#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h4k h THR 7 N 0.00 0.52 0.08 2.61 2.02 -1.99 -0.39 112.91 115.77 3h4k h THR 7 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.16 3h4k h THR 7 Cb 0.00 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 3h4k h THR 7 CO 0.00 0.01 -0.08 -1.28 0.37 0.00 0.00 175.52 174.55 3h4k h SER 8 N 0.07 -0.20 -0.43 4.18 0.87 -2.00 -2.36 113.55 113.68 3h4k h SER 8 Ca 0.27 0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.79 3h4k h SER 8 Cb 0.43 0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.44 3h4k h SER 8 CO -0.49 -0.12 0.02 -0.61 -0.53 0.00 0.00 176.83 175.09 3h4k h GLN 9 N -0.17 0.74 -0.86 2.24 4.15 -1.94 -3.03 115.11 116.24 3h4k h GLN 9 Ca 0.00 -0.23 0.01 0.00 0.77 0.00 0.00 58.65 59.20 3h4k h GLN 9 Cb 0.16 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 27.74 3h4k h GLN 9 CO -0.02 0.81 0.57 2.35 -1.93 0.00 0.00 178.83 180.61 3h4k h TRP 10 N 0.58 1.08 -0.27 3.99 7.01 -1.03 -2.77 115.95 124.54 3h4k h TRP 10 Ca 0.12 0.03 -0.12 0.00 2.11 0.00 0.00 58.89 61.03 3h4k h TRP 10 Cb 0.46 -0.37 -0.00 0.00 -2.10 0.00 0.00 29.16 27.15 3h4k h TRP 10 CO 0.03 0.68 -0.29 1.25 -2.79 0.00 0.00 178.44 177.32 3h4k h LEU 11 N 1.17 0.72 0.08 0.65 5.85 -1.39 -1.12 115.31 121.26 3h4k h LEU 11 Ca 0.32 -0.48 0.00 0.00 0.84 0.00 0.00 57.88 58.56 3h4k h LEU 11 Cb -0.13 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.69 3h4k h LEU 11 CO -0.07 1.06 -0.08 -0.09 -0.34 0.00 0.00 178.44 178.92 3h4k h ARG 12 N 0.40 -0.17 -0.71 1.25 2.43 -1.49 -0.44 114.38 115.65 3h4k h ARG 12 Ca 0.04 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.24 3h4k h ARG 12 Cb 0.87 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.42 3h4k h ARG 12 CO 0.07 -0.11 0.46 0.87 -1.51 0.00 0.00 179.97 179.75 3h4k h LYS 13 N -0.18 0.90 -0.29 0.20 1.57 -1.49 -1.09 116.57 116.18 3h4k h LYS 13 Ca 0.01 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 3h4k h LYS 13 Cb 0.17 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 3h4k h LYS 13 CO -0.03 0.59 0.16 1.15 -0.57 0.00 0.00 179.45 180.76 3h4k h THR 14 N 0.92 1.12 -0.31 -0.16 2.02 -1.00 -2.29 112.91 113.21 3h4k h THR 14 Ca 0.27 -0.31 -0.05 0.00 0.77 0.00 0.00 66.41 67.08 3h4k h THR 14 Cb -0.06 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 3h4k h THR 14 CO -0.08 0.12 -0.02 0.58 0.37 0.00 0.00 175.52 176.50 3h4k h VAL 15 N 0.36 1.26 0.00 3.16 2.07 -0.83 -1.75 116.25 120.52 3h4k h VAL 15 Ca 0.10 -0.99 -0.04 0.00 0.82 0.00 0.00 66.70 66.59 3h4k h VAL 15 Cb 0.05 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 3h4k h VAL 15 CO -0.02 0.32 -0.21 0.44 0.02 0.00 0.00 177.57 178.12 3h4k h ASP 16 N 0.36 0.00 0.00 0.57 3.32 -1.18 -2.68 116.42 116.81 3h4k h ASP 16 Ca 0.09 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.78 3h4k h ASP 16 Cb 0.47 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.95 3h4k h ASP 16 CO 0.02 0.21 -2.34 -0.24 -1.72 0.00 0.00 179.24 175.17 3h4k n SER 17 N -3.51 1.16 -4.77 6.45 2.88 -0.87 -4.53 113.62 110.43 3h4k n SER 17 Ca -0.01 -0.06 -0.41 0.00 -1.33 0.00 0.00 58.87 57.06 3h4k n SER 17 Cb 0.37 0.33 -0.02 0.00 -0.75 0.00 0.00 64.21 64.14 3h4k n SER 17 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3h4k s ALA 18 N -2.47 3.50 -0.13 -1.46 0.00 -0.66 -4.63 121.76 115.90 3h4k s ALA 18 Ca -0.20 1.25 -0.21 0.00 0.00 0.00 0.00 51.96 52.80 3h4k s ALA 18 Cb 0.07 -3.48 -0.19 0.00 0.00 0.00 0.00 23.12 19.53 3h4k s ALA 18 CO 0.68 -0.63 0.52 0.00 0.00 0.00 0.00 175.76 176.33 3h4k h ALA 19 N 3.48 0.02 -3.25 0.00 0.00 -1.84 -3.24 119.26 114.42 3h4k h ALA 19 Ca -0.49 -0.42 -0.44 0.00 0.00 0.00 0.00 54.91 53.56 3h4k h ALA 19 Cb 1.23 0.06 -0.39 0.00 0.00 0.00 0.00 17.79 18.69 3h4k h ALA 19 CO 0.66 0.06 -0.76 0.08 0.00 0.00 0.00 179.25 179.29 3h4k s VAL 20 N -2.06 0.30 -0.00 0.00 1.01 -1.26 -0.62 120.40 117.76 3h4k s VAL 20 Ca -0.15 0.04 0.01 0.00 0.00 0.00 0.00 61.98 61.87 3h4k s VAL 20 Cb -0.02 -0.56 0.00 0.00 0.00 0.00 0.00 36.38 35.80 3h4k s VAL 20 CO 0.50 0.13 -0.02 -0.51 0.00 0.00 0.00 175.10 175.21 3h4k s ILE 21 N 1.99 0.16 -0.21 2.22 2.07 -0.73 -1.09 121.20 125.61 3h4k s ILE 21 Ca 0.04 -0.07 0.02 0.00 -1.41 0.00 0.00 60.65 59.23 3h4k s ILE 21 Cb -0.13 -0.16 0.04 0.00 0.13 0.00 0.00 42.46 42.34 3h4k s ILE 21 CO -0.06 0.06 -0.15 -0.22 -1.91 0.00 0.00 174.94 172.66 3h4k s LEU 22 N 0.06 2.59 -0.12 8.50 2.96 0.66 -1.16 118.68 132.17 3h4k s LEU 22 Ca -0.00 -0.95 -0.24 0.00 -0.22 0.00 0.00 54.13 52.71 3h4k s LEU 22 Cb -0.02 -1.44 -0.03 0.00 0.50 0.00 0.00 46.19 45.21 3h4k s LEU 22 CO -0.00 -0.10 0.76 -0.36 -1.32 0.00 0.00 176.35 175.33 3h4k s PHE 23 N 1.26 3.49 0.30 5.38 0.08 -0.74 -0.97 117.98 126.77 3h4k s PHE 23 Ca -0.01 1.24 -0.03 0.00 0.12 0.00 0.00 56.93 58.24 3h4k s PHE 23 Cb -0.16 -2.91 -0.01 0.00 -0.57 0.00 0.00 43.02 39.37 3h4k s PHE 23 CO -0.09 -0.09 0.40 0.45 -0.10 0.00 0.00 175.22 175.79 3h4k s SER 24 N 1.01 0.65 0.01 1.36 0.15 0.47 -2.17 113.70 115.19 3h4k s SER 24 Ca 0.38 -1.38 0.02 0.00 0.70 0.00 0.00 55.95 55.67 3h4k s SER 24 Cb -0.17 0.59 -0.01 0.00 -1.71 0.00 0.00 66.02 64.72 3h4k s SER 24 CO 0.15 -1.16 -0.08 -0.54 1.20 0.00 0.00 173.24 172.81 3h4k s LYS 25 N -3.48 0.58 0.45 5.44 1.02 -1.26 0.30 119.74 122.78 3h4k s LYS 25 Ca 0.31 -0.44 0.14 0.00 0.02 0.00 0.00 55.97 56.01 3h4k s LYS 25 Cb 0.01 -0.50 1.01 0.00 -0.52 0.00 0.00 37.83 37.82 3h4k s LYS 25 CO 0.17 0.13 2.00 1.79 -0.92 0.00 0.00 175.35 178.52 3h4k h THR 26 N 4.80 1.12 -2.65 2.17 1.35 -1.95 -3.27 112.91 114.48 3h4k h THR 26 Ca -0.32 -0.58 -0.75 0.00 -0.55 0.00 0.00 66.41 64.21 3h4k h THR 26 Cb 1.19 1.29 -0.32 0.00 -1.73 0.00 0.00 68.15 68.59 3h4k h THR 26 CO 0.47 0.17 0.43 0.35 -0.25 0.00 0.00 175.52 176.69 3h4k n THR 27 N -4.34 4.64 -3.65 6.82 -2.24 -1.26 -4.96 114.28 109.30 3h4k n THR 27 Ca -0.02 -5.77 -0.09 0.00 -2.27 0.00 0.00 64.05 55.90 3h4k n THR 27 Cb 0.23 -2.00 -0.10 0.00 -2.10 0.00 0.00 70.33 66.37 3h4k n THR 27 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h4k h PRO 29 N 8.18 0.00 -0.02 0.00 0.13 -1.92 -2.43 132.00 135.94 3h4k h PRO 29 Ca -0.16 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.72 3h4k h PRO 29 Cb 1.11 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.25 3h4k h PRO 29 CO 0.12 0.23 -0.98 1.88 -0.23 0.00 0.00 178.00 179.02 3h4k h TYR 30 N 0.00 0.95 -0.69 1.56 0.05 -1.96 -2.50 116.97 114.38 3h4k h TYR 30 Ca -0.00 -0.50 -0.04 0.00 0.05 0.00 0.00 58.73 58.24 3h4k h TYR 30 Cb 0.70 -0.11 -0.03 0.00 1.01 0.00 0.00 36.73 38.30 3h4k h TYR 30 CO 0.00 1.33 0.27 0.00 -1.05 0.00 0.00 178.16 178.72 3h4k h LYS 32 N 0.98 0.72 -0.65 0.00 3.64 -1.45 -1.54 116.57 118.27 3h4k h LYS 32 Ca 0.23 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 3h4k h LYS 32 Cb 0.21 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 3h4k h LYS 32 CO -0.02 0.75 0.32 0.87 -2.27 0.00 0.00 179.45 179.10 3h4k h LYS 33 N 0.68 0.91 -0.07 1.90 1.57 -1.31 -0.51 116.57 119.74 3h4k h LYS 33 Ca 0.13 -0.11 -0.09 0.00 -1.87 0.00 0.00 60.65 58.71 3h4k h LYS 33 Cb 0.44 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.58 3h4k h LYS 33 CO 0.02 0.70 -0.30 0.28 -0.57 0.00 0.00 179.45 179.58 3h4k h VAL 34 N 0.92 1.43 -0.79 0.50 2.07 -1.36 -2.61 116.25 116.40 3h4k h VAL 34 Ca 0.23 -1.72 0.08 0.00 0.82 0.00 0.00 66.70 66.11 3h4k h VAL 34 Cb 0.08 2.34 -0.07 0.00 -1.52 0.00 0.00 31.29 32.12 3h4k h VAL 34 CO -0.03 0.49 0.45 0.11 0.02 0.00 0.00 177.57 178.61 3h4k h LYS 35 N -0.18 0.77 -0.08 1.57 1.57 -1.07 0.24 116.57 119.39 3h4k h LYS 35 Ca -0.02 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.60 3h4k h LYS 35 Cb 0.95 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 3h4k h LYS 35 CO 0.06 0.51 -0.47 -0.44 -0.57 0.00 0.00 179.45 178.54 3h4k h ASP 36 N 0.79 0.21 -0.14 0.86 3.32 -1.16 -1.56 116.42 118.73 3h4k h ASP 36 Ca 0.37 -0.10 -0.09 0.00 0.02 0.00 0.00 57.03 57.23 3h4k h ASP 36 Cb 0.28 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.78 3h4k h ASP 36 CO -0.22 0.66 -0.25 0.58 -1.72 0.00 0.00 179.24 178.28 3h4k h VAL 37 N 0.16 1.36 -0.30 -1.35 2.07 -0.87 -2.17 116.25 115.15 3h4k h VAL 37 Ca 0.01 -1.50 -0.08 0.00 0.82 0.00 0.00 66.70 65.94 3h4k h VAL 37 Cb 0.90 1.99 -0.02 0.00 -1.52 0.00 0.00 31.29 32.64 3h4k h VAL 37 CO 0.07 0.45 -0.15 -0.07 0.02 0.00 0.00 177.57 177.89 3h4k h LEU 38 N 0.03 0.52 -0.63 2.57 3.38 -0.52 -0.16 115.31 120.50 3h4k h LEU 38 Ca 0.01 -0.15 -0.14 0.00 0.09 0.00 0.00 57.88 57.69 3h4k h LEU 38 Cb 0.84 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 3h4k h LEU 38 CO 0.06 0.70 -0.50 0.00 0.09 0.00 0.00 178.44 178.78 3h4k h ALA 39 N 1.36 0.81 -0.19 1.53 0.00 -1.33 0.26 119.26 121.69 3h4k h ALA 39 Ca 0.08 -0.49 -0.11 0.00 0.00 0.00 0.00 54.91 54.39 3h4k h ALA 39 Cb 0.55 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3h4k h ALA 39 CO 0.03 0.67 -0.33 1.49 0.00 0.00 0.00 179.25 181.12 3h4k h GLU 40 N 0.37 0.56 0.00 0.00 4.81 -0.99 -2.88 114.58 116.45 3h4k h GLU 40 Ca 0.02 -0.35 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 3h4k h GLU 40 Cb 1.02 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.43 3h4k h GLU 40 CO 0.09 0.95 0.00 0.00 -0.73 0.00 0.00 179.01 179.33 3h4k n ALA 41 N -2.50 2.61 -2.38 2.92 0.00 -0.11 -4.90 120.51 116.16 3h4k n ALA 41 Ca -0.06 -0.17 -0.20 0.00 0.00 0.00 0.00 53.44 53.01 3h4k n ALA 41 Cb 0.49 -1.45 -0.01 0.00 0.00 0.00 0.00 19.45 18.48 3h4k n ALA 41 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3h4k n LYS 42 N -0.95 -1.73 -2.97 0.00 5.02 -0.80 -4.96 118.16 111.77 3h4k n LYS 42 Ca 0.21 0.98 -0.43 0.00 -2.02 0.00 0.00 58.31 57.05 3h4k n LYS 42 Cb 0.09 -5.63 -0.05 0.00 -0.02 0.00 0.00 35.03 29.42 3h4k n LYS 42 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3h4k s ILE 43 N -2.99 4.68 0.34 -0.18 -1.09 0.84 -5.00 121.20 117.79 3h4k s ILE 43 Ca 0.00 0.51 -0.25 0.00 -2.23 0.00 0.00 60.65 58.68 3h4k s ILE 43 Cb 0.00 -4.29 -0.10 0.00 -1.58 0.00 0.00 42.46 36.49 3h4k s ILE 43 CO 0.00 -0.65 0.97 -0.54 -1.23 0.00 0.00 174.94 173.49 3h4k s LYS 44 N 3.23 4.48 0.11 2.79 1.02 -1.26 -4.53 119.74 125.58 3h4k s LYS 44 Ca 0.30 1.36 -0.21 0.00 0.02 0.00 0.00 55.97 57.43 3h4k s LYS 44 Cb -0.12 -2.72 0.06 0.00 -0.52 0.00 0.00 37.83 34.53 3h4k s LYS 44 CO 0.21 0.18 0.53 -3.38 -0.92 0.00 0.00 175.35 171.97 3h4k s HIS 45 N -1.66 -0.42 0.23 3.18 -3.43 -1.25 -3.56 115.29 108.39 3h4k s HIS 45 Ca 0.52 0.28 -0.21 0.00 -0.80 0.00 0.00 55.06 54.86 3h4k s HIS 45 Cb -0.19 0.42 -0.08 0.00 -1.43 0.00 0.00 32.58 31.29 3h4k s HIS 45 CO 0.24 -0.75 0.76 0.00 -2.00 0.00 0.00 174.74 172.99 3h4k s ALA 46 N -3.32 3.39 -0.12 -1.38 0.00 -0.25 -4.58 121.76 115.50 3h4k s ALA 46 Ca -0.01 0.23 0.02 0.00 0.00 0.00 0.00 51.96 52.20 3h4k s ALA 46 Cb -0.00 -2.88 0.01 0.00 0.00 0.00 0.00 23.12 20.25 3h4k s ALA 46 CO -0.09 0.30 -0.18 0.99 0.00 0.00 0.00 175.76 176.79 3h4k s THR 47 N -1.51 1.73 -0.35 0.00 2.01 -1.26 -0.25 115.64 116.00 3h4k s THR 47 Ca 0.44 -0.78 -0.02 0.00 0.31 0.00 0.00 61.69 61.64 3h4k s THR 47 Cb -0.17 -1.55 0.08 0.00 0.01 0.00 0.00 72.50 70.86 3h4k s THR 47 CO 0.22 0.49 0.09 -0.63 -0.69 0.00 0.00 174.62 174.09 3h4k s ILE 48 N 0.93 3.06 -0.52 1.82 -1.09 -0.15 -4.98 121.20 120.27 3h4k s ILE 48 Ca -0.06 -1.75 -0.28 0.00 -2.23 0.00 0.00 60.65 56.32 3h4k s ILE 48 Cb -0.15 -2.95 0.03 0.00 -1.58 0.00 0.00 42.46 37.81 3h4k s ILE 48 CO -0.02 -0.40 1.14 -1.61 -1.23 0.00 0.00 174.94 172.82 3h4k s GLU 49 N 1.18 3.60 0.31 2.79 0.41 -1.26 -0.39 118.70 125.33 3h4k s GLU 49 Ca 0.02 0.36 0.14 0.00 -0.41 0.00 0.00 54.97 55.08 3h4k s GLU 49 Cb -0.21 -3.96 0.44 0.00 -1.78 0.00 0.00 34.13 28.62 3h4k s GLU 49 CO -0.03 -1.50 1.63 -0.07 -0.49 0.00 0.00 175.26 174.80 3h4k h LEU 50 N 11.46 0.00 0.00 1.80 3.38 -0.54 -2.73 115.31 128.68 3h4k h LEU 50 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3h4k h LEU 50 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 3h4k h LEU 50 CO 1.14 0.53 0.00 -0.90 0.09 0.00 0.00 178.44 179.31 3h4k n ASP 51 N -3.62 0.00 -0.85 -0.43 5.75 -1.26 -2.36 116.55 113.77 3h4k n ASP 51 Ca -0.00 0.14 0.12 0.00 -0.01 0.00 0.00 54.79 55.03 3h4k n ASP 51 Cb 0.60 -0.36 0.26 0.00 -1.03 0.00 0.00 41.12 40.59 3h4k n ASP 51 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3h4k n GLN 52 N -1.36 2.14 -4.56 0.11 6.02 -1.03 -4.93 117.38 113.76 3h4k n GLN 52 Ca 0.10 -1.69 -0.29 0.00 -0.01 0.00 0.00 57.00 55.10 3h4k n GLN 52 Cb 0.23 -1.47 -0.14 0.00 1.02 0.00 0.00 30.24 29.89 3h4k n GLN 52 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3h4k s LEU 53 N -1.79 2.27 0.12 1.08 1.43 -1.00 -5.05 118.68 115.73 3h4k s LEU 53 Ca 0.34 -0.69 -0.12 0.00 -1.03 0.00 0.00 54.13 52.62 3h4k s LEU 53 Cb 0.21 -1.24 -0.10 0.00 0.03 0.00 0.00 46.19 45.09 3h4k s LEU 53 CO 0.31 0.20 1.38 0.77 0.23 0.00 0.00 176.35 179.24 3h4k h SER 54 N 4.20 0.95 -0.39 2.29 4.64 -1.92 -3.06 113.55 120.25 3h4k h SER 54 Ca -0.49 -0.55 -0.06 0.00 -0.47 0.00 0.00 61.79 60.21 3h4k h SER 54 Cb 1.16 -0.27 -0.04 0.00 -0.31 0.00 0.00 62.40 62.94 3h4k h SER 54 CO 0.41 1.32 0.08 -0.46 -0.87 0.00 0.00 176.83 177.31 3h4k n ASN 55 N -4.03 3.76 -0.29 4.97 6.94 -1.26 -4.46 115.26 120.89 3h4k n ASN 55 Ca -0.05 -2.64 -0.02 0.00 -0.02 0.00 0.00 54.58 51.85 3h4k n ASN 55 Cb 0.64 -0.63 0.15 0.00 -2.36 0.00 0.00 39.78 37.58 3h4k n ASN 55 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 3h4k h GLY 56 N 3.97 1.24 1.49 4.83 0.00 -1.68 -1.80 103.07 111.11 3h4k h GLY 56 Ca 0.08 -0.52 -0.10 0.00 0.00 0.00 0.00 47.33 46.79 3h4k h GLY 56 CO 0.37 0.50 -0.23 1.76 0.00 0.00 0.00 176.54 178.94 3h4k h SER 57 N 1.17 0.59 -0.04 0.19 0.02 -1.82 -2.82 113.55 110.84 3h4k h SER 57 Ca 0.30 -0.20 -0.13 0.00 -0.84 0.00 0.00 61.79 60.92 3h4k h SER 57 Cb -0.04 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 3h4k h SER 57 CO -0.06 0.82 -0.41 0.00 -1.14 0.00 0.00 176.83 176.05 3h4k h ALA 58 N 1.23 0.84 -0.70 3.77 0.00 -1.79 -3.22 119.26 119.39 3h4k h ALA 58 Ca 0.08 -0.44 -0.07 0.00 0.00 0.00 0.00 54.91 54.47 3h4k h ALA 58 Cb 0.68 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3h4k h ALA 58 CO 0.05 0.65 0.15 0.82 0.00 0.00 0.00 179.25 180.92 3h4k h ILE 59 N 0.47 1.26 -0.94 0.00 2.04 -1.18 -2.73 117.51 116.44 3h4k h ILE 59 Ca 0.04 -1.00 0.06 0.00 1.00 0.00 0.00 64.86 64.96 3h4k h ILE 59 Cb 0.91 0.57 -0.06 0.00 -0.74 0.00 0.00 36.82 37.50 3h4k h ILE 59 CO 0.08 0.38 0.60 1.56 0.00 0.00 0.00 178.15 180.77 3h4k h GLN 60 N 1.06 1.06 -0.09 2.37 4.20 -1.51 0.19 115.11 122.39 3h4k h GLN 60 Ca 0.22 -0.06 -0.14 0.00 0.06 0.00 0.00 58.65 58.73 3h4k h GLN 60 Cb 0.40 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 3h4k h GLN 60 CO 0.01 0.70 -0.55 0.87 -0.67 0.00 0.00 178.83 179.19 3h4k h LYS 61 N 1.09 0.26 0.00 1.46 1.57 -1.59 -2.98 116.57 116.37 3h4k h LYS 61 Ca 0.40 -0.16 -0.10 0.00 -1.87 0.00 0.00 60.65 58.92 3h4k h LYS 61 Cb 0.15 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 3h4k h LYS 61 CO -0.17 0.74 -0.48 0.00 -0.57 0.00 0.00 179.45 178.98 3h4k h LEU 63 N 0.00 0.00 -1.57 0.00 3.38 -0.49 -2.77 115.31 113.86 3h4k h LEU 63 Ca -0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3h4k h LEU 63 Cb 1.