#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k0g n LYS 2 N 0.00 -0.78 -4.08 2.12 4.81 -1.26 -5.07 118.16 113.90 1k0g n LYS 2 Ca 0.00 0.57 -0.09 0.00 -0.87 0.00 0.00 58.31 57.91 1k0g n LYS 2 Cb 0.00 -0.93 -0.09 0.00 0.02 0.00 0.00 35.03 34.02 1k0g n LYS 2 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1k0g s THR 3 N -2.07 0.11 0.47 3.15 2.01 -0.71 -4.89 115.64 113.71 1k0g s THR 3 Ca 0.00 -1.73 -0.24 0.00 0.31 0.00 0.00 61.69 60.03 1k0g s THR 3 Cb 0.00 -1.87 -0.07 0.00 0.01 0.00 0.00 72.50 70.56 1k0g s THR 3 CO 0.00 -0.52 1.41 -0.76 -0.69 0.00 0.00 174.62 174.06 1k0g s LEU 4 N -3.00 4.06 0.55 4.42 1.43 -1.26 -4.18 118.68 120.69 1k0g s LEU 4 Ca 0.19 2.88 -0.21 0.00 -1.03 0.00 0.00 54.13 55.96 1k0g s LEU 4 Cb 0.06 -4.01 -0.05 0.00 0.03 0.00 0.00 46.19 42.23 1k0g s LEU 4 CO -0.01 -1.26 1.29 -0.44 0.23 0.00 0.00 176.35 176.15 1k0g s SER 5 N -0.61 5.34 0.53 2.29 0.01 -1.26 -4.42 113.70 115.57 1k0g s SER 5 Ca 0.63 2.59 -0.19 0.00 1.31 0.00 0.00 55.95 60.29 1k0g s SER 5 Cb -0.43 -2.62 -0.07 0.00 0.21 0.00 0.00 66.02 63.11 1k0g s SER 5 CO 0.54 -1.50 1.08 -2.16 0.41 0.00 0.00 173.24 171.61 1k0g s PRO 6 N -3.00 3.53 0.57 12.44 0.04 -1.26 -4.98 135.00 142.34 1k0g s PRO 6 Ca 0.72 1.46 -0.15 0.00 0.04 0.00 0.00 61.00 63.07 1k0g s PRO 6 Cb -0.36 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.08 1k0g s PRO 6 CO 0.42 -0.67 1.02 0.00 0.04 0.00 0.00 177.00 177.80 1k0g s ALA 7 N -1.94 2.94 0.00 8.56 0.00 0.37 -4.66 121.76 127.03 1k0g s ALA 7 Ca 0.69 0.21 0.07 0.00 0.00 0.00 0.00 51.96 52.93 1k0g s ALA 7 Cb -0.20 -3.15 -0.02 0.00 0.00 0.00 0.00 23.12 19.75 1k0g s ALA 7 CO 0.25 -0.54 -0.21 0.08 0.00 0.00 0.00 175.76 175.34 1k0g s VAL 8 N -2.67 1.63 -0.05 0.00 1.01 -1.26 -1.77 120.40 117.29 1k0g s VAL 8 Ca 0.60 -0.98 0.06 0.00 0.00 0.00 0.00 61.98 61.67 1k0g s VAL 8 Cb -0.12 -1.37 -0.01 0.00 0.00 0.00 0.00 36.38 34.87 1k0g s VAL 8 CO 0.37 0.37 -0.25 -0.63 0.00 0.00 0.00 175.10 174.97 1k0g s ILE 9 N -0.58 2.13 -0.23 2.22 1.01 0.24 -4.91 121.20 121.07 1k0g s ILE 9 Ca 0.08 -1.05 -0.15 0.00 0.00 0.00 0.00 60.65 59.52 1k0g s ILE 9 Cb -0.08 -1.76 -0.04 0.00 0.01 0.00 0.00 42.46 40.59 1k0g s ILE 9 CO 0.00 0.57 0.36 -0.89 0.00 0.00 0.00 174.94 174.98 1k0g s THR 10 N -0.32 5.21 0.38 2.92 2.01 -1.26 0.15 115.64 124.73 1k0g s THR 10 Ca 0.01 0.59 0.07 0.00 0.31 0.00 0.00 61.69 62.68 1k0g s THR 10 Cb -0.12 -3.69 -0.01 0.00 0.01 0.00 0.00 72.50 68.69 1k0g s THR 10 CO 0.02 0.23 0.45 -0.76 -0.69 0.00 0.00 174.62 173.87 1k0g s LEU 11 N 1.57 3.65 0.30 4.42 1.43 -0.08 -4.99 118.68 124.98 1k0g s LEU 11 Ca 0.16 -0.46 -0.30 0.00 -1.03 0.00 0.00 54.13 52.50 1k0g s LEU 11 Cb -0.15 -2.45 -0.11 0.00 0.03 0.00 0.00 46.19 43.51 1k0g s LEU 11 CO 0.08 -0.59 1.55 -0.76 0.23 0.00 0.00 176.35 176.87 1k0g s LEU 12 N -4.19 4.35 0.21 1.79 1.43 -1.26 -4.40 118.68 116.60 1k0g s LEU 12 Ca 0.48 2.91 -0.31 0.00 -1.03 0.00 0.00 54.13 56.18 1k0g s LEU 12 Cb -0.07 -3.64 -0.11 0.00 0.03 0.00 0.00 46.19 42.40 1k0g s LEU 12 CO 0.30 -0.87 1.62 0.86 0.23 0.00 0.00 176.35 178.49 1k0g s TRP 13 N -0.17 2.96 -0.06 0.29 -0.11 -1.26 -4.81 118.94 115.77 1k0g s TRP 13 Ca 0.61 0.58 -0.03 0.00 1.22 0.00 0.00 56.10 58.48 1k0g s TRP 13 Cb -0.46 -4.02 0.04 0.00 -1.50 0.00 0.00 33.47 27.52 1k0g s TRP 13 CO 0.49 -3.70 0.15 1.03 -4.62 0.00 0.00 176.95 170.29 1k0g s ARG 14 N 0.77 0.10 0.45 5.86 0.52 -1.26 -5.02 118.95 120.37 1k0g s ARG 14 Ca 0.70 0.35 0.22 0.00 -0.52 0.00 0.00 55.73 56.47 1k0g s ARG 14 Cb -0.46 -0.14 1.21 0.00 0.52 0.00 0.00 34.95 36.07 1k0g s ARG 14 CO 0.35 -0.15 1.86 1.96 0.02 0.00 0.00 175.30 179.34 1k0g h GLN 15 N 7.07 0.27 -0.46 3.54 1.08 -2.00 -1.63 115.11 122.97 1k0g h GLN 15 Ca -0.41 -0.02 -0.18 0.00 -1.45 0.00 0.00 58.65 56.60 1k0g h GLN 15 Cb 1.15 -0.06 -0.11 0.00 -0.05 0.00 0.00 27.48 28.41 1k0g h GLN 15 CO 0.42 0.18 0.08 -0.40 -0.95 0.00 0.00 178.83 178.17 1k0g n ASP 16 N -4.45 3.34 0.26 1.46 5.68 -1.26 -4.65 116.55 116.93 1k0g n ASP 16 Ca 0.19 -3.48 0.11 0.00 -0.50 0.00 0.00 54.79 51.12 1k0g n ASP 16 Cb 0.79 -0.65 0.73 0.00 -1.14 0.00 0.00 41.12 40.85 1k0g n ASP 16 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1k0g h ALA 17 N 1.44 1.86 -0.11 2.12 0.00 -1.67 -0.30 119.26 122.60 1k0g h ALA 17 Ca 0.22 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1k0g h ALA 17 Cb 1.85 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.64 1k0g h ALA 17 CO 0.48 -0.03 -0.08 0.00 0.00 0.00 0.00 179.25 179.63 1k0g h ALA 18 N 1.99 0.15 -0.56 0.00 0.00 -1.86 -0.72 119.26 118.26 1k0g h ALA 18 Ca 0.01 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.53 1k0g h ALA 18 Cb 0.04 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1k0g h ALA 18 CO -0.00 -0.04 -0.09 0.93 0.00 0.00 0.00 179.25 180.05 1k0g h GLU 19 N -0.15 1.04 0.30 0.00 5.08 -1.88 0.30 114.58 119.28 1k0g h GLU 19 Ca 0.02 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 1k0g h GLU 19 Cb 0.56 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 1k0g h GLU 19 CO 0.02 1.07 -0.44 0.35 -1.00 0.00 0.00 179.01 179.01 1k0g h PHE 20 N 0.93 -1.22 -0.32 4.33 3.57 -0.90 -2.22 116.94 121.11 1k0g h PHE 20 Ca 0.15 0.02 -0.16 0.00 3.53 0.00 0.00 57.97 61.51 1k0g h PHE 20 Cb 0.66 0.49 -0.01 0.00 2.79 0.00 0.00 35.95 39.89 1k0g h PHE 20 CO 0.05 -0.57 -0.43 1.88 -2.23 0.00 0.00 178.31 177.01 1k0g h TYR 21 N -0.80 0.98 -0.02 0.41 0.05 -1.07 -2.95 116.97 113.57 1k0g h TYR 21 Ca -0.02 -0.30 0.01 0.00 0.05 0.00 0.00 58.73 58.46 1k0g h TYR 21 Cb 0.75 -0.20 -0.00 0.00 1.01 0.00 0.00 36.73 38.28 1k0g h TYR 21 CO -0.30 1.09 0.02 0.35 -1.05 0.00 0.00 178.16 178.28 1k0g h PHE 22 N 0.65 0.00 -0.75 4.88 3.57 -0.27 -2.90 116.94 122.13 1k0g h PHE 22 Ca 0.05 0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.69 1k0g h PHE 22 Cb 1.00 0.00 -0.14 0.00 2.79 0.00 0.00 35.95 39.60 1k0g h PHE 22 CO 0.06 0.00 -0.26 1.03 -2.23 0.00 0.00 178.31 176.91 1k0g h SER 23 N 0.00 -0.93 0.89 0.41 0.87 -1.21 0.23 113.55 113.81 1k0g h SER 23 Ca 0.01 0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.81 1k0g h SER 23 Cb 0.05 0.54 0.00 0.00 -0.44 0.00 0.00 62.40 62.55 1k0g h SER 23 CO -0.00 -0.28 0.00 -2.11 -0.53 0.00 0.00 176.83 173.91 1k0g n ARG 24 N -5.49 0.02 0.00 2.24 1.85 -1.09 -2.49 116.66 111.70 1k0g n ARG 24 Ca 0.09 0.09 0.08 0.00 -1.00 0.00 0.00 57.85 57.10 1k0g n ARG 24 Cb 0.39 -1.52 0.04 0.00 -1.05 0.00 0.00 32.46 30.31 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 -1.56 2.01 0.28 2.89 4.77 0.63 -4.41 117.00 121.62 1k0g n LEU 25 Ca 0.06 -0.89 0.15 0.00 -0.03 0.00 0.00 56.01 55.30 1k0g n LEU 25 Cb 0.30 0.00 0.81 0.00 -2.33 0.00 0.00 43.42 42.20 1k0g n LEU 25 CO 0.24 0.37 1.02 0.77 -1.33 0.00 0.00 177.39 178.45 1k0g h SER 26 N 2.55 0.00 0.51 -1.43 4.64 -0.70 -1.63 113.55 117.48 1k0g h SER 26 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1k0g h SER 26 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1k0g h SER 26 CO 0.00 0.08 -0.49 0.00 -0.87 0.00 0.00 176.83 175.55 1k0g n HIS 27 N -3.51 0.00 -2.76 4.77 1.44 -1.26 -4.85 115.22 109.05 1k0g n HIS 27 Ca -0.02 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.28 1k0g n HIS 27 Cb 0.21 -0.25 -0.04 0.00 0.12 0.00 0.00 29.99 30.03 1k0g n HIS 27 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1k0g s LEU 28 N -3.00 4.43 0.39 2.39 1.43 -0.61 -4.99 118.68 118.71 1k0g s LEU 28 Ca 0.11 1.67 -0.28 0.00 -1.03 0.00 0.00 54.13 54.61 1k0g s LEU 28 Cb 0.18 -3.52 -0.11 0.00 0.03 0.00 0.00 46.19 42.77 1k0g s LEU 28 CO 0.70 -0.15 1.48 -2.84 0.23 0.00 0.00 176.35 175.76 1k0g s PRO 29 N 0.50 4.05 -0.25 1.29 0.02 -1.26 -0.81 135.00 138.53 1k0g s PRO 29 Ca 0.48 2.55 0.00 0.00 0.02 0.00 0.00 61.00 64.05 1k0g s PRO 29 Cb -0.22 -2.92 0.00 0.00 0.02 0.00 0.00 34.50 31.38 1k0g s PRO 29 CO 0.28 -0.58 0.00 0.91 -0.33 0.00 0.00 177.00 177.28 1k0g n TRP 30 N 0.36 0.00 -2.66 6.54 7.02 0.43 -4.65 117.44 124.48 1k0g n TRP 30 Ca 0.02 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.07 1k0g n TRP 30 Cb 0.40 -1.28 -0.03 0.00 -2.42 0.00 0.00 31.31 27.98 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 -1.67 3.25 0.02 6.99 0.00 0.01 -4.19 121.76 126.16 1k0g s ALA 31 Ca 0.00 0.55 0.02 0.00 0.00 0.00 0.00 51.96 52.53 1k0g s ALA 31 Cb 0.00 -3.38 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 1k0g s ALA 31 CO 0.00 -0.35 -0.06 -1.64 0.00 0.00 0.00 175.76 173.71 1k0g s MET 32 N 1.26 0.45 -0.10 0.00 -1.94 -0.51 -1.59 119.30 116.89 1k0g s MET 32 Ca 0.52 -0.44 0.00 0.00 -1.71 0.00 0.00 55.69 54.06 1k0g s MET 32 Cb -0.22 -0.33 0.02 0.00 2.01 0.00 0.00 34.83 36.32 1k0g s MET 32 CO 0.26 0.08 -0.09 -1.17 -0.01 0.00 0.00 175.02 174.09 1k0g s LEU 33 N -0.80 1.31 -0.25 -0.03 2.96 -0.58 -1.63 118.68 119.67 1k0g s LEU 33 Ca -0.04 -0.29 -0.08 0.00 -0.22 0.00 0.00 54.13 53.51 1k0g s LEU 33 Cb -0.06 -0.81 -0.03 0.00 0.50 0.00 0.00 46.19 45.79 1k0g s LEU 33 CO 0.00 -0.07 0.08 -0.76 -1.32 0.00 0.00 176.35 174.28 1k0g s LEU 34 N 1.38 3.49 -0.03 -0.68 1.43 0.57 -0.26 118.68 124.59 1k0g s LEU 34 Ca -0.01 -0.19 0.05 0.00 -1.03 0.00 0.00 54.13 52.95 1k0g s LEU 34 Cb -0.14 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.14 1k0g s LEU 34 CO -0.04 -0.03 -0.17 -2.28 0.23 0.00 0.00 176.35 174.05 1k0g s HIS 35 N 1.60 1.61 -1.88 0.29 2.46 -0.59 -0.19 115.29 118.60 1k0g s HIS 35 Ca 0.06 -0.37 0.05 0.00 0.47 0.00 0.00 55.06 55.28 1k0g s HIS 35 Cb -0.15 -1.06 0.17 0.00 -0.13 0.00 0.00 32.58 31.41 1k0g s HIS 35 CO 0.04 -0.08 1.10 0.43 -2.47 0.00 0.00 174.74 173.76 1k0g n SER 36 N 2.86 1.11 -0.72 9.88 7.64 -1.23 -1.51 113.62 131.65 1k0g n SER 36 Ca -0.16 -2.02 -0.09 0.00 1.01 0.00 0.00 58.87 57.60 1k0g n SER 36 Cb 0.54 -0.17 -0.04 0.00 -1.01 0.00 0.00 64.21 63.53 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 0.73 1.02 2.51 0.23 0.00 -1.12 -0.85 105.19 107.72 1k0g n GLY 37 Ca 0.06 -0.21 -0.16 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.47 0.00 -1.52 1.61 4.01 -1.26 -4.27 117.16 113.25 1k0g n TYR 38 Ca -0.09 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.35 1k0g n TYR 38 Cb 0.44 -2.85 0.10 0.00 -0.31 0.00 0.00 39.34 36.71 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 -2.55 2.17 -0.40 -0.72 0.00 -0.03 -5.02 121.76 115.21 1k0g s ALA 39 Ca 0.00 -0.21 0.01 0.00 0.00 0.00 0.00 51.96 51.77 1k0g s ALA 39 Cb 0.00 -3.11 0.11 0.00 0.00 0.00 0.00 23.12 20.12 1k0g s ALA 39 CO 0.00 -1.81 0.15 0.34 0.00 0.00 0.00 175.76 174.44 1k0g s ASP 40 N -3.87 4.90 -0.11 0.00 2.15 -1.26 -4.84 116.67 113.64 1k0g s ASP 40 Ca 0.61 -2.26 -0.30 0.00 0.43 0.00 0.00 52.55 51.02 1k0g s ASP 40 Cb -0.15 -1.71 0.12 0.00 -0.30 0.00 0.00 42.92 40.89 1k0g s ASP 40 CO 0.54 -0.41 1.01 -1.00 -0.17 0.00 0.00 175.17 175.14 1k0g s HIS 41 N 0.78 -0.31 0.43 -5.34 3.76 -1.26 -4.96 115.29 108.39 1k0g s HIS 41 Ca 0.11 0.36 0.14 0.00 -0.15 0.00 0.00 55.06 55.51 1k0g s HIS 41 Cb -0.21 0.50 0.93 0.00 1.11 0.00 0.00 32.58 34.91 1k0g s HIS 41 CO -0.06 -0.38 1.96 -1.35 -0.85 0.00 0.00 174.74 174.06 1k0g h PRO 42 N 2.23 0.03 -0.61 8.40 0.11 -2.01 0.43 132.00 140.59 1k0g h PRO 42 Ca -0.18 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.93 1k0g h PRO 42 Cb 1.19 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1k0g h PRO 42 CO 0.29 0.23 0.00 2.48 -0.21 0.00 0.00 178.00 180.80 1k0g n TYR 43 N -4.28 1.01 -2.36 0.65 0.18 -1.26 -3.57 117.16 107.52 1k0g n TYR 43 Ca -0.02 -0.40 -0.03 0.00 1.88 0.00 0.00 57.90 59.33 1k0g n TYR 43 Cb 0.27 -0.18 0.06 0.00 -0.38 0.00 0.00 39.34 39.11 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 0.67 2.15 0.04 9.48 3.41 0.15 -4.83 113.62 124.69 1k0g n SER 44 Ca 0.17 -2.71 -0.14 0.00 -0.26 0.00 0.00 58.87 55.93 1k0g n SER 44 Cb 0.64 -0.41 -0.03 0.00 -0.26 0.00 0.00 64.21 64.15 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 1.79 0.52 -6.42 4.33 2.43 -1.54 -3.41 114.38 112.08 1k0g h ARG 45 Ca -0.03 -0.49 -0.63 0.00 -0.81 0.00 0.00 59.98 58.02 1k0g h ARG 45 Cb 1.46 0.12 -0.16 0.00 -0.42 0.00 0.00 29.97 30.96 1k0g h ARG 45 CO 0.25 1.12 -0.79 -0.06 -1.51 0.00 0.00 179.97 178.98 1k0g s PHE 46 N -3.48 2.31 0.03 2.20 0.08 -1.26 -1.03 117.98 116.83 1k0g s PHE 46 Ca -0.07 -0.34 0.08 0.00 0.12 0.00 0.00 56.93 56.72 1k0g s PHE 46 Cb 0.09 -1.07 -0.03 0.00 -0.57 0.00 0.00 43.02 41.44 1k0g s PHE 46 CO 0.87 0.61 -0.25 -0.51 -0.10 0.00 0.00 175.22 175.84 1k0g s ASP 47 N -3.08 2.92 -0.02 1.36 1.01 -0.80 -3.49 116.67 114.57 1k0g s ASP 47 Ca 0.25 -0.54 0.00 0.00 0.71 0.00 0.00 52.55 52.98 1k0g s ASP 47 Cb -0.07 -0.28 0.02 0.00 1.01 0.00 0.00 42.92 43.61 1k0g s ASP 47 CO 0.13 0.25 0.00 -0.63 0.21 0.00 0.00 175.17 175.12 1k0g s ILE 48 N -0.74 0.12 -0.05 0.77 1.01 0.74 -0.52 121.20 122.53 1k0g s ILE 48 Ca 0.10 0.07 0.04 0.00 0.00 0.00 0.00 60.65 60.86 1k0g s ILE 48 Cb -0.10 -0.20 -0.00 0.00 0.01 0.00 0.00 42.46 42.17 1k0g s ILE 48 CO 0.01 0.11 -0.18 -0.69 0.00 0.00 0.00 174.94 174.19 1k0g s VAL 49 N 0.75 1.50 0.07 2.92 1.01 -0.28 -0.31 120.40 126.05 1k0g s VAL 49 Ca -0.07 -0.75 -0.06 0.00 0.00 0.00 0.00 61.98 61.10 1k0g s VAL 49 Cb -0.10 -1.29 -0.01 0.00 0.00 0.00 0.00 36.38 34.97 1k0g s VAL 49 CO -0.02 0.43 0.12 0.68 0.00 0.00 0.00 175.10 176.31 1k0g s VAL 50 N 0.09 0.16 0.06 2.92 -7.23 -0.64 -0.68 120.40 115.08 1k0g s VAL 50 Ca -0.05 -1.35 -0.28 0.00 -1.81 0.00 0.00 61.98 58.49 1k0g s VAL 50 Cb -0.12 -1.33 0.09 0.00 0.56 0.00 0.00 36.38 35.58 1k0g s VAL 50 CO 0.03 -0.74 1.13 0.00 -0.31 0.00 0.00 175.10 175.20 1k0g s ALA 51 N -3.70 -1.95 -1.07 1.32 0.00 -1.26 -1.42 121.76 113.68 1k0g s ALA 51 Ca 0.04 0.44 -0.14 0.00 0.00 0.00 0.00 51.96 52.30 1k0g s ALA 51 Cb 0.05 0.49 -0.03 0.00 0.00 0.00 0.00 23.12 23.63 1k0g s ALA 51 CO -0.10 -1.04 0.82 0.39 0.00 0.00 0.00 175.76 175.83 1k0g n GLU 52 N -0.47 -1.53 -1.87 0.00 1.02 -1.26 -4.91 120.64 111.62 1k0g n GLU 52 Ca -0.07 0.67 -0.35 0.00 -0.02 0.00 0.00 57.16 57.38 1k0g n GLU 52 Cb 0.62 -4.66 0.05 0.00 -0.02 0.00 0.00 31.44 27.42 1k0g n GLU 52 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1k0g s PRO 53 N -5.24 