#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k0g s LYS 2 N 0.00 3.38 0.00 2.12 1.02 -0.69 -4.79 119.74 120.78 1k0g s LYS 2 Ca 0.00 -0.15 0.24 0.00 0.02 0.00 0.00 55.97 56.07 1k0g s LYS 2 Cb 0.00 -4.01 0.16 0.00 -0.52 0.00 0.00 37.83 33.46 1k0g s LYS 2 CO 0.00 -1.38 1.23 0.25 -0.92 0.00 0.00 175.35 174.53 1k0g n THR 3 N 6.24 0.00 -1.53 2.17 -2.24 -1.26 0.90 114.28 118.56 1k0g n THR 3 Ca 0.03 -0.47 -0.48 0.00 -2.27 0.00 0.00 64.05 60.86 1k0g n THR 3 Cb 0.48 1.46 -0.03 0.00 -2.10 0.00 0.00 70.33 70.14 1k0g n THR 3 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1k0g n LEU 4 N 1.14 0.76 -4.75 3.22 4.77 -1.26 -4.10 117.00 116.78 1k0g n LEU 4 Ca 0.13 1.15 -0.30 0.00 -0.03 0.00 0.00 56.01 56.96 1k0g n LEU 4 Cb 0.57 -1.15 0.11 0.00 -2.33 0.00 0.00 43.42 40.63 1k0g n LEU 4 CO 0.17 -1.83 0.69 -0.94 -1.33 0.00 0.00 177.39 174.14 1k0g s SER 5 N -0.45 4.11 0.59 -1.43 1.04 -1.26 -4.50 113.70 111.79 1k0g s SER 5 Ca 0.67 1.62 -0.16 0.00 0.48 0.00 0.00 55.95 58.57 1k0g s SER 5 Cb -0.85 -2.33 -0.04 0.00 0.10 0.00 0.00 66.02 62.90 1k0g s SER 5 CO 0.56 -2.26 1.05 -2.16 0.98 0.00 0.00 173.24 171.42 1k0g s PRO 6 N -4.95 3.35 0.40 4.02 0.04 -1.26 -4.96 135.00 131.65 1k0g s PRO 6 Ca 0.62 1.20 -0.24 0.00 0.04 0.00 0.00 61.00 62.62 1k0g s PRO 6 Cb -0.17 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.24 1k0g s PRO 6 CO 0.56 -0.78 1.03 0.00 0.04 0.00 0.00 177.00 177.85 1k0g s ALA 7 N -2.44 3.07 -0.01 8.56 0.00 0.88 -4.75 121.76 127.07 1k0g s ALA 7 Ca 0.64 0.64 0.04 0.00 0.00 0.00 0.00 51.96 53.27 1k0g s ALA 7 Cb -0.16 -3.25 -0.01 0.00 0.00 0.00 0.00 23.12 19.71 1k0g s ALA 7 CO 0.36 -0.14 -0.12 0.08 0.00 0.00 0.00 175.76 175.94 1k0g s VAL 8 N -1.74 0.95 -0.02 0.00 1.01 -1.26 -1.23 120.40 118.11 1k0g s VAL 8 Ca 0.58 -0.51 0.08 0.00 0.00 0.00 0.00 61.98 62.13 1k0g s VAL 8 Cb -0.20 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.37 1k0g s VAL 8 CO 0.25 0.27 -0.25 -0.63 0.00 0.00 0.00 175.10 174.74 1k0g s ILE 9 N -0.23 1.99 0.11 2.22 1.01 0.13 -4.98 121.20 121.45 1k0g s ILE 9 Ca 0.04 -1.07 0.02 0.00 0.00 0.00 0.00 60.65 59.63 1k0g s ILE 9 Cb -0.05 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.72 1k0g s ILE 9 CO -0.00 0.56 0.20 0.42 0.00 0.00 0.00 174.94 176.12 1k0g s THR 10 N -0.53 5.07 0.27 2.92 -4.23 -1.26 -1.23 115.64 116.65 1k0g s THR 10 Ca 0.08 -0.65 0.11 0.00 -1.18 0.00 0.00 61.69 60.05 1k0g s THR 10 Cb -0.10 -3.53 -0.05 0.00 1.34 0.00 0.00 72.50 70.16 1k0g s THR 10 CO -0.00 0.03 -0.16 -0.76 -0.54 0.00 0.00 174.62 173.19 1k0g s LEU 11 N -2.79 2.72 0.56 4.79 1.43 0.10 -4.96 118.68 120.53 1k0g s LEU 11 Ca 0.33 -0.93 -0.21 0.00 -1.03 0.00 0.00 54.13 52.30 1k0g s LEU 11 Cb -0.12 -1.25 -0.04 0.00 0.03 0.00 0.00 46.19 44.81 1k0g s LEU 11 CO 0.26 0.04 1.26 -0.76 0.23 0.00 0.00 176.35 177.38 1k0g s LEU 12 N -3.48 3.79 0.34 1.79 2.01 -1.26 -4.24 118.68 117.63 1k0g s LEU 12 Ca 0.30 2.53 -0.27 0.00 0.01 0.00 0.00 54.13 56.70 1k0g s LEU 12 Cb -0.06 -4.42 -0.09 0.00 0.01 0.00 0.00 46.19 41.63 1k0g s LEU 12 CO 0.16 -1.51 1.16 0.86 1.01 0.00 0.00 176.35 178.03 1k0g s TRP 13 N -1.46 3.27 -0.16 0.29 -0.11 -1.26 -4.77 118.94 114.74 1k0g s TRP 13 Ca 0.73 1.59 -0.15 0.00 1.22 0.00 0.00 56.10 59.49 1k0g s TRP 13 Cb -0.34 -3.38 0.04 0.00 -1.50 0.00 0.00 33.47 28.29 1k0g s TRP 13 CO 0.39 -1.07 0.44 -0.98 -4.62 0.00 0.00 176.95 171.11 1k0g s ARG 14 N -1.91 0.51 0.00 5.86 1.70 -1.26 -5.03 118.95 118.82 1k0g s ARG 14 Ca 0.51 0.60 0.00 0.00 -0.47 0.00 0.00 55.73 56.37 1k0g s ARG 14 Cb -0.32 0.25 0.00 0.00 -0.57 0.00 0.00 34.95 34.31 1k0g s ARG 14 CO 0.41 -0.06 0.61 0.94 -1.08 0.00 0.00 175.30 176.12 1k0g n GLN 15 N 2.83 0.63 -0.49 3.89 7.27 -1.26 -1.90 117.38 128.35 1k0g n GLN 15 Ca -0.13 0.00 0.01 0.00 0.07 0.00 0.00 57.00 56.95 1k0g n GLN 15 Cb 0.57 -1.02 0.02 0.00 2.41 0.00 0.00 30.24 32.22 1k0g n GLN 15 CO 0.00 0.00 0.00 -0.40 0.07 0.00 0.00 177.06 176.73 1k0g n ASP 16 N -0.46 0.30 -0.24 1.69 5.75 -1.26 -4.93 116.55 117.41 1k0g n ASP 16 Ca 0.00 -2.13 0.03 0.00 -0.01 0.00 0.00 54.79 52.68 1k0g n ASP 16 Cb 0.01 -0.23 0.15 0.00 -1.03 0.00 0.00 41.12 40.02 1k0g n ASP 16 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1k0g h ALA 17 N 0.04 0.94 -0.23 2.12 0.00 -1.78 -0.26 119.26 120.08 1k0g h ALA 17 Ca -0.01 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1k0g h ALA 17 Cb 1.37 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1k0g h ALA 17 CO 0.00 -0.20 0.15 0.00 0.00 0.00 0.00 179.25 179.20 1k0g h ALA 18 N 1.50 0.30 0.00 0.00 0.00 -1.92 0.13 119.26 119.27 1k0g h ALA 18 Ca 0.37 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.19 1k0g h ALA 18 Cb 0.52 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1k0g h ALA 18 CO -0.37 -0.22 -0.31 0.93 0.00 0.00 0.00 179.25 179.28 1k0g h GLU 19 N 0.31 0.00 0.16 0.00 5.08 -1.81 -0.82 114.58 117.50 1k0g h GLU 19 Ca 0.09 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1k0g h GLU 19 Cb -0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.23 1k0g h GLU 19 CO -0.02 0.31 -0.07 0.35 -1.00 0.00 0.00 179.01 178.58 1k0g h PHE 20 N 0.00 -0.19 -0.10 4.33 3.57 0.09 0.36 116.94 124.99 1k0g h PHE 20 Ca -0.00 -0.00 -0.16 0.00 3.53 0.00 0.00 57.97 61.33 1k0g h PHE 20 Cb 0.56 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.36 1k0g h PHE 20 CO 0.00 0.09 -0.64 1.88 -2.23 0.00 0.00 178.31 177.41 1k0g h TYR 21 N -0.48 0.50 0.00 0.41 0.05 -0.69 -3.31 116.97 113.46 1k0g h TYR 21 Ca -0.02 -0.20 -0.13 0.00 0.05 0.00 0.00 58.73 58.43 1k0g h TYR 21 Cb 0.37 -0.09 -0.02 0.00 1.01 0.00 0.00 36.73 38.01 1k0g h TYR 21 CO 0.01 0.92 -0.63 0.35 -1.05 0.00 0.00 178.16 177.76 1k0g h PHE 22 N 0.28 0.00 -0.91 4.88 3.57 -1.05 -3.32 116.94 120.39 1k0g h PHE 22 Ca -0.01 0.00 0.17 0.00 3.53 0.00 0.00 57.97 61.65 1k0g h PHE 22 Cb 1.18 0.00 -0.16 0.00 2.79 0.00 0.00 35.95 39.76 1k0g h PHE 22 CO 0.04 0.62 -0.28 0.43 -2.23 0.00 0.00 178.31 176.89 1k0g n SER 23 N -3.25 -0.44 -0.07 0.41 7.64 0.11 0.19 113.62 118.20 1k0g n SER 23 Ca 0.01 1.58 0.11 0.00 1.01 0.00 0.00 58.87 61.58 1k0g n SER 23 Cb 0.79 -0.43 0.60 0.00 -1.01 0.00 0.00 64.21 64.15 1k0g n SER 23 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1k0g n ARG 24 N -5.43 1.09 0.00 1.43 1.85 -1.25 -3.02 116.66 111.34 1k0g n ARG 24 Ca 0.12 -0.14 0.04 0.00 -1.00 0.00 0.00 57.85 56.88 1k0g n ARG 24 Cb 0.42 -1.34 0.00 0.00 -1.05 0.00 0.00 32.46 30.49 1k0g n ARG 24 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1k0g n LEU 25 N -0.68 1.22 0.06 2.89 4.77 0.13 -4.76 117.00 120.61 1k0g n LEU 25 Ca 0.16 -0.80 0.08 0.00 -0.03 0.00 0.00 56.01 55.42 1k0g n LEU 25 Cb 0.11 0.00 0.35 0.00 -2.33 0.00 0.00 43.42 41.55 1k0g n LEU 25 CO 0.12 0.25 0.75 -1.54 -1.33 0.00 0.00 177.39 175.63 1k0g n SER 26 N -0.16 0.26 -1.13 -1.43 3.41 -0.67 -0.33 113.62 113.57 1k0g n SER 26 Ca 0.04 0.58 0.12 0.00 -0.26 0.00 0.00 58.87 59.34 1k0g n SER 26 Cb 0.19 -0.63 0.20 0.00 -0.26 0.00 0.00 64.21 63.71 1k0g n SER 26 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1k0g n HIS 27 N -1.80 0.42 -3.13 7.33 8.25 -1.26 -4.74 115.22 120.29 1k0g n HIS 27 Ca 0.02 -0.21 -0.39 0.00 -0.26 0.00 0.00 57.72 56.88 1k0g n HIS 27 Cb 0.15 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.21 1k0g n HIS 27 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1k0g s LEU 28 N -1.57 4.28 0.30 2.41 1.43 0.56 -5.00 118.68 121.07 1k0g s LEU 28 Ca 0.37 1.04 -0.30 0.00 -1.03 0.00 0.00 54.13 54.21 1k0g s LEU 28 Cb 0.23 -2.95 -0.12 0.00 0.03 0.00 0.00 46.19 43.37 1k0g s LEU 28 CO 0.32 -0.10 1.43 -2.65 0.23 0.00 0.00 176.35 175.57 1k0g n PRO 29 N 3.92 2.30 -0.95 1.29 -0.02 -1.26 -0.70 135.00 139.58 1k0g n PRO 29 Ca -0.03 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 1k0g n PRO 29 Cb 0.51 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 1k0g n PRO 29 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1k0g n TRP 30 N 1.38 0.00 -2.50 6.00 7.02 0.47 -4.65 117.44 125.16 1k0g n TRP 30 Ca 0.08 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.14 1k0g n TRP 30 Cb 0.35 -0.41 -0.03 0.00 -2.42 0.00 0.00 31.31 28.80 1k0g n TRP 30 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1k0g s ALA 31 N -2.47 3.34 -0.00 6.99 0.00 0.12 -4.24 121.76 125.50 1k0g s ALA 31 Ca 0.00 0.75 -0.02 0.00 0.00 0.00 0.00 51.96 52.69 1k0g s ALA 31 Cb 0.00 -3.42 -0.00 0.00 0.00 0.00 0.00 23.12 19.69 1k0g s ALA 31 CO 0.00 -0.41 0.04 -1.64 0.00 0.00 0.00 175.76 173.75 1k0g s MET 32 N 1.14 0.21 -0.08 0.00 -1.94 0.06 -0.58 119.30 118.12 1k0g s MET 32 Ca 0.57 -0.22 0.02 0.00 -1.71 0.00 0.00 55.69 54.35 1k0g s MET 32 Cb -0.27 0.09 0.02 0.00 2.01 0.00 0.00 34.83 36.67 1k0g s MET 32 CO 0.28 -0.04 -0.12 -1.17 -0.01 0.00 0.00 175.02 173.97 1k0g s LEU 33 N -0.67 1.56 -0.30 -0.03 2.96 0.08 -1.11 118.68 121.16 1k0g s LEU 33 Ca -0.07 -0.31 -0.10 0.00 -0.22 0.00 0.00 54.13 53.42 1k0g s LEU 33 Cb -0.05 -0.85 -0.02 0.00 0.50 0.00 0.00 46.19 45.77 1k0g s LEU 33 CO -0.00 0.00 0.16 -0.76 -1.32 0.00 0.00 176.35 174.43 1k0g s LEU 34 N 0.90 4.07 -0.08 -0.68 1.43 -0.46 0.16 118.68 124.02 1k0g s LEU 34 Ca -0.10 -0.37 0.03 0.00 -1.03 0.00 0.00 54.13 52.66 1k0g s LEU 34 Cb -0.15 -2.03 -0.02 0.00 0.03 0.00 0.00 46.19 44.02 1k0g s LEU 34 CO 0.01 -0.15 -0.16 -2.28 0.23 0.00 0.00 176.35 173.99 1k0g s HIS 35 N 1.66 2.68 -1.00 0.29 2.46 0.41 -0.85 115.29 120.94 1k0g s HIS 35 Ca 0.06 -0.46 0.05 0.00 0.47 0.00 0.00 55.06 55.18 1k0g s HIS 35 Cb -0.17 -1.70 0.26 0.00 -0.13 0.00 0.00 32.58 30.85 1k0g s HIS 35 CO 0.07 -0.05 0.97 0.43 -2.47 0.00 0.00 174.74 173.69 1k0g n SER 36 N 2.89 2.33 -0.72 9.88 7.64 -1.20 -2.02 113.62 132.41 1k0g n SER 36 Ca -0.18 -2.25 -0.09 0.00 1.01 0.00 0.00 58.87 57.36 1k0g n SER 36 Cb 0.52 -0.48 -0.04 0.00 -1.01 0.00 0.00 64.21 63.20 1k0g n SER 36 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1k0g n GLY 37 N 0.35 1.02 2.36 0.23 0.00 -1.04 -0.50 105.19 107.61 1k0g n GLY 37 Ca 0.09 -0.22 -0.13 0.00 0.00 0.00 0.00 46.02 45.75 1k0g n GLY 37 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1k0g n TYR 38 N -2.49 -0.09 -2.55 1.61 4.01 -1.26 -3.90 117.16 112.50 1k0g n TYR 38 Ca -0.09 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.29 1k0g n TYR 38 Cb 0.43 -2.45 -0.04 0.00 -0.31 0.00 0.00 39.34 36.97 1k0g n TYR 38 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1k0g s ALA 39 N -2.51 3.03 -0.08 -0.72 0.00 0.34 -4.97 121.76 116.85 1k0g s ALA 39 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.63 1k0g s ALA 39 Cb 0.00 -3.26 0.08 0.00 0.00 0.00 0.00 23.12 19.93 1k0g s ALA 39 CO 0.00 -0.23 1.09 -0.25 0.00 0.00 0.00 175.76 176.37 1k0g n ASP 40 N -0.30 3.03 -4.81 0.00 8.00 -1.26 -4.74 116.55 116.48 1k0g n ASP 40 Ca 0.06 -2.18 -0.33 0.00 0.71 0.00 0.00 54.79 53.05 1k0g n ASP 40 Cb 0.50 -0.54 -0.06 0.00 -0.02 0.00 0.00 41.12 41.01 1k0g n ASP 40 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1k0g s HIS 41 N -0.40 1.70 0.18 1.24 3.76 -1.26 -4.99 115.29 115.52 1k0g s HIS 41 Ca 0.06 -0.99 0.32 0.00 -0.15 0.00 0.00 55.06 54.30 1k0g s HIS 41 Cb 0.05 -1.62 1.36 0.00 1.11 0.00 0.00 32.58 33.49 1k0g s HIS 41 CO 0.01 0.10 1.99 -1.35 -0.85 0.00 0.00 174.74 174.64 1k0g h PRO 42 N 1.20 0.00 -0.62 8.40 0.11 -2.02 -2.53 132.00 136.54 1k0g h PRO 42 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1k0g h PRO 42 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1k0g h PRO 42 CO 0.71 0.06 0.00 2.48 -0.21 0.00 0.00 178.00 181.04 1k0g n TYR 43 N -3.20 0.82 -2.27 0.65 0.18 -1.26 -3.74 117.16 108.35 1k0g n TYR 43 Ca 0.00 -0.41 -0.04 0.00 1.88 0.00 0.00 57.90 59.33 1k0g n TYR 43 Cb 0.31 0.00 0.07 0.00 -0.38 0.00 0.00 39.34 39.34 1k0g n TYR 43 CO 0.00 0.00 0.00 -1.13 -2.08 0.00 0.00 176.86 173.65 1k0g n SER 44 N 1.32 2.38 0.07 9.48 3.41 -0.96 -4.83 113.62 124.49 1k0g n SER 44 Ca 0.21 -2.90 -0.11 0.00 -0.26 0.00 0.00 58.87 55.81 1k0g n SER 44 Cb 0.52 -0.41 -0.02 0.00 -0.26 0.00 0.00 64.21 64.04 1k0g n SER 44 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1k0g h ARG 45 N 1.77 0.31 -6.67 4.33 2.43 -1.63 -3.42 114.38 111.49 1k0g h ARG 45 Ca 0.01 -0.33 -0.67 0.00 -0.81 0.00 0.00 59.98 58.18 1k0g h ARG 45 Cb 1.43 0.09 -0.18 0.00 -0.42 0.00 0.00 29.97 30.89 1k0g h ARG 45 CO 0.28 1.03 -0.79 -0.06 -1.51 0.00 0.00 179.97 178.91 1k0g s PHE 46 N -3.26 2.52 -0.00 2.20 0.08 -1.26 -0.92 117.98 117.34 1k0g s PHE 46 Ca -0.04 -0.27 0.07 0.00 0.12 0.00 0.00 56.93 56.81 1k0g s PHE 46 Cb 0.09 -1.31 -0.03 0.00 -0.57 0.00 0.00 43.02 41.21 1k0g s PHE 46 CO 0.85 0.42 -0.22 -0.51 -0.10 0.00 0.00 175.22 175.66 1k0g s ASP 47 N -2.31 3.45 -0.06 1.36 1.01 -0.23 -3.26 116.67 116.63 1k0g s ASP 47 Ca 0.19 -0.42 0.02 0.00 0.71 0.00 0.00 52.55 53.05 1k0g s ASP 47 Cb -0.10 -0.50 0.01 0.00 1.01 0.00 0.00 42.92 43.34 1k0g s ASP 47 CO 0.11 0.30 -0.11 -0.63 0.21 0.00 0.00 175.17 175.04 1k0g s ILE 48 N -0.74 1.06 -0.05 0.77 1.01 -0.03 -0.24 121.20 122.98 1k0g s ILE 48 Ca 0.12 -0.44 0.05 0.00 0.00 0.00 0.00 60.65 60.37 1k0g s ILE 48 Cb -0.10 -0.97 -0.01 0.00 0.01 0.00 0.00 42.46 41.39 1k0g s ILE 48 CO 0.01 0.34 -0.20 -0.69 0.00 0.00 0.00 174.94 174.39 1k0g s VAL 49 N 0.62 1.70 0.12 2.92 1.01 0.87 -1.35 120.40 126.29 1k0g s VAL 49 Ca -0.13 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.00 1k0g s VAL 49 Cb -0.15 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 1k0g s VAL 49 CO 0.03 0.48 -0.04 0.68 0.00 0.00 0.00 175.10 176.25 1k0g s VAL 50 N -0.03 0.63 0.18 2.92 -7.23 -0.27 -1.06 120.40 115.55 1k0g s VAL 50 Ca -0.04 -1.94 -0.24 0.00 -1.81 0.00 0.00 61.98 57.94 1k0g s VAL 50 Cb -0.13 -1.83 0.06 0.00 0.56 0.00 0.00 36.38 35.04 1k0g s VAL 50 CO 0.03 -0.74 0.93 0.00 -0.31 0.00 0.00 175.10 175.02 1k0g s ALA 51 N -3.67 -1.58 -1.03 1.32 0.00 -1.26 -0.76 121.76 114.79 1k0g s ALA 51 Ca 0.16 0.02 -0.14 0.00 0.00 0.00 0.00 51.96 52.00 1k0g s ALA 51 Cb 0.06 0.67 -0.01 0.00 0.00 0.00 0.00 23.12 23.84 1k0g s ALA 51 CO -0.02 -1.05 0.77 0.39 0.00 0.00 0.00 175.76 175.85 1k0g n GLU 52 N -0.49 -1.35 -1.89 0.00 -0.58 -1.26 -4.92 120.64 110.15 1k0g n GLU 52 Ca -0.06 0.69 -0.37 0.00 -0.42 0.00 0.00 57.16 57.01 1k0g n GLU 52 Cb 0.60 -4.27 0.05 0.00 -0.57 0.00 0.00 31.44 27.25 1k0g n GLU 52 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 1k0g s PRO 53 N -5.26 2.86 0.29 3.49 0.04 -1.26 -4.81 135.00 130.35 1k0g s PRO 53 Ca 0.34 1.97 0.25 0.00 0.04 0.00 0.00 61.00 63.60 1k0g s PRO 53 Cb -0.11 -1.96 0.64 0.00 