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 3h4k h LEU 63 CO 0.06 0.03 -0.23 0.00 0.09 0.00 0.00 178.44 178.39 3h4k h ALA 64 N 1.97 1.48 0.00 1.53 0.00 -1.56 -0.23 119.26 122.45 3h4k h ALA 64 Ca -0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3h4k h ALA 64 Cb 0.41 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3h4k h ALA 64 CO 0.00 0.28 0.00 0.77 0.00 0.00 0.00 179.25 180.31 3h4k h SER 65 N 0.00 0.00 0.00 0.00 0.02 -1.68 0.23 113.55 112.12 3h4k h SER 65 Ca -0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 3h4k h SER 65 Cb 0.44 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.96 3h4k h SER 65 CO 0.03 0.00 -1.89 0.49 -1.14 0.00 0.00 176.83 174.32 3h4k n PHE 66 N -3.05 0.00 -0.01 3.45 3.72 -0.70 -4.78 117.46 116.09 3h4k n PHE 66 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3h4k n PHE 66 Cb 0.29 -0.53 0.00 0.00 -0.94 0.00 0.00 39.48 38.30 3h4k n PHE 66 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3h4k n SER 67 N -2.27 0.00 0.00 4.37 3.41 -0.18 -4.48 113.62 114.46 3h4k n SER 67 Ca -0.12 -0.12 0.00 0.00 -0.26 0.00 0.00 58.87 58.38 3h4k n SER 67 Cb 0.66 0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 3h4k n SER 67 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3h4k n LYS 68 N -0.20 0.00 -4.29 4.33 5.02 0.80 -4.98 118.16 118.85 3h4k n LYS 68 Ca 0.00 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.03 3h4k n LYS 68 Cb 0.00 -1.97 -0.09 0.00 -0.02 0.00 0.00 35.03 32.96 3h4k n LYS 68 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3h4k s ILE 69 N -1.58 3.27 -0.56 -0.18 -4.36 -1.26 -4.87 121.20 111.66 3h4k s ILE 69 Ca 0.00 -1.70 0.06 0.00 -0.26 0.00 0.00 60.65 58.75 3h4k s ILE 69 Cb 0.00 -2.64 0.01 0.00 1.25 0.00 0.00 42.46 41.07 3h4k s ILE 69 CO 0.00 -0.16 0.52 -0.62 0.24 0.00 0.00 174.94 174.92 3h4k n GLU 70 N -0.15 1.82 -2.22 0.37 1.02 -1.26 -3.44 120.64 116.78 3h4k n GLU 70 Ca -0.10 -0.54 -0.26 0.00 -0.02 0.00 0.00 57.16 56.24 3h4k n GLU 70 Cb 0.56 -0.98 0.06 0.00 -0.02 0.00 0.00 31.44 31.07 3h4k n GLU 70 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3h4k s THR 71 N -0.86 2.40 0.13 2.62 -4.23 -1.26 -4.78 115.64 109.65 3h4k s THR 71 Ca 0.05 -0.25 0.11 0.00 -1.18 0.00 0.00 61.69 60.43 3h4k s THR 71 Cb 0.05 -3.04 -0.04 0.00 1.34 0.00 0.00 72.50 70.81 3h4k s THR 71 CO 0.13 -0.04 -0.27 0.68 -0.54 0.00 0.00 174.62 174.57 3h4k s VAL 72 N -3.22 2.27 0.40 2.29 -7.23 -1.26 -4.38 120.40 109.26 3h4k s VAL 72 Ca 0.60 -1.75 -0.14 0.00 -1.81 0.00 0.00 61.98 58.88 3h4k s VAL 72 Cb -0.11 -2.00 -0.08 0.00 0.56 0.00 0.00 36.38 34.75 3h4k s VAL 72 CO 0.45 0.10 0.81 -2.16 -0.31 0.00 0.00 175.10 173.98 3h4k s PRO 73 N -2.04 3.93 -0.17 4.82 0.04 -1.26 -4.71 135.00 135.60 3h4k s PRO 73 Ca 0.14 0.68 0.01 0.00 0.04 0.00 0.00 61.00 61.87 3h4k s PRO 73 Cb -0.10 -2.34 0.03 0.00 0.04 0.00 0.00 34.50 32.13 3h4k s PRO 73 CO 0.06 -0.01 -0.14 -0.65 0.04 0.00 0.00 177.00 176.31 3h4k s GLN 74 N -3.51 2.31 -0.21 4.56 -0.21 -0.92 -3.91 119.66 117.76 3h4k s GLN 74 Ca 0.55 -0.71 -0.10 0.00 0.02 0.00 0.00 55.36 55.11 3h4k s GLN 74 Cb -0.10 -2.29 -0.05 0.00 1.00 0.00 0.00 33.01 31.57 3h4k s GLN 74 CO 0.25 -0.30 0.15 1.41 -2.12 0.00 0.00 175.29 174.67 3h4k s MET 75 N 1.42 4.17 -0.04 2.91 1.75 -1.11 -1.80 119.30 126.60 3h4k s MET 75 Ca 0.03 -0.22 0.06 0.00 -1.25 0.00 0.00 55.69 54.31 3h4k s MET 75 Cb -0.14 -3.45 -0.02 0.00 2.84 0.00 0.00 34.83 34.06 3h4k s MET 75 CO -0.10 0.24 -0.22 -0.06 -0.65 0.00 0.00 175.02 174.23 3h4k s PHE 76 N 0.53 2.47 -0.24 4.11 0.40 -0.31 -1.79 117.98 123.15 3h4k s PHE 76 Ca 0.08 -0.40 0.01 0.00 -0.60 0.00 0.00 56.93 56.02 3h4k s PHE 76 Cb -0.12 -1.56 0.06 0.00 0.51 0.00 0.00 43.02 41.92 3h4k s PHE 76 CO -0.00 0.00 -0.04 0.08 0.70 0.00 0.00 175.22 175.96 3h4k s VAL 77 N -0.56 1.51 -1.27 -0.44 1.01 0.74 -1.78 120.40 119.62 3h4k s VAL 77 Ca 0.08 -1.28 -0.05 0.00 0.00 0.00 0.00 61.98 60.73 3h4k s VAL 77 Cb -0.11 -1.82 -0.01 0.00 0.00 0.00 0.00 36.38 34.44 3h4k s VAL 77 CO 0.00 -0.17 0.69 0.54 0.00 0.00 0.00 175.10 176.17 3h4k n ARG 78 N 4.67 -3.73 -0.83 2.72 1.74 0.21 -2.41 116.66 119.02 3h4k n ARG 78 Ca -0.10 0.58 0.00 0.00 -0.77 0.00 0.00 57.85 57.55 3h4k n ARG 78 Cb 0.44 -4.92 0.00 0.00 -1.02 0.00 0.00 32.46 26.95 3h4k n ARG 78 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h4k n GLY 79 N -1.63 0.58 2.97 -0.13 0.00 -1.01 -4.98 105.19 101.00 3h4k n GLY 79 Ca -0.24 -0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.53 3h4k n GLY 79 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h4k s LYS 80 N -0.22 1.21 0.18 1.61 2.20 -1.01 -4.87 119.74 118.84 3h4k s LYS 80 Ca 0.00 -0.28 -0.30 0.00 -0.36 0.00 0.00 55.97 55.03 3h4k s LYS 80 Cb 0.00 -1.08 -0.08 0.00 -1.51 0.00 0.00 37.83 35.15 3h4k s LYS 80 CO 0.00 0.01 1.32 0.12 -0.36 0.00 0.00 175.35 176.44 3h4k s PHE 81 N 0.64 3.26 -0.03 4.03 2.19 -1.26 -0.18 117.98 126.62 3h4k s PHE 81 Ca -0.11 1.18 0.06 0.00 0.33 0.00 0.00 56.93 58.39 3h4k s PHE 81 Cb -0.14 -3.61 -0.08 0.00 -1.31 0.00 0.00 43.02 37.88 3h4k s PHE 81 CO 0.02 -1.93 0.08 0.44 1.83 0.00 0.00 175.22 175.65 3h4k n ILE 82 N 2.89 0.20 0.00 3.12 -5.35 -0.74 -4.91 119.36 114.57 3h4k n ILE 82 Ca 0.07 -0.19 0.00 0.00 -0.27 0.00 0.00 62.75 62.36 3h4k n ILE 82 Cb 0.43 -0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.07 3h4k n ILE 82 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3h4k n GLY 83 N 2.40 2.55 0.74 3.28 0.00 -1.25 -4.87 105.19 108.04 3h4k n GLY 83 Ca -0.05 -1.12 -0.05 0.00 0.00 0.00 0.00 46.02 44.80 3h4k n GLY 83 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3h4k n ASP 84 N 0.00 0.22 -0.36 1.61 5.68 -1.26 -2.74 116.55 119.70 3h4k n ASP 84 Ca 0.00 -1.20 0.06 0.00 -0.50 0.00 0.00 54.79 53.15 3h4k n ASP 84 Cb 0.00 -0.13 0.23 0.00 -1.14 0.00 0.00 41.12 40.07 3h4k n ASP 84 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 3h4k h SER 85 N -0.15 0.95 -0.20 -1.12 4.64 -1.89 0.20 113.55 115.99 3h4k h SER 85 Ca -0.07 0.04 -0.12 0.00 -0.47 0.00 0.00 61.79 61.17 3h4k h SER 85 Cb 0.23 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 3h4k h SER 85 CO 0.07 0.53 -0.30 -0.61 -0.87 0.00 0.00 176.83 175.64 3h4k h GLN 86 N 1.04 0.70 0.21 4.77 4.15 -1.94 -2.57 115.11 121.48 3h4k h GLN 86 Ca 0.48 -0.32 -0.32 0.00 0.77 0.00 0.00 58.65 59.26 3h4k h GLN 86 Cb 0.41 -0.02 0.03 0.00 0.21 0.00 0.00 27.48 28.12 3h4k h GLN 86 CO -0.24 0.92 -1.40 1.15 -1.93 0.00 0.00 178.83 177.33 3h4k h THR 87 N 0.60 1.30 -0.48 2.39 2.02 -1.65 -2.44 112.91 114.66 3h4k h THR 87 Ca 0.07 -2.68 -0.03 0.00 0.77 0.00 0.00 66.41 64.54 3h4k h THR 87 Cb 0.82 2.95 -0.02 0.00 -1.74 0.00 0.00 68.15 70.15 3h4k h THR 87 CO 0.07 0.80 0.16 0.58 0.37 0.00 0.00 175.52 177.50 3h4k h VAL 88 N 0.17 1.22 0.00 3.16 2.07 -0.69 0.34 116.25 122.53 3h4k h VAL 88 Ca -0.23 -0.72 -0.06 0.00 0.82 0.00 0.00 66.70 66.51 3h4k h VAL 88 Cb 2.09 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 32.64 3h4k h VAL 88 CO 0.26 0.26 -0.28 -0.07 0.02 0.00 0.00 177.57 177.76 3h4k h LEU 89 N 0.64 0.00 -0.43 2.57 4.07 -1.56 -1.24 115.31 119.35 3h4k h LEU 89 Ca 0.16 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.94 3h4k h LEU 89 Cb 0.25 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.98 3h4k h LEU 89 CO -0.01 0.28 -0.64 0.50 -1.08 0.00 0.00 178.44 177.49 3h4k h LYS 90 N 0.00 0.54 -0.32 1.13 3.11 -0.89 -2.08 116.57 118.06 3h4k h LYS 90 Ca -0.00 -0.38 -0.17 0.00 -2.81 0.00 0.00 60.65 57.29 3h4k h LYS 90 Cb 0.68 0.06 -0.00 0.00 -1.00 0.00 0.00 32.23 31.97 3h4k h LYS 90 CO 0.04 1.00 -0.45 1.88 -2.81 0.00 0.00 179.45 179.11 3h4k h TYR 91 N 0.39 1.07 0.00 1.91 0.05 -0.65 -3.01 116.97 116.74 3h4k h TYR 91 Ca -0.01 -0.35 -0.02 0.00 0.05 0.00 0.00 58.73 58.39 3h4k h TYR 91 Cb 1.21 -0.21 -0.00 0.00 1.01 0.00 0.00 36.73 38.73 3h4k h TYR 91 CO 0.05 1.17 -0.10 -0.92 -1.05 0.00 0.00 178.16 177.31 3h4k h TYR 92 N 0.66 0.00 -0.18 4.88 3.20 -1.22 -0.64 116.97 123.68 3h4k h TYR 92 Ca 0.04 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.74 3h4k h TYR 92 Cb 1.05 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.32 3h4k h TYR 92 CO 0.07 0.10 -0.52 0.66 -1.64 0.00 0.00 178.16 176.83 3h4k h SER 93 N 0.00 0.76 -0.01 -2.11 4.64 -1.24 -3.13 113.55 112.47 3h4k h SER 93 Ca -0.00 -0.59 0.00 0.00 -0.47 0.00 0.00 61.79 60.73 3h4k h SER 93 Cb 0.26 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3h4k h SER 93 CO 0.01 1.22 0.00 0.59 -0.87 0.00 0.00 176.83 177.78 3h4k n ASN 94 N -4.15 0.58 -3.61 4.97 4.13 -1.10 -4.92 115.26 111.15 3h4k n ASN 94 Ca -0.07 -1.21 -0.23 0.00 1.68 0.00 0.00 54.58 54.75 3h4k n ASN 94 Cb 0.61 -0.00 0.07 0.00 -1.54 0.00 0.00 39.78 38.92 3h4k n ASN 94 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 3h4k n ASP 95 N -0.54 -4.82 -0.01 6.41 8.00 -1.00 -4.93 116.55 119.66 3h4k n ASP 95 Ca 0.22 -0.61 0.08 0.00 0.71 0.00 0.00 54.79 55.18 3h4k n ASP 95 Cb 0.20 -4.83 -0.11 0.00 -0.02 0.00 0.00 41.12 36.36 3h4k n ASP 95 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3h4k n GLU 96 N -4.72 0.86 -0.29 -1.24 1.02 -0.28 -4.63 120.64 111.37 3h4k n GLU 96 Ca -0.08 -0.11 -0.03 0.00 -0.02 0.00 0.00 57.16 56.93 3h4k n GLU 96 Cb 0.59 -1.33 0.14 0.00 -0.02 0.00 0.00 31.44 30.82 3h4k n GLU 96 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3h4k h LEU 97 N 0.00 1.04 -0.72 -4.62 5.85 -1.88 -2.52 115.31 112.46 3h4k h LEU 97 Ca 0.00 -0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.71 3h4k h LEU 97 Cb 0.62 -0.26 -0.06 0.00 0.37 0.00 0.00 40.66 41.33 3h4k h LEU 97 CO 0.00 0.82 0.40 0.00 -0.34 0.00 0.00 178.44 179.32 3h4k h ALA 98 N 1.35 0.98 -0.09 1.25 0.00 -1.90 -1.89 119.26 118.96 3h4k h ALA 98 Ca 0.30 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.11 3h4k h ALA 98 Cb -0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3h4k h ALA 98 CO -0.05 0.07 -0.49 0.78 0.00 0.00 0.00 179.25 179.56 3h4k h GLY 99 N 0.72 0.24 0.84 0.00 0.00 -1.76 -2.73 103.07 100.38 3h4k h GLY 99 Ca 0.33 -0.25 -0.08 0.00 0.00 0.00 0.00 47.33 47.32 3h4k h GLY 99 CO -0.20 0.23 -0.17 -2.22 0.00 0.00 0.00 176.54 174.17 3h4k h ILE 100 N 0.18 1.32 0.00 2.60 2.04 -1.08 -2.26 117.51 120.31 3h4k h ILE 100 Ca 0.01 -1.31 0.00 0.00 1.00 0.00 0.00 64.86 64.56 3h4k h ILE 100 Cb 0.93 1.70 0.00 0.00 -0.74 0.00 0.00 36.82 38.71 3h4k h ILE 100 CO 0.07 0.40 0.00 -0.37 0.00 0.00 0.00 178.15 178.26 3h4k h VAL 101 N 0.19 0.00 0.00 1.67 -1.51 -1.39 -2.89 116.25 112.32 3h4k h VAL 101 Ca 0.04 -0.52 0.00 0.00 -1.23 0.00 0.00 66.70 64.99 3h4k h VAL 101 Cb 0.71 1.44 0.00 0.00 -2.13 0.00 0.00 31.29 31.31 3h4k h VAL 101 CO 0.05 0.00 -0.74 -3.20 -1.23 0.00 0.00 177.57 172.45 3h4k n ASN 102 N -2.65 0.62 -4.66 4.19 5.15 -1.03 -4.92 115.26 111.97 3h4k n ASN 102 Ca 0.03 -0.22 -0.42 0.00 -0.60 0.00 0.00 54.58 53.36 3h4k n ASN 102 Cb 0.36 0.47 -0.03 0.00 -0.53 0.00 0.00 39.78 40.05 3h4k n ASN 102 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 3h4k s GLU 103 N -3.10 4.13 0.03 1.20 2.12 -0.86 -4.99 118.70 117.24 3h4k s GLU 103 Ca 0.07 2.17 -0.07 0.00 0.36 0.00 0.00 54.97 57.50 3h4k s GLU 103 Cb 0.15 -4.01 -0.00 0.00 0.26 0.00 0.00 34.13 30.54 3h4k s GLU 103 CO 0.75 -0.91 0.14 0.45 -0.54 0.00 0.00 175.26 175.15 3h4k s SER 104 N 3.55 0.11 0.21 -1.70 0.15 -1.26 -4.95 113.70 109.81 3h4k s SER 104 Ca 0.74 -0.43 0.13 0.00 0.70 0.00 0.00 55.95 57.09 3h4k s SER 104 Cb -0.33 0.25 -0.03 0.00 -1.71 0.00 0.00 66.02 64.19 3h4k s SER 104 CO 0.30 -0.51 1.33 0.50 1.20 0.00 0.00 173.24 176.06 3h4k h LYS 105 N 3.66 0.00 -5.71 5.44 3.64 -1.97 -3.47 116.57 118.17 3h4k h LYS 105 Ca -0.32 0.00 -0.61 0.00 -1.27 0.00 0.00 60.65 58.45 3h4k h LYS 105 Cb 1.19 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 32.91 3h4k h LYS 105 CO 0.48 0.62 -0.51 0.71 -2.27 0.00 0.00 179.45 178.48 3h4k s TYR 106 N -2.88 2.37 0.21 1.91 2.02 -1.26 -5.04 117.35 114.67 3h4k s TYR 106 Ca 0.02 -0.70 -0.03 0.00 -0.37 0.00 0.00 57.07 56.00 3h4k s TYR 106 Cb 0.08 -1.85 0.17 0.00 -0.40 0.00 0.00 41.96 39.96 3h4k s TYR 106 CO 0.77 0.21 1.57 -0.44 -1.57 0.00 0.00 175.55 176.10 3h4k h ASP 107 N 1.46 0.68 -4.76 2.29 3.32 -1.69 -3.46 116.42 114.25 3h4k h ASP 107 Ca -0.43 -0.30 -0.27 0.00 0.02 0.00 0.00 57.03 56.05 3h4k h ASP 107 Cb 1.26 -0.19 -0.21 0.00 0.22 0.00 0.00 39.33 40.41 3h4k h ASP 107 CO 0.73 0.99 -0.73 -0.31 -1.72 0.00 0.00 179.24 178.20 3h4k s TYR 108 N -4.28 0.67 0.24 4.55 2.02 -0.39 -4.98 117.35 115.18 3h4k s TYR 108 Ca -0.08 -0.50 0.10 0.00 -0.37 0.00 0.00 57.07 56.22 3h4k s TYR 108 Cb 0.12 -0.40 0.27 0.00 -0.40 0.00 0.00 41.96 41.54 3h4k s TYR 108 CO 0.83 -0.08 1.56 -0.44 -1.57 0.00 0.00 175.55 175.85 3h4k h ASP 109 N 4.50 0.00 -3.49 2.29 3.32 -1.19 -0.51 116.42 121.34 3h4k h ASP 109 Ca -0.36 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.47 3h4k h ASP 109 Cb 1.20 0.00 -0.30 0.00 0.22 0.00 0.00 39.33 40.45 3h4k h ASP 109 CO 0.41 0.67 -0.56 -0.22 -1.72 0.00 0.00 179.24 177.82 3h4k s LEU 110 N -7.41 0.80 -0.18 1.55 2.96 -0.75 -1.21 118.68 114.45 3h4k s LEU 110 Ca -0.01 0.35 -0.01 0.00 -0.22 0.00 0.00 54.13 54.24 3h4k s LEU 110 Cb 0.12 0.47 -0.00 0.00 0.50 0.00 0.00 46.19 47.28 3h4k s LEU 110 CO 0.77 -0.13 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.91 3h4k s ILE 111 N 0.96 2.79 -0.29 6.68 1.01 -0.52 -1.20 121.20 130.64 3h4k s ILE 111 Ca -0.07 -0.71 -0.09 0.00 0.00 0.00 0.00 60.65 59.77 3h4k s ILE 111 Cb -0.09 -2.21 -0.02 0.00 0.01 0.00 0.00 42.46 40.15 3h4k s ILE 111 CO -0.05 0.49 0.14 -0.69 0.00 0.00 0.00 174.94 174.83 3h4k s VAL 112 N 1.08 4.66 -0.52 2.92 1.01 0.75 -1.26 120.40 129.03 3h4k s VAL 112 Ca -0.00 -0.26 -0.18 0.00 0.00 0.00 0.00 61.98 61.54 3h4k s VAL 112 Cb -0.14 -3.30 0.07 0.00 0.00 0.00 0.00 36.38 33.01 3h4k s VAL 112 CO -0.03 0.16 0.61 -0.63 0.00 0.00 0.00 175.10 175.21 3h4k s ILE 113 N 1.64 4.92 0.00 2.22 1.01 -0.37 -0.33 121.20 130.29 3h4k s ILE 113 Ca 0.05 -0.72 0.00 0.00 0.00 0.00 0.00 60.65 59.98 3h4k s ILE 113 Cb -0.16 -4.33 0.00 0.00 0.01 0.00 0.00 42.46 37.98 3h4k s ILE 113 CO 0.06 -0.86 0.00 0.61 0.00 0.00 0.00 174.94 174.75 3h4k n GLY 114 N 5.21 2.75 2.72 6.18 0.00 0.15 -0.71 105.19 121.49 3h4k n GLY 114 Ca -0.08 -0.96 -0.41 0.00 0.00 0.00 0.00 46.02 44.57 3h4k n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4k n GLY 115 N 0.04 5.93 0.00 -0.02 0.00 -0.93 -4.12 105.19 106.10 3h4k n GLY 115 Ca 0.00 -2.54 0.00 0.00 0.00 0.00 0.00 46.02 43.48 3h4k n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4k n GLY 116 N -0.17 4.01 0.36 -0.02 0.00 -1.26 -2.66 105.19 105.45 3h4k n GLY 116 Ca 0.49 -1.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.42 3h4k n GLY 116 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3h4k h SER 117 N 0.00 -1.05 -0.04 1.61 0.02 -1.93 -0.97 113.55 111.18 3h4k h SER 117 Ca 0.00 0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 3h4k h SER 117 Cb 0.00 0.41 -0.00 0.00 0.14 0.00 0.00 62.40 62.95 3h4k h SER 117 CO 0.00 -0.42 -0.01 1.23 -1.14 0.00 0.00 176.83 176.48 3h4k h GLY 118 N -0.54 0.09 0.93 -3.77 0.00 -1.86 -2.59 103.07 95.33 3h4k h GLY 118 Ca 0.04 -0.07 0.03 0.00 0.00 0.00 0.00 47.33 47.33 3h4k h GLY 118 CO -0.25 0.07 0.61 -1.33 0.00 0.00 0.00 176.54 175.63 3h4k h GLY 119 N -0.28 1.33 1.59 4.60 0.00 -1.70 0.02 103.07 108.63 3h4k h GLY 119 Ca 0.01 -0.47 -0.18 0.00 0.00 0.00 0.00 47.33 46.69 3h4k h GLY 119 CO 0.00 0.42 -0.72 1.41 0.00 0.00 0.00 176.54 177.66 3h4k h LEU 120 N 1.20 0.48 -0.50 3.11 3.38 -1.24 -1.80 115.31 119.93 3h4k h LEU 120 Ca 0.36 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 3h4k h LEU 120 Cb -0.05 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3h4k h LEU 120 CO -0.10 1.05 0.08 0.00 0.09 0.00 0.00 178.44 179.56 3h4k h ALA 121 N 0.94 0.67 -0.04 1.53 0.00 -1.02 -1.95 119.26 119.40 3h4k h ALA 121 Ca -0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3h4k h ALA 121 Cb 1.29 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 3h4k h ALA 121 CO 0.12 0.40 0.00 0.00 0.00 0.00 0.00 179.25 179.77 3h4k h ALA 122 N 0.97 0.05 0.00 0.00 0.00 -1.01 -2.68 119.26 116.60 3h4k h ALA 122 Ca 0.15 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3h4k h ALA 122 Cb 0.39 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3h4k h ALA 122 CO 0.01 -0.28 -0.02 0.78 0.00 0.00 0.00 179.25 179.73 3h4k h GLY 123 N -0.22 -0.03 1.02 0.00 0.00 -1.31 -0.46 103.07 102.07 3h4k h GLY 123 Ca 0.01 0.03 -0.03 0.00 0.00 0.00 0.00 47.33 47.33 3h4k h GLY 123 CO 0.00 -0.03 0.32 0.50 0.00 0.00 0.00 176.54 177.34 3h4k h LYS 124 N -0.04 1.08 -0.47 4.80 1.57 -1.44 -2.19 116.57 119.87 3h4k h LYS 124 Ca 0.01 -0.18 -0.10 0.00 -1.87 0.00 0.00 60.65 58.52 3h4k h LYS 124 Cb 0.06 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 3h4k h LYS 124 CO -0.02 0.86 -0.08 1.49 -0.57 0.00 0.00 179.45 181.13 3h4k h GLU 125 N 1.04 0.89 -0.80 3.15 4.57 -1.34 -3.05 114.58 119.04 3h4k h GLU 125 Ca 0.25 -0.32 -0.02 0.00 -1.18 0.00 0.00 59.36 58.08 3h4k h GLU 125 Cb 0.17 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.66 3h4k h GLU 125 CO -0.03 0.97 0.42 0.00 -1.18 0.00 0.00 179.01 179.19 3h4k h ALA 126 N 0.89 1.23 -0.14 2.92 0.00 -0.90 -2.78 119.26 120.49 3h4k h ALA 126 Ca 0.12 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3h4k h ALA 126 Cb 0.62 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3h4k h ALA 126 CO 0.04 0.61 -0.17 0.00 0.00 0.00 0.00 179.25 179.72 3h4k h ALA 127 N 1.34 1.45 -0.93 0.00 0.00 -1.33 -2.91 119.26 116.88 3h4k h ALA 127 Ca 0.28 -0.24 0.16 0.00 0.00 0.00 0.00 54.91 55.12 3h4k h ALA 127 Cb 0.05 -0.09 -0.10 0.00 0.00 0.00 0.00 17.79 17.66 3h4k h ALA 127 CO -0.04 0.39 0.52 0.87 0.00 0.00 0.00 179.25 180.99 3h4k h LYS 128 N 0.22 0.69 -0.77 0.00 1.57 -1.39 -1.09 116.57 115.80 3h4k h LYS 128 Ca 0.04 -0.04 -0.16 0.00 -1.87 0.00 0.00 60.65 58.61 3h4k h LYS 128 Cb 0.44 -0.16 -0.10 0.00 0.08 0.00 0.00 32.23 32.50 3h4k h LYS 128 CO 0.03 0.46 0.21 0.66 -0.57 0.00 0.00 179.45 180.23 3h4k n TYR 129 N -4.81 2.12 -1.03 -1.35 4.01 -1.12 -3.90 117.16 111.09 3h4k n TYR 129 Ca 0.20 -1.01 -0.01 0.00 -0.16 0.00 0.00 57.90 56.92 3h4k n TYR 129 Cb 0.48 -0.60 -0.00 0.00 -0.31 0.00 0.00 39.34 38.90 3h4k n TYR 129 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3h4k n GLY 130 N 0.00 0.49 