2.78 0.06 3.49 0.04 -1.26 -4.84 135.00 130.03 1k0g s PRO 53 Ca 0.42 1.78 0.25 0.00 0.04 0.00 0.00 61.00 63.49 1k0g s PRO 53 Cb -0.12 -1.91 0.47 0.00 0.04 0.00 0.00 34.50 32.98 1k0g s PRO 53 CO 0.82 -1.35 1.40 0.44 0.04 0.00 0.00 177.00 178.35 1k0g n ILE 54 N -1.89 0.19 -3.70 0.56 -6.64 0.55 -4.88 119.36 103.55 1k0g n ILE 54 Ca 0.13 -0.15 -0.12 0.00 -1.77 0.00 0.00 62.75 60.85 1k0g n ILE 54 Cb 0.50 -0.01 -0.10 0.00 -1.44 0.00 0.00 39.64 38.59 1k0g n ILE 54 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1k0g s THR 56 N 0.72 1.87 -0.09 0.00 -4.23 0.68 -0.68 115.64 113.91 1k0g s THR 56 Ca -0.04 -1.58 0.03 0.00 -1.18 0.00 0.00 61.69 58.92 1k0g s THR 56 Cb -0.05 -1.68 0.01 0.00 1.34 0.00 0.00 72.50 72.12 1k0g s THR 56 CO -0.05 0.01 -0.18 -0.76 -0.54 0.00 0.00 174.62 173.10 1k0g s LEU 57 N -1.88 1.85 -0.18 4.79 1.02 -0.22 -0.56 118.68 123.50 1k0g s LEU 57 Ca 0.09 -0.44 -0.01 0.00 0.02 0.00 0.00 54.13 53.79 1k0g s LEU 57 Cb -0.10 -1.13 0.05 0.00 0.02 0.00 0.00 46.19 45.02 1k0g s LEU 57 CO 0.05 0.08 -0.03 -0.89 0.02 0.00 0.00 176.35 175.57 1k0g s THR 58 N 0.64 1.05 -0.15 5.49 2.01 -0.94 -0.92 115.64 122.82 1k0g s THR 58 Ca -0.14 -0.71 -0.04 0.00 0.31 0.00 0.00 61.69 61.11 1k0g s THR 58 Cb -0.16 -1.31 -0.03 0.00 0.01 0.00 0.00 72.50 71.00 1k0g s THR 58 CO 0.04 0.02 -0.01 -0.89 -0.69 0.00 0.00 174.62 173.09 1k0g s THR 59 N 1.64 4.16 -0.17 -0.82 2.01 0.14 -0.28 115.64 122.32 1k0g s THR 59 Ca -0.01 -0.27 -0.01 0.00 0.31 0.00 0.00 61.69 61.71 1k0g s THR 59 Cb -0.16 -2.82 0.05 0.00 0.01 0.00 0.00 72.50 69.58 1k0g s THR 59 CO -0.07 0.51 -0.03 -0.36 -0.69 0.00 0.00 174.62 173.98 1k0g s PHE 60 N 0.10 1.53 0.00 4.92 0.08 -0.36 -0.56 117.98 123.68 1k0g s PHE 60 Ca 0.01 -1.02 0.00 0.00 0.12 0.00 0.00 56.93 56.04 1k0g s PHE 60 Cb -0.13 -1.23 0.00 0.00 -0.57 0.00 0.00 43.02 41.09 1k0g s PHE 60 CO 0.02 -0.61 0.00 0.41 -0.10 0.00 0.00 175.22 174.95 1k0g n GLY 61 N 4.92 2.18 0.00 4.36 0.00 -1.26 -2.17 105.19 113.22 1k0g n GLY 61 Ca -0.11 0.42 0.13 0.00 0.00 0.00 0.00 46.02 46.47 1k0g n GLY 61 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1k0g n LYS 62 N 5.40 0.01 -5.06 1.61 3.00 -1.26 -4.83 118.16 117.04 1k0g n LYS 62 Ca 0.00 0.01 -0.31 0.00 -0.00 0.00 0.00 58.31 58.01 1k0g n LYS 62 Cb 0.00 -1.51 -0.15 0.00 0.00 0.00 0.00 35.03 33.37 1k0g n LYS 62 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 1k0g s GLU 63 N -3.01 2.09 -0.15 1.64 2.02 -0.92 -4.17 118.70 116.20 1k0g s GLU 63 Ca 0.13 -0.95 0.01 0.00 0.02 0.00 0.00 54.97 54.19 1k0g s GLU 63 Cb 0.18 -2.10 0.02 0.00 0.10 0.00 0.00 34.13 32.33 1k0g s GLU 63 CO 0.58 0.56 -0.18 0.99 0.02 0.00 0.00 175.26 177.22 1k0g s THR 64 N -0.72 1.83 -0.29 3.63 2.01 -0.22 -1.23 115.64 120.65 1k0g s THR 64 Ca 0.11 -0.81 -0.11 0.00 0.31 0.00 0.00 61.69 61.19 1k0g s THR 64 Cb -0.10 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.71 1k0g s THR 64 CO 0.01 0.50 0.20 -0.69 -0.69 0.00 0.00 174.62 173.95 1k0g s VAL 65 N 1.21 5.24 -0.26 3.82 1.01 0.61 -1.77 120.40 130.26 1k0g s VAL 65 Ca 0.01 0.05 -0.13 0.00 0.00 0.00 0.00 61.98 61.91 1k0g s VAL 65 Cb -0.14 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 1k0g s VAL 65 CO -0.08 0.19 0.28 -0.69 0.00 0.00 0.00 175.10 174.79 1k0g s VAL 66 N 1.74 5.25 -0.14 2.92 1.01 0.13 -2.22 120.40 129.09 1k0g s VAL 66 Ca 0.07 0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.43 1k0g s VAL 66 Cb -0.16 -3.61 0.02 0.00 0.00 0.00 0.00 36.38 32.63 1k0g s VAL 66 CO 0.10 0.23 -0.14 -0.55 0.00 0.00 0.00 175.10 174.74 1k0g s SER 67 N 1.54 2.67 -0.31 3.32 0.15 0.28 -1.17 113.70 120.17 1k0g s SER 67 Ca 0.11 -0.48 -0.00 0.00 0.70 0.00 0.00 55.95 56.28 1k0g s SER 67 Cb -0.15 -1.17 0.10 0.00 -1.71 0.00 0.00 66.02 63.08 1k0g s SER 67 CO 0.09 -0.05 0.08 -0.70 1.20 0.00 0.00 173.24 173.86 1k0g s GLU 68 N 1.44 0.87 0.00 5.44 2.12 -0.65 -0.23 118.70 127.69 1k0g s GLU 68 Ca 0.04 -1.17 0.00 0.00 0.36 0.00 0.00 54.97 54.20 1k0g s GLU 68 Cb -0.13 -2.21 0.00 0.00 0.26 0.00 0.00 34.13 32.05 1k0g s GLU 68 CO -0.10 -0.95 0.00 0.45 -0.54 0.00 0.00 175.26 174.13 1k0g n SER 69 N 4.75 0.00 0.00 -1.70 2.88 -1.26 0.33 113.62 118.62 1k0g n SER 69 Ca -0.02 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.59 1k0g n SER 69 Cb 0.42 0.00 0.43 0.00 -0.75 0.00 0.00 64.21 64.31 1k0g n SER 69 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1k0g n GLU 70 N 0.00 0.67 -3.64 -1.46 4.71 -1.26 -4.92 120.64 114.74 1k0g n GLU 70 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 57.16 57.10 1k0g n GLU 70 Cb 0.00 -1.34 -0.07 0.00 -1.01 0.00 0.00 31.44 29.02 1k0g n GLU 70 CO 0.00 0.00 0.00 -1.59 0.09 0.00 0.00 177.13 175.63 1k0g s LYS 71 N -2.00 0.24 -0.52 3.49 -2.85 0.15 -5.09 119.74 113.16 1k0g s LYS 71 Ca 0.22 0.28 0.05 0.00 -1.00 0.00 0.00 55.97 55.52 1k0g s LYS 71 Cb 0.10 0.12 0.39 0.00 -2.06 0.00 0.00 37.83 36.37 1k0g s LYS 71 CO 0.17 -0.03 1.10 -2.13 0.10 0.00 0.00 175.35 174.55 1k0g n ARG 72 N 1.86 3.38 -1.70 1.78 0.63 -1.26 -1.64 116.66 119.71 1k0g n ARG 72 Ca -0.11 -4.61 -0.38 0.00 -0.92 0.00 0.00 57.85 51.82 1k0g n ARG 72 Cb 0.56 -2.25 0.05 0.00 0.45 0.00 0.00 32.46 31.27 1k0g n ARG 72 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 1k0g n THR 73 N -0.39 3.88 -4.79 5.15 -2.24 -0.32 -4.61 114.28 110.96 1k0g n THR 73 Ca 0.37 -0.50 -0.32 0.00 -2.27 0.00 0.00 64.05 61.33 1k0g n THR 73 Cb 0.54 -1.48 -0.13 0.00 -2.10 0.00 0.00 70.33 67.16 1k0g n THR 73 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1k0g s THR 74 N -1.35 2.97 -0.01 4.28 2.01 -1.26 0.23 115.64 122.51 1k0g s THR 74 Ca 0.74 -0.91 -0.19 0.00 0.31 0.00 0.00 61.69 61.64 1k0g s THR 74 Cb -0.42 -2.20 0.04 0.00 0.01 0.00 0.00 72.50 69.92 1k0g s THR 74 CO 0.48 0.48 0.41 0.28 -0.69 0.00 0.00 174.62 175.58 1k0g s THR 75 N -0.82 0.05 -1.74 -0.82 -1.32 -0.73 -4.97 115.64 105.28 1k0g s THR 75 Ca 0.13 -0.38 0.17 0.00 -1.21 0.00 0.00 61.69 60.41 1k0g s THR 75 Cb -0.11 -0.77 0.38 0.00 -1.51 0.00 0.00 72.50 70.49 1k0g s THR 75 CO 0.03 -0.21 1.30 0.35 -2.21 0.00 0.00 174.62 173.88 1k0g n THR 76 N 1.02 0.67 -0.61 5.08 -2.24 -1.26 -1.05 114.28 115.89 1k0g n THR 76 Ca -0.20 -0.84 -0.30 0.00 -2.27 0.00 0.00 64.05 60.44 1k0g n THR 76 Cb 0.57 0.79 0.21 0.00 -2.10 0.00 0.00 70.33 69.80 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 -1.16 1.96 -0.11 3.42 1.01 -1.26 -4.87 116.67 115.65 1k0g s ASP 77 Ca 0.32 1.88 -0.34 0.00 0.71 0.00 0.00 52.55 55.12 1k0g s ASP 77 Cb 0.18 -2.45 -0.12 0.00 1.01 0.00 0.00 42.92 41.54 1k0g s ASP 77 CO 0.24 -3.65 1.89 -0.67 0.21 0.00 0.00 175.17 173.20 1k0g n ASP 78 N -4.58 3.36 0.07 0.27 -0.08 -1.26 -4.80 116.55 109.54 1k0g n ASP 78 Ca 0.08 0.95 0.04 0.00 -1.51 0.00 0.00 54.79 54.35 1k0g n ASP 78 Cb 0.53 -1.36 0.46 0.00 2.34 0.00 0.00 41.12 43.09 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 9.35 0.38 0.00 -0.67 0.13 -1.96 0.13 132.00 139.36 1k0g h PRO 79 Ca -0.48 -0.03 -0.10 0.00 -0.87 0.00 0.00 66.00 64.52 1k0g h PRO 79 Cb 1.28 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1k0g h PRO 79 CO 0.95 0.29 -0.46 -0.07 -0.23 0.00 0.00 178.00 178.49 1k0g h LEU 80 N 0.39 0.00 -0.09 1.56 3.38 -1.94 -0.55 115.31 118.05 1k0g h LEU 80 Ca 0.10 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.84 1k0g h LEU 80 Cb 0.03 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.79 1k0g h LEU 80 CO -0.02 0.46 -0.84 -0.61 0.09 0.00 0.00 178.44 177.52 1k0g h GLN 81 N 0.00 0.73 -0.59 1.13 4.15 -1.23 -1.37 115.11 117.93 1k0g h GLN 81 Ca -0.00 -0.66 0.06 0.00 0.77 0.00 0.00 58.65 58.81 1k0g h GLN 81 Cb 1.28 0.16 -0.05 0.00 0.21 0.00 0.00 27.48 29.07 1k0g h GLN 81 CO 0.06 1.26 0.30 0.28 -1.93 0.00 0.00 178.83 178.81 1k0g h VAL 82 N 0.44 0.94 -0.08 2.39 2.07 -0.83 0.12 116.25 121.29 1k0g h VAL 82 Ca -0.08 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.25 1k0g h VAL 82 Cb 1.48 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1k0g h VAL 82 CO 0.17 0.10 0.06 0.25 0.02 0.00 0.00 177.57 178.17 1k0g h LEU 83 N 0.57 0.10 -1.55 2.57 5.85 -0.99 0.13 115.31 122.00 1k0g h LEU 83 Ca 0.27 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 59.01 1k0g h LEU 83 Cb 0.19 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 1k0g h LEU 83 CO -0.19 0.07 0.34 -0.61 -0.34 0.00 0.00 178.44 177.71 1k0g h GLN 84 N 0.11 0.58 -0.07 1.25 5.75 -0.56 -0.28 115.11 121.90 1k0g h GLN 84 Ca 0.03 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.46 1k0g h GLN 84 Cb -0.01 -0.13 -0.00 0.00 1.07 0.00 0.00 27.48 28.41 1k0g h GLN 84 CO -0.01 0.39 -0.11 1.96 -2.65 0.00 0.00 178.83 178.41 1k0g h GLN 85 N 0.60 0.19 -0.36 1.69 4.20 0.32 -0.40 115.11 121.35 1k0g h GLN 85 Ca 0.20 -0.11 0.08 0.00 0.06 0.00 0.00 58.65 58.88 1k0g h GLN 85 Cb 0.07 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 27.78 1k0g h GLN 85 CO -0.05 0.68 -0.20 0.28 -0.67 0.00 0.00 178.83 178.87 1k0g h VAL 86 N -0.29 0.44 -0.70 -0.54 2.07 -0.11 0.18 116.25 117.29 1k0g h VAL 86 Ca 0.01 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.60 1k0g h VAL 86 Cb 0.67 0.44 -0.06 0.00 -1.52 0.00 0.00 31.29 30.81 1k0g h VAL 86 CO 0.02 0.00 0.38 -0.07 0.02 0.00 0.00 177.57 177.92 1k0g h LEU 87 N -0.14 0.54 -0.73 2.57 3.38 -0.94 -1.82 115.31 118.18 1k0g h LEU 87 Ca 0.18 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 58.11 1k0g h LEU 87 Cb 0.42 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1k0g h LEU 87 CO -0.44 0.33 0.12 0.44 0.09 0.00 0.00 178.44 178.97 1k0g h ASP 88 N 0.68 1.04 0.70 -0.43 3.32 -0.27 -2.43 116.42 119.03 1k0g h ASP 88 Ca 0.33 -0.24 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1k0g h ASP 88 Cb 0.26 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.54 1k0g h ASP 88 CO -0.22 1.02 0.00 0.54 -1.72 0.00 0.00 179.24 178.87 1k0g n ARG 89 N -4.22 0.08 0.23 3.56 1.74 0.57 -2.10 116.66 116.53 1k0g n ARG 89 Ca 0.04 0.10 0.15 0.00 -0.77 0.00 0.00 57.85 57.38 1k0g n ARG 89 Cb 0.28 -1.50 0.59 0.00 -1.02 0.00 0.00 32.46 30.82 1k0g n ARG 89 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1k0g h ALA 90 N 2.86 1.00 -6.62 7.54 0.00 -1.20 -3.46 119.26 119.38 1k0g h ALA 90 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.44 1k0g h ALA 90 Cb 0.35 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.15 1k0g h ALA 90 CO 0.00 0.00 -0.96 -0.25 0.00 0.00 0.00 179.25 178.04 1k0g n ASP 91 N -2.84 -4.97 -3.77 0.00 9.92 -0.89 -4.97 116.55 109.02 1k0g n ASP 91 Ca 0.01 -0.99 -0.26 0.00 -0.53 0.00 0.00 54.79 53.03 1k0g n ASP 91 Cb 0.31 -2.18 -0.17 0.00 -0.64 0.00 0.00 41.12 38.43 1k0g n ASP 91 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1k0g s ILE 92 N -3.19 0.53 -0.39 0.53 1.01 -1.26 -4.99 121.20 113.44 1k0g s ILE 92 Ca 0.19 -0.26 0.10 0.00 0.00 0.00 0.00 60.65 60.69 1k0g s ILE 92 Cb -0.10 -0.84 0.30 0.00 0.01 0.00 0.00 42.46 41.84 1k0g s ILE 92 CO 0.90 0.05 0.68 0.54 0.00 0.00 0.00 174.94 177.11 1k0g n ARG 93 N 5.07 0.86 -1.44 2.79 1.74 -1.26 -4.67 116.66 119.76 1k0g n ARG 93 Ca -0.09 -3.16 -0.29 0.00 -0.77 0.00 0.00 57.85 53.54 1k0g n ARG 93 Cb 0.49 -1.46 0.12 0.00 -1.02 0.00 0.00 32.46 30.59 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 -1.64 1.42 0.44 5.56 0.04 -1.26 -1.73 135.00 137.83 1k0g s PRO 94 Ca 0.37 0.54 -0.23 0.00 0.04 0.00 0.00 61.00 61.72 1k0g s PRO 94 Cb 0.27 -1.85 -0.08 0.00 0.04 0.00 0.00 34.50 32.88 1k0g s PRO 94 CO -0.10 -2.06 1.12 0.95 0.04 0.00 0.00 177.00 176.95 1k0g s THR 95 N -3.13 3.36 0.26 1.26 -4.23 -1.26 -4.43 115.64 107.46 1k0g s THR 95 Ca 0.63 1.01 -0.29 0.00 -1.18 0.00 0.00 61.69 61.86 1k0g s THR 95 Cb -0.16 -3.51 -0.15 0.00 1.34 0.00 0.00 72.50 70.03 1k0g s THR 95 CO 0.55 -0.03 0.94 1.41 -0.54 0.00 0.00 174.62 176.95 1k0g n HIS 96 N -0.41 0.95 -3.50 3.99 -0.00 -1.26 -4.97 115.22 110.03 1k0g n HIS 96 Ca 0.07 0.75 -0.20 0.00 -0.00 0.00 0.00 57.72 58.34 1k0g n HIS 96 Cb 0.49 -2.20 -0.13 0.00 -0.00 0.00 0.00 29.99 28.15 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 -0.56 1.72 0.57 0.41 3.84 -1.26 -5.00 114.94 114.66 1k0g s ASN 97 Ca 0.62 -0.44 0.38 0.00 0.21 0.00 0.00 52.86 53.63 1k0g s ASN 97 Cb -0.77 0.26 1.89 0.00 -0.55 0.00 0.00 41.25 42.08 1k0g s ASN 97 CO 0.58 -0.35 2.14 1.05 -2.79 0.00 0.00 177.10 177.73 1k0g h GLU 98 N 8.33 0.00 -0.01 0.43 -0.00 -1.98 0.53 114.58 121.88 1k0g h GLU 98 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.19 1k0g h GLU 98 Cb 1.13 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.88 1k0g h GLU 98 CO 0.30 0.00 -0.37 -0.25 -0.00 0.00 0.00 179.01 178.69 1k0g n ASP 99 N -2.93 0.93 -3.72 3.06 8.00 -1.26 -4.44 116.55 116.18 1k0g n ASP 99 Ca -0.01 -0.74 -0.28 0.00 0.71 0.00 0.00 54.79 54.47 1k0g n ASP 99 Cb 0.15 0.22 -0.11 0.00 -0.02 0.00 0.00 41.12 41.36 1k0g n ASP 99 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1k0g s LEU 100 N -2.67 3.64 0.38 0.64 1.43 0.19 -4.98 118.68 117.30 1k0g s LEU 100 Ca 0.19 -3.58 0.11 0.00 -1.03 0.00 0.00 54.13 49.83 1k0g s LEU 100 Cb 0.19 -1.22 0.74 0.00 0.03 0.00 0.00 46.19 45.92 1k0g s LEU 100 CO 0.59 -0.11 1.86 1.55 0.23 0.00 0.00 176.35 180.46 1k0g h PRO 101 N 5.49 0.10 -4.97 1.29 0.13 -1.77 -3.38 132.00 128.89 1k0g h PRO 101 Ca 0.19 -0.03 -0.67 0.00 -0.87 0.00 0.00 66.00 64.61 1k0g h PRO 101 Cb 0.81 -0.01 -0.35 0.00 0.13 0.00 0.00 31.00 31.58 1k0g h PRO 101 CO 0.60 0.38 -0.82 0.12 -0.23 0.00 0.00 178.00 178.05 1k0g s PHE 102 N -4.40 3.01 -0.67 1.56 5.36 -1.26 -4.82 117.98 116.77 1k0g s PHE 102 Ca -0.04 -1.89 0.01 0.00 -0.96 0.00 0.00 56.93 54.05 1k0g s PHE 102 Cb 0.15 -1.94 0.39 0.00 -0.34 0.00 0.00 43.02 41.27 1k0g s PHE 102 CO 0.73 -0.82 1.65 1.04 -1.46 0.00 0.00 175.22 176.36 1k0g n GLN 103 N 4.56 3.04 0.00 10.12 6.02 -1.26 -4.90 117.38 134.95 1k0g n GLN 103 Ca -0.18 -3.90 0.00 0.00 -0.01 0.00 0.00 57.00 52.91 1k0g n GLN 103 Cb 0.47 -2.26 0.00 0.00 1.02 0.00 0.00 30.24 29.46 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 -0.54 -1.95 0.00 1.08 0.00 -1.26 -4.43 105.19 98.09 1k0g n GLY 104 Ca 0.48 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.99 