0.04 0.00 0.00 34.50 33.11 1k0g s PRO 53 CO 0.84 -1.33 1.71 -0.84 0.04 0.00 0.00 177.00 177.42 1k0g h ILE 54 N 0.87 0.00 -2.58 0.56 3.07 -1.44 -3.46 117.51 114.52 1k0g h ILE 54 Ca -0.51 -0.66 -0.10 0.00 1.55 0.00 0.00 64.86 65.15 1k0g h ILE 54 Cb 1.31 1.64 -0.23 0.00 -0.27 0.00 0.00 36.82 39.28 1k0g h ILE 54 CO 0.55 0.00 -0.14 0.00 -1.05 0.00 0.00 178.15 177.51 1k0g s THR 56 N -0.05 1.67 -0.10 0.00 -4.23 0.12 -1.41 115.64 111.63 1k0g s THR 56 Ca -0.03 -2.09 -0.01 0.00 -1.18 0.00 0.00 61.69 58.39 1k0g s THR 56 Cb -0.03 -1.93 0.03 0.00 1.34 0.00 0.00 72.50 71.90 1k0g s THR 56 CO 0.02 -0.53 -0.05 -0.76 -0.54 0.00 0.00 174.62 172.76 1k0g s LEU 57 N -3.09 0.96 -0.21 4.79 1.02 -0.01 -0.09 118.68 122.04 1k0g s LEU 57 Ca 0.19 -0.22 0.01 0.00 0.02 0.00 0.00 54.13 54.14 1k0g s LEU 57 Cb -0.02 -0.68 0.04 0.00 0.02 0.00 0.00 46.19 45.55 1k0g s LEU 57 CO 0.06 -0.15 -0.12 -0.89 0.02 0.00 0.00 176.35 175.27 1k0g s THR 58 N 1.80 1.86 -0.15 5.49 2.01 -0.67 -0.64 115.64 125.33 1k0g s THR 58 Ca 0.05 -1.19 -0.04 0.00 0.31 0.00 0.00 61.69 60.82 1k0g s THR 58 Cb -0.12 -1.91 -0.03 0.00 0.01 0.00 0.00 72.50 70.45 1k0g s THR 58 CO -0.07 0.16 -0.00 -0.89 -0.69 0.00 0.00 174.62 173.13 1k0g s THR 59 N 1.29 4.21 -0.18 -0.82 2.01 0.43 -0.60 115.64 121.99 1k0g s THR 59 Ca -0.03 -0.25 -0.01 0.00 0.31 0.00 0.00 61.69 61.71 1k0g s THR 59 Cb -0.17 -2.85 0.05 0.00 0.01 0.00 0.00 72.50 69.54 1k0g s THR 59 CO -0.08 0.50 -0.01 -0.36 -0.69 0.00 0.00 174.62 173.98 1k0g s PHE 60 N 0.17 1.44 0.00 4.92 0.08 0.56 -0.15 117.98 125.00 1k0g s PHE 60 Ca 0.00 -1.00 0.00 0.00 0.12 0.00 0.00 56.93 56.06 1k0g s PHE 60 Cb -0.13 -1.19 0.00 0.00 -0.57 0.00 0.00 43.02 41.13 1k0g s PHE 60 CO 0.02 -0.61 0.00 0.41 -0.10 0.00 0.00 175.22 174.94 1k0g n GLY 61 N 4.94 3.43 0.01 4.36 0.00 -1.26 -0.98 105.19 115.70 1k0g n GLY 61 Ca -0.10 0.21 0.14 0.00 0.00 0.00 0.00 46.02 46.26 1k0g n GLY 61 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1k0g n LYS 62 N 14.00 0.03 -4.73 1.61 5.02 -1.26 -4.82 118.16 128.01 1k0g n LYS 62 Ca 0.00 0.03 -0.32 0.00 -2.02 0.00 0.00 58.31 55.99 1k0g n LYS 62 Cb 0.00 -1.54 -0.12 0.00 -0.02 0.00 0.00 35.03 33.35 1k0g n LYS 62 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1k0g s GLU 63 N -3.01 2.47 -0.16 1.97 0.41 -0.15 -4.25 118.70 115.98 1k0g s GLU 63 Ca 0.14 -0.73 0.01 0.00 -0.41 0.00 0.00 54.97 53.97 1k0g s GLU 63 Cb 0.18 -2.40 0.01 0.00 -1.78 0.00 0.00 34.13 30.14 1k0g s GLU 63 CO 0.54 0.61 -0.18 0.99 -0.49 0.00 0.00 175.26 176.73 1k0g s THR 64 N -0.83 2.34 -0.33 3.63 2.01 0.51 -0.32 115.64 122.65 1k0g s THR 64 Ca 0.13 -0.87 -0.16 0.00 0.31 0.00 0.00 61.69 61.11 1k0g s THR 64 Cb -0.11 -1.98 -0.01 0.00 0.01 0.00 0.00 72.50 70.41 1k0g s THR 64 CO 0.03 0.53 0.41 -0.69 -0.69 0.00 0.00 174.62 174.21 1k0g s VAL 65 N 1.04 5.12 -0.33 3.82 1.01 0.23 0.06 120.40 131.35 1k0g s VAL 65 Ca -0.01 0.22 -0.10 0.00 0.00 0.00 0.00 61.98 62.08 1k0g s VAL 65 Cb -0.14 -3.85 0.00 0.00 0.00 0.00 0.00 36.38 32.39 1k0g s VAL 65 CO -0.05 -0.10 0.16 -0.69 0.00 0.00 0.00 175.10 174.43 1k0g s VAL 66 N 2.14 4.58 -0.05 2.92 1.01 0.11 -1.67 120.40 129.44 1k0g s VAL 66 Ca 0.14 -0.54 0.04 0.00 0.00 0.00 0.00 61.98 61.62 1k0g s VAL 66 Cb -0.16 -3.39 -0.00 0.00 0.00 0.00 0.00 36.38 32.82 1k0g s VAL 66 CO 0.12 -0.01 -0.18 -0.55 0.00 0.00 0.00 175.10 174.47 1k0g s SER 67 N 1.59 2.34 -0.26 3.32 0.15 0.87 -1.42 113.70 120.29 1k0g s SER 67 Ca 0.04 -0.39 -0.02 0.00 0.70 0.00 0.00 55.95 56.28 1k0g s SER 67 Cb -0.18 -0.74 0.13 0.00 -1.71 0.00 0.00 66.02 63.52 1k0g s SER 67 CO 0.06 0.15 0.29 -0.70 1.20 0.00 0.00 173.24 174.25 1k0g s GLU 68 N 0.11 0.30 6.72 5.44 2.12 0.40 0.11 118.70 133.90 1k0g s GLU 68 Ca -0.06 0.07 0.00 0.00 0.36 0.00 0.00 54.97 55.34 1k0g s GLU 68 Cb -0.13 -0.76 0.00 0.00 0.26 0.00 0.00 34.13 33.50 1k0g s GLU 68 CO 0.03 -0.87 0.00 0.43 -0.54 0.00 0.00 175.26 174.31 1k0g n SER 69 N 5.32 0.00 -0.07 -1.70 7.64 -1.26 0.13 113.62 123.68 1k0g n SER 69 Ca -0.03 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.97 1k0g n SER 69 Cb 0.48 0.00 0.20 0.00 -1.01 0.00 0.00 64.21 63.88 1k0g n SER 69 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1k0g n GLU 70 N 8.26 0.21 -3.33 1.43 0.00 -1.26 -4.85 120.64 121.09 1k0g n GLU 70 Ca 0.00 -0.14 -0.37 0.00 0.00 0.00 0.00 57.16 56.66 1k0g n GLU 70 Cb 0.00 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 29.88 1k0g n GLU 70 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 1k0g s LYS 71 N -2.88 4.06 -0.04 3.44 1.02 0.34 -5.04 119.74 120.63 1k0g s LYS 71 Ca 0.13 0.58 -0.02 0.00 0.02 0.00 0.00 55.97 56.69 1k0g s LYS 71 Cb 0.18 -3.05 0.03 0.00 -0.52 0.00 0.00 37.83 34.48 1k0g s LYS 71 CO 0.69 0.54 0.09 0.50 -0.92 0.00 0.00 175.35 176.24 1k0g s ARG 72 N -1.63 0.00 -0.03 1.68 3.52 -1.26 -0.45 118.95 120.78 1k0g s ARG 72 Ca 0.34 0.32 0.05 0.00 -0.13 0.00 0.00 55.73 56.31 1k0g s ARG 72 Cb -0.17 -0.27 -0.01 0.00 -1.56 0.00 0.00 34.95 32.95 1k0g s ARG 72 CO 0.19 -0.21 -0.16 0.99 -0.81 0.00 0.00 175.30 175.30 1k0g s THR 73 N 1.40 1.34 -0.02 4.11 2.01 -0.51 -4.99 115.64 118.98 1k0g s THR 73 Ca -0.06 -0.69 0.07 0.00 0.31 0.00 0.00 61.69 61.31 1k0g s THR 73 Cb -0.12 -1.13 -0.02 0.00 0.01 0.00 0.00 72.50 71.24 1k0g s THR 73 CO -0.04 0.38 -0.21 -0.89 -0.69 0.00 0.00 174.62 173.17 1k0g s THR 74 N -0.16 1.68 0.09 -0.82 2.01 -1.26 0.03 115.64 117.22 1k0g s THR 74 Ca 0.01 -0.92 -0.17 0.00 0.31 0.00 0.00 61.69 60.93 1k0g s THR 74 Cb -0.09 -1.40 0.04 0.00 0.01 0.00 0.00 72.50 71.06 1k0g s THR 74 CO 0.01 0.47 0.41 0.28 -0.69 0.00 0.00 174.62 175.10 1k0g s THR 75 N -0.50 0.06 -1.77 -0.82 -1.32 0.11 -4.95 115.64 106.45 1k0g s THR 75 Ca 0.08 -0.51 0.17 0.00 -1.21 0.00 0.00 61.69 60.22 1k0g s THR 75 Cb -0.08 -1.08 0.37 0.00 -1.51 0.00 0.00 72.50 70.19 1k0g s THR 75 CO -0.01 -0.28 1.29 0.35 -2.21 0.00 0.00 174.62 173.75 1k0g n THR 76 N 0.05 0.64 -0.82 5.08 -2.24 -1.26 -0.36 114.28 115.37 1k0g n THR 76 Ca -0.17 -0.82 -0.31 0.00 -2.27 0.00 0.00 64.05 60.48 1k0g n THR 76 Cb 0.62 0.82 0.15 0.00 -2.10 0.00 0.00 70.33 69.82 1k0g n THR 76 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1k0g s ASP 77 N -1.18 3.17 -0.27 3.42 1.01 -1.26 -4.84 116.67 116.72 1k0g s ASP 77 Ca 0.31 2.07 -0.39 0.00 0.71 0.00 0.00 52.55 55.25 1k0g s ASP 77 Cb 0.18 -2.54 -0.15 0.00 1.01 0.00 0.00 42.92 41.42 1k0g s ASP 77 CO 0.24 -2.93 1.80 -0.67 0.21 0.00 0.00 175.17 173.82 1k0g n ASP 78 N -4.11 2.50 0.26 0.27 -0.08 -1.26 -4.81 116.55 109.32 1k0g n ASP 78 Ca 0.11 1.02 0.09 0.00 -1.51 0.00 0.00 54.79 54.50 1k0g n ASP 78 Cb 0.52 -1.17 0.67 0.00 2.34 0.00 0.00 41.12 43.48 1k0g n ASP 78 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1k0g h PRO 79 N 7.79 0.00 0.02 -0.67 0.13 -1.94 0.41 132.00 137.74 1k0g h PRO 79 Ca -0.45 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.47 1k0g h PRO 79 Cb 1.31 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.43 1k0g h PRO 79 CO 0.97 0.06 -0.96 -0.07 -0.23 0.00 0.00 178.00 177.77 1k0g h LEU 80 N 0.00 0.13 -0.51 1.56 3.38 -1.95 0.22 115.31 118.14 1k0g h LEU 80 Ca -0.00 -0.12 -0.14 0.00 0.09 0.00 0.00 57.88 57.70 1k0g h LEU 80 Cb 0.11 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1k0g h LEU 80 CO 0.01 1.01 -0.35 -0.61 0.09 0.00 0.00 178.44 178.58 1k0g h GLN 81 N 0.04 0.83 -0.49 1.13 4.15 -1.41 0.18 115.11 119.54 1k0g h GLN 81 Ca -0.04 -0.41 0.01 0.00 0.77 0.00 0.00 58.65 58.98 1k0g h GLN 81 Cb 1.65 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 29.31 1k0g h GLN 81 CO 0.14 1.05 0.32 0.28 -1.93 0.00 0.00 178.83 178.68 1k0g h VAL 82 N 0.69 1.11 -0.16 2.39 2.07 -0.06 -1.37 116.25 120.93 1k0g h VAL 82 Ca 0.07 -0.22 0.05 0.00 0.82 0.00 0.00 66.70 67.41 1k0g h VAL 82 Cb 0.91 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 1k0g h VAL 82 CO 0.08 0.12 -0.17 0.25 0.02 0.00 0.00 177.57 177.87 1k0g h LEU 83 N 0.65 -0.54 -0.90 2.57 5.85 -0.37 -0.87 115.31 121.70 1k0g h LEU 83 Ca 0.18 0.10 0.10 0.00 0.84 0.00 0.00 57.88 59.10 1k0g h LEU 83 Cb -0.06 0.26 -0.08 0.00 0.37 0.00 0.00 40.66 41.15 1k0g h LEU 83 CO -0.05 -0.22 0.54 -0.61 -0.34 0.00 0.00 178.44 177.76 1k0g h GLN 84 N -0.21 0.87 -0.46 1.25 5.75 -0.09 0.26 115.11 122.48 1k0g h GLN 84 Ca 0.11 -0.05 -0.09 0.00 -0.15 0.00 0.00 58.65 58.46 1k0g h GLN 84 Cb 0.36 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.70 1k0g h GLN 84 CO -0.28 0.57 -0.07 1.96 -2.65 0.00 0.00 178.83 178.37 1k0g h GLN 85 N 0.89 0.87 -0.53 1.69 4.20 -0.93 0.19 115.11 121.49 1k0g h GLN 85 Ca 0.43 -0.31 -0.02 0.00 0.06 0.00 0.00 58.65 58.81 1k0g h GLN 85 Cb 0.38 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.07 1k0g h GLN 85 CO -0.24 0.95 0.26 0.28 -0.67 0.00 0.00 178.83 179.41 1k0g h VAL 86 N 0.71 1.20 -0.55 -0.54 2.07 -0.29 0.44 116.25 119.29 1k0g h VAL 86 Ca 0.12 -0.54 -0.07 0.00 0.82 0.00 0.00 66.70 67.03 1k0g h VAL 86 Cb 0.60 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1k0g h VAL 86 CO 0.04 0.22 0.06 -0.07 0.02 0.00 0.00 177.57 177.83 1k0g h LEU 87 N 0.71 0.85 -0.58 2.57 3.38 -0.04 -2.77 115.31 119.43 1k0g h LEU 87 Ca 0.18 -0.19 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1k0g h LEU 87 Cb 0.10 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1k0g h LEU 87 CO -0.02 0.88 -0.20 0.44 0.09 0.00 0.00 178.44 179.63 1k0g h ASP 88 N 0.84 0.94 0.41 -0.43 3.32 0.13 -1.08 116.42 120.55 1k0g h ASP 88 Ca 0.17 -0.34 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1k0g h ASP 88 Cb 0.42 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1k0g h ASP 88 CO 0.01 1.10 0.00 0.03 -1.72 0.00 0.00 179.24 178.67 1k0g h ARG 89 N 0.80 0.00 0.00 3.56 3.08 0.10 -0.37 114.38 121.55 1k0g h ARG 89 Ca 0.11 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.16 1k0g h ARG 89 Cb 0.75 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.80 1k0g h ARG 89 CO 0.06 0.00 -0.02 0.00 -1.07 0.00 0.00 179.97 178.94 1k0g h ALA 90 N 2.01 1.01 -5.89 0.04 0.00 -0.92 -3.45 119.26 112.06 1k0g h ALA 90 Ca 0.00 -0.01 -0.40 0.00 0.00 0.00 0.00 54.91 54.49 1k0g h ALA 90 Cb 0.21 -0.00 0.12 0.00 0.00 0.00 0.00 17.79 18.11 1k0g h ALA 90 CO 0.00 0.02 -0.70 -0.25 0.00 0.00 0.00 179.25 178.32 1k0g n ASP 91 N -3.12 -5.61 -4.09 0.00 8.00 -0.15 -4.95 116.55 106.64 1k0g n ASP 91 Ca -0.00 -0.58 -0.32 0.00 0.71 0.00 0.00 54.79 54.59 1k0g n ASP 91 Cb 0.27 -4.89 -0.16 0.00 -0.02 0.00 0.00 41.12 36.33 1k0g n ASP 91 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1k0g s ILE 92 N -3.33 1.97 -0.44 0.53 1.01 -1.26 -1.70 121.20 117.98 1k0g s ILE 92 Ca 0.52 -0.96 0.05 0.00 0.00 0.00 0.00 60.65 60.26 1k0g s ILE 92 Cb -0.23 -1.83 0.18 0.00 0.01 0.00 0.00 42.46 40.58 1k0g s ILE 92 CO 0.74 0.45 0.46 0.54 0.00 0.00 0.00 174.94 177.13 1k0g n ARG 93 N 4.63 0.32 -2.02 2.79 1.74 0.26 -4.70 116.66 119.67 1k0g n ARG 93 Ca -0.19 -2.87 -0.29 0.00 -0.77 0.00 0.00 57.85 53.73 1k0g n ARG 93 Cb 0.49 -1.59 0.05 0.00 -1.02 0.00 0.00 32.46 30.39 1k0g n ARG 93 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1k0g s PRO 94 N 0.19 2.81 0.45 5.56 0.04 -1.25 -4.21 135.00 138.59 1k0g s PRO 94 Ca 0.32 0.31 -0.23 0.00 0.04 0.00 0.00 61.00 61.44 1k0g s PRO 94 Cb 0.04 -2.08 -0.07 0.00 0.04 0.00 0.00 34.50 32.43 1k0g s PRO 94 CO -0.16 -0.99 1.21 0.95 0.04 0.00 0.00 177.00 178.05 1k0g s THR 95 N -3.28 2.92 0.55 1.26 -4.23 -1.26 -4.33 115.64 107.28 1k0g s THR 95 Ca 0.57 0.72 -0.20 0.00 -1.18 0.00 0.00 61.69 61.61 1k0g s THR 95 Cb -0.11 -3.38 -0.07 0.00 1.34 0.00 0.00 72.50 70.28 1k0g s THR 95 CO 0.50 0.02 0.83 1.41 -0.54 0.00 0.00 174.62 176.84 1k0g n HIS 96 N -0.39 0.40 -3.55 3.99 -0.00 -1.26 -4.94 115.22 109.47 1k0g n HIS 96 Ca 0.07 0.47 -0.18 0.00 -0.00 0.00 0.00 57.72 58.08 1k0g n HIS 96 Cb 0.47 -2.10 -0.14 0.00 -0.00 0.00 0.00 29.99 28.23 1k0g n HIS 96 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1k0g s ASN 97 N -1.12 1.16 0.55 0.41 3.84 -1.26 -5.01 114.94 113.50 1k0g s ASN 97 Ca 0.71 -0.03 0.30 0.00 0.21 0.00 0.00 52.86 54.06 1k0g s ASN 97 Cb -0.46 0.39 1.58 0.00 -0.55 0.00 0.00 41.25 42.21 1k0g s ASN 97 CO 0.51 -0.30 2.10 1.05 -2.79 0.00 0.00 177.10 177.68 1k0g h GLU 98 N 8.32 0.00 0.00 0.43 4.11 -1.98 0.19 114.58 125.65 1k0g h GLU 98 Ca -0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.27 1k0g h GLU 98 Cb 1.