#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j1w n PRO 4 N 0.00 0.00 -2.55 -2.82 -0.02 -1.26 -3.90 135.00 124.45 1j1w n PRO 4 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 63.50 61.11 1j1w n PRO 4 Cb 0.00 -0.48 -0.04 0.00 -0.02 0.00 0.00 33.50 32.96 1j1w n PRO 4 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1j1w s LYS 5 N 1.68 4.27 -0.11 -0.52 1.02 -1.26 -2.48 119.74 122.34 1j1w s LYS 5 Ca 0.37 1.54 -0.03 0.00 0.02 0.00 0.00 55.97 57.87 1j1w s LYS 5 Cb -0.48 -2.66 0.05 0.00 -0.52 0.00 0.00 37.83 34.22 1j1w s LYS 5 CO 0.22 -0.06 0.13 0.42 -0.92 0.00 0.00 175.35 175.15 1j1w s ILE 6 N -1.58 -0.20 -0.35 2.17 1.01 -0.91 -4.63 121.20 116.72 1j1w s ILE 6 Ca 0.55 0.21 -0.17 0.00 0.00 0.00 0.00 60.65 61.24 1j1w s ILE 6 Cb -0.23 -0.36 -0.00 0.00 0.01 0.00 0.00 42.46 41.87 1j1w s ILE 6 CO 0.29 0.02 0.46 -0.63 0.00 0.00 0.00 174.94 175.09 1j1w s ILE 7 N 2.24 5.07 -0.35 2.92 -1.09 -0.66 -2.30 121.20 127.03 1j1w s ILE 7 Ca 0.04 0.19 -0.15 0.00 -2.23 0.00 0.00 60.65 58.51 1j1w s ILE 7 Cb -0.13 -3.93 -0.01 0.00 -1.58 0.00 0.00 42.46 36.81 1j1w s ILE 7 CO -0.07 -0.19 0.34 -0.47 -1.23 0.00 0.00 174.94 173.32 1j1w s TYR 8 N 2.26 3.21 0.30 3.97 5.04 -0.53 0.33 117.35 131.93 1j1w s TYR 8 Ca 0.16 -0.08 -0.21 0.00 -2.44 0.00 0.00 57.07 54.50 1j1w s TYR 8 Cb -0.16 -2.64 -0.09 0.00 0.35 0.00 0.00 41.96 39.42 1j1w s TYR 8 CO 0.13 -0.43 0.82 0.95 -1.34 0.00 0.00 175.55 175.68 1j1w s THR 9 N 1.96 4.46 -0.21 4.34 -4.23 -0.82 -3.39 115.64 117.74 1j1w s THR 9 Ca 0.10 1.42 -0.09 0.00 -1.18 0.00 0.00 61.69 61.95 1j1w s THR 9 Cb -0.17 -3.83 -0.04 0.00 1.34 0.00 0.00 72.50 69.80 1j1w s THR 9 CO 0.11 0.05 0.10 -0.76 -0.54 0.00 0.00 174.62 173.58 1j1w s LEU 10 N -2.34 3.90 0.00 4.79 1.43 -0.08 -4.58 118.68 121.81 1j1w s LEU 10 Ca 0.50 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.67 1j1w s LEU 10 Cb -0.15 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 44.05 1j1w s LEU 10 CO 0.20 0.12 0.00 0.35 0.23 0.00 0.00 176.35 177.25 1j1w n THR 11 N 3.94 0.00 -0.00 5.49 -2.24 -1.26 -1.65 114.28 118.56 1j1w n THR 11 Ca -0.16 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.62 1j1w n THR 11 Cb 0.52 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.75 1j1w n THR 11 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1j1w n ASP 12 N 0.00 0.15 0.00 3.42 8.00 -1.26 -4.47 116.55 122.39 1j1w n ASP 12 Ca 0.00 0.02 0.00 0.00 0.71 0.00 0.00 54.79 55.52 1j1w n ASP 12 Cb 0.00 -0.34 0.00 0.00 -0.02 0.00 0.00 41.12 40.76 1j1w n ASP 12 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1j1w n GLU 13 N -2.65 0.00 -0.01 -1.24 1.02 -1.26 -4.50 120.64 112.00 1j1w n GLU 13 Ca -0.01 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.01 1j1w n GLU 13 Cb 0.03 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.39 1j1w n GLU 13 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1j1w h ALA 14 N -2.00 -0.61 -0.76 0.62 0.00 -1.92 -1.27 119.26 113.32 1j1w h ALA 14 Ca 0.00 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.01 1j1w h ALA 14 Cb 0.00 0.81 -0.13 0.00 0.00 0.00 0.00 17.79 18.47 1j1w h ALA 14 CO 0.00 -0.94 -0.41 -1.35 0.00 0.00 0.00 179.25 176.55 1j1w h PRO 15 N -0.49 -0.11 -0.55 0.00 0.11 -1.90 0.29 132.00 129.34 1j1w h PRO 15 Ca 0.07 0.01 0.06 0.00 0.11 0.00 0.00 66.00 66.25 1j1w h PRO 15 Cb 0.63 0.02 -0.09 0.00 0.11 0.00 0.00 31.00 31.67 1j1w h PRO 15 CO -0.41 -0.07 -0.56 0.00 -0.21 0.00 0.00 178.00 176.74 1j1w h ALA 16 N 0.96 -0.72 0.05 -0.75 0.00 -1.53 0.12 119.26 117.39 1j1w h ALA 16 Ca 0.25 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.21 1j1w h ALA 16 Cb 0.56 1.18 -0.04 0.00 0.00 0.00 0.00 17.79 19.49 1j1w h ALA 16 CO -0.81 -1.03 -0.26 -0.07 0.00 0.00 0.00 179.25 177.08 1j1w h LEU 17 N -0.30 -0.75 -1.01 0.00 3.38 0.05 -1.75 115.31 114.93 1j1w h LEU 17 Ca 0.10 0.10 0.36 0.00 0.09 0.00 0.00 57.88 58.53 1j1w h LEU 17 Cb 0.55 0.30 -0.16 0.00 0.09 0.00 0.00 40.66 41.44 1j1w h LEU 17 CO -0.68 -0.33 0.56 0.00 0.09 0.00 0.00 178.44 178.08 1j1w h ALA 18 N 0.36 2.06 -0.35 1.53 0.00 0.18 0.18 119.26 123.22 1j1w h ALA 18 Ca 0.05 0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1j1w h ALA 18 Cb 0.49 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1j1w h ALA 18 CO -0.19 -0.74 0.15 1.15 0.00 0.00 0.00 179.25 179.61 1j1w h THR 19 N 0.19 1.13 0.00 0.00 2.02 0.04 -0.42 112.91 115.87 1j1w h THR 19 Ca 0.78 -0.40 -0.01 0.00 0.77 0.00 0.00 66.41 67.56 1j1w h THR 19 Cb 1.93 0.70 -0.00 0.00 -1.74 0.00 0.00 68.15 69.04 1j1w h THR 19 CO -0.67 0.16 -0.04 1.88 0.37 0.00 0.00 175.52 177.22 1j1w h TYR 20 N 0.49 0.00 0.00 3.16 -1.99 -0.66 -0.82 116.97 117.15 1j1w h TYR 20 Ca 0.12 0.00 -0.30 0.00 2.00 0.00 0.00 58.73 60.56 1j1w h TYR 20 Cb 0.08 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 38.77 1j1w h TYR 20 CO 0.00 0.04 -1.73 0.45 -0.00 0.00 0.00 178.16 176.92 1j1w n SER 21 N -3.55 1.90 0.09 3.88 2.88 -0.52 -4.54 113.62 113.77 1j1w n SER 21 Ca -0.02 0.40 -0.14 0.00 -1.33 0.00 0.00 58.87 57.77 1j1w n SER 21 Cb 0.14 -0.88 -0.08 0.00 -0.75 0.00 0.00 64.21 62.64 1j1w n SER 21 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1j1w h LEU 22 N -1.00 0.48 -0.16 2.46 5.85 -1.12 -3.36 115.31 118.47 1j1w h LEU 22 Ca -0.45 -0.44 0.03 0.00 0.84 0.00 0.00 57.88 57.87 1j1w h LEU 22 Cb 1.35 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 1j1w h LEU 22 CO -0.27 1.27 -0.05 0.25 -0.34 0.00 0.00 178.44 179.30 1j1w h LEU 23 N 0.16 -0.18 -0.38 2.25 7.12 -1.36 0.16 115.31 123.07 1j1w h LEU 23 Ca -0.10 0.05 0.05 0.00 0.13 0.00 0.00 57.88 58.01 1j1w h LEU 23 Cb 1.74 0.11 -0.05 0.00 -0.53 0.00 0.00 40.66 41.94 1j1w h LEU 23 CO 0.18 -0.07 0.11 1.55 -0.13 0.00 0.00 178.44 180.08 1j1w h PRO 24 N -0.02 0.25 -0.03 5.25 0.13 -1.75 0.38 132.00 136.22 1j1w h PRO 24 Ca 0.08 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 65.20 1j1w h PRO 24 Cb 0.14 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.20 1j1w h PRO 24 CO -0.18 0.16 -0.11 0.82 -0.23 0.00 0.00 178.00 178.46 1j1w h ILE 25 N 0.25 0.00 -0.99 -3.56 2.04 -1.48 0.30 117.51 114.08 1j1w h ILE 25 Ca 0.18 0.00 0.36 0.00 1.00 0.00 0.00 64.86 66.40 1j1w h ILE 25 Cb 0.18 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.09 1j1w h ILE 25 CO -0.20 0.00 0.40 0.40 0.00 0.00 0.00 178.15 178.75 1j1w h ILE 26 N -0.13 0.07 0.00 -0.67 2.04 -0.31 0.23 117.51 118.74 1j1w h ILE 26 Ca 0.01 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.82 1j1w h ILE 26 Cb 0.14 -0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.22 1j1w h ILE 26 CO -0.09 0.01 -0.14 0.50 0.00 0.00 0.00 178.15 178.43 1j1w h LYS 27 N 0.06 0.00 0.00 2.37 3.64 0.35 -2.82 116.57 120.17 1j1w h LYS 27 Ca 0.75 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.98 1j1w h LYS 27 Cb 1.85 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.65 1j1w h LYS 27 CO -0.78 0.14 -0.87 0.00 -2.27 0.00 0.00 179.45 175.67 1j1w h ALA 28 N 1.86 0.58 0.09 5.00 0.00 0.74 -3.07 119.26 124.46 1j1w h ALA 28 Ca -0.00 -0.72 -0.29 0.00 0.00 0.00 0.00 54.91 53.90 1j1w h ALA 28 Cb 0.26 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1j1w h ALA 28 CO 0.02 0.91 -1.48 0.74 0.00 0.00 0.00 179.25 179.44 1j1w h PHE 29 N 0.00 0.36 -0.00 0.00 -1.00 -1.41 -3.28 116.94 111.61 1j1w h PHE 29 Ca -0.05 -0.27 0.00 0.00 2.81 0.00 0.00 57.97 60.46 1j1w h PHE 29 Cb 1.57 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 41.11 1j1w h PHE 29 CO 0.00 1.30 -0.21 0.25 -1.61 0.00 0.00 178.31 178.05 1j1w n THR 30 N -3.41 0.00 0.37 -1.55 -2.24 -1.08 -4.29 114.28 102.08 1j1w n THR 30 Ca -0.14 -0.08 -0.17 0.00 -2.27 0.00 0.00 64.05 61.39 1j1w n THR 30 Cb 1.03 0.12 -0.08 0.00 -2.10 0.00 0.00 70.33 69.30 1j1w n THR 30 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1j1w h GLY 31 N 4.96 -1.00 0.01 3.38 0.00 -1.59 -3.02 103.07 105.81 1j1w h GLY 31 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.70 1j1w h GLY 31 CO 0.00 -0.36 0.00 -1.14 0.00 0.00 0.00 176.54 175.04 1j1w n SER 32 N -5.45 0.00 -0.72 0.19 3.41 -1.26 -3.06 113.62 106.73 1j1w n SER 32 Ca -0.13 -1.65 0.06 0.00 -0.26 0.00 0.00 58.87 56.89 1j1w n SER 32 Cb 0.39 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.55 1j1w n SER 32 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1j1w n SER 33 N -0.50 2.99 -3.67 4.04 7.64 -1.20 -4.97 113.62 117.94 1j1w n SER 33 Ca 0.00 -3.28 -0.24 0.00 1.01 0.00 0.00 58.87 56.36 1j1w n SER 33 Cb 0.00 -0.54 0.06 0.00 -1.01 0.00 0.00 64.21 62.73 1j1w n SER 33 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j1w n GLY 34 N -0.95 -0.47 3.27 0.23 0.00 -1.17 -4.82 105.19 101.28 1j1w n GLY 34 Ca 0.23 0.20 -0.32 0.00 0.00 0.00 0.00 46.02 46.12 1j1w n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j1w s ILE 35 N -3.37 2.22 -0.25 -0.61 1.01 -1.14 -4.12 121.20 114.94 1j1w s ILE 35 Ca 0.43 -0.98 -0.10 0.00 0.00 0.00 0.00 60.65 60.00 1j1w s ILE 35 Cb -0.20 -1.84 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1j1w s ILE 35 CO 0.77 0.56 0.14 0.00 0.00 0.00 0.00 174.94 176.41 1j1w s ALA 36 N 0.11 3.45 -0.44 9.38 0.00 -1.04 -4.52 121.76 128.71 1j1w s ALA 36 Ca -0.11 -1.01 -0.04 0.00 0.00 0.00 0.00 51.96 50.80 1j1w s ALA 36 Cb -0.16 -2.28 0.12 0.00 0.00 0.00 0.00 23.12 20.80 1j1w s ALA 36 CO 0.06 -0.35 0.25 0.08 0.00 0.00 0.00 175.76 175.80 1j1w s VAL 37 N 1.37 3.54 0.33 0.00 1.01 -1.26 -2.13 120.40 123.26 1j1w s VAL 37 Ca 0.06 -2.04 0.06 0.00 0.00 0.00 0.00 61.98 60.07 1j1w s VAL 37 Cb -0.15 -3.39 -0.01 0.00 0.00 0.00 0.00 36.38 32.83 1j1w s VAL 37 CO 0.06 -0.72 0.47 -1.61 0.00 0.00 0.00 175.10 173.30 1j1w s GLU 38 N 1.13 3.13 0.25 2.72 2.02 -0.97 -4.94 118.70 122.04 1j1w s GLU 38 Ca 0.08 -0.98 0.10 0.00 0.02 0.00 0.00 54.97 54.20 1j1w s GLU 38 Cb -0.23 -2.82 -0.05 0.00 0.10 0.00 0.00 34.13 31.14 1j1w s GLU 38 CO -0.03 0.07 -0.12 0.95 0.02 0.00 0.00 175.26 176.15 1j1w s THR 39 N -2.18 2.94 -0.02 3.63 -4.23 -1.26 -1.46 115.64 113.07 1j1w s THR 39 Ca 0.45 -2.05 0.00 0.00 -1.18 0.00 0.00 61.69 58.91 1j1w s THR 39 Cb -0.10 -2.52 0.02 0.00 1.34 0.00 0.00 72.50 71.25 1j1w s THR 39 CO 0.31 -0.30 0.02 -0.13 -0.54 0.00 0.00 174.62 173.98 1j1w s ARG 40 N -3.33 -0.02 -0.56 3.99 1.81 -1.22 -4.95 118.95 114.67 1j1w s ARG 40 Ca 0.28 0.15 -0.21 0.00 -1.72 0.00 0.00 55.73 54.24 1j1w s ARG 40 Cb -0.07 -0.21 0.07 0.00 -0.45 0.00 0.00 34.95 34.29 1j1w s ARG 40 CO 0.16 -0.14 0.76 0.34 -0.68 0.00 0.00 175.30 175.74 1j1w s ASP 41 N 0.88 6.23 0.00 0.23 3.68 -1.26 -0.90 116.67 125.53 1j1w s ASP 41 Ca -0.07 -0.91 0.13 0.00 2.13 0.00 0.00 52.55 53.82 1j1w s ASP 41 Cb -0.11 -2.34 0.26 0.00 -1.45 0.00 0.00 42.92 39.28 1j1w s ASP 41 CO -0.02 -1.09 1.15 2.30 0.13 0.00 0.00 175.17 177.63 1j1w n ILE 42 N 5.77 0.60 -0.63 4.11 -5.35 -0.66 -4.53 119.36 118.68 1j1w n ILE 42 Ca -0.05 -0.80 -0.31 0.00 -0.27 0.00 0.00 62.75 61.32 1j1w n ILE 42 Cb 0.45 0.81 0.18 0.00 -1.74 0.00 0.00 39.64 39.34 1j1w n ILE 42 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1j1w n SER 43 N 0.71 -2.44 0.34 7.28 3.41 -0.94 -4.65 113.62 117.33 1j1w n SER 43 Ca 0.11 -0.19 -0.16 0.00 -0.26 0.00 0.00 58.87 58.37 1j1w n SER 43 Cb 0.40 -0.96 -0.08 0.00 -0.26 0.00 0.00 64.21 63.32 1j1w n SER 43 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1j1w h LEU 44 N -2.24 -0.74 -0.15 1.04 6.46 -1.88 -1.75 115.31 116.05 1j1w h LEU 44 Ca -0.52 -0.02 0.05 0.00 -0.12 0.00 0.00 57.88 57.27 1j1w h LEU 44 Cb 1.31 0.19 -0.06 0.00 -0.73 0.00 0.00 40.66 41.38 1j1w h LEU 44 CO 0.37 -0.41 -0.23 0.00 -0.62 0.00 0.00 178.44 177.55 1j1w h ALA 45 N -0.84 -0.18 -0.44 1.25 0.00 -1.92 -1.84 119.26 115.30 1j1w h ALA 45 Ca -0.09 0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1j1w h ALA 45 Cb 0.71 0.45 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 1j1w h ALA 45 CO 0.15 -0.68 0.17 0.78 0.00 0.00 0.00 179.25 179.67 1j1w h GLY 46 N -0.28 0.58 0.66 0.00 0.00 -1.88 0.70 103.07 102.86 1j1w h GLY 46 Ca 0.11 -0.10 0.17 0.00 0.00 0.00 0.00 47.33 47.51 1j1w h GLY 46 CO -0.31 0.04 0.49 -0.09 0.00 0.00 0.00 176.54 176.67 1j1w h ARG 47 N 0.35 0.21 0.02 4.80 2.43 -0.65 0.88 114.38 122.42 1j1w h ARG 47 Ca 0.20 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.25 1j1w h ARG 47 Cb 0.18 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1j1w h ARG 47 CO -0.19 0.14 -0.57 -0.07 -1.51 0.00 0.00 179.97 177.77 1j1w h LEU 48 N 0.21 0.08 -2.03 3.80 3.38 -0.41 -3.07 115.31 117.27 1j1w h LEU 48 Ca 0.35 -0.84 0.06 0.00 0.09 0.00 0.00 57.88 57.54 1j1w h LEU 48 Cb 1.07 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 1j1w h LEU 48 CO -0.07 1.23 0.37 0.40 0.09 0.00 0.00 178.44 180.46 1j1w h ILE 49 N -0.88 0.23 0.00 1.22 2.04 -0.20 0.24 117.51 120.17 1j1w h ILE 49 Ca -0.14 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 1j1w h ILE 49 Cb 1.22 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.98 1j1w h ILE 49 CO -0.04 0.00 -1.09 0.00 0.00 0.00 0.00 178.15 177.02 1j1w n ALA 50 N -2.16 2.52 0.09 1.87 0.00 0.24 -4.24 120.51 118.82 1j1w n ALA 50 Ca 0.03 -0.27 -0.06 0.00 0.00 0.00 0.00 53.44 53.14 1j1w n ALA 50 Cb 0.49 -1.08 -0.01 0.00 0.00 0.00 0.00 19.45 18.85 1j1w n ALA 50 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1j1w h THR 51 N 0.00 1.58 -2.25 0.00 2.02 -0.41 -3.38 112.91 110.47 1j1w h THR 51 Ca -0.01 -2.85 -0.60 0.00 0.77 0.00 0.00 66.41 63.72 1j1w h THR 51 Cb 1.03 2.56 -0.41 0.00 -1.74 0.00 0.00 68.15 69.58 1j1w h THR 51 CO 0.00 0.82 -0.56 0.49 0.37 0.00 0.00 175.52 176.64 1j1w n PHE 52 N -3.56 3.79 -0.11 3.16 3.01 -1.16 -4.88 117.46 117.71 1j1w n PHE 52 Ca -0.02 -4.04 0.09 0.00 1.01 0.00 0.00 57.45 54.49 1j1w n PHE 52 Cb 0.82 -0.56 0.43 0.00 -0.01 0.00 0.00 39.48 40.16 1j1w n PHE 52 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1j1w h PRO 53 N 3.71 0.56 -0.99 -1.08 0.11 -1.79 -2.27 132.00 130.25 1j1w h PRO 53 Ca 0.18 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 66.30 1j1w h PRO 53 Cb 0.59 -0.13 -0.06 0.00 0.11 0.00 0.00 31.00 31.51 1j1w h PRO 53 CO 0.85 0.37 0.64 1.05 -0.21 0.00 0.00 178.00 180.70 1j1w h GLU 54 N 0.57 1.19 0.00 1.05 4.11 -1.96 -2.39 114.58 117.14 1j1w h GLU 54 Ca 0.28 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 59.64 1j1w h GLU 54 Cb 0.35 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1j1w h GLU 54 CO -0.08 0.78 -0.01 1.88 0.07 0.00 0.00 179.01 181.65 1j1w h TYR 55 N 1.22 0.00 -2.47 2.06 -1.99 -1.75 -3.46 116.97 110.58 1j1w h TYR 55 Ca 0.41 0.00 -0.46 0.00 2.00 0.00 0.00 58.73 60.68 1j1w h TYR 55 Cb 0.06 0.00 0.02 0.00 2.00 0.00 0.00 36.73 38.80 1j1w h TYR 55 CO -0.00 0.00 -0.20 -0.51 -0.00 0.00 0.00 178.16 177.44 1j1w s LEU 56 N -4.64 3.85 0.67 3.88 1.43 -0.90 -4.64 118.68 118.33 1j1w s LEU 56 Ca 0.10 0.18 0.00 0.00 -1.03 0.00 0.00 54.13 53.39 1j1w s LEU 56 Cb 0.12 -3.06 0.10 0.00 0.03 0.00 0.00 46.19 43.37 1j1w s LEU 56 CO 0.60 -0.50 0.93 0.42 0.23 0.00 0.00 176.35 178.03 1j1w s THR 57 N -2.37 2.27 0.23 5.49 -4.23 -1.26 -4.94 115.64 110.83 1j1w s THR 57 Ca 0.45 -0.63 -0.08 0.00 -1.18 0.00 0.00 61.69 60.25 1j1w s THR 57 Cb -0.10 -2.64 0.23 0.00 1.34 0.00 0.00 72.50 71.33 1j1w s THR 57 CO 0.35 0.00 1.66 0.44 -0.54 0.00 0.00 174.62 176.53 1j1w h ASP 58 N -0.34 -0.23 -0.42 3.99 3.45 -1.99 -2.37 116.42 118.51 1j1w h ASP 58 Ca -0.38 0.16 0.00 0.00 0.43 0.00 0.00 57.03 57.25 1j1w h ASP 58 Cb 1.28 0.27 0.00 0.00 -0.56 0.00 0.00 39.33 40.32 1j1w h ASP 58 CO 0.44 -0.11 0.00 0.35 -1.57 0.00 0.00 179.24 178.34 1j1w n THR 59 N -5.27 0.92 0.02 0.35 -2.24 -1.26 -3.84 114.28 102.96 1j1w n THR 59 Ca 0.11 -0.68 0.01 0.00 -2.27 0.00 0.00 64.05 61.22 1j1w n THR 59 Cb 0.41 0.11 0.01 0.00 -2.10 0.00 0.00 70.33 68.76 1j1w n THR 59 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j1w n GLN 60 N 0.70 0.87 -1.73 -0.78 10.64 -0.90 -5.03 117.38 121.15 1j1w n GLN 60 Ca 0.16 -1.01 -0.29 0.00 -1.83 0.00 0.00 57.00 54.02 1j1w n GLN 60 Cb 0.51 -1.03 0.16 0.00 -0.86 0.00 0.00 30.24 29.03 1j1w n GLN 60 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.06 175.44 1j1w s LYS 61 N -0.50 0.79 -0.30 2.61 2.20 -1.20 -4.87 119.74 118.47 1j1w s LYS 61 Ca 0.02 -0.11 -0.14 0.00 -0.36 0.00 0.00 55.97 55.38 1j1w s LYS 61 Cb 0.01 -1.84 0.18 0.00 -1.51 0.00 0.00 37.83 34.67 1j1w s LYS 61 CO 0.02 -2.36 1.06 -1.50 -0.36 0.00 0.00 175.35 172.21 1j1w s ILE 62 N -3.58 -0.33 0.06 5.43 2.07 -1.26 -5.05 121.20 118.53 1j1w s ILE 62 Ca 0.69 0.00 -0.10 0.00 -1.41 0.00 0.00 60.65 59.83 1j1w s ILE 62 Cb -0.08 -1.00 -0.06 0.00 0.13 0.00 0.00 42.46 41.45 1j1w s ILE 62 CO 0.53 0.00 0.20 -1.54 -1.91 0.00 0.00 174.94 172.22 1j1w n SER 63 N 5.26 -0.38 -4.56 4.50 3.41 -1.26 -4.47 113.62 116.12 1j1w n SER 63 Ca -0.07 0.39 -0.41 0.00 -0.26 0.00 0.00 58.87 58.52 1j1w n SER 63 Cb 0.54 -0.33 -0.03 0.00 -0.26 0.00 0.00 64.21 64.13 1j1w n SER 63 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1j1w s ASP 64 N -0.30 6.44 0.19 4.04 3.68 -1.26 -4.85 116.67 124.60 1j1w s ASP 64 Ca 0.23 -1.27 0.09 0.00 2.13 0.00 0.00 52.55 53.73 1j1w s ASP 64 Cb -0.33 -2.57 0.05 0.00 -1.45 0.00 0.00 42.92 38.62 1j1w s ASP 64 CO 0.19 -1.57 1.43 0.44 0.13 0.00 0.00 175.17 175.79 1j1w h ASP 65 N 9.83 0.00 0.46 -0.34 3.32 -1.85 -2.75 116.42 125.09 1j1w h ASP 65 Ca 0.11 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 1j1w h ASP 65 Cb 1.02 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.56 1j1w h ASP 65 CO 1.40 0.81 -0.30 0.25 -1.72 0.00 0.00 179.24 179.68 1j1w h LEU 66 N 0.00 -0.76 -1.45 1.55 6.46 -1.89 0.21 115.31 119.44 1j1w h LEU 66 Ca -0.01 0.05 0.16 0.00 -0.12 0.00 0.00 57.88 57.96 1j1w h LEU 66 Cb 1.47 0.23 -0.06 0.00 -0.73 0.00 0.00 40.66 41.57 1j1w h LEU 66 CO 0.11 -0.47 0.55 0.00 -0.62 0.00 0.00 178.44 178.01 1j1w h ALA 67 N -0.26 2.02 0.10 1.25 0.00 -1.98 0.21 119.26 120.60 1j1w h ALA 67 Ca -0.05 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1j1w h ALA 67 Cb 0.61 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1j1w h ALA 67 CO 0.04 -0.25 -0.05 1.49 0.00 0.00 0.00 179.25 180.48 1j1w h GLU 68 N 0.52 -0.13 -0.71 0.00 4.81 -1.05 -3.15 114.58 114.87 1j1w h GLU 68 Ca 0.42 0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.76 1j1w h GLU 68 Cb 0.86 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 30.20 1j1w h GLU 68 CO -0.16 0.35 0.35 -0.07 -0.73 0.00 0.00 179.01 178.74 1j1w h LEU 69 N -0.72 0.45 -1.03 1.64 3.38 0.05 0.19 115.31 119.27 1j1w h LEU 69 Ca -0.01 0.06 0.32 0.00 0.09 0.00 0.00 57.88 58.34 1j1w h LEU 69 Cb 0.54 -0.01 -0.15 0.00 0.09 0.00 0.00 40.66 41.14 1j1w h LEU 69 CO 0.02 0.25 0.59 1.23 0.09 0.00 0.00 178.44 180.62 1j1w h GLY 70 N 0.59 2.01 0.06 0.83 0.00 -0.60 0.30 103.07 106.26 1j1w h GLY 70 Ca 0.36 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.45 1j1w h GLY 70 CO -0.28 -0.46 -0.01 0.50 0.00 0.00 0.00 176.54 176.29 1j1w h LYS 71 N 0.33 -0.03 -1.50 4.80 1.57 -0.97 -3.29 116.57 117.49 1j1w h LYS 71 Ca 0.73 0.00 0.44 0.00 -1.87 0.00 0.00 60.65 59.95 1j1w h LYS 71 Cb 1.68 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 33.92 1j1w h LYS 71 CO -0.58 0.62 1.07 1.25 -0.57 0.00 0.00 179.45 181.23 1j1w h LEU 72 N -0.96 0.05 -1.22 2.94 5.85 0.11 0.17 115.31 122.26 1j1w h LEU 72 Ca -0.00 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.66 1j1w h LEU 72 Cb 0.66 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 1j1w h LEU 72 CO 0.00 -0.02 -0.31 0.00 -0.34 0.00 0.00 178.44 177.78 1j1w h ALA 73 N 1.29 1.35 0.00 1.25 0.00 -0.57 -2.99 119.26 119.58 1j1w h ALA 73 Ca 0.74 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1j1w h ALA 73 Cb 2.85 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 20.57 1j1w h ALA 73 CO -0.07 0.46 -0.27 0.25 0.00 0.00 0.00 179.25 179.62 1j1w n THR 74 N -4.14 0.05 -3.19 0.00 -2.24 0.60 -4.84 114.28 100.53 1j1w n THR 74 Ca -0.01 -0.03 -0.31 0.00 -2.27 0.00 0.00 64.05 61.43 1j1w n THR 74 Cb 0.38 -0.14 -0.04 0.00 -2.10 0.00 0.00 70.33 68.43 1j1w n THR 74 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1j1w s THR 75 N -3.02 4.87 0.43 4.28 -4.23 -1.13 -4.83 115.64 112.01 1j1w s THR 75 Ca 0.12 0.49 0.11 0.00 -1.18 0.00 0.00 61.69 61.22 1j1w s THR 75 Cb 0.18 -3.68 0.21 0.00 1.34 0.00 0.00 72.50 70.54 1j1w s THR 75 CO 0.62 -0.28 2.00 -0.65 -0.54 0.00 0.00 174.62 175.77 1j1w h PRO 76 N 1.90 0.22 -0.65 3.99 0.11 -1.84 -2.97 132.00 132.76 1j1w h PRO 76 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1j1w h PRO 76 Cb 1.18 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1j1w h PRO 76 CO 0.66 0.27 0.00 -0.25 -0.21 0.00 0.00 178.00 178.47 1j1w n ASP 77 N -4.38 1.95 -4.77 -2.05 8.00 -1.26 -3.32 116.55 110.72 1j1w n ASP 77 Ca -0.01 -2.18 -0.41 0.00 0.71 0.00 0.00 54.79 52.91 1j1w n ASP 77 Cb 0.18 -0.41 -0.02 0.00 -0.02 0.00 0.00 41.12 40.86 1j1w n ASP 77 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1j1w s ALA 78 N -1.58 3.55 -0.39 2.24 0.00 -1.12 -4.91 121.76 119.54 1j1w s ALA 78 Ca 0.15 1.37 0.07 0.00 0.00 0.00 0.00 51.96 53.56 1j1w s ALA 78 Cb 0.10 -3.54 0.18 0.00 0.00 0.00 0.00 23.12 19.87 1j1w s ALA 78 CO 0.06 -0.79 0.59 1.21 0.00 0.00 0.00 175.76 176.84 1j1w s ASN 79 N -0.20 -1.21 -0.09 0.00 3.84 -1.25 -0.76 114.94 115.27 1j1w s ASN 79 Ca 0.52 -0.79 0.04 0.00 0.21 0.00 0.00 52.86 52.84 1j1w s ASN 79 Cb -0.42 1.80 -0.01 0.00 -0.55 0.00 0.00 41.25 42.07 1j1w s ASN 79 CO 0.54 -0.19 -0.22 -0.63 -2.79 0.00 0.00 177.10 173.81 1j1w s ILE 80 N 1.89 2.31 -0.38 -5.21 1.01 0.21 -1.65 121.20 119.39 1j1w s ILE 80 Ca 0.16 -0.94 -0.15 0.00 0.00 0.00 0.00 60.65 59.71 1j1w s ILE 80 Cb -0.06 -1.89 0.00 0.00 0.01 0.00 0.00 42.46 40.52 1j1w s ILE 80 CO -0.08 0.56 0.31 -0.63 0.00 0.00 0.00 174.94 175.09 1j1w s ILE 81 N 0.16 5.23 -0.29 2.92 1.01 0.15 0.82 121.20 131.19 1j1w s ILE 81 Ca -0.12 -0.37 -0.08 0.00 0.00 0.00 0.00 60.65 60.08 1j1w s ILE 81 Cb -0.16 -3.86 -0.00 0.00 0.01 0.00 0.00 42.46 38.44 1j1w s ILE 81 CO 0.07 -0.20 0.10 -0.75 0.00 0.00 0.00 174.94 174.15 1j1w s LYS 82 N 1.81 3.23 0.42 2.79 2.47 -0.42 -1.94 119.74 128.10 1j1w s LYS 82 Ca 0.07 -0.77 -0.01 0.00 -1.56 0.00 0.00 55.97 53.70 1j1w s LYS 82 Cb -0.18 -3.42 -0.02 0.00 -1.46 0.00 0.00 37.83 32.74 1j1w s LYS 82 CO 0.11 -0.40 0.65 -0.51 0.16 0.00 0.00 175.35 175.36 1j1w s LEU 83 N 1.55 3.79 0.53 5.43 1.02 -1.26 -1.70 118.68 128.03 1j1w s LEU 83 Ca 0.04 0.55 -0.22 0.00 0.02 0.00 0.00 54.13 54.51 1j1w s LEU 83 Cb -0.17 -3.43 -0.06 0.00 0.02 0.00 0.00 46.19 42.54 1j1w s LEU 83 CO 0.04 -0.50 1.19 -2.65 0.02 0.00 0.00 176.35 174.44 1j1w n PRO 84 N -2.01 1.46 -3.89 1.29 -0.02 -1.26 -4.92 135.00 125.64 1j1w n PRO 84 Ca -0.02 0.54 -0.11 0.00 -2.02 0.00 0.00 63.50 61.89 1j1w n PRO 84 Cb 0.56 -2.36 -0.11 0.00 -0.02 0.00 0.00 33.50 31.58 1j1w n PRO 84 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1j1w s ASN 85 N -0.92 0.04 0.11 2.55 4.22 -1.26 -4.31 114.94 115.37 1j1w s ASN 85 Ca 0.70 -0.17 -0.32 0.00 -2.14 0.00 0.00 52.86 50.93 1j1w s ASN 85 Cb -0.45 0.18 -0.12 0.00 1.28 0.00 0.00 41.25 42.14 1j1w s ASN 85 CO 0.51 -0.26 1.77 -0.38 -2.04 0.00 0.00 177.10 176.70 1j1w n ILE 86 N 1.93 0.27 -3.24 0.54 5.41 -1.26 -4.84 119.36 118.17 1j1w n ILE 86 Ca -0.20 -0.05 -0.46 0.00 1.00 0.00 0.00 62.75 63.04 1j1w n ILE 86 Cb 0.56 -1.93 -0.04 0.00 -0.71 0.00 0.00 39.64 37.52 1j1w n ILE 86 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 1j1w s SER 87 N 2.34 6.36 0.52 4.38 0.01 -1.26 -4.82 113.70 121.23 1j1w s SER 87 Ca 0.82 -1.95 -0.23 0.00 1.31 0.00 0.00 55.95 55.91 1j1w s SER 87 Cb -0.56 -2.25 -0.06 0.00 0.21 0.00 0.00 66.02 63.36 1j1w s SER 87 CO 0.39 -0.86 1.37 0.00 0.41 0.00 0.00 173.24 174.54 1j1w n ALA 88 N 5.28 1.67 -2.50 1.44 0.00 -1.24 -4.65 120.51 120.49 1j1w n ALA 88 Ca -0.03 0.16 -0.32 0.00 0.00 0.00 0.00 53.44 53.25 1j1w n ALA 88 Cb 0.43 -2.36 -0.15 0.00 0.00 0.00 0.00 19.45 17.37 1j1w n ALA 88 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1j1w s SER 89 N -0.79 3.45 0.17 0.00 0.15 -1.26 -0.24 113.70 115.18 1j1w s SER 89 Ca 0.69 -0.38 -0.09 0.00 0.70 0.00 0.00 55.95 56.87 1j1w s SER 89 Cb -0.43 -0.70 0.24 0.00 -1.71 0.00 0.00 66.02 63.42 1j1w s SER 89 CO 0.51 0.30 1.06 0.52 1.20 0.00 0.00 173.24 176.84 1j1w n VAL 90 N 2.57 -0.32 0.00 4.45 0.31 -1.26 -0.66 118.33 123.41 1j1w n VAL 90 Ca -0.17 1.58 0.00 0.00 -0.01 0.00 0.00 64.34 65.74 1j1w n VAL 90 Cb 0.52 -2.14 0.00 0.00 -0.91 0.00 0.00 33.84 31.31 1j1w n VAL 90 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1j1w n PRO 91 N -5.06 1.42 -0.22 5.55 -0.02 -1.26 -0.90 135.00 134.51 1j1w n PRO 91 Ca 0.09 0.00 0.18 0.00 -2.02 0.00 0.00 63.50 61.75 1j1w n PRO 91 Cb 0.31 0.00 0.29 0.00 -0.02 0.00 0.00 33.50 34.07 1j1w n PRO 91 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1j1w n GLN 92 N -0.37 -0.01 0.00 -0.52 1.13 -1.26 -1.35 117.38 115.00 1j1w n GLN 92 Ca 0.00 0.47 0.00 0.00 -1.94 0.00 0.00 57.00 55.53 1j1w n GLN 92 Cb 0.00 -0.98 0.00 0.00 0.11 0.00 0.00 30.24 29.37 1j1w n GLN 92 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1j1w n LEU 93 N -3.22 0.00 -0.01 1.08 4.77 -1.21 0.18 117.00 118.59 1j1w n LEU 93 Ca 0.17 0.23 -0.10 0.00 -0.03 0.00 0.00 56.01 56.27 1j1w n LEU 93 Cb 0.68 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.73 1j1w n LEU 93 CO 0.11 0.00 0.86 0.50 -1.33 0.00 0.00 177.39 177.52 1j1w h LYS 94 N 0.00 0.03 0.22 3.23 3.64 0.08 -2.82 116.57 120.95 1j1w h LYS 94 Ca 0.00 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1j1w h LYS 94 Cb 0.00 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1j1w h LYS 94 CO 0.00 0.02 -0.17 0.00 -2.27 0.00 0.00 179.45 177.03 1j1w h ALA 95 N 1.12 -0.95 -0.79 5.00 0.00 0.28 -2.72 119.26 121.20 1j1w h ALA 95 Ca 0.06 -0.07 0.17 0.00 0.00 0.00 0.00 54.91 55.07 1j1w h ALA 95 Cb 0.08 0.35 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 1j1w h ALA 95 CO -0.12 -0.95 0.53 0.00 0.00 0.00 0.00 179.25 178.71 1j1w h ALA 96 N -1.55 2.17 0.00 0.00 0.00 0.19 0.14 119.26 120.21 1j1w h ALA 96 Ca -0.03 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1j1w h ALA 96 Cb 0.31 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1j1w h ALA 96 CO 0.00 -0.40 -0.45 -0.84 0.00 0.00 0.00 179.25 177.56 1j1w h ILE 97 N 0.39 0.85 -0.79 0.00 -2.65 -1.39 -0.54 117.51 113.37 1j1w h ILE 97 Ca 0.39 -1.95 0.03 0.00 1.03 0.00 0.00 64.86 64.36 1j1w h ILE 97 Cb 0.96 2.24 -0.05 0.00 -2.05 0.00 0.00 36.82 37.92 1j1w h ILE 97 CO -0.13 0.44 0.50 0.50 0.03 0.00 0.00 178.15 179.50 1j1w h LYS 98 N 0.00 0.95 0.00 0.16 3.64 -0.63 -2.42 116.57 118.27 1j1w h LYS 98 Ca -0.00 -0.06 -0.17 0.00 -1.27 0.00 0.00 60.65 59.15 1j1w h LYS 98 Cb 1.20 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.78 1j1w h LYS 98 CO 0.06 0.63 -1.36 1.05 -2.27 0.00 0.00 179.45 177.56 1j1w h GLU 99 N 0.98 0.00 -0.35 1.90 4.11 -1.48 -2.86 114.58 116.88 1j1w h GLU 99 Ca 0.32 0.00 0.10 0.00 0.07 0.00 0.00 59.36 59.85 1j1w h GLU 99 Cb 0.