3k2l h GLN 441 N 0.83 0.32 0.00 3.15 4.20 -1.05 -2.47 115.11 120.09 3k2l h GLN 441 Ca 0.23 -0.13 -0.08 0.00 0.06 0.00 0.00 58.65 58.73 3k2l h GLN 441 Cb -0.09 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 3k2l h GLN 441 CO -0.05 0.61 -0.40 0.00 -0.67 0.00 0.00 178.83 178.32 3k2l n LEU 443 N -3.74 4.81 -4.71 0.00 4.77 -0.89 -3.91 117.00 113.33 3k2l n LEU 443 Ca -0.01 -3.28 -0.43 0.00 -0.03 0.00 0.00 56.01 52.26 3k2l n LEU 443 Cb 0.48 -0.65 -0.03 0.00 -2.33 0.00 0.00 43.42 40.89 3k2l n LEU 443 CO 0.38 0.87 1.31 -0.62 -1.33 0.00 0.00 177.39 178.00 3k2l n GLU 444 N -0.53 2.62 -0.20 3.23 -0.58 -1.04 -4.90 120.64 119.25 3k2l n GLU 444 Ca 0.32 0.94 -0.02 0.00 -0.42 0.00 0.00 57.16 57.98 3k2l n GLU 444 Cb 1.12 -2.76 0.08 0.00 -0.57 0.00 0.00 31.44 29.31 3k2l n GLU 444 CO 0.00 0.00 0.00 -1.49 -0.48 0.00 0.00 177.13 175.16 3k2l h TRP 445 N 6.32 0.53 -3.41 -0.32 4.06 -1.93 -3.40 115.95 117.81 3k2l h TRP 445 Ca -0.44 0.02 -0.59 0.00 2.06 0.00 0.00 58.89 59.95 3k2l h TRP 445 Cb 1.22 -0.15 -0.08 0.00 -1.00 0.00 0.00 29.16 29.14 3k2l h TRP 445 CO 0.63 0.23 0.64 0.34 -3.56 0.00 0.00 178.44 176.72 3k2l s ASP 446 N -5.51 6.77 0.51 -3.49 2.15 -1.26 -4.82 116.67 111.03 3k2l s ASP 446 Ca -0.13 0.78 0.19 0.00 0.43 0.00 0.00 52.55 53.83 3k2l s ASP 446 Cb 0.15 -2.48 1.31 0.00 -0.30 0.00 0.00 42.92 41.61 3k2l s ASP 446 CO 0.75 -0.80 2.11 1.55 -0.17 0.00 0.00 175.17 178.61 3k2l h PRO 447 N 8.23 0.00 0.00 4.34 0.13 -1.95 -0.64 132.00 142.11 3k2l h PRO 447 Ca -0.22 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.85 3k2l h PRO 447 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 3k2l h PRO 447 CO 0.98 0.07 -0.27 0.00 -0.23 0.00 0.00 178.00 178.54 3k2l h ALA 448 N 1.93 1.09 0.00 -0.56 0.00 -1.94 -2.88 119.26 116.90 3k2l h ALA 448 Ca -0.00 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 3k2l h ALA 448 Cb 0.14 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3k2l h ALA 448 CO 0.01 0.34 -1.30 0.28 0.00 0.00 0.00 179.25 178.58 3k2l n VAL 449 N -3.55 0.83 -1.77 0.00 0.31 -0.33 -4.95 118.33 108.87 3k2l n VAL 449 Ca -0.01 -0.61 -0.41 0.00 -0.01 0.00 0.00 64.34 63.30 3k2l n VAL 449 Cb 0.42 -0.48 -0.00 0.00 -0.91 0.00 0.00 33.84 32.86 3k2l n VAL 449 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 3k2l n ARG 450 N -2.73 2.70 -1.75 5.55 0.63 -0.73 -4.90 116.66 115.43 3k2l n ARG 450 Ca -0.05 0.95 -0.40 0.00 -0.92 0.00 0.00 57.85 57.43 3k2l n ARG 450 Cb 0.69 -2.70 0.02 0.00 0.45 0.00 0.00 32.46 30.92 3k2l n ARG 450 CO 0.00 0.00 0.00 -0.12 -2.51 0.00 0.00 177.63 175.00 3k2l n MET 451 N 0.78 2.15 -3.18 -0.14 0.00 -0.88 -5.01 117.12 