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1k0g h GLU 98 CO 0.24 0.09 0.00 -0.25 0.07 0.00 0.00 179.01 179.15 1k0g n ASP 99 N -3.50 0.00 -3.53 3.06 8.00 -1.26 -4.37 116.55 114.95 1k0g n ASP 99 Ca -0.02 0.09 -0.27 0.00 0.71 0.00 0.00 54.79 55.30 1k0g n ASP 99 Cb 0.22 -0.36 -0.10 0.00 -0.02 0.00 0.00 41.12 40.85 1k0g n ASP 99 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1k0g n LEU 100 N -1.36 0.63 -0.05 0.64 4.77 0.66 -4.98 117.00 117.31 1k0g n LEU 100 Ca 0.12 -4.65 0.02 0.00 -0.03 0.00 0.00 56.01 51.47 1k0g n LEU 100 Cb 0.28 0.15 0.35 0.00 -2.33 0.00 0.00 43.42 41.86 1k0g n LEU 100 CO 0.25 1.84 1.11 1.55 -1.33 0.00 0.00 177.39 180.80 1k0g h PRO 101 N 5.47 0.63 -5.01 3.23 0.13 -1.76 -3.38 132.00 131.32 1k0g h PRO 101 Ca 0.23 -0.07 -0.67 0.00 -0.87 0.00 0.00 66.00 64.62 1k0g h PRO 101 Cb 0.86 -0.13 -0.34 0.00 0.13 0.00 0.00 31.00 31.52 1k0g h PRO 101 CO 0.48 0.48 -0.82 0.12 -0.23 0.00 0.00 178.00 178.04 1k0g s PHE 102 N -5.40 2.89 -0.64 1.56 5.36 -1.26 -4.81 117.98 115.68 1k0g s PHE 102 Ca -0.09 -1.58 0.03 0.00 -0.96 0.00 0.00 56.93 54.33 1k0g s PHE 102 Cb 0.17 -1.97 0.37 0.00 -0.34 0.00 0.00 43.02 41.25 1k0g s PHE 102 CO 0.75 -0.76 1.32 1.04 -1.46 0.00 0.00 175.22 176.11 1k0g n GLN 103 N 4.64 3.54 -0.26 10.12 6.02 -1.26 -4.90 117.38 135.28 1k0g n GLN 103 Ca -0.19 -4.47 0.03 0.00 -0.01 0.00 0.00 57.00 52.36 1k0g n GLN 103 Cb 0.49 -2.28 -0.01 0.00 1.02 0.00 0.00 30.24 29.45 1k0g n GLN 103 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1k0g n GLY 104 N -0.36 -2.36 0.00 1.08 0.00 -1.26 -4.43 105.19 97.86 1k0g n GLY 104 Ca 0.40 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 45.02 1k0g n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k0g n GLY 105 N -2.65 0.38 3.86 -0.02 0.00 0.09 0.08 105.19 106.93 1k0g n GLY 105 Ca -0.01 -1.59 -0.36 0.00 0.00 0.00 0.00 46.02 44.05 1k0g n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k0g s ALA 106 N -1.38 3.72 -0.14 4.61 0.00 -0.25 0.44 121.76 128.76 1k0g s ALA 106 Ca 0.00 -0.32 -0.18 0.00 0.00 0.00 0.00 51.96 51.46 1k0g s ALA 106 Cb 0.00 -2.31 0.05 0.00 0.00 0.00 0.00 23.12 20.85 1k0g s ALA 106 CO 0.00 0.53 0.47 -1.17 0.00 0.00 0.00 175.76 175.60 1k0g s LEU 107 N -1.58 0.19 0.00 0.00 2.96 0.61 -0.92 118.68 119.94 1k0g s LEU 107 Ca 0.29 0.79 0.00 0.00 -0.22 0.00 0.00 54.13 54.99 1k0g s LEU 107 Cb -0.15 1.68 0.00 0.00 0.50 0.00 0.00 46.19 48.22 1k0g s LEU 107 CO 0.16 -0.27 0.00 0.61 -1.32 0.00 0.00 176.35 175.53 1k0g n GLY 108 N 2.33 -0.34 3.65 7.98 0.00 -0.11 -1.28 105.19 117.42 1k0g n GLY 108 Ca -0.15 -1.02 -0.35 0.00 0.00 0.00 0.00 46.02 44.49 1k0g n GLY 108 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1k0g s LEU 109 N 0.00 3.52 -0.38 0.99 2.96 0.14 -1.92 118.68 123.98 1k0g s LEU 109 Ca 0.00 0.10 -0.01 0.00 -0.22 0.00 0.00 54.13 54.00 1k0g s LEU 109 Cb 0.00 -1.81 0.10 0.00 0.50 0.00 0.00 46.19 44.98 1k0g s LEU 109 CO 0.00 0.34 0.15 -0.36 -1.32 0.00 0.00 176.35 175.17 1k0g s PHE 110 N -0.67 3.62 0.58 5.38 0.08 0.11 -1.46 117.98 125.62 1k0g s PHE 110 Ca 0.11 -2.55 -0.13 0.00 0.12 0.00 0.00 56.93 54.48 1k0g s PHE 110 Cb -0.12 -3.09 -0.05 0.00 -0.57 0.00 0.00 43.02 39.19 1k0g s PHE 110 CO 0.02 -0.96 1.01 0.20 -0.10 0.00 0.00 175.22 175.39 1k0g s GLY 111 N 1.55 1.81 0.23 4.36 0.00 0.25 -0.70 107.32 114.81 1k0g s GLY 111 Ca 0.08 0.01 -0.07 0.00 0.00 0.00 0.00 44.72 44.74 1k0g s GLY 111 CO -0.05 0.28 1.72 -1.82 0.00 0.00 0.00 173.10 173.22 1k0g h TYR 112 N 0.16 0.35 0.00 1.90 3.20 -0.73 0.93 116.97 122.77 1k0g h TYR 112 Ca -0.45 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.46 1k0g h TYR 112 Cb 1.19 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.41 1k0g h TYR 112 CO 0.65 0.01 0.00 -0.25 -1.64 0.00 0.00 178.16 176.93 1k0g n ASP 113 N -5.07 0.00 0.28 -2.11 8.00 -1.25 -1.15 116.55 115.26 1k0g n ASP 113 Ca 0.12 0.48 0.19 0.00 0.71 0.00 0.00 54.79 56.28 1k0g n ASP 113 Cb 0.37 -0.49 0.87 0.00 -0.02 0.00 0.00 41.12 41.86 1k0g n ASP 113 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1k0g h LEU 114 N 0.00 0.00 -1.28 0.64 5.85 -1.01 -2.15 115.31 117.37 1k0g h LEU 114 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1k0g h LEU 114 Cb 0.13 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.16 1k0g h LEU 114 CO 0.00 0.00 0.00 1.23 -0.34 0.00 0.00 178.44 179.33 1k0g h GLY 115 N 1.16 0.00 2.00 3.75 0.00 -1.30 -0.75 103.07 107.93 1k0g h GLY 115 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1k0g h GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.08 1k0g n ARG 116 N -2.59 0.03 0.00 4.80 1.74 -0.81 -1.03 116.66 118.81 1k0g n ARG 116 Ca 0.01 0.33 0.13 0.00 -0.77 0.00 0.00 57.85 57.55 1k0g n ARG 116 Cb 0.21 -1.57 0.50 0.00 -1.02 0.00 0.00 32.46 30.58 1k0g n ARG 116 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1k0g n ARG 117 N -1.64 0.31 -0.00 5.56 5.12 -0.29 -4.16 116.66 121.56 1k0g n ARG 117 Ca 0.02 -0.11 0.01 0.00 -1.93 0.00 0.00 57.85 55.84 1k0g n ARG 117 Cb 0.14 -1.50 -0.02 0.00 -1.16 0.00 0.00 32.46 29.93 1k0g n ARG 117 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 1k0g n PHE 118 N -1.25 0.00 -4.14 -1.55 3.72 -0.20 -4.99 117.46 109.05 1k0g n PHE 118 Ca 0.10 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.28 1k0g n PHE 118 Cb 0.31 -0.05 -0.17 0.00 -0.94 0.00 0.00 39.48 38.63 1k0g n PHE 118 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1k0g s GLU 119 N -2.16 0.94 -0.18 -1.08 8.01 -0.64 -5.13 118.70 118.46 1k0g s GLU 119 Ca -0.01 -0.12 -0.22 0.00 0.01 0.00 0.00 54.97 54.63 1k0g s GLU 119 Cb 0.01 -0.97 -0.02 0.00 -4.31 0.00 0.00 34.13 28.84 1k0g s GLU 119 CO 0.10 -0.11 0.67 0.45 0.01 0.00 0.00 175.26 176.38 1k0g s SER 120 N 1.08 6.76 0.11 -0.19 0.15 -1.26 -4.33 113.70 116.02 1k0g s SER 120 Ca -0.08 0.93 -0.19 0.00 0.70 0.00 0.00 55.95 57.30 1k0g s SER 120 Cb -0.14 -2.37 0.05 0.00 -1.71 0.00 0.00 66.02 61.84 1k0g s SER 120 CO -0.01 -0.28 0.47 -1.48 1.20 0.00 0.00 173.24 173.15 1k0g s LEU 121 N 1.83 0.08 0.97 3.45 0.05 -1.26 -5.09 118.68 118.71 1k0g s LEU 121 Ca 0.31 -0.13 -0.13 0.00 0.05 0.00 0.00 54.13 54.24 1k0g s LEU 121 Cb -0.16 2.07 0.08 0.00 -2.05 0.00 0.00 46.19 46.13 1k0g s LEU 121 CO 0.11 -0.84 0.58 -2.65 -0.55 0.00 0.00 176.35 173.00 1k0g n PRO 122 N -0.10 -0.54 -3.79 1.48 -0.02 -1.26 -4.99 135.00 125.78 1k0g n PRO 122 Ca -0.17 -0.11 -0.30 0.00 -2.02 0.00 0.00 63.50 60.90 1k0g n PRO 122 Cb 0.63 -1.99 -0.13 0.00 -0.02 0.00 0.00 33.50 31.99 1k0g n PRO 122 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1k0g s GLU 123 N -3.90 1.52 -0.10 -0.52 -1.05 -1.26 -4.96 118.70 108.43 1k0g s GLU 123 Ca 0.60 -2.22 0.04 0.00 -0.15 0.00 0.00 54.97 53.23 1k0g s GLU 123 Cb -0.21 -2.65 -0.08 0.00 -0.44 0.00 0.00 34.13 30.74 1k0g s GLU 123 CO 0.65 -1.15 -0.04 -0.89 0.95 0.00 0.00 175.26 174.78 1k0g n ILE 124 N 3.37 0.59 -0.86 1.83 5.41 -1.26 -5.01 119.36 123.43 1k0g n ILE 124 Ca 0.08 -0.29 -0.31 0.00 1.00 0.00 0.00 62.75 63.23 1k0g n ILE 124 Cb 0.34 -0.83 0.15 0.00 -0.71 0.00 0.00 39.64 38.58 1k0g n ILE 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1k0g s ALA 125 N -2.21 1.68 0.10 -1.39 0.00 -1.04 -4.94 121.76 113.96 1k0g s ALA 125 Ca -0.10 0.49 -0.21 0.00 0.00 0.00 0.00 51.96 52.14 1k0g s ALA 125 Cb 0.03 -3.40 -0.07 0.00 0.00 0.00 0.00 23.12 19.68 1k0g s ALA 125 CO 0.29 -2.49 0.63 -2.00 0.00 0.00 0.00 175.76 172.19 1k0g s GLU 126 N -4.72 4.31 -1.32 0.00 2.12 0.27 -4.54 118.70 114.82 1k0g s GLU 126 Ca 0.65 0.86 -0.17 0.00 0.36 0.00 0.00 54.97 56.67 1k0g s GLU 126 Cb -0.21 -3.25 0.07 0.00 0.26 0.00 0.00 34.13 31.01 1k0g s GLU 126 CO 0.57 0.62 1.80 0.94 -0.54 0.00 0.00 175.26 178.65 1k0g n GLN 127 N 1.68 3.16 -0.35 4.30 7.27 -1.26 -1.84 117.38 130.35 1k0g n GLN 127 Ca -0.09 -3.21 0.09 0.00 0.07 0.00 0.00 57.00 53.86 1k0g n GLN 127 Cb 0.50 -3.44 0.26 0.00 2.41 0.00 0.00 30.24 29.98 1k0g n GLN 127 CO 0.00 0.00 0.00 -0.40 0.07 0.00 0.00 177.06 176.73 1k0g n ASP 128 N 7.84 3.29 -4.03 1.69 5.75 -1.26 -4.83 116.55 125.00 1k0g n ASP 128 Ca 0.49 -2.10 -0.30 0.00 -0.01 0.00 0.00 54.79 52.87 1k0g n ASP 128 Cb 0.45 -0.42 -0.16 0.00 -1.03 0.00 0.00 41.12 39.95 1k0g n ASP 128 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1k0g s ILE 129 N -1.39 1.57 -0.51 2.12 1.01 -1.26 -5.08 121.20 117.66 1k0g s ILE 129 Ca 0.39 -0.64 -0.13 0.00 0.00 0.00 0.00 60.65 60.27 1k0g s ILE 129 Cb 0.22 -1.46 0.12 0.00 0.01 0.00 0.00 42.46 41.34 1k0g s ILE 129 CO 0.24 0.46 0.43 -0.69 0.00 0.00 0.00 174.94 175.38 1k0g s VAL 130 N 1.40 4.79 -0.25 2.92 1.01 -1.26 -4.99 120.40 124.02 1k0g s VAL 130 Ca 0.03 -1.60 -0.18 0.00 0.00 0.00 0.00 61.98 60.24 1k0g s VAL 130 Cb -0.13 -4.09 0.07 0.00 0.00 0.00 0.00 36.38 32.23 1k0g s VAL 130 CO -0.09 -0.82 0.63 -0.22 0.00 0.00 0.00 175.10 174.60 1k0g s LEU 131 N 1.50 -0.64 0.52 3.92 0.20 -1.26 -4.92 118.68 118.00 1k0g s LEU 131 Ca 0.04 1.35 -0.21 0.00 0.69 0.00 0.00 54.13 55.99 1k0g s LEU 131 Cb -0.28 2.17 -0.07 0.00 -0.43 0.00 0.00 46.19 47.58 1k0g s LEU 131 CO 0.02 -0.23 1.06 -2.65 -0.29 0.00 0.00 176.35 174.26 1k0g n PRO 132 N 3.70 1.26 0.28 0.98 -0.02 -1.26 -4.90 135.00 135.04 1k0g n PRO 132 Ca -0.18 0.47 0.17 0.00 -2.02 0.00 0.00 63.50 61.94 1k0g n PRO 132 Cb 0.57 -2.21 0.74 0.00 -0.02 0.00 0.00 33.50 32.58 1k0g n PRO 132 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1k0g h ASP 133 N 1.11 0.00 -3.22 2.55 3.32 -0.92 -3.42 116.42 115.84 1k0g h ASP 133 Ca -0.48 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.36 1k0g h ASP 133 Cb 1.34 0.00 -0.31 0.00 0.22 0.00 0.00 39.33 40.58 1k0g h ASP 133 CO 0.54 0.03 -0.53 -0.32 -1.72 0.00 0.00 179.24 177.24 1k0g s MET 134 N -3.76 0.16 -0.30 3.56 1.75 -1.17 0.85 119.30 120.38 1k0g s MET 134 Ca 0.00 0.56 -0.03 0.00 -1.25 0.00 0.00 55.69 54.97 1k0g s MET 134 Cb 0.10 -0.13 0.10 0.00 2.84 0.00 0.00 34.83 37.74 1k0g s MET 134 CO 0.54 -0.21 0.12 0.00 -0.65 0.00 0.00 175.02 174.82 1k0g s ALA 135 N 1.63 0.91 -0.01 4.11 0.00 -0.53 -0.43 121.76 127.44 1k0g s ALA 135 Ca -0.06 -1.30 0.01 0.00 0.00 0.00 0.00 51.96 50.62 1k0g s ALA 135 Cb -0.11 -1.47 0.00 0.00 0.00 0.00 0.00 23.12 21.54 1k0g s ALA 135 CO -0.08 -1.67 -0.04 0.08 0.00 0.00 0.00 175.76 174.05 1k0g s VAL 136 N 1.91 0.40 0.15 0.00 1.01 0.19 0.25 120.40 124.30 1k0g s VAL 136 Ca 0.10 -0.17 0.05 0.00 0.00 0.00 0.00 61.98 61.96 1k0g s VAL 136 Cb -0.17 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.81 1k0g s VAL 136 CO -0.32 0.13 0.07 -0.83 0.00 0.00 0.00 175.10 174.15 1k0g s GLY 137 N 0.13 1.78 -0.30 4.51 0.00 -0.41 -0.83 107.32 112.20 1k0g s GLY 137 Ca -0.01 -1.22 -0.08 0.00 0.00 0.00 0.00 44.72 43.41 1k0g s GLY 137 CO -0.00 -1.22 0.12 -0.42 0.00 0.00 0.00 173.10 171.57 1k0g s ILE 138 N -1.64 4.36 -0.09 0.90 -1.09 -0.50 -0.29 121.20 122.85 1k0g s ILE 138 Ca 0.29 -0.48 0.03 0.00 -2.23 0.00 0.00 60.65 58.26 1k0g s ILE 138 Cb -0.10 -3.21 -0.02 0.00 -1.58 0.00 0.00 42.46 37.55 1k0g s ILE 138 CO 0.21 0.10 -0.17 -0.31 -1.23 0.00 0.00 174.94 173.54 1k0g s TYR 139 N 1.58 2.67 -2.03 3.97 1.51 0.17 -1.03 117.35 124.18 1k0g s TYR 139 Ca 0.04 -0.57 0.17 0.00 -1.01 0.00 0.00 57.07 55.70 1k0g s TYR 139 Cb -0.17 -1.72 0.48 0.00 -0.11 0.00 0.00 41.96 40.45 1k0g s TYR 139 CO 0.05 -0.12 1.40 -0.25 -1.11 0.00 0.00 175.55 175.51 1k0g n ASP 140 N 3.06 2.83 -3.62 2.29 8.00 -1.26 -0.73 116.55 127.12 1k0g n ASP 140 Ca -0.18 -1.99 -0.11 0.00 0.71 0.00 0.00 54.79 53.23 1k0g n ASP 140 Cb 0.52 -0.34 -0.04 0.00 -0.02 0.00 0.00 41.12 41.24 1k0g n ASP 140 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 1k0g s TRP 141 N -1.32 0.51 -0.04 1.24 1.48 -1.26 -1.31 118.94 118.25 1k0g s TRP 141 Ca 0.36 -0.88 -0.29 0.00 -1.06 0.00 0.00 56.10 54.23 1k0g s TRP 141 Cb 0.19 0.22 0.10 0.00 -1.16 0.00 0.00 33.47 32.83 1k0g s TRP 141 CO 0.25 -1.13 0.88 0.00 -4.06 0.00 0.00 176.95 172.89 1k0g s ALA 142 N -3.49 -1.83 -0.23 2.67 0.00 -0.28 -4.54 121.76 114.06 1k0g s ALA 142 Ca 0.23 1.14 -0.07 0.00 0.00 0.00 0.00 51.96 53.27 1k0g s ALA 142 Cb -0.01 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 1k0g s ALA 142 CO 0.12 -0.58 0.05 -1.17 0.00 0.00 0.00 175.76 174.19 1k0g s LEU 143 N -2.08 3.44 -0.21 0.00 2.96 -0.23 0.10 118.68 122.66 1k0g s LEU 143 Ca 0.02 -0.17 -0.03 0.00 -0.22 0.00 0.00 54.13 53.72 1k0g s LEU 143 Cb -0.01 -1.91 -0.01 0.00 0.50 0.00 0.00 46.19 44.77 1k0g s LEU 143 CO -0.05 0.01 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.30 1k0g s ILE 144 N 1.35 3.27 -0.31 6.68 -1.09 0.50 -0.09 121.20 131.50 1k0g s ILE 144 Ca 0.05 -0.53 -0.10 0.00 -2.23 0.00 0.00 60.65 57.84 1k0g s ILE 144 Cb -0.15 -2.48 -0.01 0.00 -1.58 0.00 0.00 42.46 38.25 1k0g s ILE 144 CO 0.03 0.44 0.15 -0.69 -1.23 0.00 0.00 174.94 173.64 1k0g s VAL 145 N 1.41 4.66 -0.40 2.92 1.01 0.67 -0.36 120.40 130.30 1k0g s VAL 145 Ca 0.05 -0.37 -0.07 0.00 0.00 0.00 0.00 61.98 61.59 1k0g s VAL 145 Cb -0.14 -3.36 0.08 0.00 0.00 0.00 0.00 36.38 32.96 1k0g s VAL 145 CO -0.04 0.09 0.22 -0.62 0.00 0.00 0.00 175.10 174.75 1k0g s ASP 146 N 1.63 5.50 0.33 3.32 -1.08 0.45 -1.07 116.67 125.74 1k0g s ASP 146 Ca 0.05 -1.52 0.26 0.00 -0.52 0.00 0.00 52.55 50.82 1k0g s ASP 146 Cb -0.17 -1.93 0.91 0.00 -1.46 0.00 0.00 42.92 40.27 1k0g s ASP 146 CO 0.07 -0.50 1.77 0.45 0.52 0.00 0.00 175.17 177.48 1k0g h HIS 147 N 8.31 0.00 0.14 -5.34 3.86 -1.31 0.60 115.15 121.41 1k0g h HIS 147 Ca -0.21 0.00 -0.34 0.00 -1.16 0.00 0.00 60.37 58.65 1k0g h HIS 147 Cb 1.08 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.54 1k0g h HIS 147 CO 0.60 0.00 -1.79 0.37 0.86 0.00 0.00 177.93 177.97 1k0g h GLN 148 N 0.00 0.30 0.00 2.45 4.15 -1.92 -3.36 115.11 116.73 1k0g h GLN 148 Ca 0.00 -0.52 0.00 0.00 0.77 0.00 0.00 58.65 58.90 1k0g h GLN 148 Cb 0.60 0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.48 1k0g h GLN 148 CO 0.00 1.25 -0.44 0.54 -1.93 0.00 0.00 178.83 178.25 1k0g n ARG 149 N -3.63 0.19 -3.19 1.69 1.74 -1.19 -4.94 116.66 107.34 1k0g n ARG 149 Ca -0.28 0.08 -0.15 0.00 -0.77 0.00 0.00 57.85 56.72 1k0g n ARG 149 Cb 1.02 -1.64 0.07 0.00 -1.02 0.00 0.00 32.46 30.89 1k0g n ARG 149 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1k0g n HIS 150 N -1.93 -1.87 -4.16 -1.55 8.25 0.20 -5.00 115.22 109.15 1k0g n HIS 150 Ca 0.05 0.76 -0.15 0.00 -0.26 0.00 0.00 57.72 58.11 1k0g n HIS 150 Cb 0.40 -4.37 -0.11 0.00 1.12 0.00 0.00 29.99 27.03 1k0g n HIS 150 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1k0g s THR 151 N -3.28 0.94 -0.27 1.59 -4.23 -0.50 -4.76 115.64 105.14 1k0g s THR 151 Ca 0.12 -1.48 -0.02 0.00 -1.18 0.00 0.00 61.69 59.12 1k0g s THR 151 Cb -0.05 -1.19 0.03 0.00 1.34 0.00 0.00 72.50 72.63 1k0g s THR 151 CO 0.58 -0.45 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.49 1k0g s VAL 152 N -2.00 3.05 -0.13 2.29 1.01 -1.26 -0.41 120.40 122.94 1k0g s VAL 152 Ca 0.02 -1.08 0.02 0.00 0.00 0.00 0.00 61.98 60.94 1k0g s VAL 152 Cb -0.06 -2.60 0.01 0.00 0.00 0.00 0.00 36.38 33.73 1k0g s VAL 152 CO 0.01 0.10 -0.21 -0.44 0.00 0.00 0.00 175.10 174.56 1k0g s SER 153 N 1.33 3.02 -0.21 3.32 0.01 0.51 -0.72 113.70 120.95 1k0g s SER 153 Ca -0.01 -0.58 -0.06 0.00 1.31 0.00 0.00 55.95 56.61 1k0g s SER 153 Cb -0.18 -1.40 -0.03 0.00 0.21 0.00 0.00 66.02 64.63 1k0g s SER 153 CO -0.03 0.08 0.02 -0.22 0.41 0.00 0.00 173.24 173.50 1k0g s LEU 154 N 0.81 3.35 0.14 2.44 2.96 -0.36 0.19 118.68 128.20 1k0g s LEU 154 Ca -0.08 -0.18 0.06 0.00 -0.22 0.00 0.00 54.13 53.71 1k0g s LEU 154 Cb -0.16 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.63 1k0g s LEU 154 CO -0.01 0.04 -0.14 -1.48 -1.32 0.00 0.00 176.35 173.44 1k0g s LEU 155 N 1.14 2.44 -0.20 -0.68 0.05 0.12 0.18 118.68 121.71 1k0g s LEU 155 Ca 0.03 -0.86 -0.27 0.00 0.05 0.00 0.00 54.13 53.08 1k0g s LEU 155 Cb -0.14 -0.56 0.07 0.00 -2.05 0.00 0.00 46.19 43.51 1k0g s LEU 155 CO 0.02 -0.16 0.73 -0.55 -0.55 0.00 0.00 176.35 175.83 1k0g s SER 156 N -2.64 -0.70 0.03 1.48 0.15 -0.36 -1.12 113.70 110.54 1k0g s SER 156 Ca 0.12 1.20 0.26 0.00 0.70 0.00 0.00 55.95 58.23 1k0g s SER 156 Cb -0.04 1.15 0.77 0.00 -1.71 0.00 0.00 66.02 66.19 1k0g s SER 156 CO 0.03 -0.35 1.61 1.41 1.20 0.00 0.00 173.24 177.14 1k0g n HIS 157 N 2.12 0.15 -0.91 3.44 8.25 -0.43 -0.08 115.22 127.76 1k0g n HIS 157 Ca -0.15 0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.35 1k0g n HIS 157 Cb 0.56 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 31.22 1k0g n HIS 157 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1k0g n ASN 158 N -1.65 0.00 -4.55 0.41 3.02 -1.26 -4.93 115.26 106.30 1k0g n ASN 158 Ca 0.06 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.18 