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1j1w h GLU 99 CO -0.12 0.31 0.60 1.25 0.07 0.00 0.00 179.01 181.12 1j1w h LEU 100 N 0.00 0.00 0.00 3.06 5.85 -0.63 0.29 115.31 123.88 1j1w h LEU 100 Ca -0.15 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.57 1j1w h LEU 100 Cb 1.58 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.61 1j1w h LEU 100 CO 0.05 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.15 1j1w n GLN 101 N -3.27 0.00 -0.02 1.25 1.13 -0.96 -4.49 117.38 111.01 1j1w n GLN 101 Ca 0.07 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 55.12 1j1w n GLN 101 Cb 0.74 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 31.09 1j1w n GLN 101 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 1j1w n GLN 102 N 0.00 -0.02 0.00 -1.09 6.02 -1.08 -0.15 117.38 121.06 1j1w n GLN 102 Ca 0.00 0.28 0.00 0.00 -0.01 0.00 0.00 57.00 57.27 1j1w n GLN 102 Cb 0.00 -0.42 0.00 0.00 1.02 0.00 0.00 30.24 30.84 1j1w n GLN 102 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1j1w n GLN 103 N -2.68 0.00 0.00 -1.09 7.27 0.99 -1.50 117.38 120.37 1j1w n GLN 103 Ca 0.00 0.00 0.05 0.00 0.07 0.00 0.00 57.00 57.12 1j1w n GLN 103 Cb 0.01 0.00 -0.03 0.00 2.41 0.00 0.00 30.24 32.63 1j1w n GLN 103 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1j1w n GLY 104 N -0.18 -0.05 0.00 1.69 0.00 -1.04 -4.97 105.19 100.64 1j1w n GLY 104 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1j1w n GLY 104 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1j1w n TYR 105 N -0.78 0.00 0.00 1.61 4.02 0.78 -5.12 117.16 117.67 1j1w n TYR 105 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 1j1w n TYR 105 Cb 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.51 1j1w n TYR 105 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1j1w n LYS 106 N 0.00 2.89 -2.76 -0.72 5.02 -1.24 -4.80 118.16 116.56 1j1w n LYS 106 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.20 1j1w n LYS 106 Cb 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.08 1j1w n LYS 106 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1j1w n LEU 107 N 0.00 -0.57 0.00 -0.35 4.32 -1.26 -4.18 117.00 114.96 1j1w n LEU 107 Ca 0.00 -3.79 0.00 0.00 -0.02 0.00 0.00 56.01 52.20 1j1w n LEU 107 Cb 0.00 0.40 0.00 0.00 -1.62 0.00 0.00 43.42 42.20 1j1w n LEU 107 CO 0.00 1.88 0.00 -2.65 -1.22 0.00 0.00 177.39 175.40 1j1w n PRO 108 N -0.15 1.87 -3.92 3.23 -0.02 -1.26 -4.84 135.00 129.91 1j1w n PRO 108 Ca 0.06 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.45 1j1w n PRO 108 Cb 0.79 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 34.25 1j1w n PRO 108 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 1j1w s ASP 109 N -1.76 0.05 0.60 2.55 3.84 -1.26 -5.07 116.67 115.61 1j1w s ASP 109 Ca 0.00 -0.99 0.01 0.00 -0.00 0.00 0.00 52.55 51.57 1j1w s ASP 109 Cb 0.00 0.72 0.06 0.00 -1.38 0.00 0.00 42.92 42.32 1j1w s ASP 109 CO 0.00 -1.39 0.84 -0.31 -0.00 0.00 0.00 175.17 174.31 1j1w s TYR 110 N -3.33 2.50 0.00 2.11 1.51 -1.26 -5.05 117.35 113.82 1j1w s TYR 110 Ca 0.18 -0.09 0.00 0.00 -1.01 0.00 0.00 57.07 56.15 1j1w s TYR 110 Cb -0.03 -2.81 0.00 0.00 -0.11 0.00 0.00 41.96 39.01 1j1w s TYR 110 CO 0.11 -1.11 0.00 -2.30 -1.11 0.00 0.00 175.55 171.14 1j1w n PRO 111 N -2.48 3.68 0.00 -1.71 -0.02 -1.26 -4.69 135.00 128.52 1j1w n PRO 111 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 1j1w n PRO 111 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.08 1j1w n PRO 111 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1j1w n GLU 112 N 0.00 0.00 -2.94 -0.52 0.28 -1.26 -4.48 120.64 111.72 1j1w n GLU 112 Ca 0.00 0.00 -0.44 0.00 -0.16 0.00 0.00 57.16 56.56 1j1w n GLU 112 Cb 0.00 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 32.83 1j1w n GLU 112 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 1j1w s GLU 113 N 0.00 3.18 0.22 3.44 2.12 -1.26 -5.02 118.70 121.38 1j1w s GLU 113 Ca 0.00 -1.13 -0.30 0.00 0.36 0.00 0.00 54.97 53.90 1j1w s GLU 113 Cb 0.00 -4.36 -0.09 0.00 0.26 0.00 0.00 34.13 29.94 1j1w s GLU 113 CO 0.00 -1.74 1.33 -2.14 -0.54 0.00 0.00 175.26 172.17 1j1w s PRO 114 N 3.45 4.37 0.00 4.30 0.02 -1.26 -4.91 135.00 140.96 1j1w s PRO 114 Ca 0.21 2.11 0.00 0.00 0.02 0.00 0.00 61.00 63.34 1j1w s PRO 114 Cb -0.17 -3.17 0.00 0.00 0.02 0.00 0.00 34.50 31.18 1j1w s PRO 114 CO 0.06 -0.28 0.19 1.63 -0.33 0.00 0.00 177.00 178.27 1j1w n LYS 115 N 2.47 1.28 -4.20 5.54 4.76 -1.26 -4.90 118.16 121.85 1j1w n LYS 115 Ca 0.06 -0.19 -0.19 0.00 -2.87 0.00 0.00 58.31 55.13 1j1w n LYS 115 Cb 0.42 -0.61 -0.12 0.00 -1.84 0.00 0.00 35.03 32.88 1j1w n LYS 115 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1j1w s THR 116 N -0.24 1.10 0.64 -0.18 -4.23 -1.26 -5.01 115.64 106.47 1j1w s THR 116 Ca 0.00 -1.24 0.27 0.00 -1.18 0.00 0.00 61.69 59.55 1j1w s THR 116 Cb 0.00 -1.05 0.30 0.00 1.34 0.00 0.00 72.50 73.09 1j1w s THR 116 CO 0.00 -0.18 1.84 0.44 -0.54 0.00 0.00 174.62 176.18 1j1w h ASP 117 N 4.43 0.00 0.21 3.99 3.45 -1.99 0.28 116.42 126.78 1j1w h ASP 117 Ca -0.40 0.00 -0.35 0.00 0.43 0.00 0.00 57.03 56.71 1j1w h ASP 117 Cb 1.19 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.97 1j1w h ASP 117 CO 0.41 0.00 -1.71 0.74 -1.57 0.00 0.00 179.24 177.11 1j1w h THR 118 N 0.00 0.99 -0.59 0.35 2.02 -1.99 -2.93 112.91 110.77 1j1w h THR 118 Ca 0.07 -2.55 -0.09 0.00 0.77 0.00 0.00 66.41 64.61 1j1w h THR 118 Cb 0.95 2.81 -0.02 0.00 -1.74 0.00 0.00 68.15 70.14 1j1w h THR 118 CO -0.00 0.85 0.00 -0.33 0.37 0.00 0.00 175.52 176.41 1j1w h GLU 119 N 0.11 1.02 0.04 6.66 5.08 -0.93 -1.90 114.58 124.65 1j1w h GLU 119 Ca -0.33 -0.31 -0.00 0.00 -1.00 0.00 0.00 59.36 57.72 1j1w h GLU 119 Cb 2.11 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 31.26 1j1w h GLU 119 CO 0.19 0.99 -0.02 0.87 -1.00 0.00 0.00 179.01 180.05 1j1w h LYS 120 N 0.93 -0.05 -0.67 2.33 1.57 -1.21 0.27 116.57 119.75 1j1w h LYS 120 Ca 0.17 0.00 0.11 0.00 -1.87 0.00 0.00 60.65 59.06 1j1w h LYS 120 Cb 0.54 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.81 1j1w h LYS 120 CO 0.03 0.18 0.45 -0.44 -0.57 0.00 0.00 179.45 179.10 1j1w h ASP 121 N -0.27 0.41 0.08 0.86 5.19 -1.42 -1.13 116.42 120.14 1j1w h ASP 121 Ca -0.00 0.01 -0.11 0.00 -0.62 0.00 0.00 57.03 56.31 1j1w h ASP 121 Cb 0.25 -0.07 0.01 0.00 0.18 0.00 0.00 39.33 39.70 1j1w h ASP 121 CO 0.01 0.24 -0.47 0.58 -3.12 0.00 0.00 179.24 176.47 1j1w h VAL 122 N 0.45 1.62 -0.73 -1.35 2.07 -1.03 -3.15 116.25 114.13 1j1w h VAL 122 Ca 0.32 -2.42 0.00 0.00 0.82 0.00 0.00 66.70 65.42 1j1w h VAL 122 Cb 0.62 3.23 -0.04 0.00 -1.52 0.00 0.00 31.29 33.59 1j1w h VAL 122 CO -0.10 0.66 0.46 0.50 0.02 0.00 0.00 177.57 179.11 1j1w h LYS 123 N -0.60 0.98 -0.34 1.57 3.11 -0.24 -0.62 116.57 120.42 1j1w h LYS 123 Ca -0.08 -0.07 -0.03 0.00 -2.81 0.00 0.00 60.65 57.65 1j1w h LYS 123 Cb 1.36 -0.21 -0.02 0.00 -1.00 0.00 0.00 32.23 32.36 1j1w h LYS 123 CO 0.09 0.67 0.07 0.00 -2.81 0.00 0.00 179.45 177.47 1j1w h ALA 124 N 1.50 1.49 0.15 5.00 0.00 -1.31 -1.45 119.26 124.65 1j1w h ALA 124 Ca 0.26 -0.15 -0.31 0.00 0.00 0.00 0.00 54.91 54.72 1j1w h ALA 124 Cb -0.07 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1j1w h ALA 124 CO -0.05 0.38 -1.46 0.00 0.00 0.00 0.00 179.25 178.11 1j1w h ARG 125 N 0.49 0.31 -0.28 0.00 3.08 -1.20 -3.31 114.38 113.48 1j1w h ARG 125 Ca 0.11 -0.53 -0.12 0.00 0.07 0.00 0.00 59.98 59.51 1j1w h ARG 125 Cb 0.21 0.20 -0.00 0.00 0.08 0.00 0.00 29.97 30.46 1j1w h ARG 125 CO -0.00 1.21 -0.29 1.88 -1.07 0.00 0.00 179.97 181.70 1j1w h TYR 126 N 0.09 0.83 -0.87 3.04 0.99 -1.11 -3.08 116.97 116.86 1j1w h TYR 126 Ca -0.22 -0.25 0.23 0.00 2.00 0.00 0.00 58.73 60.48 1j1w h TYR 126 Cb 2.04 -0.17 -0.13 0.00 1.00 0.00 0.00 36.73 39.46 1j1w h TYR 126 CO 0.08 1.00 0.28 -0.44 -0.00 0.00 0.00 178.16 179.07 1j1w h ASP 127 N 0.43 0.10 0.18 3.88 3.32 -1.37 1.49 116.42 124.45 1j1w h ASP 127 Ca 0.04 0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.27 1j1w h ASP 127 Cb 0.86 0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1j1w h ASP 127 CO 0.07 -0.11 0.00 0.11 -1.72 0.00 0.00 179.24 177.60 1j1w h LYS 128 N 0.26 0.00 0.04 3.56 1.57 -1.62 -2.56 116.57 117.82 1j1w h LYS 128 Ca 0.55 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 59.01 1j1w h LYS 128 Cb 1.08 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.35 1j1w h LYS 128 CO -0.61 0.00 -1.86 -0.89 -0.57 0.00 0.00 179.45 175.53 1j1w n ILE 129 N -2.58 1.65 -1.70 1.86 2.08 0.50 -4.84 119.36 116.34 1j1w n ILE 129 Ca -0.01 -0.75 -0.30 0.00 0.56 0.00 0.00 62.75 62.25 1j1w n ILE 129 Cb 0.09 -1.22 0.18 0.00 -0.75 0.00 0.00 39.64 37.95 1j1w n ILE 129 CO 0.00 0.00 0.00 -1.59 0.56 0.00 0.00 176.55 175.52 1j1w s LYS 130 N -2.58 0.46 1.82 0.38 -2.85 -0.86 -4.75 119.74 111.36 1j1w s LYS 130 Ca -0.11 -0.19 0.00 0.00 -1.00 0.00 0.00 55.97 54.67 1j1w s LYS 130 Cb 0.07 -1.80 0.00 0.00 -2.06 0.00 0.00 37.83 34.04 1j1w s LYS 130 CO 0.80 -2.57 0.00 0.41 0.10 0.00 0.00 175.35 174.09 1j1w n GLY 131 N -2.94 -1.28 3.44 0.59 0.00 0.67 -4.48 105.19 101.19 1j1w n GLY 131 Ca 0.13 -1.24 -0.44 0.00 0.00 0.00 0.00 46.02 44.47 1j1w n GLY 131 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1j1w s SER 132 N -4.00 6.37 -0.14 1.61 0.15 -1.25 -3.67 113.70 112.77 1j1w s SER 132 Ca 0.00 -1.53 0.14 0.00 0.70 0.00 0.00 55.95 55.26 1j1w s SER 132 Cb 0.00 -2.39 -0.20 0.00 -1.71 0.00 0.00 66.02 61.73 1j1w s SER 132 CO 0.00 -1.22 0.08 0.00 1.20 0.00 0.00 173.24 173.31 1j1w n ALA 133 N 6.93 1.71 -0.00 5.45 0.00 -1.26 -4.57 120.51 128.77 1j1w n ALA 133 Ca 0.07 -0.96 0.00 0.00 0.00 0.00 0.00 53.44 52.54 1j1w n ALA 133 Cb 0.46 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.79 1j1w n ALA 133 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1j1w n VAL 134 N -2.53 0.00 -0.23 0.00 0.31 -1.26 -4.23 118.33 110.39 1j1w n VAL 134 Ca -0.23 0.65 -0.07 0.00 -0.01 0.00 0.00 64.34 64.68 1j1w n VAL 134 Cb 0.95 -1.65 -0.02 0.00 -0.91 0.00 0.00 33.84 32.21 1j1w n VAL 134 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 1j1w h ASN 135 N 0.00 -1.45 -1.07 4.52 2.35 -1.98 -0.44 115.58 117.52 1j1w h ASN 135 Ca 0.00 0.25 0.29 0.00 -0.55 0.00 0.00 56.30 56.29 1j1w h ASN 135 Cb 0.00 0.68 -0.08 0.00 0.05 0.00 0.00 38.32 38.97 1j1w h ASN 135 CO 0.00 -0.32 0.72 -0.65 -1.65 0.00 0.00 177.43 175.53 1j1w h PRO 136 N -0.18 0.26 0.00 0.81 0.11 -1.81 0.12 132.00 131.31 1j1w h PRO 136 Ca 0.20 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.30 1j1w h PRO 136 Cb 0.56 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.61 1j1w h PRO 136 CO -0.72 0.17 0.00 0.28 -0.21 0.00 0.00 178.00 177.52 1j1w n VAL 137 N -4.50 0.00 -0.33 3.15 0.31 -0.21 -3.90 118.33 112.85 1j1w n VAL 137 Ca 0.25 0.86 0.26 0.00 -0.01 0.00 0.00 64.34 65.70 1j1w n VAL 137 Cb 0.99 -1.71 0.49 0.00 -0.91 0.00 0.00 33.84 32.71 1j1w n VAL 137 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1j1w h LEU 138 N 0.00 0.39 -7.11 7.52 3.38 -1.13 -3.34 115.31 115.03 1j1w h LEU 138 Ca 0.00 0.22 -0.53 0.00 0.09 0.00 0.00 57.88 57.66 1j1w h LEU 138 Cb 0.00 0.20 0.01 0.00 0.09 0.00 0.00 40.66 40.96 1j1w h LEU 138 CO 0.00 -0.24 1.81 0.54 0.09 0.00 0.00 178.44 180.63 1j1w n ARG 139 N -5.14 1.57 -2.72 1.13 1.74 0.00 -4.77 116.66 108.47 1j1w n ARG 139 Ca 0.33 -2.12 -0.40 0.00 -0.77 0.00 0.00 57.85 54.89 1j1w n ARG 139 Cb 1.06 -3.25 0.01 0.00 -1.02 0.00 0.00 32.46 29.26 1j1w n ARG 139 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1j1w n GLU 140 N 7.55 5.14 0.00 5.56 -0.58 -1.26 -3.88 120.64 133.17 1j1w n GLU 140 Ca 0.48 -4.67 0.00 0.00 -0.42 0.00 0.00 57.16 52.55 1j1w n GLU 140 Cb 0.43 -2.46 0.00 0.00 -0.57 0.00 0.00 31.44 28.84 1j1w n GLU 140 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1j1w n GLY 141 N 0.11 -1.01 3.85 0.62 0.00 -1.26 -0.96 105.19 106.54 1j1w n GLY 141 Ca 0.43 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 45.04 1j1w n GLY 141 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1j1w s ASN 142 N 0.00 6.03 0.50 1.61 0.01 -1.26 -2.43 114.94 119.41 1j1w s ASN 142 Ca 0.00 0.22 -0.20 0.00 -0.71 0.00 0.00 52.86 52.17 1j1w s ASN 142 Cb 0.00 -1.81 -0.08 0.00 0.41 0.00 0.00 41.25 39.78 1j1w s ASN 142 CO 0.00 0.24 1.06 -0.55 -1.51 0.00 0.00 177.10 176.34 1j1w s SER 143 N -2.02 6.17 -0.35 -1.22 0.15 -0.58 -3.87 113.70 111.97 1j1w s SER 143 Ca 0.27 1.98 0.02 0.00 0.70 0.00 0.00 55.95 58.93 1j1w s SER 143 Cb -0.12 -2.56 0.15 0.00 -1.71 0.00 0.00 66.02 61.77 1j1w s SER 143 CO 0.19 -0.90 0.36 -0.62 1.20 0.00 0.00 173.24 173.47 1j1w s ASP 144 N -1.96 1.28 -0.04 5.45 2.15 -1.04 -2.13 116.67 120.38 1j1w s ASP 144 Ca 0.68 -1.41 0.01 0.00 0.43 0.00 0.00 52.55 52.26 1j1w s ASP 144 Cb -0.18 0.54 -0.03 0.00 -0.30 0.00 0.00 42.92 42.95 1j1w s ASP 144 CO 0.22 -0.29 -0.02 -0.13 -0.17 0.00 0.00 175.17 174.78 1j1w s ARG 145 N 1.62 2.80 -0.29 4.34 0.52 -1.08 -1.81 118.95 125.05 1j1w s ARG 145 Ca 0.15 -0.55 -0.16 0.00 -0.52 0.00 0.00 55.73 54.65 1j1w s ARG 145 Cb -0.15 -2.66 0.16 0.00 0.52 0.00 0.00 34.95 32.82 1j1w s ARG 145 CO -0.09 0.65 1.05 -0.98 0.02 0.00 0.00 175.30 175.95 1j1w s ARG 146 N -1.18 0.29 -0.09 3.54 1.70 -0.23 -2.12 118.95 120.86 1j1w s ARG 146 Ca 0.16 0.50 -0.30 0.00 -0.47 0.00 0.00 55.73 55.63 1j1w s ARG 146 Cb -0.11 0.06 -0.04 0.00 -0.57 0.00 0.00 34.95 34.29 1j1w s ARG 146 CO 0.06 -0.06 1.40 0.00 -1.08 0.00 0.00 175.30 175.62 1j1w s ALA 147 N 1.28 3.62 0.25 7.88 0.00 -1.26 -2.71 121.76 130.81 1j1w s ALA 147 Ca -0.09 0.71 -0.31 0.00 0.00 0.00 0.00 51.96 52.27 1j1w s ALA 147 Cb -0.03 -3.64 -0.11 0.00 0.00 0.00 0.00 23.12 19.33 1j1w s ALA 147 CO -0.14 -1.14 1.60 -2.14 0.00 0.00 0.00 175.76 173.95 1j1w s PRO 148 N 3.28 4.15 0.01 0.00 0.02 -1.26 -4.71 135.00 136.49 1j1w s PRO 148 Ca 0.62 2.52 -0.02 0.00 0.02 0.00 0.00 61.00 64.15 1j1w s PRO 148 Cb -0.28 -3.07 -0.00 0.00 0.02 0.00 0.00 34.50 31.17 1j1w s PRO 148 CO 0.22 -0.63 0.56 -0.11 -0.33 0.00 0.00 177.00 176.71 1j1w n LEU 149 N 2.94 -0.05 -0.24 -5.54 7.94 -1.26 0.59 117.00 121.38 1j1w n LEU 149 Ca 0.11 0.57 0.03 0.00 -1.11 0.00 0.00 56.01 55.61 1j1w n LEU 149 Cb 0.37 -0.25 0.07 0.00 0.53 0.00 0.00 43.42 44.14 1j1w n LEU 149 CO 0.63 -0.31 0.42 -1.54 -1.11 0.00 0.00 177.39 175.48 1j1w n SER 150 N -2.73 -0.29 -0.14 1.96 3.41 -1.26 0.13 113.62 114.69 1j1w n SER 150 Ca 0.00 1.14 -0.08 0.00 -0.26 0.00 0.00 58.87 59.67 1j1w n SER 150 Cb 0.01 -0.32 0.00 0.00 -0.26 0.00 0.00 64.21 63.64 1j1w n SER 150 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1j1w h VAL 151 N 0.00 1.17 -0.91 -3.33 2.07 -0.20 0.67 116.25 115.71 1j1w h VAL 151 Ca 0.29 -0.45 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 1j1w h VAL 151 Cb 0.46 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 1j1w h VAL 151 CO -0.67 0.18 0.50 0.50 0.02 0.00 0.00 177.57 178.09 1j1w h LYS 152 N 0.56 1.26 -0.07 1.57 1.63 0.17 0.85 116.57 122.55 1j1w h LYS 152 Ca 0.15 -0.15 -0.12 0.00 -0.85 0.00 0.00 60.65 59.69 1j1w h LYS 152 Cb 0.08 -0.25 -0.01 0.00 -0.60 0.00 0.00 32.23 31.45 1j1w h LYS 152 CO -0.02 0.92 -0.48 -0.91 -3.45 0.00 0.00 179.45 175.51 1j1w h ASN 153 N 1.27 0.19 -0.08 4.20 2.35 0.79 -0.01 115.58 124.28 1j1w h ASN 153 Ca 0.32 -0.09 -0.02 0.00 -0.55 0.00 0.00 56.30 55.97 1j1w h ASN 153 Cb 0.03 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.34 1j1w h ASN 153 CO -0.05 0.64 -0.01 0.22 -1.65 0.00 0.00 177.43 176.58 1j1w h TYR 154 N 0.14 0.17 -0.99 1.19 3.20 0.10 -2.83 116.97 117.96 1j1w h TYR 154 Ca 0.01 -0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.89 1j1w h TYR 154 Cb 0.91 -0.04 -0.06 0.00 1.54 0.00 0.00 36.73 39.07 1j1w h TYR 154 CO 0.01 0.45 0.64 0.00 -1.64 0.00 0.00 178.16 177.62 1j1w h ALA 155 N 0.70 1.34 -0.16 1.82 0.00 -0.62 -0.00 119.26 122.34 1j1w h ALA 155 Ca 0.02 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1j1w h ALA 155 Cb 0.39 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1j1w h ALA 155 CO 0.01 0.49 -0.15 0.00 0.00 0.00 0.00 179.25 179.60 1j1w h ARG 156 N 1.21 0.26 -0.00 0.00 3.08 -0.88 -2.67 114.38 115.38 1j1w h ARG 156 Ca 0.41 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.39 1j1w h ARG 156 Cb 0.07 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1j1w h ARG 156 CO -0.14 0.41 -0.85 1.63 -1.07 0.00 0.00 179.97 179.95 1j1w n LYS 157 N -4.25 0.51 -3.03 0.04 4.76 -0.94 -4.41 118.16 110.84 1j1w n LYS 157 Ca -0.01 -0.21 -0.20 0.00 -2.87 0.00 0.00 58.31 55.02 1j1w n LYS 157 Cb 0.29 -1.46 -0.02 0.00 -1.84 0.00 0.00 35.03 32.00 1j1w n LYS 157 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1j1w n HIS 158 N -1.16 1.53 -1.61 2.13 8.25 -0.06 -5.10 115.22 119.20 1j1w n HIS 158 Ca 0.05 -3.72 -0.49 0.00 -0.26 0.00 0.00 57.72 53.30 1j1w n HIS 158 Cb 0.35 -0.42 -0.05 0.00 1.12 0.00 0.00 29.99 30.99 1j1w n HIS 158 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1j1w n PRO 159 N 0.06 1.44 -2.96 -0.41 -0.02 -1.01 -4.73 135.00 127.37 1j1w n PRO 159 Ca 0.26 0.52 -0.35 0.00 -2.02 0.00 0.00 63.50 61.90 1j1w n PRO 159 Cb 0.60 -2.14 -0.06 0.00 -0.02 0.00 0.00 33.50 31.88 1j1w n PRO 159 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1j1w s HIS 160 N 0.26 3.54 0.61 6.00 -3.43 -1.26 -5.00 115.29 116.01 1j1w s HIS 160 Ca 0.78 1.52 -0.18 0.00 -0.80 0.00 0.00 55.06 56.37 1j1w s HIS 160 Cb -0.83 -2.74 -0.04 0.00 -1.43 0.00 0.00 32.58 27.53 1j1w s HIS 160 CO 0.47 0.16 0.99 0.36 -2.00 0.00 0.00 174.74 174.73 1j1w n LYS 161 N 0.18 0.91 -3.94 -0.38 2.85 -1.26 -4.95 118.16 111.58 1j1w n LYS 161 Ca 0.02 0.36 -0.21 0.00 -1.05 0.00 0.00 58.31 57.42 1j1w n LYS 161 Cb 0.52 -2.20 -0.17 0.00 -0.65 0.00 0.00 35.03 32.53 1j1w n LYS 161 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 177.40 175.71 1j1w s MET 162 N -2.81 0.66 0.23 -1.58 -1.94 -1.26 -5.07 119.30 107.53 1j1w s MET 162 Ca 0.76 0.02 -0.32 0.00 -1.71 0.00 0.00 55.69 54.45 1j1w s MET 162 Cb -0.41 -0.87 -0.13 0.00 2.01 0.00 0.00 34.83 35.43 1j1w s MET 162 CO 0.46 -0.20 1.52 0.41 -0.01 0.00 0.00 175.02 177.21 1j1w n GLY 163 N 4.61 1.07 3.77 -0.03 0.00 -0.84 -4.92 105.19 108.85 1j1w n GLY 163 Ca -0.16 0.54 -0.40 0.00 0.00 0.00 0.00 46.02 45.99 1j1w n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j1w s ALA 164 N 0.29 3.38 -0.15 4.61 0.00 -1.26 -4.37 121.76 124.26 1j1w s ALA 164 Ca 0.70 1.23 -0.04 0.00 0.00 0.00 0.00 51.96 53.85 1j1w s ALA 164 Cb -0.60 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.01 1j1w s ALA 164 CO 0.45 -0.71 -0.01 -1.58 0.00 0.00 0.00 175.76 173.92 1j1w s TRP 165 N -1.21 3.11 -0.18 0.00 0.52 -1.26 -4.43 118.94 115.49 1j1w s TRP 165 Ca 0.53 -0.10 -0.08 0.00 0.02 0.00 0.00 56.10 56.46 1j1w s TRP 165 Cb -0.38 -1.95 -0.04 0.00 -1.15 0.00 0.00 33.47 29.94 1j1w s TRP 165 CO 0.50 0.12 0.08 0.45 0.02 0.00 0.00 176.95 178.12 1j1w s SER 166 N 0.10 5.81 0.32 2.95 0.15 -1.26 -4.81 113.70 116.95 1j1w s SER 166 Ca 0.01 0.14 0.25 0.00 0.70 0.00 0.00 55.95 57.05 1j1w s SER 166 Cb -0.13 -1.99 1.11 0.00 -1.71 0.00 0.00 66.02 63.30 1j1w s SER 166 CO 0.02 0.19 1.76 0.00 1.20 0.00 0.00 173.24 176.41 1j1w h ALA 167 N 6.60 1.00 -0.93 5.45 0.00 -1.89 -2.66 119.26 126.83 1j1w h ALA 167 Ca -0.39 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 53.88 1j1w h ALA 167 Cb 1.16 0.00 -0.34 0.00 0.00 0.00 0.00 17.79 18.61 1j1w h ALA 167 CO 0.71 0.00 0.24 -0.40 0.00 0.00 0.00 179.25 179.81 1j1w n ASP 168 N -2.38 6.63 -4.81 0.00 5.68 -1.26 -4.89 116.55 115.52 1j1w n ASP 168 Ca 0.01 -3.78 -0.34 0.00 -0.50 0.00 0.00 54.79 50.18 1j1w n ASP 168 Cb 0.20 -0.74 -0.06 0.00 -1.14 0.00 0.00 41.12 39.38 1j1w n ASP 168 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1j1w s SER 169 N -2.46 6.80 0.04 -1.12 0.15 -1.00 -4.98 113.70 111.13 1j1w s SER 169 Ca 0.59 1.80 0.14 0.00 0.70 0.00 0.00 55.95 59.17 1j1w s SER 169 Cb 0.47 -2.55 -0.17 0.00 -1.71 0.00 0.00 66.02 62.06 1j1w s SER 169 CO -0.02 -0.45 0.87 0.11 1.20 0.00 0.00 173.24 174.94 1j1w h LYS 170 N 2.00 0.00 -6.48 5.44 1.79 -1.94 -3.48 116.57 113.89 1j1w h LYS 170 Ca -0.49 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 57.41 1j1w h LYS 170 Cb 1.19 0.00 0.18 0.00 -1.58 0.00 0.00 32.23 32.02 1j1w h LYS 170 CO 0.61 0.48 -0.51 0.43 -1.08 0.00 0.00 179.45 179.38 1j1w n SER 171 N -3.04 -1.49 -3.66 0.86 7.64 -1.26 -4.83 113.62 107.84 1j1w n SER 171 Ca -0.10 0.67 0.03 0.00 1.01 0.00 0.00 58.87 60.47 1j1w n SER 171 Cb 0.93 -1.14 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 1j1w n SER 171 CO 0.00 0.00 0.00 -1.38 -3.01 0.00 0.00 175.04 170.65 1j1w s HIS 172 N -1.81 -0.01 -0.10 1.43 -3.43 -0.86 -4.96 115.29 105.55 1j1w s HIS 172 Ca 0.66 -0.06 -0.01 0.00 -0.80 0.00 0.00 55.06 54.85 1j1w s HIS 172 Cb -0.41 0.53 -0.03 0.00 -1.43 0.00 0.00 32.58 31.24 1j1w s HIS 172 CO 0.57 -0.18 -0.05 0.08 -2.00 0.00 0.00 174.74 173.17 1j1w s VAL 173 N -2.20 3.87 -0.17 -5.38 1.01 -1.26 -0.94 120.40 115.33 1j1w s VAL 173 Ca 0.18 -0.40 -0.02 0.00 0.00 0.00 0.00 61.98 61.74 1j1w s VAL 173 Cb 0.04 -2.62 -0.01 0.00 0.00 0.00 0.00 36.38 33.79 1j1w s VAL 173 CO -0.04 0.57 -0.09 0.00 0.00 0.00 0.00 175.10 175.54 1j1w s ALA 174 N -0.49 2.71 0.05 5.51 0.00 0.12 -4.92 121.76 124.74 1j1w s ALA 174 Ca 0.08 -1.01 0.01 0.00 0.00 0.00 0.00 51.96 51.04 1j1w s ALA 174 Cb -0.12 -1.43 -0.03 0.00 0.00 0.00 0.00 23.12 21.54 1j1w s ALA 174 CO 0.02 -0.05 -0.06 -3.38 0.00 0.00 0.00 175.76 172.29 1j1w s HIS 175 N 0.84 0.61 0.76 0.00 -3.43 -1.26 -1.17 115.29 111.65 1j1w s HIS 175 Ca -0.03 -0.68 -0.14 0.00 -0.80 0.00 0.00 55.06 53.41 1j1w s HIS 175 Cb -0.15 -0.38 0.06 0.00 -1.43 0.00 0.00 32.58 30.68 1j1w s HIS 175 CO 0.01 -0.16 1.19 -1.64 -2.00 0.00 0.00 174.74 172.14 1j1w s MET 176 N -2.39 1.97 -0.11 -0.38 -1.94 -0.51 -4.96 119.30 110.98 1j1w s MET 176 Ca -0.04 1.71 0.14 0.00 -1.71 0.00 0.00 55.69 55.78 1j1w s MET 176 Cb -0.04 -1.82 -0.19 0.00 2.01 0.00 0.00 34.83 34.79 1j1w s MET 176 CO -0.03 -1.95 0.13 -0.25 -0.01 0.00 0.00 175.02 172.91 1j1w n ASP 177 N -2.99 1.44 -4.23 3.03 8.00 -1.26 -4.80 116.55 115.74 1j1w n ASP 177 Ca 0.13 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.50 1j1w n ASP 177 Cb 0.51 1.08 -0.10 0.00 -0.02 0.00 0.00 41.12 42.58 1j1w n ASP 177 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1j1w s ASN 178 N -4.52 1.09 -0.76 -2.24 4.22 -1.26 -4.99 114.94 106.49 1j1w s ASN 178 Ca -0.07 -1.18 -0.05 0.00 -2.14 0.00 0.00 52.86 49.43 1j1w s ASN 178 Cb 0.06 0.14 0.01 0.00 1.28 0.00 0.00 41.25 42.74 1j1w s ASN 178 CO 0.61 -0.59 0.63 0.61 -2.04 0.00 0.00 177.10 176.31 1j1w n GLY 179 N -0.22 -1.14 1.94 0.45 0.00 -1.26 -4.94 105.19 100.02 1j1w n GLY 179 Ca -0.06 0.67 -0.10 0.00 0.00 0.00 0.00 46.02 46.52 1j1w n GLY 179 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1j1w n ASP 180 N -2.15 -0.59 0.38 1.61 5.75 -1.26 -3.47 116.55 116.82 1j1w n ASP 180 Ca -0.23 -2.22 -0.18 0.00 -0.01 0.00 0.00 54.79 52.15 1j1w n ASP 180 Cb 0.66 1.21 -0.09 0.00 -1.03 0.00 0.00 41.12 41.87 1j1w n ASP 180 CO 0.00 0.00 0.00 -0.26 -0.11 0.00 0.00 177.20 176.83 1j1w h PHE 181 N 1.62 -1.19 -0.27 2.11 -1.00 -1.95 0.12 116.94 116.38 1j1w h PHE 181 Ca -0.15 -0.01 0.03 0.00 2.81 0.00 0.00 57.97 60.65 1j1w h PHE 181 Cb 0.71 0.43 -0.04 0.00 3.61 0.00 0.00 35.95 40.65 1j1w h PHE 181 CO 0.00 -0.66 -0.24 -0.92 -1.61 0.00 0.00 178.31 174.89 1j1w h TYR 182 N -1.07 -0.74 0.00 -0.55 3.20 -1.96 0.86 116.97 116.71 1j1w h TYR 182 Ca -0.09 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.82 1j1w h TYR 182 Cb 0.86 0.36 0.00 0.00 1.54 0.00 0.00 36.73 39.49 1j1w h TYR 182 CO -0.09 -0.18 0.00 0.78 -1.64 0.00 0.00 178.16 177.02 1j1w h GLY 183 N -0.10 0.00 0.41 1.82 0.00 -1.94 -2.88 103.07 100.38 1j1w h GLY 183 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1j1w h GLY 183 CO -0.30 0.00 -1.20 -1.26 0.00 0.00 0.00 176.54 173.77 1j1w n SER 184 N -2.29 0.57 -3.95 0.19 2.88 0.40 -4.82 113.62 106.60 1j1w n SER 184 Ca -0.01 -0.27 -0.36 0.00 -1.33 0.00 0.00 58.87 56.90 1j1w n SER 184 Cb 0.05 1.03 0.02 0.00 -0.75 0.00 0.00 64.21 64.57 1j1w n SER 184 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1j1w n GLU 185 N -1.98 0.00 -3.20 -1.46 2.13 -0.74 -4.67 120.64 110.72 1j1w n GLU 185 Ca 0.01 0.00 0.04 0.00 0.66 0.00 0.00 57.16 57.87 1j1w n GLU 185 Cb 0.45 -0.94 -0.02 0.00 0.27 0.00 0.00 31.44 31.20 1j1w n GLU 185 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1j1w s LYS 186 N -1.18 0.46 0.32 5.31 1.02 -0.92 -4.83 119.74 119.92 1j1w s LYS 186 Ca 0.50 0.86 0.08 0.00 0.02 0.00 0.00 55.97 57.42 1j1w s LYS 186 Cb -0.39 0.48 -0.03 0.00 -0.52 0.00 0.00 37.83 37.36 1j1w s LYS 186 CO 0.66 -0.46 0.22 0.00 -0.92 0.00 0.00 175.35 174.85 1j1w s ALA 187 N 2.87 3.67 -0.12 5.17 0.00 -1.26 -1.03 121.76 131.05 1j1w s ALA 187 Ca 0.12 -1.66 -0.16 0.00 0.00 0.00 0.00 51.96 50.26 1j1w s ALA 187 Cb -0.13 -1.05 