110.84 3k2l n MET 451 Ca 0.03 0.77 -0.20 0.00 -0.00 0.00 0.00 57.70 58.29 3k2l n MET 451 Cb 0.39 -2.57 0.01 0.00 0.00 0.00 0.00 33.22 31.04 3k2l n MET 451 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 3k2l s THR 452 N -1.20 3.81 0.14 1.12 -4.23 -1.26 -4.89 115.64 109.13 3k2l s THR 452 Ca 0.62 -0.79 -0.23 0.00 -1.18 0.00 0.00 61.69 60.10 3k2l s THR 452 Cb -0.46 -3.36 0.01 0.00 1.34 0.00 0.00 72.50 70.03 3k2l s THR 452 CO 0.57 -0.19 1.63 -0.65 -0.54 0.00 0.00 174.62 175.45 3k2l h PRO 453 N 0.61 -0.27 -0.91 3.99 0.11 -1.95 0.14 132.00 133.72 3k2l h PRO 453 Ca -0.45 0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.76 3k2l h PRO 453 Cb 1.26 0.06 -0.07 0.00 0.11 0.00 0.00 31.00 32.36 3k2l h PRO 453 CO 0.54 -0.18 0.57 0.78 -0.21 0.00 0.00 178.00 179.49 3k2l h GLY 454 N -0.28 1.40 0.96 -0.55 0.00 -1.94 0.23 103.07 102.89 3k2l h GLY 454 Ca 0.12 -0.40 -0.05 0.00 0.00 0.00 0.00 47.33 47.00 3k2l h GLY 454 CO -0.35 0.24 0.07 1.46 0.00 0.00 0.00 176.54 177.96 3k2l h GLN 455 N 1.00 0.72 -0.67 4.80 4.20 -1.90 -3.00 115.11 120.26 3k2l h GLN 455 Ca 0.41 -0.19 0.12 0.00 0.06 0.00 0.00 58.65 59.04 3k2l h GLN 455 Cb 0.25 -0.08 -0.08 0.00 0.30 0.00 0.00 27.48 27.86 3k2l h GLN 455 CO -0.20 0.75 0.24 0.00 -0.67 0.00 0.00 178.83 178.96 3k2l h ALA 456 N 0.94 0.89 0.00 3.87 0.00 0.15 0.10 119.26 125.21 3k2l h ALA 456 Ca 0.13 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 3k2l h ALA 456 Cb 0.38 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3k2l h ALA 456 CO 0.01 -0.21 -0.12 -0.07 0.00 0.00 0.00 179.25 178.86 3k2l h LEU 457 N 0.41 0.00 -2.37 0.00 3.38 -1.11 -0.58 115.31 115.03 3k2l h LEU 457 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 3k2l h LEU 457 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 3k2l h LEU 457 CO -0.36 0.12 0.00 0.54 0.09 0.00 0.00 178.44 178.82 3k2l n ARG 458 N -3.79 2.54 -2.34 1.13 1.74 -0.09 -4.10 116.66 111.75 3k2l n ARG 458 Ca -0.02 -2.34 -0.40 0.00 -0.77 0.00 0.00 57.85 54.32 3k2l n ARG 458 Cb 0.22 -1.52 -0.03 0.00 -1.02 0.00 0.00 32.46 30.10 3k2l n ARG 458 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 3k2l s HIS 459 N -1.43 3.35 0.46 -1.55 2.46 -0.23 -4.70 115.29 113.64 3k2l s HIS 459 Ca 0.40 1.59 0.29 0.00 0.47 0.00 0.00 55.06 57.81 3k2l s HIS 459 Cb 0.23 -3.43 1.36 0.00 -0.13 0.00 0.00 32.58 30.62 3k2l s HIS 459 CO 0.32 -1.06 1.72 -1.35 -2.47 0.00 0.00 174.74 171.90 3k2l h PRO 460 N 3.54 0.17 -0.83 2.88 0.11 -1.92 0.50 132.00 136.46 3k2l h PRO 460 Ca -0.48 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 3k2l h PRO 460 Cb 1.22 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 