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 -1.77 0.61 3.82 -0.02 0.00 0.16 -0.63 105.19 107.37 1k0g n GLY 105 Ca 0.00 -1.76 -0.38 0.00 0.00 0.00 0.00 46.02 43.87 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 -1.31 3.62 -0.18 4.61 0.00 0.62 0.46 121.76 129.58 1k0g s ALA 106 Ca 0.00 -0.06 -0.15 0.00 0.00 0.00 0.00 51.96 51.76 1k0g s ALA 106 Cb 0.00 -2.55 0.05 0.00 0.00 0.00 0.00 23.12 20.62 1k0g s ALA 106 CO 0.00 0.43 0.48 -1.17 0.00 0.00 0.00 175.76 175.50 1k0g s LEU 107 N -1.18 0.01 0.00 0.00 0.20 0.42 -0.57 118.68 117.55 1k0g s LEU 107 Ca 0.28 0.99 0.00 0.00 0.69 0.00 0.00 54.13 56.09 1k0g s LEU 107 Cb -0.18 1.62 0.00 0.00 -0.43 0.00 0.00 46.19 47.20 1k0g s LEU 107 CO 0.17 -0.18 0.00 0.61 -0.29 0.00 0.00 176.35 176.66 1k0g n GLY 108 N 3.33 -0.31 3.67 7.98 0.00 -0.16 -0.13 105.19 119.56 1k0g n GLY 108 Ca -0.17 -0.98 -0.35 0.00 0.00 0.00 0.00 46.02 44.52 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 4.01 -0.50 0.99 2.96 -0.18 -1.26 118.68 124.71 1k0g s LEU 109 Ca 0.00 0.13 -0.03 0.00 -0.22 0.00 0.00 54.13 54.00 1k0g s LEU 109 Cb 0.00 -2.04 0.13 0.00 0.50 0.00 0.00 46.19 44.78 1k0g s LEU 109 CO 0.00 0.14 0.31 -0.36 -1.32 0.00 0.00 176.35 175.12 1k0g s PHE 110 N 0.61 3.51 0.64 5.38 0.08 0.84 -1.40 117.98 127.65 1k0g s PHE 110 Ca 0.06 -2.50 -0.14 0.00 0.12 0.00 0.00 56.93 54.47 1k0g s PHE 110 Cb -0.12 -3.24 -0.01 0.00 -0.57 0.00 0.00 43.02 39.08 1k0g s PHE 110 CO 0.01 -0.92 1.07 0.20 -0.10 0.00 0.00 175.22 175.48 1k0g s GLY 111 N 1.43 2.01 0.29 4.36 0.00 0.94 0.61 107.32 116.97 1k0g s GLY 111 Ca 0.12 0.37 0.04 0.00 0.00 0.00 0.00 44.72 45.24 1k0g s GLY 111 CO -0.04 0.70 1.79 -1.82 0.00 0.00 0.00 173.10 173.73 1k0g h TYR 112 N -0.00 1.04 0.00 1.90 3.20 -1.05 -1.04 116.97 121.02 1k0g h TYR 112 Ca -0.46 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.44 1k0g h TYR 112 Cb 1.23 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 39.18 1k0g h TYR 112 CO 0.58 0.28 0.00 -0.25 -1.64 0.00 0.00 178.16 177.13 1k0g n ASP 113 N -4.75 0.00 0.29 -2.11 8.00 -1.25 -1.05 116.55 115.68 1k0g n ASP 113 Ca 0.21 -0.01 0.16 0.00 0.71 0.00 0.00 54.79 55.87 1k0g n ASP 113 Cb 0.50 -0.29 0.85 0.00 -0.02 0.00 0.00 41.12 42.16 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 -2.30 0.64 5.85 -1.38 -2.01 115.31 116.12 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 0.20 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.23 1k0g h LEU 114 CO 0.00 0.06 -0.00 1.23 -0.34 0.00 0.00 178.44 179.39 1k0g h GLY 115 N 0.78 0.00 1.65 3.75 0.00 -1.27 0.14 103.07 108.11 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 0.01 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.09 1k0g n ARG 116 N -3.10 0.16 0.01 4.80 1.74 -0.75 -0.19 116.66 119.33 1k0g n ARG 116 Ca -0.01 0.17 0.12 0.00 -0.77 0.00 0.00 57.85 57.37 1k0g n ARG 116 Cb 0.18 -1.50 0.32 0.00 -1.02 0.00 0.00 32.46 30.44 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 -1.32 0.04 -0.00 5.56 5.12 0.04 -4.03 116.66 122.07 1k0g n ARG 117 Ca 0.06 0.01 0.03 0.00 -1.93 0.00 0.00 57.85 56.02 1k0g n ARG 117 Cb 0.12 -1.53 -0.04 0.00 -1.16 0.00 0.00 32.46 29.85 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 -1.59 0.00 -3.80 -1.55 3.72 0.73 -4.98 117.46 110.00 1k0g n PHE 118 Ca 0.06 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.32 1k0g n PHE 118 Cb 0.35 -0.01 -0.15 0.00 -0.94 0.00 0.00 39.48 38.73 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 -1.66 0.00 -0.34 -1.08 0.41 -0.91 -5.14 118.70 109.98 1k0g s GLU 119 Ca 0.02 0.15 -0.21 0.00 -0.41 0.00 0.00 54.97 54.52 1k0g s GLU 119 Cb 0.05 -0.14 0.00 0.00 -1.78 0.00 0.00 34.13 32.25 1k0g s GLU 119 CO 0.27 -0.11 0.68 0.45 -0.49 0.00 0.00 175.26 176.06 1k0g s SER 120 N 0.70 6.49 0.13 -0.19 0.15 -1.26 -4.45 113.70 115.27 1k0g s SER 120 Ca -0.06 0.32 0.11 0.00 0.70 0.00 0.00 55.95 57.01 1k0g s SER 120 Cb -0.08 -2.35 -0.04 0.00 -1.71 0.00 0.00 66.02 61.84 1k0g s SER 120 CO -0.02 -0.59 -0.26 -0.76 1.20 0.00 0.00 173.24 172.81 1k0g s LEU 121 N 2.79 2.32 1.16 3.45 1.43 -1.26 -5.12 118.68 123.45 1k0g s LEU 121 Ca 0.27 -0.74 -0.16 0.00 -1.03 0.00 0.00 54.13 52.46 1k0g s LEU 121 Cb -0.14 -1.16 0.20 0.00 0.03 0.00 0.00 46.19 45.12 1k0g s LEU 121 CO 0.14 0.15 0.47 -2.65 0.23 0.00 0.00 176.35 174.70 1k0g n PRO 122 N 0.91 -2.11 -3.52 1.29 -0.02 -1.26 -4.97 135.00 125.32 1k0g n PRO 122 Ca -0.18 -0.59 -0.27 0.00 -2.02 0.00 0.00 63.50 60.44 1k0g n PRO 122 Cb 0.53 -1.91 -0.09 0.00 -0.02 0.00 0.00 33.50 32.01 1k0g n PRO 122 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1k0g n GLU 123 N -3.47 1.56 -0.04 -0.52 1.02 -1.26 -4.92 120.64 113.01 1k0g n GLU 123 Ca 0.01 -4.08 -0.20 0.00 -0.02 0.00 0.00 57.16 52.87 1k0g n GLU 123 Cb 0.58 -1.97 -0.13 0.00 -0.02 0.00 0.00 31.44 29.90 1k0g n GLU 123 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1k0g n ILE 124 N 1.65 1.69 -1.32 -3.67 5.41 -1.26 -4.92 119.36 116.93 1k0g n ILE 124 Ca 0.25 -0.62 -0.32 0.00 1.00 0.00 0.00 62.75 63.06 1k0g n ILE 124 Cb 0.43 -1.64 0.09 0.00 -0.71 0.00 0.00 39.64 37.81 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 -2.54 2.17 0.30 -1.39 0.00 -0.89 -4.96 121.76 114.43 1k0g s ALA 125 Ca -0.26 0.46 -0.25 0.00 0.00 0.00 0.00 51.96 51.91 1k0g s ALA 125 Cb 0.07 -3.34 -0.10 0.00 0.00 0.00 0.00 23.12 19.76 1k0g s ALA 125 CO 0.72 -1.81 0.91 -2.00 0.00 0.00 0.00 175.76 173.57 1k0g s GLU 126 N -4.53 4.55 -0.74 0.00 2.12 0.11 -4.66 118.70 115.55 1k0g s GLU 126 Ca 0.65 1.27 -0.18 0.00 0.36 0.00 0.00 54.97 57.07 1k0g s GLU 126 Cb -0.20 -2.86 0.14 0.00 0.26 0.00 0.00 34.13 31.47 1k0g s GLU 126 CO 0.51 0.32 0.83 -1.14 -0.54 0.00 0.00 175.26 175.25 1k0g s GLN 127 N -1.95 3.33 0.00 4.30 0.74 -1.26 -0.16 119.66 124.66 1k0g s GLN 127 Ca 0.48 -1.72 0.03 0.00 0.05 0.00 0.00 55.36 54.21 1k0g s GLN 127 Cb -0.19 -4.47 0.05 0.00 1.10 0.00 0.00 33.01 29.49 1k0g s GLN 127 CO 0.24 -1.54 0.74 -0.40 -0.55 0.00 0.00 175.29 173.78 1k0g n ASP 128 N 5.80 1.57 -4.27 6.67 5.75 -1.26 -4.95 116.55 125.87 1k0g n ASP 128 Ca 0.05 -1.39 -0.34 0.00 -0.01 0.00 0.00 54.79 53.10 1k0g n ASP 128 Cb 0.45 -0.02 -0.15 0.00 -1.03 0.00 0.00 41.12 40.37 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 -0.49 2.87 -0.70 2.12 1.01 -1.26 -5.05 121.20 119.70 1k0g s ILE 129 Ca 0.05 -0.68 -0.23 0.00 0.00 0.00 0.00 60.65 59.78 1k0g s ILE 129 Cb 0.03 -2.25 0.06 0.00 0.01 0.00 0.00 42.46 40.31 1k0g s ILE 129 CO 0.05 0.49 1.06 -0.69 0.00 0.00 0.00 174.94 175.84 1k0g s VAL 130 N 1.12 4.19 -0.19 2.92 1.01 -1.26 -4.96 120.40 123.23 1k0g s VAL 130 Ca 0.01 -0.24 -0.15 0.00 0.00 0.00 0.00 61.98 61.60 1k0g s VAL 130 Cb -0.14 -4.76 0.05 0.00 0.00 0.00 0.00 36.38 31.53 1k0g s VAL 130 CO -0.04 -1.57 0.49 -0.22 0.00 0.00 0.00 175.10 173.76 1k0g s LEU 131 N 4.43 -0.04 0.67 3.92 2.96 -1.26 -4.95 118.68 124.40 1k0g s LEU 131 Ca 0.26 1.01 -0.16 0.00 -0.22 0.00 0.00 54.13 55.02 1k0g s LEU 131 Cb -0.14 1.66 0.00 0.00 0.50 0.00 0.00 46.19 48.21 1k0g s LEU 131 CO 0.10 -0.18 1.19 -2.84 -1.32 0.00 0.00 176.35 173.29 1k0g s PRO 132 N 0.72 2.58 0.39 0.98 0.02 -1.26 -4.90 135.00 133.52 1k0g s PRO 132 Ca -0.04 1.71 0.21 0.00 0.02 0.00 0.00 61.00 62.90 1k0g s PRO 132 Cb -0.05 -1.89 0.51 0.00 0.02 0.00 0.00 34.50 33.09 1k0g s PRO 132 CO -0.05 -1.49 1.65 -0.44 -0.33 0.00 0.00 177.00 176.34 1k0g h ASP 133 N 0.20 0.00 -3.53 2.53 3.32 -1.20 -3.42 116.42 114.31 1k0g h ASP 133 Ca -0.48 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.26 1k0g h ASP 133 Cb 1.29 0.00 -0.34 0.00 0.22 0.00 0.00 39.33 40.50 1k0g h ASP 133 CO 0.53 0.27 -0.73 -0.32 -1.72 0.00 0.00 179.24 177.27 1k0g s MET 134 N -3.31 0.00 -0.34 3.56 1.75 -1.19 -0.04 119.30 119.75 1k0g s MET 134 Ca 0.03 0.16 0.01 0.00 -1.25 0.00 0.00 55.69 54.64 1k0g s MET 134 Cb 0.08 -0.26 0.14 0.00 2.84 0.00 0.00 34.83 37.63 1k0g s MET 134 CO 0.68 -0.15 0.30 0.00 -0.65 0.00 0.00 175.02 175.19 1k0g s ALA 135 N 0.99 -0.06 -0.07 4.11 0.00 -0.49 -0.68 121.76 125.56 1k0g s ALA 135 Ca -0.08 -0.99 0.04 0.00 0.00 0.00 0.00 51.96 50.92 1k0g s ALA 135 Cb -0.12 -1.83 0.00 0.00 0.00 0.00 0.00 23.12 21.18 1k0g s ALA 135 CO -0.03 -1.97 -0.18 0.08 0.00 0.00 0.00 175.76 173.66 1k0g s VAL 136 N 1.68 1.56 0.25 0.00 1.01 -0.10 -1.01 120.40 123.79 1k0g s VAL 136 Ca 0.14 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.40 1k0g s VAL 136 Cb -0.17 -1.37 -0.03 0.00 0.00 0.00 0.00 36.38 34.81 1k0g s VAL 136 CO -0.14 0.45 0.41 -0.83 0.00 0.00 0.00 175.10 174.99 1k0g s GLY 137 N 0.35 1.41 -0.29 4.51 0.00 0.82 -1.05 107.32 113.07 1k0g s GLY 137 Ca -0.13 -1.04 -0.09 0.00 0.00 0.00 0.00 44.72 43.46 1k0g s GLY 137 CO 0.05 -1.03 0.13 -0.42 0.00 0.00 0.00 173.10 171.84 1k0g s ILE 138 N -2.03 4.60 -0.10 0.90 -1.09 0.14 -0.44 121.20 123.19 1k0g s ILE 138 Ca 0.37 -0.29 0.04 0.00 -2.23 0.00 0.00 60.65 58.53 1k0g s ILE 138 Cb -0.10 -3.28 -0.00 0.00 -1.58 0.00 0.00 42.46 37.50 1k0g s ILE 138 CO 0.31 0.16 -0.22 -0.31 -1.23 0.00 0.00 174.94 173.64 1k0g s TYR 139 N 1.63 2.59 -1.54 3.97 1.51 0.17 -0.33 117.35 125.36 1k0g s TYR 139 Ca 0.05 -0.94 0.28 0.00 -1.01 0.00 0.00 57.07 55.46 1k0g s TYR 139 Cb -0.16 -1.72 1.16 0.00 -0.11 0.00 0.00 41.96 41.12 1k0g s TYR 139 CO 0.06 -0.36 1.82 -0.40 -1.11 0.00 0.00 175.55 175.57 1k0g n ASP 140 N 3.45 0.44 -3.23 2.29 5.68 -1.26 0.39 116.55 124.30 1k0g n ASP 140 Ca -0.19 -0.45 -0.12 0.00 -0.50 0.00 0.00 54.79 53.53 1k0g n ASP 140 Cb 0.53 -0.08 -0.02 0.00 -1.14 0.00 0.00 41.12 40.40 1k0g n ASP 140 CO 0.00 0.00 0.00 -1.66 -1.33 0.00 0.00 177.20 174.21 1k0g s TRP 141 N -2.57 0.69 -0.22 2.11 1.48 -1.26 -2.07 118.94 117.10 1k0g s TRP 141 Ca 0.26 -1.07 -0.33 0.00 -1.06 0.00 0.00 56.10 53.90 1k0g s TRP 141 Cb 0.20 0.24 0.15 0.00 -1.16 0.00 0.00 33.47 32.90 1k0g s TRP 141 CO 0.50 -1.26 1.24 0.00 -4.06 0.00 0.00 176.95 173.37 1k0g s ALA 142 N -2.94 -2.08 -0.20 2.67 0.00 -0.70 -4.51 121.76 114.00 1k0g s ALA 142 Ca 0.25 1.70 -0.03 0.00 0.00 0.00 0.00 51.96 53.88 1k0g s ALA 142 Cb -0.02 -0.60 -0.01 0.00 0.00 0.00 0.00 23.12 22.50 1k0g s ALA 142 CO 0.16 -0.46 -0.06 -1.17 0.00 0.00 0.00 175.76 174.23 1k0g s LEU 143 N -1.71 2.85 -0.13 0.00 0.20 0.14 -0.41 118.68 119.61 1k0g s LEU 143 Ca 0.08 -0.38 -0.01 0.00 0.69 0.00 0.00 54.13 54.51 1k0g s LEU 143 Cb -0.01 -1.71 -0.02 0.00 -0.43 0.00 0.00 46.19 44.02 1k0g s LEU 143 CO -0.05 0.02 -0.11 -0.63 -0.29 0.00 0.00 176.35 175.29 1k0g s ILE 144 N 1.26 3.26 -0.22 6.68 1.01 0.27 -1.13 121.20 132.33 1k0g s ILE 144 Ca 0.03 -0.59 -0.06 0.00 0.00 0.00 0.00 60.65 60.04 1k0g s ILE 144 Cb -0.14 -2.38 -0.02 0.00 0.01 0.00 0.00 42.46 39.92 1k0g s ILE 144 CO -0.02 0.52 0.02 -0.69 0.00 0.00 0.00 174.94 174.76 1k0g s VAL 145 N 0.31 3.98 -0.29 2.92 1.01 0.32 -0.75 120.40 127.90 1k0g s VAL 145 Ca -0.09 -0.29 -0.05 0.00 0.00 0.00 0.00 61.98 61.55 1k0g s VAL 145 Cb -0.15 -2.82 0.03 0.00 0.00 0.00 0.00 36.38 33.43 1k0g s VAL 145 CO 0.05 0.40 0.04 -0.62 0.00 0.00 0.00 175.10 174.96 1k0g s ASP 146 N 1.27 4.92 0.19 3.32 -1.08 0.20 -1.90 116.67 123.58 1k0g s ASP 146 Ca 0.04 -0.95 0.26 0.00 -0.52 0.00 0.00 52.55 51.38 1k0g s ASP 146 Cb -0.15 -1.79 0.71 0.00 -1.46 0.00 0.00 42.92 40.23 1k0g s ASP 146 CO 0.01 -0.22 1.67 1.41 0.52 0.00 0.00 175.17 178.57 1k0g n HIS 147 N 4.76 0.83 -0.05 -5.34 8.25 -0.20 -0.94 115.22 122.53 1k0g n HIS 147 Ca -0.14 0.24 -0.15 0.00 -0.26 0.00 0.00 57.72 57.41 1k0g n HIS 147 Cb 0.46 -0.87 -0.13 0.00 1.12 0.00 0.00 29.99 30.57 1k0g n HIS 147 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 1k0g h GLN 148 N 0.00 0.04 -0.00 -0.41 4.15 -1.93 -3.30 115.11 113.67 1k0g h GLN 148 Ca 0.00 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.35 1k0g h GLN 148 Cb 0.73 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.45 1k0g h GLN 148 CO 0.00 1.00 -0.01 0.54 -1.93 0.00 0.00 178.83 178.43 1k0g n ARG 149 N -4.56 0.31 -3.74 1.69 1.74 -1.24 -4.94 116.66 105.92 1k0g n ARG 149 Ca -0.10 -0.01 -0.23 0.00 -0.77 0.00 0.00 57.85 56.73 1k0g n ARG 149 Cb 0.51 -1.50 0.03 0.00 -1.02 0.00 0.00 32.46 30.48 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 -1.34 -2.02 -4.57 -1.55 8.25 -0.12 -4.99 115.22 108.89 1k0g n HIS 150 Ca 0.12 0.86 -0.23 0.00 -0.26 0.00 0.00 57.72 58.21 1k0g n HIS 150 Cb 0.27 -4.33 -0.16 0.00 1.12 0.00 0.00 29.99 26.89 1k0g n HIS 150 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1k0g s THR 151 N -3.59 1.05 -0.37 1.59 2.01 -0.92 -4.79 115.64 110.63 1k0g s THR 151 Ca 0.15 -0.50 -0.09 0.00 0.31 0.00 0.00 61.69 61.56 1k0g s THR 151 Cb -0.07 -0.92 0.04 0.00 0.01 0.00 0.00 72.50 71.56 1k0g s THR 151 CO 0.81 0.32 0.17 -0.69 -0.69 0.00 0.00 174.62 174.54 1k0g s VAL 152 N 0.15 4.18 -0.14 3.82 1.01 -1.26 0.58 120.40 128.74 1k0g s VAL 152 Ca -0.04 -1.06 -0.03 0.00 0.00 0.00 0.00 61.98 60.85 1k0g s VAL 152 Cb -0.10 -3.38 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 1k0g s VAL 152 CO 0.01 -0.25 -0.04 -0.44 0.00 0.00 0.00 175.10 174.38 1k0g s SER 153 N 1.56 4.81 -0.22 3.32 0.01 0.07 -0.90 113.70 122.35 1k0g s SER 153 Ca 0.00 -0.10 -0.05 0.00 1.31 0.00 0.00 55.95 57.12 1k0g s SER 153 Cb -0.20 -1.70 -0.02 0.00 0.21 0.00 0.00 66.02 64.32 1k0g s SER 153 CO 0.04 0.21 -0.00 -0.22 0.41 0.00 0.00 173.24 173.67 1k0g s LEU 154 N 0.14 3.12 0.16 2.44 2.96 0.40 -0.57 118.68 127.34 1k0g s LEU 154 Ca -0.01 -0.30 0.09 0.00 -0.22 0.00 0.00 54.13 53.69 1k0g s LEU 154 Cb -0.14 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.71 1k0g s LEU 154 CO 0.03 -0.00 -0.21 -1.48 -1.32 0.00 0.00 176.35 173.37 1k0g s LEU 155 N 1.40 2.40 -0.22 -0.68 0.05 0.46 0.82 118.68 122.91 1k0g s LEU 155 Ca 0.05 -0.82 -0.23 0.00 0.05 0.00 0.00 54.13 53.18 1k0g s LEU 155 Cb -0.15 -0.96 0.06 0.00 -2.05 0.00 0.00 46.19 43.10 1k0g s LEU 155 CO -0.00 0.04 0.63 -0.55 -0.55 0.00 0.00 176.35 175.92 1k0g s SER 156 N -2.48 -0.65 0.00 1.48 0.15 -0.73 -1.72 113.70 109.75 1k0g s SER 156 Ca 0.15 1.20 0.26 0.00 0.70 0.00 0.00 55.95 58.26 1k0g s SER 156 Cb -0.07 1.21 0.64 0.00 -1.71 0.00 0.00 66.02 66.08 1k0g s SER 156 CO 0.07 -0.26 1.49 1.41 1.20 0.00 0.00 173.24 177.15 1k0g n HIS 157 N 2.53 0.00 0.00 3.44 8.25 -0.88 0.14 115.22 128.70 1k0g n HIS 157 Ca -0.14 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.32 1k0g n HIS 157 Cb 0.56 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.56 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 -0.61 0.00 -4.39 0.41 3.02 -1.26 -4.93 115.26 107.51 1k0g n ASN 158 Ca 0.11 0.00 -0.44 0.00 -0.03 0.00 0.00 54.58 54.22 1k0g n ASN 158 Cb 0.36 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.46 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 0.61 6.16 0.44 6.41 -1.08 -1.26 -4.81 116.67 123.13 1k0g s ASP 159 Ca 0.00 -1.32 0.13 0.00 -0.52 0.00 0.00 52.55 50.84 1k0g s ASP 159 Cb 0.00 -2.20 0.96 0.00 -1.46 0.00 0.00 42.92 40.22 1k0g s ASP 159 CO 0.00 -0.70 1.99 1.62 0.52 0.00 0.00 175.17 178.60 1k0g h VAL 160 N 5.78 1.13 -0.30 1.11 3.04 -1.88 -0.73 116.25 124.40 1k0g h VAL 160 Ca -0.28 -0.60 -0.13 0.00 -1.01 0.00 0.00 66.70 64.68 1k0g h VAL 160 Cb 1.11 1.25 -0.01 0.00 -2.01 0.00 0.00 31.29 31.62 1k0g h VAL 160 CO 0.90 0.18 -0.35 0.78 -1.01 0.00 0.00 177.57 178.07 1k0g h ASN 161 N 0.08 0.71 -0.72 3.17 2.35 -1.98 0.17 115.58 119.36 1k0g h ASN 161 Ca 0.02 -0.30 -0.02 0.00 -0.55 0.00 0.00 56.30 55.44 1k0g h ASN 161 Cb 0.29 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.43 1k0g h ASN 161 CO 0.02 1.00 0.35 0.00 -1.65 0.00 0.00 177.43 177.15 1k0g h ALA 162 N 1.04 0.93 -0.74 -0.83 0.00 -1.77 -1.45 119.26 116.43 1k0g h ALA 162 Ca 0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1k0g h ALA 162 Cb 0.87 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 1k0g h ALA 162 CO 0.08 0.48 0.41 -0.09 0.00 0.00 0.00 179.25 180.13 1k0g h ARG 163 N 1.01 1.03 -0.91 0.00 9.65 -0.56 0.26 114.38 124.86 1k0g h ARG 163 Ca 0.25 -0.12 0.02 0.00 -1.10 0.00 0.00 59.98 59.03 1k0g h ARG 163 Cb 0.11 -0.20 -0.05 0.00 -1.39 0.00 0.00 29.97 28.43 1k0g h ARG 163 CO -0.03 0.76 0.59 -0.09 2.80 0.00 0.00 179.97 184.00 1k0g h ARG 164 N 1.02 1.15 0.01 0.20 2.43 -0.70 -0.28 114.38 118.20 1k0g h ARG 164 Ca 0.26 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.36 1k0g h ARG 164 Cb 0.03 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.32 1k0g h ARG 164 CO -0.04 0.76 -0.00 0.00 -1.51 0.00 0.00 179.97 179.17 1k0g h ALA 165 N 1.35 -0.01 -0.49 2.80 0.00 -0.12 1.26 119.26 124.05 1k0g h ALA 165 Ca 0.35 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.32 1k0g h ALA 165 Cb -0.07 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.66 1k0g h ALA 165 CO -0.10 -0.49 0.10 2.35 0.00 0.00 0.00 179.25 181.11 1k0g h TRP 166 N -0.05 0.15 -0.45 0.00 7.01 -0.24 0.52 115.95 122.89 1k0g h TRP 166 Ca -0.00 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 60.99 1k0g h TRP 166 Cb 0.04 0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 27.09 1k0g h TRP 166 CO -0.07 -0.01 0.13 1.25 -2.79 0.00 0.00 178.44 176.96 1k0g h LEU 167 N 0.23 0.66 -0.48 0.65 5.85 -0.55 -1.50 115.31 120.18 1k0g h LEU 167 Ca 0.25 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1k0g h LEU 167 Cb 0.33 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.19 1k0g h LEU 167 CO -0.32 0.70 0.00 -0.62 -0.34 0.00 0.00 178.44 177.86 1k0g n GLU 168 N -4.54 0.22 -0.00 1.25 -0.58 0.43 -2.47 120.64 114.95 1k0g n GLU 168 Ca 0.01 0.36 0.13 0.00 -0.42 0.00 0.00 57.16 57.23 1k0g n GLU 168 Cb 0.19 -1.86 0.27 0.00 -0.57 0.00 0.00 31.44 29.48 1k0g n GLU 168 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1k0g n SER 169 N -2.27 2.40 -4.65 1.62 3.41 0.17 -4.86 113.62 109.44 1k0g n SER 169 Ca 0.03 -1.80 -0.42 0.00 -0.26 0.00 0.00 58.87 56.42 1k0g n SER 169 Cb 0.30 -0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.22 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 -2.00 4.05 0.00 4.33 -1.52 -0.69 -4.86 119.66 118.97 1k0g s GLN 170 Ca 0.32 2.02 0.11 0.00 -1.95 0.00 0.00 55.36 55.86 1k0g s GLN 170 Cb 0.20 -4.00 0.22 0.00 -0.22 0.00 0.00 33.01 29.22 1k0g s GLN 170 CO 0.31 -0.99 1.10 1.04 -0.25 0.00 0.00 175.29 176.50 1k0g n GLN 171 N 7.28 1.93 -1.70 2.91 6.02 -1.26 -4.93 117.38 127.62 1k0g n GLN 171 Ca 0.18 -1.70 -0.43 0.00 -0.01 0.00 0.00 57.00 55.03 1k0g n GLN 171 Cb 0.44 -1.25 -0.01 0.00 1.02 0.00 0.00 30.24 30.43 1k0g n GLN 171 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1k0g n PHE 172 N 0.59 2.40 -3.87 1.08 7.35 -1.26 -4.98 117.46 118.77 1k0g n PHE 172 Ca 0.10 0.45 -0.29 0.00 -0.76 0.00 0.00 57.45 56.95 1k0g n PHE 172 Cb 0.37 -2.47 -0.16 0.00 0.35 0.00 0.00 39.48 37.57 1k0g n PHE 172 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 1k0g s SER 173 N 0.05 3.55 0.29 -2.13 0.15 -1.26 -4.19 113.70 110.15 1k0g s SER 173 Ca 0.61 -1.06 -0.29 0.00 0.70 0.00 0.00 55.95 55.90 1k0g s SER 173 Cb -0.58 -0.99 -0.10 0.00 -1.71 0.00 0.00 66.02 62.65 1k0g s SER 173 CO 0.56 -0.26 1.19 -2.16 1.20 0.00 0.00 173.24 173.77 1k0g s PRO 174 N 1.54 4.52 0.00 5.44 0.04 -1.26 -4.85 135.00 140.43 1k0g s PRO 174 Ca -0.04 1.96 0.00 0.00 0.04 0.00 0.00 61.00 62.96 1k0g s PRO 174 Cb -0.18 -3.15 0.00 0.00 0.04 0.00 0.00 34.50 31.20 1k0g s PRO 174 CO -0.07 0.03 0.38 1.04 0.04 0.00 0.00 177.00 178.43 1k0g n GLN 175 N 1.21 -0.35 -3.05 4.56 6.02 -1.26 -5.06 117.38 119.44 1k0g n GLN 175 Ca -0.00 -0.42 -0.40 0.00 -0.01 0.00 0.00 57.00 56.18 1k0g n GLN 175 Cb 0.44 -0.82 -0.05 0.00 1.02 0.00 0.00 30.24 30.83 1k0g n GLN 175 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1k0g s GLU 176 N -0.07 4.43 0.49 -1.09 2.12 -1.26 -5.05 118.70 118.27 1k0g s GLU 176 Ca 0.00 0.89 -0.08 0.00 0.36 0.00 0.00 54.97 56.14 1k0g s GLU 176 Cb 0.00 -3.42 0.12 0.00 0.26 0.00 0.00 34.13 31.09 1k0g s GLU 176 CO 0.00 0.13 0.43 -0.25 -0.54 0.00 0.00 175.26 175.03 1k0g n ASP 177 N 3.52 -1.48 -4.00 -1.70 8.00 -1.26 -4.05 116.55 115.59 1k0g n ASP 177 Ca -0.02 -0.75 -0.19 0.00 0.71 0.00 0.00 54.79 54.54 1k0g n ASP 177 Cb 0.51 -0.40 -0.15 0.00 -0.02 0.00 0.00 41.12 41.06 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 -1.78 0.82 -0.07 1.24 2.19 -1.26 0.66 117.98 119.77 1k0g s PHE 178 Ca 0.28 -0.18 -0.02 0.00 0.33 0.00 0.00 56.93 57.34 1k0g s PHE 178 Cb -0.03 -0.57 0.04 0.00 -1.31 0.00 0.00 43.02 41.15 1k0g s PHE 178 CO 0.22 -0.06 0.06 0.99 1.83 0.00 0.00 175.22 178.25 1k0g s THR 179 N 0.04 -0.01 0.13 0.12 2.01 0.53 -4.94 115.64 113.52 1k0g s THR 179 Ca -0.00 0.26 -0.31 0.00 0.31 0.00 0.00 61.69 61.94 1k0g s THR 179 Cb -0.06 -0.30 -0.09 0.00 0.01 0.00 0.00 72.50 72.06 1k0g s THR 179 CO 0.00 0.11 1.50 -0.76 -0.69 0.00 0.00 174.62 174.78 1k0g s LEU 180 N 2.13 4.37 -0.11 4.42 1.43 -1.26 0.19 118.68 129.84 1k0g s LEU 180 Ca 0.04 2.47 0.16 0.00 -1.03 0.00 0.00 54.13 55.77 1k0g s LEU 180 Cb -0.13 -3.59 0.56 0.00 0.03 0.00 0.00 46.19 43.07 1k0g s LEU 180 CO -0.04 -0.76 1.48 0.41 0.23 0.00 0.00 176.35 177.66 1k0g n THR 181 N 4.06 1.82 -3.82 5.49 -1.04 0.22 -4.81 114.28 116.20 1k0g n THR 181 Ca 0.13 -1.38 -0.06 0.00 -2.04 0.00 0.00 64.05 60.71 1k0g n THR 181 Cb 0.40 0.08 -0.01 0.00 -1.82 0.00 0.00 70.33 68.99 1k0g n THR 181 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1k0g s SER 182 N -1.25 -0.16 0.59 8.00 1.04 -1.22 -4.81 113.70 115.89 1k0g s SER 182 Ca 0.41 -0.64 -0.17 0.00 0.48 0.00 0.00 55.95 56.03 1k0g s SER 182 Cb 0.29 0.65 -0.03 0.00 0.10 0.00 0.00 66.02 67.03 1k0g s SER 182 CO 0.17 -1.24 1.12 -1.81 0.98 0.00 0.00 173.24 172.46 1k0g s ASP 183 N -3.00 5.48 0.32 7.02 1.11 -1.26 -4.57 116.67 121.76 1k0g s ASP 183 Ca 0.13 2.09 -0.26 0.00 0.18 0.00 0.00 52.55 54.69 1k0g s ASP 183 Cb -0.04 -2.57 -0.10 0.00 1.07 0.00 0.00 42.92 41.28 1k0g s ASP 183 CO 0.06 -1.38 0.95 0.26 1.18 0.00 0.00 175.17 176.24 1k0g s TRP 184 N -2.03 3.70 0.02 4.23 0.52 -1.26 -4.43 118.94 119.69 1k0g s TRP 184 Ca 0.70 1.79 0.02 0.00 0.02 0.00 0.00 56.10 58.63 1k0g s TRP 184 Cb -0.22 -2.94 -0.01 0.00 -1.15 0.00 0.00 33.47 29.15 1k0g s TRP 184 CO 0.33 0.20 -0.07 1.14 0.02 0.00 0.00 176.95 178.57 1k0g s GLN 185 N -1.99 0.53 0.57 4.98 -2.07 0.24 -4.81 119.66 117.11 1k0g s GLN 185 Ca 0.50 -0.45 -0.15 0.00 -1.82 0.00 0.00 55.36 53.44 1k0g s GLN 185 Cb -0.19 -0.44 -0.05 0.00 -1.09 0.00 0.00 33.01 31.23 1k0g s GLN 185 CO 0.25 0.11 1.02 0.45 -1.32 0.00 0.00 175.29 175.79 1k0g s SER 186 N -0.74 6.27 0.00 12.60 0.15 -1.26 -1.19 113.70 129.53 1k0g s SER 186 Ca -0.02 1.58 0.04 0.00 0.70 0.00 0.00 55.95 58.26 1k0g s SER 186 Cb -0.05 -2.50 0.27 0.00 -1.71 0.00 0.00 66.02 62.02 1k0g s SER 186 CO 0.00 -0.83 1.10 -0.46 1.20 0.00 0.00 173.24 174.25 1k0g n ASN 187 N -2.07 0.00 -3.61 5.45 6.94 0.98 -4.79 115.26 118.15 1k0g n ASN 187 Ca 0.07 -1.70 -0.16 0.00 -0.02 0.00 0.00 54.58 52.77 1k0g n ASN 187 Cb 0.54 0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.89 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 -2.00 0.88 0.61 -3.83 0.23 -1.26 -4.93 119.30 108.99 1k0g s MET 188 Ca 0.07 0.32 -0.16 0.00 -1.03 0.00 0.00 55.69 54.89 1k0g s MET 188 Cb 0.03 0.41 -0.03 0.00 -1.53 0.00 0.00 34.83 33.72 1k0g s MET 188 CO 0.05 -0.23 1.07 0.95 -2.03 0.00 0.00 175.02 174.83 1k0g s THR 189 N -0.81 3.64 0.34 3.16 -4.23 -1.26 -4.80 115.64 111.69 1k0g s THR 189 Ca -0.09 0.78 0.11 0.00 -1.18 0.00 0.00 61.69 61.32 1k0g s THR 189 Cb -0.02 -3.31 0.33 0.00 1.34 0.00 0.00 72.50 70.84 1k0g s THR 189 CO 0.06 -0.45 1.76 -0.09 -0.54 0.00 0.00 174.62 175.36 1k0g h ARG 190 N 0.37 0.56 0.02 3.99 9.65 -2.01 0.69 114.38 127.66 1k0g h ARG 190 Ca -0.47 -0.03 -0.21 0.00 -1.10 0.00 0.00 59.98 58.16 1k0g h ARG 190 Cb 1.23 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 29.67 1k0g h ARG 190 CO 0.57 0.37 -0.96 1.49 2.80 0.00 0.00 179.97 184.24 1k0g h GLU 191 N 0.58 0.21 -0.09 0.20 4.81 -1.99 -0.30 114.58 118.00 1k0g h GLU 191 Ca 0.60 -0.26 -0.17 0.00 -0.13 0.00 0.00 59.36 59.40 1k0g h GLU 191 Cb 1.19 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.65 1k0g h GLU 191 CO -0.38 1.02 -0.67 1.96 -0.73 0.00 0.00 179.01 180.22 1k0g h GLN 192 N 0.10 0.38 -0.51 1.92 4.20 -1.00 -1.36 115.11 118.84 1k0g h GLN 192 Ca -0.06 -0.28 0.08 0.00 0.06 0.00 0.00 58.65 58.45 1k0g h GLN 192 Cb 1.62 0.05 -0.07 0.00 0.30 0.00 0.00 27.48 29.38 1k0g h GLN 192 CO 0.15 0.91 0.13 -0.92 -0.67 0.00 0.00 178.83 178.43 1k0g h TYR 193 N 0.27 0.22 -0.65 2.96 3.20 0.53 -2.22 116.97 121.28 1k0g h TYR 193 Ca -0.02 0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.91 1k0g h TYR 193 Cb 1.22 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 39.43 1k0g h TYR 193 CO 0.04 0.03 0.41 0.78 -1.64 0.00 0.00 178.16 177.77 1k0g h GLY 194 N 0.28 0.93 1.33 1.82 0.00 -0.63 0.48 103.07 107.28 1k0g h GLY 194 Ca 0.25 -0.31 -0.05 0.00 0.00 0.00 0.00 47.33 47.23 1k0g h GLY 194 CO -0.31 0.26 0.16 0.83 0.00 0.00 0.00 176.54 177.48 1k0g h GLU 195 N 0.80 0.84 -0.11 4.80 4.39 -0.68 -0.64 114.58 123.98 1k0g h GLU 195 Ca 0.26 -0.16 -0.04 0.00 0.34 0.00 0.00 59.36 59.76 1k0g h GLU 195 Cb 0.01 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.53 1k0g h GLU 195 CO -0.10 0.74 -0.09 0.87 -1.16 0.00 0.00 179.01 179.27 1k0g h LYS 196 N 0.82 0.25 -0.16 2.33 1.57 -0.85 -2.51 116.57 118.02 1k0g h LYS 196 Ca 0.18 -0.13 0.05 0.00 -1.87 0.00 0.00 60.65 58.89 1k0g h LYS 196 Cb 0.26 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.52 1k0g h LYS 196 CO -0.01 0.64 -0.18 0.35 -0.57 0.00 0.00 179.45 179.68 1k0g h PHE 197 N -0.14 -0.48 -0.10 -1.35 3.04 -0.80 0.67 116.94 117.79 1k0g h PHE 197 Ca 0.02 0.03 -0.07 0.00 3.98 0.00 0.00 57.97 61.93 1k0g h PHE 197 Cb 0.59 0.24 -0.01 0.00 2.56 0.00 0.00 35.95 39.32 1k0g h PHE 197 CO 0.08 -0.26 -0.26 0.00 -2.02 0.00 0.00 178.31 175.86 1k0g h ARG 198 N -0.22 0.17 -0.44 1.11 3.08 -1.17 0.27 114.38 117.18 1k0g h ARG 198 Ca 0.11 -0.05 -0.14 0.00 0.07 0.00 0.00 59.98 59.97 1k0g h ARG 198 Cb 0.38 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 1k0g h ARG 198 CO -0.29 0.42 -0.26 1.96 -1.07 0.00 0.00 179.97 180.73 1k0g h GLN 199 N 0.16 0.95 -0.24 0.04 4.20 -0.90 0.15 115.11 119.47 1k0g h GLN 199 Ca 0.03 -0.43 -0.00 0.00 0.06 0.00 0.00 58.65 58.31 1k0g h GLN 199 Cb 0.54 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 1k0g h GLN 199 CO 0.04 1.09 0.14 0.28 -0.67 0.00 0.00 178.83 179.71 1k0g h VAL 200 N 0.81 1.09 -0.24 -0.54 2.07 0.20 0.01 116.25 119.65 1k0g h VAL 200 Ca 0.10 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 1k0g h VAL 200 Cb 0.84 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1k0g h VAL 200 CO 0.07 0.09 0.08 1.56 0.02 0.00 0.00 177.57 179.39 1k0g h GLN 201 N 0.30 0.34 -0.46 1.57 4.20 -0.31 -0.43 115.11 120.32 1k0g h GLN 201 Ca 0.09 -0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.68 1k0g h GLN 201 Cb 0.02 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.71 1k0g h GLN 201 CO -0.02 0.31 -0.02 1.49 -0.67 0.00 0.00 178.83 179.92 1k0g h GLU 202 N 0.34 0.76 -0.29 1.46 4.57 -0.13 0.80 114.58 122.09 1k0g h GLU 202 Ca 0.09 -0.21 -0.01 0.00 -1.18 0.00 0.00 59.36 58.05 1k0g h GLU 202 Cb 0.11 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.60 1k0g h GLU 202 CO -0.01 0.78 0.15 1.88 -1.18 0.00 0.00 179.01 180.63 1k0g h TYR 203 N 0.71 0.38 -0.15 0.92 0.05 0.27 -0.33 116.97 118.82 1k0g h TYR 203 Ca 0.14 -0.00 -0.20 0.00 0.05 0.00 0.00 58.73 58.71 1k0g h TYR 203 Cb 0.46 -0.13 0.01 0.00 1.01 0.00 0.00 36.73 38.09 1k0g h TYR 203 CO 0.02 0.28 -0.71 -0.07 -1.05 0.00 0.00 178.16 176.64 1k0g h LEU 204 N 0.40 0.88 -0.61 3.88 3.38 -0.19 -0.62 115.31 122.43 1k0g h LEU 204 Ca 0.10 -0.63 0.11 0.00 0.09 0.00 0.00 57.88 57.55 1k0g h LEU 204 Cb 0.03 -0.26 -0.08 0.00 0.09 0.00 0.00 40.66 40.44 1k0g h LEU 204 CO -0.02 1.36 0.19 0.45 0.09 0.00 0.00 178.44 180.52 1k0g h HIS 205 N 0.45 0.32 -0.06 1.13 3.86 0.14 -0.76 115.15 120.23 1k0g h HIS 205 Ca -0.05 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1k0g h HIS 205 Cb 1.34 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 29.76 1k0g h HIS 205 CO 0.09 0.04 0.00 -1.13 0.86 0.00 0.00 177.93 177.79 1k0g n SER 206 N -5.06 0.53 0.00 2.45 3.41 -0.21 -4.90 113.62 109.85 1k0g n