3.70 2.72 0.00 -0.41 -3.68 105.19 108.02 3h4k n GLY 130 Ca 0.34 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 3h4k n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4k s ALA 131 N -2.01 3.34 -0.19 4.61 0.00 -1.12 -4.60 121.76 121.80 3h4k s ALA 131 Ca 0.00 0.58 -0.29 0.00 0.00 0.00 0.00 51.96 52.25 3h4k s ALA 131 Cb 0.00 -3.42 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 3h4k s ALA 131 CO 0.00 -0.47 1.68 0.15 0.00 0.00 0.00 175.76 177.12 3h4k s LYS 132 N 1.51 3.80 -0.06 0.00 1.02 -1.26 -4.21 119.74 120.54 3h4k s LYS 132 Ca 0.53 1.79 0.05 0.00 0.02 0.00 0.00 55.97 58.36 3h4k s LYS 132 Cb -0.23 -4.06 -0.00 0.00 -0.52 0.00 0.00 37.83 33.01 3h4k s LYS 132 CO 0.25 -1.29 -0.21 0.99 -0.92 0.00 0.00 175.35 174.16 3h4k s THR 133 N 5.28 1.74 -0.09 2.17 2.01 -1.26 -0.63 115.64 124.86 3h4k s THR 133 Ca 0.75 -0.88 0.03 0.00 0.31 0.00 0.00 61.69 61.89 3h4k s THR 133 Cb -0.27 -1.49 -0.01 0.00 0.01 0.00 0.00 72.50 70.74 3h4k s THR 133 CO 0.30 0.49 -0.19 0.00 -0.69 0.00 0.00 174.62 174.53 3h4k s ALA 134 N 0.02 2.40 -0.19 7.40 0.00 -0.34 -1.68 121.76 129.37 3h4k s ALA 134 Ca -0.06 -0.96 -0.01 0.00 0.00 0.00 0.00 51.96 50.92 3h4k s ALA 134 Cb -0.13 -0.94 -0.00 0.00 0.00 0.00 0.00 23.12 22.04 3h4k s ALA 134 CO 0.04 0.34 -0.11 0.08 0.00 0.00 0.00 175.76 176.11 3h4k s VAL 135 N 0.07 2.87 -0.16 0.00 1.01 -0.22 -0.18 120.40 123.80 3h4k s VAL 135 Ca -0.08 -0.68 -0.07 0.00 0.00 0.00 0.00 61.98 61.16 3h4k s VAL 135 Cb -0.15 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 3h4k s VAL 135 CO 0.05 0.48 0.06 -0.76 0.00 0.00 0.00 175.10 174.93 3h4k s LEU 136 N 1.19 3.82 -0.03 3.92 1.43 0.55 -1.86 118.68 127.72 3h4k s LEU 136 Ca 0.02 0.12 -0.01 0.00 -1.03 0.00 0.00 54.13 53.23 3h4k s LEU 136 Cb -0.14 -1.95 0.02 0.00 0.03 0.00 0.00 46.19 44.15 3h4k s LEU 136 CO -0.04 0.22 0.05 -0.62 0.23 0.00 0.00 176.35 176.19 3h4k s ASP 137 N 0.06 -0.00 -0.04 2.29 2.15 -0.98 0.35 116.67 120.49 3h4k s ASP 137 Ca 0.05 0.10 -0.02 0.00 0.43 0.00 0.00 52.55 53.11 3h4k s ASP 137 Cb -0.12 0.03 0.02 0.00 -0.30 0.00 0.00 42.92 42.55 3h4k s ASP 137 CO 0.01 -0.09 0.10 -0.47 -0.17 0.00 0.00 175.17 174.55 3h4k s TYR 138 N 0.69 -0.10 -0.44 -5.34 5.04 -1.24 -2.39 117.35 113.57 3h4k s TYR 138 Ca -0.06 0.32 -0.08 0.00 -2.44 0.00 0.00 57.07 54.81 3h4k s TYR 138 Cb -0.08 -0.06 0.10 0.00 0.35 0.00 0.00 41.96 42.27 3h4k s TYR 138 CO -0.02 -0.10 0.28 0.08 -1.34 0.00 0.00 175.55 174.45 3h4k s VAL 139 N 0.67 3.98 0.16 3.14 1.01 -1.26 -5.01 120.40 123.09 3h4k s VAL 139 Ca -0.05 -1.72 -0.32 0.00 0.00 0.00 0.00 61.98 59.89 3h4k s VAL 139 Cb -0.07 -3.58 -0.10 0.00 0.00 0.00 0.00 36.38 32.63 3h4k s VAL 139 CO -0.03 -0.66 1.64 -0.70 0.00 0.00 0.00 175.10 175.35 3h4k s GLU 140 N 1.33 4.18 0.52 2.72 2.12 -1.26 -4.82 118.70 123.50 3h4k s GLU 140 Ca 0.05 2.44 -0.23 0.00 0.36 0.00 0.00 54.97 57.59 3h4k s GLU 140 Cb -0.24 -3.21 -0.06 0.00 0.26 0.00 0.00 34.13 30.88 3h4k s GLU 140 CO -0.01 -0.67 1.39 -2.14 -0.54 0.00 0.00 175.26 173.29 3h4k s PRO 141 N 1.42 3.26 0.80 4.30 0.02 -1.26 -4.93 135.00 138.60 3h4k s PRO 141 Ca 0.72 2.32 -0.11 0.00 0.02 0.00 0.00 61.00 63.95 3h4k s PRO 141 Cb -0.45 -2.36 0.07 0.00 0.02 0.00 0.00 34.50 31.78 3h4k s PRO 141 CO 0.32 -1.12 1.09 0.95 -0.33 0.00 0.00 177.00 177.91 3h4k s THR 142 N -1.26 3.21 0.43 0.99 -4.23 -0.89 -4.82 115.64 109.06 3h4k s THR 142 Ca 0.69 0.39 0.31 0.00 -1.18 0.00 0.00 61.69 61.90 3h4k s THR 142 Cb -0.42 -2.90 0.48 0.00 1.34 0.00 0.00 72.50 71.00 3h4k s THR 142 CO 0.51 -0.51 1.54 -2.65 -0.54 0.00 0.00 174.62 172.96 3h4k n PRO 143 N -3.58 -0.04 -0.17 3.99 -0.02 -1.26 0.10 135.00 134.02 3h4k n PRO 143 Ca 0.08 1.25 0.10 0.00 -2.02 0.00 0.00 63.50 62.92 3h4k n PRO 143 Cb 0.54 -2.43 0.19 0.00 -0.02 0.00 0.00 33.50 31.78 3h4k n PRO 143 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 3h4k n ILE 144 N -4.74 0.52 -0.02 4.25 -5.35 -1.26 -4.95 119.36 107.81 3h4k n ILE 144 Ca 0.39 -0.76 0.00 0.00 -0.27 0.00 0.00 62.75 62.11 3h4k n ILE 144 Cb 1.51 0.95 0.00 0.00 -1.74 0.00 0.00 39.64 40.36 3h4k n ILE 144 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3h4k n GLY 145 N 1.30 0.63 3.68 3.28 0.00 0.29 -5.03 105.19 109.34 3h4k n GLY 145 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3h4k n GLY 145 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3h4k n THR 146 N -2.00 0.47 -4.30 2.61 -1.04 -1.26 -4.65 114.28 104.10 3h4k n THR 146 Ca 0.00 -0.08 -0.16 0.00 -2.04 0.00 0.00 64.05 61.77 3h4k n THR 146 Cb 0.00 -2.20 -0.10 0.00 -1.82 0.00 0.00 70.33 66.21 3h4k n THR 146 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3h4k s THR 147 N 3.16 0.83 0.32 12.58 -1.32 -1.26 -2.10 115.64 127.85 3h4k s THR 147 Ca 0.83 -2.01 -0.07 0.00 -1.21 0.00 0.00 61.69 59.24 3h4k s THR 147 Cb -0.46 -2.35 0.01 0.00 -1.51 0.00 0.00 72.50 68.19 3h4k s THR 147 CO 0.38 -0.29 0.51 -1.66 -2.21 0.00 0.00 174.62 171.35 3h4k s TRP 148 N -3.56 0.78 0.00 9.09 -2.14 -1.26 -5.12 118.94 116.74 3h4k s TRP 148 Ca 0.29 -1.10 0.00 0.00 2.66 0.00 0.00 56.10 57.95 3h4k s TRP 148 Cb 0.06 0.09 0.00 0.00 -3.10 0.00 0.00 33.47 30.52 3h4k s TRP 148 CO 0.08 -1.15 0.00 0.41 -2.66 0.00 0.00 176.95 173.64 3h4k n GLY 149 N -0.51 -0.14 3.77 3.67 0.00 -1.26 -4.77 105.19 105.94 3h4k n GLY 149 Ca -0.01 -1.79 -0.39 0.00 0.00 0.00 0.00 46.02 43.83 3h4k n GLY 149 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h4k s LEU 150 N 0.00 4.23 0.00 0.99 2.96 -1.26 -4.43 118.68 121.17 3h4k s LEU 150 Ca 0.00 2.44 0.00 0.00 -0.22 0.00 0.00 54.13 56.35 3h4k s LEU 150 Cb 0.00 -3.94 0.00 0.00 0.50 0.00 0.00 46.19 42.75 3h4k s LEU 150 CO 0.00 -0.68 0.00 0.61 -1.32 0.00 0.00 176.35 174.96 3h4k n GLY 151 N 0.69 0.80 5.91 7.98 0.00 -1.09 -4.19 105.19 115.29 3h4k n GLY 151 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3h4k n GLY 151 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h4k n GLY 152 N 0.00 -1.75 0.19 -0.02 0.00 -1.12 -3.89 105.19 98.60 3h4k n GLY 152 Ca 0.00 -1.46 -0.14 0.00 0.00 0.00 0.00 46.02 44.42 3h4k n GLY 152 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3h4k h THR 153 N 0.00 0.75 -0.88 2.61 2.02 -1.94 -3.06 112.91 112.41 3h4k h THR 153 Ca 0.00 -0.48 0.08 0.00 0.77 0.00 0.00 66.41 66.78 3h4k h THR 153 Cb 0.00 1.00 -0.11 0.00 -1.74 0.00 0.00 68.15 67.31 3h4k h THR 153 CO 0.00 0.10 -0.52 0.00 0.37 0.00 0.00 175.52 175.46 3h4k h VAL 155 N -0.00 1.27 0.06 0.00 2.07 -1.69 -2.21 116.25 115.75 3h4k h VAL 155 Ca 0.14 -1.08 -0.32 0.00 0.82 0.00 0.00 66.70 66.26 3h4k h VAL 155 Cb 0.37 1.32 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 3h4k h VAL 155 CO -0.83 0.35 -1.79 0.59 0.02 0.00 0.00 177.57 175.91 3h4k n ASN 156 N -4.48 2.00 -1.10 0.57 3.02 -0.91 -4.29 115.26 110.07 3h4k n ASN 156 Ca -0.02 0.28 0.03 0.00 -0.03 0.00 0.00 54.58 54.84 3h4k n ASN 156 Cb 0.31 -0.87 0.04 0.00 -0.61 0.00 0.00 39.78 38.65 3h4k n ASN 156 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 3h4k n VAL 157 N -3.90 0.26 0.00 2.41 0.24 0.16 -4.75 118.33 112.75 3h4k n VAL 157 Ca -0.35 -0.97 0.00 0.00 -2.04 0.00 0.00 64.34 60.98 3h4k n VAL 157 Cb 0.89 0.72 0.00 0.00 -1.47 0.00 0.00 33.84 33.97 3h4k n VAL 157 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h4k n GLY 158 N 0.16 4.36 0.27 7.63 0.00 0.13 -4.71 105.19 113.03 3h4k n GLY 158 Ca 0.06 -0.56 0.05 0.00 0.00 0.00 0.00 46.02 45.57 3h4k n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4k h ILE 160 N 0.36 0.00 -0.10 0.00 1.08 -1.67 -1.08 117.51 116.09 3h4k h ILE 160 Ca 0.41 -0.16 -0.02 0.00 -0.39 0.00 0.00 64.86 64.69 3h4k h ILE 160 Cb 0.65 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.39 3h4k h ILE 160 CO -0.44 0.00 -0.05 1.55 -0.69 0.00 0.00 178.15 178.52 3h4k h PRO 161 N -0.74 0.15 -0.04 2.37 0.13 -1.74 -2.07 132.00 130.05 3h4k h PRO 161 Ca -0.06 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.05 3h4k h PRO 161 Cb 0.44 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.54 3h4k h PRO 161 CO 0.10 0.21 0.02 -0.22 -0.23 0.00 0.00 178.00 177.88 3h4k h LYS 162 N 0.14 0.06 -0.01 0.86 3.11 -1.31 -2.13 116.57 117.29 3h4k h LYS 162 Ca 0.03 -0.01 -0.14 0.00 -2.81 0.00 0.00 60.65 57.73 3h4k h LYS 162 Cb 0.19 -0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.39 3h4k h LYS 162 CO 0.01 0.12 -0.64 -0.22 -2.81 0.00 0.00 179.45 175.91 3h4k h LYS 163 N -0.02 0.04 -0.55 1.90 3.64 -0.90 -0.99 116.57 119.67 3h4k h LYS 163 Ca 0.01 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.28 3h4k h LYS 163 Cb 0.08 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 3h4k h LYS 163 CO -0.00 0.67 -0.01 -0.07 -2.27 0.00 0.00 179.45 177.77 3h4k h LEU 164 N 0.03 0.97 -0.67 5.20 3.38 -1.34 0.97 115.31 123.84 3h4k h LEU 164 Ca -0.01 -0.31 -0.12 0.00 0.09 0.00 0.00 57.88 57.54 3h4k h LEU 164 Cb 1.14 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 3h4k h LEU 164 CO 0.09 1.04 -0.55 0.24 0.09 0.00 0.00 178.44 179.35 3h4k h MET 165 N 0.87 0.00 -0.45 1.13 2.86 -1.26 -1.55 114.93 116.52 3h4k h MET 165 Ca 0.16 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.67 3h4k h MET 165 Cb 0.55 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 3h4k h MET 165 CO 0.03 0.55 -0.23 1.25 1.06 0.00 0.00 176.91 179.57 3h4k h HIS 166 N 0.00 1.08 -0.46 -0.22 -0.00 -0.93 -1.88 115.15 112.74 3h4k h HIS 166 Ca -0.01 -0.26 -0.06 0.00 -0.00 0.00 0.00 60.37 60.04 3h4k h HIS 166 Cb 1.12 -0.25 -0.02 0.00 -0.00 0.00 0.00 27.41 28.26 3h4k h HIS 166 CO 0.00 1.07 0.05 0.37 -0.00 0.00 0.00 177.93 179.41 3h4k h GLN 167 N 0.81 0.78 -0.69 5.26 5.75 -0.59 -0.33 115.11 126.10 3h4k h GLN 167 Ca 0.10 -0.22 0.05 0.00 -0.15 0.00 0.00 58.65 58.43 3h4k h GLN 167 Cb 0.79 -0.08 -0.04 0.00 1.07 0.00 0.00 27.48 29.22 3h4k h GLN 167 CO 0.07 0.81 0.45 0.00 -2.65 0.00 0.00 178.83 177.51 3h4k h ALA 168 N 0.94 1.68 -0.32 3.38 0.00 -1.21 -0.85 119.26 122.88 3h4k h ALA 168 Ca 0.14 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.86 3h4k h ALA 168 Cb 0.43 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3h4k h ALA 168 CO 0.01 0.22 -0.44 0.78 0.00 0.00 0.00 179.25 179.83 3h4k h GLY 169 N 0.75 0.90 1.65 0.00 0.00 -1.00 -3.21 103.07 102.16 3h4k h GLY 169 Ca 0.29 -0.96 -0.08 0.00 0.00 0.00 0.00 47.33 46.58 3h4k h GLY 169 CO -0.09 0.86 -0.21 1.41 0.00 0.00 0.00 176.54 178.52 3h4k h LEU 170 N 0.66 0.41 -1.91 3.11 3.38 -0.09 -2.81 115.31 118.06 3h4k h LEU 170 Ca 0.04 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 3h4k h LEU 170 Cb 1.02 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 3h4k h LEU 170 CO 0.10 0.63 -0.12 -0.07 0.09 0.00 0.00 178.44 179.07 3h4k h LEU 171 N 0.37 0.00 -0.51 1.67 3.38 -1.20 -1.18 115.31 117.85 3h4k h LEU 171 Ca 0.06 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.12 3h4k h LEU 171 Cb 0.58 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.26 3h4k h LEU 171 CO 0.04 0.12 0.12 -1.28 0.09 0.00 0.00 178.44 177.53 3h4k h SER 172 N 0.00 0.04 -0.25 -0.43 0.87 -1.56 0.14 113.55 112.36 3h4k h SER 172 Ca -0.00 0.09 -0.14 0.00 -1.23 0.00 0.00 61.79 60.51 3h4k h SER 172 Cb 0.33 0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.39 3h4k h SER 172 CO 0.02 0.05 -0.35 0.45 -0.53 0.00 0.00 176.83 176.47 3h4k h HIS 173 N 0.26 0.92 -0.69 2.24 3.86 -1.36 -2.87 115.15 117.51 3h4k h HIS 173 Ca 0.26 -0.25 -0.03 0.00 -1.16 0.00 0.00 60.37 59.18 3h4k h HIS 173 Cb 0.34 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.57 3h4k h HIS 173 CO -0.22 1.01 0.29 0.00 0.86 0.00 0.00 177.93 179.88 3h4k h ALA 174 N 0.96 1.22 -0.54 2.45 0.00 -0.88 0.13 119.26 122.60 3h4k h ALA 174 Ca 0.06 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 3h4k h ALA 174 Cb 0.89 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 3h4k h ALA 174 CO 0.08 0.58 0.19 -0.07 0.00 0.00 0.00 179.25 180.03 3h4k h LEU 175 N 0.98 0.73 -0.19 0.00 3.38 -0.66 -1.36 115.31 118.19 3h4k h LEU 175 Ca 0.23 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 3h4k h LEU 175 Cb 0.16 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3h4k h LEU 175 CO -0.02 0.67 -0.29 -0.33 0.09 0.00 0.00 178.44 178.56 3h4k h GLU 176 N 0.78 0.54 -0.58 1.13 5.08 -1.17 -3.33 114.58 117.04 3h4k h GLU 176 Ca 0.18 -0.32 -0.05 0.00 -1.00 0.00 0.00 59.36 58.17 3h4k h GLU 176 Cb 0.19 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 3h4k h GLU 176 CO -0.01 0.93 0.18 -0.44 -1.00 0.00 0.00 179.01 178.66 3h4k h ASP 177 N 0.21 0.84 -1.22 1.42 5.19 -0.81 -3.12 116.42 118.93 3h4k h ASP 177 Ca 0.02 -0.21 0.35 0.00 -0.62 0.00 0.00 57.03 56.57 3h4k h ASP 177 Cb 0.87 -0.22 -0.08 0.00 0.18 0.00 0.00 39.33 40.08 3h4k h ASP 177 CO 0.07 0.82 0.83 0.00 -3.12 0.00 0.00 179.24 177.84 3h4k h ALA 178 N 1.05 2.79 -0.32 3.45 0.00 -1.35 -1.01 119.26 123.85 3h4k h ALA 178 Ca 0.19 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.99 3h4k h ALA 178 Cb 0.29 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3h4k h ALA 178 CO -0.01 -1.22 -0.31 1.49 0.00 0.00 0.00 179.25 179.20 3h4k h GLU 179 N 0.16 0.70 0.00 0.00 4.81 -1.67 0.09 114.58 118.66 3h4k h GLU 179 Ca 0.65 -0.32 -0.14 0.00 -0.13 0.00 0.00 59.36 59.42 3h4k h GLU 179 Cb 2.16 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 31.50 3h4k h GLU 179 CO -0.19 0.92 -0.66 0.45 -0.73 0.00 0.00 179.01 178.81 3h4k h HIS 180 N 0.59 0.00 -0.14 0.92 3.86 -1.36 -2.28 115.15 116.75 3h4k h HIS 180 Ca 0.07 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 3h4k h HIS 180 Cb 0.83 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.30 3h4k h HIS 180 CO 0.04 0.66 0.00 1.19 0.86 0.00 0.00 177.93 180.68 3h4k n PHE 181 N -3.61 0.17 0.00 2.45 3.72 -0.86 -4.88 117.46 114.45 3h4k n PHE 181 Ca -0.01 -0.09 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 3h4k n PHE 181 Cb 0.68 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.22 3h4k n PHE 181 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3h4k n GLY 182 N 1.10 1.29 3.79 1.37 0.00 -0.86 -5.04 105.19 106.85 3h4k n GLY 182 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 3h4k n GLY 182 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3h4k s TRP 183 N -2.00 3.66 -0.50 1.61 0.52 -0.02 -4.99 118.94 117.21 3h4k s TRP 183 Ca 0.00 0.96 -0.28 0.00 0.02 0.00 0.00 56.10 56.79 3h4k s TRP 183 Cb 0.00 -2.38 0.03 0.00 -1.15 0.00 0.00 33.47 29.97 3h4k s TRP 183 CO 0.00 0.48 1.12 -1.54 0.02 0.00 0.00 176.95 177.03 3h4k s SER 184 N -0.50 6.57 -0.22 2.95 1.04 -1.26 -4.01 113.70 118.28 3h4k s SER 184 Ca 0.24 0.33 -0.32 0.00 0.48 0.00 0.00 55.95 56.69 3h4k s SER 184 Cb -0.16 -2.54 0.16 0.00 0.10 0.00 0.00 66.02 63.58 3h4k s SER 184 CO 0.12 -1.27 1.22 -1.48 0.98 0.00 0.00 173.24 172.80 3h4k s LEU 185 N 4.46 -0.15 0.00 2.42 2.34 -1.26 -5.04 118.68 121.44 3h4k s LEU 185 Ca 0.45 0.11 0.00 0.00 0.06 0.00 0.00 54.13 54.76 3h4k s LEU 185 Cb -0.08 1.38 0.00 0.00 -0.56 0.00 0.00 46.19 46.94 3h4k s LEU 185 CO 0.30 -0.18 0.00 -0.67 -1.06 0.00 0.00 176.35 174.74 3h4k n ASP 186 N 0.35 0.00 0.08 1.48 4.64 -1.26 -4.84 116.55 117.00 3h4k n ASP 186 Ca -0.02 0.00 -0.03 0.00 -1.38 0.00 0.00 54.79 53.36 3h4k n ASP 186 Cb 0.58 0.00 -0.06 0.00 -1.04 0.00 0.00 41.12 40.60 3h4k n ASP 186 CO 0.00 0.00 0.00 -0.09 -0.82 0.00 0.00 177.20 176.29 3h4k h ARG 187 N 3.22 0.00 0.00 -0.67 9.65 -1.95 -2.94 114.38 121.69 3h4k h ARG 187 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3h4k h ARG 187 Cb 0.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 3h4k h ARG 187 CO 0.00 0.67 0.00 0.66 2.80 0.00 0.00 179.97 184.10 3h4k h SER 188 N 0.00 0.00 -0.54 -3.80 4.64 -1.98 -3.19 113.55 108.68 3h4k h SER 188 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 3h4k h SER 188 Cb 1.