3k2l h PRO 460 CO 0.66 0.11 0.50 2.35 -0.21 0.00 0.00 178.00 181.41 3k2l h TRP 461 N 0.17 1.09 0.00 0.65 7.01 -1.91 -3.29 115.95 119.68 3k2l h TRP 461 Ca 0.68 -0.00 -0.07 0.00 2.11 0.00 0.00 58.89 61.61 3k2l h TRP 461 Cb 2.19 -0.36 -0.01 0.00 -2.10 0.00 0.00 29.16 28.88 3k2l h TRP 461 CO -0.00 0.73 -1.97 1.28 -2.79 0.00 0.00 178.44 175.68 3k2l n LEU 462 N -4.45 0.10 -4.67 0.65 4.77 0.14 -4.96 117.00 108.58 3k2l n LEU 462 Ca 0.08 0.04 -0.42 0.00 -0.03 0.00 0.00 56.01 55.68 3k2l n LEU 462 Cb 0.05 0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 3k2l n LEU 462 CO 0.37 0.07 1.59 -1.14 -1.33 0.00 0.00 177.39 176.96 3k2l n ARG 463 N -2.40 2.85 -3.86 3.23 3.00 0.70 -4.96 116.66 115.22 3k2l n ARG 463 Ca -0.09 1.04 -0.30 0.00 -0.00 0.00 0.00 57.85 58.51 3k2l n ARG 463 Cb 0.68 -2.99 -0.16 0.00 0.00 0.00 0.00 32.46 29.99 3k2l n ARG 463 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 3k2l s ARG 464 N 4.23 1.23 -0.66 -0.14 0.52 -1.26 -4.95 118.95 117.92 3k2l s ARG 464 Ca 0.88 -0.92 -0.25 0.00 -0.52 0.00 0.00 55.73 54.92 3k2l s ARG 464 Cb -0.45 -2.42 0.05 0.00 0.52 0.00 0.00 34.95 32.65 3k2l s ARG 464 CO 0.42 -0.69 1.10 1.03 0.02 0.00 0.00 175.30 177.18 3k2l s ARG 465 N 1.51 3.23 0.12 3.54 1.81 -1.26 -5.03 118.95 122.87 3k2l s ARG 465 Ca -0.01 -0.37 -0.11 0.00 -1.72 0.00 0.00 55.73 53.52 3k2l s ARG 465 Cb -0.18 -4.15 -0.06 0.00 -0.45 0.00 0.00 34.95 30.11 3k2l s ARG 465 CO -0.10 -1.86 0.45 -0.51 -0.68 0.00 0.00 175.30 172.61 3k2l s LEU 466 N 4.76 4.32 0.67 2.53 1.43 -1.26 -5.04 118.68 126.10 3k2l s LEU 466 Ca 0.31 0.87 -0.17 0.00 -1.03 0.00 0.00 54.13 54.11 3k2l s LEU 466 Cb -0.12 -3.15 0.00 0.00 0.03 0.00 0.00 46.19 42.96 3k2l s LEU 466 CO 0.16 0.12 1.26 -2.84 0.23 0.00 0.00 176.35 175.28 3k2l s PRO 467 N -2.06 2.43 0.17 1.29 0.02 -1.26 -5.02 135.00 130.58 3k2l s PRO 467 Ca 0.36 1.94 0.11 0.00 0.02 0.00 0.00 61.00 63.43 3k2l s PRO 467 Cb -0.14 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.49 3k2l s PRO 467 CO 0.19 -1.66 -0.24 0.15 -0.33 0.00 0.00 177.00 175.11 3k2l s LYS 468 N -3.55 1.45 0.00 5.54 -0.14 -1.26 -5.04 119.74 116.74 3k2l s LYS 468 Ca 0.79 -1.46 0.00 0.00 -1.36 0.00 0.00 55.97 53.95 3k2l s LYS 468 Cb -0.34 -1.80 0.00 0.00 -1.68 0.00 0.00 37.83 34.01 3k2l s LYS 468 CO 0.41 0.40 0.70 -2.30 -0.76 0.00 0.00 175.35 173.80 3k2l n PRO 469 N 0.47 0.00 0.00 -1.68 -0.02 -1.26 -5.34 135.00 127.16 3k2l n PRO 469 Ca -0.14 0.24 0.05 0.00 -2.02 0.00 0.00 63.50 61.62 3k2l n PRO 469 Cb 0.55 -1.69 0.04 0.00 -0.02 0.00 0.00 33.50 32.38 3k2l n PRO 469 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13