SER 206 Ca 0.09 -1.56 0.00 0.00 -0.26 0.00 0.00 58.87 57.14 1k0g n SER 206 Cb 0.31 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 1k0g n SER 206 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1k0g n GLY 207 N 0.87 0.75 0.14 5.00 0.00 -0.29 -4.95 105.19 106.71 1k0g n GLY 207 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 1k0g n GLY 207 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1k0g h ASP 208 N 0.00 0.39 -4.98 1.61 5.19 -1.35 -3.47 116.42 113.80 1k0g h ASP 208 Ca 0.00 -0.44 -0.23 0.00 -0.62 0.00 0.00 57.03 55.74 1k0g h ASP 208 Cb 0.00 -0.11 -0.15 0.00 0.18 0.00 0.00 39.33 39.25 1k0g h ASP 208 CO 0.00 0.75 -0.66 0.00 -3.12 0.00 0.00 179.24 176.21 1k0g n TYR 210 N -0.15 0.73 -3.73 0.00 4.01 -0.39 -4.31 117.16 113.32 1k0g n TYR 210 Ca -0.06 0.26 -0.13 0.00 -0.16 0.00 0.00 57.90 57.80 1k0g n TYR 210 Cb 0.63 -1.13 -0.10 0.00 -0.31 0.00 0.00 39.34 38.43 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 -2.57 0.50 -0.02 -0.72 0.74 -1.12 -4.35 119.66 112.13 1k0g s GLN 211 Ca -0.07 0.60 -0.00 0.00 0.05 0.00 0.00 55.36 55.94 1k0g s GLN 211 Cb 0.07 0.24 0.03 0.00 1.10 0.00 0.00 33.01 34.45 1k0g s GLN 211 CO 0.82 -0.06 0.03 0.08 -0.55 0.00 0.00 175.29 175.61 1k0g s VAL 212 N 0.26 -0.05 -0.47 1.34 1.01 -0.21 -2.08 120.40 120.20 1k0g s VAL 212 Ca -0.00 0.23 -0.24 0.00 0.00 0.00 0.00 61.98 61.96 1k0g s VAL 212 Cb -0.03 -0.10 0.03 0.00 0.00 0.00 0.00 36.38 36.28 1k0g s VAL 212 CO 0.00 0.10 0.86 0.20 0.00 0.00 0.00 175.10 176.26 1k0g s ASN 213 N 1.16 6.44 -0.15 3.32 -0.87 0.18 -0.32 114.94 124.70 1k0g s ASN 213 Ca -0.08 -0.06 -0.03 0.00 -1.57 0.00 0.00 52.86 51.13 1k0g s ASN 213 Cb -0.13 -2.42 -0.02 0.00 -0.02 0.00 0.00 41.25 38.66 1k0g s ASN 213 CO -0.03 -1.01 -0.07 -0.22 -2.57 0.00 0.00 177.10 173.20 1k0g s LEU 214 N 3.56 3.09 0.14 0.60 2.96 -0.67 -4.86 118.68 123.50 1k0g s LEU 214 Ca 0.33 -0.19 0.08 0.00 -0.22 0.00 0.00 54.13 54.13 1k0g s LEU 214 Cb -0.11 -1.73 -0.04 0.00 0.50 0.00 0.00 46.19 44.81 1k0g s LEU 214 CO 0.24 0.17 -0.18 0.00 -1.32 0.00 0.00 176.35 175.25 1k0g s ALA 215 N 0.35 1.88 0.19 5.97 0.00 -1.26 -2.50 121.76 126.39 1k0g s ALA 215 Ca -0.06 -1.40 0.06 0.00 0.00 0.00 0.00 51.96 50.56 1k0g s ALA 215 Cb -0.15 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 1k0g s ALA 215 CO 0.04 0.25 0.08 1.14 0.00 0.00 0.00 175.76 177.27 1k0g s GLN 216 N -2.54 2.68 -0.26 0.00 -2.07 0.48 -4.86 119.66 113.08 1k0g s GLN 216 Ca 0.12 -1.02 -0.07 0.00 -1.82 0.00 0.00 55.36 52.57 1k0g s GLN 216 Cb -0.07 -2.49 -0.02 0.00 -1.09 0.00 0.00 33.01 29.34 1k0g s GLN 216 CO 0.06 0.45 0.07 0.50 -1.32 0.00 0.00 175.29 175.05 1k0g s ARG 217 N -3.19 3.50 -0.04 9.60 3.52 -1.26 0.68 118.95 131.76 1k0g s ARG 217 Ca 0.30 -0.58 -0.03 0.00 -0.13 0.00 0.00 55.73 55.29 1k0g s ARG 217 Cb -0.09 -3.34 -0.04 0.00 -1.56 0.00 0.00 34.95 29.92 1k0g s ARG 217 CO 0.22 -0.26 0.13 -0.06 -0.81 0.00 0.00 175.30 174.51 1k0g s PHE 218 N 1.58 3.45 0.02 5.12 0.08 -0.04 -0.02 117.98 128.17 1k0g s PHE 218 Ca 0.05 0.34 0.00 0.00 0.12 0.00 0.00 56.93 57.45 1k0g s PHE 218 Cb -0.16 -1.83 -0.02 0.00 -0.57 0.00 0.00 43.02 40.45 1k0g s PHE 218 CO 0.03 0.63 -0.03 -1.58 -0.10 0.00 0.00 175.22 174.17 1k0g s HIS 219 N -1.17 0.24 0.29 0.36 5.65 -0.33 -0.76 115.29 119.56 1k0g s HIS 219 Ca 0.22 -0.46 -0.14 0.00 0.25 0.00 0.00 55.06 54.92 1k0g s HIS 219 Cb -0.12 -0.17 0.01 0.00 -1.18 0.00 0.00 32.58 31.12 1k0g s HIS 219 CO 0.12 -0.16 0.59 0.00 -0.65 0.00 0.00 174.74 174.64 1k0g s ALA 220 N -1.27 -0.45 0.08 1.58 0.00 0.04 0.82 121.76 122.55 1k0g s ALA 220 Ca -0.14 -0.79 -0.07 0.00 0.00 0.00 0.00 51.96 50.96 1k0g s ALA 220 Cb -0.09 0.96 -0.05 0.00 0.00 0.00 0.00 23.12 23.94 1k0g s ALA 220 CO -0.01 -0.92 0.34 0.99 0.00 0.00 0.00 175.76 176.17 1k0g s THR 221 N -3.59 5.20 0.11 0.00 2.01 -1.26 -0.44 115.64 117.66 1k0g s THR 221 Ca 0.19 0.19 -0.06 0.00 0.31 0.00 0.00 61.69 62.33 1k0g s THR 221 Cb -0.03 -3.61 -0.02 0.00 0.01 0.00 0.00 72.50 68.85 1k0g s THR 221 CO 0.10 0.23 0.15 -0.72 -0.69 0.00 0.00 174.62 173.70 1k0g s TYR 222 N -1.45 0.40 0.12 4.92 1.13 0.22 0.71 117.35 123.40 1k0g s TYR 222 Ca 0.34 -0.83 0.07 0.00 -1.41 0.00 0.00 57.07 55.24 1k0g s TYR 222 Cb -0.13 -0.19 -0.04 0.00 -1.10 0.00 0.00 41.96 40.51 1k0g s TYR 222 CO 0.20 -0.56 -0.18 -1.54 -2.51 0.00 0.00 175.55 170.96 1k0g s SER 223 N -2.93 2.32 0.00 -0.18 1.04 0.50 -4.47 113.70 109.99 1k0g s SER 223 Ca 0.12 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 55.81 1k0g s SER 223 Cb 0.05 -0.11 0.00 0.00 0.10 0.00 0.00 66.02 66.06 1k0g s SER 223 CO -0.06 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 174.74 1k0g n GLY 224 N 0.81 -1.14 3.60 7.32 0.00 -1.26 0.20 105.19 114.72 1k0g n GLY 224 Ca -0.17 -1.92 -0.39 0.00 0.00 0.00 0.00 46.02 43.54 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 -4.00 6.20 0.51 1.61 2.15 0.21 -4.90 116.67 118.45 1k0g s ASP 225 Ca 0.00 0.18 0.17 0.00 0.43 0.00 0.00 52.55 53.33 1k0g s ASP 225 Cb 0.00 -2.19 1.27 0.00 -0.30 0.00 0.00 42.92 41.69 1k0g s ASP 225 CO 0.00 -0.18 2.12 -0.33 -0.17 0.00 0.00 175.17 176.62 1k0g h GLU 226 N 8.24 0.00 -0.55 4.34 3.07 -1.92 -1.76 114.58 126.01 1k0g h GLU 226 Ca -0.32 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 58.56 1k0g h GLU 226 Cb 1.16 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.05 1k0g h GLU 226 CO 0.63 0.04 0.36 2.35 -1.40 0.00 0.00 179.01 181.00 1k0g h TRP 227 N 0.00 0.64 -0.14 4.33 2.91 -1.93 -1.62 115.95 120.14 1k0g h TRP 227 Ca -0.00 0.02 -0.15 0.00 1.13 0.00 0.00 58.89 59.89 1k0g h TRP 227 Cb 0.08 -0.22 -0.01 0.00 -0.51 0.00 0.00 29.16 28.50 1k0g h TRP 227 CO 0.00 0.39 -0.53 1.96 -1.03 0.00 0.00 178.44 179.22 1k0g h GLN 228 N 0.68 0.41 -0.43 2.65 1.08 -1.62 -1.38 115.11 116.50 1k0g h GLN 228 Ca 0.21 -0.25 -0.08 0.00 -1.45 0.00 0.00 58.65 57.08 1k0g h GLN 228 Cb 0.02 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.46 1k0g h GLN 228 CO -0.05 0.84 -0.05 0.00 -0.95 0.00 0.00 178.83 178.62 1k0g h ALA 229 N 1.11 0.58 -0.53 3.87 0.00 -1.51 -1.98 119.26 120.81 1k0g h ALA 229 Ca 0.01 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 1k0g h ALA 229 Cb 1.04 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1k0g h ALA 229 CO 0.09 0.41 0.18 0.35 0.00 0.00 0.00 179.25 180.29 1k0g h PHE 230 N 0.61 0.83 -0.80 0.00 3.57 -1.05 0.44 116.94 120.55 1k0g h PHE 230 Ca 0.11 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 1k0g h PHE 230 Cb 0.56 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.01 1k0g h PHE 230 CO 0.04 0.70 0.48 -0.07 -2.23 0.00 0.00 178.31 177.24 1k0g h LEU 231 N 0.72 0.96 -0.90 0.59 3.38 -1.07 0.82 115.31 119.82 1k0g h LEU 231 Ca 0.17 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 1k0g h LEU 231 Cb 0.25 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1k0g h LEU 231 CO -0.01 0.74 -0.10 1.56 0.09 0.00 0.00 178.44 180.72 1k0g h GLN 232 N 1.09 0.70 0.00 1.13 4.20 -1.09 -2.81 115.11 118.34 1k0g h GLN 232 Ca 0.29 -0.22 -0.15 0.00 0.06 0.00 0.00 58.65 58.63 1k0g h GLN 232 Cb -0.04 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 1k0g h GLN 232 CO -0.05 0.79 -0.76 -0.07 -0.67 0.00 0.00 178.83 178.06 1k0g h LEU 233 N 0.64 0.00 -0.15 1.46 3.38 0.09 -3.10 115.31 117.64 1k0g h LEU 233 Ca 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1k0g h LEU 233 Cb 0.55 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1k0g h LEU 233 CO 0.03 0.66 0.05 -1.13 0.09 0.00 0.00 178.44 178.14 1k0g h ASN 234 N 0.00 0.21 -0.15 -0.43 -1.24 -0.71 0.48 115.58 113.74 1k0g h ASN 234 Ca -0.03 -0.20 0.01 0.00 0.71 0.00 0.00 56.30 56.80 1k0g h ASN 234 Cb 1.53 -0.06 -0.02 0.00 0.73 0.00 0.00 38.32 40.51 1k0g h ASN 234 CO 0.08 0.35 -0.09 1.67 -1.29 0.00 0.00 177.43 178.16 1k0g n GLN 235 N -4.85 -0.07 -0.04 6.67 0.00 -1.07 -1.07 117.38 116.95 1k0g n GLN 235 Ca -0.05 1.03 0.03 0.00 -0.00 0.00 0.00 57.00 58.01 1k0g n GLN 235 Cb 0.14 -1.54 0.37 0.00 0.00 0.00 0.00 30.24 29.21 1k0g n GLN 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1k0g h ALA 236 N -0.73 1.61 0.00 1.69 0.00 -1.43 -3.28 119.26 117.12 1k0g h ALA 236 Ca 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1k0g h ALA 236 Cb 0.06 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1k0g h ALA 236 CO -0.14 0.34 -1.49 0.09 0.00 0.00 0.00 179.25 178.05 1k0g n ASN 237 N -4.43 0.41 -4.18 0.00 4.13 0.17 -4.98 115.26 106.37 1k0g n ASN 237 Ca 0.04 -0.12 -0.36 0.00 1.68 0.00 0.00 54.58 55.82 1k0g n ASN 237 Cb 0.08 1.34 -0.04 0.00 -1.54 0.00 0.00 39.78 39.63 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 -2.16 -2.40 -3.17 3.52 5.12 -0.24 -4.92 116.66 112.41 1k0g n ARG 238 Ca -0.01 0.29 -0.40 0.00 -1.93 0.00 0.00 57.85 55.81 1k0g n ARG 238 Cb 0.51 -4.97 -0.06 0.00 -1.16 0.00 0.00 32.46 26.78 1k0g n ARG 238 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1k0g s ALA 239 N -3.18 3.52 0.41 7.54 0.00 -1.26 -4.41 121.76 124.38 1k0g s ALA 239 Ca 0.72 -0.28 0.40 0.00 0.00 0.00 0.00 51.96 52.79 1k0g s ALA 239 Cb -0.40 -2.89 2.00 0.00 0.00 0.00 0.00 23.12 21.83 1k0g s ALA 239 CO 0.88 -0.44 2.20 -1.00 0.00 0.00 0.00 175.76 177.40 1k0g h PRO 240 N 7.36 0.00 -0.73 0.00 0.13 -1.70 -2.92 132.00 134.13 1k0g h PRO 240 Ca -0.34 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.26 1k0g h PRO 240 Cb 1.15 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.89 1k0g h PRO 240 CO 0.76 0.00 -0.63 1.19 -0.23 0.00 0.00 178.00 179.09 1k0g n PHE 241 N -3.01 2.64 -1.71 1.56 3.72 -0.39 -4.24 117.46 116.04 1k0g n PHE 241 Ca -0.02 -2.26 -0.31 0.00 -0.05 0.00 0.00 57.45 54.81 1k0g n PHE 241 Cb 0.15 -0.45 0.04 0.00 -0.94 0.00 0.00 39.48 38.28 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 -3.40 5.54 -0.06 4.37 0.01 -0.57 -3.94 113.70 115.66 1k0g s SER 242 Ca 0.52 1.65 -0.30 0.00 1.31 0.00 0.00 55.95 59.12 1k0g s SER 242 Cb 0.42 -2.50 0.09 0.00 0.21 0.00 0.00 66.02 64.24 1k0g s SER 242 CO 0.03 -1.33 0.79 0.00 0.41 0.00 0.00 173.24 173.13 1k0g s ALA 243 N -2.92 -1.81 -0.11 1.44 0.00 0.01 -1.54 121.76 116.84 1k0g s ALA 243 Ca 0.59 1.30 0.00 0.00 0.00 0.00 0.00 51.96 53.85 1k0g s ALA 243 Cb -0.14 -0.10 0.02 0.00 0.00 0.00 0.00 23.12 22.90 1k0g s ALA 243 CO 0.51 -0.41 -0.10 0.12 0.00 0.00 0.00 175.76 175.88 1k0g s PHE 244 N -1.56 1.56 -0.14 0.00 5.36 0.64 -0.22 117.98 123.63 1k0g s PHE 244 Ca -0.06 -0.75 0.02 0.00 -0.96 0.00 0.00 56.93 55.18 1k0g s PHE 244 Cb -0.00 -1.24 0.02 0.00 -0.34 0.00 0.00 43.02 41.45 1k0g s PHE 244 CO 0.04 -0.48 -0.18 -0.51 -1.46 0.00 0.00 175.22 172.63 1k0g s LEU 245 N 1.43 1.92 -0.62 6.12 1.43 0.11 -1.52 118.68 127.55 1k0g s LEU 245 Ca 0.00 -0.54 -0.21 0.00 -1.03 0.00 0.00 54.13 52.35 1k0g s LEU 245 Cb -0.13 -1.30 0.08 0.00 0.03 0.00 0.00 46.19 44.87 1k0g s LEU 245 CO -0.06 0.02 0.85 -0.60 0.23 0.00 0.00 176.35 176.80 1k0g s ARG 246 N 1.09 3.11 0.43 1.70 6.06 -0.62 -1.14 118.95 129.58 1k0g s ARG 246 Ca -0.02 -0.95 0.02 0.00 -2.50 0.00 0.00 55.73 52.28 1k0g s ARG 246 Cb -0.14 -4.22 -0.00 0.00 0.06 0.00 0.00 34.95 30.65 1k0g s ARG 246 CO -0.06 -1.66 0.63 -0.51 -2.50 0.00 0.00 175.30 171.20 1k0g s LEU 247 N 3.51 3.69 0.40 -0.88 1.43 -0.39 0.16 118.68 126.60 1k0g s LEU 247 Ca 0.19 0.11 0.10 0.00 -1.03 0.00 0.00 54.13 53.50 1k0g s LEU 247 Cb -0.19 -3.01 0.82 0.00 0.03 0.00 0.00 46.19 43.84 1k0g s LEU 247 CO 0.10 -0.68 1.92 -0.33 0.23 0.00 0.00 176.35 177.59 1k0g h GLU 248 N 0.50 0.19 -0.33 1.70 5.08 -1.96 -3.18 114.58 116.58 1k0g h GLU 248 Ca -0.45 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1k0g h GLU 248 Cb 1.26 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1k0g h GLU 248 CO 0.55 0.34 0.00 1.04 -1.00 0.00 0.00 179.01 179.94 1k0g n GLN 249 N -4.28 2.40 -3.92 2.33 3.00 -1.26 -5.03 117.38 110.63 1k0g n GLN 249 Ca -0.01 -2.11 0.00 0.00 -0.01 0.00 0.00 57.00 54.87 1k0g n GLN 249 Cb 0.27 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.01 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 1.45 -1.94 3.34 1.08 0.00 -1.20 -4.82 105.19 103.09 1k0g n GLY 250 Ca 0.19 -1.28 -0.32 0.00 0.00 0.00 0.00 46.02 44.61 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 2.32 -0.24 4.61 0.00 0.20 -1.26 121.76 126.01 1k0g s ALA 251 Ca 0.00 -1.04 -0.07 0.00 0.00 0.00 0.00 51.96 50.86 1k0g s ALA 251 Cb 0.00 -0.76 -0.03 0.00 0.00 0.00 0.00 23.12 22.33 1k0g s ALA 251 CO 0.00 0.46 0.05 0.42 0.00 0.00 0.00 175.76 176.69 1k0g s ILE 252 N -0.36 4.21 -0.46 0.00 -1.09 -0.29 0.03 121.20 123.23 1k0g s ILE 252 Ca 0.03 -0.21 -0.06 0.00 -2.23 0.00 0.00 60.65 58.17 1k0g s ILE 252 Cb -0.12 -2.95 0.12 0.00 -1.58 0.00 0.00 42.46 37.93 1k0g s ILE 252 CO 0.02 0.37 0.30 -0.76 -1.23 0.00 0.00 174.94 173.64 1k0g s LEU 253 N 1.44 5.51 -0.19 2.97 1.02 -0.48 0.08 118.68 129.03 1k0g s LEU 253 Ca 0.05 -2.05 -0.05 0.00 0.02 0.00 0.00 54.13 52.11 1k0g s LEU 253 Cb -0.15 -1.93 -0.03 0.00 0.02 0.00 0.00 46.19 44.10 1k0g s LEU 253 CO 0.03 -0.61 0.00 -0.55 0.02 0.00 0.00 176.35 175.24 1k0g s SER 254 N 2.18 4.94 -0.38 2.29 0.15 0.70 0.24 113.70 123.83 1k0g s SER 254 Ca 0.08 -0.14 0.05 0.00 0.70 0.00 0.00 55.95 56.64 1k0g s SER 254 Cb -0.24 -1.84 0.45 0.00 -1.71 0.00 0.00 66.02 62.68 1k0g s SER 254 CO -0.03 0.10 1.31 0.18 1.20 0.00 0.00 173.24 176.01 1k0g n LEU 255 N 3.99 5.33 -4.72 3.45 7.99 0.19 -0.81 117.00 132.43 1k0g n LEU 255 Ca -0.17 -4.78 -0.42 0.00 -0.01 0.00 0.00 56.01 50.63 1k0g n LEU 255 Cb 0.52 -0.47 -0.03 0.00 -0.11 0.00 0.00 43.42 43.33 1k0g n LEU 255 CO 0.32 2.04 0.98 -0.55 -1.51 0.00 0.00 177.39 178.68 1k0g s SER 256 N -3.28 6.94 0.00 -1.43 0.15 -1.25 -4.72 113.70 110.10 1k0g s SER 256 Ca 0.52 2.20 0.21 0.00 0.70 0.00 0.00 55.95 59.58 1k0g s SER 256 Cb 0.42 -2.58 0.88 0.00 -1.71 0.00 0.00 66.02 63.03 1k0g s SER 256 CO -0.02 -0.57 1.62 -0.81 1.20 0.00 0.00 173.24 174.66 1k0g n PRO 257 N 3.85 1.54 -4.16 5.44 -0.04 -1.26 -1.26 135.00 139.12 1k0g n PRO 257 Ca 0.10 -0.81 -0.34 0.00 -0.04 0.00 0.00 63.50 62.40 1k0g n PRO 257 Cb 0.44 -1.38 -0.14 0.00 -0.04 0.00 0.00 33.50 32.38 