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.72 3h4k h SER 188 CO 0.09 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.34 3h4k n LYS 189 N -3.04 4.61 -5.15 4.77 4.76 -1.11 -4.90 118.16 118.10 3h4k n LYS 189 Ca 0.04 -2.93 -0.32 0.00 -2.87 0.00 0.00 58.31 52.23 3h4k n LYS 189 Cb 0.52 -2.21 -0.16 0.00 -1.84 0.00 0.00 35.03 31.34 3h4k n LYS 189 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3h4k s ILE 190 N -2.62 2.32 0.32 -0.18 1.01 -1.20 -5.09 121.20 115.76 3h4k s ILE 190 Ca 0.51 -0.97 0.05 0.00 0.00 0.00 0.00 60.65 60.24 3h4k s ILE 190 Cb 0.39 -1.87 -0.06 0.00 0.01 0.00 0.00 42.46 40.92 3h4k s ILE 190 CO 0.15 0.57 0.01 -0.94 0.00 0.00 0.00 174.94 174.72 3h4k s SER 191 N -0.18 2.70 -0.03 3.58 1.04 -1.26 -5.02 113.70 114.54 3h4k s SER 191 Ca -0.03 -1.30 0.02 0.00 0.48 0.00 0.00 55.95 55.12 3h4k s SER 191 Cb -0.14 -0.16 -0.03 0.00 0.10 0.00 0.00 66.02 65.80 3h4k s SER 191 CO 0.04 -0.48 -0.07 -2.28 0.98 0.00 0.00 173.24 171.42 3h4k s HIS 192 N -3.12 2.90 -0.33 5.02 2.46 -1.26 -5.10 115.29 115.87 3h4k s HIS 192 Ca 0.33 -0.02 -0.04 0.00 0.47 0.00 0.00 55.06 55.81 3h4k s HIS 192 Cb 0.07 -1.65 0.05 0.00 -0.13 0.00 0.00 32.58 30.92 3h4k s HIS 192 CO 0.14 0.35 0.07 1.21 -2.47 0.00 0.00 174.74 174.04 3h4k s ASN 193 N -1.12 5.09 0.27 9.88 3.84 -1.26 -5.00 114.94 126.64 3h4k s ASN 193 Ca 0.15 -1.33 -0.02 0.00 0.21 0.00 0.00 52.86 51.87 3h4k s ASN 193 Cb -0.11 -1.78 0.45 0.00 -0.55 0.00 0.00 41.25 39.25 3h4k s ASN 193 CO 0.05 -0.32 1.86 -0.25 -2.79 0.00 0.00 177.10 175.64 3h4k h TRP 194 N 8.09 1.16 -0.27 0.43 2.91 -1.98 -2.86 115.95 123.42 3h4k h TRP 194 Ca -0.21 0.03 -0.17 0.00 1.13 0.00 0.00 58.89 59.68 3h4k h TRP 194 Cb 1.07 -0.38 -0.00 0.00 -0.51 0.00 0.00 29.16 29.34 3h4k h TRP 194 CO 0.60 0.55 -0.50 0.77 -1.03 0.00 0.00 178.44 178.84 3h4k h SER 195 N 1.10 0.81 -0.43 2.65 0.02 -1.92 -0.39 113.55 115.38 3h4k h SER 195 Ca 0.45 -0.41 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3h4k h SER 195 Cb 0.28 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 3h4k h SER 195 CO -0.21 1.17 0.25 0.74 -1.14 0.00 0.00 176.83 177.64 3h4k h THR 196 N 0.58 1.14 0.12 -2.27 2.02 -1.96 -1.86 112.91 110.69 3h4k h THR 196 Ca 0.03 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 66.85 3h4k h THR 196 Cb 1.07 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 68.08 3h4k h THR 196 CO 0.10 0.15 -0.06 -0.03 0.37 0.00 0.00 175.52 176.05 3h4k h MET 197 N 0.56 -0.16 -0.36 6.66 1.85 -1.40 -2.54 114.93 119.54 3h4k h MET 197 Ca 0.15 0.01 0.07 0.00 -0.61 0.00 0.00 59.70 59.32 3h4k h MET 197 Cb 0.02 0.04 -0.07 0.00 0.43 0.00 0.00 31.60 32.02 3h4k h MET 197 CO -0.03 0.13 -0.08 0.28 -0.40 0.00 0.00 176.91 176.81 3h4k h VAL 198 N -0.45 0.65 -0.39 -5.77 2.07 -1.05 -0.09 116.25 111.22 3h4k h VAL 198 Ca -0.02 -0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.46 3h4k h VAL 198 Cb 0.36 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 3h4k h VAL 198 CO 0.03 0.00 0.06 -0.33 0.02 0.00 0.00 177.57 177.35 3h4k h GLU 199 N 0.01 0.59 -0.19 1.57 4.39 -1.36 0.34 114.58 119.93 3h4k h GLU 199 Ca 0.17 -0.11 -0.02 0.00 0.34 0.00 0.00 59.36 59.74 3h4k h GLU 199 Cb 0.26 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 3h4k h GLU 199 CO -0.36 0.57 0.02 0.78 -1.16 0.00 0.00 179.01 178.86 3h4k h GLY 200 N 0.83 0.34 0.97 -3.84 0.00 -0.97 -0.97 103.07 99.43 3h4k h GLY 200 Ca 0.13 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.21 3h4k h GLY 200 CO 0.00 0.22 0.22 -2.08 0.00 0.00 0.00 176.54 174.89 3h4k h VAL 201 N 0.10 1.19 0.00 4.60 2.07 -0.57 -2.36 116.25 121.28 3h4k h VAL 201 Ca 0.06 -0.56 -0.06 0.00 0.82 0.00 0.00 66.70 66.96 3h4k h VAL 201 Cb 0.33 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 3h4k h VAL 201 CO 0.01 0.21 -0.28 1.56 0.02 0.00 0.00 177.57 179.09 3h4k h GLN 202 N 0.61 0.00 -0.27 1.57 1.08 -0.35 -1.03 115.11 116.73 3h4k h GLN 202 Ca 0.16 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.18 3h4k h GLN 202 Cb 0.14 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.56 3h4k h GLN 202 CO -0.02 0.28 -0.54 1.03 -0.95 0.00 0.00 178.83 178.63 3h4k h SER 203 N 0.00 0.88 -0.02 1.46 0.87 -0.94 0.46 113.55 116.27 3h4k h SER 203 Ca -0.00 -0.47 -0.16 0.00 -1.23 0.00 0.00 61.79 59.93 3h4k h SER 203 Cb 0.71 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 3h4k h SER 203 CO 0.04 1.24 -0.51 -0.74 -0.53 0.00 0.00 176.83 176.33 3h4k h HIS 204 N 0.61 0.72 -0.70 2.24 -0.00 -1.18 -2.71 115.15 114.14 3h4k h HIS 204 Ca 0.02 -0.24 -0.06 0.00 -0.00 0.00 0.00 60.37 60.08 3h4k h HIS 204 Cb 1.13 -0.14 -0.03 0.00 -0.00 0.00 0.00 27.41 28.36 3h4k h HIS 204 CO 0.06 0.97 0.19 0.82 -0.00 0.00 0.00 177.93 179.98 3h4k h ILE 205 N 0.46 1.26 -1.00 6.26 2.04 -1.09 -2.63 117.51 122.81 3h4k h ILE 205 Ca 0.02 -0.93 0.02 0.00 1.00 0.00 0.00 64.86 64.97 3h4k h ILE 205 Cb 1.05 0.52 -0.05 0.00 -0.74 0.00 0.00 36.82 37.60 3h4k h ILE 205 CO 0.10 0.36 0.66 1.23 0.00 0.00 0.00 178.15 180.50 3h4k h GLY 206 N 1.08 1.42 1.80 5.37 0.00 -0.81 -0.17 103.07 111.76 3h4k h GLY 206 Ca 0.22 -0.52 -0.13 0.00 0.00 0.00 0.00 47.33 46.91 3h4k h GLY 206 CO -0.00 0.49 -0.53 1.48 0.00 0.00 0.00 176.54 177.98 3h4k h SER 207 N 1.33 0.23 -0.24 0.19 4.64 -1.29 -2.14 113.55 116.28 3h4k h SER 207 Ca 0.37 -0.12 -0.20 0.00 -0.47 0.00 0.00 61.79 61.38 3h4k h SER 207 Cb -0.11 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 61.92 3h4k h SER 207 CO -0.09 0.72 -0.62 -0.07 -0.87 0.00 0.00 176.83 175.89 3h4k h LEU 208 N 0.16 0.96 -0.50 5.97 3.38 -1.15 0.12 115.31 124.25 3h4k h LEU 208 Ca 0.00 -0.57 0.09 0.00 0.09 0.00 0.00 57.88 57.50 3h4k h LEU 208 Cb 0.99 -0.28 -0.08 0.00 0.09 0.00 0.00 40.66 41.38 3h4k h LEU 208 CO 0.08 1.36 0.05 0.78 0.09 0.00 0.00 178.44 180.79 3h4k h ASN 209 N 0.61 -0.12 0.27 -0.43 2.35 -0.84 -1.57 115.58 115.85 3h4k h ASN 209 Ca -0.01 0.11 -0.21 0.00 -0.55 0.00 0.00 56.30 55.64 3h4k h ASN 209 Cb 1.24 0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.78 3h4k h ASN 209 CO 0.13 -0.03 -0.85 -0.25 -1.65 0.00 0.00 177.43 174.78 3h4k h TRP 210 N 0.17 0.62 -0.85 1.19 7.01 -1.37 -3.07 115.95 119.65 3h4k h TRP 210 Ca 0.26 -0.31 0.07 0.00 2.11 0.00 0.00 58.89 61.02 3h4k h TRP 210 Cb 0.37 -0.08 -0.07 0.00 -2.10 0.00 0.00 29.16 27.28 3h4k h TRP 210 CO -0.28 1.11 0.52 0.78 -2.79 0.00 0.00 178.44 177.78 3h4k h GLY 211 N 1.20 1.30 1.42 2.65 0.00 -0.30 -1.12 103.07 108.21 3h4k h GLY 211 Ca -0.06 -0.36 -0.16 0.00 0.00 0.00 0.00 47.33 46.75 3h4k h GLY 211 CO 0.15 0.22 -0.51 -0.97 0.00 0.00 0.00 176.54 175.43 3h4k h TYR 212 N 0.91 0.77 -0.68 5.60 0.05 -1.33 -1.36 116.97 120.94 3h4k h TYR 212 Ca 0.38 -0.26 -0.06 0.00 0.05 0.00 0.00 58.73 58.85 3h4k h TYR 212 Cb 0.24 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 37.80 3h4k h TYR 212 CO -0.04 1.00 0.19 0.87 -1.05 0.00 0.00 178.16 179.13 3h4k h LYS 213 N 0.48 1.06 -0.24 4.88 1.57 -1.33 -1.68 116.57 121.31 3h4k h LYS 213 Ca 0.02 -0.23 -0.13 0.00 -1.87 0.00 0.00 60.65 58.44 3h4k h LYS 213 Cb 1.06 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.21 3h4k h LYS 213 CO 0.10 0.92 -0.37 0.28 -0.57 0.00 0.00 179.45 179.81 3h4k h VAL 214 N 1.01 1.31 -0.45 0.50 2.07 -1.18 -2.76 116.25 116.76 3h4k h VAL 214 Ca 0.22 -1.57 0.01 0.00 0.82 0.00 0.00 66.70 66.18 3h4k h VAL 214 Cb 0.32 1.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.81 3h4k h VAL 214 CO -0.00 0.49 0.28 0.00 0.02 0.00 0.00 177.57 178.36 3h4k h ALA 215 N 0.64 0.57 -0.66 1.67 0.00 -1.08 0.40 119.26 120.80 3h4k h ALA 215 Ca 0.02 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3h4k h ALA 215 Cb 0.96 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 3h4k h ALA 215 CO 0.08 -0.02 0.11 -0.07 0.00 0.00 0.00 179.25 179.36 3h4k h LEU 216 N 0.57 1.03 0.10 0.00 3.38 -1.37 -1.33 115.31 117.70 3h4k h LEU 216 Ca 0.17 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 3h4k h LEU 216 Cb -0.03 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.45 3h4k h LEU 216 CO -0.06 1.02 -0.05 -0.09 0.09 0.00 0.00 178.44 179.36 3h4k h ARG 217 N 1.01 -0.13 -0.09 1.13 2.43 -1.17 0.59 114.38 118.15 3h4k h ARG 217 Ca 0.20 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.34 3h4k h ARG 217 Cb 0.43 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 3h4k h ARG 217 CO 0.01 0.04 -0.11 -0.44 -1.51 0.00 0.00 179.97 177.96 3h4k h ASP 218 N -0.27 0.13 -0.30 -3.80 3.32 -0.82 -0.03 116.42 114.65 3h4k h ASP 218 Ca -0.01 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.02 3h4k h ASP 218 Cb 0.23 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.74 3h4k h ASP 218 CO 0.02 0.26 0.00 0.59 -1.72 0.00 0.00 179.24 178.39 3h4k n ASN 219 N -4.34 1.69 -3.45 6.45 4.13 -0.51 -4.94 115.26 114.29 3h4k n ASN 219 Ca -0.01 -1.96 -0.24 0.00 1.68 0.00 0.00 54.58 54.05 3h4k n ASN 219 Cb 0.22 -0.20 0.05 0.00 -1.54 0.00 0.00 39.78 38.32 3h4k n ASN 219 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3h4k n GLN 220 N 0.41 -6.40 -3.66 3.52 3.00 -0.02 -4.84 117.38 109.39 3h4k n GLN 220 Ca 0.11 0.80 -0.36 0.00 -0.01 0.00 0.00 57.00 57.55 3h4k n GLN 220 Cb 0.27 -5.76 -0.09 0.00 0.00 0.00 0.00 30.24 24.67 3h4k n GLN 220 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 3h4k s VAL 221 N -3.25 5.36 -0.21 5.09 1.01 0.20 -4.71 120.40 123.88 3h4k s VAL 221 Ca 0.50 0.24 -0.29 0.00 0.00 0.00 0.00 61.98 62.43 3h4k s VAL 221 Cb -0.23 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 3h4k s VAL 221 CO 0.62 0.37 1.59 -0.89 0.00 0.00 0.00 175.10 176.79 3h4k s THR 222 N 0.82 3.73 -0.26 3.92 2.01 -0.68 -4.19 115.64 120.99 3h4k s THR 222 Ca 0.09 0.83 -0.11 0.00 0.31 0.00 0.00 61.69 62.82 3h4k s THR 222 Cb -0.13 -3.73 -0.05 0.00 0.01 0.00 0.00 72.50 68.60 3h4k s THR 222 CO 0.03 -0.29 0.18 -0.47 -0.69 0.00 0.00 174.62 173.37 3h4k s TYR 223 N 5.04 3.28 -0.16 4.92 5.04 -1.26 -1.05 117.35 133.15 3h4k s TYR 223 Ca 0.70 0.19 0.01 0.00 -2.44 0.00 0.00 57.07 55.53 3h4k s TYR 223 Cb -0.25 -2.32 0.01 0.00 0.35 0.00 0.00 41.96 39.75 3h4k s TYR 223 CO 0.28 -0.03 -0.20 -0.51 -1.34 0.00 0.00 175.55 173.75 3h4k s LEU 224 N 1.36 2.19 -1.27 6.97 1.43 -0.78 -5.00 118.68 123.59 3h4k s LEU 224 Ca 0.07 -0.60 -0.17 0.00 -1.03 0.00 0.00 54.13 52.41 3h4k s LEU 224 Cb -0.15 -1.48 0.10 0.00 0.03 0.00 0.00 46.19 44.70 3h4k s LEU 224 CO 0.07 0.05 1.64 0.21 0.23 0.00 0.00 176.35 178.55 3h4k s ASN 225 N 1.01 6.92 0.08 2.29 2.47 -1.26 -2.33 114.94 124.12 3h4k s ASN 225 Ca -0.02 -2.64 -0.10 0.00 0.42 0.00 0.00 52.86 50.53 3h4k s ASN 225 Cb -0.15 -2.52 0.00 0.00 -1.45 0.00 0.00 41.25 37.14 3h4k s ASN 225 CO -0.06 -1.03 0.22 0.00 -3.72 0.00 0.00 177.10 172.51 3h4k s ALA 226 N 3.34 -0.35 -0.28 1.71 0.00 -1.01 -4.32 121.76 120.85 3h4k s ALA 226 Ca 0.50 -0.45 -0.20 0.00 0.00 0.00 0.00 51.96 51.82 3h4k s ALA 226 Cb 0.02 0.44 -0.02 0.00 0.00 0.00 0.00 23.12 23.56 3h4k s ALA 226 CO 0.05 -0.48 0.60 0.21 0.00 0.00 0.00 175.76 176.15 3h4k s LYS 227 N -3.46 3.99 0.24 0.00 2.20 -0.41 -3.63 119.74 118.67 3h4k s LYS 227 Ca 0.02 0.36 -0.10 0.00 -0.36 0.00 0.00 55.97 55.89 3h4k s LYS 227 Cb 0.03 -3.69 -0.07 0.00 -1.51 0.00 0.00 37.83 32.58 3h4k s LYS 227 CO -0.09 -0.48 0.56 0.20 -0.36 0.00 0.00 175.35 175.18 3h4k s GLY 228 N 1.58 2.26 -0.16 5.54 0.00 -1.26 -1.54 107.32 113.73 3h4k s GLY 228 Ca 0.24 -0.27 -0.04 0.00 0.00 0.00 0.00 44.72 44.65 3h4k s GLY 228 CO 0.10 -0.13 0.27 -1.60 0.00 0.00 0.00 173.10 171.75 3h4k s ARG 229 N -2.88 0.18 -0.51 2.90 3.52 0.16 -4.71 118.95 117.61 3h4k s ARG 229 Ca 0.48 0.62 -0.28 0.00 -0.13 0.00 0.00 55.73 56.42 3h4k s ARG 229 Cb -0.11 -0.31 0.02 0.00 -1.56 0.00 0.00 34.95 32.98 3h4k s ARG 229 CO 0.22 -0.40 1.37 -1.17 -0.81 0.00 0.00 175.30 174.51 3h4k s LEU 230 N 2.42 3.48 -0.02 -0.88 2.96 -0.64 0.66 118.68 126.66 3h4k s LEU 230 Ca 0.03 0.45 0.21 0.00 -0.22 0.00 0.00 54.13 54.60 3h4k s LEU 230 Cb -0.13 -3.25 -0.28 0.00 0.50 0.00 0.00 46.19 43.03 3h4k s LEU 230 CO -0.10 -1.57 0.50 2.30 -1.32 0.00 0.00 176.35 176.16 3h4k n ILE 231 N 6.92 0.32 -3.72 6.68 -5.35 -0.88 -3.01 119.36 120.32 3h4k n ILE 231 Ca 0.13 -0.57 -0.10 0.00 -0.27 0.00 0.00 62.75 61.95 3h4k n ILE 231 Cb 0.49 -0.14 -0.05 0.00 -1.74 0.00 0.00 39.64 38.20 3h4k n ILE 231 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3h4k s SER 232 N -4.81 -0.15 0.47 7.28 1.04 -1.16 -4.70 113.70 111.67 3h4k s SER 232 Ca -0.07 -0.45 0.30 0.00 0.48 0.00 0.00 55.95 56.21 3h4k s SER 232 Cb 0.12 0.46 1.39 0.00 0.10 0.00 0.00 66.02 68.09 3h4k s SER 232 CO 0.88 -0.87 1.74 -0.65 0.98 0.00 0.00 173.24 175.32 3h4k h PRO 233 N 2.42 0.15 -0.03 4.02 0.11 -1.94 -0.48 132.00 136.26 3h4k h PRO 233 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3h4k h PRO 233 Cb 1.24 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3h4k h PRO 233 CO 0.47 0.10 0.00 0.72 -0.21 0.00 0.00 178.00 179.08 3h4k n HIS 234 N -4.41 0.03 -4.69 0.65 8.25 -1.26 -4.81 115.22 108.97 3h4k n HIS 234 Ca 0.29 -0.08 -0.33 0.00 -0.26 0.00 0.00 57.72 57.34 3h4k n HIS 234 Cb 1.22 -0.01 -0.14 0.00 1.12 0.00 0.00 29.99 32.19 3h4k n HIS 234 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 3h4k s GLU 235 N -0.48 3.44 -0.16 -0.41 2.02 -0.19 -1.69 118.70 121.22 3h4k s GLU 235 Ca 0.06 -0.65 0.01 0.00 0.02 0.00 0.00 54.97 54.40 3h4k s GLU 235 Cb 0.04 -2.69 0.02 0.00 0.10 0.00 0.00 34.13 31.60 3h4k s GLU 235 CO 0.06 0.21 -0.17 0.08 0.02 0.00 0.00 175.26 175.46 3h4k s VAL 236 N 0.38 1.82 -0.11 2.63 1.01 -0.25 -2.08 120.40 123.80 3h4k s VAL 236 Ca -0.09 -0.79 -0.24 0.00 0.00 0.00 0.00 61.98 60.85 3h4k s VAL 236 Cb -0.16 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 3h4k s VAL 236 CO 0.05 0.50 0.76 -1.58 0.00 0.00 0.00 175.10 174.83 3h4k s GLN 237 N 1.38 4.38 0.17 2.72 0.74 0.21 -1.37 119.66 127.89 3h4k s GLN 237 Ca 0.05 0.94 0.07 0.00 0.05 0.00 0.00 55.36 56.47 3h4k s GLN 237 Cb -0.13 -3.50 -0.04 0.00 1.10 0.00 0.00 33.01 30.44 3h4k s GLN 237 CO -0.12 -0.10 -0.00 0.96 -0.55 0.00 0.00 175.29 175.49 3h4k s ILE 238 N 1.34 3.75 -0.11 -2.34 -4.36 0.58 0.39 121.20 120.45 3h4k s ILE 238 Ca 0.38 -1.38 -0.03 0.00 -0.26 0.00 0.00 60.65 59.37 3h4k s ILE 238 Cb -0.17 -2.88 0.04 0.00 1.25 0.00 0.00 42.46 40.70 3h4k s ILE 238 CO 0.16 -0.09 0.04 -0.89 0.24 0.00 0.00 174.94 174.41 3h4k s THR 239 N -1.68 0.20 0.00 8.37 2.01 -0.59 -2.05 115.64 121.89 3h4k s THR 239 Ca 0.27 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.27 3h4k s THR 239 Cb -0.10 -0.55 0.00 0.00 0.01 0.00 0.00 72.50 71.87 3h4k s THR 239 CO 0.19 0.04 0.00 -0.90 -0.69 0.00 0.00 174.62 173.25 3h4k n ASP 240 N 5.19 0.00 0.23 3.53 5.68 -1.11 -1.29 116.55 128.78 3h4k n ASP 240 Ca -0.06 -0.83 0.06 0.00 -0.50 0.00 0.00 54.79 53.45 3h4k n ASP 240 Cb 0.49 0.00 0.53 0.00 -1.14 0.00 0.00 41.12 41.00 3h4k n ASP 240 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 3h4k h LYS 241 N 0.00 0.00 -0.58 0.11 2.10 -1.93 -2.47 116.57 113.81 3h4k h LYS 241 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3h4k h LYS 241 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 3h4k h LYS 241 CO 0.00 0.18 0.00 0.09 -2.00 0.00 0.00 179.45 177.72 3h4k n ASN 242 N -4.24 3.24 -1.40 7.07 5.03 -1.26 -4.92 115.26 118.78 3h4k n ASN 242 Ca -0.02 -2.14 -0.17 0.00 0.87 0.00 0.00 54.58 53.12 3h4k n ASN 242 Cb 0.25 -0.42 -0.06 0.00 -1.02 0.00 0.00 39.78 38.53 3h4k n ASN 242 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3h4k n GLN 243 N 0.96 -1.19 -2.25 3.52 1.13 -0.93 -4.98 117.38 113.64 3h4k n GLN 243 Ca 0.19 1.04 -0.42 0.00 -1.94 0.00 0.00 57.00 55.86 3h4k n GLN 243 Cb 0.56 -5.28 -0.03 0.00 0.11 0.00 0.00 30.24 25.60 3h4k n GLN 243 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 3h4k s LYS 244 N -3.68 4.30 -0.21 -1.09 -0.14 -1.26 -4.84 119.74 112.83 3h4k s LYS 244 Ca 0.00 1.94 -0.09 0.00 -1.36 0.00 0.00 55.97 56.47 3h4k s LYS 244 Cb 0.00 -3.51 -0.04 0.00 -1.68 0.00 0.00 37.83 32.60 3h4k s LYS 244 CO 0.00 -0.52 0.10 0.08 -0.76 0.00 0.00 175.35 174.25 3h4k s VAL 245 N 2.11 5.00 0.17 3.17 1.01 -1.26 -2.77 120.40 127.83 3h4k s VAL 245 Ca 0.63 0.05 -0.08 0.00 0.00 0.00 0.00 61.98 62.58 3h4k s VAL 245 Cb -0.31 -3.29 -0.01 0.00 0.00 0.00 0.00 36.38 32.76 3h4k s VAL 245 CO 0.27 0.41 0.27 -0.55 0.00 0.00 0.00 175.10 175.50 3h4k s SER 246 N 0.68 0.06 -0.10 3.32 0.15 -0.87 -5.00 113.70 111.93 3h4k s SER 246 Ca 0.05 -0.94 0.03 0.00 0.70 0.00 0.00 55.95 55.79 3h4k s SER 246 Cb -0.13 0.43 0.01 0.00 -1.71 0.00 0.00 66.02 64.62 3h4k s SER 246 CO 0.01 -0.90 -0.18 -0.89 1.20 0.00 0.00 173.24 172.49 3h4k s THR 247 N -3.99 1.66 0.08 6.45 2.01 -1.26 -0.31 115.64 120.29 3h4k s THR 247 Ca 0.20 -0.76 0.08 0.00 0.31 0.00 0.00 61.69 61.52 3h4k s THR 247 Cb 0.04 -1.48 -0.04 0.00 0.01 0.00 0.00 72.50 71.02 3h4k s THR 247 CO 0.02 0.47 -0.18 0.27 -0.69 0.00 0.00 174.62 174.51 3h4k s ILE 248 N 0.73 2.80 -0.03 1.82 -4.36 -0.47 -4.97 121.20 116.72 3h4k s ILE 248 Ca -0.11 -1.37 0.01 0.00 -0.26 0.00 0.00 60.65 58.92 3h4k s ILE 248 Cb -0.16 -2.24 -0.03 0.00 1.25 0.00 0.00 42.46 41.28 3h4k s ILE 248 CO 0.02 0.20 -0.04 0.42 0.24 0.00 0.00 174.94 175.78 3h4k s THR 249 N -1.05 3.86 -0.00 8.37 -4.23 -1.26 -1.09 115.64 120.24 3h4k s THR 249 Ca 0.16 -0.58 -0.02 0.00 -1.18 0.00 0.00 61.69 60.07 3h4k s THR 249 Cb -0.11 -2.65 -0.01 0.00 1.34 0.00 0.00 72.50 71.08 3h4k s THR 249 CO 0.08 0.48 0.04 -0.83 -0.54 0.00 0.00 174.62 173.85 3h4k s GLY 250 N -1.21 0.09 0.01 3.99 0.00 -0.68 -1.26 107.32 108.26 3h4k s GLY 250 Ca 0.16 -0.19 -0.25 0.00 0.00 0.00 0.00 44.72 44.43 3h4k s GLY 250 CO 0.06 -0.26 1.15 -0.57 0.00 0.00 0.00 173.10 173.48 3h4k h ASN 251 N 5.12 -0.59 -3.78 1.64 -0.73 -1.10 -3.42 115.58 112.71 3h4k h ASN 251 Ca -0.29 -0.06 -0.68 0.00 1.87 0.00 0.00 56.30 57.14 3h4k h ASN 251 Cb 1.20 0.15 -0.20 0.00 0.27 