1k0g n ASN 158 Cb 0.36 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.49 1k0g n ASN 158 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1k0g s ASP 159 N -0.42 6.42 0.39 6.41 -1.08 -1.26 -4.76 116.67 122.37 1k0g s ASP 159 Ca 0.00 -0.09 0.18 0.00 -0.52 0.00 0.00 52.55 52.12 1k0g s ASP 159 Cb 0.00 -2.47 0.79 0.00 -1.46 0.00 0.00 42.92 39.78 1k0g s ASP 159 CO 0.00 -1.24 1.80 1.62 0.52 0.00 0.00 175.17 177.87 1k0g h VAL 160 N 6.08 0.94 -0.21 1.11 3.04 -1.88 -0.38 116.25 124.95 1k0g h VAL 160 Ca -0.25 -1.35 -0.14 0.00 -1.01 0.00 0.00 66.70 63.95 1k0g h VAL 160 Cb 1.07 1.80 -0.01 0.00 -2.01 0.00 0.00 31.29 32.14 1k0g h VAL 160 CO 1.10 0.34 -0.44 0.78 -1.01 0.00 0.00 177.57 178.34 1k0g h ASN 161 N 0.00 0.56 0.80 3.17 2.35 -1.97 0.14 115.58 120.63 1k0g h ASN 161 Ca -0.00 -0.26 -0.12 0.00 -0.55 0.00 0.00 56.30 55.37 1k0g h ASN 161 Cb 0.77 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.97 1k0g h ASN 161 CO 0.05 0.93 -0.56 0.00 -1.65 0.00 0.00 177.43 176.19 1k0g h ALA 162 N 1.10 0.90 -0.17 -0.83 0.00 -1.85 -0.36 119.26 118.04 1k0g h ALA 162 Ca 0.03 -0.51 -0.17 0.00 0.00 0.00 0.00 54.91 54.26 1k0g h ALA 162 Cb 0.94 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 1k0g h ALA 162 CO 0.08 0.70 -0.61 -0.09 0.00 0.00 0.00 179.25 179.33 1k0g h ARG 163 N 0.00 0.58 -0.10 0.00 9.65 -0.69 -1.88 114.38 121.94 1k0g h ARG 163 Ca -0.01 -0.40 -0.00 0.00 -1.10 0.00 0.00 59.98 58.47 1k0g h ARG 163 Cb 1.11 0.06 -0.00 0.00 -1.39 0.00 0.00 29.97 29.74 1k0g h ARG 163 CO 0.07 1.01 0.04 -0.09 2.80 0.00 0.00 179.97 183.81 1k0g h ARG 164 N 0.43 0.15 -0.97 0.20 2.43 -0.61 -0.54 114.38 115.48 1k0g h ARG 164 Ca -0.01 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.20 1k0g h ARG 164 Cb 1.17 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 30.63 1k0g h ARG 164 CO 0.12 0.24 0.62 0.00 -1.51 0.00 0.00 179.97 179.44 1k0g h ALA 165 N 0.90 1.32 -0.52 2.80 0.00 -1.08 0.39 119.26 123.07 1k0g h ALA 165 Ca 0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1k0g h ALA 165 Cb 0.14 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1k0g h ALA 165 CO -0.00 0.44 0.32 2.35 0.00 0.00 0.00 179.25 182.35 1k0g h TRP 166 N 1.16 0.69 -0.19 0.00 7.01 -0.83 -2.50 115.95 121.28 1k0g h TRP 166 Ca 0.41 -0.00 -0.13 0.00 2.11 0.00 0.00 58.89 61.28 1k0g h TRP 166 Cb 0.11 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 26.94 1k0g h TRP 166 CO -0.01 0.47 -0.42 1.25 -2.79 0.00 0.00 178.44 176.94 1k0g h LEU 167 N 0.70 0.48 -0.52 0.65 5.85 -0.07 -2.24 115.31 120.17 1k0g h LEU 167 Ca 0.19 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1k0g h LEU 167 Cb -0.02 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 40.88 1k0g h LEU 167 CO -0.04 0.85 0.00 -0.62 -0.34 0.00 0.00 178.44 178.29 1k0g n GLU 168 N -4.02 1.34 0.00 1.25 1.02 0.13 -2.96 120.64 117.40 1k0g n GLU 168 Ca -0.02 -0.51 0.08 0.00 -0.02 0.00 0.00 57.16 56.69 1k0g n GLU 168 Cb 0.51 -1.32 -0.01 0.00 -0.02 0.00 0.00 31.44 30.59 1k0g n GLU 168 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1k0g n SER 169 N -0.25 1.54 -4.74 1.62 3.41 -0.85 -4.94 113.62 109.41 1k0g n SER 169 Ca 0.14 -1.27 -0.41 0.00 -0.26 0.00 0.00 58.87 57.07 1k0g n SER 169 Cb 0.18 0.54 -0.03 0.00 -0.26 0.00 0.00 64.21 64.65 1k0g n SER 169 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1k0g s GLN 170 N -2.02 4.31 0.18 4.33 -1.52 -1.16 -4.98 119.66 118.80 1k0g s GLN 170 Ca 0.13 2.20 -0.04 0.00 -1.95 0.00 0.00 55.36 55.70 1k0g s GLN 170 Cb 0.13 -3.15 -0.05 0.00 -0.22 0.00 0.00 33.01 29.72 1k0g s GLN 170 CO 0.45 -0.38 0.40 1.14 -0.25 0.00 0.00 175.29 176.66 1k0g s GLN 171 N -0.05 3.59 -0.72 2.91 -2.07 -1.26 -5.00 119.66 117.07 1k0g s GLN 171 Ca 0.60 -0.15 -0.26 0.00 -1.82 0.00 0.00 55.36 53.73 1k0g s GLN 171 Cb -0.40 -2.82 -0.01 0.00 -1.09 0.00 0.00 33.01 28.69 1k0g s GLN 171 CO 0.40 0.42 1.75 -0.06 -1.32 0.00 0.00 175.29 176.47 1k0g s PHE 172 N -1.77 1.85 0.53 9.60 0.40 -1.26 -4.79 117.98 122.55 1k0g s PHE 172 Ca 0.41 0.51 -0.16 0.00 -0.60 0.00 0.00 56.93 57.08 1k0g s PHE 172 Cb -0.12 -4.21 -0.07 0.00 0.51 0.00 0.00 43.02 39.13 1k0g s PHE 172 CO 0.26 -2.14 1.00 -1.12 0.70 0.00 0.00 175.22 173.93 1k0g s SER 173 N 7.12 6.45 0.53 1.36 0.01 -1.26 -5.00 113.70 122.91 1k0g s SER 173 Ca 0.61 1.61 -0.21 0.00 1.31 0.00 0.00 55.95 59.27 1k0g s SER 173 Cb -0.10 -2.51 -0.05 0.00 0.21 0.00 0.00 66.02 63.57 1k0g s SER 173 CO 0.14 -0.71 1.21 -2.84 0.41 0.00 0.00 173.24 171.46 1k0g s PRO 174 N -4.11 3.32 -0.05 12.44 0.02 -1.26 -5.02 135.00 140.34 1k0g s PRO 174 Ca 0.60 1.87 0.03 0.00 0.02 0.00 0.00 61.00 63.51 1k0g s PRO 174 Cb -0.11 -2.17 0.01 0.00 0.02 0.00 0.00 34.50 32.25 1k0g s PRO 174 CO 0.33 -0.93 -0.12 1.14 -0.33 0.00 0.00 177.00 177.09 1k0g s GLN 175 N -3.02 1.55 0.00 5.54 1.03 -1.26 -5.14 119.66 118.36 1k0g s GLN 175 Ca 0.71 -0.41 -0.30 0.00 0.04 0.00 0.00 55.36 55.40 1k0g s GLN 175 Cb -0.31 -1.32 -0.08 0.00 0.03 0.00 0.00 33.01 31.34 1k0g s GLN 175 CO 0.36 0.07 1.82 -2.00 -2.54 0.00 0.00 175.29 172.99 1k0g s GLU 176 N 0.52 4.16 0.41 9.60 -6.30 -1.26 -4.89 118.70 120.93 1k0g s GLU 176 Ca -0.11 2.43 -0.23 0.00 -2.50 0.00 0.00 54.97 54.56 1k0g s GLU 176 Cb -0.14 -4.05 -0.13 0.00 0.00 0.00 0.00 34.13 29.82 1k0g s GLU 176 CO 0.03 -0.90 0.54 -0.25 0.02 0.00 0.00 175.26 174.70 1k0g n ASP 177 N 7.22 -0.91 -4.76 -1.70 8.00 -1.26 0.17 116.55 123.31 1k0g n ASP 177 Ca 0.19 0.92 -0.39 0.00 0.71 0.00 0.00 54.79 56.21 1k0g n ASP 177 Cb 0.42 -1.10 -0.05 0.00 -0.02 0.00 0.00 41.12 40.36 1k0g n ASP 177 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1k0g s PHE 178 N -1.45 3.77 -0.09 1.24 5.36 -1.26 -3.75 117.98 121.79 1k0g s PHE 178 Ca 0.63 1.45 -0.08 0.00 -0.96 0.00 0.00 56.93 57.97 1k0g s PHE 178 Cb -0.62 -2.75 0.03 0.00 -0.34 0.00 0.00 43.02 39.34 1k0g s PHE 178 CO 0.58 0.37 0.24 0.95 -1.46 0.00 0.00 175.22 175.90 1k0g s THR 179 N -0.41 -0.01 0.19 0.12 -4.23 0.70 -4.96 115.64 107.03 1k0g s THR 179 Ca 0.36 0.04 -0.31 0.00 -1.18 0.00 0.00 61.69 60.60 1k0g s THR 179 Cb -0.21 -0.35 -0.10 0.00 1.34 0.00 0.00 72.50 73.18 1k0g s THR 179 CO 0.22 0.02 1.55 -0.76 -0.54 0.00 0.00 174.62 175.11 1k0g s LEU 180 N 0.43 4.37 -0.42 4.79 1.43 -1.26 0.12 118.68 128.14 1k0g s LEU 180 Ca -0.03 2.65 0.05 0.00 -1.03 0.00 0.00 54.13 55.77 1k0g s LEU 180 Cb -0.04 -3.60 0.50 0.00 0.03 0.00 0.00 46.19 43.08 1k0g s LEU 180 CO -0.02 -0.81 1.63 0.35 0.23 0.00 0.00 176.35 177.73 1k0g n THR 181 N 3.61 2.96 -3.71 5.49 -2.24 0.64 -4.80 114.28 116.23 1k0g n THR 181 Ca 0.12 -3.02 0.00 0.00 -2.27 0.00 0.00 64.05 58.88 1k0g n THR 181 Cb 0.39 -0.77 -0.00 0.00 -2.10 0.00 0.00 70.33 67.85 1k0g n THR 181 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1k0g s SER 182 N -2.40 -0.07 0.53 3.42 1.04 -1.24 -4.72 113.70 110.26 1k0g s SER 182 Ca 0.54 -0.23 -0.10 0.00 0.48 0.00 0.00 55.95 56.64 1k0g s SER 182 Cb 0.45 0.24 -0.05 0.00 0.10 0.00 0.00 66.02 66.76 1k0g s SER 182 CO 0.02 -0.45 0.91 -1.81 0.98 0.00 0.00 173.24 172.89 1k0g s ASP 183 N -3.10 6.34 0.16 7.02 1.01 -1.26 -4.55 116.67 122.29 1k0g s ASP 183 Ca 0.16 1.26 -0.30 0.00 0.71 0.00 0.00 52.55 54.38 1k0g s ASP 183 Cb 0.03 -2.39 -0.07 0.00 1.01 0.00 0.00 42.92 41.49 1k0g s ASP 183 CO -0.02 -0.67 1.12 0.26 0.21 0.00 0.00 175.17 176.07 1k0g s TRP 184 N -2.85 3.55 -0.09 4.23 0.52 -1.26 -4.52 118.94 118.53 1k0g s TRP 184 Ca 0.53 1.55 0.01 0.00 0.02 0.00 0.00 56.10 58.20 1k0g s TRP 184 Cb -0.11 -3.31 0.02 0.00 -1.15 0.00 0.00 33.47 28.92 1k0g s TRP 184 CO 0.45 -0.75 -0.10 -1.14 0.02 0.00 0.00 176.95 175.42 1k0g s GLN 185 N -0.19 1.64 0.61 4.98 0.74 0.35 -4.89 119.66 122.91 1k0g s GLN 185 Ca 0.51 -0.35 -0.16 0.00 0.05 0.00 0.00 55.36 55.41 1k0g s GLN 185 Cb -0.30 -1.51 -0.03 0.00 1.10 0.00 0.00 33.01 32.27 1k0g s GLN 185 CO 0.34 -0.12 1.09 0.45 -0.55 0.00 0.00 175.29 176.50 1k0g s SER 186 N 1.18 5.53 0.00 6.67 0.15 -1.26 -0.19 113.70 125.77 1k0g s SER 186 Ca -0.05 1.94 0.12 0.00 0.70 0.00 0.00 55.95 58.66 1k0g s SER 186 Cb -0.14 -2.55 0.53 0.00 -1.71 0.00 0.00 66.02 62.15 1k0g s SER 186 CO -0.02 -1.34 1.37 -0.46 1.20 0.00 0.00 173.24 173.98 1k0g n ASN 187 N -2.05 0.77 -3.54 5.45 6.94 -0.65 -4.81 115.26 117.37 1k0g n ASN 187 Ca 0.10 -1.78 -0.17 0.00 -0.02 0.00 0.00 54.58 52.70 1k0g n ASN 187 Cb 0.52 -0.07 -0.06 0.00 -2.36 0.00 0.00 39.78 37.81 1k0g n ASN 187 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1k0g s MET 188 N -1.85 1.02 0.75 -3.83 0.23 -1.26 -4.92 119.30 109.44 1k0g s MET 188 Ca 0.20 0.38 -0.11 0.00 -1.03 0.00 0.00 55.69 55.12 1k0g s MET 188 Cb 0.10 0.48 0.05 0.00 -1.53 0.00 0.00 34.83 33.93 1k0g s MET 188 CO 0.15 -0.29 1.13 0.95 -2.03 0.00 0.00 175.02 174.93 1k0g s THR 189 N -0.93 2.76 0.30 3.16 -4.23 -1.26 -4.85 115.64 110.59 1k0g s THR 189 Ca -0.09 0.22 0.04 0.00 -1.18 0.00 0.00 61.69 60.68 1k0g s THR 189 Cb -0.01 -3.24 0.30 0.00 1.34 0.00 0.00 72.50 70.89 1k0g s THR 189 CO 0.09 -0.31 1.83 -0.09 -0.54 0.00 0.00 174.62 175.59 1k0g h ARG 190 N -0.83 0.86 -0.01 3.99 9.65 -2.01 0.99 114.38 127.01 1k0g h ARG 190 Ca -0.45 -0.05 -0.20 0.00 -1.10 0.00 0.00 59.98 58.17 1k0g h ARG 190 Cb 1.29 -0.19 -0.00 0.00 -1.39 0.00 0.00 29.97 29.67 1k0g h ARG 190 CO 0.65 0.57 -0.87 1.49 2.80 0.00 0.00 179.97 184.61 1k0g h GLU 191 N 0.88 0.31 -0.08 0.20 4.22 -1.98 0.22 114.58 118.37 1k0g h GLU 191 Ca 0.50 -0.32 -0.15 0.00 0.08 0.00 0.00 59.36 59.47 1k0g h GLU 191 Cb 0.62 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 1k0g h GLU 191 CO -0.27 1.01 -0.63 1.96 -2.18 0.00 0.00 179.01 178.90 1k0g h GLN 192 N 0.18 0.28 0.24 1.92 4.20 -1.65 -0.69 115.11 119.59 1k0g h GLN 192 Ca -0.05 -0.20 -0.01 0.00 0.06 0.00 0.00 58.65 58.44 1k0g h GLN 192 Cb 1.48 0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.30 1k0g h GLN 192 CO 0.14 0.82 -0.11 -0.92 -0.67 0.00 0.00 178.83 178.09 1k0g h TYR 193 N 0.20 -0.30 -0.97 2.96 3.20 -0.51 -1.25 116.97 120.31 1k0g h TYR 193 Ca -0.01 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.93 1k0g h TYR 193 Cb 1.15 0.10 -0.07 0.00 1.54 0.00 0.00 36.73 39.45 1k0g h TYR 193 CO 0.03 -0.15 0.62 0.78 -1.64 0.00 0.00 178.16 177.79 1k0g h GLY 194 N -0.36 1.49 1.04 1.82 0.00 -0.38 0.17 103.07 106.85 1k0g h GLY 194 Ca -0.03 -0.44 -0.04 0.00 0.00 0.00 0.00 47.33 46.81 1k0g h GLY 194 CO 0.05 0.29 0.33 0.83 0.00 0.00 0.00 176.54 178.04 1k0g h GLU 195 N 1.09 1.17 -0.32 4.80 5.08 -0.44 -2.06 114.58 123.90 1k0g h GLU 195 Ca 0.43 -0.20 -0.17 0.00 -1.00 0.00 0.00 59.36 58.42 1k0g h GLU 195 Cb 0.23 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 1k0g h GLU 195 CO -0.19 0.93 -0.47 0.87 -1.00 0.00 0.00 179.01 179.15 1k0g h LYS 196 N 1.14 0.87 -0.36 2.33 1.57 0.12 -0.74 116.57 121.50 1k0g h LYS 196 Ca 0.26 -0.51 0.06 0.00 -1.87 0.00 0.00 60.65 58.60 1k0g h LYS 196 Cb 0.19 0.04 -0.06 0.00 0.08 0.00 0.00 32.23 32.48 1k0g h LYS 196 CO -0.02 1.15 -0.01 0.35 -0.57 0.00 0.00 179.45 180.35 1k0g h PHE 197 N 0.69 -0.03 -0.16 -1.35 3.04 -0.61 0.22 116.94 118.74 1k0g h PHE 197 Ca 0.03 0.03 -0.08 0.00 3.98 0.00 0.00 57.97 61.93 1k0g h PHE 197 Cb 1.07 0.07 -0.01 0.00 2.56 0.00 0.00 35.95 39.64 1k0g h PHE 197 CO 0.07 -0.07 -0.26 0.00 -2.02 0.00 0.00 178.31 176.02 1k0g h ARG 198 N 0.09 0.29 -0.30 1.11 3.08 -1.04 -1.66 114.38 115.96 1k0g h ARG 198 Ca 0.17 -0.10 -0.11 0.00 0.07 0.00 0.00 59.98 60.02 1k0g h ARG 198 Cb 0.24 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 1k0g h ARG 198 CO -0.30 0.54 -0.23 0.37 -1.07 0.00 0.00 179.97 179.28 1k0g h GLN 199 N 0.26 0.68 -0.75 0.04 5.75 -0.24 0.57 115.11 121.43 1k0g h GLN 199 Ca 0.04 -0.34 -0.01 0.00 -0.15 0.00 0.00 58.65 58.20 1k0g h GLN 199 Cb 0.60 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.12 1k0g h GLN 199 CO 0.04 0.94 0.45 0.28 -2.65 0.00 0.00 178.83 177.89 1k0g h VAL 200 N 0.43 1.21 -0.07 2.39 2.07 0.30 -2.12 116.25 120.47 1k0g h VAL 200 Ca 0.06 -0.48 -0.06 0.00 0.82 0.00 0.00 66.70 67.03 1k0g h VAL 200 Cb 0.79 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 1k0g h VAL 200 CO 0.06 0.23 -0.25 1.56 0.02 0.00 0.00 177.57 179.18 1k0g h GLN 201 N 1.03 0.12 -0.09 1.57 4.20 -1.11 -0.44 115.11 120.38 1k0g h GLN 201 Ca 0.27 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.95 1k0g h GLN 201 Cb -0.03 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 1k0g h GLN 201 CO -0.05 0.37 0.05 1.49 -0.67 0.00 0.00 178.83 180.02 1k0g h GLU 202 N 0.11 0.10 -0.79 1.46 4.81 -0.23 0.11 114.58 120.15 1k0g h GLU 202 Ca 0.02 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.32 1k0g h GLU 202 Cb 0.51 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.80 1k0g h GLU 202 CO 0.04 0.07 0.46 1.88 -0.73 0.00 0.00 179.01 180.72 1k0g h TYR 203 N 0.11 0.84 -0.34 0.92 0.05 -1.00 -0.47 116.97 117.07 1k0g h TYR 203 Ca 0.04 0.03 -0.09 0.00 0.05 0.00 0.00 58.73 58.75 1k0g h TYR 203 Cb -0.00 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 37.47 1k0g h TYR 203 CO -0.08 0.37 -0.15 -0.07 -1.05 0.00 0.00 178.16 177.17 1k0g h LEU 204 N 0.80 0.72 -1.18 3.88 3.38 -0.76 0.56 115.31 122.72 1k0g h LEU 204 Ca 0.37 -0.40 0.11 0.00 0.09 0.00 0.00 57.88 58.05 1k0g h LEU 204 Cb 0.29 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.77 1k0g h LEU 204 CO -0.22 0.97 0.59 -0.74 0.09 0.00 0.00 178.44 179.13 1k0g h HIS 205 N 0.48 0.97 -0.00 1.13 2.76 -0.37 0.96 115.15 121.07 1k0g h HIS 205 Ca 0.08 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.27 1k0g h HIS 205 Cb 0.69 -0.31 0.00 0.00 1.55 0.00 0.00 27.41 29.34 1k0g h HIS 205 CO 0.06 0.41 -0.02 0.43 -1.30 0.00 0.00 177.93 177.51 1k0g n SER 206 N -4.56 0.38 0.00 3.26 7.64 -0.22 -4.87 113.62 115.25 1k0g n SER 206 Ca 0.17 -0.97 0.00 0.00 1.01 0.00 0.00 58.87 59.08 1k0g n SER 206 Cb 0.36 -0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.52 1k0g n SER 206 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1k0g n GLY 207 N 1.10 0.52 0.02 0.23 0.00 0.33 -4.93 105.19 102.46 1k0g n GLY 207 Ca 0.21 -0.48 0.12 0.00 0.00 0.00 0.00 46.02 45.87 1k0g n GLY 207 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1k0g n ASP 208 N 0.87 0.50 -3.94 1.61 8.00 0.19 -4.93 116.55 118.85 1k0g n ASP 208 Ca 0.00 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.42 1k0g n ASP 208 Cb 0.00 0.08 -0.04 0.00 -0.02 0.00 0.00 41.12 41.14 1k0g n ASP 208 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1k0g n TYR 210 N -0.41 0.00 -3.63 0.00 4.01 0.19 -4.56 117.16 112.75 1k0g n TYR 210 Ca -0.02 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.61 1k0g n TYR 210 Cb 0.61 -0.31 -0.07 0.00 -0.31 0.00 0.00 39.34 39.26 1k0g n TYR 210 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 1k0g s GLN 211 N -2.90 0.75 -0.05 -0.72 0.74 -1.03 -4.38 119.66 112.07 1k0g s GLN 211 Ca -0.05 1.02 0.02 0.00 0.05 0.00 0.00 55.36 56.40 1k0g s GLN 211 Cb 0.08 0.30 0.02 0.00 1.10 0.00 0.00 33.01 34.51 1k0g s GLN 211 CO 0.54 -0.11 -0.07 0.08 -0.55 0.00 0.00 175.29 175.18 1k0g s VAL 212 N 0.80 0.77 -0.62 1.34 1.01 -0.70 -0.81 120.40 122.17 1k0g s VAL 212 Ca -0.03 -0.26 -0.24 0.00 0.00 0.00 0.00 61.98 61.45 1k0g s VAL 212 Cb -0.05 -0.74 0.06 0.00 0.00 0.00 0.00 36.38 35.64 1k0g s VAL 212 CO -0.07 0.27 0.98 0.21 0.00 0.00 0.00 175.10 176.50 1k0g s ASN 213 N 0.80 6.24 -0.21 3.32 2.47 0.65 0.63 114.94 128.83 1k0g s ASN 213 Ca -0.13 -0.69 -0.09 0.00 0.42 0.00 0.00 52.86 52.36 1k0g s ASN 213 Cb -0.15 -2.44 -0.05 0.00 -1.45 0.00 0.00 41.25 37.17 1k0g s ASN 213 CO 0.02 -1.39 0.12 -0.22 -3.72 0.00 0.00 177.10 171.91 1k0g s LEU 214 N 4.16 4.06 0.14 3.21 2.96 -1.01 -4.83 118.68 127.37 1k0g s LEU 214 Ca 0.26 0.14 0.10 0.00 -0.22 0.00 0.00 54.13 54.42 1k0g s LEU 214 Cb -0.14 -2.06 -0.04 0.00 0.50 0.00 0.00 46.19 44.45 1k0g s LEU 214 CO 0.14 0.14 -0.24 0.00 -1.32 0.00 0.00 176.35 175.07 1k0g s ALA 215 N 0.60 2.26 0.41 5.97 0.00 -1.26 -1.75 121.76 128.00 1k0g s ALA 215 Ca 0.07 -1.46 0.08 0.00 0.00 0.00 0.00 51.96 50.64 1k0g s ALA 215 Cb -0.12 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.63 1k0g s ALA 215 CO 0.01 0.45 0.25 1.14 0.00 0.00 0.00 175.76 177.61 1k0g s GLN 216 N -2.22 2.36 -0.13 0.00 -2.07 0.39 -4.88 119.66 113.09 1k0g s GLN 216 Ca 0.14 -1.69 0.02 0.00 -1.82 0.00 0.00 55.36 52.01 1k0g s GLN 216 Cb -0.09 -2.15 0.00 0.00 -1.09 0.00 0.00 33.01 29.68 1k0g s GLN 216 CO 0.07 -0.12 -0.20 0.50 -1.32 0.00 0.00 175.29 174.22 1k0g s ARG 217 N -3.98 3.11 0.14 9.60 3.52 -1.26 -1.22 118.95 128.85 1k0g s ARG 217 Ca 0.43 -0.82 -0.17 0.00 -0.13 0.00 0.00 55.73 55.05 1k0g s ARG 217 Cb 0.01 -2.47 -0.07 0.00 -1.56 0.00 0.00 34.95 30.85 1k0g s ARG 217 CO 0.25 0.05 0.59 -0.06 -0.81 0.00 0.00 175.30 175.32 1k0g s PHE 218 N 0.68 3.68 0.04 5.12 0.08 0.91 -1.63 117.98 126.85 1k0g s PHE 218 Ca -0.09 1.19 0.02 0.00 0.12 0.00 0.00 56.93 58.17 1k0g s PHE 218 Cb -0.16 -2.45 -0.02 0.00 -0.57 0.00 0.00 43.02 39.81 1k0g s PHE 218 CO 0.01 0.46 -0.08 -1.58 -0.10 0.00 0.00 175.22 173.94 1k0g s HIS 219 N -1.37 0.69 0.29 0.36 5.65 0.73 -1.69 115.29 119.95 1k0g s HIS 219 Ca 0.36 -0.43 -0.15 0.00 0.25 0.00 0.00 55.06 55.10 1k0g s HIS 219 Cb -0.17 -0.41 0.01 0.00 -1.18 0.00 0.00 32.58 30.83 1k0g s HIS 219 CO 0.19 -0.06 0.60 0.00 -0.65 0.00 0.00 174.74 174.82 1k0g s ALA 220 N -1.16 -0.50 0.29 1.58 0.00 -0.70 -0.49 121.76 120.78 1k0g s ALA 220 Ca -0.07 -0.76 0.09 0.00 0.00 0.00 0.00 51.96 51.22 1k0g s ALA 220 Cb -0.09 0.96 -0.04 0.00 0.00 0.00 0.00 23.12 23.94 1k0g s ALA 220 CO 0.00 -0.92 0.04 0.95 0.00 0.00 0.00 175.76 175.83 1k0g s THR 221 N -3.63 3.25 0.21 0.00 -4.23 -1.26 -1.04 115.64 108.93 1k0g s THR 221 Ca 0.19 -1.86 -0.19 0.00 -1.18 0.00 0.00 61.69 58.64 1k0g s THR 221 Cb -0.03 -2.87 0.03 0.00 1.34 0.00 0.00 72.50 70.97 1k0g s THR 221 CO 0.10 -0.30 0.58 -0.72 -0.54 0.00 0.00 174.62 173.73 1k0g s TYR 222 N -2.37 -0.20 0.10 3.99 1.13 -0.14 0.23 117.35 120.09 1k0g s TYR 222 Ca 0.33 -0.14 0.01 0.00 -1.41 0.00 0.00 57.07 55.87 1k0g s TYR 222 Cb -0.05 0.48 -0.04 0.00 -1.10 0.00 0.00 41.96 41.25 1k0g s TYR 222 CO 0.21 -0.97 -0.03 -1.54 -2.51 0.00 0.00 175.55 170.70 1k0g s SER 223 N -2.86 0.91 0.00 -0.18 1.04 0.32 -4.58 113.70 108.35 1k0g s SER 223 Ca 0.08 -1.05 0.00 0.00 0.48 0.00 0.00 55.95 55.46 1k0g s SER 223 Cb -0.02 0.14 0.00 0.00 0.10 0.00 0.00 66.02 66.25 1k0g s SER 223 CO -0.03 -0.54 0.00 0.61 0.98 0.00 0.00 173.24 174.26 1k0g n GLY 224 N -0.05 0.76 3.61 7.32 0.00 -1.25 0.25 105.19 115.84 1k0g n GLY 224 Ca -0.11 -2.15 -0.43 0.00 0.00 0.00 0.00 46.02 43.33 1k0g n GLY 224 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1k0g s ASP 225 N 0.00 6.74 0.59 1.61 2.15 0.45 -4.86 116.67 123.35 1k0g s ASP 225 Ca 0.00 0.67 0.35 0.00 0.43 0.00 0.00 52.55 54.00 1k0g s ASP 225 Cb 0.00 -2.53 1.89 0.00 -0.30 0.00 0.00 42.92 41.98 1k0g s ASP 225 CO 0.00 -1.05 2.21 -0.33 -0.17 0.00 0.00 175.17 175.83 1k0g h GLU 226 N 8.70 0.00 -0.48 4.34 3.07 -1.93 0.16 114.58 128.44 1k0g h GLU 226 Ca -0.22 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 58.66 1k0g h GLU 226 Cb 1.06 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.95 1k0g h GLU 226 CO 1.07 0.03 0.32 2.35 -1.40 0.00 0.00 179.01 181.38 1k0g h TRP 227 N 0.00 0.55 -0.47 4.33 -0.00 -1.93 -0.35 115.95 118.08 1k0g h TRP 227 Ca -0.00 0.01 -0.12 0.00 -0.00 0.00 0.00 58.89 58.78 1k0g h TRP 227 Cb 0.16 -0.18 -0.01 0.00 -0.00 0.00 0.00 29.16 29.12 1k0g h TRP 227 CO 0.00 0.33 -0.20 1.96 -0.00 0.00 0.00 178.44 180.53 1k0g h GLN 228 N 0.58 0.94 -0.77 2.65 1.08 -1.03 0.16 115.11 118.71 1k0g h GLN 228 Ca 0.19 -0.38 0.03 0.00 -1.45 0.00 0.00 58.65 57.03 1k0g h GLN 228 Cb 0.04 -0.04 -0.05 0.00 -0.05 0.00 0.00 27.48 27.38 1k0g h GLN 228 CO -0.05 1.05 0.49 0.00 -0.95 0.00 0.00 178.83 179.37 1k0g h ALA 229 N 0.95 1.00 -0.54 3.87 0.00 -1.23 -2.86 119.26 120.45 1k0g h ALA 229 Ca 0.11 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1k0g h ALA 229 Cb 0.76 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1k0g h ALA 229 CO 0.06 0.30 0.25 0.35 0.00 0.00 0.00 179.25 180.21 1k0g h PHE 230 N 0.96 0.79 -0.82 0.00 3.57 -0.16 0.19 116.94 121.48 1k0g h PHE 230 Ca 0.30 -0.04 0.11 0.00 3.53 0.00 0.00 57.97 61.87 1k0g h PHE 230 Cb -0.00 -0.24 -0.08 0.00 2.79 0.00 0.00 35.95 38.41 1k0g h PHE 230 CO -0.03 0.62 0.45 -0.07 -2.23 0.00 0.00 178.31 177.05 1k0g h LEU 231 N 0.73 0.60 -0.27 0.59 3.38 -0.57 0.21 115.31 119.98 1k0g h LEU 231 Ca 0.18 0.06 -0.12 0.00 0.09 0.00 0.00 57.88 58.10 1k0g h LEU 231 Cb 0.14 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 1k0g h LEU 231 CO -0.02 0.32 -0.29 1.56 0.09 0.00 0.00 178.44 180.10 1k0g h GLN 232 N 0.72 0.68 -0.63 1.13 4.20 -1.23 -2.70 115.11 117.27 1k0g h GLN 232 Ca 0.41 -0.37 -0.08 0.00 0.06 0.00 0.00 58.65 58.67 1k0g h GLN 232 Cb 0.45 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.22 1k0g h GLN 232 CO -0.28 0.98 0.09 -0.07 -0.67 0.00 0.00 178.83 178.87 1k0g h LEU 233 N 0.41 1.02 -0.79 1.46 3.38 0.09 -2.93 115.31 117.95 1k0g h LEU 233 Ca 0.04 -0.27 0.08 0.00 0.09 0.00 0.00 57.88 57.82 1k0g h LEU 233 Cb 0.86 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 41.27 1k0g h LEU 233 CO 0.07 1.03 0.46 -1.13 0.09 0.00 0.00 178.44 178.96 1k0g h ASN 234 N 0.97 0.67 0.05 -0.43 -1.24 -0.59 0.49 115.58 115.50 1k0g h ASN 234 Ca 0.19 0.04 0.01 0.00 0.71 0.00 0.00 56.30 57.25 1k0g h ASN 234 Cb 0.46 -0.09 -0.03 0.00 0.73 0.00 0.00 38.32 39.39 1k0g h ASN 234 CO 0.02 0.40 -0.27 -0.61 -1.29 0.00 0.00 177.43 175.67 1k0g h GLN 235 N 0.79 -0.36 -0.91 6.67 4.15 -1.39 0.21 115.11 124.27 1k0g h GLN 235 Ca 0.37 0.02 0.13 0.00 0.77 0.00 0.00 58.65 59.94 1k0g h GLN 235 Cb 0.29 0.08 -0.09 0.00 0.21 0.00 0.00 27.48 27.98 1k0g h GLN 235 CO -0.22 -0.24 0.53 0.00 -1.93 0.00 0.00 178.83 176.96 1k0g h ALA 236 N -1.02 1.36 0.00 3.38 0.00 -1.32 -3.31 119.26 118.35 1k0g h ALA 236 Ca -0.00 0.05 -0.35 0.00 0.00 0.00 0.00 54.91 54.61 1k0g h ALA 236 Cb 0.39 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 1k0g h ALA 236 CO -0.16 0.07 -2.20 0.09 0.00 0.00 0.00 179.25 177.05 1k0g n ASN 237 N -4.74 0.34 -4.03 0.00 4.13 0.14 -4.98 115.26 106.12 1k0g n ASN 237 Ca 0.17 0.11 -0.28 0.00 1.68 0.00 0.00 54.58 56.26 1k0g n ASN 237 Cb 0.38 0.63 -0.03 0.00 -1.54 0.00 0.00 39.78 39.22 1k0g n ASN 237 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1k0g n ARG 238 N -2.86 -3.20 -3.20 3.52 1.74 0.72 -4.92 116.66 108.47 1k0g n ARG 238 Ca -0.29 0.38 -0.39 0.00 -0.77 0.00 0.00 57.85 56.79 1k0g n ARG 238 Cb 1.12 -4.63 -0.05 0.00 -1.02 0.00 0.00 32.46 27.88 1k0g n ARG 238 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1k0g s ALA 239 N -3.82 3.42 -0.98 7.54 0.00 -1.26 -4.39 121.76 122.28 1k0g s ALA 239 Ca 0.18 -0.04 0.11 0.00 0.00 0.00 0.00 51.96 52.21 1k0g s ALA 239 Cb -0.10 -2.78 0.45 0.00 0.00 0.00 0.00 23.12 20.70 1k0g s ALA 239 CO 0.90 -0.02 1.34 -2.30 0.00 0.00 0.00 175.76 175.68 1k0g n PRO 240 N 3.60 0.01 -2.19 0.00 -0.02 -1.25 -2.51 135.00 132.64 1k0g n PRO 240 Ca -0.05 0.33 -0.20 0.00 -2.02 0.00 0.00 63.50 61.57 1k0g n PRO 240 Cb 0.51 -1.52 0.02 0.00 -0.02 0.00 0.00 33.50 32.50 1k0g n PRO 240 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1k0g n PHE 241 N -1.53 2.49 -1.76 6.00 3.72 0.20 -4.38 117.46 122.20 1k0g n PHE 241 Ca 0.02 -2.24 -0.31 0.00 -0.05 0.00 0.00 57.45 54.88 1k0g n PHE 241 Cb 0.12 -0.31 0.04 0.00 -0.94 0.00 0.00 39.48 38.39 1k0g n PHE 241 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1k0g s SER 242 N -3.63 5.51 0.02 4.37 0.01 -0.86 -4.02 113.70 115.10 1k0g s SER 242 Ca 0.46 1.35 -0.24 0.00 1.31 0.00 0.00 55.95 58.84 1k0g s SER 242 Cb 0.39 -2.23 0.05 0.00 0.21 0.00 0.00 66.02 64.45 1k0g s SER 242 CO 0.02 -1.32 0.54 0.00 0.41 0.00 0.00 173.24 172.88 1k0g s ALA 243 N -3.20 -1.38 -0.12 1.44 0.00 0.19 -0.44 121.76 118.24 1k0g s ALA 243 Ca 0.58 0.73 -0.00 0.00 0.00 0.00 0.00 51.96 53.26 1k0g s ALA 243 Cb -0.12 0.29 0.02 0.00 0.00 0.00 0.00 23.12 23.31 1k0g s ALA 243 CO 0.54 -0.46 -0.10 0.12 0.00 0.00 0.00 175.76 175.86 1k0g s PHE 244 N -2.10 1.70 -0.18 0.00 2.19 0.12 0.49 117.98 120.20 1k0g s PHE 244 Ca -0.07 -0.88 -0.02 0.00 0.33 0.00 0.00 56.93 56.29 1k0g s PHE 244 Cb -0.01 -1.34 -0.01 0.00 -1.31 0.00 0.00 43.02 40.35 1k0g s PHE 244 CO 0.01 -0.56 -0.10 -0.51 1.83 0.00 0.00 175.22 175.90 1k0g s LEU 245 N 1.61 2.75 -0.40 6.12 1.43 -0.20 -0.75 118.68 129.23 1k0g s LEU 245 Ca 0.04 -0.39 -0.17 0.00 -1.03 0.00 0.00 54.13 52.59 1k0g s LEU 245 Cb -0.13 -1.66 0.01 0.00 0.03 0.00 0.00 46.19 44.45 1k0g s LEU 245 CO -0.09 0.06 0.44 -0.60 0.23 0.00 0.00 176.35 176.39 1k0g s ARG 246 N 0.98 3.22 0.51 1.70 6.06 0.25 -1.19 118.95 130.48 1k0g s ARG 246 Ca -0.01 -0.65 0.09 0.00 -2.50 0.00 0.00 55.73 52.66 1k0g s ARG 246 Cb -0.15 -3.93 0.05 0.00 0.06 0.00 0.00 34.95 30.98 1k0g s ARG 246 CO -0.01 -0.79 0.64 -0.51 -2.50 0.00 0.00 175.30 172.14 1k0g s LEU 247 N 2.16 3.26 0.43 -0.88 1.43 0.14 -0.40 118.68 124.82 1k0g s LEU 247 Ca 0.13 -0.75 0.15 0.00 -1.03 0.00 0.00 54.13 52.63 1k0g s LEU 247 Cb -0.17 -1.94 0.96 0.00 0.03 0.00 0.00 46.19 45.08 1k0g s LEU 247 CO 0.13 -1.07 1.96 -0.33 0.23 0.00 0.00 176.35 177.27 1k0g h GLU 248 N 0.46 0.00 -0.00 1.70 5.08 -1.95 -3.21 114.58 116.65 1k0g h GLU 248 Ca -0.35 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 1k0g h GLU 248 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1k0g h GLU 248 CO 0.45 0.22 -0.80 1.04 -1.00 0.00 0.00 179.01 178.93 1k0g n GLN 249 N -4.22 0.32 -3.57 2.33 3.00 -1.26 -5.05 117.38 108.92 1k0g n GLN 249 Ca -0.02 -0.26 0.00 0.00 -0.01 0.00 0.00 57.00 56.71 1k0g n GLN 249 Cb 0.28 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 29.03 1k0g n GLN 249 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1k0g n GLY 250 N 1.48 -1.64 3.51 1.08 0.00 -1.21 -4.77 105.19 103.63 1k0g n GLY 250 Ca 0.06 -1.10 -0.33 0.00 0.00 0.00 0.00 46.02 44.64 1k0g n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k0g s ALA 251 N -1.38 2.79 -0.18 4.61 0.00 -0.13 0.23 121.76 127.71 1k0g s ALA 251 Ca 0.00 -0.94 -0.04 0.00 0.00 0.00 0.00 51.96 50.99 1k0g s ALA 251 Cb 0.00 -1.09 -0.02 0.00 0.00 0.00 0.00 23.12 22.00 1k0g s ALA 251 CO 0.00 0.54 -0.04 0.42 0.00 0.00 0.00 175.76 176.68 1k0g s ILE 252 N -0.69 3.73 -0.50 0.00 -1.09 -0.33 -1.56 121.20 120.77 1k0g s ILE 252 Ca 0.10 -0.40 -0.05 0.00 -2.23 0.00 0.00 60.65 58.08 1k0g s ILE 252 Cb -0.11 -2.65 0.13 0.00 -1.58 0.00 0.00 42.46 38.25 1k0g s ILE 252 CO 0.01 0.47 0.32 -0.76 -1.23 0.00 0.00 174.94 173.75 1k0g s LEU 253 N 0.73 5.41 -0.22 2.97 1.02 -0.11 -1.04 118.68 127.45 1k0g s LEU 253 Ca -0.02 -2.25 -0.09 0.00 0.02 0.00 0.00 54.13 51.79 1k0g s LEU 253 Cb -0.14 -1.89 -0.04 0.00 0.02 0.00 0.00 46.19 44.13 1k0g s LEU 253 CO 0.02 -0.53 0.12 -0.55 0.02 0.00 0.00 176.35 175.42 1k0g s SER 254 N 1.73 5.86 -0.34 2.29 0.15 0.18 -1.29 113.70 122.28 1k0g s SER 254 Ca 0.10 0.08 0.07 0.00 0.70 0.00 0.00 55.95 56.90 1k0g s SER 254 Cb -0.22 -2.04 0.49 0.00 -1.71 0.00 0.00 66.02 62.54 1k0g s SER 254 CO -0.03 0.10 1.47 0.18 1.20 0.00 0.00 173.24 176.15 1k0g n LEU 255 N 4.06 4.74 -4.72 3.45 7.99 0.15 0.56 117.00 133.23 1k0g n LEU 255 Ca -0.16 -4.09 -0.42 0.00 -0.01 0.00 0.00 56.01 51.34 1k0g n LEU 255 Cb 0.52 -0.61 -0.03 0.00 -0.11 0.00 0.00 43.42 43.19 1k0g n LEU 255 CO 0.35 1.50 1.15 -0.55 -1.51 0.00 0.00 177.39 178.33 1k0g s SER 256 N -2.72 6.69 0.00 -1.43 0.15 -1.25 -4.69 113.70 110.46 1k0g s SER 256 Ca 0.49 2.49 0.21 0.00 0.70 0.00 0.00 55.95 59.83 1k0g s SER 256 Cb 0.42 -2.59 0.53 0.00 -1.71 0.00 0.00 66.02 62.67 1k0g s SER 256 CO 0.00 -0.74 1.45 -0.81 1.20 0.00 0.00 173.24 174.33 1k0g n PRO 257 N 3.93 2.24 -4.61 5.44 -0.04 -1.26 0.60 135.00 141.31 1k0g n PRO 257 Ca 0.13 -1.89 -0.33 0.00 -0.04 0.00 0.00 63.50 61.37 1k0g n PRO 257 Cb 0.40 -1.46 -0.15 0.00 -0.04 0.00 0.00 33.50 32.25 1k0g n PRO 257 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1k0g s GLU 258 N -1.52 3.22 0.53 0.54 0.41 -1.26 -4.63 118.70 115.98 1k0g s GLU 258 Ca 0.37 -0.75 -0.19 0.00 -0.41 0.00 0.00 54.97 53.99 1k0g s GLU 258 Cb 0.21 -2.60 -0.06 0.00 -1.78 0.00 0.00 34.13 29.89 1k0g s GLU 258 CO 0.29 0.05 1.06 0.50 -0.49 0.00 0.00 175.26 176.67 1k0g s ARG 259 N 0.73 3.55 0.00 1.61 3.52 -1.26 -1.99 118.95 125.11 1k0g s ARG 259 Ca -0.07 1.36 0.00 0.00 -0.13 0.00 0.00 55.73 56.90 1k0g s ARG 259 Cb -0.16 -2.06 0.00 0.00 -1.56 0.00 0.00 34.95 31.18 1k0g s ARG 259 CO 0.01 -0.64 0.00 0.34 -0.81 0.00 0.00 175.30 174.20 1k0g n PHE 260 N -1.37 0.00 -3.73 5.12 7.35 0.11 -4.45 117.46 120.48 1k0g n PHE 260 Ca 0.10 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.62 1k0g n PHE 260 Cb 0.52 0.00 -0.16 0.00 0.35 0.00 0.00 39.48 40.19 1k0g n PHE 260 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 1k0g s ILE 261 N 0.00 -0.08 -0.16 -2.13 1.01 -1.22 -4.32 121.20 114.31 1k0g s ILE 261 Ca 0.00 0.28 -0.08 0.00 0.00 0.00 0.00 60.65 60.84 1k0g s ILE 261 Cb 0.00 -0.14 -0.04 0.00 0.01 0.00 0.00 42.46 42.29 1k0g s ILE 261 CO 0.00 0.11 0.13 -0.22 0.00 0.00 0.00 174.94 174.97 1k0g s LEU 262 N 1.45 4.29 -0.23 2.97 2.96 0.02 -1.76 118.68 128.38 1k0g s LEU 262 Ca -0.05 0.35 -0.03 0.00 -0.22 0.00 0.00 54.13 54.19 1k0g s LEU 262 Cb -0.12 -2.07 0.07 0.00 0.50 0.00 0.00 46.19 44.57 1k0g s LEU 262 CO -0.04 0.31 0.07 0.00 -1.32 0.00 0.00 176.35 175.37 1k0g s ASP 264 N 1.89 3.37 -1.40 0.00 -1.08 -0.55 -0.25 116.67 118.65 1k0g s ASP 264 Ca 0.03 -0.98 -0.02 0.00 -0.52 0.00 0.00 52.55 51.06 1k0g s ASP 264 Cb -0.17 -0.92 0.01 0.00 -1.46 0.00 0.00 42.92 40.39 1k0g s ASP 264 CO -0.16 -0.26 0.55 -3.20 0.52 0.00 0.00 175.17 172.61 1k0g n ASN 265 N 4.84 -0.95 0.00 -0.34 5.15 -1.26 -0.51 115.26 122.19 1k0g n ASN 265 Ca -0.11 -0.94 0.00 0.00 -0.60 0.00 0.00 54.58 52.93 1k0g n ASN 265 Cb 0.46 -3.36 0.00 0.00 -0.53 0.00 0.00 39.78 36.34 1k0g n ASN 265 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1k0g n SER 266 N -2.98 0.00 -4.66 1.20 7.64 -1.26 -4.96 113.62 108.60 1k0g n SER 266 Ca -0.27 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.23 1k0g n SER 266 Cb 0.66 -0.67 -0.08 0.00 -1.01 0.00 0.00 64.21 63.11 1k0g n SER 266 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1k0g s GLU 267 N -0.21 4.14 0.02 1.43 2.12 0.33 -0.28 118.70 126.25 1k0g s GLU 267 Ca 0.00 0.13 -0.17 0.00 0.36 0.00 0.00 54.97 55.29 1k0g s GLU 267 Cb 0.00 -3.56 -0.06 0.00 0.26 0.00 0.00 34.13 30.77 1k0g s GLU 267 CO 0.00 -0.07 0.47 0.42 -0.54 0.00 0.00 175.26 175.54 1k0g s ILE 268 N 1.43 4.93 0.02 -3.70 1.01 0.16 -1.49 121.20 123.56 1k0g s ILE 268 Ca 0.17 0.98 -0.02 0.00 0.00 0.00 0.00 60.65 61.78 1k0g s ILE 268 Cb -0.15 -3.78 -0.02 0.00 0.01 0.00 0.00 42.46 38.52 1k0g s ILE 268 CO 0.08 0.56 0.02 -1.10 0.00 0.00 0.00 174.94 174.50 1k0g s GLN 269 N -1.01 0.42 0.00 2.79 -0.21 0.43 -1.04 119.66 121.03 1k0g s GLN 269 Ca 0.26 -0.66 0.00 0.00 0.02 0.00 0.00 55.36 54.97 1k0g s GLN 269 Cb -0.18 0.16 0.00 0.00 1.00 0.00 0.00 33.01 33.99 1k0g s GLN 269 CO 0.15 -0.08 0.00 0.25 -2.12 0.00 0.00 175.29 173.49 1k0g n THR 270 N 1.28 0.00 -2.03 -0.19 -2.24 -0.88 -0.80 114.28 109.42 1k0g n THR 270 Ca -0.22 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.14 1k0g n THR 270 Cb 0.56 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.76 1k0g n THR 270 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1k0g s ARG 271 N 3.16 4.26 0.32 -0.78 3.52 -1.26 -4.63 118.95 123.54 1k0g s ARG 271 Ca 0.00 2.24 -0.29 0.00 -0.13 0.00 0.00 55.73 57.55 1k0g s ARG 271 Cb 0.00 -3.22 -0.12 0.00 -1.56 0.00 0.00 34.95 30.05 1k0g s ARG 271 CO 0.00 -0.54 1.49 -2.30 -0.81 0.00 0.00 175.30 173.13 1k0g n PRO 272 N 4.06 2.50 -2.05 5.12 -0.02 -1.26 -1.61 135.00 141.74 1k0g n PRO 272 Ca 0.13 0.88 -0.42 0.00 -2.02 0.00 0.00 63.50 62.07 1k0g n PRO 272 Cb 0.40 -2.60 -0.03 0.00 -0.02 0.00 0.00 33.50 31.25 1k0g n PRO 272 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1k0g s ILE 273 N -0.51 3.35 0.00 4.25 1.01 0.16 -4.75 121.20 124.70 1k0g s ILE 273 Ca 0.60 0.74 0.00 0.00 0.00 0.00 0.00 60.65 61.99 1k0g s ILE 273 Cb -0.52 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 38.47 1k0g s ILE 273 CO 0.55 -0.01 0.00 0.29 0.00 0.00 0.00 174.94 175.77 1k0g n LYS 274 N 5.67 0.00 -1.55 2.79 4.01 -1.26 -4.90 118.16 122.92 1k0g n LYS 274 Ca 0.15 0.00 -0.27 0.00 -0.51 0.00 0.00 58.31 57.68 1k0g n LYS 274 Cb 0.42 0.00 -0.06 0.00 -0.51 0.00 0.00 35.03 34.88 1k0g n LYS 274 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 1k0g n ASP 299 N 0.00 1.80 -4.13 4.39 -0.08 -1.26 -5.16 116.55 112.11 1k0g n ASP 299 Ca 0.00 -0.86 -0.13 0.00 -1.51 0.00 0.00 54.79 52.29 1k0g n ASP 299 Cb 0.00 -1.53 -0.10 0.00 2.34 0.00 0.00 41.12 41.84 1k0g n ASP 299 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 1k0g s ARG 300 N 8.53 1.27 -0.63 -0.67 1.81 -1.26 -5.12 118.95 122.88 1k0g s ARG 300 Ca 1.00 -1.68 -0.03 0.00 -1.72 0.00 0.00 55.73 53.30 1k0g s ARG 300 Cb -0.26 0.24 0.16 0.00 -0.45 0.00 0.00 34.95 34.64 1k0g s ARG 300 CO 0.22 -0.41 0.45 0.00 -0.68 0.00 0.00 175.30 174.88 1k0g s ALA 301 N -4.07 3.59 0.04 2.13 0.00 -1.26 -5.07 121.76 117.12 1k0g s ALA 301 Ca 0.39 -3.25 -0.30 0.00 0.00 0.00 0.00 51.96 48.80 1k0g s ALA 301 Cb 0.07 -2.68 -0.09 0.00 0.00 0.00 0.00 23.12 20.42 1k0g s ALA 301 CO 0.14 -2.10 1.89 -2.00 0.00 0.00 0.00 175.76 173.68 1k0g s GLU 302 N -0.03 4.15 0.36 0.00 2.56 -1.26 -4.88 118.70 119.60 1k0g s GLU 302 Ca 0.17 2.53 0.20 0.00 0.00 0.00 0.00 54.97 57.87 1k0g s GLU 302 Cb -0.20 -4.03 0.21 0.00 2.00 0.00 0.00 34.13 32.12 1k0g s GLU 302 CO -0.04 -0.91 1.49 -2.95 -0.56 0.00 0.00 175.26 172.29 1k0g h ASN 303 N 10.04 0.00 -2.77 -1.70 -1.07 -2.09 -3.46 115.58 114.54 1k0g h ASN 303 Ca -0.47 0.00 -0.65 0.00 0.07 0.00 0.00 56.30 55.25 1k0g h ASN 303 Cb 1.22 0.00 -0.06 0.00 -2.07 0.00 0.00 38.32 37.41 1k0g h ASN 303 CO 0.94 0.17 -0.39 -0.76 0.07 0.00 0.00 177.43 177.47 1k0g s LEU 304 N -6.21 4.42 -0.20 6.14 1.43 -1.26 -5.09 118.68 117.91 1k0g s LEU 304 Ca 0.05 0.63 0.01 0.00 -1.03 0.00 0.00 54.13 53.79 1k0g s LEU 304 Cb 0.06 -2.25 0.02 0.00 0.03 0.00 0.00 46.19 44.06 1k0g s LEU 304 CO 0.71 0.38 -0.17 -0.32 0.23 0.00 0.00 176.35 177.18 1k0g s MET 305 N -1.06 2.90 -0.23 1.70 -2.45 -1.26 -5.11 119.30 113.79 1k0g s MET 305 Ca 0.18 -0.90 -0.06 0.00 -1.25 0.00 0.00 55.69 53.66 1k0g s MET 305 Cb -0.14 -2.66 -0.03 0.00 1.25 0.00 0.00 34.83 33.26 1k0g s MET 305 CO 0.07 -0.27 0.04 0.42 1.05 0.00 0.00 175.02 176.33 1k0g s ILE 306 N 1.28 4.12 -0.08 10.11 1.01 -1.26 -5.08 121.20 131.30 1k0g s ILE 306 Ca 0.03 -0.24 0.04 0.00 0.00 0.00 0.00 60.65 60.48 1k0g s ILE 306 Cb -0.14 -2.90 -0.01 0.00 0.01 0.00 0.00 42.46 39.42 1k0g s ILE 306 CO -0.11 0.38 -0.22 -0.69 0.00 0.00 0.00 174.94 174.30 1k0g s VAL 307 N 1.40 2.33 -0.21 2.92 1.01 -1.26 -5.09 120.40 121.51 1k0g s VAL 307 Ca 0.05 -0.95 -0.15 0.00 0.00 0.00 0.00 61.98 60.93 1k0g s VAL 307 Cb -0.15 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 1k0g s VAL 307 CO 0.02 0.56 0.36 -0.62 0.00 0.00 0.00 175.10 175.42 1k0g s ASP 308 N -0.05 6.38 0.00 3.32 -1.08 -1.26 -4.96 116.67 119.03 1k0g s ASP 308 Ca -0.06 0.45 0.14 0.00 -0.52 0.00 0.00 52.55 52.56 1k0g s ASP 308 Cb -0.15 -2.21 0.78 0.00 -1.46 0.00 0.00 42.92 39.88 1k0g s ASP 308 CO 0.05 -0.05 1.35 0.18 0.52 0.00 0.00 175.17 177.21 1k0g n LEU 309 N 4.45 0.00 -0.06 -1.34 4.77 -1.26 -1.09 117.00 122.47 1k0g n LEU 309 Ca -0.09 0.18 0.03 0.00 -0.03 0.00 0.00 56.01 56.09 1k0g n LEU 309 Cb 0.51 -0.18 -0.02 0.00 -2.33 0.00 0.00 43.42 41.41 1k0g n LEU 309 CO 0.39 -0.09 0.07 0.23 -1.33 0.00 0.00 177.39 176.66 1k0g n MET 310 N -1.18 3.88 -0.24 3.23 2.81 -1.26 -4.21 117.12 120.16 1k0g n MET 310 Ca 0.08 -0.21 -0.02 0.00 -1.81 0.00 0.00 57.70 55.74 1k0g n MET 310 Cb 0.09 -0.85 0.09 0.00 -0.71 0.00 0.00 33.22 31.84 1k0g n MET 310 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 1k0g h ARG 311 N 0.30 0.75 -0.32 0.03 9.65 -1.52 -1.80 114.38 121.47 1k0g h ARG 311 Ca 0.00 -0.04 -0.12 0.00 -1.10 0.00 0.00 59.98 58.71 1k0g h ARG 311 Cb 0.16 -0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 28.56 1k0g h ARG 311 CO 0.00 0.49 -0.30 -0.97 2.80 0.00 0.00 179.97 181.99 1k0g h ASN 312 N 0.77 0.71 -0.34 -3.80 -0.73 -1.85 0.32 115.58 110.65 1k0g h ASN 312 Ca 0.29 -0.28 -0.01 0.00 1.87 0.00 0.00 56.30 58.17 1k0g h ASN 312 Cb 0.11 -0.20 -0.02 0.00 0.27 0.00 0.00 38.32 38.49 1k0g h ASN 312 CO -0.15 0.96 0.17 0.44 -0.37 0.00 0.00 177.43 178.48 1k0g h ASP 313 N 0.58 0.45 -0.55 1.15 3.32 -1.76 -1.92 116.42 117.68 1k0g h ASP 313 Ca 0.07 -0.12 -0.11 0.00 0.02 0.00 0.00 57.03 56.89 1k0g h ASP 313 Cb 0.81 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.23 1k0g h ASP 313 CO 0.07 0.44 -0.08 0.40 -1.72 0.00 0.00 179.24 178.34 1k0g h ILE 314 N 0.42 1.27 0.00 0.35 1.08 -1.11 -2.52 117.51 117.00 1k0g h ILE 314 Ca 0.12 -1.24 0.00 0.00 -0.39 0.00 0.00 64.86 63.35 1k0g h ILE 314 Cb 0.11 0.95 0.00 0.00 -3.07 0.00 0.00 36.82 34.81 1k0g h ILE 314 CO -0.02 0.44 0.00 1.23 -0.69 0.00 0.00 178.15 179.11 1k0g h GLY 315 N 0.90 0.00 2.00 5.37 0.00 -0.09 0.52 103.07 111.77 1k0g h GLY 315 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.47 1k0g h GLY 315 CO 0.04 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.12 1k0g n ARG 316 N -2.82 0.05 0.00 4.80 1.74 -0.75 -3.76 116.66 115.93 1k0g n ARG 316 Ca -0.01 0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.15 1k0g n ARG 316 Cb 0.17 -1.56 0.00 0.00 -1.02 0.00 0.00 32.46 30.05 1k0g n ARG 316 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1k0g n VAL 317 N -1.64 0.00 -1.40 1.55 0.24 0.30 -5.04 118.33 112.35 1k0g n VAL 317 Ca 0.06 -0.15 -0.30 0.00 -2.04 0.00 0.00 64.34 61.92 1k0g n VAL 317 Cb 0.33 0.62 0.12 0.00 -1.47 0.00 0.00 33.84 33.44 1k0g n VAL 317 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1k0g s ALA 318 N -1.07 1.87 0.25 2.33 0.00 0.15 -4.25 121.76 121.04 1k0g s ALA 318 Ca 0.00 -0.20 -0.30 0.00 0.00 0.00 0.00 51.96 51.46 1k0g s ALA 318 Cb 0.00 -3.13 -0.10 0.00 0.00 0.00 0.00 23.12 19.89 1k0g s ALA 318 CO 0.00 -2.08 1.49 0.08 0.00 0.00 0.00 175.76 175.24 1k0g s VAL 319 N -3.08 2.53 0.28 0.00 1.01 -0.03 -4.85 120.40 116.27 1k0g s VAL 319 Ca 0.62 0.44 -0.30 0.00 0.00 0.00 0.00 61.98 62.74 1k0g s VAL 319 Cb -0.16 -3.28 -0.11 0.00 0.00 0.00 0.00 36.38 32.83 1k0g s VAL 319 CO 0.55 0.07 1.58 0.00 0.00 0.00 0.00 175.10 177.30 1k0g s ALA 320 N 0.12 3.73 0.00 5.51 0.00 -1.26 -0.62 121.76 129.24 1k0g s ALA 320 Ca 0.61 1.54 0.00 0.00 0.00 0.00 0.00 51.96 54.11 1k0g s ALA 320 Cb -0.43 -3.64 0.00 0.00 0.00 0.00 0.00 23.12 19.05 1k0g s ALA 320 CO 0.43 -0.95 0.00 0.41 0.00 0.00 0.00 175.76 175.65 1k0g n GLY 321 N 2.21 1.15 0.02 0.00 0.00 -1.26 -4.91 105.19 102.41 1k0g n GLY 321 Ca 0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.22 1k0g n GLY 321 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1k0g n SER 322 N 0.00 0.59 -4.71 1.61 3.41 0.20 -4.93 113.62 109.80 1k0g n SER 322 Ca 0.00 -0.37 -0.42 0.00 -0.26 0.00 0.00 58.87 57.82 1k0g n SER 322 Cb 0.00 0.30 -0.03 0.00 -0.26 0.00 0.00 64.21 64.22 1k0g n SER 322 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1k0g s VAL 323 N -2.95 3.84 -0.00 -3.33 1.01 -1.26 -4.22 120.40 113.48 1k0g s VAL 323 Ca 0.12 1.31 0.07 0.00 0.00 0.00 0.00 61.98 63.48 1k0g s VAL 323 Cb 0.18 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 1k0g s VAL 323 CO 0.70 0.09 -0.22 -0.54 0.00 0.00 0.00 175.10 175.12 1k0g s LYS 324 N 1.20 1.73 0.07 2.72 3.01 0.35 -4.96 119.74 123.86 1k0g s LYS 324 Ca 0.60 -0.85 0.02 0.00 -1.01 0.00 0.00 55.97 54.74 1k0g s LYS 324 Cb -0.31 -1.72 -0.03 0.00 -1.01 0.00 0.00 37.83 34.75 1k0g s LYS 324 CO 0.29 0.47 -0.08 0.14 0.51 0.00 0.00 175.35 176.68 1k0g s VAL 325 N -0.59 0.68 0.62 3.17 -7.23 -1.26 -1.53 120.40 114.26 1k0g s VAL 325 Ca 0.09 -1.50 -0.10 0.00 -1.81 0.00 0.00 61.98 58.65 1k0g s VAL 325 Cb -0.09 -1.15 -0.02 0.00 0.56 0.00 0.00 36.38 35.67 1k0g s VAL 325 CO -0.00 -0.59 1.01 -2.16 -0.31 0.00 0.00 175.10 173.04 1k0g s PRO 326 N -2.64 3.38 -0.09 4.82 0.04 -1.26 -5.00 135.00 134.25 1k0g s PRO 326 Ca 0.01 0.57 -0.30 0.00 0.04 0.00 0.00 61.00 61.32 1k0g s PRO 326 Cb -0.03 -2.11 -0.05 0.00 0.04 0.00 0.00 34.50 32.35 1k0g s PRO 326 CO -0.02 -0.64 1.60 -2.00 0.04 0.00 0.00 177.00 175.98 1k0g s GLU 327 N -5.16 4.13 0.22 4.56 2.12 -1.26 -5.01 118.70 118.32 1k0g s GLU 327 Ca 0.55 2.05 0.06 0.00 0.36 0.00 0.00 54.97 57.99 1k0g s GLU 327 Cb -0.11 -3.96 -0.04 0.00 0.26 0.00 0.00 34.13 30.28 1k0g s GLU 327 CO 0.52 -0.89 0.20 -0.51 -0.54 0.00 0.00 175.26 174.04 1k0g s LEU 328 N 4.13 3.88 -0.06 2.70 1.43 -1.26 -5.10 118.68 124.40 1k0g s LEU 328 Ca 0.71 -0.17 0.04 0.00 -1.03 0.00 0.00 54.13 53.67 1k0g s LEU 328 Cb -0.31 -2.43 0.00 0.00 0.03 0.00 0.00 46.19 43.48 1k0g s LEU 328 CO 0.27 -0.01 -0.18 -0.36 0.23 0.00 0.00 176.35 176.30 1k0g s PHE 329 N -2.01 1.94 -0.22 0.29 0.40 -1.26 -5.26 117.98 111.87 1k0g s PHE 329 Ca 0.33 -0.66 0.13 0.00 -0.60 0.00 0.00 56.93 56.12 1k0g s PHE 329 Cb -0.09 -1.32 0.45 0.00 0.51 0.00 0.00 43.02 42.57 1k0g s PHE 329 CO 0.25 -0.26 1.34 0.28 0.70 0.00 0.00 175.22 177.53 1k0g n VAL 330 N 3.38 2.28 0.00 -0.44 0.31 -1.26 -5.29 118.33 117.32 1k0g n VAL 330 Ca -0.19 -2.58 0.00 0.00 -0.01 0.00 0.00 64.34 61.56 1k0g n VAL 330 Cb 0.53 -0.27 0.00 0.00 -0.91 0.00 0.00 33.84 33.18 1k0g n VAL 330 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1k0g n LEU 340 N -1.06 -1.09 -0.20 7.52 4.77 -1.26 -5.34 117.00 120.34 1k0g n LEU 340 Ca 0.24 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.24 1k0g n LEU 340 Cb 0.85 0.66 0.04 0.00 -2.33 0.00 0.00 43.42 42.63 1k0g n LEU 340 CO 0.09 0.00 0.45 1.33 -1.33 0.00 0.00 177.39 177.93 1k0g n VAL 341 N 0.47 0.58 -3.97 4.08 0.24 -1.26 -4.95 118.33 113.51 1k0g n VAL 341 Ca 0.00 -0.79 -0.08 0.00 -2.04 0.00 0.00 64.34 61.43 1k0g n VAL 341 Cb 0.00 0.75 -0.09 0.00 -1.47 0.00 0.00 33.84 33.03 1k0g n VAL 341 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1k0g s SER 342 N -0.72 0.29 0.27 -1.34 0.15 -1.26 0.37 113.70 111.45 1k0g s SER 342 Ca 0.07 -0.75 -0.00 0.00 0.70 0.00 0.00 55.95 55.97 1k0g s SER 342 Cb 0.04 0.24 0.36 0.00 -1.71 0.00 0.00 66.02 64.95 1k0g s SER 342 CO 0.05 -0.60 1.73 0.71 1.20 0.00 0.00 173.24 176.34 1k0g h THR 343 N 3.26 1.25 -3.89 6.45 1.35 -1.60 -3.42 112.91 116.32 1k0g h THR 343 Ca -0.33 -1.13 -0.54 0.00 -0.55 0.00 0.00 66.41 63.85 1k0g h THR 343 Cb 1.17 1.12 -0.31 0.00 -1.73 0.00 0.00 68.15 68.40 1k0g h THR 343 CO 0.58 0.38 -0.83 -0.63 -0.25 0.00 0.00 175.52 174.77 1k0g s ILE 344 N -4.74 1.32 -0.01 6.82 1.01 -1.26 -4.18 121.20 120.16 1k0g s ILE 344 Ca -0.08 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 59.94 1k0g s ILE 344 Cb 0.14 -1.14 -0.01 0.00 0.01 0.00 0.00 42.46 41.46 1k0g s ILE 344 CO 0.80 0.38 -0.10 -0.89 0.00 0.00 0.00 174.94 175.14 1k0g s THR 345 N 0.06 0.82 0.05 2.92 2.01 -0.58 -2.08 115.64 118.84 1k0g s THR 345 Ca -0.04 -0.44 -0.02 0.00 0.31 0.00 0.00 61.69 61.51 1k0g s THR 345 Cb -0.11 -0.69 0.01 0.00 0.01 0.00 0.00 72.50 71.72 1k0g s THR 345 CO 0.02 0.23 0.10 0.00 -0.69 0.00 0.00 174.62 174.28 1k0g n ALA 346 N 2.87 -0.24 -2.80 7.40 0.00 -0.21 0.13 120.51 127.67 1k0g n ALA 346 Ca -0.14 -0.16 -0.26 0.00 0.00 0.00 0.00 53.44 52.88 1k0g n ALA 346 Cb 0.56 0.12 -0.16 0.00 0.00 0.00 0.00 19.45 19.98 1k0g n ALA 346 