0.04 0.00 0.00 0.00 0.00 23.12 21.98 1j1w s ALA 187 CO -0.18 0.07 0.42 0.00 0.00 0.00 0.00 175.76 176.06 1j1w s ALA 188 N -2.31 -1.04 -0.45 0.00 0.00 0.23 -4.95 121.76 113.24 1j1w s ALA 188 Ca 0.38 1.03 -0.16 0.00 0.00 0.00 0.00 51.96 53.22 1j1w s ALA 188 Cb -0.05 -0.51 0.05 0.00 0.00 0.00 0.00 23.12 22.61 1j1w s ALA 188 CO 0.25 -0.22 0.38 -1.17 0.00 0.00 0.00 175.76 175.00 1j1w s LEU 189 N -0.16 5.36 0.20 0.00 2.96 -1.26 -0.82 118.68 124.96 1j1w s LEU 189 Ca -0.03 -1.12 -0.32 0.00 -0.22 0.00 0.00 54.13 52.44 1j1w s LEU 189 Cb -0.03 -2.21 -0.12 0.00 0.50 0.00 0.00 46.19 44.33 1j1w s LEU 189 CO 0.02 -0.59 1.72 -0.38 -1.32 0.00 0.00 176.35 175.80 1j1w n ILE 190 N 5.23 0.04 -0.10 6.68 2.08 -0.05 -4.94 119.36 128.30 1j1w n ILE 190 Ca -0.11 -0.01 -0.15 0.00 0.56 0.00 0.00 62.75 63.04 1j1w n ILE 190 Cb 0.45 -1.96 -0.06 0.00 -0.75 0.00 0.00 39.64 37.32 1j1w n ILE 190 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1j1w n GLY 191 N 3.95 -0.75 3.56 7.39 0.00 -1.26 -2.05 105.19 116.03 1j1w n GLY 191 Ca 0.16 -0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 1j1w n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j1w s ALA 192 N -2.62 2.90 -0.13 4.61 0.00 -1.26 -4.44 121.76 120.83 1j1w s ALA 192 Ca -0.26 -1.09 -0.29 0.00 0.00 0.00 0.00 51.96 50.32 1j1w s ALA 192 Cb 0.06 -1.00 -0.06 0.00 0.00 0.00 0.00 23.12 22.12 1j1w s ALA 192 CO 0.42 0.61 2.09 -2.14 0.00 0.00 0.00 175.76 176.74 1j1w s PRO 193 N -1.52 3.53 0.00 0.00 0.02 -1.26 -4.69 135.00 131.08 1j1w s PRO 193 Ca 0.17 2.21 0.00 0.00 0.02 0.00 0.00 61.00 63.40 1j1w s PRO 193 Cb -0.11 -4.28 0.00 0.00 0.02 0.00 0.00 34.50 30.13 1j1w s PRO 193 CO 0.08 -1.65 0.00 0.41 -0.33 0.00 0.00 177.00 175.51 1j1w n GLY 194 N 5.26 3.02 3.40 0.52 0.00 -0.67 -5.02 105.19 111.70 1j1w n GLY 194 Ca 0.26 0.04 -0.13 0.00 0.00 0.00 0.00 46.02 46.18 1j1w n GLY 194 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1j1w s SER 195 N 2.00 -0.47 0.11 1.61 1.04 -1.26 -2.00 113.70 114.73 1j1w s SER 195 Ca 0.00 0.06 0.07 0.00 0.48 0.00 0.00 55.95 56.56 1j1w s SER 195 Cb 0.00 0.53 -0.04 0.00 0.10 0.00 0.00 66.02 66.62 1j1w s SER 195 CO 0.00 -0.83 -0.18 0.68 0.98 0.00 0.00 173.24 173.89 1j1w s VAL 196 N -3.09 1.52 -0.12 5.02 -7.23 -0.06 -2.16 120.40 114.27 1j1w s VAL 196 Ca -0.02 -1.58 -0.01 0.00 -1.81 0.00 0.00 61.98 58.56 1j1w s VAL 196 Cb -0.00 -1.49 -0.02 0.00 0.56 0.00 0.00 36.38 35.43 1j1w s VAL 196 CO -0.07 -0.21 -0.10 -0.75 -0.31 0.00 0.00 175.10 173.66 1j1w s LYS 197 N -2.16 3.28 -0.43 4.82 2.20 0.18 -1.49 119.74 126.13 1j1w s LYS 197 Ca 0.06 -0.62 -0.13 0.00 -0.36 0.00 0.00 55.97 54.93 1j1w s LYS 197 Cb -0.08 -2.68 0.06 0.00 -1.51 0.00 0.00 37.83 33.62 1j1w s LYS 197 CO 0.04 0.33 0.31 0.42 -0.36 0.00 0.00 175.35 176.09 1j1w s ILE 198 N 0.07 4.81 0.03 5.43 1.01 0.37 -1.31 121.20 131.61 1j1w s ILE 198 Ca -0.03 -1.09 0.06 0.00 0.00 0.00 0.00 60.65 59.59 1j1w s ILE 198 Cb -0.14 -3.84 -0.02 0.00 0.01 0.00 0.00 42.46 38.47 1j1w s ILE 198 CO 0.04 -0.47 -0.18 -0.70 0.00 0.00 0.00 174.94 173.63 1j1w s GLU 199 N 1.56 1.21 -0.11 2.79 2.12 -0.70 -0.96 118.70 124.61 1j1w s GLU 199 Ca 0.03 -0.81 -0.10 0.00 0.36 0.00 0.00 54.97 54.45 1j1w s GLU 199 Cb -0.22 -1.26 -0.05 0.00 0.26 0.00 0.00 34.13 32.86 1j1w s GLU 199 CO 0.06 0.32 0.21 -1.17 -0.54 0.00 0.00 175.26 174.14 1j1w s LEU 200 N -1.03 4.37 -0.34 2.70 2.96 0.14 -0.46 118.68 127.02 1j1w s LEU 200 Ca 0.05 0.54 0.03 0.00 -0.22 0.00 0.00 54.13 54.54 1j1w s LEU 200 Cb -0.08 -2.21 0.10 0.00 0.50 0.00 0.00 46.19 44.50 1j1w s LEU 200 CO 0.01 0.33 0.05 -0.63 -1.32 0.00 0.00 176.35 174.79 1j1w s ILE 201 N -0.69 2.36 0.60 6.68 -1.09 0.16 -1.16 121.20 128.05 1j1w s ILE 201 Ca 0.16 -2.26 -0.17 0.00 -2.23 0.00 0.00 60.65 56.15 1j1w s ILE 201 Cb -0.13 -2.70 -0.03 0.00 -1.58 0.00 0.00 42.46 38.02 1j1w s ILE 201 CO 0.05 -0.56 1.11 0.00 -1.23 0.00 0.00 174.94 174.32 1j1w s ALA 202 N 0.94 2.60 0.47 9.38 0.00 -0.26 -1.33 121.76 133.55 1j1w s ALA 202 Ca 0.09 0.67 0.18 0.00 0.00 0.00 0.00 51.96 52.90 1j1w s ALA 202 Cb -0.19 -3.33 1.17 0.00 0.00 0.00 0.00 23.12 20.77 1j1w s ALA 202 CO -0.07 -1.00 1.98 0.87 0.00 0.00 0.00 175.76 177.54 1j1w h LYS 203 N 0.62 0.25 -0.92 0.00 1.79 -1.86 0.10 116.57 116.55 1j1w h LYS 203 Ca -0.48 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 57.97 1j1w h LYS 203 Cb 1.25 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.85 1j1w h LYS 203 CO 0.56 0.16 0.00 -0.40 -1.08 0.00 0.00 179.45 178.69 1j1w n ASP 204 N -4.44 1.27 0.00 0.86 5.68 -1.26 -4.82 116.55 113.83 1j1w n ASP 204 Ca 0.11 -1.50 0.00 0.00 -0.50 0.00 0.00 54.79 52.89 1j1w n ASP 204 Cb 0.48 -0.38 0.00 0.00 -1.14 0.00 0.00 41.12 40.09 1j1w n ASP 204 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1j1w n GLY 205 N 0.30 1.48 3.81 6.12 0.00 0.36 -4.96 105.19 112.29 1j1w n GLY 205 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1j1w n GLY 205 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1j1w s SER 206 N -0.87 3.25 -0.01 1.61 1.04 -1.26 -4.78 113.70 112.68 1j1w s SER 206 Ca 0.00 0.75 0.00 0.00 0.48 0.00 0.00 55.95 57.18 1j1w s SER 206 Cb 0.00 -1.16 0.02 0.00 0.10 0.00 0.00 66.02 64.98 1j1w s SER 206 CO 0.00 -2.69 0.01 -0.94 0.98 0.00 0.00 173.24 170.60 1j1w s SER 207 N -4.27 0.08 -0.10 7.02 1.04 -1.26 -1.11 113.70 115.10 1j1w s SER 207 Ca 0.67 0.01 0.02 0.00 0.48 0.00 0.00 55.95 57.13 1j1w s SER 207 Cb -0.11 -0.05 -0.01 0.00 0.10 0.00 0.00 66.02 65.94 1j1w s SER 207 CO 0.53 -0.06 -0.16 -0.89 0.98 0.00 0.00 173.24 173.63 1j1w s THR 208 N 0.56 2.80 0.07 2.02 2.01 -0.31 -4.96 115.64 117.83 1j1w s THR 208 Ca -0.05 -0.78 -0.24 0.00 0.31 0.00 0.00 61.69 60.94 1j1w s THR 208 Cb -0.07 -2.13 -0.06 0.00 0.01 0.00 0.00 72.50 70.25 1j1w s THR 208 CO -0.01 0.55 0.74 -0.69 -0.69 0.00 0.00 174.62 174.51 1j1w s VAL 209 N 0.03 4.65 -0.10 3.82 1.01 -1.26 0.26 120.40 128.81 1j1w s VAL 209 Ca -0.06 1.58 0.11 0.00 0.00 0.00 0.00 61.98 63.61 1j1w s VAL 209 Cb -0.15 -4.09 -0.15 0.00 0.00 0.00 0.00 36.38 32.00 1j1w s VAL 209 CO 0.05 0.43 0.07 0.18 0.00 0.00 0.00 175.10 175.82 1j1w n LEU 210 N 2.40 0.00 -3.40 3.92 4.77 -0.14 -4.92 117.00 119.63 1j1w n LEU 210 Ca -0.04 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 55.95 1j1w n LEU 210 Cb 0.50 0.26 -0.03 0.00 -2.33 0.00 0.00 43.42 41.81 1j1w n LEU 210 CO 0.46 0.26 0.42 -0.75 -1.33 0.00 0.00 177.39 176.45 1j1w s LYS 211 N -2.35 0.42 -0.10 3.23 2.20 -0.91 -5.00 119.74 117.24 1j1w s LYS 211 Ca -0.06 0.95 -0.19 0.00 -0.36 0.00 0.00 55.97 56.32 1j1w s LYS 211 Cb 0.04 0.56 -0.28 0.00 -1.51 0.00 0.00 37.83 36.64 1j1w s LYS 211 CO 0.48 -0.24 0.64 0.00 -0.36 0.00 0.00 175.35 175.88 1j1w h ALA 212 N 7.81 0.09 -3.12 3.13 0.00 -1.86 1.08 119.26 126.39 1j1w h ALA 212 Ca -0.17 -0.95 -0.67 0.00 0.00 0.00 0.00 54.91 53.11 1j1w h ALA 212 Cb 1.13 0.36 -0.34 0.00 0.00 0.00 0.00 17.79 18.93 1j1w h ALA 212 CO 0.10 0.64 -0.86 -1.59 0.00 0.00 0.00 179.25 177.54 1j1w s LYS 213 N -2.44 3.01 -0.30 0.00 -2.85 -1.26 -3.44 119.74 112.46 1j1w s LYS 213 Ca -0.19 -0.84 -0.01 0.00 -1.00 0.00 0.00 55.97 53.94 1j1w s LYS 213 Cb 0.03 -2.52 0.13 0.00 -2.06 0.00 0.00 37.83 33.41 1j1w s LYS 213 CO 0.77 -0.13 0.26 0.99 0.10 0.00 0.00 175.35 177.34 1j1w s THR 214 N 1.09 -0.30 0.35 3.79 2.01 -0.55 -4.93 115.64 117.10 1j1w s THR 214 Ca 0.00 -0.65 -0.29 0.00 0.31 0.00 0.00 61.69 61.06 1j1w s THR 214 Cb -0.14 -0.96 -0.11 0.00 0.01 0.00 0.00 72.50 71.30 1j1w s THR 214 CO -0.08 -0.56 1.52 -0.94 -0.69 0.00 0.00 174.62 173.86 1j1w s SER 215 N 2.16 6.35 -0.04 3.53 1.04 -1.26 -0.88 113.70 124.60 1j1w s SER 215 Ca 0.10 3.02 0.03 0.00 0.48 0.00 0.00 55.95 59.58 1j1w s SER 215 Cb -0.15 -2.66 0.01 0.00 0.10 0.00 0.00 66.02 63.32 1j1w s SER 215 CO -0.30 -0.88 -0.11 0.68 0.98 0.00 0.00 173.24 173.60 1j1w s VAL 216 N -0.82 1.02 0.67 5.02 -7.23 -0.85 -4.90 120.40 113.31 1j1w s VAL 216 Ca 0.56 -0.46 -0.04 0.00 -1.81 0.00 0.00 61.98 60.23 1j1w s VAL 216 Cb -0.47 -0.91 0.06 0.00 0.56 0.00 0.00 36.38 35.63 1j1w s VAL 216 CO 0.59 0.31 0.95 -1.10 -0.31 0.00 0.00 175.10 175.54 1j1w s GLN 217 N 0.35 2.20 0.53 4.82 -0.21 -1.26 -1.66 119.66 124.43 1j1w s GLN 217 Ca -0.07 -0.52 -0.20 0.00 0.02 0.00 0.00 55.36 54.59 1j1w s GLN 217 Cb -0.12 -2.28 -0.06 0.00 1.00 0.00 0.00 33.01 31.55 1j1w s GLN 217 CO 0.02 -1.13 1.12 0.00 -2.12 0.00 0.00 175.29 173.17 1j1w s ALA 218 N -3.10 2.73 0.00 6.09 0.00 -1.26 -2.90 121.76 123.31 1j1w s ALA 218 Ca 0.60 0.80 0.00 0.00 0.00 0.00 0.00 51.96 53.36 1j1w s ALA 218 Cb -0.10 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.68 1j1w s ALA 218 CO 0.43 -0.70 0.00 0.41 0.00 0.00 0.00 175.76 175.90 1j1w n GLY 219 N 0.11 0.34 3.78 0.00 0.00 -0.87 -4.70 105.19 103.85 1j1w n GLY 219 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 1j1w n GLY 219 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1j1w s GLU 220 N -0.72 3.97 -0.26 1.61 2.12 -1.14 -4.08 118.70 120.19 1j1w s GLU 220 Ca 0.00 1.62 -0.06 0.00 0.36 0.00 0.00 54.97 56.89 1j1w s GLU 220 Cb 0.00 -2.46 -0.01 0.00 0.26 0.00 0.00 34.13 31.93 1j1w s GLU 220 CO 0.00 -0.33 0.04 0.42 -0.54 0.00 0.00 175.26 174.85 1j1w s ILE 221 N -1.63 3.86 -0.04 -3.70 1.01 0.47 -0.87 121.20 120.30 1j1w s ILE 221 Ca 0.61 -0.51 0.07 0.00 0.00 0.00 0.00 60.65 60.82 1j1w s ILE 221 Cb -0.24 -2.88 -0.02 0.00 0.01 0.00 0.00 42.46 39.33 1j1w s ILE 221 CO 0.30 0.25 -0.24 0.27 0.00 0.00 0.00 174.94 175.52 1j1w s ILE 222 N 1.52 2.18 0.05 2.92 -4.36 -0.00 -0.42 121.20 123.09 1j1w s ILE 222 Ca 0.04 -1.05 0.02 0.00 -0.26 0.00 0.00 60.65 59.40 1j1w s ILE 222 Cb -0.16 -1.78 -0.03 0.00 1.25 0.00 0.00 42.46 41.75 1j1w s ILE 222 CO 0.01 0.58 -0.07 1.51 0.24 0.00 0.00 174.94 177.21 1j1w s ASP 223 N -0.46 0.80 -0.01 4.36 1.47 -0.35 0.76 116.67 123.24 1j1w s ASP 223 Ca 0.05 -0.64 0.02 0.00 1.18 0.00 0.00 52.55 53.16 1j1w s ASP 223 Cb -0.11 0.06 -0.00 0.00 -0.34 0.00 0.00 42.92 42.53 1j1w s ASP 223 CO 0.01 -0.28 -0.05 -0.94 0.68 0.00 0.00 175.17 174.59 1j1w s SER 224 N -1.86 0.63 0.28 2.11 1.04 -0.20 -0.18 113.70 115.53 1j1w s SER 224 Ca -0.07 -0.10 -0.01 0.00 0.48 0.00 0.00 55.95 56.25 1j1w s SER 224 Cb -0.07 -0.08 -0.02 0.00 0.10 0.00 0.00 66.02 65.95 1j1w s SER 224 CO -0.01 0.06 0.33 -0.94 0.98 0.00 0.00 173.24 173.66 1j1w s SER 225 N -0.08 0.72 -0.20 7.02 1.04 -0.81 -2.16 113.70 119.23 1j1w s SER 225 Ca 0.01 -1.43 -0.11 0.00 0.48 0.00 0.00 55.95 54.90 1j1w s SER 225 Cb -0.03 0.55 0.07 0.00 0.10 0.00 0.00 66.02 66.71 1j1w s SER 225 CO -0.00 -1.09 0.48 0.54 0.98 0.00 0.00 173.24 174.15 1j1w s VAL 226 N -3.61 -0.08 -0.12 5.02 0.11 -1.26 -1.44 120.40 119.03 1j1w s VAL 226 Ca 0.34 0.08 -0.27 0.00 -2.93 0.00 0.00 61.98 59.20 1j1w s VAL 226 Cb 0.02 -0.71 -0.02 0.00 -1.53 0.00 0.00 36.38 34.15 1j1w s VAL 226 CO 0.18 0.03 0.89 -0.32 -3.33 0.00 0.00 175.10 172.55 1j1w s MET 227 N 1.57 4.39 -0.25 1.54 1.75 0.34 -3.97 119.30 124.68 1j1w s MET 227 Ca -0.09 1.17 -0.22 0.00 -1.25 0.00 0.00 55.69 55.30 1j1w s MET 227 Cb -0.08 -3.53 -0.01 0.00 2.84 0.00 0.00 34.83 34.04 1j1w s MET 227 CO -0.15 -0.24 0.70 0.45 -0.65 0.00 0.00 175.02 175.14 1j1w s SER 228 N 1.07 6.68 0.13 1.11 0.15 -1.23 -1.10 113.70 120.51 1j1w s SER 228 Ca 0.43 0.84 -0.27 0.00 0.70 0.00 0.00 55.95 57.65 1j1w s SER 228 Cb -0.18 -2.37 -0.05 0.00 -1.71 0.00 0.00 66.02 61.70 1j1w s SER 228 CO 0.17 -0.42 1.61 0.50 1.20 0.00 0.00 173.24 176.30 1j1w h LYS 229 N 7.79 -0.46 0.00 5.44 3.64 -1.89 0.37 116.57 131.46 1j1w h LYS 229 Ca -0.26 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.12 1j1w h LYS 229 Cb 1.11 0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 33.03 1j1w h LYS 229 CO 0.81 -0.31 -0.16 -2.95 -2.27 0.00 0.00 179.45 174.58 1j1w h ASN 230 N -0.48 0.00 0.12 4.20 7.08 -1.93 0.16 115.58 124.73 1j1w h ASN 230 Ca 0.06 0.00 -0.26 0.00 -3.08 0.00 0.00 56.30 53.02 1j1w h ASN 230 Cb 0.57 0.00 0.02 0.00 -2.08 0.00 0.00 38.32 36.83 1j1w h ASN 230 CO -0.28 0.16 -1.07 0.00 -2.08 0.00 0.00 177.43 174.16 1j1w h ALA 231 N 1.84 0.15 -0.41 4.14 0.00 -1.74 -1.65 119.26 121.61 1j1w h ALA 231 Ca -0.00 -0.72 -0.11 0.00 0.00 0.00 0.00 54.91 54.08 1j1w h ALA 231 Cb 0.57 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1j1w h ALA 231 CO 0.02 0.72 -0.17 1.25 0.00 0.00 0.00 179.25 181.08 1j1w h LEU 232 N 0.33 0.85 -0.26 0.00 5.85 -0.52 -1.54 115.31 120.02 1j1w h LEU 232 Ca -0.13 -0.39 0.04 0.00 0.84 0.00 0.00 57.88 58.23 1j1w h LEU 232 Cb 1.72 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 42.48 1j1w h LEU 232 CO 0.20 1.06 0.05 -0.09 -0.34 0.00 0.00 178.44 179.32 1j1w h ARG 233 N 0.65 0.14 0.00 1.25 2.43 -0.70 0.43 114.38 118.58 1j1w h ARG 233 Ca 0.09 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 1j1w h ARG 233 Cb 0.72 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.23 1j1w h ARG 233 CO 0.05 0.09 -0.12 -0.91 -1.51 0.00 0.00 179.97 177.58 1j1w h ASN 234 N 0.15 0.00 0.12 -3.80 -0.26 -1.15 -2.50 115.58 108.14 1j1w h ASN 234 Ca 0.12 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.85 1j1w h ASN 234 Cb 0.12 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.38 1j1w h ASN 234 CO -0.16 0.12 -0.06 0.15 -1.06 0.00 0.00 177.43 176.42 1j1w h PHE 235 N 0.00 -0.15 -0.57 1.19 3.04 -0.14 -3.17 116.94 117.15 1j1w h PHE 235 Ca -0.00 -0.00 0.10 0.00 3.98 0.00 0.00 57.97 62.05 1j1w h PHE 235 Cb 0.45 0.05 -0.03 0.00 2.56 0.00 0.00 35.95 38.98 1j1w h PHE 235 CO 0.00 -0.06 0.38 0.82 -2.02 0.00 0.00 178.31 177.43 1j1w h ILE 236 N -1.04 0.88 -0.48 1.41 2.04 -1.00 -0.59 117.51 118.73 1j1w h ILE 236 Ca -0.02 -0.12 -0.05 0.00 1.00 0.00 0.00 64.86 65.67 1j1w h ILE 236 Cb 0.16 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 1j1w h ILE 236 CO 0.03 0.06 0.10 0.00 0.00 0.00 0.00 178.15 178.34 1j1w h ALA 237 N 1.71 0.64 -0.07 1.87 0.00 -1.57 -2.12 119.26 119.72 1j1w h ALA 237 Ca 0.26 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1j1w h ALA 237 Cb 0.57 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1j1w h ALA 237 CO -0.07 0.34 -0.07 0.00 0.00 0.00 0.00 179.25 179.46 1j1w h ALA 238 N 0.97 0.10 -0.13 0.00 0.00 -1.18 -2.69 119.26 116.33 1j1w h ALA 238 Ca 0.15 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.81 1j1w h ALA 238 Cb 0.36 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1j1w h ALA 238 CO 0.01 -0.09 0.10 0.93 0.00 0.00 0.00 179.25 180.19 1j1w h GLU 239 N -0.28 0.00 0.30 0.00 4.39 -1.13 0.19 114.58 118.05 1j1w h GLU 239 Ca 0.01 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 1j1w h GLU 239 Cb 0.58 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 1j1w h GLU 239 CO 0.02 0.00 -0.15 0.82 -1.16 0.00 0.00 179.01 178.54 1j1w h ILE 240 N 0.00 0.00 -0.96 3.13 2.04 -1.36 -0.40 117.51 119.96 1j1w h ILE 240 Ca 0.06 -0.39 0.09 0.00 1.00 0.00 0.00 64.86 65.62 1j1w h ILE 240 Cb 0.25 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.21 1j1w h ILE 240 CO -0.00 0.00 -0.58 -0.08 0.00 0.00 0.00 178.15 177.49 1j1w h GLU 241 N -0.80 -0.02 -0.54 2.37 4.57 -1.08 0.50 114.58 119.59 1j1w h GLU 241 Ca -0.04 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 1j1w h GLU 241 Cb 0.31 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 1j1w h GLU 241 CO 0.07 -0.02 0.34 0.22 -1.18 0.00 0.00 179.01 178.44 1j1w h ASP 242 N -0.02 0.63 0.45 1.04 3.58 -0.75 -0.43 116.42 120.91 1j1w h ASP 242 Ca 0.16 -0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.58 1j1w h ASP 242 Cb 0.42 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.32 1j1w h ASP 242 CO -0.92 0.47 0.00 0.00 -2.88 0.00 0.00 179.24 175.91 1j1w h ALA 243 N 1.64 1.00 0.07 -0.78 0.00 0.17 -1.80 119.26 119.55 1j1w h ALA 243 Ca 0.20 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.91 1j1w h ALA 243 Cb -0.05 0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.76 1j1w h ALA 243 CO -0.04 0.00 -0.79 -0.22 0.00 0.00 0.00 179.25 178.20 1j1w h LYS 244 N 0.00 0.42 0.09 0.00 3.64 0.30 -2.96 116.57 118.05 1j1w h LYS 244 Ca 0.00 -0.54 -0.00 0.00 -1.27 0.00 0.00 60.65 58.84 1j1w h LYS 244 Cb 0.22 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1j1w h LYS 244 CO 0.00 1.20 -0.04 -0.22 -2.27 0.00 0.00 179.45 178.12 1j1w h LYS 245 N -0.11 -0.11 -0.25 1.90 1.63 -1.25 -2.63 116.57 115.75 1j1w h LYS 245 Ca -0.12 0.01 0.07 0.00 -0.85 0.00 0.00 60.65 59.76 1j1w h LYS 245 Cb 1.53 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 33.18 1j1w h LYS 245 CO 0.15 -0.03 0.31 1.96 -3.45 0.00 0.00 179.45 178.40 1j1w h GLN 246 N -0.17 0.00 -1.58 1.90 1.08 -1.46 -3.45 115.11 111.43 1j1w h GLN 246 Ca -0.01 0.00 -0.13 0.00 -1.45 0.00 0.00 58.65 57.06 1j1w h GLN 246 Cb 0.14 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.58 1j1w h GLN 246 CO 0.02 0.00 -0.19 0.41 -0.95 0.00 0.00 178.83 178.12 1j1w n GLY 247 N -1.41 0.26 3.59 3.46 0.00 -0.99 -5.04 105.19 105.06 1j1w n GLY 247 Ca 0.03 -0.52 -0.24 0.00 0.00 0.00 0.00 46.02 45.29 1j1w n GLY 247 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1j1w s VAL 248 N -2.64 2.76 0.25 1.61 -7.23 -1.13 -4.93 120.40 109.09 1j1w s VAL 248 Ca 0.07 -2.07 -0.30 0.00 -1.81 0.00 0.00 61.98 57.88 1j1w s VAL 248 Cb -0.03 -2.69 -0.09 0.00 0.56 0.00 0.00 36.38 34.12 1j1w s VAL 248 CO 0.09 -0.28 0.98 -0.76 -0.31 0.00 0.00 175.10 174.82 1j1w s LEU 249 N -3.66 4.62 -0.15 1.32 1.43 -0.95 -4.47 118.68 116.83 1j1w s LEU 249 Ca 0.33 2.02 -0.18 0.00 -1.03 0.00 0.00 54.13 55.28 1j1w s LEU 249 Cb -0.02 -3.62 -0.04 0.00 0.03 0.00 0.00 46.19 42.54 1j1w s LEU 249 CO 0.18 0.09 0.46 -0.22 0.23 0.00 0.00 176.35 177.09 1j1w s LEU 250 N -1.25 4.23 0.00 1.79 2.96 -0.37 -1.28 118.68 124.76 1j1w s LEU 250 Ca 0.42 0.72 -0.00 0.00 -0.22 0.00 0.00 54.13 55.05 1j1w s LEU 250 Cb -0.27 -2.65 -0.00 0.00 0.50 0.00 0.00 46.19 43.76 1j1w s LEU 250 CO 0.34 -0.04 -0.00 -0.94 -1.32 0.00 0.00 176.35 174.39 1j1w s SER 251 N 0.79 0.05 -0.21 3.68 1.04 -1.11 -1.66 113.70 116.27 1j1w s SER 251 Ca 0.24 -0.10 -0.04 0.00 0.48 0.00 0.00 55.95 56.53 1j1w s SER 251 Cb -0.15 0.03 -0.02 0.00 0.10 0.00 0.00 66.02 65.99 1j1w s SER 251 CO 0.09 -0.07 -0.02 -0.69 0.98 0.00 0.00 173.24 173.54 1j1w s VAL 252 N -0.31 3.62 -0.76 5.02 1.01 -1.26 -0.15 120.40 127.58 1j1w s VAL 252 Ca -0.03 -0.41 -0.00 0.00 0.00 0.00 0.00 61.98 61.53 1j1w s VAL 252 Cb -0.02 -2.65 0.19 0.00 0.00 0.00 0.00 36.38 33.90 1j1w s VAL 252 CO -0.00 0.42 0.59 -1.00 0.00 0.00 0.00 175.10 175.11 1j1w s HIS 253 N 1.31 3.65 0.49 5.22 3.76 -0.43 -4.86 115.29 124.42 1j1w s HIS 253 Ca 0.04 -3.03 0.06 0.00 -0.15 0.00 0.00 55.06 51.98 1j1w s HIS 253 Cb -0.14 -3.09 -0.00 0.00 1.11 0.00 0.00 32.58 30.46 1j1w s HIS 253 CO -0.01 -0.72 0.28 -0.51 -0.85 0.00 0.00 174.74 172.93 1j1w s LEU 254 N -0.97 2.84 -0.47 0.89 1.43 -1.26 -4.60 118.68 116.54 1j1w s LEU 254 Ca 0.23 -1.20 0.06 0.00 -1.03 0.00 0.00 54.13 52.19 1j1w s LEU 254 Cb -0.11 -1.29 0.40 0.00 0.03 0.00 0.00 46.19 45.22 1j1w s LEU 254 CO -0.10 -0.86 1.05 1.17 0.23 0.00 0.00 176.35 177.84 1j1w n LYS 255 N -1.52 3.22 -0.07 1.70 4.81 -1.26 -1.61 118.16 123.43 1j1w n LYS 255 Ca -0.03 -4.51 0.00 0.00 -0.87 0.00 0.00 58.31 52.89 1j1w n LYS 255 Cb 0.64 -2.18 0.00 0.00 0.02 0.00 0.00 35.03 33.51 1j1w n LYS 255 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1j1w n ALA 256 N -0.39 2.10 0.02 3.14 0.00 -1.26 -1.86 120.51 122.26 1j1w n ALA 256 Ca 0.35 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.79 1j1w n ALA 256 Cb 0.60 -1.23 -0.00 0.00 0.00 0.00 0.00 19.45 18.82 1j1w n ALA 256 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1j1w n THR 257 N 1.18 0.52 -0.15 0.00 -2.24 -1.26 -4.65 114.28 107.68 1j1w n THR 257 Ca 0.00 0.18 -0.11 0.00 -2.27 0.00 0.00 64.05 61.85 1j1w n THR 257 Cb 0.19 -1.28 -0.01 0.00 -2.10 0.00 0.00 70.33 67.13 1j1w n THR 257 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1j1w h MET 258 N -0.03 0.87 -2.64 -0.78 -1.53 -1.88 -3.11 114.93 105.84 1j1w h MET 258 Ca 0.00 -0.36 -0.49 0.00 -3.44 0.00 0.00 59.70 55.41 1j1w h MET 258 Cb 0.03 -0.04 -0.01 0.00 -0.55 0.00 0.00 31.60 31.03 1j1w h MET 258 CO 0.00 1.00 2.33 -1.33 0.14 0.00 0.00 176.91 179.04 1j1w n MET 259 N -4.24 3.08 0.08 0.39 2.81 -0.78 -4.28 117.12 114.19 1j1w n MET 259 Ca -0.01 -1.76 0.17 0.00 -1.81 0.00 0.00 57.70 54.29 1j1w n MET 259 Cb 0.41 -2.51 0.45 0.00 -0.71 0.00 0.00 33.22 30.86 1j1w n MET 259 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 1j1w h LYS 260 N 4.29 0.00 0.00 0.03 2.10 -1.81 -3.10 116.57 118.08 1j1w h LYS 260 Ca 0.63 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 59.13 1j1w h LYS 260 Cb 0.72 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.03 1j1w h LYS 260 CO 1.23 0.00 -1.48 0.28 -2.00 0.00 0.00 179.45 177.47 1j1w n VAL 261 N -3.09 1.51 0.05 0.07 0.31 -1.26 -4.66 118.33 111.25 1j1w n VAL 261 Ca 0.10 -0.03 -0.22 0.00 -0.01 0.00 0.00 64.34 64.18 1j1w n VAL 261 Cb 1.02 -2.20 -0.15 0.00 -0.91 0.00 0.00 33.84 31.61 1j1w n VAL 261 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1j1w h SER 262 N -1.00 0.52 -0.79 4.52 4.64 -1.93 -3.35 113.55 116.15 1j1w h SER 262 Ca -0.23 -0.91 -0.03 0.00 -0.47 0.00 0.00 61.79 60.16 1j1w h SER 262 Cb 1.19 -0.17 -0.04 0.00 -0.31 0.00 0.00 62.40 63.07 1j1w h SER 262 CO -0.14 1.60 0.38 0.44 -0.87 0.00 0.00 176.83 178.24 1j1w h ASP 263 N -0.19 1.03 -0.16 4.97 5.19 -1.86 -0.97 116.42 124.42 1j1w h ASP 263 Ca -0.26 -0.13 -0.00 0.00 -0.62 0.00 0.00 57.03 56.02 1j1w h ASP 263 Cb 1.85 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 41.08 1j1w h ASP 263 CO 0.14 0.87 0.10 -0.65 -3.12 0.00 0.00 179.24 176.58 1j1w h PRO 264 N 1.11 0.22 -0.17 3.56 0.11 -1.75 0.62 132.00 135.71 1j1w h PRO 264 Ca 0.27 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.34 1j1w h PRO 264 Cb 0.11 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.17 1j1w h PRO 264 CO -0.03 0.16 -0.01 0.82 -0.21 0.00 0.00 178.00 178.73 1j1w h ILE 265 N 0.23 1.26 -0.73 4.15 2.04 -1.42 -0.88 117.51 122.16 1j1w h ILE 265 Ca 0.06 -0.87 -0.06 0.00 1.00 0.00 0.00 64.86 64.99 1j1w h ILE 265 Cb -0.01 1.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.54 1j1w h ILE 265 CO -0.01 0.26 0.23 0.24 0.00 0.00 0.00 178.15 178.87 1j1w h MET 266 N 0.05 1.12 -0.08 2.37 2.86 -0.21 -2.47 114.93 118.57 1j1w h MET 266 Ca 0.05 -0.23 0.04 0.00 -2.06 0.00 0.00 59.70 57.50 1j1w h MET 266 Cb 0.39 -0.17 -0.05 0.00 0.06 0.00 0.00 31.60 31.83 1j1w h MET 266 CO 0.01 0.95 -0.27 0.35 1.06 0.00 0.00 176.91 179.01 1j1w h PHE 267 N 1.08 -0.73 -0.77 -0.22 3.57 0.46 -2.50 116.94 117.83 1j1w h PHE 267 Ca 0.24 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.78 1j1w h PHE 267 Cb 0.29 0.33 -0.04 0.00 2.79 0.00 0.00 35.95 39.33 1j1w h PHE 267 CO 0.02 -0.36 0.50 0.78 -2.23 0.00 0.00 178.31 177.03 1j1w h GLY 268 N -0.37 1.10 1.78 2.40 0.00 -0.90 -1.17 103.07 105.91 1j1w h GLY 268 Ca 0.09 -0.39 0.03 0.00 0.00 0.00 0.00 47.33 47.05 1j1w h GLY 268 CO -0.29 0.36 0.08 1.46 0.00 0.00 0.00 176.54 178.15 1j1w h GLN 269 N 1.00 0.00 0.23 4.80 4.20 -1.13 1.21 115.11 125.42 1j1w h GLN 269 Ca 0.29 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.99 1j1w h GLN 269 Cb -0.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.72 1j1w h GLN 269 CO -0.08 0.00 -0.11 0.82 -0.67 0.00 0.00 178.83 178.78 1j1w h ILE 270 N 0.00 0.00 -0.43 2.54 2.04 -0.88 0.78 117.51 121.56 1j1w h ILE 270 Ca 0.04 -0.67 0.12 0.00 1.00 0.00 0.00 64.86 65.35 1j1w h ILE 270 Cb 0.21 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.27 1j1w h ILE 270 CO -0.00 0.00 0.56 0.58 0.00 0.00 0.00 178.15 179.29 1j1w h VAL 271 N -0.99 0.25 0.01 1.67 2.07 -0.38 -0.72 116.25 118.16 1j1w h VAL 271 Ca -0.03 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 1j1w h VAL 271 Cb 0.24 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1j1w h VAL 271 CO 0.05 0.00 -0.00 0.28 0.02 0.00 0.00 177.57 177.92 1j1w h SER 272 N 0.00 -0.01 0.00 0.57 0.02 0.15 -3.11 113.55 111.17 1j1w h SER 272 Ca 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1j1w h SER 272 Cb 1.