0.00 0.00 38.32 39.75 3h4k h ASN 251 CO 0.43 -0.22 -0.74 -0.54 -0.37 0.00 0.00 177.43 175.99 3h4k s LYS 252 N -4.63 2.45 -0.16 6.67 -0.14 -0.35 -4.86 119.74 118.72 3h4k s LYS 252 Ca -0.14 -0.76 0.01 0.00 -1.36 0.00 0.00 55.97 53.73 3h4k s LYS 252 Cb 0.02 -2.41 0.02 0.00 -1.68 0.00 0.00 37.83 33.77 3h4k s LYS 252 CO 0.47 0.60 -0.19 0.42 -0.76 0.00 0.00 175.35 175.88 3h4k s ILE 253 N -0.91 1.94 -0.26 2.17 -1.09 0.01 -1.44 121.20 121.62 3h4k s ILE 253 Ca 0.15 -0.88 -0.07 0.00 -2.23 0.00 0.00 60.65 57.62 3h4k s ILE 253 Cb -0.11 -1.75 -0.02 0.00 -1.58 0.00 0.00 42.46 39.01 3h4k s ILE 253 CO 0.05 0.52 0.06 -0.63 -1.23 0.00 0.00 174.94 173.72 3h4k s ILE 254 N 1.14 4.15 -0.29 2.92 1.01 -0.39 0.61 121.20 130.35 3h4k s ILE 254 Ca 0.00 -0.33 -0.21 0.00 0.00 0.00 0.00 60.65 60.11 3h4k s ILE 254 Cb -0.14 -2.99 -0.01 0.00 0.01 0.00 0.00 42.46 39.33 3h4k s ILE 254 CO -0.08 0.28 0.66 -0.76 0.00 0.00 0.00 174.94 175.03 3h4k s LEU 255 N 1.58 4.12 -0.36 2.97 1.43 0.22 -1.23 118.68 127.40 3h4k s LEU 255 Ca 0.05 0.54 0.13 0.00 -1.03 0.00 0.00 54.13 53.82 3h4k s LEU 255 Cb -0.16 -2.87 0.38 0.00 0.03 0.00 0.00 46.19 43.58 3h4k s LEU 255 CO 0.03 -0.47 0.83 0.00 0.23 0.00 0.00 176.35 176.96 3h4k n ALA 256 N 5.89 2.22 1.02 4.21 0.00 0.11 -1.64 120.51 132.32 3h4k n ALA 256 Ca -0.00 -3.17 0.12 0.00 0.00 0.00 0.00 53.44 50.39 3h4k n ALA 256 Cb 0.49 -0.95 0.26 0.00 0.00 0.00 0.00 19.45 19.25 3h4k n ALA 256 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3h4k n THR 257 N 0.17 0.00 -4.80 0.00 -2.24 -1.19 -4.17 114.28 102.05 3h4k n THR 257 Ca 0.19 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 3h4k n THR 257 Cb 0.71 0.26 0.00 0.00 -2.10 0.00 0.00 70.33 69.20 3h4k n THR 257 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h4k n GLY 258 N 1.49 0.41 3.39 3.38 0.00 -1.26 -4.95 105.19 107.64 3h4k n GLY 258 Ca 0.06 -0.93 -0.19 0.00 0.00 0.00 0.00 46.02 44.96 3h4k n GLY 258 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h4k s GLU 259 N 0.00 1.50 0.11 1.61 2.02 -1.26 -4.45 118.70 118.23 3h4k s GLU 259 Ca 0.00 -1.80 0.03 0.00 0.02 0.00 0.00 54.97 53.22 3h4k s GLU 259 Cb 0.00 -0.69 -0.04 0.00 0.10 0.00 0.00 34.13 33.50 3h4k s GLU 259 CO 0.00 -0.17 -0.09 1.03 0.02 0.00 0.00 175.26 176.05 3h4k s ARG 260 N -3.90 0.90 0.54 1.61 1.81 -0.57 -4.92 118.95 114.41 3h4k s ARG 260 Ca 0.34 -1.29 -0.21 0.00 -1.72 0.00 0.00 55.73 52.84 3h4k s ARG 260 Cb 0.07 -0.44 -0.05 0.00 -0.45 0.00 0.00 34.95 34.08 3h4k s ARG 260 CO 0.13 0.05 1.28 -2.14 -0.68 0.00 0.00 175.30 173.93 3h4k s PRO 261 N -3.39 3.25 0.42 3.54 0.02 -1.26 -0.68 135.00 136.91 3h4k s PRO 261 Ca 0.10 2.03 -0.14 0.00 0.02 0.00 0.00 61.00 63.02 3h4k s PRO 261 Cb 0.01 -2.22 -0.08 0.00 0.02 0.00 0.00 34.50 32.24 3h4k s PRO 261 CO -0.01 -1.04 0.83 0.15 -0.33 0.00 0.00 177.00 176.60 3h4k s LYS 262 N -2.95 3.89 -0.08 5.54 1.02 -0.45 -4.77 119.74 121.95 3h4k s LYS 262 Ca 0.71 0.68 0.04 0.00 0.02 0.00 0.00 55.97 57.42 3h4k s LYS 262 Cb -0.35 -2.31 -0.01 0.00 -0.52 0.00 0.00 37.83 34.63 3h4k s LYS 262 CO 0.41 -0.07 -0.21 0.71 -0.92 0.00 0.00 175.35 175.27 3h4k s TYR 263 N -2.36 2.56 0.51 3.18 2.02 -1.26 -4.54 117.35 117.45 3h4k s TYR 263 Ca 0.55 -0.68 -0.22 0.00 -0.37 0.00 0.00 57.07 56.35 3h4k s TYR 263 Cb -0.10 -1.66 -0.06 0.00 -0.40 0.00 0.00 41.96 39.74 3h4k s TYR 263 CO 0.28 -0.19 1.23 -1.25 -1.57 0.00 0.00 175.55 174.04 3h4k s PRO 264 N -0.08 3.43 -1.39 -1.71 0.04 -1.26 -4.90 135.00 129.13 3h4k s PRO 264 Ca -0.05 1.92 -0.16 0.00 0.04 0.00 0.00 61.00 62.75 3h4k s PRO 264 Cb -0.14 -2.27 0.05 0.00 0.04 0.00 0.00 34.50 32.18 3h4k s PRO 264 CO 0.04 -0.86 2.02 -1.91 0.04 0.00 0.00 177.00 176.33 3h4k n GLU 265 N -0.86 3.00 -4.10 4.56 4.07 -1.26 -4.88 120.64 121.17 3h4k n GLU 265 Ca 0.09 -2.89 -0.10 0.00 -0.06 0.00 0.00 57.16 54.20 3h4k n GLU 265 Cb 0.47 -3.38 -0.10 0.00 -0.06 0.00 0.00 31.44 28.37 3h4k n GLU 265 CO 0.00 0.00 0.00 0.96 -0.06 0.00 0.00 177.13 178.03 3h4k s ILE 266 N 3.63 0.48 0.27 6.31 -4.36 -1.26 -5.12 121.20 121.14 3h4k s ILE 266 Ca 0.50 -1.58 -0.29 0.00 -0.26 0.00 0.00 60.65 59.02 3h4k s ILE 266 Cb 0.10 -1.21 -0.10 0.00 1.25 0.00 0.00 42.46 42.50 3h4k s ILE 266 CO -0.02 -0.74 1.26 -2.84 0.24 0.00 0.00 174.94 172.85 3h4k s PRO 267 N -3.02 4.43 0.00 0.37 0.02 -1.26 -3.61 135.00 131.93 3h4k s PRO 267 Ca 0.02 2.07 0.00 0.00 0.02 0.00 0.00 61.00 63.11 3h4k s PRO 267 Cb 0.00 -3.14 0.00 0.00 0.02 0.00 0.00 34.50 31.38 3h4k s PRO 267 CO -0.04 -0.13 0.00 0.41 -0.33 0.00 0.00 177.00 176.91 3h4k n GLY 268 N 1.48 3.21 0.32 0.52 0.00 -1.26 -1.41 105.19 108.04 3h4k n GLY 268 Ca 0.02 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.90 3h4k n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4k h ALA 269 N 0.00 -0.60 -0.13 4.61 0.00 -1.84 0.26 119.26 121.55 3h4k h ALA 269 Ca 0.00 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 3h4k h ALA 269 Cb 0.00 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3h4k h ALA 269 CO 0.00 -0.87 -0.41 0.28 0.00 0.00 0.00 179.25 178.25 3h4k h VAL 270 N -0.61 1.31 0.06 0.00 2.07 -1.86 -1.83 116.25 115.40 3h4k h VAL 270 Ca -0.01 -1.52 -0.09 0.00 0.82 0.00 0.00 66.70 65.90 3h4k h VAL 270 Cb 0.56 1.66 0.01 0.00 -1.52 0.00 0.00 31.29 32.00 3h4k h VAL 270 CO -0.06 0.46 -0.38 -0.33 0.02 0.00 0.00 177.57 177.28 3h4k h GLU 271 N 0.24 0.15 -0.00 1.57 3.07 -1.92 -3.41 114.58 114.28 3h4k h GLU 271 Ca 0.02 -0.24 0.00 0.00 -0.50 0.00 0.00 59.36 58.64 3h4k h GLU 271 Cb 0.83 0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.82 3h4k h GLU 271 CO 0.07 1.10 -0.32 0.66 -1.40 0.00 0.00 179.01 179.12 3h4k n TYR 272 N -4.39 0.00 -4.09 4.33 0.53 0.89 -5.00 117.16 109.43 3h4k n TYR 272 Ca -0.12 0.00 -0.25 0.00 -1.02 0.00 0.00 57.90 56.51 3h4k n TYR 272 Cb 0.63 0.00 -0.05 0.00 -1.03 0.00 0.00 39.34 38.89 3h4k n TYR 272 CO 0.00 0.00 0.00 0.20 -1.02 0.00 0.00 176.86 176.04 3h4k s GLY 273 N -1.59 1.62 0.39 2.72 0.00 -0.69 -4.60 107.32 105.17 3h4k s GLY 273 Ca 0.05 -1.27 0.08 0.00 0.00 0.00 0.00 44.72 43.58 3h4k s GLY 273 CO 0.30 -1.29 0.09 -0.26 0.00 0.00 0.00 173.10 171.95 3h4k s ILE 274 N -1.86 2.33 0.17 0.90 -4.36 -0.02 -4.78 121.20 113.58 3h4k s ILE 274 Ca 0.32 -1.84 0.00 0.00 -0.26 0.00 0.00 60.65 58.86 3h4k s ILE 274 Cb -0.09 -2.94 -0.00 0.00 1.25 0.00 0.00 42.46 40.67 3h4k s ILE 274 CO 0.24 -0.06 0.00 0.35 0.24 0.00 0.00 174.94 175.71 3h4k n THR 275 N -1.10 0.00 0.28 8.37 -2.24 -1.26 -0.45 114.28 117.87 3h4k n THR 275 Ca -0.03 -0.80 0.13 0.00 -2.27 0.00 0.00 64.05 61.08 3h4k n THR 275 Cb 0.64 0.16 0.80 0.00 -2.10 0.00 0.00 70.33 69.83 3h4k n THR 275 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3h4k h SER 276 N 0.41 0.00 0.10 3.42 4.64 -1.94 -2.34 113.55 117.84 3h4k h SER 276 Ca -0.14 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.17 3h4k h SER 276 Cb 0.43 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3h4k h SER 276 CO 0.23 0.06 -0.07 0.44 -0.87 0.00 0.00 176.83 176.63 3h4k h ASP 277 N 0.00 0.00 0.00 4.97 5.19 -1.95 -3.13 116.42 121.49 3h4k h ASP 277 Ca -0.00 0.00 -0.37 0.00 -0.62 0.00 0.00 57.03 56.04 3h4k h ASP 277 Cb 0.16 0.00 -0.07 0.00 0.18 0.00 0.00 39.33 39.60 3h4k h ASP 277 CO 0.01 0.07 -2.38 0.47 -3.12 0.00 0.00 179.24 174.29 3h4k n ASP 278 N -4.15 0.13 -0.34 6.45 8.00 -0.91 -4.60 116.55 121.13 3h4k n ASP 278 Ca -0.03 -0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.44 3h4k n ASP 278 Cb 0.15 0.94 0.10 0.00 -0.02 0.00 0.00 41.12 42.29 3h4k n ASP 278 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3h4k h LEU 279 N 0.00 1.04 -0.36 0.64 5.85 -1.42 -2.35 115.31 118.70 3h4k h LEU 279 Ca -0.54 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.15 3h4k h LEU 279 Cb 2.22 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 43.00 3h4k h LEU 279 CO 0.03 0.74 0.00 0.49 -0.34 0.00 0.00 178.44 179.36 3h4k n PHE 280 N -4.46 0.86 -0.13 1.25 3.72 -1.25 -2.42 117.46 115.04 3h4k n PHE 280 Ca 0.11 0.29 0.01 0.00 -0.05 0.00 0.00 57.45 57.81 3h4k n PHE 280 Cb 0.03 -0.97 0.03 0.00 -0.94 0.00 0.00 39.48 37.62 3h4k n PHE 280 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3h4k n SER 281 N -2.24 2.11 -4.65 4.37 3.41 -1.17 -4.83 113.62 110.61 3h4k n SER 281 Ca 0.04 -2.12 -0.45 0.00 -0.26 0.00 0.00 58.87 56.08 3h4k n SER 281 Cb 0.33 -0.06 -0.04 0.00 -0.26 0.00 0.00 64.21 64.17 3h4k n SER 281 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3h4k n LEU 282 N -0.53 3.64 0.15 1.04 7.94 -0.89 -4.87 117.00 123.47 3h4k n LEU 282 Ca 0.03 0.82 0.05 0.00 -1.11 0.00 0.00 56.01 55.79 3h4k n LEU 282 Cb 0.31 -1.45 0.48 0.00 0.53 0.00 0.00 43.42 43.29 3h4k n LEU 282 CO 0.01 -0.06 0.99 1.55 -1.11 0.00 0.00 177.39 178.77 3h4k h PRO 283 N 10.64 0.20 -6.23 1.96 0.13 -1.91 -3.44 132.00 133.36 3h4k h PRO 283 Ca -0.47 -0.03 -0.55 0.00 -0.87 0.00 0.00 66.00 64.08 3h4k h PRO 283 Cb 1.26 -0.04 -0.08 0.00 0.13 0.00 0.00 31.00 32.27 3h4k h PRO 283 CO 0.95 0.25 -0.59 1.52 -0.23 0.00 0.00 178.00 179.89 3h4k s TYR 284 N -4.96 2.93 -0.02 1.56 1.13 -1.26 -4.78 117.35 111.95 3h4k s TYR 284 Ca -0.06 -0.14 -0.30 0.00 -1.41 0.00 0.00 57.07 55.16 3h4k s TYR 284 Cb 0.16 -1.34 -0.04 0.00 -1.10 0.00 0.00 41.96 39.64 3h4k s TYR 284 CO 0.71 0.55 1.17 0.12 -2.51 0.00 0.00 175.55 175.60 3h4k s PHE 285 N -2.07 3.30 0.41 -3.49 5.36 -1.26 -4.94 117.98 115.29 3h4k s PHE 285 Ca 0.31 1.29 0.20 0.00 -0.96 0.00 0.00 56.93 57.78 3h4k s PHE 285 Cb -0.08 -3.39 1.16 0.00 -0.34 0.00 0.00 43.02 40.37 3h4k s PHE 285 CO 0.22 -1.16 1.76 -1.35 -1.46 0.00 0.00 175.22 173.23 3h4k h PRO 286 N 7.22 0.33 0.00 10.12 0.11 -1.98 -3.40 132.00 144.40 3h4k h PRO 286 Ca -0.37 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.72 3h4k h PRO 286 Cb 1.18 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3h4k h PRO 286 CO 0.85 0.22 0.00 0.41 -0.21 0.00 0.00 178.00 179.27 3h4k n GLY 287 N -1.49 0.67 3.62 -0.55 0.00 -1.26 -3.62 105.19 102.56 3h4k n GLY 287 Ca 0.27 -0.85 -0.43 0.00 0.00 0.00 0.00 46.02 45.00 3h4k n GLY 287 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h4k s LYS 288 N 0.00 3.51 -0.03 1.61 2.20 -1.26 -4.05 119.74 121.72 3h4k s LYS 288 Ca 0.00 1.97 0.06 0.00 -0.36 0.00 0.00 55.97 57.64 3h4k s LYS 288 Cb 0.00 -4.23 -0.01 0.00 -1.51 0.00 0.00 37.83 32.08 3h4k s LYS 288 CO 0.00 -1.66 -0.21 0.99 -0.36 0.00 0.00 175.35 174.11 3h4k s THR 289 N 6.63 1.70 -0.20 3.43 2.01 0.77 -0.61 115.64 129.38 3h4k s THR 289 Ca 0.88 -0.90 -0.04 0.00 0.31 0.00 0.00 61.69 61.94 3h4k s THR 289 Cb -0.31 -1.43 -0.02 0.00 0.01 0.00 0.00 72.50 70.75 3h4k s THR 289 CO 0.35 0.48 -0.02 -0.22 -0.69 0.00 0.00 174.62 174.52 3h4k s LEU 290 N -0.31 3.12 -0.34 4.42 2.96 -0.20 -0.78 118.68 127.55 3h4k s LEU 290 Ca 0.03 -0.25 -0.10 0.00 -0.22 0.00 0.00 54.13 53.59 3h4k s LEU 290 Cb -0.10 -1.78 0.01 0.00 0.50 0.00 0.00 46.19 44.82 3h4k s LEU 290 CO 0.01 0.06 0.18 -0.69 -1.32 0.00 0.00 176.35 174.59 3h4k s VAL 291 N 1.01 4.55 -0.31 1.68 1.01 0.86 -0.03 120.40 129.17 3h4k s VAL 291 Ca 0.01 -0.68 -0.19 0.00 0.00 0.00 0.00 61.98 61.13 3h4k s VAL 291 Cb -0.14 -3.44 -0.01 0.00 0.00 0.00 0.00 36.38 32.78 3h4k s VAL 291 CO 0.01 -0.10 0.56 -0.63 0.00 0.00 0.00 175.10 174.94 3h4k s ILE 292 N 1.57 5.00 0.00 2.22 1.01 0.32 -0.46 121.20 130.87 3h4k s ILE 292 Ca 0.03 0.68 0.00 0.00 0.00 0.00 0.00 60.65 61.36 3h4k s ILE 292 Cb -0.18 -3.94 0.00 0.00 0.01 0.00 0.00 42.46 38.35 3h4k s ILE 292 CO 0.06 -0.11 0.00 0.61 0.00 0.00 0.00 174.94 175.50 3h4k n GLY 293 N 4.55 3.30 0.15 6.18 0.00 -0.77 -0.79 105.19 117.82 3h4k n GLY 293 Ca -0.03 -1.88 0.01 0.00 0.00 0.00 0.00 46.02 44.11 3h4k n GLY 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4k n ALA 294 N -1.37 1.46 -0.91 4.61 0.00 -1.26 -4.54 120.51 118.49 3h4k n ALA 294 Ca 0.00 -0.81 -0.29 0.00 0.00 0.00 0.00 53.44 52.34 3h4k n ALA 294 Cb 0.00 -0.17 0.23 0.00 0.00 0.00 0.00 19.45 19.52 3h4k n ALA 294 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3h4k s SER 295 N -0.54 1.07 0.37 0.00 1.04 -1.26 -1.14 113.70 113.24 3h4k s SER 295 Ca 0.02 0.96 0.07 0.00 0.48 0.00 0.00 55.95 57.47 3h4k s SER 295 Cb 0.01 -1.43 0.72 0.00 0.10 0.00 0.00 66.02 65.42 3h4k s SER 295 CO 0.00 -4.07 1.91 0.10 0.98 0.00 0.00 173.24 172.17 3h4k h TYR 296 N -2.54 0.39 -0.20 5.02 -0.00 -1.97 -2.11 116.97 115.57 3h4k h TYR 296 Ca -0.51 -0.04 0.00 0.00 -0.00 0.00 0.00 58.73 58.19 3h4k h TYR 296 Cb 1.32 -0.11 -0.01 0.00 -0.00 0.00 0.00 36.73 37.93 3h4k h TYR 296 CO -1.20 0.43 0.13 0.28 -0.00 0.00 0.00 178.16 177.80 3h4k h VAL 297 N 0.37 1.05 -0.13 -0.90 2.07 -1.94 -0.47 116.25 116.30 3h4k h VAL 297 Ca 0.08 -0.09 0.01 0.00 0.82 0.00 0.00 66.70 67.51 3h4k h VAL 297 Cb 0.32 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 3h4k h VAL 297 CO 0.01 0.05 0.06 0.00 0.02 0.00 0.00 177.57 177.71 3h4k h ALA 298 N 1.08 0.15 -0.20 1.67 0.00 -1.72 -1.71 119.26 118.52 3h4k h ALA 298 Ca 0.08 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.79 3h4k h ALA 298 Cb -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3h4k h ALA 298 CO -0.02 -0.39 -0.66 -0.07 0.00 0.00 0.00 179.25 178.11 3h4k h LEU 299 N 0.13 0.87 -0.11 0.00 3.38 -1.35 -1.56 115.31 116.67 3h4k h LEU 299 Ca 0.05 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 57.50 3h4k h LEU 299 Cb 0.01 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3h4k h LEU 299 CO -0.04 1.30 0.07 -0.33 0.09 0.00 0.00 178.44 179.53 3h4k h GLU 300 N 0.55 0.15 0.21 1.13 5.08 -1.04 0.80 114.58 121.45 3h4k h GLU 300 Ca -0.02 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 3h4k h GLU 300 Cb 1.27 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.49 3h4k h GLU 300 CO 0.14 0.13 -0.10 0.00 -1.00 0.00 0.00 179.01 178.17 3h4k h ALA 302 N 0.29 1.79 0.48 0.00 0.00 -1.30 -2.27 119.26 118.24 3h4k h ALA 302 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3h4k h ALA 302 Cb 0.35 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3h4k h ALA 302 CO 0.05 0.01 -0.37 0.78 0.00 0.00 0.00 179.25 179.71 3h4k h GLY 303 N 0.73 -0.93 1.89 0.00 0.00 -0.46 -2.50 103.07 101.79 3h4k h GLY 303 Ca 0.41 0.42 -0.16 0.00 0.00 0.00 0.00 47.33 48.01 3h4k h GLY 303 CO -0.18 -0.33 -0.72 0.27 0.00 0.00 0.00 176.54 175.59 3h4k h PHE 304 N -0.84 0.15 -0.85 5.60 -0.00 -1.38 -3.00 116.94 116.62 3h4k h PHE 304 Ca -0.05 -0.07 0.00 0.00 -0.00 0.00 0.00 57.97 57.86 3h4k h PHE 304 Cb 0.72 -0.02 -0.04 0.00 -0.00 0.00 0.00 35.95 36.60 3h4k h PHE 304 CO -0.16 0.79 0.55 -0.07 -0.00 0.00 0.00 178.31 179.42 3h4k h LEU 305 N 0.07 0.99 -0.57 2.10 3.38 -1.38 0.60 115.31 120.49 3h4k h LEU 305 Ca -0.02 -0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 3h4k h LEU 305 Cb 1.27 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 3h4k h LEU 305 CO 0.10 0.73 -0.04 0.00 0.09 0.00 0.00 178.44 179.32 3h4k h ALA 306 N 1.45 0.77 0.00 1.53 0.00 -1.42 -1.85 119.26 119.74 3h4k h ALA 306 Ca 0.31 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3h4k h ALA 306 Cb -0.11 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.47 3h4k h ALA 306 CO -0.06 0.64 0.00 0.77 0.00 0.00 0.00 179.25 180.59 3h4k h SER 307 N 0.92 0.00 -0.98 0.00 0.02 -1.17 -2.76 113.55 109.57 3h4k h SER 307 Ca 0.16 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.51 3h4k h SER 307 Cb 0.60 0.00 -0.30 0.00 0.14 0.00 0.00 62.40 62.84 3h4k h SER 307 CO 0.04 0.00 0.74 0.18 -1.14 0.00 0.00 176.83 176.64 3h4k n LEU 308 N -2.71 7.18 -2.92 5.07 4.77 0.11 -4.85 117.00 123.66 3h4k n LEU 308 Ca 0.01 -3.98 -0.15 0.00 -0.03 0.00 0.00 56.01 51.86 3h4k n LEU 308 Cb 0.28 -0.90 0.07 0.00 -2.33 0.00 0.00 43.42 40.53 3h4k n LEU 308 CO 0.24 1.29 0.11 0.61 -1.33 0.00 0.00 177.39 178.31 3h4k n GLY 309 N -1.02 -0.20 3.48 -0.72 0.00 -1.05 -4.89 105.19 100.79 3h4k n GLY 309 Ca 0.61 -0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.32 3h4k n GLY 309 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h4k s GLY 310 N -3.88 1.62 -0.62 -0.02 0.00 -0.72 -5.00 107.32 98.71 3h4k s GLY 310 Ca 0.11 -1.23 -0.21 0.00 0.00 0.00 0.00 44.72 43.39 3h4k s GLY 310 CO 0.57 -1.15 0.84 -0.35 0.00 0.00 0.00 173.10 173.01 3h4k s ASP 311 N -1.68 6.19 -0.11 1.64 2.15 -1.26 -4.41 116.67 119.19 3h4k s ASP 311 Ca 0.16 -1.15 0.02 0.00 0.43 0.00 0.00 52.55 52.02 3h4k s ASP 311 Cb -0.11 -2.36 -0.01 0.00 -0.30 0.00 0.00 42.92 40.14 3h4k s ASP 311 CO 0.07 -1.27 -0.19 -0.69 -0.17 0.00 0.00 175.17 172.93 3h4k s VAL 312 N 3.40 2.54 -0.04 1.11 1.01 -1.26 -0.16 120.40 127.00 3h4k s VAL 312 Ca 0.18 -0.85 0.06 0.00 0.00 0.00 0.00 61.98 61.36 3h4k s VAL 312 Cb -0.20 -2.02 -0.01 0.00 0.00 0.00 0.00 36.38 34.15 3h4k s VAL 312 CO 0.09 0.54 -0.22 -0.89 0.00 0.00 0.00 175.10 174.63 3h4k s THR 313 N 0.29 1.79 -0.20 3.92 2.01 0.04 -1.52 