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 -1.86 3.37 0.46 0.54 0.41 -1.26 -4.54 118.70 115.82 1k0g s GLU 258 Ca 0.32 -0.65 -0.22 0.00 -0.41 0.00 0.00 54.97 54.01 1k0g s GLU 258 Cb 0.17 -2.88 -0.08 0.00 -1.78 0.00 0.00 34.13 29.56 1k0g s GLU 258 CO 0.26 -0.07 1.10 0.50 -0.49 0.00 0.00 175.26 176.56 1k0g s ARG 259 N 1.13 3.81 0.00 1.61 3.52 -1.26 -0.36 118.95 127.40 1k0g s ARG 259 Ca 0.01 1.60 0.00 0.00 -0.13 0.00 0.00 55.73 57.21 1k0g s ARG 259 Cb -0.14 -2.32 0.00 0.00 -1.56 0.00 0.00 34.95 30.93 1k0g s ARG 259 CO -0.02 -0.46 0.00 0.34 -0.81 0.00 0.00 175.30 174.35 1k0g n PHE 260 N -0.60 0.00 -4.10 5.12 7.35 0.18 -4.48 117.46 120.94 1k0g n PHE 260 Ca 0.08 0.00 -0.19 0.00 -0.76 0.00 0.00 57.45 56.57 1k0g n PHE 260 Cb 0.50 0.00 -0.16 0.00 0.35 0.00 0.00 39.48 40.16 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 -0.60 0.46 -0.09 -2.13 1.01 -1.23 -4.40 121.20 114.22 1k0g s ILE 261 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.58 1k0g s ILE 261 Cb 0.00 -0.50 -0.03 0.00 0.01 0.00 0.00 42.46 41.94 1k0g s ILE 261 CO 0.00 0.21 -0.08 -0.22 0.00 0.00 0.00 174.94 174.85 1k0g s LEU 262 N 0.98 3.07 -0.19 2.97 2.96 0.01 -1.92 118.68 126.57 1k0g s LEU 262 Ca -0.10 -0.11 -0.02 0.00 -0.22 0.00 0.00 54.13 53.68 1k0g s LEU 262 Cb -0.14 -1.68 0.06 0.00 0.50 0.00 0.00 46.19 44.92 1k0g s LEU 262 CO -0.00 0.29 0.02 0.00 -1.32 0.00 0.00 176.35 175.34 1k0g s ASP 264 N 1.82 3.59 -1.48 0.00 -1.08 -0.58 0.27 116.67 119.21 1k0g s ASP 264 Ca -0.01 -1.17 -0.12 0.00 -0.52 0.00 0.00 52.55 50.73 1k0g s ASP 264 Cb -0.17 -0.94 0.07 0.00 -1.46 0.00 0.00 42.92 40.42 1k0g s ASP 264 CO -0.08 -0.30 1.00 -3.20 0.52 0.00 0.00 175.17 173.12 1k0g n ASN 265 N 4.82 -4.78 0.00 -0.34 5.15 -1.26 -2.00 115.26 116.84 1k0g n ASN 265 Ca -0.09 -0.74 0.00 0.00 -0.60 0.00 0.00 54.58 53.16 1k0g n ASN 265 Cb 0.45 -4.11 0.00 0.00 -0.53 0.00 0.00 39.78 35.58 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 -2.89 0.00 -4.64 1.20 7.64 -1.26 -4.98 113.62 108.69 1k0g n SER 266 Ca 0.01 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.47 1k0g n SER 266 Cb 0.54 -0.65 -0.04 0.00 -1.01 0.00 0.00 64.21 63.06 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 -0.16 4.13 -0.07 1.43 2.12 -0.85 0.35 118.70 125.65 1k0g s GLU 267 Ca 0.00 0.94 -0.20 0.00 0.36 0.00 0.00 54.97 56.07 1k0g s GLU 267 Cb 0.00 -3.67 -0.04 0.00 0.26 0.00 0.00 34.13 30.67 1k0g s GLU 267 CO 0.00 -0.61 0.58 0.42 -0.54 0.00 0.00 175.26 175.11 1k0g s ILE 268 N 3.01 5.07 0.04 -3.70 1.01 0.27 -1.52 121.20 125.38 1k0g s ILE 268 Ca 0.37 1.18 0.01 0.00 0.00 0.00 0.00 60.65 62.21 1k0g s ILE 268 Cb -0.15 -3.92 -0.03 0.00 0.01 0.00 0.00 42.46 38.38 1k0g s ILE 268 CO 0.09 0.33 -0.06 -1.10 0.00 0.00 0.00 174.94 174.20 1k0g s GLN 269 N 0.44 0.52 0.00 2.79 -0.21 0.28 -1.67 119.66 121.80 1k0g s GLN 269 Ca 0.31 -0.83 0.00 0.00 0.02 0.00 0.00 55.36 54.85 1k0g s GLN 269 Cb -0.17 -0.13 0.00 0.00 1.00 0.00 0.00 33.01 33.71 1k0g s GLN 269 CO 0.15 0.00 0.00 0.25 -2.12 0.00 0.00 175.29 173.57 1k0g n THR 270 N 1.18 0.00 -2.85 -0.19 -2.24 -0.80 -0.81 114.28 108.58 1k0g n THR 270 Ca -0.21 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.16 1k0g n THR 270 Cb 0.56 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.75 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 2.15 4.52 0.47 -0.78 3.52 -1.26 -4.70 118.95 122.87 1k0g s ARG 271 Ca 0.00 1.21 -0.24 0.00 -0.13 0.00 0.00 55.73 56.57 1k0g s ARG 271 Cb 0.00 -3.45 -0.08 0.00 -1.56 0.00 0.00 34.95 29.86 1k0g s ARG 271 CO 0.00 0.02 1.29 -2.30 -0.81 0.00 0.00 175.30 173.49 1k0g n PRO 272 N 3.76 1.83 0.09 5.12 -0.02 -1.26 -0.26 135.00 144.27 1k0g n PRO 272 Ca 0.03 0.66 -0.14 0.00 -2.02 0.00 0.00 63.50 62.02 1k0g n PRO 272 Cb 0.51 -2.44 -0.14 0.00 -0.02 0.00 0.00 33.50 31.41 1k0g n PRO 272 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1k0g h ILE 273 N 1.83 1.50 0.00 4.25 -0.00 0.58 -3.37 117.51 122.29 1k0g h ILE 273 Ca -0.49 -3.10 0.00 0.00 -0.00 0.00 0.00 64.86 61.27 1k0g h ILE 273 Cb 1.30 2.90 0.00 0.00 -0.00 0.00 0.00 36.82 41.02 1k0g h ILE 273 CO 0.59 0.90 0.00 0.29 -0.00 0.00 0.00 178.15 179.92 1k0g n LYS 274 N -3.48 0.00 0.00 2.19 5.02 -1.26 -5.03 118.16 115.60 1k0g n LYS 274 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 1k0g n LYS 274 Cb 1.01 -1.04 0.00 0.00 -0.02 0.00 0.00 35.03 34.98 1k0g n LYS 274 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k0g n GLY 275 N 1.55 -1.84 0.16 0.72 0.00 -1.26 -5.21 105.19 99.31 1k0g n GLY 275 Ca 0.00 0.89 -0.02 0.00 0.00 0.00 0.00 46.02 46.89 1k0g n GLY 275 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k0g n ALA 301 N 0.00 -2.11 -1.89 4.61 0.00 -1.26 -4.93 120.51 114.94 1k0g n ALA 301 Ca 0.00 -0.02 -0.41 0.00 0.00 0.00 0.00 53.44 53.01 1k0g n ALA 301 Cb 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 19.45 19.36 1k0g n ALA 301 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1k0g s GLU 302 N -0.08 4.29 0.29 0.00 -6.30 -1.26 -4.88 118.70 110.77 1k0g s GLU 302 Ca 0.03 2.26 0.26 0.00 -2.50 0.00 0.00 54.97 55.01 1k0g s GLU 302 Cb -0.02 -3.12 0.95 0.00 0.00 0.00 0.00 34.13 31.95 1k0g s GLU 302 CO 0.04 -0.38 1.76 -2.95 0.02 0.00 0.00 175.26 173.75 1k0g h ASN 303 N 4.99 0.00 -3.25 -1.70 7.08 -2.11 -3.45 115.58 117.15 1k0g h ASN 303 Ca -0.46 0.00 -0.65 0.00 -3.08 0.00 0.00 56.30 52.12 1k0g h ASN 303 Cb 1.22 0.00 -0.10 0.00 -2.08 0.00 0.00 38.32 37.35 1k0g h ASN 303 CO 0.77 0.00 -0.62 -0.76 -2.08 0.00 0.00 177.43 174.74 1k0g s LEU 304 N -4.82 3.68 -0.05 6.14 1.43 -1.26 -5.11 118.68 118.70 1k0g s LEU 304 Ca 0.06 -0.06 0.03 0.00 -1.03 0.00 0.00 54.13 53.13 1k0g s LEU 304 Cb 0.10 -2.35 0.00 0.00 0.03 0.00 0.00 46.19 43.97 1k0g s LEU 304 CO 0.48 0.19 -0.13 -0.32 0.23 0.00 0.00 176.35 176.79 1k0g s MET 305 N -2.27 1.53 -0.21 1.70 -2.45 -1.26 -5.11 119.30 111.22 1k0g s MET 305 Ca 0.27 -0.46 -0.05 0.00 -1.25 0.00 0.00 55.69 54.20 1k0g s MET 305 Cb -0.12 -1.32 -0.02 0.00 1.25 0.00 0.00 34.83 34.62 1k0g s MET 305 CO 0.20 0.14 -0.01 0.42 1.05 0.00 0.00 175.02 176.81 1k0g s ILE 306 N 0.28 3.78 -0.04 10.11 1.01 -1.26 -5.09 121.20 129.99 1k0g s ILE 306 Ca -0.07 -0.37 0.06 0.00 0.00 0.00 0.00 60.65 60.27 1k0g s ILE 306 Cb -0.12 -2.72 -0.01 0.00 0.01 0.00 0.00 42.46 39.62 1k0g s ILE 306 CO 0.02 0.42 -0.23 -0.69 0.00 0.00 0.00 174.94 174.46 1k0g s VAL 307 N 1.20 1.84 -0.22 2.92 1.01 -1.26 -5.09 120.40 120.80 1k0g s VAL 307 Ca 0.03 -0.97 -0.16 0.00 0.00 0.00 0.00 61.98 60.88 1k0g s VAL 307 Cb -0.15 -1.55 -0.04 0.00 0.00 0.00 0.00 36.38 34.65 1k0g s VAL 307 CO 0.01 0.52 0.42 -0.62 0.00 0.00 0.00 175.10 175.42 1k0g s ASP 308 N -0.28 6.42 0.00 3.32 -1.08 -1.26 -4.97 116.67 118.83 1k0g s ASP 308 Ca 0.02 0.50 0.12 0.00 -0.52 0.00 0.00 52.55 52.67 1k0g s ASP 308 Cb -0.11 -2.24 0.57 0.00 -1.46 0.00 0.00 42.92 39.68 1k0g s ASP 308 CO 0.01 -0.12 1.35 0.18 0.52 0.00 0.00 175.17 177.11 1k0g n LEU 309 N 4.73 0.00 -0.45 -1.34 4.77 -1.26 -1.17 117.00 122.27 1k0g n LEU 309 Ca -0.08 0.40 0.06 0.00 -0.03 0.00 0.00 56.01 56.37 1k0g n LEU 309 Cb 0.51 -0.40 0.04 0.00 -2.33 0.00 0.00 43.42 41.24 1k0g n LEU 309 CO 0.40 -0.23 0.39 0.23 -1.33 0.00 0.00 177.39 176.84 1k0g n MET 310 N -1.40 1.18 -0.04 3.23 2.81 -1.26 -4.26 117.12 117.39 1k0g n MET 310 Ca 0.04 -1.10 -0.10 0.00 -1.81 0.00 0.00 57.70 54.74 1k0g n MET 310 Cb 0.12 -1.22 -0.03 0.00 -0.71 0.00 0.00 33.22 31.37 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 2.22 0.19 -0.43 0.03 9.65 -1.56 0.79 114.38 125.27 1k0g h ARG 311 Ca 0.00 -0.01 -0.02 0.00 -1.10 0.00 0.00 59.98 58.85 1k0g h ARG 311 Cb 0.51 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.03 1k0g h ARG 311 CO 0.00 0.13 0.19 -0.97 2.80 0.00 0.00 179.97 182.11 1k0g h ASN 312 N 0.20 0.58 -0.20 -3.80 -0.73 -1.86 0.29 115.58 110.05 1k0g h ASN 312 Ca 0.07 -0.15 0.00 0.00 1.87 0.00 0.00 56.30 58.10 1k0g h ASN 312 Cb 0.01 -0.15 -0.01 0.00 0.27 0.00 0.00 38.32 38.44 1k0g h ASN 312 CO -0.05 0.57 0.13 0.44 -0.37 0.00 0.00 177.43 178.15 1k0g h ASP 313 N 0.55 0.22 -0.34 1.15 3.32 -1.81 -0.78 116.42 118.73 1k0g h ASP 313 Ca 0.15 -0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.10 1k0g h ASP 313 Cb 0.16 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 1k0g h ASP 313 CO -0.01 0.16 -0.09 0.40 -1.72 0.00 0.00 179.24 177.97 1k0g h ILE 314 N 0.27 1.25 0.00 0.35 1.08 0.93 -2.46 117.51 118.92 1k0g h ILE 314 Ca 0.08 -1.13 -0.01 0.00 -0.39 0.00 0.00 64.86 63.40 1k0g h ILE 314 Cb -0.02 1.02 -0.00 0.00 -3.07 0.00 0.00 36.82 34.74 1k0g h ILE 314 CO -0.02 0.39 -0.06 1.23 -0.69 0.00 0.00 178.15 179.00 1k0g h GLY 315 N 0.97 0.00 2.00 5.37 0.00 -0.76 0.78 103.07 111.43 1k0g h GLY 315 Ca 0.12 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.41 1k0g h GLY 315 CO 0.03 0.00 -0.18 -0.09 0.00 0.00 0.00 176.54 176.30 1k0g h ARG 316 N 0.00 0.00 0.00 4.80 2.43 -0.64 -3.29 114.38 117.67 1k0g h ARG 316 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1k0g h ARG 316 Cb 0.11 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1k0g h ARG 316 CO 0.01 0.18 -1.13 1.33 -1.51 0.00 0.00 179.97 178.84 1k0g n VAL 317 N -3.24 0.00 -1.74 0.20 0.24 -0.50 -5.03 118.33 108.27 1k0g n VAL 317 Ca 0.01 -0.17 -0.30 0.00 -2.04 0.00 0.00 64.34 61.84 1k0g n VAL 317 Cb 0.48 0.45 0.08 0.00 -1.47 0.00 0.00 33.84 33.39 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 -2.30 2.47 0.24 2.33 0.00 0.15 -4.39 121.76 120.26 1k0g s ALA 318 Ca -0.02 -0.40 -0.31 0.00 0.00 0.00 0.00 51.96 51.23 1k0g s ALA 318 Cb 0.04 -3.04 -0.12 0.00 0.00 0.00 0.00 23.12 20.01 1k0g s ALA 318 CO 0.26 -1.62 1.66 0.08 0.00 0.00 0.00 175.76 176.14 1k0g s VAL 319 N -3.34 2.08 0.22 0.00 1.01 -0.22 -4.83 120.40 115.34 1k0g s VAL 319 Ca 0.61 0.06 -0.31 0.00 0.00 0.00 0.00 61.98 62.34 1k0g s VAL 319 Cb -0.13 -3.04 -0.14 0.00 0.00 0.00 0.00 36.38 33.07 1k0g s VAL 319 CO 0.52 0.01 1.31 0.00 0.00 0.00 0.00 175.10 176.94 1k0g n ALA 320 N 3.29 0.47 -0.80 5.51 0.00 -1.26 -0.07 120.51 127.65 1k0g n ALA 320 Ca 0.13 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.99 1k0g n ALA 320 Cb 0.36 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.63 1k0g n ALA 320 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k0g n GLY 321 N 2.03 1.19 0.69 0.00 0.00 -1.26 -4.89 105.19 102.94 1k0g n GLY 321 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.27 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 2.13 -4.73 1.61 3.41 0.90 -4.91 113.62 112.03 1k0g n SER 322 Ca 0.00 -1.72 -0.41 0.00 -0.26 0.00 0.00 58.87 56.48 1k0g n SER 322 Cb 0.00 -0.03 -0.04 0.00 -0.26 0.00 0.00 64.21 63.87 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 -1.93 4.44 0.06 -3.33 1.01 -1.26 -4.15 120.40 115.25 1k0g s VAL 323 Ca 0.34 2.01 0.07 0.00 0.00 0.00 0.00 61.98 64.40 1k0g s VAL 323 Cb 0.20 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 32.27 1k0g s VAL 323 CO 0.31 0.30 -0.19 -0.54 0.00 0.00 0.00 175.10 174.98 1k0g s LYS 324 N 0.04 1.18 0.05 2.72 -0.14 0.41 -4.96 119.74 119.03 1k0g s LYS 324 Ca 0.48 -0.97 0.02 0.00 -1.36 0.00 0.00 55.97 54.13 1k0g s LYS 324 Cb -0.24 -1.31 -0.03 0.00 -1.68 0.00 0.00 37.83 34.57 1k0g s LYS 324 CO 0.30 0.32 -0.07 0.14 -0.76 0.00 0.00 175.35 175.29 1k0g s VAL 325 N -0.95 0.49 0.81 3.17 -7.23 -1.26 -0.86 120.40 114.56 1k0g s VAL 325 Ca 0.05 -1.21 -0.11 0.00 -1.81 0.00 0.00 61.98 58.91 1k0g s VAL 325 Cb -0.09 -0.75 0.08 0.00 0.56 0.00 0.00 36.38 36.18 1k0g s VAL 325 CO 0.02 -0.49 1.09 -2.16 -0.31 0.00 0.00 175.10 173.25 1k0g s PRO 326 N -1.98 1.94 0.11 4.82 0.04 -1.26 -5.01 135.00 133.67 1k0g s PRO 326 Ca -0.07 1.11 -0.31 0.00 0.04 0.00 0.00 61.00 61.78 1k0g s PRO 326 Cb -0.07 -1.87 -0.07 0.00 0.04 0.00 0.00 34.50 32.53 1k0g s PRO 326 CO -0.01 -1.85 1.33 -2.00 0.04 0.00 0.00 177.00 174.52 1k0g s GLU 327 N -4.89 4.36 -0.63 4.56 2.56 -1.26 -5.16 118.70 118.24 1k0g s GLU 327 Ca 0.62 2.00 0.05 0.00 0.00 0.00 0.00 54.97 57.63 1k0g s GLU 327 Cb -0.18 -3.27 0.32 0.00 2.00 0.00 0.00 34.13 33.01 1k0g s GLU 327 CO 0.56 -0.37 0.98 1.28 -0.56 0.00 0.00 175.26 177.15 1k0g n LEU 328 N 3.78 4.59 -0.34 2.70 4.77 -1.26 -5.27 117.00 125.97 1k0g n LEU 328 Ca 0.10 -5.62 0.00 0.00 -0.03 0.00 0.00 56.01 50.46 1k0g n LEU 328 Cb 0.43 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 1k0g n LEU 328 CO 0.58 2.28 0.00 0.18 -1.33 0.00 0.00 177.39 179.10 1k0g n LEU 340 N -0.03 -0.85 -0.00 2.23 4.77 -1.26 -5.19 117.00 116.68 1k0g n LEU 340 Ca 0.32 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.36 1k0g n LEU 340 Cb 0.38 -0.42 -0.08 0.00 -2.33 0.00 0.00 43.42 40.97 1k0g n LEU 340 CO 0.37 0.00 -0.26 0.52 -1.33 0.00 0.00 177.39 176.69 1k0g n VAL 341 N 1.73 0.00 -4.32 4.08 0.31 -1.26 -4.98 118.33 113.89 1k0g n VAL 341 Ca 0.00 -0.24 -0.17 0.00 -0.01 0.00 0.00 64.34 63.92 1k0g n VAL 341 Cb 0.00 0.70 -0.10 0.00 -0.91 0.00 0.00 33.84 33.53 1k0g n VAL 341 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1k0g s SER 342 N -2.69 2.26 0.48 4.52 0.15 -1.26 0.12 113.70 117.27 1k0g s SER 342 Ca 0.01 -1.05 0.22 0.00 0.70 0.00 0.00 55.95 55.84 1k0g s SER 342 Cb 0.09 -0.08 1.20 0.00 -1.71 0.00 0.00 66.02 65.52 1k0g s SER 342 CO 0.53 -0.26 2.00 0.71 1.20 0.00 0.00 173.24 177.42 1k0g h THR 343 N 2.61 0.80 -3.48 6.45 1.35 -0.91 -3.41 112.91 116.32 1k0g h THR 343 Ca -0.38 -0.72 -0.41 0.00 -0.55 0.00 0.00 66.41 64.36 1k0g h THR 343 Cb 1.21 1.43 -0.34 0.00 -1.73 0.00 0.00 68.15 68.72 1k0g h THR 343 CO 0.63 0.18 -0.77 -0.63 -0.25 0.00 0.00 175.52 174.68 1k0g s ILE 344 N -4.25 0.56 0.01 6.82 1.01 -1.26 -4.15 121.20 119.95 1k0g s ILE 344 Ca -0.03 -0.15 0.07 0.00 0.00 0.00 0.00 60.65 60.54 1k0g s ILE 344 Cb 0.14 -0.58 -0.02 0.00 0.01 0.00 0.00 42.46 42.01 1k0g s ILE 344 CO 0.63 0.23 -0.21 -0.89 0.00 0.00 0.00 174.94 174.70 1k0g s THR 345 N 0.83 1.66 0.38 2.92 2.01 -0.04 -1.91 115.64 121.49 1k0g s THR 345 Ca -0.12 -1.04 -0.15 0.00 0.31 0.00 0.00 61.69 60.69 1k0g s THR 345 Cb -0.14 -1.41 0.05 0.00 0.01 0.00 0.00 72.50 71.01 1k0g s THR 345 CO 0.01 0.34 0.77 0.00 -0.69 0.00 