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.86 1j1w h SER 272 CO -0.00 0.25 0.00 1.21 -1.14 0.00 0.00 176.83 177.15 1j1w n GLU 273 N -3.46 0.00 -0.04 3.45 4.07 0.26 -1.42 120.64 123.50 1j1w n GLU 273 Ca -0.00 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 57.06 1j1w n GLU 273 Cb 0.01 -1.50 -0.01 0.00 -0.06 0.00 0.00 31.44 29.87 1j1w n GLU 273 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 1j1w n PHE 274 N -0.98 0.03 0.80 4.31 7.35 -0.39 -4.49 117.46 124.09 1j1w n PHE 274 Ca 0.00 0.01 0.00 0.00 -0.76 0.00 0.00 57.45 56.71 1j1w n PHE 274 Cb 0.00 -0.24 0.04 0.00 0.35 0.00 0.00 39.48 39.63 1j1w n PHE 274 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 1j1w n TYR 275 N -3.36 0.23 -0.14 -5.13 4.02 -1.13 -4.53 117.16 107.13 1j1w n TYR 275 Ca -0.06 -0.15 -0.05 0.00 -0.01 0.00 0.00 57.90 57.63 1j1w n TYR 275 Cb 0.22 -0.17 0.01 0.00 -0.02 0.00 0.00 39.34 39.38 1j1w n TYR 275 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 176.86 177.42 1j1w h LYS 276 N 0.38 -0.15 -0.72 -0.72 2.10 -1.46 0.29 116.57 116.29 1j1w h LYS 276 Ca 0.01 0.01 0.11 0.00 -2.00 0.00 0.00 60.65 58.78 1j1w h LYS 276 Cb 0.73 0.03 -0.08 0.00 -0.90 0.00 0.00 32.23 32.01 1j1w h LYS 276 CO 0.06 -0.10 0.34 -0.44 -2.00 0.00 0.00 179.45 177.31 1j1w h ASP 277 N -0.16 0.41 -0.18 7.07 3.32 -1.88 0.84 116.42 125.84 1j1w h ASP 277 Ca 0.21 0.08 -0.21 0.00 0.02 0.00 0.00 57.03 57.13 1j1w h ASP 277 Cb 0.49 0.01 0.01 0.00 0.22 0.00 0.00 39.33 40.06 1j1w h ASP 277 CO -0.55 0.21 -0.69 0.00 -1.72 0.00 0.00 179.24 176.49 1j1w h ALA 278 N 1.47 0.33 0.00 3.45 0.00 -1.71 -1.82 119.26 120.97 1j1w h ALA 278 Ca 0.37 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1j1w h ALA 278 Cb 0.45 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1j1w h ALA 278 CO -0.31 0.65 0.00 -0.07 0.00 0.00 0.00 179.25 179.52 1j1w h LEU 279 N 0.53 0.00 0.15 0.00 3.38 -0.40 -2.76 115.31 116.21 1j1w h LEU 279 Ca -0.04 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.62 1j1w h LEU 279 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.08 1j1w h LEU 279 CO 0.15 0.00 -1.54 0.74 0.09 0.00 0.00 178.44 177.88 1j1w h THR 280 N 0.00 1.16 0.00 0.22 2.02 0.78 -2.53 112.91 114.56 1j1w h THR 280 Ca 0.00 -2.76 -0.03 0.00 0.77 0.00 0.00 66.41 64.39 1j1w h THR 280 Cb 0.73 2.82 -0.00 0.00 -1.74 0.00 0.00 68.15 69.95 1j1w h THR 280 CO 0.00 0.83 -0.15 0.50 0.37 0.00 0.00 175.52 177.07 1j1w h LYS 281 N 0.09 0.00 -0.24 6.66 3.64 -1.19 -3.02 116.57 122.52 1j1w h LYS 281 Ca -0.25 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 58.94 1j1w h LYS 281 Cb 2.05 0.00 -0.19 0.00 -0.41 0.00 0.00 32.23 33.68 1j1w h LYS 281 CO 0.19 0.15 -0.69 0.72 -2.27 0.00 0.00 179.45 177.55 1j1w n HIS 282 N -3.53 0.85 -0.31 1.91 8.25 -1.05 -4.88 115.22 116.45 1j1w n HIS 282 Ca -0.01 -1.63 0.09 0.00 -0.26 0.00 0.00 57.72 55.92 1j1w n HIS 282 Cb 0.30 -0.26 0.21 0.00 1.12 0.00 0.00 29.99 31.36 1j1w n HIS 282 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1j1w h ALA 283 N 1.43 0.93 0.19 -1.41 0.00 -1.31 -2.84 119.26 116.24 1j1w h ALA 283 Ca 0.07 0.31 -0.34 0.00 0.00 0.00 0.00 54.91 54.95 1j1w h ALA 283 Cb 1.27 0.56 0.01 0.00 0.00 0.00 0.00 17.79 19.64 1j1w h ALA 283 CO 0.24 -0.48 -1.67 1.49 0.00 0.00 0.00 179.25 178.82 1j1w h GLU 284 N 0.04 0.41 -0.94 0.00 4.81 -1.89 -2.97 114.58 114.03 1j1w h GLU 284 Ca 0.51 -0.69 0.13 0.00 -0.13 0.00 0.00 59.36 59.17 1j1w h GLU 284 Cb 0.95 0.26 -0.08 0.00 0.63 0.00 0.00 28.75 30.51 1j1w h GLU 284 CO -0.85 1.33 0.60 -0.24 -0.73 0.00 0.00 179.01 179.12 1j1w h VAL 285 N 0.07 0.89 -0.17 0.32 3.04 -1.89 0.21 116.25 118.71 1j1w h VAL 285 Ca -0.33 -0.29 -0.12 0.00 -1.01 0.00 0.00 66.70 64.95 1j1w h VAL 285 Cb 2.08 -0.04 0.00 0.00 -2.01 0.00 0.00 31.29 31.32 1j1w h VAL 285 CO 0.18 0.16 -0.37 -0.07 -1.01 0.00 0.00 177.57 176.46 1j1w h LEU 286 N 0.85 0.62 -0.91 3.16 4.07 -1.65 -3.03 115.31 118.42 1j1w h LEU 286 Ca 0.47 -0.56 0.14 0.00 0.08 0.00 0.00 57.88 58.01 1j1w h LEU 286 Cb 0.58 -0.18 -0.09 0.00 1.08 0.00 0.00 40.66 42.05 1j1w h LEU 286 CO -0.23 1.06 0.52 0.50 -1.08 0.00 0.00 178.44 179.21 1j1w h LYS 287 N 0.19 0.74 0.00 1.13 1.63 -0.93 0.18 116.57 119.52 1j1w h LYS 287 Ca 0.00 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1j1w h LYS 287 Cb 0.97 -0.17 0.00 0.00 -0.60 0.00 0.00 32.23 32.43 1j1w h LYS 287 CO 0.08 0.49 0.00 1.04 -3.45 0.00 0.00 179.45 177.61 1j1w n GLN 288 N -4.77 0.00 0.00 1.90 6.02 0.56 -2.01 117.38 119.08 1j1w n GLN 288 Ca 0.18 0.49 0.00 0.00 -0.01 0.00 0.00 57.00 57.66 1j1w n GLN 288 Cb 0.42 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.21 1j1w n GLN 288 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.06 176.49 1j1w n ILE 289 N -1.96 0.63 -2.69 5.09 -5.35 -1.11 -4.83 119.36 109.15 1j1w n ILE 289 Ca 0.00 0.18 -0.00 0.00 -0.27 0.00 0.00 62.75 62.66 1j1w n ILE 289 Cb 0.00 -1.18 0.00 0.00 -1.74 0.00 0.00 39.64 36.72 1j1w n ILE 289 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1j1w n GLY 290 N -1.13 -1.02 3.81 3.28 0.00 0.50 -5.01 105.19 105.63 1j1w n GLY 290 Ca 0.00 0.31 -0.34 0.00 0.00 0.00 0.00 46.02 45.99 1j1w n GLY 290 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1j1w s PHE 291 N -3.00 3.32 -0.52 1.61 5.99 -0.46 -5.00 117.98 119.92 1j1w s PHE 291 Ca 0.00 1.63 0.04 0.00 0.00 0.00 0.00 56.93 58.60 1j1w s PHE 291 Cb -0.00 -2.89 0.16 0.00 0.00 0.00 0.00 43.02 40.29 1j1w s PHE 291 CO 0.57 -0.17 0.37 0.34 -0.00 0.00 0.00 175.22 176.33 1j1w s ASP 292 N -2.07 3.15 0.52 6.13 2.15 -1.26 -4.91 116.67 120.38 1j1w s ASP 292 Ca 0.61 -3.21 0.42 0.00 0.43 0.00 0.00 52.55 50.80 1j1w s ASP 292 Cb -0.11 -0.98 1.61 0.00 -0.30 0.00 0.00 42.92 43.13 1j1w s ASP 292 CO 0.15 -0.17 1.63 1.62 -0.17 0.00 0.00 175.17 178.24 1j1w h VAL 293 N 4.71 0.12 0.00 1.11 3.04 -1.94 0.61 116.25 123.89 1j1w h VAL 293 Ca 0.16 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.84 1j1w h VAL 293 Cb 0.86 0.09 0.00 0.00 -2.01 0.00 0.00 31.29 30.23 1j1w h VAL 293 CO 0.51 0.01 0.00 0.59 -1.01 0.00 0.00 177.57 177.67 1j1w n ASN 294 N -4.20 0.00 -0.50 3.17 3.02 -1.26 -0.84 115.26 114.65 1j1w n ASN 294 Ca 0.39 -0.42 0.05 0.00 -0.03 0.00 0.00 54.58 54.57 1j1w n ASN 294 Cb 1.70 0.00 0.13 0.00 -0.61 0.00 0.00 39.78 41.00 1j1w n ASN 294 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1j1w n ASN 295 N -0.84 2.82 0.00 6.41 5.03 0.21 -4.68 115.26 124.20 1j1w n ASN 295 Ca 0.05 -2.20 0.00 0.00 0.87 0.00 0.00 54.58 53.31 1j1w n ASN 295 Cb 0.02 -0.23 0.00 0.00 -1.02 0.00 0.00 39.78 38.55 1j1w n ASN 295 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1j1w n GLY 296 N 0.04 -1.11 0.31 7.41 0.00 -0.02 -3.98 105.19 107.84 1j1w n GLY 296 Ca 0.10 -1.56 0.19 0.00 0.00 0.00 0.00 46.02 44.76 1j1w n GLY 296 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1j1w h ILE 297 N 0.00 0.13 -0.93 -0.61 6.09 -1.33 -1.71 117.51 119.15 1j1w h ILE 297 Ca 0.00 -0.20 0.16 0.00 -1.37 0.00 0.00 64.86 63.45 1j1w h ILE 297 Cb 0.00 1.17 -0.08 0.00 0.47 0.00 0.00 36.82 38.38 1j1w h ILE 297 CO 0.00 0.02 0.60 1.23 -3.07 0.00 0.00 178.15 176.92 1j1w h GLY 298 N 0.61 1.32 1.44 8.18 0.00 -1.55 -0.31 103.07 112.76 1j1w h GLY 298 Ca -0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 1j1w h GLY 298 CO 0.00 0.04 0.24 -1.80 0.00 0.00 0.00 176.54 175.02 1j1w h ASP 299 N 0.68 0.65 0.93 0.19 1.82 -1.43 -2.87 116.42 116.39 1j1w h ASP 299 Ca 0.49 -0.06 -0.04 0.00 -0.39 0.00 0.00 57.03 57.02 1j1w h ASP 299 Cb 0.83 -0.17 0.01 0.00 0.68 0.00 0.00 39.33 40.68 1j1w h ASP 299 CO -0.25 0.57 -0.48 0.25 -1.61 0.00 0.00 179.24 177.72 1j1w h LEU 300 N 0.73 -1.17 -1.66 2.28 6.46 -1.19 -1.86 115.31 118.89 1j1w h LEU 300 Ca 0.18 0.05 0.27 0.00 -0.12 0.00 0.00 57.88 58.26 1j1w h LEU 300 Cb 0.10 0.32 -0.04 0.00 -0.73 0.00 0.00 40.66 40.30 1j1w h LEU 300 CO -0.02 -0.79 0.88 1.88 -0.62 0.00 0.00 178.44 179.77 1j1w h TYR 301 N -1.29 0.00 0.00 1.25 0.99 -1.38 -0.29 116.97 116.24 1j1w h TYR 301 Ca -0.13 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.55 1j1w h TYR 301 Cb 1.01 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 38.73 1j1w h TYR 301 CO -0.04 0.00 -1.61 0.00 -0.00 0.00 0.00 178.16 176.52 1j1w n ALA 302 N -2.44 2.50 0.09 3.88 0.00 -1.00 -4.32 120.51 119.22 1j1w n ALA 302 Ca 0.20 -0.48 0.06 0.00 0.00 0.00 0.00 53.44 53.21 1j1w n ALA 302 Cb 1.18 -0.86 -0.01 0.00 0.00 0.00 0.00 19.45 19.76 1j1w n ALA 302 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j1w h ARG 303 N 0.00 0.00 0.00 0.00 2.47 -0.24 -3.37 114.38 113.24 1j1w h ARG 303 Ca -0.06 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.61 1j1w h ARG 303 Cb 1.17 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.48 1j1w h ARG 303 CO 0.01 0.16 -0.50 -0.84 0.56 0.00 0.00 179.97 179.36 1j1w h ILE 304 N 0.00 0.31 0.00 2.04 3.07 -1.62 -3.33 117.51 117.98 1j1w h ILE 304 Ca -0.06 -1.48 0.00 0.00 1.55 0.00 0.00 64.86 64.87 1j1w h ILE 304 Cb 1.26 2.03 0.00 0.00 -0.27 0.00 0.00 36.82 39.85 1j1w h ILE 304 CO 0.02 0.18 0.11 0.29 -1.05 0.00 0.00 178.15 177.70 1j1w n LYS 305 N -3.03 0.00 0.01 0.16 5.02 -1.26 0.20 118.16 119.26 1j1w n LYS 305 Ca 0.01 0.14 0.11 0.00 -2.02 0.00 0.00 58.31 56.54 1j1w n LYS 305 Cb 0.63 -1.61 -0.09 0.00 -0.02 0.00 0.00 35.03 33.94 1j1w n LYS 305 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1j1w n THR 306 N -1.02 0.06 -1.80 -0.18 5.66 -1.25 -4.96 114.28 110.79 1j1w n THR 306 Ca 0.00 -0.24 -0.31 0.00 -3.05 0.00 0.00 64.05 60.45 1j1w n THR 306 Cb 0.11 0.42 0.02 0.00 -1.55 0.00 0.00 70.33 69.33 1j1w n THR 306 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1j1w s LEU 307 N -3.80 3.25 0.24 1.09 2.01 0.54 -4.97 118.68 117.03 1j1w s LEU 307 Ca 0.01 1.56 -0.30 0.00 0.01 0.00 0.00 54.13 55.42 1j1w s LEU 307 Cb 0.15 -4.49 -0.15 0.00 0.01 0.00 0.00 46.19 41.71 1j1w s LEU 307 CO 0.86 -1.13 1.02 -2.65 1.01 0.00 0.00 176.35 175.46 1j1w n PRO 308 N -2.75 1.15 -0.47 1.29 -0.02 -1.26 -4.64 135.00 128.29 1j1w n PRO 308 Ca 0.07 0.41 0.39 0.00 -2.02 0.00 0.00 63.50 62.34 1j1w n PRO 308 Cb 0.54 -1.79 0.67 0.00 -0.02 0.00 0.00 33.50 32.90 1j1w n PRO 308 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1j1w h GLU 309 N 2.43 0.07 0.00 -0.52 4.57 -1.95 0.53 114.58 119.71 1j1w h GLU 309 Ca -0.40 -0.00 -0.24 0.00 -1.18 0.00 0.00 59.36 57.54 1j1w h GLU 309 Cb 1.35 -0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.89 1j1w h GLU 309 CO 0.64 0.04 -1.41 0.00 -1.18 0.00 0.00 179.01 177.10 1j1w h ALA 310 N 1.53 0.64 -0.67 2.92 0.00 -2.01 -3.24 119.26 118.43 1j1w h ALA 310 Ca 0.83 -1.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 1j1w h ALA 310 Cb 2.72 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 20.74 1j1w h ALA 310 CO -0.37 1.35 0.14 -0.22 0.00 0.00 0.00 179.25 180.15 1j1w h LYS 311 N 0.00 1.10 0.76 0.00 3.64 -0.29 -2.45 116.57 119.32 1j1w h LYS 311 Ca -0.18 -0.28 -0.03 0.00 -1.27 0.00 0.00 60.65 58.89 1j1w h LYS 311 Cb 1.85 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 33.54 1j1w h LYS 311 CO 0.09 0.99 -0.45 1.96 -2.27 0.00 0.00 179.45 179.77 1j1w h GLN 312 N 1.02 -1.09 -0.90 1.90 4.20 -1.38 -2.73 115.11 116.13 1j1w h GLN 312 Ca 0.21 0.07 0.24 0.00 0.06 0.00 0.00 58.65 59.24 1j1w h GLN 312 Cb 0.41 0.25 -0.16 0.00 0.30 0.00 0.00 27.48 28.28 1j1w h GLN 312 CO 0.01 -0.72 0.14 -0.22 -0.67 0.00 0.00 178.83 177.37 1j1w h LYS 313 N -1.13 0.11 0.17 1.46 3.11 -1.55 -0.27 116.57 118.47 1j1w h LYS 313 Ca -0.10 -0.01 0.01 0.00 -2.81 0.00 0.00 60.65 57.75 1j1w h LYS 313 Cb 0.90 -0.03 -0.03 0.00 -1.00 0.00 0.00 32.23 32.08 1j1w h LYS 313 CO 0.11 0.07 -0.27 1.49 -2.81 0.00 0.00 179.45 178.05 1j1w h GLU 314 N 0.12 -0.49 0.54 1.90 4.81 -1.15 0.81 114.58 121.11 1j1w h GLU 314 Ca 0.56 0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.80 1j1w h GLU 314 Cb 1.14 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.62 1j1w h GLU 314 CO -0.75 -0.33 -0.39 0.82 -0.73 0.00 0.00 179.01 177.63 1j1w h ILE 315 N -0.51 0.00 -0.63 2.32 2.04 -0.83 0.02 117.51 119.92 1j1w h ILE 315 Ca 0.02 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.00 1j1w h ILE 315 Cb 0.51 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.49 1j1w h ILE 315 CO -0.12 0.00 0.06 -0.08 0.00 0.00 0.00 178.15 178.02 1j1w h GLU 316 N -0.89 0.17 -0.13 2.37 4.57 -1.07 0.51 114.58 120.11 1j1w h GLU 316 Ca -0.07 -0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.12 1j1w h GLU 316 Cb 0.74 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.28 1j1w h GLU 316 CO 0.03 0.11 0.09 0.00 -1.18 0.00 0.00 179.01 178.07 1j1w h ALA 317 N 1.55 2.04 0.05 2.92 0.00 0.93 -0.59 119.26 126.16 1j1w h ALA 317 Ca 0.33 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.99 1j1w h ALA 317 Cb 0.54 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1j1w h ALA 317 CO -0.49 -0.07 -1.24 -0.44 0.00 0.00 0.00 179.25 177.01 1j1w h ASP 318 N 0.07 0.18 -0.46 0.00 3.32 0.18 -3.18 116.42 116.52 1j1w h ASP 318 Ca 0.06 -0.21 0.01 0.00 0.02 0.00 0.00 57.03 56.90 1j1w h ASP 318 Cb 0.15 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1j1w h ASP 318 CO -0.01 1.17 0.31 0.40 -1.72 0.00 0.00 179.24 179.39 1j1w h ILE 319 N 0.03 1.12 -0.80 0.35 1.08 0.12 -1.55 117.51 117.86 1j1w h ILE 319 Ca -0.11 -0.21 0.06 0.00 -0.39 0.00 0.00 64.86 64.20 1j1w h ILE 319 Cb 1.89 0.44 -0.05 0.00 -3.07 0.00 0.00 36.82 36.03 1j1w h ILE 319 CO 0.15 0.11 0.52 1.56 -0.69 0.00 0.00 178.15 179.81 1j1w h GLN 320 N 0.62 0.85 -0.03 2.37 1.08 -1.30 -0.36 115.11 118.34 1j1w h GLN 320 Ca 0.17 -0.05 0.01 0.00 -1.45 0.00 0.00 58.65 57.33 1j1w h GLN 320 Cb -0.07 -0.19 -0.00 0.00 -0.05 0.00 0.00 27.48 27.17 1j1w h GLN 320 CO -0.04 0.56 0.03 0.00 -0.95 0.00 0.00 178.83 178.43 1j1w h ALA 321 N 1.57 1.55 0.16 3.87 0.00 -1.26 -1.47 119.26 123.68 1j1w h ALA 321 Ca 0.34 -0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.99 1j1w h ALA 321 Cb 0.23 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.04 1j1w h ALA 321 CO -0.12 -0.05 -1.21 0.28 0.00 0.00 0.00 179.25 178.16 1j1w h VAL 322 N 0.00 1.28 0.00 0.00 2.07 -0.91 -2.79 116.25 115.89 1j1w h VAL 322 Ca 0.01 -2.53 0.00 0.00 0.82 0.00 0.00 66.70 65.00 1j1w h VAL 322 Cb 0.08 2.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.85 1j1w h VAL 322 CO -0.00 0.75 0.00 -1.22 0.02 0.00 0.00 177.57 177.12 1j1w n TYR 323 N -3.94 0.00 -0.07 1.57 0.53 -0.59 -0.44 117.16 114.22 1j1w n TYR 323 Ca -0.19 0.00 -0.05 0.00 -1.02 0.00 0.00 57.90 56.64 1j1w n TYR 323 Cb 0.93 -0.31 -0.13 0.00 -1.03 0.00 0.00 39.34 38.79 1j1w n TYR 323 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1j1w n ALA 324 N -1.31 1.77 0.91 -0.72 0.00 -0.95 -4.34 120.51 115.87 1j1w n ALA 324 Ca 0.02 -1.00 0.12 0.00 0.00 0.00 0.00 53.44 52.59 1j1w n ALA 324 Cb 0.04 -0.19 0.32 0.00 0.00 0.00 0.00 19.45 19.61 1j1w n ALA 324 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1j1w n GLN 325 N -2.54 0.06 -4.23 0.00 7.27 0.42 -4.92 117.38 113.44 1j1w n GLN 325 Ca -0.23 0.02 -0.19 0.00 0.07 0.00 0.00 57.00 56.67 1j1w n GLN 325 Cb 0.95 -1.54 -0.11 0.00 2.41 0.00 0.00 30.24 31.94 1j1w n GLN 325 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1j1w s ARG 326 N -3.03 0.98 0.79 3.69 0.52 0.24 -5.07 118.95 117.06 1j1w s ARG 326 Ca 0.11 -1.16 -0.16 0.00 -0.52 0.00 0.00 55.73 54.01 1j1w s ARG 326 Cb 0.17 -0.93 -0.04 0.00 0.52 0.00 0.00 34.95 34.67 1j1w s ARG 326 CO 0.66 0.19 0.33 -2.30 0.02 0.00 0.00 175.30 174.20 1j1w n PRO 327 N 0.79 0.11 -2.63 3.54 -0.02 -1.26 -4.76 135.00 130.77 1j1w n PRO 327 Ca -0.17 0.07 -0.41 0.00 -2.02 0.00 0.00 63.50 60.97 1j1w n PRO 327 Cb 0.56 -1.70 -0.04 0.00 -0.02 0.00 0.00 33.50 32.29 1j1w n PRO 327 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1j1w s GLN 328 N -2.79 4.68 0.31 -0.52 -0.21 -1.26 -4.79 119.66 115.08 1j1w s GLN 328 Ca 0.60 1.59 -0.21 0.00 0.02 0.00 0.00 55.36 57.36 1j1w s GLN 328 Cb -0.31 -3.31 -0.09 0.00 1.00 0.00 0.00 33.01 30.30 1j1w s GLN 328 CO 0.63 0.20 0.84 -0.51 -2.12 0.00 0.00 175.29 174.33 1j1w s LEU 329 N -0.42 4.22 0.76 2.90 1.43 -1.26 -1.24 118.68 125.08 1j1w s LEU 329 Ca 0.47 1.58 -0.15 0.00 -1.03 0.00 0.00 54.13 55.00 1j1w s LEU 329 Cb -0.27 -3.98 0.06 0.00 0.03 0.00 0.00 46.19 42.03 1j1w s LEU 329 CO 0.33 -0.11 1.23 0.00 0.23 0.00 0.00 176.35 178.03 1j1w s ALA 330 N -1.75 1.99 -0.01 4.21 0.00 -0.67 -4.36 121.76 121.18 1j1w s ALA 330 Ca 0.51 0.96 0.06 0.00 0.00 0.00 0.00 51.96 53.48 1j1w s ALA 330 Cb -0.15 -3.51 -0.03 0.00 0.00 0.00 0.00 23.12 19.43 1j1w s ALA 330 CO 0.20 -2.09 -0.19 -1.64 0.00 0.00 0.00 175.76 172.04 1j1w s MET 331 N -3.91 2.25 0.14 0.00 1.00 0.39 -2.37 119.30 116.79 1j1w s MET 331 Ca 0.76 -0.85 -0.05 0.00 0.00 0.00 0.00 55.69 55.54 1j1w s MET 331 Cb -0.31 -2.22 -0.06 0.00 0.00 0.00 0.00 34.83 32.23 1j1w s MET 331 CO 0.47 0.58 1.34 0.28 0.00 0.00 0.00 175.02 177.69 1j1w h VAL 332 N 4.28 1.37 -1.83 -6.03 2.07 -1.47 -3.42 116.25 111.22 1j1w h VAL 332 Ca -0.46 -2.26 -0.22 0.00 0.82 0.00 0.00 66.70 64.58 1j1w h VAL 332 Cb 1.14 2.25 -0.30 0.00 -1.52 0.00 0.00 31.29 32.87 1j1w h VAL 332 CO 0.48 0.68 -0.55 0.21 0.02 0.00 0.00 177.57 178.41 1j1w s ASN 333 N -7.07 0.68 0.24 0.57 3.84 -0.99 -5.06 114.94 107.15 1j1w s ASN 333 Ca -0.07 -0.41 -0.05 0.00 0.21 0.00 0.00 52.86 52.54 1j1w s ASN 333 Cb 0.09 0.96 0.38 0.00 -0.55 0.00 0.00 41.25 42.13 1j1w s ASN 333 CO 0.87 -0.36 1.80 0.77 -2.79 0.00 0.00 177.10 177.39 1j1w h SER 334 N 8.19 0.59 0.02 -4.21 4.64 -1.81 -2.93 113.55 118.04 1j1w h SER 334 Ca -0.11 0.05 -0.12 0.00 -0.47 0.00 0.00 61.79 61.14 1j1w h SER 334 Cb 1.11 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 63.14 1j1w h SER 334 CO 0.28 0.33 -0.39 0.44 -0.87 0.00 0.00 176.83 176.63 1j1w h ASP 335 N 0.72 0.51 -0.16 4.97 3.32 -1.88 -3.09 116.42 120.81 1j1w h ASP 335 Ca 0.38 -0.22 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1j1w h ASP 335 Cb 0.38 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.78 1j1w h ASP 335 CO -0.26 0.85 0.00 0.29 -1.72 0.00 0.00 179.24 178.40 1j1w n LYS 336 N -4.04 1.90 0.00 3.56 5.02 -1.19 -4.93 118.16 118.48 1j1w n LYS 336 Ca -0.01 -1.34 0.00 0.00 -2.02 0.00 0.00 58.31 54.93 1j1w n LYS 336 Cb 0.50 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 34.07 1j1w n LYS 336 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1j1w n GLY 337 N 1.22 2.93 3.52 0.72 0.00 -1.12 -4.97 105.19 107.50 1j1w n GLY 337 Ca 0.17 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.70 1j1w n GLY 337 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1j1w n ILE 338 N -2.00 0.28 -2.65 -0.61 2.08 -1.15 -4.94 119.36 110.37 1j1w n ILE 338 Ca 0.00 -0.29 -0.23 0.00 0.56 0.00 0.00 62.75 62.79 1j1w n ILE 338 Cb 0.00 -1.89 0.10 0.00 -0.75 0.00 0.00 39.64 37.10 1j1w n ILE 338 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 1j1w s THR 339 N 7.06 2.11 0.31 1.39 -4.23 -1.26 -1.51 115.64 119.51 1j1w s THR 339 Ca 1.05 -0.65 0.24 0.00 -1.18 0.00 0.00 61.69 61.15 1j1w s THR 339 Cb -0.71 -2.46 0.23 0.00 1.34 0.00 0.00 72.50 70.90 1j1w s THR 339 CO 0.46 0.00 1.94 -1.13 -0.54 0.00 0.00 174.62 175.35 1j1w h ASN 340 N -0.46 0.00 -0.79 3.99 -0.73 -1.79 -2.63 115.58 113.17 1j1w h ASN 340 Ca -0.35 0.00 -0.45 0.00 1.87 0.00 0.00 56.30 57.37 1j1w h ASN 340 Cb 1.27 0.00 -0.25 0.00 0.27 0.00 0.00 38.32 39.61 1j1w h ASN 340 CO 0.40 0.21 0.39 0.18 -0.37 0.00 0.00 177.43 178.23 1j1w n LEU 341 N -3.62 6.03 -0.12 0.34 4.77 -1.26 -4.53 117.00 118.61 1j1w n LEU 341 Ca -0.01 -3.84 -0.25 0.00 -0.03 0.00 0.00 56.01 51.87 1j1w n LEU 341 Cb 0.34 -0.78 -0.11 0.00 -2.33 0.00 0.00 43.42 40.55 1j1w n LEU 341 CO 0.33 1.25 -1.13 1.41 -1.33 0.00 0.00 177.39 177.91 1j1w n HIS 342 N -1.08 0.38 -4.44 -1.77 8.25 -0.99 -1.31 115.22 114.26 1j1w n HIS 342 Ca 0.52 0.14 -0.22 0.00 -0.26 0.00 0.00 57.72 57.90 1j1w n HIS 342 Cb 1.28 -1.04 -0.16 0.00 1.12 0.00 0.00 29.99 31.19 1j1w n HIS 342 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1j1w s VAL 343 N -2.47 0.88 0.27 1.59 1.01 -1.26 -2.11 120.40 118.30 1j1w s VAL 343 Ca -0.34 -0.38 -0.06 0.00 0.00 0.00 0.00 61.98 61.20 1j1w s VAL 343 Cb 0.11 -0.80 0.36 0.00 0.00 0.00 0.00 36.38 36.04 1j1w s VAL 343 CO 0.55 0.28 1.60 -0.65 0.00 0.00 0.00 175.10 176.88 1j1w h PRO 344 N 6.63 0.04 -0.63 2.72 0.11 -1.88 -2.58 132.00 136.40 1j1w h PRO 344 Ca -0.34 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1j1w h PRO 344 Cb 1.17 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1j1w h PRO 344 CO 0.48 0.02 0.00 0.43 -0.21 0.00 0.00 178.00 178.72 1j1w n SER 345 N -5.47 4.90 -0.03 -2.05 7.64 -1.26 -4.44 113.62 112.91 1j1w n SER 345 Ca 0.16 -2.65 -0.14 0.00 1.01 0.00 0.00 58.87 57.25 1j1w n SER 345 Cb 0.54 -0.62 -0.11 0.00 -1.01 0.00 0.00 64.21 63.01 1j1w n SER 345 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 1j1w h ASP 346 N 3.68 0.09 -3.43 6.43 3.32 -1.81 -3.41 116.42 121.28 1j1w h ASP 346 Ca 0.00 -0.67 -0.72 0.00 0.02 0.00 0.00 57.03 55.66 1j1w h ASP 346 Cb 1.63 -0.03 -0.24 0.00 0.22 0.00 0.00 39.33 40.91 1j1w h ASP 346 CO 0.35 0.74 -0.42 -0.69 -1.72 0.00 0.00 179.24 177.50 1j1w s VAL 347 N -3.55 4.87 -0.23 -1.35 1.01 -1.26 -5.01 120.40 114.86 1j1w s VAL 347 Ca -0.16 -1.02 -0.03 0.00 0.00 0.00 0.00 61.98 60.76 1j1w s VAL 347 Cb 0.01 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.55 1j1w s VAL 347 CO 0.70 -0.44 -0.04 -0.63 0.00 0.00 0.00 175.10 174.69 1j1w s ILE 348 N 1.58 3.24 0.20 2.22 1.01 -1.26 -4.49 121.20 123.69 1j1w s ILE 348 Ca 0.03 -0.68 -0.01 0.00 0.00 0.00 0.00 60.65 60.00 1j1w s ILE 348 Cb -0.22 -2.54 0.28 0.00 0.01 0.00 0.00 42.46 40.00 1j1w s ILE 348 CO 0.06 0.33 1.01 0.55 0.00 0.00 0.00 174.94 176.90 1j1w n VAL 349 N 4.76 -0.27 0.23 2.92 3.14 -0.63 -1.01 118.33 127.47 1j1w n VAL 349 Ca -0.17 1.45 0.10 0.00 -2.96 0.00 0.00 64.34 62.75 1j1w n VAL 349 Cb 0.49 -2.08 0.66 0.00 -1.06 0.00 0.00 33.84 31.86 1j1w n VAL 349 CO 0.00 0.00 0.00 -2.24 -6.46 0.00 0.00 176.83 168.13 1j1w h ASP 350 N 0.00 0.00 0.00 6.55 2.03 -1.94 -2.75 116.42 120.30 1j1w h ASP 350 Ca 0.37 0.00 -0.36 0.00 -0.73 0.00 0.00 57.03 56.31 1j1w h ASP 350 Cb 0.71 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 39.15 1j1w h ASP 350 CO -0.63 0.00 -2.24 0.00 -1.03 0.00 0.00 179.24 175.34 1j1w n ALA 351 N -2.54 1.55 -0.31 4.15 0.00 -0.31 -4.41 120.51 118.63 1j1w n ALA 351 Ca -0.01 -0.90 0.03 0.00 0.00 0.00 0.00 53.44 52.56 1j1w n ALA 351 Cb 0.16 0.15 0.10 0.00 0.00 0.00 0.00 19.45 19.87 1j1w n ALA 351 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1j1w h SER 352 N -0.57 -0.88 0.74 0.00 4.64 -1.08 -2.52 113.55 113.88 1j1w h SER 352 Ca -0.54 0.26 -0.04 0.00 -0.47 0.00 0.00 61.79 61.01 1j1w h SER 352 Cb 1.57 0.56 0.01 0.00 -0.31 0.00 0.00 62.40 64.22 1j1w h SER 352 CO -0.27 -0.29 -0.36 0.24 -0.87 0.00 0.00 176.83 175.28 1j1w h MET 353 N -0.01 -0.96 -0.84 4.77 2.86 -1.73 -0.88 114.93 118.13 1j1w h MET 353 Ca 0.40 0.07 0.17 0.00 -2.06 0.00 0.00 59.70 58.28 1j1w h MET 353 Cb 0.63 0.22 -0.16 0.00 0.06 0.00 0.00 31.60 32.35 1j1w h MET 353 CO -0.90 -0.64 -0.18 -1.35 1.06 0.00 0.00 176.91 174.90 1j1w h PRO 354 N -1.23 0.01 0.05 -0.22 0.11 -1.71 0.52 132.00 129.52 1j1w h PRO 354 Ca -0.10 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.01 1j1w h PRO 354 Cb 0.77 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.87 1j1w h PRO 354 CO 0.17 0.00 -0.03 0.00 -0.21 0.00 0.00 178.00 177.93 1j1w h ALA 355 N 1.84 -0.07 -0.12 -0.75 0.00 -1.47 -0.23 119.26 118.47 1j1w h ALA 355 Ca 0.41 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.34 1j1w h ALA 355 Cb 0.65 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1j1w h ALA 355 CO -0.86 -0.54 0.09 1.98 0.00 0.00 0.00 179.25 179.92 1j1w h MET 356 N -0.07 0.00 0.06 0.00 -1.53 0.83 0.47 114.93 114.69 1j1w h MET 356 Ca -0.00 0.00 -0.00 0.00 -3.44 0.00 0.00 59.70 56.25 1j1w h MET 356 Cb 0.06 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.11 1j1w h MET 356 CO 0.01 0.00 -0.03 0.82 0.14 0.00 0.00 176.91 177.85 1j1w h ILE 357 N 0.00 1.22 -0.66 1.77 2.04 0.54 -1.42 117.51 121.00 1j1w h ILE 357 Ca 0.06 -1.54 0.11 0.00 1.00 0.00 0.00 64.86 64.48 1j1w h ILE 357 Cb 0.23 2.14 -0.12 0.00 -0.74 0.00 0.00 36.82 38.34 1j1w h ILE 357 CO -0.00 0.35 -0.35 -0.09 0.00 0.00 0.00 178.15 178.06 1j1w h ARG 358 N -0.84 -0.13 -2.78 2.37 2.43 0.03 -2.12 114.38 113.34 1j1w h ARG 358 Ca -0.01 0.01 -0.21 0.00 -0.81 0.00 0.00 59.98 58.96 1j1w h ARG 358 Cb 0.64 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.20 1j1w h ARG 358 CO 0.01 -0.09 0.93 -0.25 -1.51 0.00 0.00 179.97 179.07 1j1w n ASP 359 N -5.44 3.72 -2.27 -3.80 8.00 0.05 -1.98 116.55 114.83 1j1w n ASP 359 Ca 0.05 -2.15 -0.14 0.00 0.71 0.00 0.00 54.79 53.25 1j1w n ASP 359 Cb 0.36 -0.92 -0.02 0.00 -0.02 0.00 0.00 41.12 40.53 1j1w n ASP 359 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1j1w n SER 360 N 3.24 -4.25 -2.94 -2.24 7.64 -1.06 -0.79 113.62 113.21 1j1w n SER 360 Ca 0.32 0.18 -0.19 0.00 1.01 0.00 0.00 58.87 60.20 1j1w n SER 360 Cb 0.39 -3.64 0.06 0.00 -1.01 0.00 0.00 64.21 60.02 1j1w n SER 360 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1j1w n GLY 361 N -0.76 -0.23 3.26 0.23 0.00 -0.56 -4.87 105.19 102.26 1j1w n GLY 361 Ca -0.16 0.06 -0.14 0.00 0.00 0.00 0.00 46.02 45.77 1j1w n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j1w s LYS 362 N -5.97 1.17 -0.02 1.61 1.02 0.03 -3.71 119.74 113.86 1j1w s LYS 362 Ca 0.43 -1.57 -0.02 0.00 0.02 0.00 0.00 55.97 54.83 1j1w s LYS 362 Cb -0.19 -0.35 0.00 0.00 -0.52 0.00 0.00 37.83 36.78 1j1w s LYS 362 CO 0.58 -0.13 0.06 -1.64 -0.92 0.00 0.00 175.35 173.30 1j1w s MET 363 N -3.91 0.09 0.26 1.68 -1.94 -0.71 -4.60 119.30 110.17 1j1w s MET 363 Ca 0.25 0.04 -0.30 0.00 -1.71 0.00 0.00 55.69 53.97 1j1w s MET 363 Cb 0.06 0.04 -0.14 0.00 2.01 0.00 0.00 34.83 36.80 1j1w s MET 363 CO 0.05 -0.01 1.17 0.91 -0.01 0.00 0.00 175.02 177.13 1j1w n TRP 364 N 2.94 1.60 -3.00 -0.03 7.02 -1.26 -2.73 117.44 121.97 1j1w n TRP 364 Ca -0.13 0.62 -0.10 0.00 -1.02 0.00 0.00 57.50 56.87 1j1w n TRP 364 Cb 0.59 -2.32 0.04 0.00 -2.42 0.00 0.00 31.31 27.19 1j1w n TRP 364 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1j1w n GLY 365 N 1.54 1.91 0.37 6.99 0.00 0.03 -0.46 105.19 115.58 1j1w n GLY 365 Ca 0.11 -2.18 0.02 0.00 0.00 0.00 0.00 46.02 43.97 1j1w n GLY 365 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1j1w h PRO 366 N 0.00 1.15 0.00 1.61 0.11 -1.88 -3.21 132.00 129.78 1j1w h PRO 366 Ca -0.14 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.90 1j1w h PRO 366 Cb 0.65 -0.26 0.00 0.00 0.11 0.00 0.00 31.00 31.50 1j1w h PRO 366 CO 0.20 0.76 0.00 -0.40 -0.21 0.00 0.00 178.00 178.35 1j1w n ASP 367 N -4.50 0.00 0.00 -2.05 5.75 -1.26 -4.84 116.55 109.65 1j1w n ASP 367 Ca 0.15 0.67 0.00 0.00 -0.01 0.00 0.00 54.79 55.60 1j1w n ASP 367 Cb 0.17 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.10 1j1w n ASP 367 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1j1w n GLY 368 N -0.68 0.00 3.48 6.12 0.00 -1.21 -4.84 105.19 108.05 1j1w n GLY 368 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1j1w n GLY 368 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j1w s LYS 369 N 0.00 1.66 0.52 1.61 1.02 -1.26 -4.85 119.74 118.43 1j1w s LYS 369 Ca 0.00 -1.85 -0.19 0.00 0.02 0.00 0.00 55.97 53.95 1j1w s LYS 369 Cb 0.00 -1.36 -0.07 0.00 -0.52 0.00 0.00 37.83 35.88 1j1w s LYS 369 CO 0.00 0.07 1.04 -0.51 -0.92 0.00 0.00 175.35 175.03 1j1w s LEU 370 N -3.51 3.74 0.08 3.17 1.43 -1.26 -0.79 118.68 121.54 1j1w s LEU 370 Ca 0.31 1.88 -0.14 0.00 -1.03 0.00 0.00 54.13 55.14 1j1w s LEU 370 Cb 0.04 -4.55 0.02 0.00 0.03 0.00 0.00 46.19 41.73 1j1w s LEU 