115.64 121.97 3h4k s THR 313 Ca -0.14 -0.93 -0.04 0.00 0.31 0.00 0.00 61.69 60.89 3h4k s THR 313 Cb -0.17 -1.52 -0.02 0.00 0.01 0.00 0.00 72.50 70.81 3h4k s THR 313 CO 0.07 0.50 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.78 3h4k s VAL 314 N -0.17 3.60 -0.35 3.82 1.01 0.97 -0.10 120.40 129.18 3h4k s VAL 314 Ca -0.01 -0.43 -0.16 0.00 0.00 0.00 0.00 61.98 61.38 3h4k s VAL 314 Cb -0.12 -2.62 -0.01 0.00 0.00 0.00 0.00 36.38 33.63 3h4k s VAL 314 CO 0.02 0.44 0.39 -0.32 0.00 0.00 0.00 175.10 175.63 3h4k s MET 315 N 1.11 3.51 -0.18 2.72 1.75 0.39 -0.06 119.30 128.54 3h4k s MET 315 Ca 0.02 -0.44 -0.04 0.00 -1.25 0.00 0.00 55.69 53.98 3h4k s MET 315 Cb -0.15 -3.83 -0.03 0.00 2.84 0.00 0.00 34.83 33.67 3h4k s MET 315 CO 0.00 -0.58 -0.02 0.08 -0.65 0.00 0.00 175.02 173.86 3h4k s VAL 316 N 2.07 3.92 -0.02 10.11 1.01 -0.41 -1.85 120.40 135.22 3h4k s VAL 316 Ca 0.12 -0.33 -0.25 0.00 0.00 0.00 0.00 61.98 61.53 3h4k s VAL 316 Cb -0.17 -2.75 -0.20 0.00 0.00 0.00 0.00 36.38 33.27 3h4k s VAL 316 CO 0.12 0.45 1.23 -0.09 0.00 0.00 0.00 175.10 176.81 3h4k h ARG 317 N 7.19 0.11 0.00 2.72 2.43 -1.85 0.16 114.38 125.13 3h4k h ARG 317 Ca -0.34 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.76 3h4k h ARG 317 Cb 1.18 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 3h4k h ARG 317 CO 0.62 0.64 0.00 -1.13 -1.51 0.00 0.00 179.97 178.59 3h4k n SER 318 N -4.72 0.00 -4.47 -3.80 3.41 -1.26 -4.05 113.62 98.73 3h4k n SER 318 Ca -0.08 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.29 3h4k n SER 318 Cb 0.32 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.17 3h4k n SER 318 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 3h4k s ILE 319 N -0.41 2.23 0.19 -1.33 -4.36 -1.26 -4.72 121.20 111.54 3h4k s ILE 319 Ca 0.00 -2.29 -0.16 0.00 -0.26 0.00 0.00 60.65 57.94 3h4k s ILE 319 Cb 0.00 -2.40 -0.08 0.00 1.25 0.00 0.00 42.46 41.24 3h4k s ILE 319 CO 0.00 -0.35 0.63 -0.76 0.24 0.00 0.00 174.94 174.70 3h4k s LEU 320 N -3.51 4.32 -1.05 0.37 1.43 -1.26 -4.52 118.68 114.45 3h4k s LEU 320 Ca 0.30 1.22 -0.20 0.00 -1.03 0.00 0.00 54.13 54.42 3h4k s LEU 320 Cb -0.01 -3.45 0.02 0.00 0.03 0.00 0.00 46.19 42.78 3h4k s LEU 320 CO 0.14 0.05 0.67 0.18 0.23 0.00 0.00 176.35 177.62 3h4k n LEU 321 N 0.67 -1.42 -4.71 1.79 4.77 -0.29 -4.84 117.00 112.97 3h4k n LEU 321 Ca -0.03 -1.10 -0.43 0.00 -0.03 0.00 0.00 56.01 54.42 3h4k n LEU 321 Cb 0.52 -1.79 -0.03 0.00 -2.33 0.00 0.00 43.42 39.78 3h4k n LEU 321 CO 0.43 0.54 1.35 -1.14 -1.33 0.00 0.00 177.39 177.24 3h4k n ARG 322 N -3.96 2.69 0.00 3.23 0.63 -1.26 -1.70 116.66 116.29 3h4k n ARG 322 Ca -0.18 0.97 0.00 0.00 -0.92 0.00 0.00 57.85 57.72 3h4k n ARG 322 Cb 0.61 -2.81 0.00 0.00 0.45 0.00 0.00 32.46 30.71 3h4k n ARG 322 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3h4k n GLY 323 N 3.90 3.02 3.94 5.14 0.00 -1.26 -5.06 105.19 114.86 3h4k n GLY 323 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 3h4k n GLY 323 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h4k s PHE 324 N -2.81 3.36 -0.10 1.61 0.08 -0.69 -4.97 117.98 114.46 3h4k s PHE 324 Ca 0.00 0.43 -0.36 0.00 0.12 0.00 0.00 56.93 57.11 3h4k s PHE 324 Cb 0.00 -2.27 -0.14 0.00 -0.57 0.00 0.00 43.02 40.05 3h4k s PHE 324 CO 0.00 -0.29 1.76 -3.47 -0.10 0.00 0.00 175.22 173.12 3h4k n ASP 325 N -2.11 2.92 0.11 1.36 -0.08 -1.26 -4.88 116.55 112.60 3h4k n ASP 325 Ca 0.00 1.03 -0.04 0.00 -1.51 0.00 0.00 54.79 54.28 3h4k n ASP 325 Cb 0.57 -1.29 0.05 0.00 2.34 0.00 0.00 41.12 42.79 3h4k n ASP 325 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 3h4k h GLN 326 N 7.80 0.00 -0.22 -0.67 1.08 -1.93 0.72 115.11 121.89 3h4k h GLN 326 Ca -0.47 -0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 56.71 3h4k h GLN 326 Cb 1.29 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.71 3h4k h GLN 326 CO 0.93 0.77 0.07 0.37 -0.95 0.00 0.00 178.83 180.02 3h4k h GLN 327 N 0.00 0.35 -0.73 1.46 4.15 -2.00 -1.75 115.11 116.60 3h4k h GLN 327 Ca -0.01 -0.08 -0.04 0.00 0.77 0.00 0.00 58.65 59.30 3h4k h GLN 327 Cb 1.37 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.98 3h4k h GLN 327 CO 0.10 0.44 0.32 0.52 -1.93 0.00 0.00 178.83 178.28 3h4k h MET 328 N 0.18 1.07 -0.84 1.69 2.86 -1.90 -2.52 114.93 115.47 3h4k h MET 328 Ca 0.07 -0.18 -0.00 0.00 -2.06 0.00 0.00 59.70 57.53 3h4k h MET 328 Cb 0.24 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.68 3h4k h MET 328 CO -0.00 0.86 0.51 0.00 1.06 0.00 0.00 176.91 179.34 3h4k h ALA 329 N 1.16 1.31 -0.64 6.32 0.00 -0.77 -1.47 119.26 125.16 3h4k h ALA 329 Ca 0.25 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 3h4k h ALA 329 Cb 0.17 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3h4k h ALA 329 CO -0.03 0.60 0.10 1.49 0.00 0.00 0.00 179.25 181.41 3h4k h GLU 330 N 1.16 1.06 -0.43 0.00 4.81 -1.03 -2.21 114.58 117.94 3h4k h GLU 330 Ca 0.30 -0.29 -0.11 0.00 -0.13 0.00 0.00 59.36 59.14 3h4k h GLU 330 Cb -0.05 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.19 3h4k h GLU 330 CO -0.06 0.99 -0.16 0.87 -0.73 0.00 0.00 179.01 179.92 3h4k h LYS 331 N 0.97 0.81 -0.57 1.92 1.57 -1.03 0.37 116.57 120.61 3h4k h LYS 331 Ca 0.19 -0.30 0.03 0.00 -1.87 0.00 0.00 60.65 58.70 3h4k h LYS 331 Cb 0.44 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.66 3h4k h LYS 331 CO 0.01 0.91 0.35 0.28 -0.57 0.00 0.00 179.45 180.44 3h4k h VAL 332 N 0.72 1.07 -0.38 0.50 2.07 -1.13 -2.39 116.25 116.70 3h4k h VAL 332 Ca 0.11 -0.24 -0.15 0.00 0.82 0.00 0.00 66.70 67.25 3h4k h VAL 332 Cb 0.67 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 3h4k h VAL 332 CO 0.05 0.13 -0.33 1.23 0.02 0.00 0.00 177.57 178.66 3h4k h GLY 333 N 0.69 0.97 0.77 2.17 0.00 -1.06 -2.90 103.07 103.72 3h4k h GLY 333 Ca 0.23 -0.98 0.04 0.00 0.00 0.00 0.00 47.33 46.62 3h4k h GLY 333 CO -0.10 0.88 0.31 -0.55 0.00 0.00 0.00 176.54 177.09 3h4k h ASP 334 N 0.71 0.47 -0.24 0.19 5.19 -0.80 0.71 116.42 122.65 3h4k h ASP 334 Ca 0.07 0.02 0.01 0.00 -0.62 0.00 0.00 57.03 56.50 3h4k h ASP 334 Cb 0.92 -0.08 -0.01 0.00 0.18 0.00 0.00 39.33 40.34 3h4k h ASP 334 CO 0.09 0.32 0.15 0.22 -3.12 0.00 0.00 179.24 176.90 3h4k h TYR 335 N 0.60 0.28 -0.68 4.55 3.20 -1.43 -0.85 116.97 122.64 3h4k h TYR 335 Ca 0.24 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.11 3h4k h TYR 335 Cb 0.10 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.25 3h4k h TYR 335 CO -0.08 0.17 0.40 0.52 -1.64 0.00 0.00 178.16 177.53 3h4k h MET 336 N 0.30 0.92 -0.21 1.82 2.86 -1.24 -1.35 114.93 118.04 3h4k h MET 336 Ca 0.09 -0.09 -0.08 0.00 -2.06 0.00 0.00 59.70 57.57 3h4k h MET 336 Cb -0.02 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.44 3h4k h MET 336 CO -0.04 0.66 -0.21 1.49 1.06 0.00 0.00 176.91 179.87 3h4k h GLU 337 N 0.92 0.37 -0.00 1.72 4.81 -0.66 -0.88 114.58 120.86 3h4k h GLU 337 Ca 0.24 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3h4k h GLU 337 Cb -0.02 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.33 3h4k h GLU 337 CO -0.04 0.57 -0.03 0.09 -0.73 0.00 0.00 179.01 178.86 3h4k n ASN 338 N -4.17 0.05 -2.31 1.04 3.02 -0.34 -3.89 115.26 108.66 3h4k n ASN 338 Ca -0.00 0.26 -0.22 0.00 -0.03 0.00 0.00 54.58 54.59 3h4k n ASN 338 Cb 0.36 -0.39 0.02 0.00 -0.61 0.00 0.00 39.78 39.16 3h4k n ASN 338 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3h4k n HIS 339 N -1.43 2.75 0.00 3.10 8.25 -0.55 -4.99 115.22 122.35 3h4k n HIS 339 Ca 0.09 -2.58 0.00 0.00 -0.26 0.00 0.00 57.72 54.97 3h4k n HIS 339 Cb 0.31 -0.24 0.00 0.00 1.12 0.00 0.00 29.99 31.19 3h4k n HIS 339 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3h4k n GLY 340 N -0.57 2.91 3.68 -1.41 0.00 -1.16 -4.86 105.19 103.79 3h4k n GLY 340 Ca 0.36 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 3h4k n GLY 340 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h4k s VAL 341 N -1.31 3.30 0.18 1.61 1.01 -0.39 -4.70 120.40 120.10 3h4k s VAL 341 Ca 0.00 0.67 -0.05 0.00 0.00 0.00 0.00 61.98 62.60 3h4k s VAL 341 Cb 0.00 -3.43 -0.06 0.00 0.00 0.00 0.00 36.38 32.89 3h4k s VAL 341 CO 0.00 -0.01 0.42 -0.54 0.00 0.00 0.00 175.10 174.97 3h4k s LYS 342 N 2.84 3.65 -0.07 2.72 1.02 -0.58 -3.88 119.74 125.44 3h4k s LYS 342 Ca 0.71 -0.03 0.03 0.00 0.02 0.00 0.00 55.97 56.70 3h4k s LYS 342 Cb -0.37 -2.79 0.01 0.00 -0.52 0.00 0.00 37.83 34.16 3h4k s LYS 342 CO 0.30 0.41 -0.15 -0.06 -0.92 0.00 0.00 175.35 174.93 3h4k s PHE 343 N -1.74 1.72 -0.60 3.18 0.08 -1.26 -0.02 117.98 119.33 3h4k s PHE 343 Ca 0.42 -0.65 -0.15 0.00 0.12 0.00 0.00 56.93 56.68 3h4k s PHE 343 Cb -0.12 -1.21 0.15 0.00 -0.57 0.00 0.00 43.02 41.27 3h4k s PHE 343 CO 0.25 -0.30 0.55 0.00 -0.10 0.00 0.00 175.22 175.61 3h4k s ALA 344 N 0.55 3.73 0.27 5.36 0.00 0.92 -4.93 121.76 127.66 3h4k s ALA 344 Ca -0.15 -2.73 -0.29 0.00 0.00 0.00 0.00 51.96 48.79 3h4k s ALA 344 Cb -0.16 -3.28 -0.09 0.00 0.00 0.00 0.00 23.12 19.59 3h4k s ALA 344 CO 0.05 -2.07 0.97 0.15 0.00 0.00 0.00 175.76 174.86 3h4k s LYS 345 N 1.23 4.75 -1.37 0.00 1.02 -1.26 -1.29 119.74 122.82 3h4k s LYS 345 Ca 0.07 1.51 -0.04 0.00 0.02 0.00 0.00 55.97 57.53 3h4k s LYS 345 Cb -0.25 -3.15 0.02 0.00 -0.52 0.00 0.00 37.83 33.93 3h4k s LYS 345 CO -0.00 0.40 0.77 1.28 -0.92 0.00 0.00 175.35 176.88 3h4k n LEU 346 N 1.22 -2.94 -4.15 3.17 4.77 -0.27 -4.87 117.00 113.92 3h4k n LEU 346 Ca -0.01 -0.81 -0.23 0.00 -0.03 0.00 0.00 56.01 54.93 3h4k n LEU 346 Cb 0.47 -2.63 -0.15 0.00 -2.33 0.00 0.00 43.42 38.79 3h4k n LEU 346 CO 0.49 0.43 -0.49 0.00 -1.33 0.00 0.00 177.39 176.50 3h4k s VAL 348 N -0.51 0.88 0.23 0.00 -7.23 -0.89 -3.53 120.40 109.36 3h4k s VAL 348 Ca 0.05 -1.07 -0.12 0.00 -1.81 0.00 0.00 61.98 59.03 3h4k s VAL 348 Cb -0.07 -0.86 -0.08 0.00 0.56 0.00 0.00 36.38 35.94 3h4k s VAL 348 CO 0.00 -0.19 0.60 -2.16 -0.31 0.00 0.00 175.10 173.04 3h4k s PRO 349 N -1.41 3.90 -0.15 4.82 0.04 -1.26 -1.44 135.00 139.50 3h4k s PRO 349 Ca -0.03 0.42 -0.00 0.00 0.04 0.00 0.00 61.00 61.43 3h4k s PRO 349 Cb -0.09 -2.66 -0.09 0.00 0.04 0.00 0.00 34.50 31.70 3h4k s PRO 349 CO 0.01 0.32 -0.14 -0.25 0.04 0.00 0.00 177.00 176.98 3h4k n ASP 350 N 0.03 2.62 -3.49 6.66 8.00 0.12 -4.90 116.55 125.58 3h4k n ASP 350 Ca -0.00 -0.04 -0.12 0.00 0.71 0.00 0.00 54.79 55.34 3h4k n ASP 350 Cb 0.52 -0.26 -0.03 0.00 -0.02 0.00 0.00 41.12 41.33 3h4k n ASP 350 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 3h4k s GLU 351 N -2.29 0.96 -0.19 -1.24 -1.05 -0.89 -4.12 118.70 109.87 3h4k s GLU 351 Ca -0.20 -0.17 -0.00 0.00 -0.15 0.00 0.00 54.97 54.45 3h4k s GLU 351 Cb 0.06 0.45 0.01 0.00 -0.44 0.00 0.00 34.13 34.21 3h4k s GLU 351 CO 0.33 -0.38 -0.15 0.42 0.95 0.00 0.00 175.26 176.42 3h4k s ILE 352 N -2.61 2.45 -0.15 1.83 1.09 -0.50 -1.52 121.20 121.78 3h4k s ILE 352 Ca -0.00 -0.83 -0.08 0.00 -1.10 0.00 0.00 60.65 58.64 3h4k s ILE 352 Cb -0.01 -2.07 -0.04 0.00 -1.06 0.00 0.00 42.46 39.28 3h4k s ILE 352 CO -0.05 0.49 0.13 -0.75 -0.10 0.00 0.00 174.94 174.67 3h4k s LYS 353 N 1.34 3.74 -0.12 2.79 2.20 -0.25 -4.15 119.74 125.30 3h4k s LYS 353 Ca 0.05 -0.17 -0.29 0.00 -0.36 0.00 0.00 55.97 55.20 3h4k s LYS 353 Cb -0.14 -3.28 -0.01 0.00 -1.51 0.00 0.00 37.83 32.90 3h4k s LYS 353 CO -0.10 0.58 1.00 -1.14 -0.36 0.00 0.00 175.35 175.33 3h4k s GLN 354 N -0.46 4.40 -0.11 4.03 0.74 -1.26 -0.15 119.66 126.85 3h4k s GLN 354 Ca 0.12 1.36 0.18 0.00 0.05 0.00 0.00 55.36 57.07 3h4k s GLN 354 Cb -0.12 -3.55 -0.26 0.00 1.10 0.00 0.00 33.01 30.18 3h4k s GLN 354 CO 0.02 -0.35 0.23 1.28 -0.55 0.00 0.00 175.29 175.92 3h4k n LEU 355 N 5.15 0.00 -3.69 3.68 4.77 0.82 -4.90 117.00 122.82 3h4k n LEU 355 Ca 0.09 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.95 3h4k n LEU 355 Cb 0.48 0.24 -0.09 0.00 -2.33 0.00 0.00 43.42 41.72 3h4k n LEU 355 CO 0.52 0.24 0.17 -0.75 -1.33 0.00 0.00 177.39 176.24 3h4k s LYS 356 N -2.86 0.55 0.16 3.23 2.20 -0.38 -4.85 119.74 117.79 3h4k s LYS 356 Ca -0.08 0.79 -0.27 0.00 -0.36 0.00 0.00 55.97 56.05 3h4k s LYS 356 Cb 0.09 0.19 -0.08 0.00 -1.51 0.00 0.00 37.83 36.52 3h4k s LYS 356 CO 0.77 -0.10 0.83 0.08 -0.36 0.00 0.00 175.35 176.57 3h4k s VAL 357 N 0.72 4.37 -0.08 4.02 1.01 -1.26 -1.52 120.40 127.66 3h4k s VAL 357 Ca -0.04 1.81 -0.36 0.00 0.00 0.00 0.00 61.98 63.39 3h4k s VAL 357 Cb -0.05 -4.19 -0.14 0.00 0.00 0.00 0.00 36.38 32.00 3h4k s VAL 357 CO -0.05 0.48 1.74 0.52 0.00 0.00 0.00 175.10 177.79 3h4k n VAL 358 N 1.85 0.36 -2.69 2.92 0.31 -1.26 -4.39 118.33 115.43 3h4k n VAL 358 Ca -0.04 -0.06 -0.42 0.00 -0.01 0.00 0.00 64.34 63.81 3h4k n VAL 358 Cb 0.49 -1.55 -0.03 0.00 -0.91 0.00 0.00 33.84 31.83 3h4k n VAL 358 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3h4k s ASP 359 N 3.05 6.17 0.06 4.52 -1.08 -0.90 -4.89 116.67 123.60 3h4k s ASP 359 Ca 0.91 -0.70 -0.20 0.00 -0.52 0.00 0.00 52.55 52.04 3h4k s ASP 359 Cb -0.81 -2.50 -0.12 0.00 -1.46 0.00 0.00 42.92 38.04 3h4k s ASP 359 CO 0.52 -1.66 1.47 0.71 0.52 0.00 0.00 175.17 176.73 3h4k h THR 360 N 6.01 1.27 -0.01 1.71 1.35 -1.91 -2.81 112.91 118.53 3h4k h THR 360 Ca -0.28 -0.94 0.00 0.00 -0.55 0.00 0.00 66.41 64.64 3h4k h THR 360 Cb 1.06 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 69.02 3h4k h THR 360 CO 1.24 0.28 0.00 -1.84 -0.25 0.00 0.00 175.52 174.95 3h4k n GLU 361 N -4.69 1.06 0.00 4.72 0.28 -1.26 -3.34 120.64 117.41 3h4k n GLU 361 Ca -0.05 -0.09 0.00 0.00 -0.16 0.00 0.00 57.16 56.86 3h4k n GLU 361 Cb 0.25 -1.39 0.00 0.00 1.43 0.00 0.00 31.44 31.73 3h4k n GLU 361 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 3h4k n ASN 362 N -0.78 0.89 -3.77 -1.84 5.03 -1.21 -5.04 115.26 108.54 3h4k n ASN 362 Ca 0.18 -1.20 -0.31 0.00 0.87 0.00 0.00 54.58 54.12 3h4k n ASN 362 Cb 0.11 0.00 0.03 0.00 -1.02 0.00 0.00 39.78 38.90 3h4k n ASN 362 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3h4k n ASN 363 N -0.10 -4.03 -4.03 6.41 3.02 -1.08 -5.02 115.26 110.42 3h4k n ASN 363 Ca 0.00 -1.03 -0.14 0.00 -0.03 0.00 0.00 54.58 53.38 3h4k n ASN 363 Cb 0.15 -3.21 -0.12 0.00 -0.61 0.00 0.00 39.78 35.98 3h4k n ASN 363 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3h4k s LYS 364 N -6.20 0.50 0.81 3.52 1.02 -1.08 -4.58 119.74 113.73 3h4k s LYS 364 Ca 0.36 -0.58 -0.11 0.00 0.02 0.00 0.00 55.97 55.66 3h4k s LYS 364 Cb -0.14 -0.34 0.08 0.00 -0.52 0.00 0.00 37.83 36.91 3h4k s LYS 364 CO 0.87 0.07 1.09 -1.25 -0.92 0.00 0.00 175.35 175.22 3h4k s PRO 365 N -1.11 1.95 0.00 -1.68 0.04 -1.26 -2.12 135.00 130.81 3h4k s PRO 365 Ca -0.06 0.72 0.00 0.00 0.04 0.00 0.00 61.00 61.70 3h4k s PRO 365 Cb -0.07 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.57 3h4k s PRO 365 CO 0.00 -1.74 0.00 0.41 0.04 0.00 0.00 177.00 175.71 3h4k n GLY 366 N -1.83 0.74 2.97 0.56 0.00 -1.26 -4.48 105.19 101.89 3h4k n GLY 366 Ca 0.07 -1.46 -0.13 0.00 0.00 0.00 0.00 46.02 44.50 3h4k n GLY 366 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h4k s LEU 367 N 0.00 0.99 -0.00 0.99 2.96 -0.57 -4.59 118.68 118.45 3h4k s LEU 367 Ca 0.00 0.31 0.06 0.00 -0.22 0.00 0.00 54.13 54.27 3h4k s LEU 367 Cb 0.00 0.43 -0.02 0.00 0.50 0.00 0.00 46.19 47.10 3h4k s LEU 367 CO 0.00 -0.11 -0.19 -0.76 -1.32 0.00 0.00 176.35 173.97 3h4k s LEU 368 N 0.76 2.06 -0.26 -0.68 2.01 0.14 -0.13 118.68 122.59 3h4k s LEU 368 Ca -0.06 -0.37 -0.13 0.00 0.01 0.00 0.00 54.13 53.59 3h4k s LEU 368 Cb -0.07 -0.94 -0.04 0.00 0.01 0.00 0.00 46.19 45.14 3h4k s LEU 368 CO -0.04 0.21 0.28 -0.22 1.01 0.00 0.00 176.35 177.59 3h4k s LEU 369 N -0.57 4.06 -0.33 1.79 2.96 0.79 -0.67 118.68 126.71 3h4k s LEU 369 Ca 0.07 0.18 -0.11 0.00 -0.22 0.00 0.00 54.13 54.05 3h4k s LEU 369 Cb -0.07 -2.28 -0.01 0.00 0.50 0.00 0.00 46.19 44.33 3h4k s LEU 369 CO -0.00 -0.09 0.18 -0.69 -1.32 0.00 0.00 176.35 174.43 3h4k s VAL 370 N 1.72 4.79 -0.18 1.68 1.01 -0.66 -1.09 120.40 127.67 3h4k s VAL 370 Ca 0.11 -0.41 -0.07 0.00 0.00 0.00 0.00 61.98 61.61 3h4k s VAL 370 Cb -0.15 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 3h4k s VAL 370 CO 0.09 0.01 0.05 -0.54 0.00 0.00 0.00 175.10 174.71 3h4k s LYS 371 N 1.64 3.93 0.13 2.72 1.02 -0.58 -2.55 119.74 126.05 3h4k s LYS 371 Ca 0.05 -0.37 -0.02 0.00 0.02 0.00 0.00 55.97 55.65 3h4k s LYS 371 Cb -0.17 -3.17 0.01 0.00 -0.52 0.00 0.00 37.83 33.97 3h4k s LYS 371 CO 0.07 0.26 0.21 0.41 -0.92 0.00 0.00 175.35 175.39 3h4k n GLY 372 N 3.55 2.45 3.08 -3.33 0.00 0.02 0.12 105.19 111.08 3h4k n GLY 372 Ca -0.17 -1.36 -0.11 0.00 0.00 0.00 0.00 46.02 44.38 3h4k n GLY 372 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3h4k s HIS 373 N -4.88 0.05 0.79 1.61 -3.43 -0.52 0.35 115.29 109.25 3h4k s HIS 373 Ca 0.09 -0.13 -0.11 0.00 -0.80 0.00 0.00 55.06 54.12 3h4k s HIS 373 Cb -0.01 -0.05 0.07 0.00 -1.43 0.00 0.00 32.58 31.16 3h4k s HIS 373 CO 