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1k0g s GLN 347 N -2.01 1.76 -0.05 0.00 -1.52 -1.26 0.40 119.66 116.97 1k0g s GLN 347 Ca 0.02 -0.64 -0.29 0.00 -1.95 0.00 0.00 55.36 52.51 1k0g s GLN 347 Cb -0.01 -1.56 -0.02 0.00 -0.22 0.00 0.00 33.01 31.20 1k0g s GLN 347 CO 0.01 0.29 0.95 -1.17 -0.25 0.00 0.00 175.29 175.12 1k0g s LEU 348 N -0.08 4.31 0.46 2.90 2.96 0.62 -0.85 118.68 129.00 1k0g s LEU 348 Ca -0.01 1.54 -0.25 0.00 -0.22 0.00 0.00 54.13 55.19 1k0g s LEU 348 Cb -0.11 -3.49 -0.08 0.00 0.50 0.00 0.00 46.19 43.01 1k0g s LEU 348 CO 0.02 -0.31 1.43 -2.65 -1.32 0.00 0.00 176.35 173.52 1k0g n PRO 349 N 4.31 2.20 0.08 0.98 -0.02 -1.26 -4.83 135.00 136.47 1k0g n PRO 349 Ca 0.06 0.79 0.20 0.00 -2.02 0.00 0.00 63.50 62.53 1k0g n PRO 349 Cb 0.50 -2.63 0.75 0.00 -0.02 0.00 0.00 33.50 32.09 1k0g n PRO 349 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1k0g h GLU 350 N 2.19 0.00 -0.18 -0.52 4.57 -1.98 0.28 114.58 118.94 1k0g h GLU 350 Ca -0.51 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.67 1k0g h GLU 350 Cb 1.27 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 1k0g h GLU 350 CO 0.60 0.00 0.00 1.04 -1.18 0.00 0.00 179.01 179.47 1k0g n GLN 351 N -3.85 1.82 -4.03 1.92 3.00 -1.26 -4.87 117.38 110.11 1k0g n GLN 351 Ca 0.07 -1.23 -0.22 0.00 -0.01 0.00 0.00 57.00 55.62 1k0g n GLN 351 Cb 0.60 -1.41 -0.04 0.00 0.00 0.00 0.00 30.24 29.38 1k0g n GLN 351 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1k0g s LEU 352 N -1.59 3.76 0.28 1.08 1.43 0.99 -5.12 118.68 119.51 1k0g s LEU 352 Ca 0.33 -0.31 0.07 0.00 -1.03 0.00 0.00 54.13 53.19 1k0g s LEU 352 Cb 0.18 -2.32 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 1k0g s LEU 352 CO 0.27 -0.12 0.24 -1.00 0.23 0.00 0.00 176.35 175.97 1k0g s HIS 353 N -2.18 3.05 0.36 0.29 3.76 -1.26 -4.86 115.29 114.46 1k0g s HIS 353 Ca 0.35 -0.17 0.12 0.00 -0.15 0.00 0.00 55.06 55.21 1k0g s HIS 353 Cb -0.07 -1.56 0.93 0.00 1.11 0.00 0.00 32.58 32.98 1k0g s HIS 353 CO 0.25 0.39 1.81 0.00 -0.85 0.00 0.00 174.74 176.34 1k0g h ALA 354 N 1.38 1.97 -0.26 -1.40 0.00 -1.96 0.28 119.26 119.26 1k0g h ALA 354 Ca -0.47 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 1k0g h ALA 354 Cb 1.24 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1k0g h ALA 354 CO 0.60 -0.31 0.12 0.66 0.00 0.00 0.00 179.25 180.32 1k0g h SER 355 N 0.57 0.32 -0.22 0.00 4.64 -1.93 0.49 113.55 117.42 1k0g h SER 355 Ca 0.54 -0.02 -0.09 0.00 -0.47 0.00 0.00 61.79 61.74 1k0g h SER 355 Cb 1.09 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 63.09 1k0g h SER 355 CO -0.29 0.28 -0.17 0.44 -0.87 0.00 0.00 176.83 176.23 1k0g h ASP 356 N 0.36 0.64 -0.32 4.97 3.32 -0.83 -1.48 116.42 123.08 1k0g h ASP 356 Ca 0.09 -0.20 -0.12 0.00 0.02 0.00 0.00 57.03 56.82 1k0g h ASP 356 Cb 0.05 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 1k0g h ASP 356 CO -0.01 0.82 -0.28 0.25 -1.72 0.00 0.00 179.24 178.30 1k0g h LEU 357 N 0.58 0.80 -0.85 1.55 5.85 -0.48 -0.98 115.31 121.78 1k0g h LEU 357 Ca 0.09 -0.46 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 1k0g h LEU 357 Cb 0.62 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 1k0g h LEU 357 CO 0.04 1.09 0.50 0.25 -0.34 0.00 0.00 178.44 179.98 1k0g h LEU 358 N 0.52 1.04 -0.12 2.25 5.85 0.10 -2.78 115.31 122.16 1k0g h LEU 358 Ca 0.06 -0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.73 1k0g h LEU 358 Cb 0.85 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1k0g h LEU 358 CO 0.07 0.81 -0.04 -0.09 -0.34 0.00 0.00 178.44 178.85 1k0g h ARG 359 N 1.18 -0.02 0.00 1.25 2.43 -1.04 -2.20 114.38 115.97 1k0g h ARG 359 Ca 0.30 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.46 1k0g h ARG 359 Cb -0.02 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1k0g h ARG 359 CO -0.05 -0.01 -0.08 0.00 -1.51 0.00 0.00 179.97 178.31 1k0g h ALA 360 N 1.10 1.35 -0.23 2.80 0.00 -0.91 -2.26 119.26 121.11 1k0g h ALA 360 Ca 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1k0g h ALA 360 Cb 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1k0g h ALA 360 CO -0.14 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.21 1k0g n ALA 361 N -2.29 2.42 -2.74 0.00 0.00 -0.96 -4.80 120.51 112.14 1k0g n ALA 361 Ca -0.02 -0.86 -0.36 0.00 0.00 0.00 0.00 53.44 52.20 1k0g n ALA 361 Cb 0.19 -0.71 -0.07 0.00 0.00 0.00 0.00 19.45 18.86 1k0g n ALA 361 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1k0g s PHE 362 N -1.44 3.50 0.79 0.00 5.36 -0.85 -3.44 117.98 121.90 1k0g s PHE 362 Ca 0.29 0.52 -0.11 0.00 -0.96 0.00 0.00 56.93 56.67 1k0g s PHE 362 Cb 0.18 -2.19 0.07 0.00 -0.34 0.00 0.00 43.02 40.75 1k0g s PHE 362 CO 0.26 0.40 1.16 -1.25 -1.46 0.00 0.00 175.22 174.33 1k0g s PRO 363 N -0.02 2.03 0.22 10.12 0.04 -1.26 -4.75 135.00 141.38 1k0g s PRO 363 Ca 0.14 0.09 -0.31 0.00 0.04 0.00 0.00 61.00 60.96 1k0g s PRO 363 Cb -0.12 -1.98 -0.10 0.00 0.04 0.00 0.00 34.50 32.33 1k0g s PRO 363 CO 0.03 -1.53 1.54 0.20 0.04 0.00 0.00 177.00 177.28 1k0g s GLY 364 N -4.56 1.91 0.40 0.56 0.00 -1.22 -4.86 107.32 99.54 1k0g s GLY 364 Ca 0.62 1.42 0.15 0.00 0.00 0.00 0.00 44.72 46.90 1k0g s GLY 364 CO 0.49 2.52 1.88 -1.33 0.00 0.00 0.00 173.10 176.65 1k0g h GLY 365 N 5.79 0.92 1.71 0.20 0.00 -1.75 0.18 103.07 110.12 1k0g h GLY 365 Ca -0.45 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.67 1k0g h GLY 365 CO 0.85 0.04 0.00 -1.14 0.00 0.00 0.00 176.54 176.28 1k0g n SER 366 N -4.52 0.00 -0.31 0.19 3.41 -1.26 -2.31 113.62 108.82 1k0g n SER 366 Ca 0.17 0.07 0.05 0.00 -0.26 0.00 0.00 58.87 58.90 1k0g n SER 366 Cb 0.59 -0.35 0.11 0.00 -0.26 0.00 0.00 64.21 64.29 1k0g n SER 366 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1k0g n ILE 367 N -1.35 1.39 0.00 -1.33 -6.64 0.03 -4.75 119.36 106.71 1k0g n ILE 367 Ca 0.12 -1.41 0.00 0.00 -1.77 0.00 0.00 62.75 59.69 1k0g n ILE 367 Cb 0.27 0.22 0.00 0.00 -1.44 0.00 0.00 39.64 38.69 1k0g n ILE 367 CO 0.00 0.00 0.00 0.35 -1.77 0.00 0.00 176.55 175.13 1k0g n THR 368 N -0.45 0.00 -0.27 7.28 -2.24 -1.08 -4.63 114.28 112.90 1k0g n THR 368 Ca 0.10 0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 1k0g n THR 368 Cb 0.48 -0.92 0.00 0.00 -2.10 0.00 0.00 70.33 67.79 1k0g n THR 368 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k0g n GLY 369 N 3.43 0.30 3.09 3.38 0.00 -0.98 -0.25 105.19 114.16 1k0g n GLY 369 Ca 0.00 -1.34 -0.12 0.00 0.00 0.00 0.00 46.02 44.56 1k0g n GLY 369 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k0g s ALA 370 N -1.00 -0.61 0.42 4.61 0.00 0.01 -3.37 121.76 121.82 1k0g s ALA 370 Ca 0.00 0.94 -0.26 0.00 0.00 0.00 0.00 51.96 52.64 1k0g s ALA 370 Cb 0.00 -0.58 -0.08 0.00 0.00 0.00 0.00 23.12 22.46 1k0g s ALA 370 CO 0.00 -0.18 1.31 -2.14 0.00 0.00 0.00 175.76 174.75 1k0g s PRO 371 N 0.91 3.90 0.11 0.00 0.02 -1.26 0.54 135.00 139.21 1k0g s PRO 371 Ca -0.06 2.16 -0.27 0.00 0.02 0.00 0.00 61.00 62.85 1k0g s PRO 371 Cb -0.07 -2.71 -0.10 0.00 0.02 0.00 0.00 34.50 31.64 1k0g s PRO 371 CO -0.06 -0.55 1.65 -0.22 -0.33 0.00 0.00 177.00 177.49 1k0g h LYS 372 N 2.56 -0.43 -0.18 5.54 3.64 -1.95 0.42 116.57 126.17 1k0g h LYS 372 Ca -0.50 0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 58.80 1k0g h LYS 372 Cb 1.25 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.16 1k0g h LYS 372 CO 0.62 -0.29 -0.38 0.28 -2.27 0.00 0.00 179.45 177.41 1k0g h VAL 373 N -0.45 1.30 -0.36 2.00 2.07 -1.98 0.65 116.25 119.48 1k0g h VAL 373 Ca 0.02 -1.50 0.00 0.00 0.82 0.00 0.00 66.70 66.04 1k0g h VAL 373 Cb 0.45 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 1k0g h VAL 373 CO -0.10 0.46 0.23 -0.09 0.02 0.00 0.00 177.57 178.10 1k0g h ARG 374 N 0.34 0.48 -1.00 1.57 9.65 -1.82 -0.70 114.38 122.89 1k0g h ARG 374 Ca 0.03 -0.03 0.06 0.00 -1.10 0.00 0.00 59.98 58.94 1k0g h ARG 374 Cb 0.83 -0.11 -0.07 0.00 -1.39 0.00 0.00 29.97 29.23 1k0g h ARG 374 CO 0.07 0.33 0.65 0.00 2.80 0.00 0.00 179.97 183.82 1k0g h ALA 375 N 1.12 1.40 -0.49 2.80 0.00 -0.25 -0.06 119.26 123.78 1k0g h ALA 375 Ca 0.13 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1k0g h ALA 375 Cb -0.04 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 1k0g h ALA 375 CO -0.03 0.46 0.21 0.52 0.00 0.00 0.00 179.25 180.41 1k0g h MET 376 N 1.19 0.70 -0.24 0.00 2.86 -0.06 0.47 114.93 119.85 1k0g h MET 376 Ca 0.42 -0.09 -0.20 0.00 -2.06 0.00 0.00 59.70 57.77 1k0g h MET 376 Cb 0.14 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 31.67 1k0g h MET 376 CO -0.16 0.57 -0.62 1.49 1.06 0.00 0.00 176.91 179.24 1k0g h GLU 377 N 0.70 0.85 -0.19 1.72 4.81 -0.16 -1.66 114.58 120.64 1k0g h GLU 377 Ca 0.17 -0.58 -0.12 0.00 -0.13 0.00 0.00 59.36 58.70 1k0g h GLU 377 Cb 0.12 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1k0g h GLU 377 CO -0.02 1.21 -0.37 0.82 -0.73 0.00 0.00 179.01 179.92 1k0g h ILE 378 N 0.63 1.30 -0.64 2.32 2.04 -0.12 -2.43 117.51 120.60 1k0g h ILE 378 Ca -0.01 -1.49 0.01 0.00 1.00 0.00 0.00 64.86 64.37 1k0g h ILE 378 Cb 1.24 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 38.84 1k0g h ILE 378 CO 0.13 0.46 0.42 0.40 0.00 0.00 0.00 178.15 179.57 1k0g h ILE 379 N 0.36 1.15 0.00 -0.67 2.04 0.17 -1.98 117.51 118.58 1k0g h ILE 379 Ca 0.04 -0.29 -0.03 0.00 1.00 0.00 0.00 64.86 65.58 1k0g h ILE 379 Cb 0.82 0.22 -0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1k0g h ILE 379 CO 0.07 0.16 -0.12 -0.78 0.00 0.00 0.00 178.15 177.47 1k0g h ASP 380 N 0.86 0.00 0.18 1.72 3.58 -1.13 -0.79 116.42 120.84 1k0g h ASP 380 Ca 0.24 0.00 -0.23 0.00 0.42 0.00 0.00 57.03 57.46 1k0g h ASP 380 Cb -0.08 0.00 0.01 0.00 1.72 0.00 0.00 39.33 40.98 1k0g h ASP 380 CO -0.06 0.12 -0.92 -0.33 -2.88 0.00 0.00 179.24 175.17 1k0g h GLU 381 N 0.00 0.53 0.00 0.28 5.08 -0.88 -2.77 114.58 116.82 1k0g h GLU 381 Ca -0.00 -0.54 -0.34 0.00 -1.00 0.00 0.00 59.36 57.48 1k0g h GLU 381 Cb 0.36 0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.69 1k0g h GLU 381 CO 0.02 1.16 -2.19 1.28 -1.00 0.00 0.00 179.01 178.28 1k0g n LEU 382 N -3.81 0.24 -4.64 1.33 4.77 -0.97 -4.89 117.00 109.03 1k0g n LEU 382 Ca -0.08 0.12 -0.42 0.00 -0.03 0.00 0.00 56.01 55.60 1k0g n LEU 382 Cb 0.82 0.40 -0.04 0.00 -2.33 0.00 0.00 43.42 42.27 1k0g n LEU 382 CO 0.52 0.46 0.71 -1.61 -1.33 0.00 0.00 177.39 176.14 1k0g s GLU 383 N -2.54 4.16 0.29 3.23 2.02 -0.32 -4.93 118.70 120.60 1k0g s GLU 383 Ca -0.08 0.98 0.02 0.00 0.02 0.00 0.00 54.97 55.91 1k0g s GLU 383 Cb 0.07 -3.66 0.60 0.00 0.10 0.00 0.00 34.13 31.24 1k0g s GLU 383 CO 0.83 -0.59 1.81 -1.35 0.02 0.00 0.00 175.26 175.98 1k0g h PRO 384 N 7.73 0.87 -5.80 0.39 0.11 -1.89 -3.41 132.00 130.00 1k0g h PRO 384 Ca -0.22 -0.05 -0.56 0.00 0.11 0.00 0.00 66.00 65.28 1k0g h PRO 384 Cb 1.08 -0.20 -0.14 0.00 0.11 0.00 0.00 31.00 31.86 1k0g h PRO 384 CO 0.91 0.58 -0.70 -0.65 -0.21 0.00 0.00 178.00 177.92 1k0g s GLN 385 N -5.93 1.65 0.62 1.05 1.11 -1.26 0.94 119.66 117.84 1k0g s GLN 385 Ca -0.12 -1.82 -0.19 0.00 0.01 0.00 0.00 55.36 53.25 1k0g s GLN 385 Cb 0.23 -1.47 -0.02 0.00 -1.01 0.00 0.00 33.01 30.74 1k0g s GLN 385 CO 0.80 0.15 1.27 1.03 0.01 0.00 0.00 175.29 178.56 1k0g s ARG 386 N -3.63 2.75 0.42 2.91 0.52 -0.77 -4.73 118.95 116.42 1k0g s ARG 386 Ca 0.30 2.01 0.23 0.00 -0.52 0.00 0.00 55.73 57.75 1k0g s ARG 386 Cb 0.01 -1.91 0.60 0.00 0.52 0.00 0.00 34.95 34.17 1k0g s ARG 386 CO 0.14 -1.43 1.69 0.00 0.02 0.00 0.00 175.30 175.72 1k0g h ARG 387 N 0.75 0.00 0.00 3.54 3.08 -1.92 -3.47 114.38 116.36 1k0g h ARG 387 Ca -0.51 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.54 1k0g h ARG 387 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.37 1k0g h ARG 387 CO 0.54 0.17 0.00 -1.71 -1.07 0.00 0.00 179.97 177.90 1k0g n ASN 388 N -3.19 0.00 0.26 7.04 2.85 -1.26 -1.43 115.26 119.53 1k0g n ASN 388 Ca 0.02 0.00 0.16 0.00 -0.11 0.00 0.00 54.58 54.65 1k0g n ASN 388 Cb 0.51 0.00 0.61 0.00 1.24 0.00 0.00 39.78 42.15 1k0g n ASN 388 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1k0g h ALA 389 N -0.54 1.00 -2.49 5.20 0.00 -1.92 0.25 119.26 120.76 1k0g h ALA 389 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 1k0g h ALA 389 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1k0g h ALA 389 CO 0.00 0.00 0.51 -0.46 0.00 0.00 0.00 179.25 179.30 1k0g s TRP 390 N -3.59 3.50 -0.87 0.00 -0.00 -0.51 -2.35 118.94 115.12 1k0g s TRP 390 Ca 0.02 1.42 0.00 0.00 -0.00 0.00 0.00 56.10 57.54 1k0g s TRP 390 Cb 0.08 -3.34 0.00 0.00 -0.00 0.00 0.00 33.47 30.21 1k0g s TRP 390 CO 0.55 -0.95 0.00 0.00 -0.00 0.00 0.00 176.95 176.56 1k0g n GLY 392 N -1.13 1.10 3.14 0.00 0.00 -0.99 -4.57 105.19 102.74 1k0g n GLY 392 Ca -0.08 -0.88 -0.12 0.00 0.00 0.00 0.00 46.02 44.93 1k0g n GLY 392 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1k0g s SER 393 N -1.00 -0.18 0.02 1.61 0.15 0.12 -0.70 113.70 113.72 1k0g s SER 393 Ca 0.00 0.27 0.07 0.00 0.70 0.00 0.00 55.95 56.99 1k0g s SER 393 Cb 0.00 0.40 -0.03 0.00 -1.71 0.00 0.00 66.02 64.68 1k0g s SER 393 CO 0.00 -0.20 -0.18 -0.63 1.20 0.00 0.00 173.24 173.42 1k0g s ILE 394 N -0.43 2.75 -0.88 6.45 1.01 -1.18 0.04 121.20 128.96 1k0g s ILE 394 Ca -0.05 -1.09 0.00 0.00 0.00 0.00 0.00 60.65 59.51 1k0g s ILE 394 Cb -0.04 -2.12 0.00 0.00 0.01 0.00 0.00 42.46 40.32 1k0g s ILE 394 CO 0.01 0.42 0.00 0.61 0.00 0.00 0.00 174.94 175.98 1k0g n GLY 395 N 1.81 -1.10 3.10 6.18 0.00 -0.81 0.33 105.19 114.70 1k0g n GLY 395 Ca -0.16 -0.83 -0.13 0.00 0.00 0.00 0.00 46.02 44.90 1k0g n GLY 395 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1k0g s TYR 396 N -3.00 0.78 -0.39 1.61 -0.85 -0.71 -0.93 117.35 113.86 1k0g s TYR 396 Ca 0.00 -0.61 0.03 0.00 -0.52 0.00 0.00 57.07 55.98 1k0g s TYR 396 Cb 0.00 -0.46 0.11 0.00 0.38 0.00 0.00 41.96 41.99 1k0g s TYR 396 CO 0.00 -0.09 0.12 -0.51 -1.52 0.00 0.00 175.55 173.56 1k0g s LEU 397 N -2.00 4.20 0.59 -3.49 1.02 -0.09 -2.72 118.68 116.20 1k0g s LEU 397 Ca -0.03 -2.34 -0.17 0.00 0.02 0.00 0.00 54.13 51.61 1k0g s LEU 397 Cb -0.06 -1.50 -0.03 0.00 0.02 0.00 0.00 46.19 44.62 1k0g s LEU 397 CO -0.01 -0.34 1.09 -0.55 0.02 0.00 0.00 176.35 176.57 1k0g s SER 398 N 0.65 5.58 0.63 2.29 0.15 0.87 -1.09 113.70 122.78 1k0g s SER 398 Ca 0.13 1.99 0.38 0.00 0.70 0.00 0.00 55.95 59.15 1k0g s SER 398 Cb -0.21 -2.56 2.14 0.00 -1.71 0.00 0.00 66.02 63.69 1k0g s SER 398 CO -0.08 -1.31 2.32 -0.26 1.20 0.00 0.00 173.24 175.11 1k0g h PHE 399 N 0.61 0.00 0.00 3.44 0.04 -0.57 -0.25 116.94 120.21 1k0g h PHE 399 Ca -0.48 