370 CO 0.14 -0.87 0.33 -1.00 0.23 0.00 0.00 176.35 175.18 1j1w s HIS 371 N -2.14 -0.11 0.65 0.29 3.76 -1.11 -4.87 115.29 111.76 1j1w s HIS 371 Ca 0.66 -0.14 -0.18 0.00 -0.15 0.00 0.00 55.06 55.25 1j1w s HIS 371 Cb -0.16 0.14 -0.01 0.00 1.11 0.00 0.00 32.58 33.66 1j1w s HIS 371 CO 0.25 -0.59 1.24 -0.51 -0.85 0.00 0.00 174.74 174.28 1j1w s ASP 372 N -2.50 4.72 0.12 1.40 1.01 -1.26 -1.74 116.67 118.42 1j1w s ASP 372 Ca -0.00 2.47 0.02 0.00 0.71 0.00 0.00 52.55 55.75 1j1w s ASP 372 Cb 0.01 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 1j1w s ASP 372 CO -0.08 -1.92 -0.06 0.28 0.21 0.00 0.00 175.17 173.60 1j1w s THR 373 N -1.62 0.79 -0.57 -1.27 -1.32 -1.24 -2.24 115.64 108.18 1j1w s THR 373 Ca 0.79 -1.97 -0.02 0.00 -1.21 0.00 0.00 61.69 59.28 1j1w s THR 373 Cb -0.33 -1.80 0.15 0.00 -1.51 0.00 0.00 72.50 69.01 1j1w s THR 373 CO 0.39 -0.78 0.36 -0.75 -2.21 0.00 0.00 174.62 171.63 1j1w s LYS 374 N -3.83 2.35 -0.29 7.08 2.20 -0.40 -2.02 119.74 124.82 1j1w s LYS 374 Ca 0.15 -2.41 -0.29 0.00 -0.36 0.00 0.00 55.97 53.06 1j1w s LYS 374 Cb 0.05 -3.63 -0.01 0.00 -1.51 0.00 0.00 37.83 32.73 1j1w s LYS 374 CO -0.02 -1.14 1.50 0.00 -0.36 0.00 0.00 175.35 175.33 1j1w s ALA 375 N 0.13 3.21 -0.46 3.13 0.00 -0.11 -2.74 121.76 124.91 1j1w s ALA 375 Ca 0.15 0.21 -0.21 0.00 0.00 0.00 0.00 51.96 52.12 1j1w s ALA 375 Cb -0.21 -3.86 0.03 0.00 0.00 0.00 0.00 23.12 19.08 1j1w s ALA 375 CO -0.03 -2.05 0.66 0.08 0.00 0.00 0.00 175.76 174.42 1j1w s VAL 376 N 5.17 4.80 -0.69 0.00 1.01 0.79 0.14 120.40 131.63 1j1w s VAL 376 Ca 0.66 -0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.63 1j1w s VAL 376 Cb -0.20 -4.25 0.17 0.00 0.00 0.00 0.00 36.38 32.10 1j1w s VAL 376 CO 0.28 -0.69 0.49 -0.63 0.00 0.00 0.00 175.10 174.56 1j1w s ILE 377 N 2.86 3.29 0.22 2.22 1.01 -0.31 -1.32 121.20 129.18 1j1w s ILE 377 Ca 0.21 -3.74 -0.07 0.00 0.00 0.00 0.00 60.65 57.05 1j1w s ILE 377 Cb -0.15 -3.15 0.36 0.00 0.01 0.00 0.00 42.46 39.53 1j1w s ILE 377 CO 0.17 -0.95 1.27 -2.65 0.00 0.00 0.00 174.94 172.78 1j1w n PRO 378 N 2.57 -0.08 -0.38 2.79 -0.02 -1.26 -4.14 135.00 134.48 1j1w n PRO 378 Ca 0.15 1.27 -0.07 0.00 -2.02 0.00 0.00 63.50 62.83 1j1w n PRO 378 Cb 0.35 -1.90 0.05 0.00 -0.02 0.00 0.00 33.50 31.98 1j1w n PRO 378 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1j1w n ASP 379 N -5.32 -0.34 0.00 2.55 4.64 -1.26 -1.42 116.55 115.41 1j1w n ASP 379 Ca 0.13 -0.98 0.00 0.00 -1.38 0.00 0.00 54.79 52.56 1j1w n ASP 379 Cb 0.40 -0.23 0.00 0.00 -1.04 0.00 0.00 41.12 40.25 1j1w n ASP 379 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 1j1w n ARG 380 N -1.82 3.76 -0.22 -0.67 1.74 -1.26 -4.40 116.66 113.79 1j1w n ARG 380 Ca 0.04 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.14 1j1w n ARG 380 Cb 0.13 -0.58 0.14 0.00 -1.02 0.00 0.00 32.46 31.13 1j1w n ARG 380 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1j1w n TYR 382 N -5.05 0.00 -0.05 0.00 4.02 -1.26 -4.70 117.16 110.12 1j1w n TYR 382 Ca 0.11 -0.34 -0.12 0.00 -0.01 0.00 0.00 57.90 57.54 1j1w n TYR 382 Cb 0.34 -0.04 -0.06 0.00 -0.02 0.00 0.00 39.34 39.57 1j1w n TYR 382 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1j1w h ALA 383 N 0.00 0.22 -0.58 -0.72 0.00 -1.79 -3.23 119.26 113.17 1j1w h ALA 383 Ca 0.00 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.76 1j1w h ALA 383 Cb 0.72 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.35 1j1w h ALA 383 CO 0.00 -0.06 -0.56 0.78 0.00 0.00 0.00 179.25 179.41 1j1w h GLY 384 N 0.03 -0.94 -1.02 0.00 0.00 -1.84 -1.32 103.07 97.98 1j1w h GLY 384 Ca 0.05 0.74 0.42 0.00 0.00 0.00 0.00 47.33 48.53 1j1w h GLY 384 CO 0.01 -0.07 0.79 -2.08 0.00 0.00 0.00 176.54 175.18 1j1w h VAL 385 N -0.28 0.13 0.05 4.60 2.07 -1.83 0.55 116.25 121.53 1j1w h VAL 385 Ca 0.10 -0.04 -0.23 0.00 0.82 0.00 0.00 66.70 67.36 1j1w h VAL 385 Cb 0.54 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1j1w h VAL 385 CO -0.70 0.02 -1.06 1.88 0.02 0.00 0.00 177.57 177.73 1j1w h TYR 386 N 0.11 0.23 -0.24 1.57 0.99 -1.34 -3.08 116.97 115.20 1j1w h TYR 386 Ca 0.81 -0.16 -0.02 0.00 2.00 0.00 0.00 58.73 61.36 1j1w h TYR 386 Cb 2.43 -0.01 -0.01 0.00 1.00 0.00 0.00 36.73 40.14 1j1w h TYR 386 CO -0.01 1.09 0.06 0.37 -0.00 0.00 0.00 178.16 179.67 1j1w h GLN 387 N 0.04 0.39 0.16 4.88 5.75 0.39 0.14 115.11 126.86 1j1w h GLN 387 Ca -0.06 -0.09 0.02 0.00 -0.15 0.00 0.00 58.65 58.36 1j1w h GLN 387 Cb 1.79 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 30.26 1j1w h GLN 387 CO 0.16 0.50 -0.34 0.28 -2.65 0.00 0.00 178.83 176.77 1j1w h VAL 388 N 0.21 0.29 -0.78 2.39 2.07 -1.37 0.73 116.25 119.79 1j1w h VAL 388 Ca 0.07 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.67 1j1w h VAL 388 Cb 0.29 0.29 -0.05 0.00 -1.52 0.00 0.00 31.29 30.29 1j1w h VAL 388 CO 0.00 0.00 0.51 0.58 0.02 0.00 0.00 177.57 178.68 1j1w h VAL 389 N -0.59 1.02 -0.27 2.57 2.07 -1.44 0.51 116.25 120.12 1j1w h VAL 389 Ca 0.02 -0.28 -0.18 0.00 0.82 0.00 0.00 66.70 67.08 1j1w h VAL 389 Cb 0.60 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1j1w h VAL 389 CO -0.17 0.15 -0.53 0.40 0.02 0.00 0.00 177.57 177.44 1j1w h ILE 390 N 0.81 1.28 0.00 4.57 2.04 0.45 -2.84 117.51 123.83 1j1w h ILE 390 Ca 0.34 -1.72 0.00 0.00 1.00 0.00 0.00 64.86 64.48 1j1w h ILE 390 Cb 0.28 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.03 1j1w h ILE 390 CO -0.12 0.56 0.00 -0.62 0.00 0.00 0.00 178.15 177.97 1j1w n GLU 391 N -4.05 0.64 -0.03 2.37 -0.58 0.24 -3.18 120.64 116.05 1j1w n GLU 391 Ca -0.05 0.01 -0.22 0.00 -0.42 0.00 0.00 57.16 56.49 1j1w n GLU 391 Cb 0.62 -1.50 -0.13 0.00 -0.57 0.00 0.00 31.44 29.86 1j1w n GLU 391 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 1j1w h ASP 392 N 0.00 0.26 0.19 1.62 3.58 -0.73 -3.35 116.42 118.00 1j1w h ASP 392 Ca 0.00 -0.78 -0.01 0.00 0.42 0.00 0.00 57.03 56.66 1j1w h ASP 392 Cb 0.14 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.10 1j1w h ASP 392 CO 0.00 1.71 -0.09 0.00 -2.88 0.00 0.00 179.24 177.97 1j1w n LYS 394 N -5.16 0.31 0.00 0.00 2.85 -1.21 0.93 118.16 115.88 1j1w n LYS 394 Ca -0.09 0.07 0.00 0.00 -1.05 0.00 0.00 58.31 57.24 1j1w n LYS 394 Cb 0.16 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.04 1j1w n LYS 394 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29 1j1w n GLN 395 N -1.12 1.05 0.00 -1.58 7.27 -0.86 -3.79 117.38 118.35 1j1w n GLN 395 Ca 0.08 -0.95 0.00 0.00 0.07 0.00 0.00 57.00 56.20 1j1w n GLN 395 Cb 0.07 -0.93 0.00 0.00 2.41 0.00 0.00 30.24 31.78 1j1w n GLN 395 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 1j1w n HIS 396 N -0.24 0.00 -0.01 3.69 8.25 -0.20 -5.03 115.22 121.68 1j1w n HIS 396 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1j1w n HIS 396 Cb 0.17 0.03 -0.00 0.00 1.12 0.00 0.00 29.99 31.32 1j1w n HIS 396 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1j1w n GLY 397 N 0.00 -2.44 3.67 -1.41 0.00 0.27 -4.92 105.19 100.37 1j1w n GLY 397 Ca 0.00 -1.46 -0.40 0.00 0.00 0.00 0.00 46.02 44.16 1j1w n GLY 397 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j1w n ALA 398 N -2.16 0.91 -1.66 4.61 0.00 -1.26 -4.64 120.51 116.31 1j1w n ALA 398 Ca -0.00 0.18 -0.35 0.00 0.00 0.00 0.00 53.44 53.27 1j1w n ALA 398 Cb 0.01 -2.22 0.03 0.00 0.00 0.00 0.00 19.45 17.27 1j1w n ALA 398 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1j1w s PHE 399 N -1.30 2.56 -0.44 0.00 0.40 -1.26 -4.99 117.98 112.96 1j1w s PHE 399 Ca 0.67 1.54 -0.15 0.00 -0.60 0.00 0.00 56.93 58.39 1j1w s PHE 399 Cb -0.48 -3.30 0.04 0.00 0.51 0.00 0.00 43.02 39.79 1j1w s PHE 399 CO 0.54 -1.80 0.34 0.34 0.70 0.00 0.00 175.22 175.34 1j1w s ASP 400 N -2.00 6.12 0.61 1.36 -1.08 -1.26 -4.92 116.67 115.50 1j1w s ASP 400 Ca 0.72 -1.07 0.26 0.00 -0.52 0.00 0.00 52.55 51.94 1j1w s ASP 400 Cb -0.24 -2.17 1.18 0.00 -1.46 0.00 0.00 42.92 40.23 1j1w s ASP 400 CO 0.34 -0.53 1.60 -0.65 0.52 0.00 0.00 175.17 176.45 1j1w h PRO 401 N 8.68 0.00 0.00 4.34 0.11 -1.89 0.79 132.00 144.03 1j1w h PRO 401 Ca -0.28 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.82 1j1w h PRO 401 Cb 1.12 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1j1w h PRO 401 CO 0.79 0.00 -0.11 1.79 -0.21 0.00 0.00 178.00 180.26 1j1w h THR 402 N 0.00 0.14 0.00 -1.15 1.35 -1.82 -3.34 112.91 108.08 1j1w h THR 402 Ca 0.30 -1.20 0.00 0.00 -0.55 0.00 0.00 66.41 64.96 1j1w h THR 402 Cb 1.90 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 70.38 1j1w h THR 402 CO -0.00 0.08 -0.71 0.35 -0.25 0.00 0.00 175.52 174.98 1j1w n THR 403 N -3.11 0.00 -0.92 6.82 -2.24 0.25 -4.91 114.28 110.17 1j1w n THR 403 Ca 0.04 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.48 1j1w n THR 403 Cb 0.56 -0.59 0.11 0.00 -2.10 0.00 0.00 70.33 68.31 1j1w n THR 403 CO 0.00 0.00 0.00 1.15 -0.57 0.00 0.00 175.07 175.65 1j1w n MET 404 N -1.79 -0.13 0.00 -0.78 0.00 0.09 -4.38 117.12 110.14 1j1w n MET 404 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 57.70 57.71 1j1w n MET 404 Cb 0.36 -1.85 0.00 0.00 0.00 0.00 0.00 33.22 31.73 1j1w n MET 404 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1j1w n GLY 405 N 1.55 1.02 3.04 3.17 0.00 -1.01 -4.91 105.19 108.05 1j1w n GLY 405 Ca 0.07 -1.72 -0.14 0.00 0.00 0.00 0.00 46.02 44.23 1j1w n GLY 405 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1j1w s SER 406 N -1.00 0.81 -0.49 1.61 0.01 -1.26 -4.97 113.70 108.41 1j1w s SER 406 Ca 0.00 -0.44 0.03 0.00 1.31 0.00 0.00 55.95 56.85 1j1w s SER 406 Cb 0.00 0.01 0.14 0.00 0.21 0.00 0.00 66.02 66.38 1j1w s SER 406 CO 0.00 -0.14 0.27 -0.69 0.41 0.00 0.00 173.24 173.09 1j1w s VAL 407 N -1.08 1.97 0.00 3.43 1.01 -1.26 -2.15 120.40 122.32 1j1w s VAL 407 Ca -0.07 -2.99 0.00 0.00 0.00 0.00 0.00 61.98 58.92 1j1w s VAL 407 Cb -0.08 -2.37 0.00 0.00 0.00 0.00 0.00 36.38 33.93 1j1w s VAL 407 CO 0.00 -0.87 0.00 -2.65 0.00 0.00 0.00 175.10 171.58 1j1w n PRO 408 N 3.24 0.92 -3.15 2.72 -0.02 -1.26 -4.75 135.00 132.71 1j1w n PRO 408 Ca 0.08 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.61 1j1w n PRO 408 Cb 0.34 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 33.81 1j1w n PRO 408 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1j1w s ASN 409 N -1.74 -0.72 -0.78 2.55 3.84 -0.90 -2.82 114.94 114.36 1j1w s ASN 409 Ca 0.00 0.27 -0.18 0.00 0.21 0.00 0.00 52.86 53.16 1j1w s ASN 409 Cb 0.00 1.53 0.14 0.00 -0.55 0.00 0.00 41.25 42.37 1j1w s ASN 409 CO 0.00 -0.13 0.90 -0.69 -2.79 0.00 0.00 177.10 174.39 1j1w s VAL 410 N 2.93 4.91 0.04 -5.21 1.01 -0.02 -2.62 120.40 121.43 1j1w s VAL 410 Ca 0.12 -1.47 -0.01 0.00 0.00 0.00 0.00 61.98 60.63 1j1w s VAL 410 Cb -0.08 -4.62 -0.04 0.00 0.00 0.00 0.00 36.38 31.64 1j1w s VAL 410 CO -0.18 -1.28 0.18 -0.83 0.00 0.00 0.00 175.10 172.98 1j1w s GLY 411 N 3.33 2.16 -0.07 4.51 0.00 -0.91 -2.82 107.32 113.52 1j1w s GLY 411 Ca 0.22 -0.84 -0.22 0.00 0.00 0.00 0.00 44.72 43.88 1j1w s GLY 411 CO -0.03 -0.78 0.64 -2.27 0.00 0.00 0.00 173.10 170.66 1j1w s LEU 412 N -2.27 4.32 0.00 0.66 2.96 -0.70 -1.53 118.68 122.13 1j1w s LEU 412 Ca 0.31 1.11 0.00 0.00 -0.22 0.00 0.00 54.13 55.33 1j1w s LEU 412 Cb -0.13 -2.98 0.00 0.00 0.50 0.00 0.00 46.19 43.59 1j1w s LEU 412 CO 0.24 -0.06 0.00 1.15 -1.32 0.00 0.00 176.35 176.36 1j1w n MET 413 N 3.60 0.00 -0.95 1.98 0.00 -1.26 -1.89 117.12 118.59 1j1w n MET 413 Ca -0.03 0.00 -0.33 0.00 0.00 0.00 0.00 57.70 57.33 1j1w n MET 413 Cb 0.51 -0.18 -0.03 0.00 0.00 0.00 0.00 33.22 33.53 1j1w n MET 413 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1j1w n ALA 414 N -0.54 -2.32 -3.46 3.17 0.00 -1.02 0.12 120.51 116.46 1j1w n ALA 414 Ca 0.00 0.31 -0.18 0.00 0.00 0.00 0.00 53.44 53.57 1j1w n ALA 414 Cb 0.00 -1.09 0.09 0.00 0.00 0.00 0.00 19.45 18.44 1j1w n ALA 414 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1j1w n GLN 415 N 0.73 -6.63 -4.03 0.00 6.02 -1.25 -2.38 117.38 109.83 1j1w n GLN 415 Ca 0.12 0.83 -0.30 0.00 -0.01 0.00 0.00 57.00 57.65 1j1w n GLN 415 Cb 0.15 -5.83 -0.03 0.00 1.02 0.00 0.00 30.24 25.55 1j1w n GLN 415 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1j1w n LYS 416 N -4.22 -2.15 -1.71 -1.09 4.01 -1.04 -4.78 118.16 107.18 1j1w n LYS 416 Ca -0.26 0.30 -0.43 0.00 -0.51 0.00 0.00 58.31 57.40 1j1w n LYS 416 Cb 0.66 -4.04 -0.03 0.00 -0.51 0.00 0.00 35.03 31.11 1j1w n LYS 416 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1j1w n ALA 417 N -4.49 2.42 -0.85 7.82 0.00 0.34 -3.78 120.51 121.96 1j1w n ALA 417 Ca -0.27 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1j1w n ALA 417 Cb 0.67 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.65 1j1w n ALA 417 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1j1w n GLU 418 N 3.27 0.00 -0.25 0.00 1.02 -1.19 -3.48 120.64 120.00 1j1w n GLU 418 Ca 0.14 0.00 0.15 0.00 -0.02 0.00 0.00 57.16 57.43 1j1w n GLU 418 Cb 0.34 0.00 0.30 0.00 -0.02 0.00 0.00 31.44 32.06 1j1w n GLU 418 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1j1w n GLU 419 N 0.00 -0.06 0.00 3.49 1.02 -1.26 -0.97 120.64 122.86 1j1w n GLU 419 Ca 0.00 1.10 0.00 0.00 -0.02 0.00 0.00 57.16 58.24 1j1w n GLU 419 Cb 0.00 -1.82 0.00 0.00 -0.02 0.00 0.00 31.44 29.60 1j1w n GLU 419 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1j1w n TYR 420 N -4.93 0.00 -2.73 -0.32 4.02 -1.23 -1.28 117.16 110.70 1j1w n TYR 420 Ca 0.21 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 58.05 1j1w n TYR 420 Cb 0.71 -0.15 0.05 0.00 -0.02 0.00 0.00 39.34 39.93 1j1w n TYR 420 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1j1w n GLY 421 N -1.05 1.63 0.00 2.72 0.00 -0.15 -4.88 105.19 103.47 1j1w n GLY 421 Ca 0.00 -0.99 0.06 0.00 0.00 0.00 0.00 46.02 45.08 1j1w n GLY 421 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1j1w n SER 422 N -0.42 0.96 -0.26 1.61 3.41 -0.40 -4.75 113.62 113.76 1j1w n SER 422 Ca 0.05 -0.59 -0.05 0.00 -0.26 0.00 0.00 58.87 58.02 1j1w n SER 422 Cb 0.82 1.13 -0.00 0.00 -0.26 0.00 0.00 64.21 65.90 1j1w n SER 422 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 1j1w h HIS 423 N 0.00 -1.12 0.00 7.33 3.86 -1.90 0.27 115.15 123.60 1j1w h HIS 423 Ca 0.00 0.09 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 1j1w h HIS 423 Cb 0.34 0.59 0.00 0.00 1.06 0.00 0.00 27.41 29.40 1j1w h HIS 423 CO 0.00 -0.40 0.00 -0.40 0.86 0.00 0.00 177.93 177.99 1j1w n ASP 424 N -5.43 0.00 -0.68 2.45 5.75 -1.26 -1.88 116.55 115.49 1j1w n ASP 424 Ca 0.05 -1.14 0.03 0.00 -0.01 0.00 0.00 54.79 53.72 1j1w n ASP 424 Cb 0.36 0.00 0.05 0.00 -1.03 0.00 0.00 41.12 40.50 1j1w n ASP 424 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1j1w n LYS 425 N -0.57 0.34 -4.06 0.11 5.02 0.88 -5.00 118.16 114.88 1j1w n LYS 425 Ca 0.02 -1.70 -0.34 0.00 -2.02 0.00 0.00 58.31 54.27 1j1w n LYS 425 Cb 0.01 -0.63 -0.15 0.00 -0.02 0.00 0.00 35.03 34.23 1j1w n LYS 425 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1j1w s THR 426 N -0.75 2.54 0.07 -0.18 2.01 -0.79 -2.51 115.64 116.03 1j1w s THR 426 Ca 0.17 -0.78 0.07 0.00 0.31 0.00 0.00 61.69 61.46 1j1w s THR 426 Cb 0.17 -2.10 -0.03 0.00 0.01 0.00 0.00 72.50 70.55 1j1w s THR 426 CO -0.04 0.50 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.83 1j1w s PHE 427 N 1.34 1.67 -0.36 4.92 0.40 0.67 -4.97 117.98 121.65 1j1w s PHE 427 Ca 0.05 -0.40 -0.19 0.00 -0.60 0.00 0.00 56.93 55.79 1j1w s PHE 427 Cb -0.14 -0.95 0.00 0.00 0.51 0.00 0.00 43.02 42.45 1j1w s PHE 427 CO -0.09 0.13 0.54 -1.14 0.70 0.00 0.00 175.22 175.36 1j1w s GLN 428 N -1.56 3.56 0.08 0.44 0.74 -1.26 -1.19 119.66 120.47 1j1w s GLN 428 Ca 0.05 -0.19 -0.36 0.00 0.05 0.00 0.00 55.36 54.91 1j1w s GLN 428 Cb -0.09 -3.83 -0.16 0.00 1.10 0.00 0.00 33.01 30.02 1j1w s GLN 428 CO 0.03 -0.71 1.41 -0.89 -0.55 0.00 0.00 175.29 174.58 1j1w n ILE 429 N 5.50 0.02 0.24 -2.34 2.08 0.42 -4.83 119.36 120.45 1j1w n ILE 429 Ca -0.04 -0.00 0.12 0.00 0.56 0.00 0.00 62.75 63.39 1j1w n ILE 429 Cb 0.49 -0.98 0.18 0.00 -0.75 0.00 0.00 39.64 38.57 1j1w n ILE 429 CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 1j1w h PRO 430 N 5.00 0.00 -1.59 0.38 0.11 -1.91 -1.97 132.00 132.02 1j1w h PRO 430 Ca -0.47 0.00 0.22 0.00 0.11 0.00 0.00 66.00 65.86 1j1w h PRO 430 Cb 1.32 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 32.24 1j1w h PRO 430 CO 0.81 0.00 0.75 0.00 -0.21 0.00 0.00 178.00 179.35 1j1w s ALA 431 N -3.21 -2.02 0.50 -0.75 0.00 -1.26 -4.91 121.76 110.11 1j1w s ALA 431 Ca 0.07 1.52 -0.21 0.00 0.00 0.00 0.00 51.96 53.34 1j1w s ALA 431 Cb 0.06 -0.15 -0.09 0.00 0.00 0.00 0.00 23.12 22.94 1j1w s ALA 431 CO 0.67 -0.57 0.81 -0.25 0.00 0.00 0.00 175.76 176.42 1j1w n ASP 432 N -0.02 0.26 0.00 0.00 10.43 -1.26 -4.06 116.55 121.90 1j1w n ASP 432 Ca -0.02 0.89 0.00 0.00 2.57 0.00 0.00 54.79 58.23 1j1w n ASP 432 Cb 0.59 -1.28 0.00 0.00 1.84 0.00 0.00 41.12 42.27 1j1w n ASP 432 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1j1w n GLY 433 N 1.44 -0.66 3.15 0.44 0.00 -0.96 -3.20 105.19 105.39 1j1w n GLY 433 Ca 0.11 -0.49 -0.12 0.00 0.00 0.00 0.00 46.02 45.52 1j1w n GLY 433 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j1w s VAL 434 N -4.00 -0.03 -0.12 1.61 0.11 -0.44 -1.64 120.40 115.89 1j1w s VAL 434 Ca 0.00 0.09 -0.12 0.00 -2.93 0.00 0.00 61.98 59.03 1j1w s VAL 434 Cb 0.00 -0.45 -0.05 0.00 -1.53 0.00 0.00 36.38 34.35 1j1w s VAL 434 CO 0.00 0.04 0.25 -0.69 -3.33 0.00 0.00 175.10 171.37 1j1w s VAL 435 N 0.99 5.32 -0.09 2.04 1.01 -0.76 0.36 120.40 129.27 1j1w s VAL 435 Ca -0.07 0.47 0.01 0.00 0.00 0.00 0.00 61.98 62.38 1j1w s VAL 435 Cb -0.08 -3.56 0.02 0.00 0.00 0.00 0.00 36.38 32.76 1j1w s VAL 435 CO -0.07 0.50 -0.09 -0.13 0.00 0.00 0.00 175.10 175.31 1j1w s ARG 436 N -0.31 1.54 -0.38 2.72 0.52 0.39 -1.33 118.95 122.10 1j1w s ARG 436 Ca 0.16 -0.30 -0.14 0.00 -0.52 0.00 0.00 55.73 54.93 1j1w s ARG 436 Cb -0.13 -1.46 0.00 0.00 0.52 0.00 0.00 34.95 33.89 1j1w s ARG 436 CO 0.05 -0.14 0.28 0.08 0.02 0.00 0.00 175.30 175.60 1j1w s VAL 437 N 1.23 5.27 0.30 3.52 1.01 -0.58 -1.71 120.40 129.43 1j1w s VAL 437 Ca -0.04 -0.47 0.10 0.00 0.00 0.00 0.00 61.98 61.57 1j1w s VAL 437 Cb -0.14 -3.84 -0.05 0.00 0.00 0.00 0.00 36.38 32.35 1j1w s VAL 437 CO -0.03 -0.19 -0.03 0.42 0.00 0.00 0.00 175.10 175.28 1j1w s THR 438 N 1.71 2.93 0.00 3.92 -4.23 -0.43 -1.65 115.64 117.90 1j1w s THR 438 Ca 0.06 -2.02 0.00 0.00 -1.18 0.00 0.00 61.69 58.55 1j1w s THR 438 Cb -0.18 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 70.93 1j1w s THR 438 CO 0.10 -0.30 0.00 -0.90 -0.54 0.00 0.00 174.62 172.98 1j1w n ASP 439 N -0.88 0.50 -0.32 3.99 3.85 -1.06 0.47 116.55 123.10 1j1w n ASP 439 Ca -0.05 -0.24 -0.03 0.00 -0.71 0.00 0.00 54.79 53.76 1j1w n ASP 439 Cb 0.61 0.00 0.11 0.00 -1.35 0.00 0.00 41.12 40.49 1j1w n ASP 439 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1j1w h GLU 440 N 0.00 1.23 0.19 0.11 4.39 -1.79 -3.08 114.58 115.63 1j1w h GLU 440 Ca 0.00 -0.13 -0.25 0.00 0.34 0.00 0.00 59.36 59.31 1j1w h GLU 440 Cb 0.00 -0.25 0.03 0.00 -0.10 0.00 0.00 28.75 28.43 1j1w h GLU 440 CO 0.00 0.88 -1.11 0.66 -1.16 0.00 0.00 179.01 178.28 1j1w h SER 441 N 1.24 0.65 0.00 1.42 4.64 -1.96 -3.48 113.55 116.06 1j1w h SER 441 Ca 0.31 -0.94 0.00 0.00 -0.47 0.00 0.00 61.79 60.70 1j1w h SER 441 Cb 0.00 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 61.88 1j1w h SER 441 CO -0.05 1.54 0.00 0.61 -0.87 0.00 0.00 176.83 178.05 1j1w n GLY 442 N 1.68 0.78 3.74 -0.77 0.00 -1.16 -5.11 105.19 104.35 1j1w n GLY 442 Ca -0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 1j1w n GLY 442 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1j1w s LYS 443 N 0.00 4.44 -0.60 1.61 2.20 -1.26 -4.74 119.74 121.38 1j1w s LYS 443 Ca 0.00 1.96 -0.28 0.00 -0.36 0.00 0.00 55.97 57.29 1j1w s LYS 443 Cb 0.00 -3.22 0.03 0.00 -1.51 0.00 0.00 37.83 33.13 1j1w s LYS 443 CO 0.00 -0.17 1.21 -1.17 -0.36 0.00 0.00 175.35 174.86 1j1w s LEU 444 N -0.19 3.41 -0.11 5.43 2.96 -1.26 -2.56 118.68 126.36 1j1w s LEU 444 Ca 0.55 0.04 -0.23 0.00 -0.22 0.00 0.00 54.13 54.26 1j1w s LEU 444 Cb -0.34 -3.09 -0.27 0.00 0.50 0.00 0.00 46.19 42.99 1j1w s LEU 444 CO 0.38 -1.53 0.70 -0.07 -1.32 0.00 0.00 176.35 174.50 1j1w h LEU 445 N 12.08 0.23 -8.42 -0.68 3.38 -1.67 -3.49 115.31 116.74 1j1w h LEU 445 Ca -0.25 -0.89 -0.19 0.00 0.09 0.00 0.00 57.88 56.63 1j1w h LEU 445 Cb 1.06 -0.07 -0.15 0.00 0.09 0.00 0.00 40.66 41.58 1j1w h LEU 445 CO 1.20 1.32 -0.67 -0.76 0.09 0.00 0.00 178.44 179.62 1j1w s LEU 446 N -7.93 2.17 -0.30 1.67 1.43 -1.06 -4.81 118.68 109.86 1j1w s LEU 446 Ca -0.19 -1.11 -0.17 0.00 -1.03 0.00 0.00 54.13 51.64 1j1w s LEU 446 Cb 0.01 0.14 0.18 0.00 0.03 0.00 0.00 46.19 46.55 1j1w s LEU 446 CO 0.74 -0.62 1.12 -0.70 0.23 0.00 0.00 176.35 177.12 1j1w s GLU 447 N -3.95 0.17 -0.03 1.70 2.12 -1.26 -1.53 118.70 115.93 1j1w s GLU 447 Ca 0.17 0.42 0.01 0.00 0.36 0.00 0.00 54.97 55.92 1j1w s GLU 447 Cb 0.07 0.25 0.02 0.00 0.26 0.00 0.00 34.13 34.73 1j1w s GLU 447 CO -0.02 -0.08 -0.01 -1.14 -0.54 0.00 0.00 175.26 173.47 1j1w s GLN 448 N 2.36 0.34 0.49 4.30 -0.44 -0.44 -4.99 119.66 121.28 1j1w s GLN 448 Ca -0.01 0.03 -0.23 0.00 -2.50 0.00 0.00 55.36 52.65 1j1w s GLN 448 Cb -0.04 -0.47 -0.07 0.00 -1.64 0.00 0.00 33.01 30.79 1j1w s GLN 448 CO -0.16 -0.10 1.33 0.45 0.50 0.00 0.00 175.29 177.31 1j1w s SER 449 N 0.84 5.71 0.19 6.67 0.15 -1.26 -1.83 113.70 124.16 1j1w s SER 449 Ca -0.09 2.71 0.00 0.00 0.70 0.00 0.00 55.95 59.27 1j1w s SER 449 Cb -0.12 -2.63 -0.04 0.00 -1.71 0.00 0.00 66.02 61.51 1j1w s SER 449 CO -0.01 -1.27 0.06 0.68 1.20 0.00 0.00 173.24 173.90 1j1w s VAL 450 N -1.31 0.36 -0.01 4.45 -7.23 -0.65 -4.86 120.40 111.15 1j1w s VAL 450 Ca 0.66 -1.97 0.01 0.00 -1.81 0.00 0.00 61.98 58.87 1j1w s VAL 450 Cb -0.39 -2.29 -0.00 0.00 0.56 0.00 0.00 36.38 34.26 1j1w s VAL 450 CO 0.48 -0.27 -0.04 -1.61 -0.31 0.00 0.00 175.10 173.35 1j1w s GLU 451 N -4.03 0.33 0.09 4.82 2.02 -1.26 -2.27 118.70 118.40 1j1w s GLU 451 Ca 0.30 -0.13 -0.36 0.00 0.02 0.00 0.00 54.97 54.81 1j1w s GLU 451 Cb 0.07 -0.33 -0.18 0.00 0.10 0.00 0.00 34.13 33.79 1j1w s GLU 451 CO 0.07 0.07 1.02 0.00 0.02 0.00 0.00 175.26 176.44 1j1w n ALA 452 N 3.06 -2.46 0.00 5.21 0.00 -1.26 -0.44 120.51 124.63 1j1w n ALA 452 Ca -0.14 0.53 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1j1w n ALA 452 Cb 0.58 -1.84 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1j1w n ALA 452 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j1w n GLY 453 N 1.85 3.03 3.57 0.00 0.00 -0.74 -4.86 105.19 108.05 1j1w n GLY 453 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 1j1w n GLY 453 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1j1w n ASP 454 N 0.18 -0.02 -4.33 1.61 10.43 0.41 -4.53 116.55 120.30 1j1w n ASP 454 Ca 0.00 0.62 -0.38 0.00 2.57 0.00 0.00 54.79 57.60 1j1w n ASP 454 Cb 0.00 -1.36 -0.12 0.00 1.84 0.00 0.00 41.12 41.48 1j1w n ASP 454 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1j1w s ILE 455 N -1.91 4.06 -0.08 0.53 1.01 -0.26 -0.44 121.20 124.12 1j1w s ILE 455 Ca 0.70 -0.85 0.00 0.00 0.00 0.00 0.00 60.65 60.51 1j1w s ILE 455 Cb -0.33 -3.19 -0.03 0.00 0.01 0.00 0.00 42.46 38.92 1j1w s ILE 455 CO 0.53 -0.07 -0.07 0.86 0.00 0.00 0.00 174.94 176.20 1j1w s TRP 456 N 1.49 2.93 0.12 3.97 -0.00 -0.33 -0.50 118.94 126.61 1j1w s TRP 456 Ca 0.01 -0.05 -0.05 0.00 -0.00 0.00 0.00 56.10 56.01 1j1w s TRP 456 Cb -0.18 -1.74 -0.02 0.00 -0.00 0.00 0.00 33.47 31.53 1j1w s TRP 456 CO 0.04 0.27 0.14 -0.98 -0.00 0.00 0.00 176.95 176.41 1j1w s ARG 457 N -0.64 0.92 -0.03 5.86 1.70 -0.52 -0.24 118.95 126.01 1j1w s ARG 457 Ca 0.10 -1.21 0.01 0.00 -0.47 0.00 0.00 55.73 54.16 1j1w s ARG 457 Cb -0.11 0.30 0.02 0.00 -0.57 0.00 0.00 34.95 34.58 1j1w s ARG 457 CO 0.02 -0.29 -0.03 1.41 -1.08 0.00 0.00 175.30 175.33 1j1w s MET 458 N -3.96 0.53 0.05 3.89 1.75 -1.05 -1.93 119.30 118.59 1j1w s MET 458 Ca 0.15 -0.08 0.09 0.00 -1.25 0.00 0.00 55.69 54.60 1j1w s MET 458 Cb 0.06 -0.58 -0.03 0.00 2.84 0.00 0.00 34.83 37.12 1j1w s MET 458 CO -0.04 -0.03 -0.25 0.00 -0.65 0.00 0.00 175.02 174.05 1j1w s GLN 460 N -1.31 0.87 -0.27 0.00 -2.07 -1.26 -1.21 119.66 114.41 1j1w s GLN 460 Ca 0.11 -0.05 -0.07 0.00 -1.82 0.00 0.00 55.36 53.53 1j1w s GLN 460 Cb -0.10 -1.02 -0.01 0.00 -1.09 0.00 0.00 33.01 30.80 1j1w s GLN 460 CO 0.02 -0.19 0.06 0.00 -1.32 0.00 0.00 175.29 173.86 1j1w s ALA 461 N 1.45 3.07 0.21 2.60 0.00 0.44 -3.17 121.76 126.36 1j1w s ALA 461 Ca -0.02 -1.28 -0.25 0.00 0.00 0.00 0.00 51.96 50.40 1j1w s ALA 461 Cb -0.13 -2.07 -0.08 0.00 0.00 0.00 0.00 23.12 20.84 1j1w s ALA 461 CO -0.03 -0.68 0.82 0.15 0.00 0.00 0.00 175.76 176.01 1j1w s LYS 462 N 1.55 4.55 0.12 0.00 1.02 -1.26 -0.40 119.74 125.32 1j1w s LYS 462 Ca 0.05 1.18 -0.27 0.00 0.02 0.00 0.00 55.97 56.94 1j1w s LYS 462 Cb -0.16 -3.12 -0.07 0.00 -0.52 0.00 0.00 37.83 33.96 1j1w s LYS 462 CO 0.02 0.49 1.62 0.22 -0.92 0.00 0.00 175.35 176.78 1j1w h ASP 463 N 3.95 -0.92 -0.58 2.83 1.82 -1.84 -2.31 116.42 119.36 1j1w h ASP 463 Ca -0.47 0.11 0.11 0.00 -0.39 0.00 0.00 57.03 56.40 1j1w h ASP 463 Cb 1.20 0.36 -0.11 0.00 0.68 0.00 0.00 39.33 41.46 1j1w h ASP 463 CO 0.66 -0.39 -0.22 0.00 -1.61 0.00 0.00 179.24 177.68 1j1w h ALA 464 N 0.21 0.23 -0.90 -0.78 0.00 -1.93 -0.58 119.26 115.51 1j1w h ALA 464 Ca 0.05 0.21 0.02 0.00 0.00 0.00 0.00 54.91 55.18 1j1w h ALA 464 Cb 0.56 0.58 -0.05 0.00 0.00 0.00 0.00 17.79 18.87 1j1w h ALA 464 CO -0.23 -0.52 0.60 -1.35 0.00 0.00 0.00 179.25 177.75 1j1w h PRO 465 N -0.07 1.17 -0.62 0.00 0.11 -1.83 -0.92 132.00 129.83 1j1w h PRO 465 Ca 0.27 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 66.28 1j1w h PRO 465 Cb 0.49 -0.26 -0.03 0.00 0.11 0.00 0.00 31.00 31.31 1j1w h PRO 465 CO -0.64 0.77 0.28 0.82 -0.21 0.00 0.00 178.00 179.03 1j1w h ILE 466 N 1.20 1.21 0.40 4.15 2.04 -0.63 -0.80 117.51 125.07 1j1w h ILE 466 Ca 0.34 -0.60 -0.02 0.00 1.00 0.00 0.00 64.86 65.58 1j1w h ILE 466 Cb -0.10 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 1j1w h ILE 466 CO -0.08 0.25 -0.19 1.56 0.00 0.00 0.00 178.15 179.68 1j1w h GLN 467 N 0.88 -0.52 -1.09 2.37 4.20 -0.48 0.08 115.11 120.55 1j1w h GLN 467 Ca 0.21 0.04 0.32 0.00 0.06 0.00 0.00 58.65 59.27 1j1w h GLN 467 Cb 0.11 0.12 -0.04 0.00 0.30 0.00 0.00 27.48 27.97 1j1w h GLN 467 CO -0.03 -0.22 0.78 0.22 -0.67 0.00 0.00 178.83 178.92 1j1w h ASP 468 N -1.01 0.01 0.00 1.46 3.58 -1.13 -1.19 116.42 118.14 1j1w h ASP 468 Ca -0.05 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.40 1j1w h ASP 468 Cb 0.53 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.58 1j1w h ASP 468 CO 0.09 0.00 0.00 1.87 -2.88 0.00 0.00 179.24 178.32 1j1w n TRP 469 N -4.21 0.00 -0.33 0.28 -0.00 -0.31 -2.62 117.44 110.25 1j1w n TRP 469 Ca 0.23 0.00 0.27 0.00 -0.00 0.00 0.00 57.50 58.00 1j1w n TRP 469 Cb 1.15 -0.40 0.51 0.00 -0.00 0.00 0.00 31.31 32.57 1j1w n TRP 469 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 1j1w h VAL 470 N 0.00 0.11 0.00 5.87 2.07 -0.06 -0.22 116.25 124.02 1j1w h VAL 470 Ca 0.00 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1j1w h VAL 470 Cb 0.00 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.76 1j1w h VAL 470 CO 0.00 0.02 0.00 1.17 0.02 0.00 0.00 177.57 178.78 1j1w n LYS 471 N -5.22 0.00 -0.49 1.57 4.81 -0.54 -1.88 118.16 116.41 1j1w n LYS 471 Ca 0.34 0.33 0.40 0.00 -0.87 0.00 0.00 58.31 58.51 1j1w n LYS 471 Cb 1.12 -1.29 0.65 0.00 0.02 0.00 0.00 35.03 35.53 1j1w n LYS 471 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1j1w n LEU 472 N -1.44 0.14 0.37 3.14 7.94 -0.60 0.11 117.00 126.67 1j1w n LEU 472 Ca 0.00 1.17 -0.15 0.00 -1.11 0.00 0.00 56.01 55.92 1j1w n LEU 472 Cb 0.00 -0.58 -0.07 0.00 0.53 0.00 0.00 43.42 43.30 1j1w n LEU 472 CO 0.00 -1.25 0.52 0.00 -1.11 0.00 0.00 177.39 175.55 1j1w h ALA 473 N 1.30 -1.23 -0.24 1.96 0.00 -0.72 -1.75 119.26 118.59 1j1w h ALA 473 Ca 0.82 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 55.58 1j1w h ALA 473 Cb 2.82 0.37 -0.07 0.00 0.00 0.00 0.00 17.79 20.91 1j1w h ALA 473 CO -0.31 -1.17 -0.27 0.28 0.00 0.00 0.00 179.25 177.78 1j1w h VAL 474 N -0.96 0.34 -0.83 0.00 2.07 0.15 -1.44 116.25 115.58 1j1w h VAL 474 Ca -0.10 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.50 1j1w h VAL 474 Cb 0.73 0.34 -0.10 0.00 -1.52 0.00 0.00 31.29 30.74 1j1w h VAL 474 CO 0.16 0.00 -0.49 -3.20 0.02 0.00 0.00 177.57 174.06 1j1w n ASN 475 N -5.39 -0.88 -0.20 0.57 5.15 0.00 0.41 115.26 114.92 1j1w n ASN 475 Ca -0.01 1.50 -0.05 0.00 -0.60 0.00 0.00 54.58 55.41 1j1w n ASN 475 Cb 0.31 -0.20 0.04 0.00 -0.53 0.00 0.00 39.78 39.40 1j1w n ASN 475 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 1j1w h ARG 476 N 0.00 0.74 -0.91 1.20 2.47 -0.72 -1.10 114.38 116.06 1j1w h ARG 476 Ca 0.13 -0.04 0.19 0.00 -1.26 0.00 0.00 59.98 59.00 1j1w h ARG 476 Cb 0.34 -0.17 -0.11 0.00 -1.65 0.00 0.00 29.97 28.38 1j1w h ARG 476 CO -0.78 0.49 0.47 0.00 0.56 0.00 0.00 179.97 180.71 1j1w h ALA 477 N 1.24 1.47 0.10 0.04 0.00 0.10 -2.39 119.26 119.82 1j1w h ALA 477 Ca 0.23 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 1j1w h ALA 477 Cb -0.04 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1j1w h ALA 477 CO -0.07 -0.20 -0.05 -0.09 0.00 0.00 0.00 179.25 178.84 1j1w h ARG 478 N 0.55 -0.13 -0.94 0.00 9.65 0.11 0.21 114.38 123.83 1j1w h ARG 478 Ca 0.54 0.01 0.38 0.00 -1.10 0.00 0.00 59.98 59.81 1j1w h ARG 478 Cb 0.93 0.03 -0.17 0.00 -1.39 0.00 0.00 29.97 29.37 1j1w h ARG 478 CO -0.44 -0.09 0.46 0.00 2.80 0.00 0.00 179.97 182.70 1j1w n ALA 479 N -2.17 0.92 -0.08 2.80 0.00 -0.51 -0.57 120.51 120.89 1j1w n ALA 479 Ca -0.02 0.96 -0.10 0.00 0.00 0.00 0.00 53.44 54.29 1j1w n ALA 479 Cb 0.06 -0.94 -0.16 0.00 0.00 0.00 0.00 19.45 18.41 1j1w n ALA 479 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1j1w n THR 480 N -5.15 1.42 -2.98 0.00 -2.24 -0.91 -5.01 114.28 99.41 1j1w n THR 480 Ca 0.34 -0.84 -0.12 0.00 -2.27 0.00 0.00 64.05 61.16 1j1w n THR 480 Cb 1.16 -0.57 0.06 0.00 -2.10 0.00 0.00 70.33 68.89 1j1w n THR 480 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1j1w n ASN 481 N -2.80 -2.28 -4.43 3.42 5.15 0.72 -5.04 115.26 110.00 1j1w n ASN 481 Ca -0.30 -0.44 -0.27 0.00 -0.60 0.00 0.00 54.58 52.97 1j1w n ASN 481 Cb 1.13 -3.76 -0.12 0.00 -0.53 0.00 0.00 39.78 36.51 1j1w n ASN 481 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1j1w s THR 482 N -3.25 2.37 0.77 -0.44 2.01 -1.14 -5.03 115.64 110.94 1j1w s THR 482 Ca 0.03 -1.99 -0.14 0.00 0.31 0.00 0.00 61.69 59.90 1j1w s THR 482 Cb -0.00 -2.13 0.06 0.00 0.01 0.00 0.00 72.50 70.44 1j1w s THR 482 CO 0.51 -0.10 1.18 -2.84 -0.69 0.00 0.00 174.62 172.69 1j1w s PRO 483 N -2.62 1.91 -0.09 4.92 0.02 -1.26 -4.61 135.00 133.28 1j1w s PRO 483 Ca 0.20 1.66 -0.03 0.00 0.02 0.00 0.00 61.00 62.84 1j1w s PRO 483 Cb -0.08 -1.82 0.05 0.00 0.02 0.00 0.00 34.50 32.67 1j1w s PRO 483 CO 0.10 -1.99 0.17 0.00 -0.33 0.00 0.00 177.00 174.95 1j1w s ALA 484 N -2.22 -0.24 -0.03 -1.55 0.00 -0.98 -0.62 121.76 116.13 1j1w s ALA 484 Ca 0.71 0.64 0.00 0.00 0.00 0.00 0.00 51.96 53.31 1j1w s ALA 484 Cb -0.26 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.07 1j1w s ALA 484 CO 0.49 -0.47 0.02 0.08 0.00 0.00 0.00 175.76 175.88 1j1w s VAL 485 N 2.02 4.32 -0.28 0.00 1.01 -0.52 -2.46 120.40 124.50 1j1w s VAL 485 Ca -0.00 -0.45 -0.13 0.00 0.00 0.00 0.00 61.98 61.40 1j1w s VAL 485 Cb -0.12 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 1j1w s VAL 485 CO -0.06 0.44 0.29 -0.36 0.00 0.00 0.00 175.10 175.42 1j1w s PHE 486 N -1.04 3.23 -1.11 5.22 0.40 -0.87 0.01 117.98 123.81 1j1w s PHE 486 Ca 0.18 0.27 -0.17 0.00 -0.60 0.00 0.00 56.93 56.62 1j1w s PHE 486 Cb -0.12 -2.49 0.14 0.00 0.51 0.00 0.00 43.02 41.06 1j1w s PHE 486 CO 0.08 -0.21 1.37 -1.58 0.70 0.00 0.00 175.22 175.58 1j1w s TRP 487 N 1.94 3.23 -0.18 0.36 0.52 -0.29 -1.42 118.94 123.09 1j1w s TRP 487 Ca 0.11 -1.74 -0.00 0.00 0.02 0.00 0.00 56.10 54.49 1j1w s TRP 487 Cb -0.16 -4.38 0.04 0.00 -1.15 0.00 0.00 33.47 27.82 1j1w s TRP 487 CO 0.10 -1.51 -0.07 -0.51 0.02 0.00 0.00 176.95 174.99 1j1w s LEU 488 N 2.48 1.86 -0.22 2.99 1.43 0.29 -4.61 118.68 122.90 1j1w s LEU 488 Ca 0.41 -0.77 -0.26 0.00 -1.03 0.00 0.00 54.13 52.48 1j1w s LEU 488 Cb -0.02 -1.02 -0.00 0.00 0.03 0.00 0.00 46.19 45.17 1j1w s LEU 488 CO -0.03 -0.18 0.89 -0.62 0.23 0.00 0.00 176.35 176.64 1j1w s ASP 489 N 1.55 6.94 0.50 2.29 3.68 -1.26 -4.11 116.67 126.26 1j1w s ASP 489 Ca -0.00 1.17 0.24 0.00 2.13 0.00 0.00 52.55 56.09 1j1w s ASP 489 Cb -0.16 -2.47 1.34 0.00 -1.45 0.00 0.00 42.92 40.18 1j1w s ASP 489 CO -0.08 -0.52 2.05 -0.65 0.13 0.00 0.00 175.17 176.10 1j1w h PRO 490 N 7.52 0.00 -0.71 4.34 0.11 -1.94 -2.55 132.00 138.77 1j1w h PRO 490 Ca -0.24 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.91 1j1w h PRO 490 Cb 1.10 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.16 1j1w h PRO 490 CO 0.89 0.14 0.44 0.00 -0.21 0.00 0.00 178.00 179.26 1j1w h ALA 491 N 1.86 0.95 -1.93 -0.75 0.00 -1.99 -3.41 119.26 113.99 1j1w h ALA 491 Ca -0.00 -0.01 -0.57 0.00 0.00 0.00 0.00 54.91 54.33 1j1w h ALA 491 Cb 0.34 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1j1w h ALA 491 CO 0.02 0.19 1.05 1.03 0.00 0.00 0.00 179.25 181.53 1j1w s ARG 492 N -6.11 3.78 0.66 0.00 0.52 -0.96 -4.88 118.95 111.96 1j1w s ARG 492 Ca -0.13 1.29 0.22 0.00 -0.52 0.00 0.00 55.73 56.59 1j1w s ARG 492 Cb 0.16 -3.97 1.17 0.00 0.52 0.00 0.00 34.95 32.83 1j1w s ARG 492 CO 0.77 -1.30 1.66 0.00 0.02 0.00 0.00 175.30 176.45 1j1w h ALA 493 N 10.15 1.64 0.00 2.13 0.00 -1.86 0.12 119.26 131.44 1j1w h ALA 493 Ca -0.29 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1j1w h ALA 493 Cb 1.12 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1j1w h ALA 493 CO 1.04 -0.59 -0.03 1.25 0.00 0.00 0.00 179.25 180.92 1j1w h HIS 494 N 0.00 0.00 -1.18 0.00 -0.00 -1.90 -3.24 115.15 108.83 1j1w h HIS 494 Ca 0.04 0.00 0.34 0.00 -0.00 0.00 0.00 60.37 60.75 1j1w h HIS 494 Cb 1.14 0.00 -0.10 0.00 -0.00 0.00 0.00 27.41 28.45 1j1w h HIS 494 CO 0.00 0.00 0.78 -0.44 -0.00 0.00 0.00 177.93 178.27 1j1w h ASP 495 N -0.22 0.30 -0.01 3.26 5.19 -1.58 0.12 116.42 123.49 1j1w h ASP 495 Ca 0.00 0.09 0.02 0.00 -0.62 0.00 0.00 57.03 56.52 1j1w h ASP 495 Cb 0.03 0.05 -0.03 0.00 0.18 0.00 0.00 39.33 39.56 1j1w h ASP 495 CO 0.00 -0.02 -0.13 0.00 -3.12 0.00 0.00 179.24 175.97 1j1w h ALA 496 N 1.57 -0.14 0.00 3.45 0.00 -0.90 0.34 119.26 123.58 1j1w h ALA 496 Ca 0.68 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.57 1j1w h ALA 496 Cb 2.05 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 20.05 1j1w h ALA 496 CO -0.29 -0.61 -0.15 1.96 0.00 0.00 0.00 179.25 180.16 1j1w h GLN 497 N -0.21 0.00 0.00 0.00 4.20 -0.81 -2.06 115.11 116.23 1j1w h GLN 497 Ca 0.05 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.62 1j1w h GLN 497 Cb 0.27 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 1j1w h GLN 497 CO -0.13 0.15 -0.68 0.28 -0.67 0.00 0.00 178.83 177.78 1j1w h VAL 498 N 0.00 1.29 -0.50 -0.54 2.07 -0.54 -2.92 116.25 115.11 1j1w h VAL 498 Ca -0.00 -2.49 -0.10 0.00 0.82 0.00 0.00 66.70 64.93 1j1w h VAL 498 Cb 0.73 2.42 -0.02 0.00 -1.52 0.00 0.00 31.29 32.90 1j1w h VAL 498 CO 0.02 0.66 -0.10 0.40 0.02 0.00 0.00 177.57 178.57 1j1w h ILE 499 N 0.00 1.26 -0.19 4.57 2.04 0.36 -1.75 117.51 123.81 1j1w h ILE 499 Ca -0.01 -1.22 0.01 0.00 1.00 0.00 0.00 64.86 64.64 1j1w h ILE 499 Cb 1.36 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 38.41 1j1w h ILE 499 CO 0.09 0.43 0.11 0.00 0.00 0.00 0.00 178.15 178.78 1j1w h ALA 500 N 1.05 0.24 0.04 1.87 0.00 -1.38 -0.74 119.26 120.34 1j1w h ALA 500 Ca 0.13 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1j1w h ALA 500 Cb 0.63 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1j1w h ALA 500 CO 0.04 -0.30 -0.42 0.87 0.00 0.00 0.00 179.25 179.45 1j1w h LYS 501 N 0.24 -0.53 0.07 0.00 1.79 -1.29 -1.96 116.57 114.89 1j1w h LYS 501 Ca 0.07 0.04 0.02 0.00 -2.18 0.00 0.00 60.65 58.60 1j1w h LYS 501 Cb -0.01 0.12 -0.05 0.00 -1.58 0.00 0.00 32.23 30.71 1j1w h LYS 501 CO -0.03 -0.35 -0.45 0.28 -1.08 0.00 0.00 179.45 177.82 1j1w h VAL 502 N -0.55 0.12 -1.03 0.50 2.07 -1.13 -1.12 116.25 115.11 1j1w h VAL 502 Ca 0.00 0.00 0.28 0.00 0.82 0.00 0.00 66.70 67.80 1j1w h VAL 502 Cb 0.57 0.12 -0.12 0.00 -1.52 0.00 0.00 31.29 30.34 1j1w h VAL 502 CO -0.26 0.00 0.62 -0.33 0.02 0.00 0.00 177.57 177.63 1j1w h GLU 503 N -0.65 0.44 0.00 1.57 5.08 -1.00 0.16 114.58 120.18 1j1w h GLU 503 Ca 0.03 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1j1w h GLU 503 Cb 0.69 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 1j1w h GLU 503 CO -0.29 0.29 -0.23 -0.09 -1.00 0.00 0.00 179.01 177.69 1j1w h ARG 504 N 0.46 0.00 0.00 2.33 2.43 -0.70 -3.34 114.38 115.56 1j1w h ARG 504 Ca 0.66 0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 59.65 1j1w h ARG 504 Cb 1.46 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.98 1j1w h ARG 504 CO -0.45 0.07 -1.48 0.66 -1.51 0.00 0.00 179.97 177.26 1j1w n TYR 505 N -3.06 0.95 0.24 2.20 4.02 0.45 -3.68 117.16 118.29 1j1w n TYR 505 Ca 0.03 0.32 0.09 0.00 -0.01 0.00 0.00 57.90 58.33 1j1w n TYR 505 Cb 0.57 -1.09 0.61 0.00 -0.02 0.00 0.00 39.34 39.40 1j1w n TYR 505 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1j1w h LEU 506 N 0.00 0.00 -0.82 7.72 3.38 -1.39 -0.26 115.31 123.94 1j1w h LEU 506 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1j1w h LEU 506 Cb 1.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.39 1j1w h LEU 506 CO 0.05 0.16 0.00 0.29 0.09 0.00 0.00 178.44 179.03 1j1w n LYS 507 N -4.02 0.68 0.00 1.13 5.02 -1.24 -1.17 118.16 118.55 1j1w n LYS 507 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1j1w n LYS 507 Cb 0.24 -1.28 -0.00 0.00 -0.02 0.00 0.00 35.03 33.97 1j1w n LYS 507 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1j1w n ASP 508 N 0.04 0.18 -4.05 4.39 10.43 -0.11 -5.06 116.55 122.38 1j1w n ASP 508 Ca 0.00 -0.59 -0.26 0.00 2.57 0.00 0.00 54.79 56.51 1j1w n ASP 508 Cb 0.14 0.83 -0.06 0.00 1.84 0.00 0.00 41.12 43.87 1j1w n ASP 508 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 1j1w n TYR 509 N -0.83 0.69 -2.99 1.24 4.02 -0.32 -5.11 117.16 113.87 1j1w n TYR 509 Ca 0.00 -2.22 -0.42 0.00 -0.01 0.00 0.00 57.90 55.25 1j1w n TYR 509 Cb 0.00 -0.19 -0.05 0.00 -0.02 0.00 0.00 39.34 39.08 1j1w n TYR 509 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1j1w s ASP 510 N -3.34 6.54 -0.02 7.72 -1.08 -1.26 -4.90 116.67 120.32 1j1w s ASP 510 Ca 0.07 0.36 0.21 0.00 -0.52 0.00 0.00 52.55 52.66 1j1w s ASP 510 Cb 0.00 -2.38 -0.29 0.00 -1.46 0.00 0.00 42.92 38.79 1j1w s ASP 510 CO 0.05 -0.68 0.59 1.07 0.52 0.00 0.00 175.17 176.72 1j1w n THR 511 N 5.69 0.00 -1.58 1.71 5.66 -1.26 -4.96 114.28 119.54 1j1w n THR 511 Ca 0.02 -0.34 -0.50 0.00 -3.05 0.00 0.00 64.05 60.18 1j1w n THR 511 Cb 0.48 0.32 -0.06 0.00 -1.55 0.00 0.00 70.33 69.53 1j1w n THR 511 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1j1w n SER 512 N -2.00 2.75 0.00 1.09 3.41 -1.26 -1.82 113.62 115.79 1j1w n SER 512 Ca -0.01 0.68 0.00 0.00 -0.26 0.00 0.00 58.87 59.28 1j1w n SER 512 Cb 0.48 -1.31 0.00 0.00 -0.26 0.00 0.00 64.21 63.11 1j1w n SER 512 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1j1w n GLY 513 N 5.39 0.68 3.36 5.00 0.00 -1.26 -5.06 105.19 113.29 1j1w n GLY 513 Ca 0.31 -0.18 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1j1w n GLY 513 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1j1w s LEU 514 N 0.00 2.28 -1.24 0.99 2.01 -0.76 -5.02 118.68 116.94 1j1w s LEU 514 Ca 0.00 -0.39 -0.04 0.00 0.01 0.00 0.00 54.13 53.71 1j1w s LEU 514 Cb 0.00 -1.42 0.18 0.00 0.01 0.00 0.00 46.19 44.96 1j1w s LEU 514 CO 0.00 0.32 2.22 0.47 1.01 0.00 0.00 176.35 180.36 1j1w n ASP 515 N 2.48 7.83 -4.72 2.29 10.43 -1.26 -4.97 116.55 128.63 1j1w n ASP 515 Ca -0.17 -3.30 -0.39 0.00 2.57 0.00 0.00 54.79 53.50 1j1w n ASP 515 Cb 0.52 -1.30 -0.05 0.00 1.84 0.00 0.00 41.12 42.12 1j1w n ASP 515 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1j1w s ILE 516 N -2.09 5.10 0.05 0.53 1.01 -1.26 -2.31 121.20 122.23 1j1w s ILE 516 Ca 0.49 1.26 -0.19 0.00 0.00 0.00 0.00 60.65 62.22 1j1w s ILE 516 Cb 0.19 -3.96 0.04 0.00 0.01 0.00 0.00 42.46 38.74 1j1w s ILE 516 CO -0.10 0.28 0.44 0.00 0.00 0.00 0.00 174.94 175.56 1j1w s ARG 517 N 0.74 0.96 -0.15 2.79 1.70 -1.03 -4.99 118.95 118.97 1j1w s ARG 517 Ca 0.33 -0.34 -0.04 0.00 -0.47 0.00 0.00 55.73 55.21 1j1w s ARG 517 Cb -0.17 0.43 -0.03 0.00 -0.57 0.00 0.00 34.95 34.61 1j1w s ARG 517 CO 0.15 -0.34 -0.02 0.42 -1.08 0.00 0.00 175.30 174.43 1j1w s ILE 518 N -2.53 4.04 0.21 4.99 1.01 -1.26 -2.06 121.20 125.60 1j1w s ILE 518 Ca -0.05 -0.31 -0.02 0.00 0.00 0.00 0.00 60.65 60.27 1j1w s ILE 518 Cb -0.01 -2.77 -0.04 0.00 0.01 0.00 0.00 42.46 39.65 1j1w s ILE 518 CO -0.03 0.50 0.18 -0.76 0.00 0.00 0.00 174.94 174.83 1j1w s LEU 519 N 0.29 1.05 0.36 2.97 1.43 -0.51 -4.93 118.68 119.34 1j1w s LEU 519 Ca -0.02 -1.34 -0.25 0.00 -1.03 0.00 0.00 54.13 51.49 1j1w s LEU 519 Cb -0.14 0.57 -0.10 0.00 0.03 0.00 0.00 46.19 46.55 1j1w s LEU 519 CO 0.02 -0.88 0.98 -0.94 0.23 0.00 0.00 176.35 175.76 1j1w s SER 520 N -3.15 7.09 0.57 2.29 1.04 -1.26 -0.55 113.70 119.74 1j1w s SER 520 Ca 0.37 1.89 0.33 0.00 0.48 0.00 0.00 55.95 59.02 1j1w s SER 520 Cb 0.06 -2.58 1.45 0.00 0.10 0.00 0.00 66.02 65.05 1j1w s SER 520 CO 0.12 -0.25 1.79 -0.65 0.98 0.00 0.00 173.24 175.23 1j1w h PRO 521 N 2.79 0.00 0.29 4.02 0.11 -1.85 1.59 132.00 138.95 1j1w h PRO 521 Ca -0.48 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1j1w h PRO 521 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1j1w h PRO 521 CO 0.64 0.00 -0.14 0.28 -0.21 0.00 0.00 178.00 178.57 1j1w h VAL 522 N 0.00 0.45 -0.70 3.15 2.07 -1.94 -1.15 116.25 118.12 1j1w h VAL 522 Ca 0.43 -0.83 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 1j1w h VAL 522 Cb 1.93 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 32.41 1j1w h VAL 522 CO -0.00 0.11 0.40 -0.33 0.02 0.00 0.00 177.57 177.77 1j1w h GLU 523 N -0.98 0.97 -0.99 1.57 5.08 -1.15 -2.71 114.58 116.37 1j1w h GLU 523 Ca -0.04 -0.10 0.02 0.00 -1.00 0.00 0.00 59.36 58.24 1j1w h GLU 523 Cb 0.48 -0.20 -0.05 0.00 0.50 0.00 0.00 28.75 29.48 1j1w h GLU 523 CO 0.07 0.71 0.65 0.00 -1.00 0.00 0.00 179.01 179.44 1j1w h ALA 524 N 1.21 1.28 0.00 3.43 0.00 0.21 0.22 119.26 125.61 1j1w h ALA 524 Ca 0.25 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1j1w h ALA 524 Cb 0.01 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 1j1w h ALA 524 CO -0.04 0.61 -0.42 1.15 0.00 0.00 0.00 179.25 180.55 1j1w h THR 525 N 1.31 1.19 0.20 0.00 2.02 -0.90 -1.27 112.91 115.46 1j1w h THR 525 Ca 0.37 -1.48 -0.01 0.00 0.77 0.00 0.00 66.41 66.06 1j1w h THR 525 Cb -0.10 1.82 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 1j1w h THR 525 CO -0.10 0.41 -0.10 0.03 0.37 0.00 0.00 175.52 176.13 1j1w h ARG 526 N 0.00 -0.27 -0.93 6.66 3.08 -0.96 0.80 114.38 122.77 1j1w h ARG 526 Ca -0.00 0.02 0.24 0.00 0.07 0.00 0.00 59.98 60.31 1j1w h ARG 526 Cb 0.79 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.85 1j1w h ARG 526 CO 0.05 0.01 0.64 0.35 -1.07 0.00 0.00 179.97 179.96 1j1w h PHE 527 N -1.00 0.26 0.13 3.04 3.57 -0.59 0.92 116.94 123.27 1j1w h PHE 527 Ca -0.03 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 1j1w h PHE 527 Cb 0.40 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.06 1j1w h PHE 527 CO 0.05 0.05 -0.06 0.77 -2.23 0.00 0.00 178.31 176.89 1j1w h SER 528 N 0.18 -0.15 -0.02 0.41 0.02 -1.22 -2.99 113.55 109.79 1j1w h SER 528 Ca 0.47 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.37 1j1w h SER 528 Cb 1.52 0.04 -0.00 0.00 0.14 0.00 0.00 62.40 64.10 1j1w h SER 528 CO -0.10 0.35 0.27 -0.07 -1.14 0.00 0.00 176.83 176.14 1j1w h LEU 529 N -1.04 0.00 0.00 5.07 3.38 -0.29 0.25 115.31 122.67 1j1w h LEU 529 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1j1w h LEU 529 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1j1w h LEU 529 CO 0.03 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.56 1j1w n ALA 530 N -1.95 -0.16 -0.36 1.53 0.00 0.27 -2.79 120.51 117.04 1j1w n ALA 530 Ca -0.02 0.00 0.26 0.00 0.00 0.00 0.00 53.44 53.68 1j1w n ALA 530 Cb 0.32 0.00 0.52 0.00 0.00 0.00 0.00 19.45 20.30 1j1w n ALA 530 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j1w h ARG 531 N 0.00 0.32 0.74 0.00 3.08 -1.26 -2.39 114.38 114.86 1j1w h ARG 531 Ca 0.00 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 1j1w h ARG 531 Cb 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.98 1j1w h ARG 531 CO 0.00 0.21 -0.40 0.97 -1.07 0.00 0.00 179.97 179.68 1j1w h ILE 532 N 0.33 0.20 -0.65 2.04 2.10 -0.49 1.37 117.51 122.40 1j1w h ILE 532 Ca 0.68 0.00 -0.01 0.00 1.08 0.00 0.00 64.86 66.62 1j1w h ILE 532 Cb 1.77 0.20 -0.03 0.00 -1.09 0.00 0.00 36.82 37.66 1j1w h ILE 532 CO -0.41 0.00 0.38 0.03 -1.08 0.00 0.00 178.15 177.07 1j1w h ARG 533 N -1.05 0.87 0.00 2.19 3.08 -1.26 0.22 114.38 118.44 1j1w h ARG 533 Ca -0.10 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.87 1j1w h ARG 533 Cb 0.82 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.69 1j1w h ARG 533 CO 0.14 0.62 0.00 -0.85 -1.07 0.00 0.00 179.97 178.81 1j1w n GLU 534 N -4.40 0.33 -0.39 0.04 0.28 -1.16 -4.73 120.64 110.62 1j1w n GLU 534 Ca 0.06 0.08 0.00 0.00 -0.16 0.00 0.00 57.16 57.14 1j1w n GLU 534 Cb 0.08 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.45 1j1w n GLU 534 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1j1w n GLY 535 N 0.55 1.25 3.53 -1.84 0.00 0.74 -5.03 105.19 104.39 1j1w n GLY 535 Ca 0.11 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 1j1w n GLY 535 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j1w s LYS 536 N -1.18 2.40 0.86 1.61 -0.14 0.47 -4.56 119.74 119.20 1j1w s LYS 536 Ca 0.00 -0.79 -0.12 0.00 -1.36 0.00 0.00 55.97 53.70 1j1w s LYS 536 Cb 0.00 -2.38 0.11 0.00 -1.68 0.00 0.00 37.83 33.88 1j1w s LYS 536 CO 0.00 0.59 1.17 -0.51 -0.76 0.00 0.00 175.35 175.83 1j1w s ASP 537 N -1.26 4.01 -0.30 2.83 1.01 -1.26 -3.20 116.67 118.50 1j1w s ASP 537 Ca 0.15 0.84 -0.11 0.00 0.71 0.00 0.00 52.55 54.14 1j1w s ASP 537 Cb -0.11 -1.35 0.18 0.00 1.01 0.00 0.00 42.92 42.65 1j1w s ASP 537 CO 0.05 -2.23 1.03 0.28 0.21 0.00 0.00 175.17 174.51 1j1w s THR 538 N -3.46 -0.31 0.16 -1.27 -1.32 -0.91 -4.57 115.64 103.96 1j1w s THR 538 Ca 0.63 0.00 -0.34 0.00 -1.21 0.00 0.00 61.69 60.77 1j1w s THR 538 Cb -0.12 -0.53 -0.14 0.00 -1.51 0.00 0.00 72.50 70.20 1j1w s THR 538 CO 0.51 0.00 1.55 -0.38 -2.21 0.00 0.00 174.62 174.09 1j1w n ILE 539 N 5.24 0.05 -3.50 5.08 5.41 0.21 -4.13 119.36 127.72 1j1w n ILE 539 Ca 0.04 -0.01 -0.42 0.00 1.00 0.00 0.00 62.75 63.36 1j1w n ILE 539 Cb 0.56 -1.47 -0.08 0.00 -0.71 0.00 0.00 39.64 37.94 1j1w n ILE 539 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1j1w s SER 540 N 0.84 5.85 -0.46 4.38 0.15 -1.13 -1.43 113.70 121.90 1j1w s SER 540 Ca 0.79 -1.62 -0.17 0.00 0.70 0.00 0.00 55.95 55.64 1j1w s SER 540 Cb -0.70 -2.07 0.05 0.00 -1.71 0.00 0.00 66.02 61.58 1j1w s SER 540 CO 0.39 -0.65 0.48 -0.69 1.20 0.00 0.00 173.24 173.96 1j1w s VAL 541 N 1.48 5.07 0.29 4.45 1.01 0.10 -0.84 120.40 131.96 1j1w s VAL 541 Ca 0.04 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.46 1j1w s VAL 541 Cb -0.25 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 1j1w s VAL 541 CO 0.02 -0.57 0.20 0.42 0.00 0.00 0.00 175.10 175.17 1j1w s THR 542 N 2.13 0.14 0.00 3.92 -4.23 -1.13 -1.14 115.64 115.33 1j1w s THR 542 Ca 0.11 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.62 1j1w s THR 542 Cb -0.20 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.15 1j1w s THR 542 CO 0.11 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.80 1j1w n GLY 543 N -0.53 -2.99 0.15 3.99 0.00 -1.26 -1.71 105.19 102.83 1j1w n GLY 543 Ca 0.03 -1.31 -0.24 0.00 0.00 0.00 0.00 46.02 44.51 1j1w n GLY 543 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1j1w h ASN 544 N -0.81 0.81 -0.05 1.61 -0.73 -1.69 -2.30 115.58 112.42 1j1w h ASN 544 Ca 0.00 -0.90 -0.02 0.00 1.87 0.00 0.00 56.30 57.25 1j1w h ASN 544 Cb 0.00 -0.26 -0.00 0.00 0.27 0.00 0.00 38.32 38.33 1j1w h ASN 544 CO 0.00 1.65 -0.05 0.58 -0.37 0.00 0.00 177.43 179.24 1j1w h VAL 545 N 0.10 1.37 -0.73 2.57 2.07 -1.91 -3.04 116.25 116.68 1j1w h VAL 545 Ca -0.23 -1.19 -0.02 0.00 0.82 0.00 0.00 66.70 66.08 1j1w h VAL 545 Cb 2.04 2.05 -0.03 0.00 -1.52 0.00 0.00 31.29 33.83 1j1w h VAL 545 CO 0.25 0.32 0.37 -0.07 0.02 0.00 0.00 177.57 178.46 1j1w h LEU 546 N -0.32 0.92 -0.90 2.57 3.38 -1.94 -2.01 115.31 117.02 1j1w h LEU 546 Ca 0.01 -0.09 0.24 0.00 0.09 0.00 0.00 57.88 58.13 1j1w h LEU 546 Cb 0.54 -0.24 -0.15 0.00 0.09 0.00 0.00 40.66 40.91 1j1w h LEU 546 CO 0.01 0.77 0.16 -0.09 0.09 0.00 0.00 178.44 179.38 1j1w h ARG 547 N 1.02 0.12 0.00 1.13 2.43 -1.30 0.38 114.38 118.17 1j1w h ARG 547 Ca 0.25 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 1j1w h ARG 547 Cb 0.07 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1j1w h ARG 547 CO -0.04 0.08 0.00 -3.47 -1.51 0.00 0.00 179.97 175.04 1j1w n ASP 548 N -5.32 0.00 -0.14 -3.80 4.64 -0.80 -2.82 116.55 108.31 1j1w n ASP 548 Ca 0.22 0.62 -0.00 0.00 -1.38 0.00 0.00 54.79 54.25 1j1w n ASP 548 Cb 0.70 -0.46 0.02 0.00 -1.04 0.00 0.00 41.12 40.34 1j1w n ASP 548 CO 0.00 0.00 0.00 -1.22 -0.82 0.00 0.00 177.20 175.16 1j1w n TYR 549 N -1.87 0.01 -0.02 -0.67 0.53 -0.91 -0.66 117.16 113.58 1j1w n TYR 549 Ca 0.00 0.46 -0.13 0.00 -1.02 0.00 0.00 57.90 57.21 1j1w n TYR 549 Cb 0.00 -0.64 -0.09 0.00 -1.03 0.00 0.00 39.34 37.58 1j1w n TYR 549 CO 0.00 0.00 0.00 -0.07 -1.02 0.00 0.00 176.86 175.77 1j1w h LEU 550 N 0.00 0.06 -2.56 7.72 3.38 -1.08 0.20 115.31 123.02 1j1w h LEU 550 Ca 0.13 -0.47 0.01 0.00 0.09 0.00 0.00 57.88 57.64 1j1w h LEU 550 Cb 0.22 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1j1w h LEU 550 CO -0.37 0.51 0.11 0.71 0.09 0.00 0.00 178.44 179.49 1j1w h THR 551 N -0.40 0.18 0.08 0.22 1.35 -0.72 0.11 112.91 113.72 1j1w h THR 551 Ca 0.00 0.00 -0.36 0.00 -0.55 0.00 0.00 66.41 65.50 1j1w h THR 551 Cb 0.49 0.90 -0.03 0.00 -1.73 0.00 0.00 68.15 67.78 1j1w h THR 551 CO 0.00 0.00 -2.07 -0.67 -0.25 0.00 0.00 175.52 172.53 1j1w n ASP 552 N -3.31 1.83 0.00 5.36 2.03 -0.63 -4.11 116.55 117.72 1j1w n ASP 552 Ca -0.02 0.16 0.00 0.00 0.52 0.00 0.00 54.79 55.45 1j1w n ASP 552 Cb 0.19 -0.58 0.00 0.00 -0.72 0.00 0.00 41.12 40.01 1j1w n ASP 552 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1j1w n LEU 553 N -3.34 0.14 -0.38 -2.67 7.94 0.68 -3.04 117.00 116.34 1j1w n LEU 553 Ca -0.33 0.03 0.00 0.00 -1.11 0.00 0.00 56.01 54.61 1j1w n LEU 553 Cb 1.04 0.00 0.06 0.00 0.53 0.00 0.00 43.42 45.05 1j1w n LEU 553 CO 0.40 0.00 0.59 0.49 -1.11 0.00 0.00 177.39 177.76 1j1w n PHE 554 N -0.06 0.10 -0.32 1.96 3.01 -0.41 0.11 117.46 121.85 1j1w n PHE 554 Ca 0.00 1.22 0.11 0.00 1.01 0.00 0.00 57.45 59.79 1j1w n PHE 554 Cb 0.00 -0.91 0.29 0.00 -0.01 0.00 0.00 39.48 38.84 1j1w n PHE 554 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1j1w h PRO 555 N 0.00 0.62 0.09 -1.08 0.11 -1.72 -0.31 132.00 129.71 1j1w h PRO 555 Ca 0.37 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 66.45 1j1w h PRO 555 Cb 0.62 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.57 1j1w h PRO 555 CO -0.99 0.41 -0.12 0.82 -0.21 0.00 0.00 178.00 177.91 1j1w h ILE 556 N 0.63 0.71 -0.69 4.15 2.04 -0.24 0.55 117.51 124.66 1j1w h ILE 556 Ca 0.54 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.51 1j1w h ILE 556 Cb 0.86 0.71 -0.08 0.00 -0.74 0.00 0.00 36.82 37.57 1j1w h ILE 556 CO -0.41 0.00 0.29 0.24 0.00 0.00 0.00 178.15 178.27 1j1w h MET 557 N -0.25 0.46 0.00 2.37 2.86 -0.84 0.49 114.93 120.01 1j1w h MET 557 Ca 0.02 -0.03 -0.29 0.00 -2.06 0.00 0.00 59.70 57.34 1j1w h MET 557 Cb 0.26 -0.10 -0.05 0.00 0.06 0.00 0.00 31.60 31.77 1j1w h MET 557 CO -0.06 0.30 -1.71 -0.85 1.06 0.00 0.00 176.91 175.65 1j1w n GLU 558 N -4.97 0.63 0.00 1.72 0.28 -0.69 -4.39 120.64 113.23 1j1w n GLU 558 Ca 0.11 0.29 0.03 0.00 -0.16 0.00 0.00 57.16 57.44 1j1w n GLU 558 Cb 0.33 -1.79 0.01 0.00 1.43 0.00 0.00 31.44 31.41 1j1w n GLU 558 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1j1w n LEU 559 N -3.04 1.14 0.00 -1.84 4.77 0.19 -4.82 117.00 113.40 1j1w n LEU 559 Ca -0.17 -0.83 0.00 0.00 -0.03 0.00 0.00 56.01 54.98 1j1w n LEU 559 Cb 1.