0.07 -0.25 1.15 0.71 -2.00 0.00 0.00 174.74 174.42 3h4k s TYR 374 N -1.23 2.98 0.32 0.38 2.02 0.02 -2.09 117.35 119.75 3h4k s TYR 374 Ca -0.13 0.73 0.01 0.00 -0.37 0.00 0.00 57.07 57.31 3h4k s TYR 374 Cb -0.07 -3.42 0.54 0.00 -0.40 0.00 0.00 41.96 38.61 3h4k s TYR 374 CO 0.01 -1.67 1.92 1.79 -1.57 0.00 0.00 175.55 176.02 3h4k h THR 375 N -0.96 1.19 -0.13 -0.71 1.35 -1.72 -2.70 112.91 109.23 3h4k h THR 375 Ca -0.46 -0.58 -0.08 0.00 -0.55 0.00 0.00 66.41 64.74 3h4k h THR 375 Cb 1.32 0.54 -0.01 0.00 -1.73 0.00 0.00 68.15 68.27 3h4k h THR 375 CO 0.65 0.23 -0.27 -2.24 -0.25 0.00 0.00 175.52 173.65 3h4k h ASP 376 N 0.76 0.24 0.00 5.36 3.04 -1.94 -3.46 116.42 120.42 3h4k h ASP 376 Ca 0.18 -0.07 0.00 0.00 -3.24 0.00 0.00 57.03 53.90 3h4k h ASP 376 Cb 0.13 -0.07 0.00 0.00 -1.04 0.00 0.00 39.33 38.36 3h4k h ASP 376 CO -0.02 0.51 0.00 0.61 -2.04 0.00 0.00 179.24 178.30 3h4k n GLY 377 N -0.53 1.17 3.73 7.15 0.00 -1.02 -5.13 105.19 110.55 3h4k n GLY 377 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 3h4k n GLY 377 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h4k s LYS 378 N 0.00 2.38 0.16 1.61 -0.14 -1.26 -4.74 119.74 117.75 3h4k s LYS 378 Ca 0.00 1.92 -0.15 0.00 -1.36 0.00 0.00 55.97 56.38 3h4k s LYS 378 Cb 0.00 -1.84 -0.07 0.00 -1.68 0.00 0.00 37.83 34.24 3h4k s LYS 378 CO 0.00 -1.69 0.57 0.15 -0.76 0.00 0.00 175.35 173.62 3h4k s LYS 379 N -3.60 4.01 -0.13 1.68 -0.14 -1.26 -0.80 119.74 119.49 3h4k s LYS 379 Ca 0.79 0.53 -0.00 0.00 -1.36 0.00 0.00 55.97 55.93 3h4k s LYS 379 Cb -0.33 -2.92 -0.01 0.00 -1.68 0.00 0.00 37.83 32.88 3h4k s LYS 379 CO 0.42 0.47 -0.13 0.12 -0.76 0.00 0.00 175.35 175.46 3h4k s PHE 380 N -1.48 2.81 -0.22 3.18 2.19 0.16 -4.83 117.98 119.78 3h4k s PHE 380 Ca 0.39 -0.67 -0.04 0.00 0.33 0.00 0.00 56.93 56.93 3h4k s PHE 380 Cb -0.15 -1.85 0.11 0.00 -1.31 0.00 0.00 43.02 39.82 3h4k s PHE 380 CO 0.19 -0.23 0.38 -2.00 1.83 0.00 0.00 175.22 175.39 3h4k s GLU 381 N 0.38 0.32 -0.05 10.12 2.12 -1.26 -0.80 118.70 129.53 3h4k s GLU 381 Ca -0.11 0.73 -0.20 0.00 0.36 0.00 0.00 54.97 55.75 3h4k s GLU 381 Cb -0.16 -0.16 0.04 0.00 0.26 0.00 0.00 34.13 34.11 3h4k s GLU 381 CO 0.05 -0.47 0.45 -2.00 -0.54 0.00 0.00 175.26 172.75 3h4k s GLU 382 N 2.56 0.78 -0.04 4.30 2.12 -1.06 -5.02 118.70 122.33 3h4k s GLU 382 Ca 0.06 0.07 -0.22 0.00 0.36 0.00 0.00 54.97 55.24 3h4k s GLU 382 Cb -0.14 0.36 -0.04 0.00 0.26 0.00 0.00 34.13 34.56 3h4k s GLU 382 CO -0.14 -0.21 0.66 -1.21 -0.54 0.00 0.00 175.26 173.81 3h4k s GLU 383 N -1.07 4.41 0.04 4.30 2.02 -1.26 -1.65 118.70 125.49 3h4k s GLU 383 Ca -0.11 0.82 0.04 0.00 0.02 0.00 0.00 54.97 55.74 3h4k s GLU 383 Cb -0.03 -3.41 -0.02 0.00 0.10 0.00 0.00 34.13 30.76 3h4k s GLU 383 CO 0.06 0.17 -0.11 -0.06 0.02 0.00 0.00 175.26 175.34 3h4k s PHE 384 N 0.44 0.97 0.09 1.61 0.40 0.16 -4.99 117.98 116.66 3h4k s PHE 384 Ca 0.35 -0.38 -0.06 0.00 -0.60 0.00 0.00 56.93 56.23 3h4k s PHE 384 Cb -0.18 -0.57 -0.22 0.00 0.51 0.00 0.00 43.02 42.55 3h4k s PHE 384 CO 0.18 -0.00 1.18 0.93 0.70 0.00 0.00 175.22 178.21 3h4k h GLU 385 N 4.83 0.38 -3.85 0.44 5.08 -1.11 0.41 114.58 120.76 3h4k h GLU 385 Ca -0.37 -0.54 -0.33 0.00 -1.00 0.00 0.00 59.36 57.12 3h4k h GLU 385 Cb 1.19 0.18 -0.32 0.00 0.50 0.00 0.00 28.75 30.30 3h4k h GLU 385 CO 0.43 1.22 -0.75 0.99 -1.00 0.00 0.00 179.01 179.90 3h4k s THR 386 N -2.89 0.23 -0.25 1.13 2.01 -0.85 -4.12 115.64 110.90 3h4k s THR 386 Ca -0.06 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 61.91 3h4k s THR 386 Cb 0.07 -0.28 0.00 0.00 0.01 0.00 0.00 72.50 72.30 3h4k s THR 386 CO 0.89 0.13 -0.01 -0.69 -0.69 0.00 0.00 174.62 174.25 3h4k s VAL 387 N 0.70 3.45 -0.23 3.82 1.01 -1.26 -1.03 120.40 126.86 3h4k s VAL 387 Ca -0.07 -0.64 -0.07 0.00 0.00 0.00 0.00 61.98 61.20 3h4k s VAL 387 Cb -0.10 -2.66 -0.03 0.00 0.00 0.00 0.00 36.38 33.59 3h4k s VAL 387 CO -0.01 0.29 0.05 -0.63 0.00 0.00 0.00 175.10 174.80 3h4k s ILE 388 N 1.46 4.26 -0.26 2.22 1.01 0.96 -0.84 121.20 130.01 3h4k s ILE 388 Ca 0.04 -0.20 -0.17 0.00 0.00 0.00 0.00 60.65 60.32 3h4k s ILE 388 Cb -0.15 -2.97 -0.03 0.00 0.01 0.00 0.00 42.46 39.32 3h4k s ILE 388 CO -0.02 0.37 0.49 -0.36 0.00 0.00 0.00 174.94 175.42 3h4k s PHE 389 N 1.34 3.27 -0.45 3.97 0.08 0.40 -0.52 117.98 126.07 3h4k s PHE 389 Ca 0.05 0.60 0.09 0.00 0.12 0.00 0.00 56.93 57.79 3h4k s PHE 389 Cb -0.15 -2.69 0.35 0.00 -0.57 0.00 0.00 43.02 39.96 3h4k s PHE 389 CO 0.03 -0.26 0.82 0.00 -0.10 0.00 0.00 175.22 175.71 3h4k n ALA 390 N 5.47 3.10 -0.34 5.36 0.00 0.03 -4.36 120.51 129.77 3h4k n ALA 390 Ca -0.05 -3.90 0.08 0.00 0.00 0.00 0.00 53.44 49.57 3h4k n ALA 390 Cb 0.50 -0.85 0.32 0.00 0.00 0.00 0.00 19.45 19.42 3h4k n ALA 390 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3h4k n VAL 391 N 0.06 1.61 0.00 0.00 0.24 -1.25 -4.25 118.33 114.74 3h4k n VAL 391 Ca 0.27 -1.03 0.00 0.00 -2.04 0.00 0.00 64.34 61.54 3h4k n VAL 391 Cb 0.56 0.07 0.00 0.00 -1.47 0.00 0.00 33.84 33.00 3h4k n VAL 391 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h4k n GLY 392 N 1.05 1.35 2.93 7.63 0.00 -1.26 -4.87 105.19 112.01 3h4k n GLY 392 Ca 0.23 -2.11 -0.14 0.00 0.00 0.00 0.00 46.02 43.99 3h4k n GLY 392 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h4k s ARG 393 N -1.21 0.26 0.02 1.61 0.52 -1.26 -1.34 118.95 117.55 3h4k s ARG 393 Ca 0.00 -0.14 0.05 0.00 -0.52 0.00 0.00 55.73 55.12 3h4k s ARG 393 Cb 0.00 -0.24 -0.02 0.00 0.52 0.00 0.00 34.95 35.21 3h4k s ARG 393 CO 0.00 0.06 -0.14 -1.83 0.02 0.00 0.00 175.30 173.42 3h4k s GLU 394 N -0.14 0.97 0.53 3.54 -1.05 0.15 -4.90 118.70 117.80 3h4k s GLU 394 Ca 0.01 -0.67 -0.18 0.00 -0.15 0.00 0.00 54.97 53.97 3h4k s GLU 394 Cb -0.02 -0.97 -0.06 0.00 -0.44 0.00 0.00 34.13 32.64 3h4k s GLU 394 CO -0.00 0.25 1.04 -1.25 0.95 0.00 0.00 175.26 176.25 3h4k s PRO 395 N -0.89 3.60 -0.54 -4.83 0.04 -1.26 -1.51 135.00 129.61 3h4k s PRO 395 Ca 0.03 1.27 0.07 0.00 0.04 0.00 0.00 61.00 62.40 3h4k s PRO 395 Cb -0.07 -2.07 0.33 0.00 0.04 0.00 0.00 34.50 32.73 3h4k s PRO 395 CO 0.01 -0.58 0.86 1.04 0.04 0.00 0.00 177.00 178.37 3h4k n GLN 396 N -1.46 2.59 0.05 4.56 6.02 -1.26 -4.89 117.38 122.99 3h4k n GLN 396 Ca 0.09 -4.47 0.13 0.00 -0.01 0.00 0.00 57.00 52.73 3h4k n GLN 396 Cb 0.53 -2.09 0.40 0.00 1.02 0.00 0.00 30.24 30.09 3h4k n GLN 396 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3h4k n LEU 397 N 0.06 0.49 0.10 1.08 4.77 -1.26 -3.02 117.00 119.21 3h4k n LEU 397 Ca 0.29 0.39 0.02 0.00 -0.03 0.00 0.00 56.01 56.68 3h4k n LEU 397 Cb 0.45 -0.34 0.39 0.00 -2.33 0.00 0.00 43.42 41.60 3h4k n LEU 397 CO 0.32 -0.05 0.93 0.77 -1.33 0.00 0.00 177.39 178.02 3h4k h SER 398 N 0.00 0.28 1.08 -1.43 4.64 -1.90 0.55 113.55 116.77 3h4k h SER 398 Ca 0.00 -0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 61.16 3h4k h SER 398 Cb 0.63 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.63 3h4k h SER 398 CO 0.00 0.39 -0.51 0.11 -0.87 0.00 0.00 176.83 175.95 3h4k h LYS 399 N 0.29 0.00 0.00 4.77 1.57 -1.97 -3.34 116.57 117.89 3h4k h LYS 399 Ca 0.06 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.60 3h4k h LYS 399 Cb 0.31 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.58 3h4k h LYS 399 CO 0.01 0.51 -2.03 0.28 -0.57 0.00 0.00 179.45 177.65 3h4k n VAL 400 N -3.42 1.10 -3.80 0.50 0.31 -0.80 -4.84 118.33 107.37 3h4k n VAL 400 Ca 0.01 -0.75 -0.24 0.00 -0.01 0.00 0.00 64.34 63.35 3h4k n VAL 400 Cb 0.65 -0.49 -0.17 0.00 -0.91 0.00 0.00 33.84 32.91 3h4k n VAL 400 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 3h4k s LEU 401 N -5.42 0.81 0.29 7.52 2.96 0.19 -1.62 118.68 123.41 3h4k s LEU 401 Ca -0.08 -0.21 -0.29 0.00 -0.22 0.00 0.00 54.13 53.33 3h4k s LEU 401 Cb 0.08 -0.56 -0.10 0.00 0.50 0.00 0.00 46.19 46.11 3h4k s LEU 401 CO 0.84 -0.18 1.22 0.00 -1.32 0.00 0.00 176.35 176.90 3h4k h GLU 403 N 3.79 0.00 0.00 0.00 5.08 -1.93 -2.87 114.58 118.64 3h4k h GLU 403 Ca -0.47 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 57.86 3h4k h GLU 403 Cb 1.22 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 3h4k h GLU 403 CO 0.67 0.10 -0.14 1.79 -1.00 0.00 0.00 179.01 180.43 3h4k h THR 404 N 0.00 0.36 -0.45 1.13 1.35 -1.93 -3.19 112.91 110.17 3h4k h THR 404 Ca -0.00 -0.90 -0.07 0.00 -0.55 0.00 0.00 66.41 64.90 3h4k h THR 404 Cb 0.20 1.67 -0.02 0.00 -1.73 0.00 0.00 68.15 68.28 3h4k h THR 404 CO 0.01 0.14 0.01 0.58 -0.25 0.00 0.00 175.52 176.01 3h4k h VAL 405 N 0.00 1.23 0.00 6.82 2.07 -1.78 -3.47 116.25 121.11 3h4k h VAL 405 Ca -0.00 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.57 3h4k h VAL 405 Cb 0.66 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 3h4k h VAL 405 CO 0.02 0.33 0.00 0.61 0.02 0.00 0.00 177.57 178.55 3h4k n GLY 406 N -0.70 0.92 3.62 2.17 0.00 -1.21 -4.86 105.19 105.13 3h4k n GLY 406 Ca 0.02 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 3h4k n GLY 406 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h4k s VAL 407 N -2.00 4.41 0.13 1.61 1.01 -1.26 -4.39 120.40 119.92 3h4k s VAL 407 Ca 0.00 1.49 -0.30 0.00 0.00 0.00 0.00 61.98 63.17 3h4k s VAL 407 Cb 0.00 -4.47 -0.07 0.00 0.00 0.00 0.00 36.38 31.84 3h4k s VAL 407 CO 0.00 -0.67 1.13 -0.75 0.00 0.00 0.00 175.10 174.81 3h4k s LYS 408 N 3.91 4.53 0.09 2.72 2.20 -1.26 -5.00 119.74 126.93 3h4k s LYS 408 Ca 0.45 1.73 0.10 0.00 -0.36 0.00 0.00 55.97 57.89 3h4k s LYS 408 Cb -0.10 -3.30 -0.04 0.00 -1.51 0.00 0.00 37.83 32.88 3h4k s LYS 408 CO 0.21 -0.05 -0.24 -0.51 -0.36 0.00 0.00 175.35 174.41 3h4k s LEU 409 N 0.14 2.41 0.00 5.43 1.43 -1.26 -1.81 118.68 125.01 3h4k s LEU 409 Ca 0.53 -0.63 -0.02 0.00 -1.03 0.00 0.00 54.13 52.98 3h4k s LEU 409 Cb -0.29 -1.35 0.03 0.00 0.03 0.00 0.00 46.19 44.61 3h4k s LEU 409 CO 0.33 0.21 0.16 -0.90 0.23 0.00 0.00 176.35 176.38 3h4k n ASP 410 N 1.18 0.04 0.26 2.29 5.75 0.14 -4.88 116.55 121.33 3h4k n ASP 410 Ca -0.17 -1.08 0.08 0.00 -0.01 0.00 0.00 54.79 53.61 3h4k n ASP 410 Cb 0.53 -0.12 0.63 0.00 -1.03 0.00 0.00 41.12 41.12 3h4k n ASP 410 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 3h4k h LYS 411 N 0.00 0.00 -0.51 0.11 3.11 -2.02 -2.01 116.57 115.25 3h4k h LYS 411 Ca -0.05 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.79 3h4k h LYS 411 Cb 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.38 3h4k h LYS 411 CO 0.04 0.03 0.00 0.09 -2.81 0.00 0.00 179.45 176.80 3h4k n ASN 412 N -4.48 2.89 -0.20 4.20 5.03 -1.26 -4.93 115.26 116.51 3h4k n ASN 412 Ca -0.03 -1.98 -0.03 0.00 0.87 0.00 0.00 54.58 53.41 3h4k n ASN 412 Cb 0.11 -0.34 -0.01 0.00 -1.02 0.00 0.00 39.78 38.52 3h4k n ASN 412 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3h4k n GLY 413 N 1.37 0.59 3.91 7.41 0.00 -0.76 -4.71 105.19 113.01 3h4k n GLY 413 Ca 0.18 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 45.12 3h4k n GLY 413 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h4k s ARG 414 N -1.92 3.47 -0.04 1.61 0.52 -1.26 -4.72 118.95 116.62 3h4k s ARG 414 Ca 0.00 -0.36 -0.30 0.00 -0.52 0.00 0.00 55.73 54.55 3h4k s ARG 414 Cb 0.00 -3.02 -0.05 0.00 0.52 0.00 0.00 34.95 32.40 3h4k s ARG 414 CO 0.00 0.60 1.45 0.08 0.02 0.00 0.00 175.30 177.45 3h4k s VAL 415 N -1.50 3.74 -0.15 3.52 1.01 0.02 -0.68 120.40 126.35 3h4k s VAL 415 Ca 0.35 1.04 -0.29 0.00 0.00 0.00 0.00 61.98 63.07 3h4k s VAL 415 Cb -0.13 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 3h4k s VAL 415 CO 0.26 -0.04 1.19 -0.69 0.00 0.00 0.00 175.10 175.83 3h4k s VAL 416 N 2.98 4.37 0.24 2.92 1.01 -0.75 -1.73 120.40 129.44 3h4k s VAL 416 Ca 0.65 1.67 0.11 0.00 0.00 0.00 0.00 61.98 64.41 3h4k s VAL 416 Cb -0.31 -4.08 -0.05 0.00 0.00 0.00 0.00 36.38 31.95 3h4k s VAL 416 CO 0.26 -0.10 -0.19 0.00 0.00 0.00 0.00 175.10 175.06 3h4k n THR 418 N -0.32 0.00 1.22 0.00 -2.24 -0.58 -4.91 114.28 107.45 3h4k n THR 418 Ca -0.08 -0.81 0.11 0.00 -2.27 0.00 0.00 64.05 61.01 3h4k n THR 418 Cb 0.59 -1.51 0.62 0.00 -2.10 0.00 0.00 70.33 67.93 3h4k n THR 418 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3h4k n ASP 419 N -3.48 0.00 -0.61 3.42 5.75 -1.26 -2.13 116.55 118.24 3h4k n ASP 419 Ca 0.12 -0.31 0.06 0.00 -0.01 0.00 0.00 54.79 54.65 3h4k n ASP 419 Cb 0.42 -0.17 0.20 0.00 -1.03 0.00 0.00 41.12 40.53 3h4k n ASP 419 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 3h4k n ASP 420 N -1.17 2.62 -0.59 -1.12 5.75 -1.26 -4.65 116.55 116.12 3h4k n ASP 420 Ca 0.13 -3.38 -0.08 0.00 -0.01 0.00 0.00 54.79 51.45 3h4k n ASP 420 Cb 0.14 -0.52 -0.03 0.00 -1.03 0.00 0.00 41.12 39.68 3h4k n ASP 420 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3h4k n GLU 421 N -1.08 -1.06 -2.73 0.11 4.71 -0.90 -4.99 120.64 114.69 3h4k n GLU 421 Ca 0.22 0.70 -0.42 0.00 -0.01 0.00 0.00 57.16 57.64 3h4k n GLU 421 Cb 0.80 -4.71 -0.03 0.00 -1.01 0.00 0.00 31.44 26.49 3h4k n GLU 421 CO 0.00 0.00 0.00 -1.14 0.09 0.00 0.00 177.13 176.08 3h4k s GLN 422 N -2.35 4.55 0.85 3.49 0.74 -1.26 -1.73 119.66 123.95 3h4k s GLN 422 Ca 0.00 1.38 -0.14 0.00 0.05 0.00 0.00 55.36 56.65 3h4k s GLN 422 Cb 0.00 -3.46 0.20 0.00 1.10 0.00 0.00 33.01 30.85 3h4k s GLN 422 CO 0.00 -0.04 1.00 0.25 -0.55 0.00 0.00 175.29 175.94 3h4k n THR 423 N 3.89 0.00 0.42 -0.34 -2.24 -0.36 -1.53 114.28 114.13 3h4k n THR 423 Ca 0.06 -0.64 0.11 0.00 -2.27 0.00 0.00 64.05 61.30 3h4k n THR 423 Cb 0.51 -1.46 0.46 0.00 -2.10 0.00 0.00 70.33 67.74 3h4k n THR 423 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3h4k n THR 424 N -3.79 0.84 -3.66 4.28 -2.24 -1.26 -4.39 114.28 104.05 3h4k n THR 424 Ca 0.13 0.22 -0.36 0.00 -2.27 0.00 0.00 64.05 61.76 3h4k n THR 424 Cb 0.46 -1.11 -0.09 0.00 -2.10 0.00 0.00 70.33 67.49 3h4k n THR 424 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3h4k s VAL 425 N -3.26 5.36 0.39 2.28 1.01 -1.26 -4.95 120.40 119.96 3h4k s VAL 425 Ca 0.05 0.18 0.05 0.00 0.00 0.00 0.00 61.98 62.27 3h4k s VAL 425 Cb 0.09 -3.50 0.26 0.00 0.00 0.00 0.00 36.38 33.23 3h4k s VAL 425 CO 0.38 0.35 2.03 0.28 0.00 0.00 0.00 175.10 178.14 3h4k h SER 426 N 7.48 0.56 0.01 3.32 0.02 -1.99 -1.55 113.55 121.40 3h4k h SER 426 Ca -0.38 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 3h4k h SER 426 Cb 1.17 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.57 3h4k h SER 426 CO 0.66 0.42 -0.05 -0.46 -1.14 0.00 0.00 176.83 176.26 3h4k n ASN 427 N -4.45 1.81 -4.59 3.07 6.94 -1.26 -4.88 115.26 111.91 3h4k n ASN 427 Ca 0.04 -1.54 -0.34 0.00 -0.02 0.00 0.00 54.58 52.72 3h4k n ASN 427 Cb 0.07 0.04 -0.11 0.00 -2.36 0.00 0.00 39.78 37.42 3h4k n ASN 427 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3h4k s VAL 428 N -2.08 4.31 0.16 3.53 1.01 -0.58 -0.81 120.40 125.93 3h4k s VAL 428 Ca 0.33 -0.22 0.07 0.00 0.00 0.00 0.00 61.98 62.16 3h4k s VAL 428 Cb 0.20 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 3h4k s VAL 428 CO 0.36 0.51 -0.14 -0.31 0.00 0.00 0.00 175.10 175.51 3h4k s TYR 429 N 0.08 1.55 -0.02 5.22 2.02 0.20 -1.22 117.35 125.18 3h4k s TYR 429 Ca 0.02 -0.58 0.01 0.00 -0.37 0.00 0.00 57.07 56.16 3h4k s TYR 429 Cb -0.13 -0.77 0.01 0.00 -0.40 0.00 0.00 41.96 40.68 3h4k s TYR 429 CO 0.02 0.23 -0.04 0.00 -1.57 0.00 0.00 175.55 174.20 3h4k s ALA 430 N -2.56 0.48 0.20 3.71 0.00 -0.71 0.71 121.76 123.59 3h4k s ALA 430 Ca 0.15 -0.06 0.02 0.00 0.00 0.00 0.00 51.96 52.08 3h4k s ALA 430 Cb -0.03 -0.27 -0.05 0.00 0.00 0.00 0.00 23.12 22.78 3h4k s ALA 430 CO 0.04 0.02 0.02 0.96 0.00 0.00 0.00 175.76 176.80 3h4k s ILE 431 N 0.53 0.72 0.00 0.00 -4.36 -0.65 -4.77 121.20 112.67 3h4k s ILE 431 Ca -0.06 -1.99 0.00 0.00 -0.26 0.00 0.00 60.65 58.34 3h4k s ILE 431 Cb -0.09 -2.24 0.00 0.00 1.25 0.00 0.00 42.46 41.37 3h4k s ILE 431 CO -0.00 -0.37 0.00 0.61 0.24 0.00 0.00 174.94 175.41 3h4k n GLY 432 N -0.31 -0.26 0.28 6.27 0.00 -1.26 -4.09 105.19 105.82 3h4k n GLY 432 Ca -0.05 -1.18 0.13 0.00 0.00 0.00 0.00 46.02 44.92 3h4k n GLY 432 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3h4k h ASP 433 N 7.15 0.00 0.61 1.61 3.32 -1.91 -2.67 116.42 124.53 3h4k h ASP 433 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3h4k h ASP 433 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3h4k h ASP 433 CO 0.00 0.07 -0.09 2.30 -1.72 0.00 0.00 179.24 179.80 3h4k n ILE 434 N -3.76 0.00 -2.74 0.35 -5.35 -1.26 -4.74 119.36 101.86 3h4k n ILE 434 Ca -0.02 -0.02 -0.43 0.00 -0.27 0.00 0.00 62.75 62.01 3h4k n ILE 434 Cb 0.17 -0.28 -0.03 0.00 -1.74 0.00 0.00 39.64 37.75 3h4k n ILE 434 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 3h4k s ASN 435 N -2.70 6.54 0.26 7.28 3.84 -1.01 -0.80 114.94 128.35 3h4k s ASN 435 Ca 0.23 0.22 -0.29 0.00 0.21 0.00 0.00 52.86 53.22 3h4k s ASN 435 Cb 0.20 -2.49 -0.14 0.00 -0.55 0.00 0.00 41.25 38.27 3h4k s ASN 435 CO 0.51 -1.14 1.10 0.00 -2.79 