0.00 174.62 175.04 1k0g s ALA 346 N -0.64 -0.68 -0.06 7.40 0.00 -0.67 0.15 121.76 127.26 1k0g s ALA 346 Ca 0.08 -0.77 0.04 0.00 0.00 0.00 0.00 51.96 51.31 1k0g s ALA 346 Cb -0.08 0.71 -0.02 0.00 0.00 0.00 0.00 23.12 23.72 1k0g s ALA 346 CO 0.01 -0.98 -0.18 -0.65 0.00 0.00 0.00 175.76 173.95 1k0g s GLN 347 N -2.41 2.55 -0.06 0.00 -1.52 -1.26 -0.56 119.66 116.40 1k0g s GLN 347 Ca 0.16 -0.78 -0.30 0.00 -1.95 0.00 0.00 55.36 52.49 1k0g s GLN 347 Cb -0.05 -2.31 -0.03 0.00 -0.22 0.00 0.00 33.01 30.41 1k0g s GLN 347 CO 0.12 0.51 1.12 -1.17 -0.25 0.00 0.00 175.29 175.62 1k0g s LEU 348 N -0.46 4.28 0.61 2.90 2.96 0.15 -1.05 118.68 128.07 1k0g s LEU 348 Ca 0.05 1.72 -0.20 0.00 -0.22 0.00 0.00 54.13 55.49 1k0g s LEU 348 Cb -0.12 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 42.99 1k0g s LEU 348 CO 0.01 -0.51 1.32 -2.65 -1.32 0.00 0.00 176.35 173.21 1k0g n PRO 349 N 4.95 1.36 -0.19 0.98 -0.02 -1.26 -4.85 135.00 135.96 1k0g n PRO 349 Ca 0.10 0.52 0.14 0.00 -2.02 0.00 0.00 63.50 62.23 1k0g n PRO 349 Cb 0.47 -2.55 0.46 0.00 -0.02 0.00 0.00 33.50 31.86 1k0g n PRO 349 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1k0g h GLU 350 N 0.90 0.50 -0.00 -0.52 3.07 -1.99 -2.24 114.58 114.30 1k0g h GLU 350 Ca -0.51 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.32 1k0g h GLU 350 Cb 1.33 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 29.12 1k0g h GLU 350 CO 0.55 0.33 -0.13 1.04 -1.40 0.00 0.00 179.01 179.40 1k0g n GLN 351 N -4.50 0.43 -3.72 2.33 3.00 -1.26 -4.88 117.38 108.78 1k0g n GLN 351 Ca 0.15 -0.13 -0.28 0.00 -0.01 0.00 0.00 57.00 56.72 1k0g n GLN 351 Cb 0.49 -1.50 -0.03 0.00 0.00 0.00 0.00 30.24 29.20 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 -2.66 4.25 0.35 1.08 1.43 -0.84 -5.12 118.68 117.16 1k0g s LEU 352 Ca 0.23 0.42 0.07 0.00 -1.03 0.00 0.00 54.13 53.82 1k0g s LEU 352 Cb 0.19 -3.17 -0.01 0.00 0.03 0.00 0.00 46.19 43.23 1k0g s LEU 352 CO 0.52 -0.01 0.43 -1.00 0.23 0.00 0.00 176.35 176.52 1k0g s HIS 353 N -1.80 3.00 0.40 0.29 3.76 -1.26 -4.86 115.29 114.83 1k0g s HIS 353 Ca 0.39 -0.28 0.07 0.00 -0.15 0.00 0.00 55.06 55.08 1k0g s HIS 353 Cb -0.11 -2.01 0.84 0.00 1.11 0.00 0.00 32.58 32.41 1k0g s HIS 353 CO 0.28 -0.02 2.06 0.00 -0.85 0.00 0.00 174.74 176.20 1k0g h ALA 354 N 0.95 1.69 0.00 -1.40 0.00 -1.97 0.12 119.26 118.65 1k0g h ALA 354 Ca -0.44 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1k0g h ALA 354 Cb 1.26 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1k0g h ALA 354 CO 0.53 0.29 0.00 0.66 0.00 0.00 0.00 179.25 180.73 1k0g h SER 355 N 0.58 0.00 -0.37 0.00 4.64 -1.93 -0.72 113.55 115.76 1k0g h SER 355 Ca 0.16 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.31 1k0g h SER 355 Cb -0.07 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.02 1k0g h SER 355 CO -0.03 0.00 -0.41 0.44 -0.87 0.00 0.00 176.83 175.95 1k0g h ASP 356 N 0.00 1.01 -0.63 4.97 3.32 -1.14 -1.38 116.42 122.57 1k0g h ASP 356 Ca 0.00 -0.47 -0.06 0.00 0.02 0.00 0.00 57.03 56.52 1k0g h ASP 356 Cb 0.35 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 1k0g h ASP 356 CO 0.00 1.28 0.18 0.25 -1.72 0.00 0.00 179.24 179.23 1k0g h LEU 357 N 0.76 0.95 -0.21 1.55 5.85 -0.99 -1.37 115.31 121.85 1k0g h LEU 357 Ca 0.05 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 1k0g h LEU 357 Cb 1.01 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 1k0g h LEU 357 CO 0.10 0.91 0.10 0.25 -0.34 0.00 0.00 178.44 179.45 1k0g h LEU 358 N 0.97 0.27 -0.21 2.25 5.85 -1.01 -2.54 115.31 120.89 1k0g h LEU 358 Ca 0.21 -0.13 0.05 0.00 0.84 0.00 0.00 57.88 58.86 1k0g h LEU 358 Cb 0.31 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.22 1k0g h LEU 358 CO -0.00 0.32 -0.15 -0.09 -0.34 0.00 0.00 178.44 178.18 1k0g h ARG 359 N 0.20 -0.14 0.00 1.25 2.43 -0.86 -1.82 114.38 115.44 1k0g h ARG 359 Ca 0.07 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1k0g h ARG 359 Cb 0.12 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1k0g h ARG 359 CO -0.01 -0.09 -0.00 0.00 -1.51 0.00 0.00 179.97 178.35 1k0g h ALA 360 N 0.99 1.38 -0.14 2.80 0.00 -0.98 -2.92 119.26 120.40 1k0g h ALA 360 Ca 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1k0g h ALA 360 Cb 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1k0g h ALA 360 CO -0.30 0.00 0.00 0.00 0.00 0.00 0.00 179.25 178.95 1k0g n ALA 361 N -2.26 2.40 -2.78 0.00 0.00 -0.74 -4.82 120.51 112.32 1k0g n ALA 361 Ca -0.03 -0.78 -0.36 0.00 0.00 0.00 0.00 53.44 52.28 1k0g n ALA 361 Cb 0.08 -0.50 -0.07 0.00 0.00 0.00 0.00 19.45 18.97 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 -1.12 3.49 0.71 0.00 5.36 -0.88 -3.31 117.98 122.22 1k0g s PHE 362 Ca 0.20 0.42 -0.11 0.00 -0.96 0.00 0.00 56.93 56.48 1k0g s PHE 362 Cb 0.13 -2.08 0.01 0.00 -0.34 0.00 0.00 43.02 40.74 1k0g s PHE 362 CO 0.18 0.46 1.10 -1.25 -1.46 0.00 0.00 175.22 174.25 1k0g s PRO 363 N -0.18 2.86 0.15 10.12 0.04 -1.26 -4.72 135.00 142.01 1k0g s PRO 363 Ca 0.11 0.47 -0.34 0.00 0.04 0.00 0.00 61.00 61.29 1k0g s PRO 363 Cb -0.11 -2.02 -0.13 0.00 0.04 0.00 0.00 34.50 32.27 1k0g s PRO 363 CO 0.01 -1.03 1.62 0.41 0.04 0.00 0.00 177.00 178.04 1k0g n GLY 364 N -2.99 1.20 0.35 0.56 0.00 -1.21 -4.87 105.19 98.24 1k0g n GLY 364 Ca 0.07 0.66 0.18 0.00 0.00 0.00 0.00 46.02 46.93 1k0g n GLY 364 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1k0g h GLY 365 N 6.28 0.00 2.00 -0.02 0.00 -1.74 -0.99 103.07 108.59 1k0g h GLY 365 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1k0g h GLY 365 CO 0.90 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 176.30 1k0g n SER 366 N -3.91 0.39 -0.25 0.19 3.41 -1.26 -1.83 113.62 110.36 1k0g n SER 366 Ca 0.03 0.56 0.08 0.00 -0.26 0.00 0.00 58.87 59.28 1k0g n SER 366 Cb 0.40 -0.65 0.14 0.00 -0.26 0.00 0.00 64.21 63.84 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 -1.89 1.81 0.01 -1.33 -6.64 -0.40 -4.77 119.36 106.15 1k0g n ILE 367 Ca 0.05 -1.96 -0.01 0.00 -1.77 0.00 0.00 62.75 59.07 1k0g n ILE 367 Cb 0.32 -0.11 -0.00 0.00 -1.44 0.00 0.00 39.64 38.41 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 -1.04 0.55 -1.23 7.28 -2.24 -1.08 -4.66 114.28 111.86 1k0g n THR 368 Ca 0.15 0.20 0.00 0.00 -2.27 0.00 0.00 64.05 62.13 1k0g n THR 368 Cb 0.63 -1.35 0.00 0.00 -2.10 0.00 0.00 70.33 67.51 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 3.19 0.52 3.03 3.38 0.00 -0.76 0.47 105.19 115.03 1k0g n GLY 369 Ca -0.01 -1.65 -0.13 0.00 0.00 0.00 0.00 46.02 44.24 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 -0.45 0.42 4.61 0.00 -0.88 -3.32 121.76 121.13 1k0g s ALA 370 Ca 0.00 0.73 -0.25 0.00 0.00 0.00 0.00 51.96 52.43 1k0g s ALA 370 Cb 0.00 -0.46 -0.08 0.00 0.00 0.00 0.00 23.12 22.58 1k0g s ALA 370 CO 0.00 -0.14 1.29 -1.25 0.00 0.00 0.00 175.76 175.66 1k0g s PRO 371 N 0.75 3.89 0.12 0.00 0.04 -1.26 -1.26 135.00 137.27 1k0g s PRO 371 Ca -0.05 2.13 -0.27 0.00 0.04 0.00 0.00 61.00 62.85 1k0g s PRO 371 Cb -0.07 -2.69 -0.07 0.00 0.04 0.00 0.00 34.50 31.71 1k0g s PRO 371 CO -0.04 -0.55 1.63 -0.22 0.04 0.00 0.00 177.00 177.86 1k0g h LYS 372 N 2.53 -0.43 -0.34 4.56 3.64 -1.94 0.35 116.57 124.93 1k0g h LYS 372 Ca -0.50 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 58.93 1k0g h LYS 372 Cb 1.25 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 33.14 1k0g h LYS 372 CO 0.62 -0.29 0.19 0.28 -2.27 0.00 0.00 179.45 177.98 1k0g h VAL 373 N -0.45 1.02 -0.41 2.00 2.07 -1.98 0.51 116.25 119.01 1k0g h VAL 373 Ca 0.04 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 67.46 1k0g h VAL 373 Cb 0.50 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1k0g h VAL 373 CO -0.19 0.07 0.21 -0.09 0.02 0.00 0.00 177.57 177.60 1k0g h ARG 374 N 0.39 0.42 -0.87 1.57 9.65 -1.89 0.33 114.38 123.99 1k0g h ARG 374 Ca 0.14 -0.03 0.03 0.00 -1.10 0.00 0.00 59.98 59.02 1k0g h ARG 374 Cb 0.02 -0.09 -0.05 0.00 -1.39 0.00 0.00 29.97 28.45 1k0g h ARG 374 CO -0.07 0.28 0.57 0.00 2.80 0.00 0.00 179.97 183.54 1k0g h ALA 375 N 1.21 1.44 -0.73 2.80 0.00 0.70 -0.68 119.26 123.99 1k0g h ALA 375 Ca 0.17 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1k0g h ALA 375 Cb 0.06 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1k0g h ALA 375 CO -0.11 0.48 0.29 0.52 0.00 0.00 0.00 179.25 180.43 1k0g h MET 376 N 1.10 1.09 -0.48 0.00 2.86 0.21 -0.57 114.93 119.14 1k0g h MET 376 Ca 0.34 -0.19 -0.03 0.00 -2.06 0.00 0.00 59.70 57.76 1k0g h MET 376 Cb -0.01 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.45 1k0g h MET 376 CO -0.09 0.89 0.19 0.93 1.06 0.00 0.00 176.91 179.89 1k0g h GLU 377 N 1.07 0.72 -0.09 1.72 5.08 0.95 -1.68 114.58 122.35 1k0g h GLU 377 Ca 0.25 -0.13 -0.10 0.00 -1.00 0.00 0.00 59.36 58.37 1k0g h GLU 377 Cb 0.21 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1k0g h GLU 377 CO -0.02 0.65 -0.39 0.82 -1.00 0.00 0.00 179.01 179.07 1k0g h ILE 378 N 0.64 1.30 -0.23 3.13 2.04 -0.51 0.18 117.51 124.06 1k0g h ILE 378 Ca 0.16 -1.46 0.02 0.00 1.00 0.00 0.00 64.86 64.59 1k0g h ILE 378 Cb 0.20 1.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.93 1k0g h ILE 378 CO -0.01 0.43 0.07 0.40 0.00 0.00 0.00 178.15 179.04 1k0g h ILE 379 N 0.16 0.93 0.00 -0.67 2.04 -0.89 -1.01 117.51 118.07 1k0g h ILE 379 Ca 0.02 -0.06 -0.06 0.00 1.00 0.00 0.00 64.86 65.75 1k0g h ILE 379 Cb 0.77 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 1k0g h ILE 379 CO 0.06 0.03 -0.30 -0.78 0.00 0.00 0.00 178.15 177.16 1k0g h ASP 380 N 0.17 0.00 -0.17 1.72 3.58 -0.95 0.44 116.42 121.21 1k0g h ASP 380 Ca 0.10 0.00 -0.20 0.00 0.42 0.00 0.00 57.03 57.35 1k0g h ASP 380 Cb 0.07 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.13 1k0g h ASP 380 CO -0.11 0.30 -0.68 -0.08 -2.88 0.00 0.00 179.24 175.79 1k0g h GLU 381 N 0.00 0.77 0.00 0.28 4.81 -0.61 -2.37 114.58 117.46 1k0g h GLU 381 Ca -0.00 -0.59 -0.37 0.00 -0.13 0.00 0.00 59.36 58.26 1k0g h GLU 381 Cb 0.79 0.11 -0.07 0.00 0.63 0.00 0.00 28.75 30.21 1k0g h GLU 381 CO 0.04 1.21 -2.40 1.28 -0.73 0.00 0.00 179.01 178.41 1k0g n LEU 382 N -4.01 0.49 -4.70 1.64 4.77 -0.41 -4.83 117.00 109.94 1k0g n LEU 382 Ca -0.07 -0.02 -0.42 0.00 -0.03 0.00 0.00 56.01 55.47 1k0g n LEU 382 Cb 0.70 0.27 -0.03 0.00 -2.33 0.00 0.00 43.42 42.03 1k0g n LEU 382 CO 0.51 0.57 0.85 -1.61 -1.33 0.00 0.00 177.39 176.38 1k0g s GLU 383 N -2.49 4.44 0.46 3.23 2.02 0.15 -4.91 118.70 121.59 1k0g s GLU 383 Ca -0.14 1.61 0.14 0.00 0.02 0.00 0.00 54.97 56.60 1k0g s GLU 383 Cb 0.06 -3.46 1.04 0.00 0.10 0.00 0.00 34.13 31.88 1k0g s GLU 383 CO 0.79 -0.27 2.03 -1.35 0.02 0.00 0.00 175.26 176.48 1k0g h PRO 384 N 7.04 0.07 -5.93 0.39 0.11 -1.88 -3.41 132.00 128.39 1k0g h PRO 384 Ca -0.38 -0.01 -0.55 0.00 0.11 0.00 0.00 66.00 65.17 1k0g h PRO 384 Cb 1.19 -0.01 -0.14 0.00 0.11 0.00 0.00 31.00 32.15 1k0g h PRO 384 CO 0.82 0.17 -0.74 -0.65 -0.21 0.00 0.00 178.00 177.39 1k0g s GLN 385 N -4.84 1.57 0.61 1.05 1.11 -1.26 0.06 119.66 117.96 1k0g s GLN 385 Ca -0.05 -1.72 -0.18 0.00 0.01 0.00 0.00 55.36 53.41 1k0g s GLN 385 Cb 0.16 -1.51 -0.03 0.00 -1.01 0.00 0.00 33.01 30.62 1k0g s GLN 385 CO 0.70 0.25 1.22 1.03 0.01 0.00 0.00 175.29 178.49 1k0g s ARG 386 N -3.58 2.88 0.36 2.91 0.52 0.78 -4.76 118.95 118.07 1k0g s ARG 386 Ca 0.28 1.84 0.19 0.00 -0.52 0.00 0.00 55.73 57.52 1k0g s ARG 386 Cb -0.02 -1.92 0.51 0.00 0.52 0.00 0.00 34.95 34.04 1k0g s ARG 386 CO 0.12 -1.28 1.65 0.00 0.02 0.00 0.00 175.30 175.81 1k0g h ARG 387 N 0.78 0.00 0.00 3.54 3.08 -1.91 -3.48 114.38 116.39 1k0g h ARG 387 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.55 1k0g h ARG 387 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.35 1k0g h ARG 387 CO 0.55 0.38 0.00 0.09 -1.07 0.00 0.00 179.97 179.91 1k0g n ASN 388 N -3.37 0.00 0.16 7.04 5.03 -1.26 -1.68 115.26 121.19 1k0g n ASN 388 Ca 0.01 0.00 0.13 0.00 0.87 0.00 0.00 54.58 55.59 1k0g n ASN 388 Cb 0.57 0.00 0.36 0.00 -1.02 0.00 0.00 39.78 39.70 1k0g n ASN 388 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1k0g h ALA 389 N -0.62 1.00 -2.58 5.41 0.00 -1.92 0.71 119.26 121.27 1k0g h ALA 389 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.39 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 0.49 -0.46 0.00 0.00 0.00 179.25 179.28 1k0g s TRP 390 N -3.21 3.55 -0.45 0.00 -0.00 -0.67 -2.70 118.94 115.45 1k0g s TRP 390 Ca 0.08 1.51 0.00 0.00 -0.00 0.00 0.00 56.10 57.69 1k0g s TRP 390 Cb 0.09 -3.31 0.00 0.00 -0.00 0.00 0.00 33.47 30.26 1k0g s TRP 390 CO 0.59 -0.76 0.00 0.00 -0.00 0.00 0.00 176.95 176.78 1k0g n GLY 392 N -1.32 1.27 3.25 0.00 0.00 -1.10 -4.58 105.19 102.72 1k0g n GLY 392 Ca -0.04 -1.12 -0.12 0.00 0.00 0.00 0.00 46.02 44.74 1k0g n GLY 392 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1k0g s SER 393 N -1.00 -0.14 0.03 1.61 0.01 0.20 -0.41 113.70 114.00 1k0g s SER 393 Ca 0.00 -0.15 0.08 0.00 1.31 0.00 0.00 55.95 57.19 1k0g s SER 393 Cb 0.00 0.36 -0.02 0.00 0.21 0.00 0.00 66.02 66.56 1k0g s SER 393 CO 0.00 -0.60 -0.23 -0.63 0.41 0.00 0.00 173.24 172.20 1k0g s ILE 394 N -2.40 1.82 -1.38 1.44 1.01 -1.24 -0.11 121.20 120.35 1k0g s ILE 394 Ca -0.06 -1.19 0.00 0.00 0.00 0.00 0.00 60.65 59.40 1k0g s ILE 394 Cb -0.01 -1.56 0.00 0.00 0.01 0.00 0.00 42.46 40.90 1k0g s ILE 394 CO -0.02 0.32 0.00 0.61 0.00 0.00 0.00 174.94 175.85 1k0g n GLY 395 N 1.99 -0.95 3.09 6.18 0.00 -0.39 -0.53 105.19 114.59 1k0g n GLY 395 Ca -0.17 -0.84 -0.12 0.00 0.00 0.00 0.00 46.02 44.89 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 0.75 -0.34 1.61 -0.85 -0.49 -0.99 117.35 114.03 1k0g s TYR 396 Ca 0.00 -0.61 0.04 0.00 -0.52 0.00 0.00 57.07 55.97 1k0g s TYR 396 Cb 0.00 -0.44 0.10 0.00 0.38 0.00 0.00 41.96 42.00 1k0g s TYR 396 CO 0.00 -0.10 0.06 -0.51 -1.52 0.00 0.00 175.55 173.48 1k0g s LEU 397 N -1.99 4.64 0.52 -3.49 1.02 0.26 -2.63 118.68 117.01 1k0g s LEU 397 Ca -0.04 -2.16 -0.21 0.00 0.02 0.00 0.00 54.13 51.74 1k0g s LEU 397 Cb -0.06 -1.59 -0.06 0.00 0.02 0.00 0.00 46.19 44.50 1k0g s LEU 397 CO -0.01 -0.38 1.21 -0.55 0.02 0.00 0.00 176.35 176.65 1k0g