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.14 1j1w n LEU 559 CO 0.45 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 1j1w n GLY 560 N 0.63 1.62 3.11 -0.72 0.00 0.17 -4.91 105.19 105.10 1j1w n GLY 560 Ca 0.03 -0.23 -0.18 0.00 0.00 0.00 0.00 46.02 45.64 1j1w n GLY 560 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j1w s THR 561 N -0.23 0.94 0.04 2.61 2.01 -1.26 -4.63 115.64 115.12 1j1w s THR 561 Ca 0.00 -0.96 0.09 0.00 0.31 0.00 0.00 61.69 61.13 1j1w s THR 561 Cb 0.00 -0.87 -0.13 0.00 0.01 0.00 0.00 72.50 71.50 1j1w s THR 561 CO 0.00 -0.08 1.30 0.77 -0.69 0.00 0.00 174.62 175.93 1j1w h SER 562 N 4.90 0.00 -0.14 3.53 4.64 -1.85 -2.95 113.55 121.68 1j1w h SER 562 Ca -0.37 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 60.99 1j1w h SER 562 Cb 1.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 1j1w h SER 562 CO 0.44 0.86 0.11 0.00 -0.87 0.00 0.00 176.83 177.36 1j1w h ALA 563 N 1.14 1.99 0.00 5.18 0.00 -1.88 -1.80 119.26 123.89 1j1w h ALA 563 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1j1w h ALA 563 Cb 1.67 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.47 1j1w h ALA 563 CO 0.11 -0.18 0.00 1.17 0.00 0.00 0.00 179.25 180.35 1j1w n LYS 564 N -4.27 0.88 -4.32 0.00 4.81 -1.12 -3.17 118.16 110.97 1j1w n LYS 564 Ca 0.00 0.00 -0.20 0.00 -0.87 0.00 0.00 58.31 57.24 1j1w n LYS 564 Cb 0.23 -1.21 -0.08 0.00 0.02 0.00 0.00 35.03 33.98 1j1w n LYS 564 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1j1w s MET 565 N -0.34 1.73 -0.06 1.64 0.23 -0.88 -4.85 119.30 116.77 1j1w s MET 565 Ca 0.00 -2.01 -0.19 0.00 -1.03 0.00 0.00 55.69 52.46 1j1w s MET 565 Cb 0.00 0.14 -0.05 0.00 -1.53 0.00 0.00 34.83 33.39 1j1w s MET 565 CO 0.00 -0.59 0.54 -1.17 -2.03 0.00 0.00 175.02 171.77 1j1w s LEU 566 N -3.40 4.35 -0.29 0.18 0.20 -1.10 -4.44 118.68 114.18 1j1w s LEU 566 Ca 0.37 1.00 -0.03 0.00 0.69 0.00 0.00 54.13 56.16 1j1w s LEU 566 Cb 0.03 -2.82 0.10 0.00 -0.43 0.00 0.00 46.19 43.06 1j1w s LEU 566 CO 0.24 0.04 0.12 -0.55 -0.29 0.00 0.00 176.35 175.91 1j1w s SER 567 N 0.24 3.58 -0.14 3.68 0.15 -1.26 -1.07 113.70 118.88 1j1w s SER 567 Ca 0.29 -1.33 -0.03 0.00 0.70 0.00 0.00 55.95 55.58 1j1w s SER 567 Cb -0.17 -0.49 -0.03 0.00 -1.71 0.00 0.00 66.02 63.63 1j1w s SER 567 CO 0.14 -0.42 -0.02 -0.63 1.20 0.00 0.00 173.24 173.50 1j1w s ILE 568 N 1.97 4.06 -0.35 6.45 1.01 -0.75 -1.91 121.20 131.68 1j1w s ILE 568 Ca 0.08 -0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.43 1j1w s ILE 568 Cb -0.16 -2.76 0.09 0.00 0.01 0.00 0.00 42.46 39.64 1j1w s ILE 568 CO -0.31 0.52 0.08 -0.69 0.00 0.00 0.00 174.94 174.54 1j1w s VAL 569 N -0.00 2.75 -0.73 2.92 1.01 0.65 -2.48 120.40 124.51 1j1w s VAL 569 Ca 0.02 -2.01 -0.26 0.00 0.00 0.00 0.00 61.98 59.73 1j1w s VAL 569 Cb -0.13 -2.86 -0.01 0.00 0.00 0.00 0.00 36.38 33.38 1j1w s VAL 569 CO 0.02 -0.49 1.73 -2.84 0.00 0.00 0.00 175.10 173.52 1j1w s PRO 570 N 1.07 2.80 0.31 2.72 0.02 -1.25 -1.12 135.00 139.55 1j1w s PRO 570 Ca 0.05 0.11 -0.30 0.00 0.02 0.00 0.00 61.00 60.89 1j1w s PRO 570 Cb -0.21 -4.56 -0.12 0.00 0.02 0.00 0.00 34.50 29.64 1j1w s PRO 570 CO -0.05 -2.71 1.57 1.28 -0.33 0.00 0.00 177.00 176.77 1j1w n LEU 571 N 12.01 4.40 -2.91 -5.54 4.77 -1.18 -4.11 117.00 124.44 1j1w n LEU 571 Ca 0.22 1.16 -0.25 0.00 -0.03 0.00 0.00 56.01 57.11 1j1w n LEU 571 Cb 0.50 -1.59 -0.06 0.00 -2.33 0.00 0.00 43.42 39.94 1j1w n LEU 571 CO 0.68 0.14 2.51 0.23 -1.33 0.00 0.00 177.39 179.62 1j1w n MET 572 N 1.86 2.61 0.00 3.23 2.81 -0.14 -3.04 117.12 124.45 1j1w n MET 572 Ca 0.07 -1.57 0.00 0.00 -1.81 0.00 0.00 57.70 54.40 1j1w n MET 572 Cb 0.37 -2.43 0.00 0.00 -0.71 0.00 0.00 33.22 30.45 1j1w n MET 572 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1j1w n SER 573 N 3.48 0.00 -0.82 7.83 3.41 -1.26 -4.96 113.62 121.29 1j1w n SER 573 Ca 0.56 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.17 1j1w n SER 573 Cb 0.35 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 1j1w n SER 573 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1j1w n GLY 574 N 0.00 -0.00 1.18 5.00 0.00 -1.17 -3.02 105.19 107.18 1j1w n GLY 574 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1j1w n GLY 574 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j1w n GLY 575 N -0.00 0.42 2.86 -0.02 0.00 -1.21 -4.56 105.19 102.68 1j1w n GLY 575 Ca 0.00 -1.93 -0.12 0.00 0.00 0.00 0.00 46.02 43.97 1j1w n GLY 575 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1j1w s GLY 576 N -3.32 -0.29 -0.40 -0.02 0.00 0.06 -3.11 107.32 100.25 1j1w s GLY 576 Ca 0.21 0.61 -0.13 0.00 0.00 0.00 0.00 44.72 45.40 1j1w s GLY 576 CO 0.14 2.54 0.27 -2.27 0.00 0.00 0.00 173.10 173.78 1j1w s LEU 577 N 2.47 5.01 -0.65 0.66 2.96 -0.27 0.66 118.68 129.51 1j1w s LEU 577 Ca 0.11 -0.98 -0.10 0.00 -0.22 0.00 0.00 54.13 52.94 1j1w s LEU 577 Cb -0.15 -2.11 0.17 0.00 0.50 0.00 0.00 46.19 44.60 1j1w s LEU 577 CO -0.17 -0.44 0.55 -0.36 -1.32 0.00 0.00 176.35 174.61 1j1w s PHE 578 N 1.63 3.53 0.49 5.38 0.40 0.24 -0.25 117.98 129.39 1j1w s PHE 578 Ca 0.04 -2.09 -0.21 0.00 -0.60 0.00 0.00 56.93 54.07 1j1w s PHE 578 Cb -0.19 -3.57 -0.08 0.00 0.51 0.00 0.00 43.02 39.69 1j1w s PHE 578 CO 0.08 -0.95 1.08 -1.21 0.70 0.00 0.00 175.22 174.92 1j1w s GLU 579 N 0.55 3.72 0.00 0.44 2.02 -0.80 -1.30 118.70 123.32 1j1w s GLU 579 Ca 0.13 1.50 0.00 0.00 0.02 0.00 0.00 54.97 56.62 1j1w s GLU 579 Cb -0.19 -2.17 0.00 0.00 0.10 0.00 0.00 34.13 31.87 1j1w s GLU 579 CO -0.04 -0.52 0.64 2.41 0.02 0.00 0.00 175.26 177.76 1j1w n THR 580 N -0.88 0.00 -4.20 3.63 -1.04 -0.69 -4.18 114.28 106.92 1j1w n THR 580 Ca 0.09 1.11 -0.13 0.00 -2.04 0.00 0.00 64.05 63.08 1j1w n THR 580 Cb 0.51 -2.06 -0.09 0.00 -1.82 0.00 0.00 70.33 66.86 1j1w n THR 580 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1j1w s GLY 581 N -1.14 1.53 0.00 3.41 0.00 -1.26 -4.28 107.32 105.57 1j1w s GLY 581 Ca 0.00 -1.71 0.01 0.00 0.00 0.00 0.00 44.72 43.02 1j1w s GLY 581 CO 0.00 -1.37 0.91 0.00 0.00 0.00 0.00 173.10 172.64 1j1w n ALA 582 N -0.33 2.38 -3.33 3.20 0.00 -0.73 -4.82 120.51 116.89 1j1w n ALA 582 Ca 0.03 -0.01 -0.05 0.00 0.00 0.00 0.00 53.44 53.41 1j1w n ALA 582 Cb 0.65 -1.01 0.01 0.00 0.00 0.00 0.00 19.45 19.09 1j1w n ALA 582 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j1w n GLY 583 N 0.39 2.55 0.00 0.00 0.00 -1.26 -4.63 105.19 102.23 1j1w n GLY 583 Ca 0.01 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 43.85 1j1w n GLY 583 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j1w n GLY 584 N 3.79 5.57 3.49 -0.02 0.00 -1.26 -4.71 105.19 112.05 1j1w n GLY 584 Ca 0.01 -2.14 -0.30 0.00 0.00 0.00 0.00 46.02 43.59 1j1w n GLY 584 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1j1w s SER 585 N -0.24 0.53 -0.55 1.61 1.04 -1.26 -4.87 113.70 109.96 1j1w s SER 585 Ca 0.00 0.97 0.05 0.00 0.48 0.00 0.00 55.95 57.45 1j1w s SER 585 Cb 0.00 -1.44 0.18 0.00 0.10 0.00 0.00 66.02 64.87 1j1w s SER 585 CO 0.00 -4.40 0.45 0.00 0.98 0.00 0.00 173.24 170.27 1j1w n ALA 586 N -4.99 3.15 -0.26 5.32 0.00 -1.26 -4.95 120.51 117.51 1j1w n ALA 586 Ca 0.09 -3.85 -0.07 0.00 0.00 0.00 0.00 53.44 49.62 1j1w n ALA 586 Cb 0.58 -0.88 -0.06 0.00 0.00 0.00 0.00 19.45 19.09 1j1w n ALA 586 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1j1w n PRO 587 N 2.20 -0.28 -0.01 0.00 -0.02 -1.26 0.24 135.00 135.87 1j1w n PRO 587 Ca 0.25 0.97 0.21 0.00 -2.02 0.00 0.00 63.50 62.91 1j1w n PRO 587 Cb 0.43 -1.43 0.69 0.00 -0.02 0.00 0.00 33.50 33.17 1j1w n PRO 587 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1j1w h LYS 588 N 0.00 0.00 0.00 -0.52 1.57 -1.99 0.10 116.57 115.73 1j1w h LYS 588 Ca 0.10 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 1j1w h LYS 588 Cb 0.26 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.57 1j1w h LYS 588 CO -0.59 0.00 -0.09 0.45 -0.57 0.00 0.00 179.45 178.65 1j1w h HIS 589 N 0.00 0.00 0.16 -1.35 3.86 0.27 -1.59 115.15 116.50 1j1w h HIS 589 Ca 0.26 0.00 -0.35 0.00 -1.16 0.00 0.00 60.37 59.12 1j1w h HIS 589 Cb 1.06 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.53 1j1w h HIS 589 CO 0.00 0.09 -1.81 0.28 0.86 0.00 0.00 177.93 177.35 1j1w h VAL 590 N 0.00 0.86 -0.75 2.45 2.07 -0.62 -3.17 116.25 117.09 1j1w h VAL 590 Ca -0.00 -2.49 0.10 0.00 0.82 0.00 0.00 66.70 65.13 1j1w h VAL 590 Cb 0.40 2.68 -0.08 0.00 -1.52 0.00 0.00 31.29 32.77 1j1w h VAL 590 CO 0.01 0.86 0.38 1.56 0.02 0.00 0.00 177.57 180.40 1j1w h GLN 591 N 0.09 0.61 -0.30 1.57 4.20 -0.90 0.78 115.11 121.16 1j1w h GLN 591 Ca -0.36 -0.04 -0.15 0.00 0.06 0.00 0.00 58.65 58.16 1j1w h GLN 591 Cb 2.07 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 29.71 1j1w h GLN 591 CO 0.15 0.40 -0.40 0.37 -0.67 0.00 0.00 178.83 178.68 1j1w h GLN 592 N 0.63 0.80 -0.85 1.46 4.15 -1.43 -3.13 115.11 116.74 1j1w h GLN 592 Ca 0.38 -0.46 -0.01 0.00 0.77 0.00 0.00 58.65 59.32 1j1w h GLN 592 Cb 0.42 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.10 1j1w h GLN 592 CO -0.28 1.09 0.49 0.35 -1.93 0.00 0.00 178.83 178.55 1j1w h PHE 593 N 0.57 1.14 0.00 3.99 3.57 -0.80 0.29 116.94 125.70 1j1w h PHE 593 Ca 0.04 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1j1w h PHE 593 Cb 0.99 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 39.36 1j1w h PHE 593 CO 0.07 0.78 0.00 1.28 -2.23 0.00 0.00 178.31 178.21 1j1w n LEU 594 N -4.40 0.00 0.04 0.59 4.77 0.18 -1.64 117.00 116.54 1j1w n LEU 594 Ca 0.09 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1j1w n LEU 594 Cb 0.08 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1j1w n LEU 594 CO 0.38 0.00 -0.10 -0.62 -1.33 0.00 0.00 177.39 175.72 1j1w n GLU 595 N -0.87 0.00 0.03 3.23 1.02 -0.71 -3.32 120.64 120.03 1j1w n GLU 595 Ca 0.15 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.33 1j1w n GLU 595 Cb 0.07 -0.46 -0.08 0.00 -0.02 0.00 0.00 31.44 30.95 1j1w n GLU 595 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1j1w n GLU 596 N -3.38 0.63 -1.41 3.49 1.02 0.93 -2.82 120.64 119.09 1j1w n GLU 596 Ca 0.00 0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 1j1w n GLU 596 Cb 0.10 -1.74 0.00 0.00 -0.02 0.00 0.00 31.44 29.78 1j1w n GLU 596 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1j1w n GLY 597 N 1.35 0.81 3.22 0.62 0.00 -0.65 0.28 105.19 110.82 1j1w n GLY 597 Ca -0.08 -0.65 -0.29 0.00 0.00 0.00 0.00 46.02 45.00 1j1w n GLY 597 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1j1w s TYR 598 N -2.00 2.10 -0.31 1.61 6.14 -1.26 -4.35 117.35 119.29 1j1w s TYR 598 Ca 0.00 -0.57 0.02 0.00 0.64 0.00 0.00 57.07 57.15 1j1w s TYR 598 Cb 0.00 -1.38 0.09 0.00 0.42 0.00 0.00 41.96 41.09 1j1w s TYR 598 CO 0.00 -0.16 0.05 -1.17 0.64 0.00 0.00 175.55 174.90 1j1w s LEU 599 N -0.17 3.52 0.00 6.97 2.96 -1.26 -2.18 118.68 128.51 1j1w s LEU 599 Ca -0.01 -1.81 0.21 0.00 -0.22 0.00 0.00 54.13 52.30 1j1w s LEU 599 Cb -0.12 -1.29 0.97 0.00 0.50 0.00 0.00 46.19 46.25 1j1w s LEU 599 CO 0.02 -0.37 1.66 -2.11 -1.32 0.00 0.00 176.35 174.23 1j1w n ARG 600 N 4.53 1.38 -1.67 1.98 1.85 -1.26 -3.34 116.66 120.12 1j1w n ARG 600 Ca -0.01 -0.57 -0.47 0.00 -1.00 0.00 0.00 57.85 55.80 1j1w n ARG 600 Cb 0.42 -1.36 -0.04 0.00 -1.05 0.00 0.00 32.46 30.43 1j1w n ARG 600 CO 0.00 0.00 0.00 1.87 -0.01 0.00 0.00 177.63 179.49 1j1w n TRP 601 N -0.22 2.29 -3.02 2.89 -0.00 -1.26 -4.87 117.44 113.25 1j1w n TRP 601 Ca 0.16 0.16 -0.40 0.00 -0.00 0.00 0.00 57.50 57.41 1j1w n TRP 601 Cb 0.21 -2.59 -0.05 0.00 -0.00 0.00 0.00 31.31 28.88 1j1w n TRP 601 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 1j1w s ASP 602 N 2.16 6.88 -0.15 5.87 -1.08 -1.26 -4.82 116.67 124.26 1j1w s ASP 602 Ca 0.84 1.06 0.14 0.00 -0.52 0.00 0.00 52.55 54.08 1j1w s ASP 602 Cb -0.68 -2.40 0.69 0.00 -1.46 0.00 0.00 42.92 39.06 1j1w s ASP 602 CO 0.43 -0.26 1.57 -1.20 0.52 0.00 0.00 175.17 176.23 1j1w n SER 603 N 4.68 4.74 0.26 -0.34 7.64 -1.26 -4.38 113.62 124.96 1j1w n SER 603 Ca 0.01 -2.61 0.11 0.00 1.01 0.00 0.00 58.87 57.39 1j1w n SER 603 Cb 0.50 -0.61 0.68 0.00 -1.01 0.00 0.00 64.21 63.78 1j1w n SER 603 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1j1w h LEU 604 N 3.60 0.00 -0.41 -3.43 5.85 -1.92 -2.14 115.31 116.86 1j1w h LEU 604 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1j1w h LEU 604 Cb 1.56 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.57 1j1w h LEU 604 CO 0.32 0.13 0.27 1.23 -0.34 0.00 0.00 178.44 180.05 1j1w h GLY 605 N 0.74 0.57 0.92 3.75 0.00 -1.75 -2.28 103.07 105.02 1j1w h GLY 605 Ca -0.00 -0.21 -0.09 0.00 0.00 0.00 0.00 47.33 47.03 1j1w h GLY 605 CO 0.02 0.21 -0.17 0.83 0.00 0.00 0.00 176.54 177.42 1j1w h GLU 606 N 0.55 0.64 -0.86 4.80 5.08 -1.59 -1.60 114.58 121.60 1j1w h GLU 606 Ca 0.15 -0.29 0.12 0.00 -1.00 0.00 0.00 59.36 58.34 1j1w h GLU 606 Cb -0.06 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.11 1j1w h GLU 606 CO -0.03 0.88 0.56 0.74 -1.00 0.00 0.00 179.01 180.15 1j1w h PHE 607 N 0.39 0.83 -0.06 4.33 0.04 -1.28 0.47 116.94 121.67 1j1w h PHE 607 Ca 0.06 0.02 -0.08 0.00 2.80 0.00 0.00 57.97 60.78 1j1w h PHE 607 Cb 0.70 -0.27 0.00 0.00 2.20 0.00 0.00 35.95 38.59 1j1w h PHE 607 CO 0.06 0.35 -0.26 -0.07 -0.60 0.00 0.00 178.31 177.79 1j1w h LEU 608 N 0.74 0.33 -0.58 1.54 3.38 -1.29 -2.20 115.31 117.23 1j1w h LEU 608 Ca 0.42 -0.65 0.07 0.00 0.09 0.00 0.00 57.88 57.81 1j1w h LEU 608 Cb 0.58 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.17 1j1w h LEU 608 CO -0.18 0.92 0.27 0.00 0.09 0.00 0.00 178.44 179.54 1j1w h ALA 609 N 0.41 0.76 0.78 1.53 0.00 -0.15 0.34 119.26 122.94 1j1w h ALA 609 Ca -0.02 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1j1w h ALA 609 Cb 0.91 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.68 1j1w h ALA 609 CO 0.05 -0.10 -0.37 1.25 0.00 0.00 0.00 179.25 180.08 1j1w h LEU 610 N 0.50 -0.88 0.00 0.00 5.85 -0.19 -1.13 115.31 119.46 1j1w h LEU 610 Ca 0.28 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.03 1j1w h LEU 610 Cb 0.25 0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.51 1j1w h LEU 610 CO -0.22 -0.56 0.19 0.00 -0.34 0.00 0.00 178.44 177.51 1j1w n ALA 611 N -2.64 0.60 -0.09 1.25 0.00 -0.83 -0.68 120.51 118.12 1j1w n ALA 611 Ca -0.13 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.08 1j1w n ALA 611 Cb 0.41 -0.57 -0.12 0.00 0.00 0.00 0.00 19.45 19.17 1j1w n ALA 611 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j1w n ALA 612 N -1.24 1.08 0.11 0.00 0.00 0.08 -4.22 120.51 116.32 1j1w n ALA 612 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.63 1j1w n ALA 612 Cb 0.19 -0.32 -0.02 0.00 0.00 0.00 0.00 19.45 19.31 1j1w n ALA 612 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1j1w h SER 613 N -0.43 0.00 0.28 0.00 4.64 0.23 -2.84 113.55 115.43 1j1w h SER 613 Ca -0.51 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.76 1j1w h SER 613 Cb 1.74 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.82 1j1w h SER 613 CO -0.14 0.60 -0.23 -0.07 -0.87 0.00 0.00 176.83 176.12 1j1w h LEU 614 N 0.00 0.00 0.03 5.97 3.38 -1.12 -1.41 115.31 122.16 1j1w h LEU 614 Ca -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1j1w h LEU 614 Cb 1.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.23 1j1w h LEU 614 CO 0.07 0.23 -0.01 -0.08 0.09 0.00 0.00 178.44 178.74 1j1w h GLU 615 N 0.00 -0.04 -1.03 1.13 4.81 -1.71 -2.77 114.58 114.97 1j1w h GLU 615 Ca -0.00 0.00 0.30 0.00 -0.13 0.00 0.00 59.36 59.53 1j1w h GLU 615 Cb 0.43 0.01 -0.13 0.00 0.63 0.00 0.00 28.75 29.69 1j1w h GLU 615 CO 0.03 0.64 0.61 1.25 -0.73 0.00 0.00 179.01 180.80 1j1w h HIS 616 N -0.93 0.91 0.00 0.92 2.76 -1.38 0.31 115.15 117.74 1j1w h HIS 616 Ca -0.00 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 1j1w h HIS 616 Cb 0.69 -0.25 0.00 0.00 1.55 0.00 0.00 27.41 29.40 1j1w h HIS 616 CO 0.18 -0.07 0.00 -0.11 -1.30 0.00 0.00 177.93 176.62 1j1w n LEU 617 N -4.93 0.00 -0.35 0.26 7.94 -0.54 -1.73 117.00 117.65 1j1w n LEU 617 Ca 0.30 0.56 0.32 0.00 -1.11 0.00 0.00 56.01 56.07 1j1w n LEU 617 Cb 0.92 -0.06 0.58 0.00 0.53 0.00 0.00 43.42 45.39 1j1w n LEU 617 CO 0.14 -0.06 1.10 1.23 -1.11 0.00 0.00 177.39 178.69 1j1w h GLY 618 N 0.00 2.09 0.62 -3.96 0.00 -0.96 -1.67 103.07 99.19 1j1w h GLY 618 Ca 0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 47.33 47.14 1j1w h GLY 618 CO 0.00 -0.69 -0.08 3.43 0.00 0.00 0.00 176.54 179.20 1j1w h ASN 619 N 0.07 0.19 0.44 0.19 2.35 -0.44 -3.15 115.58 115.23 1j1w h ASN 619 Ca 0.83 -0.49 0.00 0.00 -0.55 0.00 0.00 56.30 56.09 1j1w h ASN 619 Cb 2.22 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 40.53 1j1w h ASN 619 CO -0.69 0.64 0.00 0.00 -1.65 0.00 0.00 177.43 175.74 1j1w n ALA 620 N -2.39 2.10 -3.45 -0.83 0.00 -0.69 -4.85 120.51 110.41 1j1w n ALA 620 Ca -0.07 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1j1w n ALA 620 Cb 0.31 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1j1w n ALA 620 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1j1w n TYR 621 N -1.31 0.00 -1.23 0.00 4.02 -0.86 -5.04 117.16 112.74 1j1w n TYR 621 Ca 0.10 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 57.68 1j1w n TYR 621 Cb 0.18 0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.57 1j1w n TYR 621 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 1j1w n LYS 622 N 0.00 2.50 -3.77 -0.72 2.85 -1.26 -4.88 118.16 112.88 1j1w n LYS 622 Ca 0.00 -2.93 -0.37 0.00 -1.05 0.00 0.00 58.31 53.97 1j1w n LYS 622 Cb 0.00 -2.15 -0.12 0.00 -0.65 0.00 0.00 35.03 32.12 1j1w n LYS 622 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 1j1w s ASN 623 N -1.41 5.26 -0.08 -5.58 3.84 -1.24 -4.91 114.94 110.82 1j1w s ASN 623 Ca 0.58 -1.75 -0.27 0.00 0.21 0.00 0.00 52.86 51.62 1j1w s ASN 623 Cb 0.45 -1.84 -0.23 0.00 -0.55 0.00 0.00 41.25 39.08 1j1w s ASN 623 CO -0.01 -0.48 1.01 -0.65 -2.79 0.00 0.00 177.10 174.18 1j1w h PRO 624 N 8.12 0.01 -0.99 0.43 0.11 -1.91 -3.21 132.00 134.56 1j1w h PRO 624 Ca -0.17 -0.01 0.32 0.00 0.11 0.00 0.00 66.00 66.25 1j1w h PRO 624 Cb 1.06 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 31.99 1j1w h PRO 624 CO 0.67 0.77 0.23 0.87 -0.21 0.00 0.00 178.00 180.33 1j1w h LYS 625 N -0.74 0.03 0.31 1.05 1.57 -1.93 0.88 116.57 117.74 1j1w h LYS 625 Ca -0.00 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1j1w h LYS 625 Cb 0.77 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.06 1j1w h LYS 625 CO 0.00 0.02 -0.24 0.00 -0.57 0.00 0.00 179.45 178.66 1j1w h ALA 626 N 1.98 -0.54 -0.19 3.86 0.00 -1.87 -0.10 119.26 122.39 1j1w h ALA 626 Ca 0.69 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.56 1j1w h ALA 626 Cb 1.59 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 19.70 1j1w h ALA 626 CO -0.85 -0.83 0.28 -0.07 0.00 0.00 0.00 179.25 177.79 1j1w h LEU 627 N -0.55 0.00 0.02 0.00 3.38 0.71 -1.48 115.31 117.40 1j1w h LEU 627 Ca -0.02 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.79 1j1w h LEU 627 Cb 0.49 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1j1w h LEU 627 CO -0.01 0.00 -0.84 0.58 0.09 0.00 0.00 178.44 178.26 1j1w h VAL 628 N 0.00 1.26 0.00 1.22 2.07 0.06 -2.30 116.25 118.56 1j1w h VAL 628 Ca 0.09 -2.29 0.00 0.00 0.82 0.00 0.00 66.70 65.32 1j1w h VAL 628 Cb 0.66 2.75 0.00 0.00 -1.52 0.00 0.00 31.29 33.18 1j1w h VAL 628 CO -0.00 0.50 0.00 0.00 0.02 0.00 0.00 177.57 178.09 1j1w n LEU 629 N -4.39 0.00 -0.07 2.57 -0.00 -0.17 -0.88 117.00 114.07 1j1w n LEU 629 Ca -0.23 0.48 -0.16 0.00 -0.00 0.00 0.00 56.01 56.10 1j1w n LEU 629 Cb 0.65 -0.48 -0.14 0.00 -0.00 0.00 0.00 43.42 43.46 1j1w n LEU 629 CO 0.29 -0.21 -1.02 0.00 -0.00 0.00 0.00 177.39 176.45 1j1w n ALA 630 N -1.48 1.29 -0.12 1.47 0.00 -0.59 -2.27 120.51 118.81 1j1w n ALA 630 Ca 0.04 -0.94 -0.03 0.00 0.00 0.00 0.00 53.44 52.52 1j1w n ALA 630 Cb 0.19 -0.41 0.20 0.00 0.00 0.00 0.00 19.45 19.43 1j1w n ALA 630 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1j1w h SER 631 N 0.02 0.76 0.02 0.00 0.87 -0.81 0.17 113.55 114.57 1j1w h SER 631 Ca -0.48 -0.13 -0.00 0.00 -1.23 0.00 0.00 61.79 59.94 1j1w h SER 631 Cb 2.03 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 63.79 1j1w h SER 631 CO 0.01 0.75 -0.01 0.71 -0.53 0.00 0.00 176.83 177.76 1j1w h THR 632 N 0.79 1.43 -0.68 2.23 1.35 -1.16 -3.12 112.91 113.74 1j1w h THR 632 Ca 0.17 -1.89 0.14 0.00 -0.55 0.00 0.00 66.41 64.28 1j1w h THR 632 Cb 0.29 2.62 -0.13 0.00 -1.73 0.00 0.00 68.15 69.20 1j1w h THR 632 CO -0.00 0.45 -0.18 0.25 -0.25 0.00 0.00 175.52 175.79 1j1w h LEU 633 N -0.92 -0.66 -0.88 3.87 5.85 -1.27 1.70 115.31 123.01 1j1w h LEU 633 Ca -0.00 0.21 0.24 0.00 0.84 0.00 0.00 57.88 59.16 1j1w h LEU 633 Cb 0.76 0.43 -0.15 0.00 0.37 0.00 0.00 40.66 42.08 1j1w h LEU 633 CO 0.00 -0.23 0.20 0.44 -0.34 0.00 0.00 178.44 178.51 1j1w h ASP 634 N -0.01 -0.08 0.56 1.25 3.32 -0.73 -1.38 116.42 119.35 1j1w h ASP 634 Ca 0.33 0.21 -0.03 0.00 0.02 0.00 0.00 57.03 57.56 1j1w h ASP 634 Cb 0.50 0.30 0.01 0.00 0.22 0.00 0.00 39.33 40.35 1j1w h ASP 634 CO -0.71 -0.18 -0.27 -0.61 -1.72 0.00 0.00 179.24 175.75 1j1w h GLN 635 N 0.17 -0.72 -1.12 3.56 4.15 0.25 -2.77 115.11 118.63 1j1w h GLN 635 Ca 0.55 0.05 0.31 0.00 0.77 0.00 0.00 58.65 60.33 1j1w h GLN 635 Cb 1.11 0.16 -0.08 0.00 0.21 0.00 0.00 27.48 28.88 1j1w h GLN 635 CO -0.68 -0.44 0.75 0.00 -1.93 0.00 0.00 178.83 176.52 1j1w h ALA 636 N -1.03 2.57 0.59 3.38 0.00 -0.23 0.73 119.26 125.27 1j1w h ALA 636 Ca -0.08 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1j1w h ALA 636 Cb 0.62 0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.48 1j1w h ALA 636 CO 0.13 -0.98 -0.28 1.15 0.00 0.00 0.00 179.25 179.26 1j1w h THR 637 N 0.23 0.41 -0.78 0.00 2.02 -1.20 -1.29 112.91 112.31 1j1w h THR 637 Ca 0.61 -0.04 0.13 0.00 0.77 0.00 0.00 66.41 67.89 1j1w h THR 637 Cb 1.87 0.43 -0.14 0.00 -1.74 0.00 0.00 68.15 68.57 1j1w h THR 637 CO -0.22 0.01 -0.32 1.23 0.37 0.00 0.00 175.52 176.59 1j1w h GLY 638 N -0.82 0.12 1.91 2.16 0.00 0.71 1.97 103.07 109.11 1j1w h GLY 638 Ca -0.08 0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.67 1j1w h GLY 638 CO 0.13 -0.23 0.04 0.50 0.00 0.00 0.00 176.54 176.99 1j1w h LYS 639 N -0.07 0.00 -0.06 4.80 1.79 -0.78 0.13 116.57 122.38 1j1w h LYS 639 Ca 0.31 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.73 1j1w h LYS 639 Cb 0.58 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.23 1j1w h LYS 639 CO -0.82 0.00 -0.13 0.82 -1.08 0.00 0.00 179.45 178.24 1j1w h ILE 640 N 0.00 1.42 0.00 1.86 1.08 0.43 -2.56 117.51 119.74 1j1w h ILE 640 Ca 0.00 -1.44 -0.01 0.00 -0.39 0.00 0.00 64.86 63.02 1j1w h ILE 640 Cb 0.09 2.21 -0.00 0.00 -3.07 0.00 0.00 36.82 36.05 1j1w h ILE 640 CO 0.00 0.40 -0.05 -0.07 -0.69 0.00 0.00 178.15 177.74 1j1w h LEU 641 N -0.29 0.00 0.00 1.44 3.38 -0.53 -1.42 115.31 117.88 1j1w h LEU 641 Ca 0.00 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.74 1j1w h LEU 641 Cb 0.72 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.43 1j1w h LEU 641 CO 0.03 0.05 -1.43 0.44 0.09 0.00 0.00 178.44 177.62 1j1w h ASP 642 N 0.00 0.00 -0.39 -0.43 5.19 -1.04 -3.35 116.42 116.40 1j1w h ASP 642 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1j1w h ASP 642 Cb 0.72 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.23 1j1w h ASP 642 CO 0.01 0.85 0.00 0.59 -3.12 0.00 0.00 179.24 177.57 1j1w n ASN 643 N -3.06 3.18 -3.68 6.45 3.02 -0.97 -4.99 115.26 115.21 1j1w n ASN 643 Ca -0.11 -2.10 -0.21 0.00 -0.03 0.00 0.00 54.58 52.13 1j1w n ASN 643 Cb 0.95 -0.30 0.04 0.00 -0.61 0.00 0.00 39.78 39.86 1j1w n ASN 643 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1j1w n ASN 644 N 0.56 -1.23 -2.02 6.41 5.15 -1.00 -4.89 115.26 118.23 1j1w n ASN 644 Ca 0.14 -0.80 -0.22 0.00 -0.60 0.00 0.00 54.58 53.10 1j1w n ASN 644 Cb 0.50 -4.14 0.10 0.00 -0.53 0.00 0.00 39.78 35.72 1j1w n ASN 644 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1j1w n LYS 645 N -4.26 2.10 -3.98 1.20 4.76 -0.57 -4.91 118.16 112.50 1j1w n LYS 645 Ca -0.30 -2.39 -0.31 0.00 -2.87 0.00 0.00 58.31 52.44 1j1w n LYS 645 Cb 0.68 -1.94 -0.05 0.00 -1.84 0.00 0.00 35.03 31.88 1j1w n LYS 645 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1j1w s SER 646 N -0.83 6.00 0.03 4.39 0.01 -1.26 -4.32 113.70 117.72 1j1w s SER 646 Ca 0.46 0.16 -0.39 0.00 1.31 0.00 0.00 55.95 57.49 1j1w s SER 646 Cb 0.38 -1.76 -0.19 0.00 0.21 0.00 0.00 66.02 64.66 1j1w s SER 646 CO 0.04 0.18 1.19 -2.65 0.41 0.00 0.00 173.24 172.41 1j1w n PRO 647 N 0.43 0.48 -0.02 12.44 -0.02 -1.26 -4.94 135.00 142.12 1j1w n PRO 647 Ca -0.07 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 1j1w n PRO 647 Cb 0.51 -1.73 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 1j1w n PRO 647 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1j1w n ALA 648 N 1.96 0.00 -0.06 3.55 0.00 -1.23 -4.98 120.51 119.75 1j1w n ALA 648 Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.54 1j1w n ALA 648 Cb 0.13 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.53 1j1w n ALA 648 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1j1w n ARG 