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.29 1k0g h PHE 399 Cb 1.24 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.39 1k0g h PHE 399 CO 0.55 0.00 0.00 0.00 -0.60 0.00 0.00 178.31 178.26 1k0g n GLY 401 N 0.74 2.64 3.79 0.00 0.00 -0.11 -4.62 105.19 107.64 1k0g n GLY 401 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1k0g n GLY 401 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1k0g s ASN 402 N -0.77 3.52 -0.01 1.61 0.01 -1.25 -4.59 114.94 113.45 1k0g s ASN 402 Ca 0.00 0.94 -0.13 0.00 -0.71 0.00 0.00 52.86 52.96 1k0g s ASN 402 Cb 0.00 -1.50 0.02 0.00 0.41 0.00 0.00 41.25 40.18 1k0g s ASN 402 CO 0.00 -2.54 0.27 -0.32 -1.51 0.00 0.00 177.10 173.00 1k0g s MET 403 N -5.30 0.62 -0.04 -0.60 -2.45 0.66 -0.09 119.30 112.09 1k0g s MET 403 Ca 0.64 -0.22 -0.06 0.00 -1.25 0.00 0.00 55.69 54.81 1k0g s MET 403 Cb -0.14 0.27 0.01 0.00 1.25 0.00 0.00 34.83 36.22 1k0g s MET 403 CO 0.53 -0.16 0.15 0.34 1.05 0.00 0.00 175.02 176.92 1k0g s ASP 404 N -1.29 -0.12 0.03 1.11 2.15 -1.10 -0.92 116.67 116.54 1k0g s ASP 404 Ca -0.13 0.19 -0.13 0.00 0.43 0.00 0.00 52.55 52.91 1k0g s ASP 404 Cb -0.06 0.29 0.02 0.00 -0.30 0.00 0.00 42.92 42.87 1k0g s ASP 404 CO 0.04 -0.12 0.28 0.42 -0.17 0.00 0.00 175.17 175.62 1k0g s THR 405 N -0.23 0.08 0.40 1.71 -4.23 -0.72 -1.74 115.64 110.92 1k0g s THR 405 Ca -0.03 -0.69 0.08 0.00 -1.18 0.00 0.00 61.69 59.86 1k0g s THR 405 Cb -0.02 -0.88 -0.03 0.00 1.34 0.00 0.00 72.50 72.90 1k0g s THR 405 CO 0.00 -0.38 0.31 -0.94 -0.54 0.00 0.00 174.62 173.07 1k0g s SER 406 N -1.96 4.92 -0.26 3.99 1.04 0.15 -0.72 113.70 120.86 1k0g s SER 406 Ca -0.06 -0.79 -0.11 0.00 0.48 0.00 0.00 55.95 55.47 1k0g s SER 406 Cb -0.02 -0.61 -0.05 0.00 0.10 0.00 0.00 66.02 65.45 1k0g s SER 406 CO -0.02 -0.57 0.17 -0.63 0.98 0.00 0.00 173.24 173.16 1k0g s ILE 407 N -2.48 5.27 -1.33 -1.02 1.01 -0.84 -3.08 121.20 118.73 1k0g s ILE 407 Ca 0.45 0.15 -0.10 0.00 0.00 0.00 0.00 60.65 61.16 1k0g s ILE 407 Cb -0.02 -3.49 0.13 0.00 0.01 0.00 0.00 42.46 39.09 1k0g s ILE 407 CO 0.26 0.29 2.04 0.35 0.00 0.00 0.00 174.94 177.88 1k0g n THR 408 N 4.76 4.31 -2.00 2.92 -2.24 0.13 -4.64 114.28 117.52 1k0g n THR 408 Ca -0.14 -4.09 -0.29 0.00 -2.27 0.00 0.00 64.05 57.26 1k0g n THR 408 Cb 0.52 -2.38 0.06 0.00 -2.10 0.00 0.00 70.33 66.44 1k0g n THR 408 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1k0g s ILE 409 N 0.72 2.91 -1.54 2.28 -4.36 -1.26 0.56 121.20 120.51 1k0g s ILE 409 Ca 0.44 0.18 -0.06 0.00 -0.26 0.00 0.00 60.65 60.94 1k0g s ILE 409 Cb 0.12 -3.27 0.06 0.00 1.25 0.00 0.00 42.46 40.61 1k0g s ILE 409 CO -0.03 -0.34 0.46 0.54 0.24 0.00 0.00 174.94 175.82 1k0g n ARG 410 N -3.03 -2.75 -4.45 0.37 3.00 -1.26 -3.85 116.66 104.69 1k0g n ARG 410 Ca 0.07 0.33 -0.26 0.00 -0.01 0.00 0.00 57.85 57.98 1k0g n ARG 410 Cb 0.59 -4.54 -0.17 0.00 0.00 0.00 0.00 32.46 28.34 1k0g n ARG 410 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 1k0g s THR 411 N -3.81 1.21 0.01 0.55 2.01 -1.26 -0.68 115.64 113.67 1k0g s THR 411 Ca 0.25 -0.49 -0.01 0.00 0.31 0.00 0.00 61.69 61.75 1k0g s THR 411 Cb -0.14 -1.12 -0.04 0.00 0.01 0.00 0.00 72.50 71.21 1k0g s THR 411 CO 0.93 0.38 0.17 -0.76 -0.69 0.00 0.00 174.62 174.64 1k0g s LEU 412 N 0.92 4.28 -0.18 4.42 1.02 -0.41 -4.34 118.68 124.38 1k0g s LEU 412 Ca -0.09 0.28 -0.01 0.00 0.02 0.00 0.00 54.13 54.33 1k0g s LEU 412 Cb -0.15 -2.65 -0.00 0.00 0.02 0.00 0.00 46.19 43.41 1k0g s LEU 412 CO 0.01 0.24 -0.13 -0.89 0.02 0.00 0.00 176.35 175.60 1k0g s THR 413 N -1.36 2.81 -0.22 5.49 2.01 -0.07 -0.93 115.64 123.37 1k0g s THR 413 Ca 0.29 -0.71 0.01 0.00 0.31 0.00 0.00 61.69 61.60 1k0g s THR 413 Cb -0.13 -2.22 0.04 0.00 0.01 0.00 0.00 72.50 70.20 1k0g s THR 413 CO 0.21 0.49 -0.14 0.00 -0.69 0.00 0.00 174.62 174.49 1k0g s ALA 414 N 1.06 2.49 -0.19 7.40 0.00 -0.60 -0.18 121.76 131.73 1k0g s ALA 414 Ca -0.00 -1.49 -0.05 0.00 0.00 0.00 0.00 51.96 50.42 1k0g s ALA 414 Cb -0.15 -1.43 0.09 0.00 0.00 0.00 0.00 23.12 21.64 1k0g s ALA 414 CO -0.03 -0.78 0.35 0.42 0.00 0.00 0.00 175.76 175.72 1k0g s ILE 415 N 1.22 -0.55 -0.93 0.00 1.01 0.22 -0.95 121.20 121.21 1k0g s ILE 415 Ca -0.02 0.12 -0.05 0.00 0.00 0.00 0.00 60.65 60.70 1k0g s ILE 415 Cb -0.17 -0.64 0.01 0.00 0.01 0.00 0.00 42.46 41.67 1k0g s ILE 415 CO -0.08 0.01 0.81 0.59 0.00 0.00 0.00 174.94 176.27 1k0g n ASN 416 N 5.37 -4.42 -0.59 3.58 3.02 -1.26 -1.76 115.26 119.19 1k0g n ASN 416 Ca -0.06 -0.39 -0.06 0.00 -0.03 0.00 0.00 54.58 54.03 1k0g n ASN 416 Cb 0.50 -3.71 -0.03 0.00 -0.61 0.00 0.00 39.78 35.93 1k0g n ASN 416 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k0g n GLY 417 N -1.46 0.60 3.60 7.41 0.00 -1.26 -4.96 105.19 109.12 1k0g n GLY 417 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 1k0g n GLY 417 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1k0g s GLN 418 N -2.23 3.69 -0.02 1.61 -1.52 -0.72 -0.97 119.66 119.50 1k0g s GLN 418 Ca 0.00 -0.41 0.05 0.00 -1.95 0.00 0.00 55.36 53.05 1k0g s GLN 418 Cb 0.00 -3.04 -0.01 0.00 -0.22 0.00 0.00 33.01 29.74 1k0g s GLN 418 CO 0.00 0.35 -0.17 -1.50 -0.25 0.00 0.00 175.29 173.72 1k0g s ILE 419 N 0.12 1.35 0.08 1.08 2.07 -0.21 -0.61 121.20 125.07 1k0g s ILE 419 Ca 0.02 -0.72 0.10 0.00 -1.41 0.00 0.00 60.65 58.64 1k0g s ILE 419 Cb -0.13 -1.13 -0.03 0.00 0.13 0.00 0.00 42.46 41.30 1k0g s ILE 419 CO 0.02 0.38 -0.26 -0.36 -1.91 0.00 0.00 174.94 172.81 1k0g s PHE 420 N -0.33 2.26 -0.13 3.50 0.40 0.75 -1.73 117.98 122.69 1k0g s PHE 420 Ca 0.05 -0.40 -0.04 0.00 -0.60 0.00 0.00 56.93 55.94 1k0g s PHE 420 Cb -0.07 -1.30 0.07 0.00 0.51 0.00 0.00 43.02 42.22 1k0g s PHE 420 CO -0.00 0.20 0.21 0.00 0.70 0.00 0.00 175.22 176.32 1k0g s SER 422 N 2.34 5.68 -0.24 0.00 0.01 -1.26 -0.06 113.70 120.17 1k0g s SER 422 Ca 0.04 -0.34 -0.16 0.00 1.31 0.00 0.00 55.95 56.79 1k0g s SER 422 Cb -0.13 -1.03 0.07 0.00 0.21 0.00 0.00 66.02 65.14 1k0g s SER 422 CO -0.08 -0.48 0.61 0.00 0.41 0.00 0.00 173.24 173.70 1k0g s ALA 423 N -2.26 -1.60 0.33 1.44 0.00 -0.36 -4.63 121.76 114.68 1k0g s ALA 423 Ca 0.46 2.04 0.05 0.00 0.00 0.00 0.00 51.96 54.51 1k0g s ALA 423 Cb -0.08 -1.20 -0.03 0.00 0.00 0.00 0.00 23.12 21.80 1k0g s ALA 423 CO 0.30 -0.33 0.19 0.20 0.00 0.00 0.00 175.76 176.12 1k0g s GLY 424 N 1.21 2.26 -0.18 0.00 0.00 -1.26 0.15 107.32 109.49 1k0g s GLY 424 Ca -0.07 -1.74 -0.15 0.00 0.00 0.00 0.00 44.72 42.75 1k0g s GLY 424 CO -0.12 -1.59 0.48 -0.32 0.00 0.00 0.00 173.10 171.54 1k0g s GLY 425 N -3.42 -0.37 -0.32 0.20 0.00 -0.71 -4.61 107.32 98.09 1k0g s GLY 425 Ca 0.35 1.42 -0.29 0.00 0.00 0.00 0.00 44.72 46.20 1k0g s GLY 425 CO 0.20 1.30 1.38 -0.32 0.00 0.00 0.00 173.10 175.66 1k0g s GLY 426 N 0.49 1.27 -0.13 0.20 0.00 -1.26 -2.41 107.32 105.48 1k0g s GLY 426 Ca -0.02 0.08 -0.19 0.00 0.00 0.00 0.00 44.72 44.59 1k0g s GLY 426 CO -0.02 2.70 0.51 -0.42 0.00 0.00 0.00 173.10 175.88 1k0g s ILE 427 N 4.83 5.15 0.51 0.90 1.01 0.20 -4.87 121.20 128.93 1k0g s ILE 427 Ca 0.60 1.01 0.01 0.00 0.00 0.00 0.00 60.65 62.27 1k0g s ILE 427 Cb -0.17 -3.85 -0.00 0.00 0.01 0.00 0.00 42.46 38.45 1k0g s ILE 427 CO 0.27 0.28 0.04 0.68 0.00 0.00 0.00 174.94 176.20 1k0g s VAL 428 N 0.90 0.88 0.42 2.92 -7.23 -1.26 -1.73 120.40 115.30 1k0g s VAL 428 Ca 0.27 -2.00 0.14 0.00 -1.81 0.00 0.00 61.98 58.58 1k0g s VAL 428 Cb -0.15 -2.06 0.34 0.00 0.56 0.00 0.00 36.38 35.06 1k0g s VAL 428 CO 0.11 0.00 1.95 0.00 -0.31 0.00 0.00 175.10 176.85 1k0g h ALA 429 N 1.38 2.02 -0.55 1.32 0.00 -1.97 0.17 119.26 121.62 1k0g h ALA 429 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1k0g h ALA 429 Cb 1.32 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1k0g h ALA 429 CO 0.68 -0.18 0.00 -0.25 0.00 0.00 0.00 179.25 179.50 1k0g n ASP 430 N -4.48 4.28 -4.69 0.00 8.00 -1.26 -4.96 116.55 113.44 1k0g n ASP 430 Ca 0.12 -2.41 -0.30 0.00 0.71 0.00 0.00 54.79 52.90 1k0g n ASP 430 Cb 0.42 -0.51 0.15 0.00 -0.02 0.00 0.00 41.12 41.16 1k0g n ASP 430 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1k0g s SER 431 N -1.07 3.28 -0.05 -2.24 0.01 0.59 -5.02 113.70 109.19 1k0g s SER 431 Ca 0.45 1.80 0.06 0.00 1.31 0.00 0.00 55.95 59.57 1k0g s SER 431 Cb 0.29 -2.41 -0.02 0.00 0.21 0.00 0.00 66.02 64.09 1k0g s SER 431 CO 0.22 -2.81 -0.22 -1.10 0.41 0.00 0.00 173.24 169.73 1k0g s GLN 432 N -4.78 2.42 0.12 12.44 -1.52 -1.26 -4.96 119.66 122.12 1k0g s GLN 432 Ca 0.64 -0.86 -0.26 0.00 -1.95 0.00 0.00 55.36 52.93 1k0g s GLN 432 Cb -0.20 -2.19 -0.06 0.00 -0.22 0.00 0.00 33.01 30.33 1k0g s GLN 432 CO 0.58 0.49 1.63 1.49 -0.25 0.00 0.00 175.29 179.24 1k0g h GLU 433 N 5.72 -0.42 -0.21 2.91 4.81 -1.99 -1.60 114.58 123.80 1k0g h GLU 433 Ca -0.39 0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 58.76 1k0g h GLU 433 Cb 1.15 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.62 1k0g h GLU 433 CO 0.48 -0.28 -0.29 1.49 -0.73 0.00 0.00 179.01 179.69 1k0g h GLU 434 N -0.43 0.57 -0.90 1.92 4.57 -1.99 0.36 114.58 118.67 1k0g h GLU 434 Ca 0.05 -0.33 0.11 0.00 -1.18 0.00 0.00 59.36 58.01 1k0g h GLU 434 Cb 0.49 0.03 -0.07 0.00 -0.16 0.00 0.00 28.75 29.04 1k0g h GLU 434 CO -0.20 0.93 0.58 0.00 -1.18 0.00 0.00 179.01 179.14 1k0g h ALA 435 N 0.63 1.68 -0.18 2.92 0.00 -1.98 0.67 119.26 123.00 1k0g h ALA 435 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1k0g h ALA 435 Cb 0.86 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1k0g h ALA 435 CO 0.07 0.11 -0.30 1.49 0.00 0.00 0.00 179.25 180.63 1k0g h GLU 436 N 0.84 0.52 -0.12 0.00 4.57 -0.94 0.26 114.58 119.71 1k0g h GLU 436 Ca 0.43 -0.32 0.04 0.00 -1.18 0.00 0.00 59.36 58.34 1k0g h GLU 436 Cb 0.51 0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 29.08 1k0g h GLU 436 CO -0.20 0.92 -0.16 -0.92 -1.18 0.00 0.00 179.01 177.47 1k0g h TYR 437 N 0.17 -0.41 -0.22 0.92 3.20 -0.22 -1.18 116.97 119.22 1k0g h TYR 437 Ca 0.01 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.87 1k0g h TYR 437 Cb 0.88 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 39.34 1k0g h TYR 437 CO 0.09 -0.23 -0.01 1.96 -1.64 0.00 0.00 178.16 178.32 1k0g h GLN 438 N -0.20 0.32 -0.86 1.82 1.08 -0.81 -1.28 115.11 115.18 1k0g h GLN 438 Ca 0.09 -0.05 -0.03 0.00 -1.45 0.00 0.00 58.65 57.21 1k0g h GLN 438 Cb 0.34 -0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 27.68 1k0g h GLN 438 CO -0.25 0.36 0.43 1.49 -0.95 0.00 0.00 178.83 179.91 1k0g h GLU 439 N 0.31 1.22 -0.50 1.46 4.22 0.25 -2.21 114.58 119.33 1k0g h GLU 439 Ca 0.07 -0.17 0.06 0.00 0.08 0.00 0.00 59.36 59.40 1k0g h GLU 439 Cb 0.24 -0.23 -0.05 0.00 0.50 0.00 0.00 28.75 29.21 1k0g h GLU 439 CO 0.01 0.93 0.20 1.79 -2.18 0.00 0.00 179.01 179.76 1k0g h THR 440 N 1.21 0.87 -0.60 0.32 1.35 -0.04 0.81 112.91 116.83 1k0g h THR 440 Ca 0.30 -0.14 -0.01 0.00 -0.55 0.00 0.00 66.41 66.01 1k0g h THR 440 Cb 0.09 0.44 -0.03 0.00 -1.73 0.00 0.00 68.15 66.92 1k0g h THR 440 CO -0.04 0.07 0.36 -0.26 -0.25 0.00 0.00 175.52 175.40 1k0g h PHE 441 N 0.40 0.81 0.00 4.73 -1.00 -1.29 -1.60 116.94 118.99 1k0g h PHE 441 Ca 0.23 -0.01 -0.01 0.00 2.81 0.00 0.00 57.97 61.00 1k0g h PHE 441 Cb 0.22 -0.26 -0.00 0.00 3.61 0.00 0.00 35.95 39.51 1k0g h PHE 441 CO -0.14 0.56 -0.03 -0.44 -1.61 0.00 0.00 178.31 176.65 1k0g h ASP 442 N 0.82 0.00 0.32 2.17 3.32 -1.03 1.58 116.42 123.60 1k0g h ASP 442 Ca 0.22 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.20 1k0g h ASP 442 Cb -0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1k0g h ASP 442 CO -0.04 0.03 -0.32 0.11 -1.72 0.00 0.00 179.24 177.30 1k0g h LYS 443 N 0.00 0.00 0.00 3.56 1.57 0.20 -3.35 116.57 118.55 1k0g h LYS 443 Ca -0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1k0g h LYS 443 Cb 0.06 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1k0g h LYS 443 CO 0.00 0.32 0.00 1.33 -0.57 0.00 0.00 179.45 180.53 1k0g n VAL 444 N -4.16 0.26 -0.30 0.50 0.24 0.23 -4.78 118.33 110.32 1k0g n VAL 444 Ca -0.02 -0.41 0.13 0.00 -2.04 0.00 0.00 64.34 61.99 1k0g n VAL 444 Cb 0.36 1.10 0.37 0.00 -1.47 0.00 0.00 33.84 34.20 1k0g n VAL 444 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 1k0g h ASN 445 N 0.00 0.67 -0.69 -1.34 2.35 0.20 0.27 115.58 117.05 1k0g h ASN 445 Ca 0.00 0.05 -0.03 0.00 -0.55 0.00 0.00 56.30 55.77 1k0g h ASN 445 Cb 0.45 -0.07 -0.03 0.00 0.05 0.00 0.00 38.32 38.71 1k0g h ASN 445 CO 0.00 0.31 0.31 -0.09 -1.65 0.00 0.00 177.43 176.30 1k0g h ARG 446 N 0.69 1.01 -0.12 0.81 2.43 -1.85 0.41 114.38 117.76 1k0g h ARG 446 Ca 0.49 -0.16 -0.02 0.00 -0.81 0.00 0.00 59.98 59.48 1k0g h ARG 446 Cb 0.82 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 30.19 1k0g h ARG 446 CO -0.25 0.81 0.01 0.82 -1.51 0.00 0.00 179.97 179.85 1k0g h ILE 447 N 0.97 1.24 -0.35 1.20 2.04 -0.85 0.22 117.51 121.98 1k0g h ILE 447 Ca 0.23 -0.78 -0.01 0.00 1.00 0.00 0.00 64.86 65.31 1k0g h ILE 447 Cb 0.16 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 1k0g h ILE 447 CO -0.03 0.23 0.18 -0.07 0.00 0.00 0.00 178.15 178.46 1k0g h LEU 448 N -0.04 0.44 -0.74 1.44 3.38 -0.96 -1.49 115.31 117.34 1k0g h LEU 448 Ca 0.04 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 1k0g h LEU 448 Cb 0.34 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1k0g h LEU 448 CO 0.01 0.41 -0.14 0.11 0.09 0.00 0.00 178.44 178.92 1k0g h LYS 449 N 0.43 0.82 -0.80 1.13 6.56 -0.14 0.44 116.57 125.02 1k0g h LYS 449 Ca 0.12 -0.29 0.12 0.00 -1.06 0.00 0.00 60.65 59.54 1k0g h LYS 449 Cb 0.08 -0.06 -0.08 0.00 -0.57 0.00 0.00 32.23 31.60 1k0g h LYS 449 CO -0.02 0.91 0.41 0.37 -2.06 0.00 0.00 179.45 179.06 1k0g h GLN 450 N 0.73 0.63 0.00 3.15 5.75 -0.13 0.35 115.11 125.60 1k0g h GLN 450 Ca 0.12 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.58 1k0g h GLN 450 Cb 0.64 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 29.05 1k0g h GLN 450 CO 0.04 0.42 0.00 1.28 -2.65 0.00 0.00 178.83 177.92 1k0g n LEU 451 N -4.84 0.00 0.00 -2.39 4.77 0.11 -3.73 117.00 110.93 1k0g n LEU 451 Ca 0.14 0.11 -0.03 0.00 -0.03 0.00 0.00 56.01 56.21 1k0g n LEU 451 Cb 0.34 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.31 1k0g n LEU 451 CO 0.24 -0.03 0.07 -0.33 -1.33 0.00 0.00 177.39 176.00 1k0g h GLU 452 N 0.00 -0.12 0.00 3.23 5.08 0.12 -3.38 114.58 119.51 1k0g h GLU 452 Ca 0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1k0g h GLU 452 Cb 0.08 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1k0g h GLU 452 CO 0.00 -0.04 0.00 1.63 -1.00 0.00 0.00 179.01 179.60