s SER 398 N 0.90 5.68 0.55 2.29 0.15 0.12 -0.27 113.70 123.12 1k0g s SER 398 Ca 0.11 2.42 0.23 0.00 0.70 0.00 0.00 55.95 59.40 1k0g s SER 398 Cb -0.19 -2.61 1.48 0.00 -1.71 0.00 0.00 66.02 62.99 1k0g s SER 398 CO -0.09 -1.26 2.14 -0.26 1.20 0.00 0.00 173.24 174.97 1k0g h PHE 399 N 1.54 0.00 0.00 3.44 0.04 -1.08 -0.34 116.94 120.53 1k0g h PHE 399 Ca -0.50 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.27 1k0g h PHE 399 Cb 1.27 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.42 1k0g h PHE 399 CO 0.50 0.00 0.00 0.00 -0.60 0.00 0.00 178.31 178.21 1k0g n GLY 401 N 0.45 3.00 3.76 0.00 0.00 -0.14 -4.68 105.19 107.59 1k0g n GLY 401 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.72 4.14 -0.01 1.61 -0.87 -1.26 -4.58 114.94 113.25 1k0g s ASN 402 Ca 0.00 1.52 -0.07 0.00 -1.57 0.00 0.00 52.86 52.73 1k0g s ASN 402 Cb 0.00 -2.23 0.01 0.00 -0.02 0.00 0.00 41.25 39.00 1k0g s ASN 402 CO 0.00 -2.22 0.15 -0.32 -2.57 0.00 0.00 177.10 172.14 1k0g s MET 403 N -5.00 0.42 -0.09 -0.60 -2.45 0.14 0.16 119.30 111.88 1k0g s MET 403 Ca 0.62 -0.24 -0.08 0.00 -1.25 0.00 0.00 55.69 54.74 1k0g s MET 403 Cb -0.16 0.18 0.03 0.00 1.25 0.00 0.00 34.83 36.12 1k0g s MET 403 CO 0.56 -0.09 0.24 0.34 1.05 0.00 0.00 175.02 177.12 1k0g s ASP 404 N -1.03 -0.26 0.02 1.11 -1.08 -1.08 -0.59 116.67 113.77 1k0g s ASP 404 Ca -0.11 0.50 -0.08 0.00 -0.52 0.00 0.00 52.55 52.34 1k0g s ASP 404 Cb -0.06 0.48 -0.00 0.00 -1.46 0.00 0.00 42.92 41.88 1k0g s ASP 404 CO 0.01 -0.10 0.15 0.42 0.52 0.00 0.00 175.17 176.17 1k0g s THR 405 N 0.35 0.10 0.39 1.71 -4.23 -0.81 -1.40 115.64 111.75 1k0g s THR 405 Ca -0.02 -0.84 0.08 0.00 -1.18 0.00 0.00 61.69 59.73 1k0g s THR 405 Cb -0.03 -0.68 -0.02 0.00 1.34 0.00 0.00 72.50 73.11 1k0g s THR 405 CO -0.01 -0.46 0.34 -0.94 -0.54 0.00 0.00 174.62 173.00 1k0g s SER 406 N -1.75 5.09 -0.23 3.99 1.04 0.32 0.52 113.70 122.68 1k0g s SER 406 Ca -0.10 -0.68 -0.09 0.00 0.48 0.00 0.00 55.95 55.56 1k0g s SER 406 Cb -0.04 -0.70 -0.05 0.00 0.10 0.00 0.00 66.02 65.33 1k0g s SER 406 CO -0.01 -0.54 0.13 -0.63 0.98 0.00 0.00 173.24 173.17 1k0g s ILE 407 N -2.42 5.13 -1.33 -1.02 1.01 0.52 -3.59 121.20 119.50 1k0g s ILE 407 Ca 0.45 0.10 -0.08 0.00 0.00 0.00 0.00 60.65 61.12 1k0g s ILE 407 Cb -0.04 -3.38 0.12 0.00 0.01 0.00 0.00 42.46 39.18 1k0g s ILE 407 CO 0.27 0.37 2.20 0.35 0.00 0.00 0.00 174.94 178.14 1k0g n THR 408 N 4.15 4.75 -1.38 2.92 -2.24 0.45 -4.63 114.28 118.30 1k0g n THR 408 Ca -0.16 -4.21 -0.29 0.00 -2.27 0.00 0.00 64.05 57.13 1k0g n THR 408 Cb 0.52 -2.25 0.16 0.00 -2.10 0.00 0.00 70.33 66.66 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 -0.17 1.99 -1.55 2.28 -4.36 -1.26 -1.28 121.20 116.85 1k0g s ILE 409 Ca 0.49 0.00 -0.02 0.00 -0.26 0.00 0.00 60.65 60.85 1k0g s ILE 409 Cb 0.15 -2.64 0.02 0.00 1.25 0.00 0.00 42.46 41.24 1k0g s ILE 409 CO -0.05 0.00 0.14 0.54 0.24 0.00 0.00 174.94 175.81 1k0g n ARG 410 N -3.97 -1.41 -4.87 0.37 1.74 -1.26 -3.83 116.66 103.42 1k0g n ARG 410 Ca 0.06 0.16 -0.27 0.00 -0.77 0.00 0.00 57.85 57.03 1k0g n ARG 410 Cb 0.59 -3.88 -0.16 0.00 -1.02 0.00 0.00 32.46 27.98 1k0g n ARG 410 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1k0g s THR 411 N -4.20 1.52 0.06 0.55 2.01 -1.26 0.56 115.64 114.89 1k0g s THR 411 Ca 0.08 -0.73 0.03 0.00 0.31 0.00 0.00 61.69 61.38 1k0g s THR 411 Cb -0.05 -1.32 -0.04 0.00 0.01 0.00 0.00 72.50 71.10 1k0g s THR 411 CO 0.98 0.44 0.03 -0.76 -0.69 0.00 0.00 174.62 174.62 1k0g s LEU 412 N 0.28 3.61 -0.17 4.42 1.02 0.14 -4.33 118.68 123.64 1k0g s LEU 412 Ca -0.10 -0.07 -0.00 0.00 0.02 0.00 0.00 54.13 53.97 1k0g s LEU 412 Cb -0.14 -2.26 0.00 0.00 0.02 0.00 0.00 46.19 43.81 1k0g s LEU 412 CO 0.04 0.20 -0.14 -0.89 0.02 0.00 0.00 176.35 175.58 1k0g s THR 413 N -1.28 2.63 -0.20 5.49 2.01 0.12 -1.39 115.64 123.02 1k0g s THR 413 Ca 0.25 -0.76 0.01 0.00 0.31 0.00 0.00 61.69 61.50 1k0g s THR 413 Cb -0.12 -2.13 0.02 0.00 0.01 0.00 0.00 72.50 70.29 1k0g s THR 413 CO 0.18 0.50 -0.17 0.00 -0.69 0.00 0.00 174.62 174.44 1k0g s ALA 414 N 1.07 2.41 -0.10 7.40 0.00 0.10 -0.79 121.76 131.86 1k0g s ALA 414 Ca -0.00 -1.31 -0.02 0.00 0.00 0.00 0.00 51.96 50.63 1k0g s ALA 414 Cb -0.14 -1.30 0.04 0.00 0.00 0.00 0.00 23.12 21.71 1k0g s ALA 414 CO -0.04 -0.50 0.03 0.42 0.00 0.00 0.00 175.76 175.66 1k0g s ILE 415 N 1.28 0.26 -1.40 0.00 1.01 0.87 -0.63 121.20 122.59 1k0g s ILE 415 Ca 0.03 0.03 -0.15 0.00 0.00 0.00 0.00 60.65 60.56 1k0g s ILE 415 Cb -0.14 -0.55 0.02 0.00 0.01 0.00 0.00 42.46 41.80 1k0g s ILE 415 CO -0.11 0.11 0.32 0.59 0.00 0.00 0.00 174.94 175.84 1k0g n ASN 416 N 5.17 -1.32 0.00 3.58 5.03 -1.26 0.13 115.26 126.60 1k0g n ASN 416 Ca -0.07 -1.28 0.00 0.00 0.87 0.00 0.00 54.58 54.11 1k0g n ASN 416 Cb 0.49 -1.70 0.00 0.00 -1.02 0.00 0.00 39.78 37.56 1k0g n ASN 416 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1k0g n GLY 417 N -2.35 2.01 3.58 7.41 0.00 -1.26 -4.98 105.19 109.60 1k0g n GLY 417 Ca -0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.24 3.13 0.00 1.61 -1.52 0.36 0.71 119.66 123.71 1k0g s GLN 418 Ca 0.00 -0.50 0.06 0.00 -1.95 0.00 0.00 55.36 52.97 1k0g s GLN 418 Cb 0.00 -2.75 -0.02 0.00 -0.22 0.00 0.00 33.01 30.02 1k0g s GLN 418 CO 0.00 0.53 -0.19 -1.50 -0.25 0.00 0.00 175.29 173.88 1k0g s ILE 419 N -0.42 1.48 -0.02 1.08 2.07 0.42 -0.09 121.20 125.72 1k0g s ILE 419 Ca 0.07 -0.90 0.08 0.00 -1.41 0.00 0.00 60.65 58.49 1k0g s ILE 419 Cb -0.12 -1.25 -0.02 0.00 0.13 0.00 0.00 42.46 41.20 1k0g s ILE 419 CO 0.02 0.34 -0.26 -0.36 -1.91 0.00 0.00 174.94 172.77 1k0g s PHE 420 N -0.54 2.32 -0.08 3.50 0.40 0.03 -0.78 117.98 122.82 1k0g s PHE 420 Ca 0.07 -0.47 0.01 0.00 -0.60 0.00 0.00 56.93 55.94 1k0g s PHE 420 Cb -0.08 -1.50 0.02 0.00 0.51 0.00 0.00 43.02 41.98 1k0g s PHE 420 CO -0.00 -0.06 -0.08 0.00 0.70 0.00 0.00 175.22 175.78 1k0g s SER 422 N 1.25 4.67 -0.14 0.00 0.01 -1.26 -0.86 113.70 117.37 1k0g s SER 422 Ca -0.04 -0.53 -0.17 0.00 1.31 0.00 0.00 55.95 56.52 1k0g s SER 422 Cb -0.14 -0.94 0.04 0.00 0.21 0.00 0.00 66.02 65.20 1k0g s SER 422 CO -0.03 0.03 0.45 0.00 0.41 0.00 0.00 173.24 174.11 1k0g s ALA 423 N -2.08 -1.12 0.00 1.44 0.00 0.21 -4.70 121.76 115.51 1k0g s ALA 423 Ca 0.30 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.42 1k0g s ALA 423 Cb -0.08 -0.60 0.00 0.00 0.00 0.00 0.00 23.12 22.44 1k0g s ALA 423 CO 0.20 -0.23 0.00 0.41 0.00 0.00 0.00 175.76 176.14 1k0g n GLY 424 N 2.52 3.60 3.58 0.00 0.00 -1.26 -0.39 105.19 113.25 1k0g n GLY 424 Ca -0.15 -1.07 -0.13 0.00 0.00 0.00 0.00 46.02 44.68 1k0g n GLY 424 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1k0g s GLY 425 N -0.22 -0.38 -0.32 -0.02 0.00 -1.04 -4.73 107.32 100.60 1k0g s GLY 425 Ca 0.00 1.95 -0.29 0.00 0.00 0.00 0.00 44.72 46.38 1k0g s GLY 425 CO 0.00 1.29 1.59 -0.32 0.00 0.00 0.00 173.10 175.66 1k0g s GLY 426 N -0.63 1.04 -0.16 0.20 0.00 -1.26 -1.68 107.32 104.84 1k0g s GLY 426 Ca -0.03 0.18 -0.24 0.00 0.00 0.00 0.00 44.72 44.63 1k0g s GLY 426 CO 0.02 2.99 0.75 -0.42 0.00 0.00 0.00 173.10 176.45 1k0g s ILE 427 N 5.80 4.95 0.41 0.90 1.01 0.56 -4.87 121.20 129.95 1k0g s ILE 427 Ca 0.70 1.46 0.04 0.00 0.00 0.00 0.00 60.65 62.85 1k0g s ILE 427 Cb -0.20 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 1k0g s ILE 427 CO 0.31 0.08 0.07 0.68 0.00 0.00 0.00 174.94 176.08 1k0g s VAL 428 N 1.89 1.06 0.43 2.92 -7.23 -1.26 -1.05 120.40 117.16 1k0g s VAL 428 Ca 0.35 -2.00 0.12 0.00 -1.81 0.00 0.00 61.98 58.64 1k0g s VAL 428 Cb -0.16 -2.50 0.31 0.00 0.56 0.00 0.00 36.38 34.58 1k0g s VAL 428 CO 0.12 0.00 2.00 0.00 -0.31 0.00 0.00 175.10 176.92 1k0g h ALA 429 N 1.77 1.93 -0.59 1.32 0.00 -1.97 -1.62 119.26 120.10 1k0g h ALA 429 Ca -0.40 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1k0g h ALA 429 Cb 1.27 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1k0g h ALA 429 CO 0.67 -0.03 0.00 -0.25 0.00 0.00 0.00 179.25 179.64 1k0g n ASP 430 N -4.47 5.33 -4.81 0.00 8.00 -1.26 -4.94 116.55 114.40 1k0g n ASP 430 Ca 0.08 -2.74 -0.32 0.00 0.71 0.00 0.00 54.79 52.52 1k0g n ASP 430 Cb 0.28 -0.65 0.04 0.00 -0.02 0.00 0.00 41.12 40.77 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 -0.80 5.44 -0.10 -2.24 0.01 -0.61 -5.03 113.70 110.37 1k0g s SER 431 Ca 0.53 1.72 0.03 0.00 1.31 0.00 0.00 55.95 59.53 1k0g s SER 431 Cb 0.38 -2.51 -0.01 0.00 0.21 0.00 0.00 66.02 64.08 1k0g s SER 431 CO 0.19 -1.40 -0.18 -1.10 0.41 0.00 0.00 173.24 171.16 1k0g s GLN 432 N -4.64 3.01 0.13 12.44 -0.21 -1.26 -4.96 119.66 124.17 1k0g s GLN 432 Ca 0.61 -0.78 -0.25 0.00 0.02 0.00 0.00 55.36 54.96 1k0g s GLN 432 Cb -0.15 -2.42 -0.03 0.00 1.00 0.00 0.00 33.01 31.41 1k0g s GLN 432 CO 0.48 0.30 1.63 1.49 -2.12 0.00 0.00 175.29 177.07 1k0g h GLU 433 N 6.38 -0.34 -0.20 2.91 4.81 -1.99 0.32 114.58 126.47 1k0g h GLU 433 Ca -0.28 0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 58.90 1k0g h GLU 433 Cb 1.20 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.66 1k0g h GLU 433 CO 0.51 -0.23 -0.16 1.49 -0.73 0.00 0.00 179.01 179.89 1k0g h GLU 434 N -0.35 0.45 -0.60 1.92 4.57 -1.99 -0.91 114.58 117.67 1k0g h GLU 434 Ca 0.08 -0.23 0.04 0.00 -1.18 0.00 0.00 59.36 58.08 1k0g h GLU 434 Cb 0.48 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.02 1k0g h GLU 434 CO -0.28 0.79 0.34 0.00 -1.18 0.00 0.00 179.01 178.68 1k0g h ALA 435 N 0.66 0.78 -0.23 2.92 0.00 -1.92 -1.28 119.26 120.19 1k0g h ALA 435 Ca 0.04 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.99 1k0g h ALA 435 Cb 0.69 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 1k0g h ALA 435 CO 0.04 0.05 -0.08 1.49 0.00 0.00 0.00 179.25 180.75 1k0g h GLU 436 N 0.67 -0.04 -0.71 0.00 4.57 -0.22 0.81 114.58 119.66 1k0g h GLU 436 Ca 0.25 0.00 0.05 0.00 -1.18 0.00 0.00 59.36 58.48 1k0g h GLU 436 Cb 0.08 0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.63 1k0g h GLU 436 CO -0.13 -0.03 0.42 -0.92 -1.18 0.00 0.00 179.01 177.17 1k0g h TYR 437 N -0.04 0.78 0.00 0.92 3.20 -0.79 -2.10 116.97 118.94 1k0g h TYR 437 Ca 0.12 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.90 1k0g h TYR 437 Cb 0.22 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.22 1k0g h TYR 437 CO -0.26 0.41 -0.61 1.96 -1.64 0.00 0.00 178.16 178.02 1k0g h GLN 438 N 0.80 0.00 0.28 1.82 1.08 -0.75 -1.86 115.11 116.47 1k0g h GLN 438 Ca 0.30 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.50 1k0g h GLN 438 Cb 0.11 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.53 1k0g h GLN 438 CO -0.15 0.50 -0.33 0.93 -0.95 0.00 0.00 178.83 178.83 1k0g h GLU 439 N 0.00 -0.60 -0.97 1.46 3.07 0.13 -2.36 114.58 115.32 1k0g h GLU 439 Ca -0.02 0.04 0.34 0.00 -0.50 0.00 0.00 59.36 59.22 1k0g h GLU 439 Cb 1.42 0.14 -0.18 0.00 -0.84 0.00 0.00 28.75 29.29 1k0g h GLU 439 CO 0.07 -0.40 0.28 2.41 -1.40 0.00 0.00 179.01 179.96 1k0g n THR 440 N -4.38 -0.41 1.88 1.13 -1.04 -0.90 0.33 114.28 110.90 1k0g n THR 440 Ca -0.07 2.04 0.06 0.00 -2.04 0.00 0.00 64.05 64.04 1k0g n THR 440 Cb 0.29 -3.15 0.35 0.00 -1.82 0.00 0.00 70.33 66.00 1k0g n THR 440 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1k0g n PHE 441 N -5.31 0.00 -2.36 -1.42 3.01 -0.70 -2.96 117.46 107.71 1k0g n PHE 441 Ca 0.30 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.74 1k0g n PHE 441 Cb 1.00 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 40.48 1k0g n PHE 441 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 1k0g n ASP 442 N -0.70 -0.23 -0.01 4.37 5.68 0.15 -4.10 116.55 121.73 1k0g n ASP 442 Ca 0.09 -2.04 0.09 0.00 -0.50 0.00 0.00 54.79 52.42 1k0g n ASP 442 Cb 0.04 0.11 -0.13 0.00 -1.14 0.00 0.00 41.12 40.00 1k0g n ASP 442 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1k0g n LYS 443 N -0.23 0.73 -0.00 0.11 4.81 0.40 -3.89 118.16 120.08 1k0g n LYS 443 Ca -0.13 -0.12 0.02 0.00 -0.87 0.00 0.00 58.31 57.22 1k0g n LYS 443 Cb 0.87 -1.41 -0.04 0.00 0.02 0.00 0.00 35.03 34.48 1k0g n LYS 443 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 1k0g n VAL 444 N -1.92 0.00 0.00 3.15 0.24 -1.25 -4.83 118.33 113.72 1k0g n VAL 444 Ca -0.01 -0.12 0.00 0.00 -2.04 0.00 0.00 64.34 62.16 1k0g n VAL 444 Cb 0.42 0.42 0.00 0.00 -1.47 0.00 0.00 33.84 33.20 1k0g n VAL 444 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1k0g n ASN 445 N -1.64 0.00 0.00 -1.34 2.85 -1.25 -0.65 115.26 113.23 1k0g n ASN 445 Ca -0.01 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.46 1k0g n ASN 445 Cb 0.12 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.14 1k0g n ASN 445 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 1k0g n ARG 446 N -0.70 0.00 -0.12 1.20 0.63 -1.26 0.73 116.66 117.14 1k0g n ARG 446 Ca 0.00 0.19 -0.09 0.00 -0.92 0.00 0.00 57.85 57.02 1k0g n ARG 446 Cb 0.00 -0.40 -0.07 0.00 0.45 0.00 0.00 32.46 32.44 1k0g n ARG 446 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 1k0g h ILE 447 N 0.00 0.00 -0.55 5.15 2.04 -1.23 0.62 117.51 123.54 1k0g h ILE 447 Ca 0.00 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.94 1k0g h ILE 447 Cb 0.00 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.01 1k0g h ILE 447 CO 0.00 0.00 0.18 -0.07 0.00 0.00 0.00 178.15 178.26 1k0g h LEU 448 N -0.24 0.15 0.00 1.44 4.07 -1.24 -2.77 115.31 116.72 1k0g h LEU 448 Ca 0.06 0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.09 1k0g h LEU 448 Cb 0.40 0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.21 1k0g h LEU 448 CO -0.45 0.10 0.00 1.17 -1.08 0.00 0.00 178.44 178.19 1k0g n LYS 449 N -5.03 0.00 -0.30 1.13 3.00 0.22 -3.56 118.16 113.62 1k0g n LYS 449 Ca 0.07 0.51 0.14 0.00 -0.00 0.00 0.00 58.31 59.03 1k0g n LYS 449 Cb 0.24 -1.35 0.28 0.00 0.00 0.00 0.00 35.03 34.20 1k0g n LYS 449 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 1k0g n GLN 450 N -1.83 -0.07 0.00 1.64 -0.06 0.18 -5.08 117.38 112.17 1k0g n GLN 450 Ca 0.00 1.30 0.16 0.00 -2.00 0.00 0.00 57.00 56.46 1k0g n GLN 450 Cb 0.00 -2.09 0.87 0.00 -4.06 0.00 0.00 30.24 24.96 1k0g n GLN 450 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14