649 N -0.23 0.27 -4.11 0.00 5.12 -1.26 -4.77 116.66 111.69 1j1w n ARG 649 Ca 0.00 0.08 -0.22 0.00 -1.93 0.00 0.00 57.85 55.78 1j1w n ARG 649 Cb 0.00 -1.11 -0.04 0.00 -1.16 0.00 0.00 32.46 30.14 1j1w n ARG 649 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1j1w s LYS 650 N -2.22 2.94 0.53 5.56 2.36 -1.26 -4.87 119.74 122.78 1j1w s LYS 650 Ca -0.16 -1.03 -0.19 0.00 -2.55 0.00 0.00 55.97 52.04 1j1w s LYS 650 Cb 0.05 -2.58 -0.09 0.00 -1.05 0.00 0.00 37.83 34.15 1j1w s LYS 650 CO 0.24 0.41 0.60 0.28 1.55 0.00 0.00 175.35 178.43 1j1w n VAL 651 N -1.12 2.27 0.00 4.02 0.31 -1.26 -3.94 118.33 118.62 1j1w n VAL 651 Ca -0.08 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.75 1j1w n VAL 651 Cb 0.58 -0.73 0.00 0.00 -0.91 0.00 0.00 33.84 32.78 1j1w n VAL 651 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1j1w n GLY 652 N 1.69 2.30 3.54 2.92 0.00 -1.26 -5.07 105.19 109.31 1j1w n GLY 652 Ca 0.11 -0.69 -0.35 0.00 0.00 0.00 0.00 46.02 45.09 1j1w n GLY 652 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j1w s GLU 653 N 0.00 3.81 0.00 1.61 2.02 -1.25 -4.90 118.70 119.99 1j1w s GLU 653 Ca 0.00 -0.42 0.00 0.00 0.02 0.00 0.00 54.97 54.57 1j1w s GLU 653 Cb 0.00 -3.26 0.00 0.00 0.10 0.00 0.00 34.13 30.97 1j1w s GLU 653 CO 0.00 0.05 0.00 -0.89 0.02 0.00 0.00 175.26 174.44 1j1w n ILE 654 N 4.20 0.00 0.00 -1.63 -0.00 -1.26 -3.58 119.36 117.09 1j1w n ILE 654 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.59 1j1w n ILE 654 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 40.16 1j1w n ILE 654 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 1j1w n ASP 655 N 0.48 0.00 -0.07 4.38 -0.08 -1.26 -3.35 116.55 116.65 1j1w n ASP 655 Ca 0.00 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 53.17 1j1w n ASP 655 Cb 0.00 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 43.42 1j1w n ASP 655 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 1j1w n ASN 656 N -3.55 1.70 0.00 1.67 5.15 -1.21 -3.99 115.26 115.03 1j1w n ASN 656 Ca 0.00 0.28 0.04 0.00 -0.60 0.00 0.00 54.58 54.30 1j1w n ASN 656 Cb 0.00 -0.65 0.17 0.00 -0.53 0.00 0.00 39.78 38.77 1j1w n ASN 656 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1j1w n ARG 657 N -4.18 0.01 -0.04 1.20 0.00 -1.26 -0.07 116.66 112.32 1j1w n ARG 657 Ca -0.19 0.36 -0.12 0.00 -0.00 0.00 0.00 57.85 57.90 1j1w n ARG 657 Cb 0.50 -1.50 -0.07 0.00 0.00 0.00 0.00 32.46 31.39 1j1w n ARG 657 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 1j1w h GLY 658 N 1.31 0.22 0.46 5.14 0.00 -1.76 0.42 103.07 108.86 1j1w h GLY 658 Ca 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.14 1j1w h GLY 658 CO 0.00 0.17 -0.01 1.48 0.00 0.00 0.00 176.54 178.18 1j1w h SER 659 N -0.14 -0.03 -1.25 0.19 4.64 -0.77 -2.14 113.55 114.04 1j1w h SER 659 Ca 0.02 -0.50 0.36 0.00 -0.47 0.00 0.00 61.79 61.20 1j1w h SER 659 Cb 0.47 0.01 -0.08 0.00 -0.31 0.00 0.00 62.40 62.49 1j1w h SER 659 CO 0.01 0.50 0.86 0.45 -0.87 0.00 0.00 176.83 177.78 1j1w h HIS 660 N -0.58 0.27 0.12 4.77 -0.00 -0.44 0.66 115.15 119.96 1j1w h HIS 660 Ca -0.00 0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.37 1j1w h HIS 660 Cb 0.53 -0.08 0.00 0.00 -0.00 0.00 0.00 27.41 27.87 1j1w h HIS 660 CO 0.11 -0.02 -0.06 0.35 -0.00 0.00 0.00 177.93 178.31 1j1w h PHE 661 N 0.13 -0.15 -0.86 2.45 3.57 0.26 -0.60 116.94 121.73 1j1w h PHE 661 Ca 0.65 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 62.16 1j1w h PHE 661 Cb 2.25 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 41.00 1j1w h PHE 661 CO -0.00 0.24 0.57 1.88 -2.23 0.00 0.00 178.31 178.77 1j1w h TYR 662 N -0.59 1.08 -0.08 0.41 -1.99 0.70 1.34 116.97 117.84 1j1w h TYR 662 Ca -0.02 0.02 0.04 0.00 2.00 0.00 0.00 58.73 60.78 1j1w h TYR 662 Cb 0.46 -0.37 -0.05 0.00 2.00 0.00 0.00 36.73 38.77 1j1w h TYR 662 CO 0.06 0.68 -0.25 1.25 -0.00 0.00 0.00 178.16 179.90 1j1w h LEU 663 N 1.17 -0.77 -0.63 3.88 5.85 -0.08 1.19 115.31 125.92 1j1w h LEU 663 Ca 0.32 0.12 0.07 0.00 0.84 0.00 0.00 57.88 59.23 1j1w h LEU 663 Cb -0.13 0.33 -0.06 0.00 0.37 0.00 0.00 40.66 41.17 1j1w h LEU 663 CO -0.07 -0.31 0.30 0.00 -0.34 0.00 0.00 178.44 178.03 1j1w h ALA 664 N 0.55 0.83 0.30 1.25 0.00 0.24 0.24 119.26 122.67 1j1w h ALA 664 Ca 0.09 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1j1w h ALA 664 Cb 0.47 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1j1w h ALA 664 CO -0.28 -0.07 -0.14 1.25 0.00 0.00 0.00 179.25 180.00 1j1w h LEU 665 N 0.55 -0.34 -2.06 0.00 5.85 0.32 -1.63 115.31 118.00 1j1w h LEU 665 Ca 0.30 0.01 0.11 0.00 0.84 0.00 0.00 57.88 59.14 1j1w h LEU 665 Cb 0.27 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1j1w h LEU 665 CO -0.23 -0.21 0.34 1.88 -0.34 0.00 0.00 178.44 179.88 1j1w h TYR 666 N -0.48 0.00 0.03 1.25 0.99 0.15 -1.68 116.97 117.23 1j1w h TYR 666 Ca -0.04 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.69 1j1w h TYR 666 Cb 0.31 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.04 1j1w h TYR 666 CO 0.12 0.00 -0.02 2.35 -0.00 0.00 0.00 178.16 180.61 1j1w h TRP 667 N 0.00 -0.04 -0.26 4.88 7.01 -0.49 -0.04 115.95 127.00 1j1w h TRP 667 Ca 0.18 -0.00 0.06 0.00 2.11 0.00 0.00 58.89 61.24 1j1w h TRP 667 Cb 0.86 0.01 -0.06 0.00 -2.10 0.00 0.00 29.16 27.88 1j1w h TRP 667 CO 0.00 0.61 -0.13 0.00 -2.79 0.00 0.00 178.44 176.13 1j1w h ALA 668 N 0.12 0.08 -0.04 2.65 0.00 -0.63 -0.77 119.26 120.68 1j1w h ALA 668 Ca -0.00 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1j1w h ALA 668 Cb 0.67 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1j1w h ALA 668 CO 0.01 -0.53 0.02 1.96 0.00 0.00 0.00 179.25 180.71 1j1w h GLN 669 N -0.09 0.05 -0.96 0.00 4.20 -1.38 0.28 115.11 117.21 1j1w h GLN 669 Ca 0.14 -0.00 0.23 0.00 0.06 0.00 0.00 58.65 59.07 1j1w h GLN 669 Cb 0.31 -0.01 -0.07 0.00 0.30 0.00 0.00 27.48 28.00 1j1w h GLN 669 CO -0.33 0.08 0.63 0.00 -0.67 0.00 0.00 178.83 178.54 1j1w h ALA 670 N 0.97 2.25 0.00 3.87 0.00 -0.31 -1.67 119.26 124.36 1j1w h ALA 670 Ca 0.01 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1j1w h ALA 670 Cb 0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1j1w h ALA 670 CO -0.00 -0.57 -0.01 -0.07 0.00 0.00 0.00 179.25 178.60 1j1w h LEU 671 N 0.39 0.00 -0.72 0.00 3.38 -0.67 -3.31 115.31 114.38 1j1w h LEU 671 Ca 0.51 -0.79 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1j1w h LEU 671 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 1j1w h LEU 671 CO -0.21 0.90 0.00 0.00 0.09 0.00 0.00 178.44 179.22 1j1w n ALA 672 N -2.65 1.87 -0.70 1.53 0.00 0.04 -1.79 120.51 118.81 1j1w n ALA 672 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1j1w n ALA 672 Cb 0.38 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.83 1j1w n ALA 672 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j1w n ALA 673 N 0.03 1.35 -2.45 0.00 0.00 -0.69 -4.87 120.51 113.88 1j1w n ALA 673 Ca 0.00 -0.69 -0.27 0.00 0.00 0.00 0.00 53.44 52.48 1j1w n ALA 673 Cb 0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 19.45 19.52 1j1w n ALA 673 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1j1w s GLN 674 N -0.34 2.25 0.00 0.00 1.03 -0.74 -5.05 119.66 116.81 1j1w s GLN 674 Ca 0.00 -2.08 0.00 0.00 0.04 0.00 0.00 55.36 53.32 1j1w s GLN 674 Cb 0.00 -2.01 0.00 0.00 0.03 0.00 0.00 33.01 31.03 1j1w s GLN 674 CO 0.00 -0.58 0.85 0.25 -2.54 0.00 0.00 175.29 173.28 1j1w n THR 675 N -1.69 0.00 0.07 3.63 -2.24 -1.26 -4.77 114.28 108.02 1j1w n THR 675 Ca -0.04 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.70 1j1w n THR 675 Cb 0.65 0.52 0.18 0.00 -2.10 0.00 0.00 70.33 69.58 1j1w n THR 675 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1j1w h GLU 676 N 0.00 0.32 -2.60 -0.78 4.39 -1.97 -3.38 114.58 110.56 1j1w h GLU 676 Ca 0.00 -0.16 -0.48 0.00 0.34 0.00 0.00 59.36 59.05 1j1w h GLU 676 Cb 1.29 0.00 -0.38 0.00 -0.10 0.00 0.00 28.75 29.56 1j1w h GLU 676 CO 0.00 0.70 -0.75 0.34 -1.16 0.00 0.00 179.01 178.15 1j1w s ASP 677 N -6.87 3.01 0.38 1.42 -1.08 -1.26 -5.01 116.67 107.25 1j1w s ASP 677 Ca -0.05 -1.22 0.11 0.00 -0.52 0.00 0.00 52.55 50.86 1j1w s ASP 677 Cb 0.13 -0.13 0.89 0.00 -1.46 0.00 0.00 42.92 42.35 1j1w s ASP 677 CO 0.79 -0.42 1.92 0.50 0.52 0.00 0.00 175.17 178.48 1j1w h LYS 678 N 8.26 0.58 0.57 4.34 3.64 -1.88 -1.93 116.57 130.16 1j1w h LYS 678 Ca -0.16 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.16 1j1w h LYS 678 Cb 1.02 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.70 1j1w h LYS 678 CO 0.40 0.39 -0.41 1.49 -2.27 0.00 0.00 179.45 179.04 1j1w h GLU 679 N 0.60 -0.91 -0.19 1.90 4.81 -1.97 0.24 114.58 119.06 1j1w h GLU 679 Ca 0.38 0.06 0.05 0.00 -0.13 0.00 0.00 59.36 59.72 1j1w h GLU 679 Cb 0.63 0.21 -0.06 0.00 0.63 0.00 0.00 28.75 30.15 1j1w h GLU 679 CO -0.14 -0.61 -0.22 -0.07 -0.73 0.00 0.00 179.01 177.24 1j1w h LEU 680 N -0.94 -0.69 -1.10 1.64 4.07 -1.86 0.22 115.31 116.65 1j1w h LEU 680 Ca -0.08 0.12 0.30 0.00 0.08 0.00 0.00 57.88 58.31 1j1w h LEU 680 Cb 0.77 0.32 -0.13 0.00 1.08 0.00 0.00 40.66 42.71 1j1w h LEU 680 CO 0.04 -0.26 0.62 -0.61 -1.08 0.00 0.00 178.44 177.15 1j1w h GLN 681 N -0.24 0.38 0.01 1.13 4.15 -1.04 -1.05 115.11 118.45 1j1w h GLN 681 Ca 0.12 -0.02 -0.05 0.00 0.77 0.00 0.00 58.65 59.46 1j1w h GLN 681 Cb 0.43 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.03 1j1w h GLN 681 CO -0.34 0.25 -0.21 0.00 -1.93 0.00 0.00 178.83 176.61 1j1w h ALA 682 N 1.75 0.02 -0.41 3.38 0.00 0.18 -3.16 119.26 121.02 1j1w h ALA 682 Ca 0.69 -0.47 -0.32 0.00 0.00 0.00 0.00 54.91 54.81 1j1w h ALA 682 Cb 1.59 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 19.26 1j1w h ALA 682 CO -0.49 0.06 0.32 0.00 0.00 0.00 0.00 179.25 179.13 1j1w n GLN 683 N -4.53 1.86 0.00 0.00 10.64 0.52 -3.19 117.38 122.68 1j1w n GLN 683 Ca -0.10 -1.53 0.00 0.00 -1.83 0.00 0.00 57.00 53.54 1j1w n GLN 683 Cb 0.50 -1.69 0.00 0.00 -0.86 0.00 0.00 30.24 28.19 1j1w n GLN 683 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 1j1w n PHE 684 N 0.72 0.00 -0.04 2.61 3.01 -0.90 -4.89 117.46 117.97 1j1w n PHE 684 Ca 0.32 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.62 1j1w n PHE 684 Cb 0.59 0.01 -0.08 0.00 -0.01 0.00 0.00 39.48 39.99 1j1w n PHE 684 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 1j1w h THR 685 N 0.21 1.34 -1.08 4.37 1.35 -1.51 0.73 112.91 118.33 1j1w h THR 685 Ca 0.00 -1.80 0.30 0.00 -0.55 0.00 0.00 66.41 64.36 1j1w h THR 685 Cb 0.11 2.07 -0.07 0.00 -1.73 0.00 0.00 68.15 68.53 1j1w h THR 685 CO 0.00 0.55 0.73 1.23 -0.25 0.00 0.00 175.52 177.78 1j1w h GLY 686 N 0.24 0.66 0.00 5.82 0.00 -1.85 -1.21 103.07 106.73 1j1w h GLY 686 Ca -0.03 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1j1w h GLY 686 CO 0.11 -0.08 -0.31 -2.22 0.00 0.00 0.00 176.54 174.04 1j1w h ILE 687 N 0.21 0.00 -0.58 2.60 2.04 -1.77 -3.39 117.51 116.61 1j1w h ILE 687 Ca 0.57 -0.90 0.11 0.00 1.00 0.00 0.00 64.86 65.65 1j1w h ILE 687 Cb 1.81 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 37.78 1j1w h ILE 687 CO -0.17 0.00 -0.15 0.00 0.00 0.00 0.00 178.15 177.83 1j1w n ALA 688 N -3.25 0.12 -2.47 1.87 0.00 0.24 0.11 120.51 117.13 1j1w n ALA 688 Ca -0.04 0.63 -0.41 0.00 0.00 0.00 0.00 53.44 53.62 1j1w n ALA 688 Cb 0.16 -0.37 0.01 0.00 0.00 0.00 0.00 19.45 19.25 1j1w n ALA 688 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1j1w n LYS 689 N -4.94 4.89 0.00 0.00 4.81 -0.51 -3.55 118.16 118.86 1j1w n LYS 689 Ca 0.09 -4.19 0.00 0.00 -0.87 0.00 0.00 58.31 53.34 1j1w n LYS 689 Cb 0.28 -2.57 0.00 0.00 0.02 0.00 0.00 35.03 32.77 1j1w n LYS 689 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1j1w n ALA 690 N 1.04 0.00 0.18 3.14 0.00 0.12 -4.82 120.51 120.18 1j1w n ALA 690 Ca 0.48 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.99 1j1w n ALA 690 Cb 0.28 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.87 1j1w n ALA 690 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1j1w h LEU 691 N 0.00 0.00 0.12 0.00 -0.00 -1.49 -1.64 115.31 112.29 1j1w h LEU 691 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 57.88 57.65 1j1w h LEU 691 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 40.67 1j1w h LEU 691 CO 0.00 0.26 -1.14 0.74 -0.00 0.00 0.00 178.44 178.30 1j1w h THR 692 N 0.00 1.23 -0.83 0.22 2.02 -1.83 -2.74 112.91 110.98 1j1w h THR 692 Ca -0.00 -2.44 0.02 0.00 0.77 0.00 0.00 66.41 64.76 1j1w h THR 692 Cb 1.14 2.90 -0.04 0.00 -1.74 0.00 0.00 68.15 70.41 1j1w h THR 692 CO 0.03 0.69 0.55 0.44 0.37 0.00 0.00 175.52 177.60 1j1w h ASP 693 N -0.37 0.92 -0.53 4.18 5.19 -1.87 -2.60 116.42 121.33 1j1w h ASP 693 Ca -0.24 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.16 1j1w h ASP 693 Cb 1.68 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 40.97 1j1w h ASP 693 CO 0.08 0.64 0.00 0.59 -3.12 0.00 0.00 179.24 177.44 1j1w n ASN 694 N -4.43 4.19 0.26 6.45 4.13 -0.62 -4.63 115.26 120.60 1j1w n ASN 694 Ca 0.10 -2.41 -0.17 0.00 1.68 0.00 0.00 54.58 53.79 1j1w n ASN 694 Cb 0.07 -0.49 -0.09 0.00 -1.54 0.00 0.00 39.78 37.73 1j1w n ASN 694 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 1j1w h GLU 695 N 3.32 -0.88 -0.87 3.52 4.81 -1.13 0.56 114.58 123.91 1j1w h GLU 695 Ca 0.00 0.06 0.18 0.00 -0.13 0.00 0.00 59.36 59.47 1j1w h GLU 695 Cb 1.27 0.20 -0.11 0.00 0.63 0.00 0.00 28.75 30.74 1j1w h GLU 695 CO 0.16 -0.59 0.41 1.79 -0.73 0.00 0.00 179.01 180.06 1j1w h THR 696 N -0.91 0.61 0.23 0.32 1.35 -1.82 0.14 112.91 112.82 1j1w h THR 696 Ca -0.05 -0.18 -0.01 0.00 -0.55 0.00 0.00 66.41 65.62 1j1w h THR 696 Cb 0.80 0.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.27 1j1w h THR 696 CO -0.08 0.09 -0.11 0.50 -0.25 0.00 0.00 175.52 175.68 1j1w h LYS 697 N 0.51 -0.30 -0.00 4.72 3.64 -1.78 -2.67 116.57 120.69 1j1w h LYS 697 Ca 0.50 0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.93 1j1w h LYS 697 Cb 0.84 0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 32.67 1j1w h LYS 697 CO -0.44 0.08 -0.47 0.82 -2.27 0.00 0.00 179.45 177.16 1j1w h ILE 698 N -0.84 0.08 -0.84 2.00 2.04 0.55 0.65 117.51 121.15 1j1w h ILE 698 Ca -0.03 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.02 1j1w h ILE 698 Cb 0.51 0.08 -0.15 0.00 -0.74 0.00 0.00 36.82 36.52 1j1w h ILE 698 CO 0.05 0.00 -0.05 0.58 0.00 0.00 0.00 178.15 178.73 1j1w h VAL 699 N -0.62 0.21 -0.22 1.67 2.07 -0.85 0.48 116.25 118.99 1j1w h VAL 699 Ca 0.03 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1j1w h VAL 699 Cb 0.69 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1j1w h VAL 699 CO -0.34 0.01 0.14 1.23 0.02 0.00 0.00 177.57 178.63 1j1w h GLY 700 N 0.05 0.31 0.98 2.17 0.00 -0.42 -0.82 103.07 105.35 1j1w h GLY 700 Ca 0.46 -0.11 0.06 0.00 0.00 0.00 0.00 47.33 47.74 1j1w h GLY 700 CO -0.79 0.11 0.53 0.83 0.00 0.00 0.00 176.54 177.22 1j1w h GLU 701 N 0.29 0.87 0.57 4.80 5.08 0.47 -0.51 114.58 126.14 1j1w h GLU 701 Ca 0.08 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1j1w h GLU 701 Cb -0.03 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 29.03 1j1w h GLU 701 CO -0.02 0.57 -0.27 -0.07 -1.00 0.00 0.00 179.01 178.22 1j1w h LEU 702 N 0.89 -0.65 -1.84 1.33 3.38 -0.26 -3.02 115.31 115.15 1j1w h LEU 702 Ca 0.34 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.33 1j1w h LEU 702 Cb 0.20 0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1j1w h LEU 702 CO -0.12 -0.25 0.14 0.00 0.09 0.00 0.00 178.44 178.31 1j1w h ALA 703 N -1.17 1.12 0.00 1.53 0.00 -1.05 -1.09 119.26 118.60 1j1w h ALA 703 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1j1w h ALA 703 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1j1w h ALA 703 CO 0.13 -0.12 0.00 0.00 0.00 0.00 0.00 179.25 179.26 1j1w n ALA 704 N -1.83 2.18 -0.88 0.00 0.00 -0.21 -2.16 120.51 117.61 1j1w n ALA 704 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1j1w n ALA 704 Cb 0.19 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.64 1j1w n ALA 704 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j1w n ALA 705 N 0.19 0.72 -2.56 0.00 0.00 -0.41 -5.04 120.51 113.40 1j1w n ALA 705 Ca 0.00 -0.32 -0.31 0.00 0.00 0.00 0.00 53.44 52.81 1j1w n ALA 705 Cb 0.22 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.63 1j1w n ALA 705 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1j1w s GLN 706 N -0.06 3.68 0.00 0.00 -0.21 -0.92 -4.50 119.66 117.66 1j1w s GLN 706 Ca 0.00 0.05 0.00 0.00 0.02 0.00 0.00 55.36 55.43 1j1w s GLN 706 Cb 0.00 -2.75 0.00 0.00 1.00 0.00 0.00 33.01 31.26 1j1w s GLN 706 CO 0.00 0.38 0.00 0.41 -2.12 0.00 0.00 175.29 173.96 1j1w n GLY 707 N -0.16 2.95 3.79 3.09 0.00 0.81 -4.98 105.19 110.70 1j1w n GLY 707 Ca -0.01 -0.77 -0.30 0.00 0.00 0.00 0.00 46.02 44.93 1j1w n GLY 707 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j1w s LYS 708 N 0.00 2.23 0.61 1.61 1.02 -1.16 -4.49 119.74 119.55 1j1w s LYS 708 Ca 0.00 0.81 -0.09 0.00 0.02 0.00 0.00 55.97 56.71 1j1w s LYS 708 Cb 0.00 -1.92 -0.02 0.00 -0.52 0.00 0.00 37.83 35.37 1j1w s LYS 708 CO 0.00 -1.56 0.98 -2.14 -0.92 0.00 0.00 175.35 171.71 1j1w s PRO 709 N -5.07 3.30 0.07 -1.68 0.02 -1.13 -2.88 135.00 127.63 1j1w s PRO 709 Ca 0.60 0.45 0.09 0.00 0.02 0.00 0.00 61.00 62.16 1j1w s PRO 709 Cb -0.15 -2.15 -0.03 0.00 0.02 0.00 0.00 34.50 32.19 1j1w s PRO 709 CO 0.55 -0.64 -0.24 0.08 -0.33 0.00 0.00 177.00 176.43 1j1w s VAL 710 N -3.11 1.92 -0.14 3.83 1.01 -1.21 -4.91 120.40 117.78 1j1w s VAL 710 Ca 0.54 -1.40 -0.01 0.00 0.00 0.00 0.00 61.98 61.11 1j1w s VAL 710 Cb -0.11 -1.67 0.04 0.00 0.00 0.00 0.00 36.38 34.64 1j1w s VAL 710 CO 0.50 0.20 -0.02 -0.62 0.00 0.00 0.00 175.10 175.17 1j1w s ASP 711 N -1.44 2.48 -0.22 3.32 2.15 -1.26 -4.73 116.67 116.97 1j1w s ASP 711 Ca 0.10 -0.53 0.13 0.00 0.43 0.00 0.00 52.55 52.68 1j1w s ASP 711 Cb -0.10 -0.70 0.45 0.00 -0.30 0.00 0.00 42.92 42.27 1j1w s ASP 711 CO 0.03 -0.21 1.35 2.30 -0.17 0.00 0.00 175.17 178.46 1j1w n ILE 712 N 4.99 2.29 -1.29 4.11 -5.35 -1.26 -4.88 119.36 117.97 1j1w n ILE 712 Ca -0.10 -2.53 -0.12 0.00 -0.27 0.00 0.00 62.75 59.73 1j1w n ILE 712 Cb 0.48 -0.27 -0.05 0.00 -1.74 0.00 0.00 39.64 38.06 1j1w n ILE 712 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1j1w n ALA 713 N -1.04 -0.18 0.00 -1.28 0.00 -1.26 -1.08 120.51 115.67 1j1w n ALA 713 Ca 0.24 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1j1w n ALA 713 Cb 0.86 -1.53 0.00 0.00 0.00 0.00 0.00 19.45 18.78 1j1w n ALA 713 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j1w n GLY 714 N -0.02 -0.73 2.03 0.00 0.00 -1.26 -4.64 105.19 100.57 1j1w n GLY 714 Ca -0.12 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1j1w n GLY 714 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1j1w n TYR 715 N 0.51 -2.58 0.05 1.61 9.36 -1.26 -4.82 117.16 120.03 1j1w n TYR 715 Ca 0.00 0.18 0.03 0.00 3.32 0.00 0.00 57.90 61.43 1j1w n TYR 715 Cb 0.00 0.88 -0.06 0.00 -0.63 0.00 0.00 39.34 39.53 1j1w n TYR 715 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1j1w n TYR 716 N -2.61 0.93 -3.07 2.98 4.02 -1.26 -4.51 117.16 113.63 1j1w n TYR 716 Ca 0.00 0.30 -0.16 0.00 -0.01 0.00 0.00 57.90 58.03 1j1w n TYR 716 Cb 0.00 -1.03 -0.00 0.00 -0.02 0.00 0.00 39.34 38.29 1j1w n TYR 716 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 176.86 177.43 1j1w n HIS 717 N -2.80 -0.63 -0.78 -0.72 -0.00 -1.26 -4.41 115.22 104.61 1j1w n HIS 717 Ca -0.07 -3.37 -0.34 0.00 0.46 0.00 0.00 57.72 54.40 1j1w n HIS 717 Cb 0.76 0.11 0.13 0.00 -0.12 0.00 0.00 29.99 30.86 1j1w n HIS 717 CO 0.00 0.00 0.00 -2.30 0.46 0.00 0.00 176.34 174.50 1j1w n PRO 718 N 0.36 -0.85 -2.68 1.57 -0.02 -1.26 -4.79 135.00 127.34 1j1w n PRO 718 Ca 0.20 -0.23 -0.43 0.00 -2.02 0.00 0.00 63.50 61.03 1j1w n PRO 718 Cb 0.66 -1.61 -0.03 0.00 -0.02 0.00 0.00 33.50 32.51 1j1w n PRO 718 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1j1w s ASN 719 N -1.73 6.49 0.37 2.55 3.84 -0.24 -4.90 114.94 121.32 1j1w s ASN 719 Ca 0.53 0.13 0.14 0.00 0.21 0.00 0.00 52.86 53.87 1j1w s ASN 719 Cb -0.13 -2.51 0.98 0.00 -0.55 0.00 0.00 41.25 39.04 1j1w s ASN 719 CO 0.68 -1.28 1.78 0.71 -2.79 0.00 0.00 177.10 176.20 1j1w h THR 720 N 6.14 0.60 0.64 -5.21 1.35 -1.89 -2.10 112.91 112.44 1j1w h THR 720 Ca -0.24 -0.18 -0.03 0.00 -0.55 0.00 0.00 66.41 65.41 1j1w h THR 720 Cb 1.06 0.04 0.01 0.00 -1.73 0.00 0.00 68.15 67.53 1j1w h THR 720 CO 1.12 0.09 -0.31 -0.78 -0.25 0.00 0.00 175.52 175.40 1j1w h ASP 721 N 0.51 -0.73 -1.00 5.36 1.82 -1.98 -1.51 116.42 118.90 1j1w h ASP 721 Ca 0.58 0.03 0.23 0.00 -0.39 0.00 0.00 57.03 57.47 1j1w h ASP 721 Cb 1.26 0.19 -0.10 0.00 0.68 0.00 0.00 39.33 41.36 1j1w h ASP 721 CO -0.32 -0.47 0.63 -0.07 -1.61 0.00 0.00 179.24 177.40 1j1w h LEU 722 N -0.96 0.59 -0.24 2.28 4.07 -1.88 -1.19 115.31 117.98 1j1w h LEU 722 Ca -0.09 0.09 -0.04 0.00 0.08 0.00 0.00 57.88 57.93 1j1w h LEU 722 Cb 0.66 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.38 1j1w h LEU 722 CO 0.14 0.16 0.01 0.74 -1.08 0.00 0.00 178.44 178.42 1j1w h THR 723 N 0.55 1.25 -0.70 0.22 2.02 -1.26 -2.02 112.91 112.97 1j1w h THR 723 Ca 0.58 -0.87 0.03 0.00 0.77 0.00 0.00 66.41 66.92 1j1w h THR 723 Cb 1.21 1.35 -0.04 0.00 -1.74 0.00 0.00 68.15 68.93 1j1w h THR 723 CO -0.34 0.27 0.45 0.28 0.37 0.00 0.00 175.52 176.55 1j1w h SER 724 N 0.20 0.74 0.24 4.18 0.02 -0.15 0.11 113.55 118.89 1j1w h SER 724 Ca 0.07 -0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.92 1j1w h SER 724 Cb 0.39 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 1j1w h SER 724 CO 0.01 0.51 -0.36 0.11 -1.14 0.00 0.00 176.83 175.96 1j1w h LYS 725 N 0.88 0.18 -0.03 3.45 1.57 -1.32 0.41 116.57 121.70 1j1w h LYS 725 Ca 0.28 -0.07 -0.22 0.00 -1.87 0.00 0.00 60.65 58.76 1j1w h LYS 725 Cb -0.00 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1j1w h LYS 725 CO -0.10 0.52 -0.89 0.00 -0.57 0.00 0.00 179.45 178.41 1j1w h ALA 726 N 1.47 0.38 0.00 3.86 0.00 -0.74 -3.19 119.26 121.04 1j1w h ALA 726 Ca 0.02 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1j1w h ALA 726 Cb 0.72 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1j1w h ALA 726 CO 0.05 0.78 -0.47 0.52 0.00 0.00 0.00 179.25 180.13 1j1w h MET 727 N 0.29 0.00 -2.18 0.00 2.86 -0.53 -3.37 114.93 112.00 1j1w h MET 727 Ca -0.07 0.00 -0.56 0.00 -2.06 0.00 0.00 59.70 57.00 1j1w h MET 727 Cb 1.51 0.00 -0.41 0.00 0.06 0.00 0.00 31.60 32.76 1j1w h MET 727 CO 0.16 0.00 -0.80 0.54 1.06 0.00 0.00 176.91 177.87 1j1w n ARG 728 N -2.45 2.36 0.30 1.72 1.74 0.14 -4.65 116.66 115.83 1j1w n ARG 728 Ca 0.03 -4.34 -0.16 0.00 -0.77 0.00 0.00 57.85 52.61 1j1w n ARG 728 Cb 0.48 -2.03 -0.08 0.00 -1.02 0.00 0.00 32.46 29.81 1j1w n ARG 728 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 1j1w h PRO 729 N 3.31 -0.73 -5.47 5.56 0.11 -1.72 -3.43 132.00 129.63 1j1w h PRO 729 Ca 0.13 0.05 -0.43 0.00 0.11 0.00 0.00 66.00 65.86 1j1w h PRO 729 Cb 0.67 0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.94 1j1w h PRO 729 CO 0.72 -0.43 1.56 0.45 -0.21 0.00 0.00 178.00 180.09 1j1w n SER 730 N -5.36 1.85 0.13 -2.05 2.88 -1.26 -4.77 113.62 105.03 1j1w n SER 730 Ca -0.12 -0.46 0.12 0.00 -1.33 0.00 0.00 58.87 57.09 1j1w n SER 730 Cb 0.33 -1.45 0.48 0.00 -0.75 0.00 0.00 64.21 62.82 1j1w n SER 730 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1j1w n ALA 731 N 15.00 1.79 0.01 -1.46 0.00 -1.26 -2.43 120.51 132.15 1j1w n ALA 731 Ca 0.44 0.06 -0.07 0.00 0.00 0.00 0.00 53.44 53.87 1j1w n ALA 731 Cb 0.44 -1.41 -0.12 0.00 0.00 0.00 0.00 19.45 18.36 1j1w n ALA 731 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1j1w h THR 732 N 0.00 1.04 -0.03 0.00 1.35 -1.98 -2.83 112.91 110.46 1j1w h THR 732 Ca 0.00 -2.81 -0.19 0.00 -0.55 0.00 0.00 66.41 62.86 1j1w h THR 732 Cb 0.44 2.49 -0.01 0.00 -1.73 0.00 0.00 68.15 69.35 1j1w h THR 732 CO 0.00 0.59 -0.80 0.15 -0.25 0.00 0.00 175.52 175.22 1j1w h PHE 733 N 0.00 0.41 0.02 4.73 -0.00 -1.88 -2.76 116.94 117.45 1j1w h PHE 733 Ca -0.19 -0.20 -0.00 0.00 -0.00 0.00 0.00 57.97 57.58 1j1w h PHE 733 Cb 1.89 -0.06 0.00 0.00 -0.00 0.00 0.00 35.95 37.79 1j1w h PHE 733 CO 0.00 0.97 -0.01 -0.91 -0.00 0.00 0.00 178.31 178.36 1j1w h ASN 734 N 0.18 -0.02 0.55 0.41 2.35 -1.55 -2.82 115.58 114.69 1j1w h ASN 734 Ca -0.04 -0.37 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 1j1w h ASN 734 Cb 1.39 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.76 1j1w h ASN 734 CO 0.13 0.36 0.00 0.00 -1.65 0.00 0.00 177.43 176.27 1j1w n ALA 735 N -2.30 1.54 -1.16 -0.83 0.00 -1.07 -1.59 120.51 115.10 1j1w n ALA 735 Ca -0.08 0.07 -0.19 0.00 0.00 0.00 0.00 53.44 53.24 1j1w n ALA 735 Cb 0.20 -1.33 0.21 0.00 0.00 0.00 0.00 19.45 18.54 1j1w n ALA 735 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j1w n ALA 736 N -1.71 5.33 0.00 0.00 0.00 -1.04 -4.35 120.51 118.73 1j1w n ALA 736 Ca 0.02 -2.73 0.00 0.00 0.00 0.00 0.00 53.44 50.73 1j1w n ALA 736 Cb 0.18 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.23 1j1w n ALA 736 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1j1w n LEU 737 N -0.87 0.21 -0.21 0.00 7.94 -0.62 -4.87 117.00 118.58 1j1w n LEU 737 Ca 0.55 0.00 -0.05 0.00 -1.11 0.00 0.00 56.01 55.40 1j1w n LEU 737 Cb 1.60 0.00 0.05 0.00 0.53 0.00 0.00 43.42 45.60 1j1w n LEU 737 CO 0.56 -0.14 1.11 0.00 -1.11 0.00 0.00 177.39 177.82 1j1w h ALA 738 N 0.00 0.78 -0.37 1.96 0.00 -1.72 -3.13 119.26 116.78 1j1w h ALA 738 Ca 0.00 -0.03 -0.72 0.00 0.00 0.00 0.00 54.91 54.16 1j1w h ALA 738 Cb 0.12 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 17.63 1j1w h ALA 738 CO 0.00 0.15 2.88 -2.30 0.00 0.00 0.00 179.25 179.99 1j1w n PRO 739 N -4.70 3.63 0.00 0.00 -0.02 -1.26 -5.17 135.00 127.48 1j1w n PRO 739 Ca 0.05 -2.92 0.00 0.00 -2.02 0.00 0.00 63.50 58.61 1j1w n PRO 739 Cb 0.05 -2.93 0.00 0.00 -0.02 0.00 0.00 33.50 30.60 1j1w n PRO 739 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76