0.00 0.00 177.10 174.79 3h4k n ALA 436 N 7.44 -0.10 -0.70 1.71 0.00 -0.71 -2.59 120.51 125.57 3h4k n ALA 436 Ca 0.08 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.93 3h4k n ALA 436 Cb 0.49 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.87 3h4k n ALA 436 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h4k n GLY 437 N 1.46 0.77 3.85 0.00 0.00 -1.26 -4.86 105.19 105.15 3h4k n GLY 437 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 3h4k n GLY 437 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h4k s LYS 438 N -0.34 3.89 0.13 1.61 -0.14 -1.07 -5.03 119.74 118.78 3h4k s LYS 438 Ca 0.00 0.36 -0.35 0.00 -1.36 0.00 0.00 55.97 54.62 3h4k s LYS 438 Cb 0.00 -2.97 -0.15 0.00 -1.68 0.00 0.00 37.83 33.03 3h4k s LYS 438 CO 0.00 0.52 1.47 -2.30 -0.76 0.00 0.00 175.35 174.28 3h4k n PRO 439 N 0.89 1.70 -3.13 -1.68 -0.02 -1.26 -4.89 135.00 126.60 3h4k n PRO 439 Ca -0.07 0.61 -0.45 0.00 -2.02 0.00 0.00 63.50 61.58 3h4k n PRO 439 Cb 0.52 -2.32 -0.00 0.00 -0.02 0.00 0.00 33.50 31.68 3h4k n PRO 439 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3h4k s GLN 440 N 0.69 4.12 0.03 -0.52 -0.21 -1.26 -4.85 119.66 117.66 3h4k s GLN 440 Ca 0.81 -2.85 -0.02 0.00 0.02 0.00 0.00 55.36 53.31 3h4k s GLN 440 Cb -0.80 -4.82 -0.02 0.00 1.00 0.00 0.00 33.01 28.37 3h4k s GLN 440 CO 0.42 -1.52 0.02 -0.51 -2.12 0.00 0.00 175.29 171.58 3h4k s LEU 441 N 0.28 2.11 0.10 2.90 1.43 -1.26 -5.03 118.68 119.22 3h4k s LEU 441 Ca 0.37 -0.60 -0.29 0.00 -1.03 0.00 0.00 54.13 52.58 3h4k s LEU 441 Cb -0.06 0.31 -0.12 0.00 0.03 0.00 0.00 46.19 46.36 3h4k s LEU 441 CO -0.04 -0.43 1.63 0.74 0.23 0.00 0.00 176.35 178.48 3h4k h THR 442 N 3.99 0.39 0.00 5.49 2.02 -2.00 -2.63 112.91 120.18 3h4k h THR 442 Ca -0.32 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 66.82 3h4k h THR 442 Cb 1.19 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 3h4k h THR 442 CO 0.49 0.00 -0.19 -0.65 0.37 0.00 0.00 175.52 175.55 3h4k h PRO 443 N -0.59 0.00 -0.26 6.66 0.11 -1.98 -0.89 132.00 135.05 3h4k h PRO 443 Ca -0.00 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.08 3h4k h PRO 443 Cb 0.55 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 3h4k h PRO 443 CO -0.08 0.19 0.07 0.28 -0.21 0.00 0.00 178.00 178.25 3h4k h VAL 444 N 0.00 1.21 -0.62 3.15 2.07 -1.88 0.31 116.25 120.48 3h4k h VAL 444 Ca -0.00 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 66.83 3h4k h VAL 444 Cb 0.49 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 3h4k h VAL 444 CO 0.02 0.22 0.29 0.00 0.02 0.00 0.00 177.57 178.12 3h4k h ALA 445 N 0.90 1.35 0.08 1.67 0.00 -0.95 -0.50 119.26 121.82 3h4k h ALA 445 Ca 0.08 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3h4k h ALA 445 Cb 0.26 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3h4k h ALA 445 CO -0.00 0.50 -0.04 0.82 0.00 0.00 0.00 179.25 180.54 3h4k h ILE 446 N 0.87 1.17 -0.27 0.00 2.04 -1.00 -1.09 117.51 119.23 3h4k h ILE 446 Ca 0.22 -0.98 0.01 0.00 1.00 0.00 0.00 64.86 65.11 3h4k h ILE 446 Cb 0.10 1.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 3h4k h ILE 446 CO -0.03 0.24 0.14 -0.61 0.00 0.00 0.00 178.15 177.89 3h4k h GLN 447 N -0.56 0.29 0.02 2.37 5.75 -0.89 -0.30 115.11 121.79 3h4k h GLN 447 Ca -0.01 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.50 3h4k h GLN 447 Cb 0.47 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 28.91 3h4k h GLN 447 CO 0.02 0.19 -0.32 0.00 -2.65 0.00 0.00 178.83 176.06 3h4k h ALA 448 N 1.13 -0.49 -0.11 3.38 0.00 -1.11 -0.93 119.26 121.13 3h4k h ALA 448 Ca 0.11 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.00 3h4k h ALA 448 Cb 0.02 0.57 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 3h4k h ALA 448 CO -0.07 -0.84 0.04 0.78 0.00 0.00 0.00 179.25 179.16 3h4k h GLY 449 N -0.49 0.13 0.93 0.00 0.00 -1.00 -0.59 103.07 102.05 3h4k h GLY 449 Ca 0.05 -0.03 -0.00 0.00 0.00 0.00 0.00 47.33 47.36 3h4k h GLY 449 CO -0.25 0.02 0.03 3.21 0.00 0.00 0.00 176.54 179.55 3h4k h ARG 450 N 0.10 0.09 -0.59 4.80 3.08 -0.99 -1.77 114.38 119.10 3h4k h ARG 450 Ca 0.05 -0.01 -0.07 0.00 0.07 0.00 0.00 59.98 60.01 3h4k h ARG 450 Cb 0.02 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3h4k h ARG 450 CO -0.04 0.14 0.08 1.88 -1.07 0.00 0.00 179.97 180.96 3h4k h TYR 451 N 0.01 1.05 -0.36 3.04 -1.99 -1.11 -1.50 116.97 116.11 3h4k h TYR 451 Ca 0.02 -0.15 0.02 0.00 2.00 0.00 0.00 58.73 60.62 3h4k h TYR 451 Cb 0.08 -0.28 -0.03 0.00 2.00 0.00 0.00 36.73 38.50 3h4k h TYR 451 CO -0.05 0.91 0.20 1.25 -0.00 0.00 0.00 178.16 180.48 3h4k h LEU 452 N 0.88 0.32 -1.40 3.88 5.85 -1.06 -1.14 115.31 122.64 3h4k h LEU 452 Ca 0.18 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.90 3h4k h LEU 452 Cb 0.44 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 3h4k h LEU 452 CO 0.01 0.23 0.37 0.00 -0.34 0.00 0.00 178.44 178.72 3h4k h ALA 453 N 1.17 1.56 -0.42 1.25 0.00 -1.04 -0.58 119.26 121.19 3h4k h ALA 453 Ca 0.14 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 3h4k h ALA 453 Cb 0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3h4k h ALA 453 CO -0.08 0.40 -0.25 0.00 0.00 0.00 0.00 179.25 179.33 3h4k h ARG 454 N 0.80 0.87 -0.28 0.00 3.08 -0.80 -2.12 114.38 115.93 3h4k h ARG 454 Ca 0.21 -0.38 -0.12 0.00 0.07 0.00 0.00 59.98 59.76 3h4k h ARG 454 Cb -0.07 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 29.95 3h4k h ARG 454 CO -0.04 1.02 -0.31 0.00 -1.07 0.00 0.00 179.97 179.57 3h4k h ARG 455 N 0.75 0.70 -0.31 0.04 3.08 -0.63 -1.21 114.38 116.81 3h4k h ARG 455 Ca 0.09 -0.38 -0.05 0.00 0.07 0.00 0.00 59.98 59.71 3h4k h ARG 455 Cb 0.80 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.85 3h4k h ARG 455 CO 0.07 1.00 -0.02 -0.07 -1.07 0.00 0.00 179.97 179.88 3h4k h LEU 456 N 0.44 0.55 -0.61 3.04 3.38 -1.11 -3.28 115.31 117.73 3h4k h LEU 456 Ca 0.04 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3h4k h LEU 456 Cb 0.88 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.48 3h4k h LEU 456 CO 0.07 0.74 0.00 0.49 0.09 0.00 0.00 178.44 179.84 3h4k n PHE 457 N -4.53 0.00 -0.35 1.13 3.72 -0.80 -2.88 117.46 113.75 3h4k n PHE 457 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 3h4k n PHE 457 Cb 0.28 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.82 3h4k n PHE 457 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3h4k n ALA 458 N -0.35 1.64 -1.47 4.37 0.00 -0.50 -4.59 120.51 119.62 3h4k n ALA 458 Ca 0.00 -0.71 -0.13 0.00 0.00 0.00 0.00 53.44 52.60 3h4k n ALA 458 Cb 0.01 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 3h4k n ALA 458 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h4k n GLY 459 N -0.25 1.27 3.80 0.00 0.00 -1.01 -4.90 105.19 104.10 3h4k n GLY 459 Ca 0.00 -0.39 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 3h4k n GLY 459 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4k s ALA 460 N -2.52 2.50 -0.03 4.61 0.00 -0.91 -4.97 121.76 120.44 3h4k s ALA 460 Ca 0.00 0.15 0.01 0.00 0.00 0.00 0.00 51.96 52.12 3h4k s ALA 460 Cb 0.00 -3.21 -0.02 0.00 0.00 0.00 0.00 23.12 19.89 3h4k s ALA 460 CO 0.00 -1.45 0.05 0.25 0.00 0.00 0.00 175.76 174.60 3h4k n THR 461 N -3.29 0.00 -1.98 0.00 -2.24 -1.26 -4.29 114.28 101.21 3h4k n THR 461 Ca 0.08 -0.24 -0.42 0.00 -2.27 0.00 0.00 64.05 61.19 3h4k n THR 461 Cb 0.53 0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 69.46 3h4k n THR 461 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3h4k s GLU 462 N -1.63 4.21 0.40 -0.78 2.12 -1.26 -5.01 118.70 116.75 3h4k s GLU 462 Ca -0.00 2.26 -0.02 0.00 0.36 0.00 0.00 54.97 57.57 3h4k s GLU 462 Cb 0.01 -3.62 -0.03 0.00 0.26 0.00 0.00 34.13 30.75 3h4k s GLU 462 CO 0.06 -0.71 0.65 -0.51 -0.54 0.00 0.00 175.26 174.20 3h4k s LEU 463 N 2.68 3.86 0.03 2.70 1.43 -1.26 -4.83 118.68 123.28 3h4k s LEU 463 Ca 0.72 0.65 -0.30 0.00 -1.03 0.00 0.00 54.13 54.18 3h4k s LEU 463 Cb -0.38 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.25 3h4k s LEU 463 CO 0.31 -0.41 1.00 -0.89 0.23 0.00 0.00 176.35 176.59 3h4k s THR 464 N -2.49 4.73 -0.29 5.49 2.01 -1.26 -5.04 115.64 118.80 3h4k s THR 464 Ca 0.43 2.01 -0.19 0.00 0.31 0.00 0.00 61.69 64.25 3h4k s THR 464 Cb -0.10 -4.29 -0.02 0.00 0.01 0.00 0.00 72.50 68.11 3h4k s THR 464 CO 0.39 0.19 0.56 -0.62 -0.69 0.00 0.00 174.62 174.45 3h4k s ASP 465 N 0.82 6.45 0.00 3.53 -1.08 -1.26 -4.95 116.67 120.18 3h4k s ASP 465 Ca 0.52 0.44 0.23 0.00 -0.52 0.00 0.00 52.55 53.22 3h4k s ASP 465 Cb -0.22 -2.30 0.09 0.00 -1.46 0.00 0.00 42.92 39.02 3h4k s ASP 465 CO 0.29 -0.38 1.16 -1.22 0.52 0.00 0.00 175.17 175.53 3h4k n TYR 466 N 5.69 0.00 -3.02 -5.34 4.01 -1.26 -4.91 117.16 112.33 3h4k n TYR 466 Ca -0.03 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.37 3h4k n TYR 466 Cb 0.49 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.46 3h4k n TYR 466 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 3h4k s SER 467 N -2.21 6.94 -1.33 7.72 1.04 -1.26 -4.19 113.70 120.41 3h4k s SER 467 Ca 0.23 1.46 -0.03 0.00 0.48 0.00 0.00 55.95 58.09 3h4k s SER 467 Cb 0.19 -2.44 0.02 0.00 0.10 0.00 0.00 66.02 63.88 3h4k s SER 467 CO 0.43 -0.17 0.22 0.59 0.98 0.00 0.00 173.24 175.29 3h4k n ASN 468 N -0.09 -4.63 -4.67 7.02 5.03 -1.26 -4.93 115.26 111.73 3h4k n ASN 468 Ca 0.03 -0.06 -0.42 0.00 0.87 0.00 0.00 54.58 55.00 3h4k n ASN 468 Cb 0.53 -3.85 -0.03 0.00 -1.02 0.00 0.00 39.78 35.41 3h4k n ASN 468 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3h4k s VAL 469 N -2.86 3.51 0.37 2.41 1.01 -1.26 -4.56 120.40 119.02 3h4k s VAL 469 Ca 0.14 0.79 -0.25 0.00 0.00 0.00 0.00 61.98 62.67 3h4k s VAL 469 Cb -0.07 -3.51 -0.09 0.00 0.00 0.00 0.00 36.38 32.71 3h4k s VAL 469 CO 0.18 -0.04 1.03 0.00 0.00 0.00 0.00 175.10 176.27 3h4k s ALA 470 N 3.23 3.14 0.20 5.51 0.00 -1.26 -4.56 121.76 128.02 3h4k s ALA 470 Ca 0.70 0.67 0.08 0.00 0.00 0.00 0.00 51.96 53.41 3h4k s ALA 470 Cb -0.34 -3.25 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 3h4k s ALA 470 CO 0.29 -0.11 -0.16 0.95 0.00 0.00 0.00 175.76 176.72 3h4k s THR 471 N -1.63 1.82 -0.08 0.00 -4.23 0.66 -5.00 115.64 107.18 3h4k s THR 471 Ca 0.55 -2.16 -0.03 0.00 -1.18 0.00 0.00 61.69 58.87 3h4k s THR 471 Cb -0.22 -2.01 0.04 0.00 1.34 0.00 0.00 72.50 71.65 3h4k s THR 471 CO 0.27 -0.51 0.12 -0.89 -0.54 0.00 0.00 174.62 173.08 3h4k s THR 472 N -2.71 -0.20 -0.34 3.99 2.01 -1.26 -1.01 115.64 116.12 3h4k s THR 472 Ca 0.21 0.31 -0.25 0.00 0.31 0.00 0.00 61.69 62.28 3h4k s THR 472 Cb -0.02 -0.29 0.01 0.00 0.01 0.00 0.00 72.50 72.21 3h4k s THR 472 CO 0.08 0.11 0.88 -0.69 -0.69 0.00 0.00 174.62 174.30 3h4k s VAL 473 N 2.24 4.67 -1.05 3.82 1.01 0.63 -4.94 120.40 126.78 3h4k s VAL 473 Ca 0.04 1.22 -0.06 0.00 0.00 0.00 0.00 61.98 63.18 3h4k s VAL 473 Cb -0.13 -4.26 0.02 0.00 0.00 0.00 0.00 36.38 32.01 3h4k s VAL 473 CO -0.05 -0.42 2.73 0.49 0.00 0.00 0.00 175.10 177.85 3h4k n PHE 474 N 6.54 2.05 -1.78 5.22 3.72 -1.26 -1.23 117.46 130.72 3h4k n PHE 474 Ca 0.06 -2.54 -0.29 0.00 -0.05 0.00 0.00 57.45 54.63 3h4k n PHE 474 Cb 0.48 -1.84 0.08 0.00 -0.94 0.00 0.00 39.48 37.26 3h4k n PHE 474 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3h4k s THR 475 N -0.49 2.67 0.28 4.37 -4.23 -1.26 -4.72 115.64 112.25 3h4k s THR 475 Ca 0.60 0.22 -0.07 0.00 -1.18 0.00 0.00 61.69 61.25 3h4k s THR 475 Cb 0.24 -3.13 0.45 0.00 1.34 0.00 0.00 72.50 71.40 3h4k s THR 475 CO -0.11 -0.28 1.56 -0.65 -0.54 0.00 0.00 174.62 174.60 3h4k h PRO 476 N -1.00 0.00 -4.81 3.99 0.11 -1.87 -2.86 132.00 125.56 3h4k h PRO 476 Ca -0.46 -0.00 -0.67 0.00 0.11 0.00 0.00 66.00 64.98 3h4k h PRO 476 Cb 1.29 -0.00 -0.21 0.00 0.11 0.00 0.00 31.00 32.20 3h4k h PRO 476 CO 0.64 0.00 -0.54 -1.17 -0.21 0.00 0.00 178.00 176.71 3h4k s LEU 477 N -11.23 4.08 0.42 2.35 2.96 -1.26 -5.00 118.68 111.00 3h4k s LEU 477 Ca -0.15 -0.37 -0.25 0.00 -0.22 0.00 0.00 54.13 53.15 3h4k s LEU 477 Cb 0.27 -2.04 -0.08 0.00 0.50 0.00 0.00 46.19 44.84 3h4k s LEU 477 CO 0.78 -0.15 1.21 -1.61 -1.32 0.00 0.00 176.35 175.25 3h4k s GLU 478 N 1.66 3.91 -0.23 1.98 2.02 -1.08 -4.78 118.70 122.18 3h4k s GLU 478 Ca 0.06 1.91 0.02 0.00 0.02 0.00 0.00 54.97 56.98 3h4k s GLU 478 Cb -0.17 -2.60 0.05 0.00 0.10 0.00 0.00 34.13 31.51 3h4k s GLU 478 CO 0.08 -0.46 -0.10 -0.47 0.02 0.00 0.00 175.26 174.32 3h4k s TYR 479 N -1.41 2.84 -0.16 1.61 5.04 -0.37 -1.10 117.35 123.81 3h4k s TYR 479 Ca 0.59 -1.98 -0.06 0.00 -2.44 0.00 0.00 57.07 53.19 3h4k s TYR 479 Cb -0.32 -1.78 -0.04 0.00 0.35 0.00 0.00 41.96 40.17 3h4k s TYR 479 CO 0.40 -0.82 0.03 0.20 -1.34 0.00 0.00 175.55 174.03 3h4k s GLY 480 N 1.25 1.86 0.08 8.97 0.00 0.62 -0.27 107.32 119.85 3h4k s GLY 480 Ca -0.05 -0.76 0.04 0.00 0.00 0.00 0.00 44.72 43.94 3h4k s GLY 480 CO -0.07 -0.06 -0.11 0.00 0.00 0.00 0.00 173.10 172.86 3h4k s ALA 481 N 0.16 1.07 -0.26 3.20 0.00 -0.18 -0.48 121.76 125.28 3h4k s ALA 481 Ca 0.03 -1.08 -0.02 0.00 0.00 0.00 0.00 51.96 50.89 3h4k s ALA 481 Cb -0.13 -0.01 0.15 0.00 0.00 0.00 0.00 23.12 23.13 3h4k s ALA 481 CO 0.01 0.03 0.42 0.00 0.00 0.00 0.00 175.76 176.22 3h4k n GLY 483 N 5.38 0.05 3.82 0.00 0.00 -1.26 -0.43 105.19 112.74 3h4k n GLY 483 Ca -0.03 -2.05 -0.35 0.00 0.00 0.00 0.00 46.02 43.59 3h4k n GLY 483 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h4k s LEU 484 N 0.00 4.22 0.91 0.99 1.43 -0.53 -4.89 118.68 120.81 3h4k s LEU 484 Ca 0.00 1.50 -0.12 0.00 -1.03 0.00 0.00 54.13 54.48 3h4k s LEU 484 Cb 0.00 -3.91 0.14 0.00 0.03 0.00 0.00 46.19 42.45 3h4k s LEU 484 CO 0.00 -0.10 1.09 -0.94 0.23 0.00 0.00 176.35 176.64 3h4k s SER 485 N -1.86 3.32 0.12 2.29 1.04 -1.26 -4.16 113.70 113.19 3h4k s SER 485 Ca 0.50 1.44 -0.17 0.00 0.48 0.00 0.00 55.95 58.20 3h4k s SER 485 Cb -0.14 -2.12 -0.03 0.00 0.10 0.00 0.00 66.02 63.83 3h4k s SER 485 CO 0.20 -2.73 1.65 -0.08 0.98 0.00 0.00 173.24 173.25 3h4k h GLU 486 N -1.61 0.53 -0.31 4.02 4.81 -1.97 -1.93 114.58 118.11 3h4k h GLU 486 Ca -0.50 -0.11 -0.04 0.00 -0.13 0.00 0.00 59.36 58.57 3h4k h GLU 486 Cb 1.29 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.57 3h4k h GLU 486 CO 0.55 0.55 0.00 1.05 -0.73 0.00 0.00 179.01 180.43 3h4k h GLU 487 N 0.41 0.48 -0.21 1.92 9.09 -1.99 -1.53 114.58 122.75 3h4k h GLU 487 Ca 0.11 -0.10 -0.16 0.00 0.05 0.00 0.00 59.36 59.26 3h4k h GLU 487 Cb 0.23 -0.07 0.00 0.00 -1.65 0.00 0.00 28.75 27.26 3h4k h GLU 487 CO -0.01 0.50 -0.51 -0.44 0.05 0.00 0.00 179.01 178.61 3h4k h ASP 488 N 0.46 0.81 -0.63 3.06 3.32 -1.90 -1.97 116.42 119.57 3h4k h ASP 488 Ca 0.10 -0.57 -0.09 0.00 0.02 0.00 0.00 57.03 56.50 3h4k h ASP 488 Cb 0.30 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 3h4k h ASP 488 CO 0.01 1.23 0.05 0.00 -1.72 0.00 0.00 179.24 178.81 3h4k h ALA 489 N 0.60 0.84 -0.43 3.45 0.00 -1.21 -1.04 119.26 121.48 3h4k h ALA 489 Ca -0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 3h4k h ALA 489 Cb 1.12 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 3h4k h ALA 489 CO 0.11 0.64 0.13 0.82 0.00 0.00 0.00 179.25 180.95 3h4k h ILE 490 N 0.98 1.22 -0.62 0.00 2.04 -1.32 -1.93 117.51 117.88 3h4k h ILE 490 Ca 0.18 -0.74 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 3h4k h ILE 490 Cb 0.50 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 3h4k h ILE 490 CO 0.02 0.26 0.33 -0.08 0.00 0.00 0.00 178.15 178.69 3h4k h GLU 491 N 0.55 0.88 -0.04 2.37 4.81 -1.21 0.28 114.58 122.22 3h4k h GLU 491 Ca 0.14 -0.11 -0.18 0.00 -0.13 0.00 0.00 59.36 59.08 3h4k h GLU 491 Cb 0.27 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 3h4k h GLU 491 CO -0.00 0.68 -0.75 -0.22 -0.73 0.00 0.00 179.01 177.99 3h4k h LYS 492 N 0.85 0.25 0.00 1.92 3.64 -1.08 -3.38 116.57 118.77 3h4k h LYS 492 Ca 0.22 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3h4k h LYS 492 Cb 0.06 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 3h4k h LYS 492 CO -0.03 0.88 -0.65 0.66 -2.27 0.00 0.00 179.45 178.04 3h4k n TYR 493 N -3.77 0.00 0.00 1.91 4.02 -0.74 -5.10 117.16 113.48 3h4k n TYR 493 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 3h4k n TYR 493 Cb 0.72 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.04 3h4k n TYR 493 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3h4k n GLY 494 N 1.87 2.19 0.36 2.72 0.00 0.98 -4.59 105.19 108.72 3h4k n GLY 494 Ca 0.00 -1.61 0.10 0.00 0.00 0.00 0.00 46.02 44.51 3h4k n GLY 494 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3h4k h ASP 495 N 0.00 0.55 1.10 1.61 3.58 -1.92 -1.79 116.42 119.55 3h4k h ASP 495 Ca 0.00 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.46 3h4k h ASP 495 Cb 0.00 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 40.95 3h4k h ASP 495 CO 0.00 0.33 0.00 0.11 -2.88 0.00 0.00 179.24 176.80 3h4k h LYS 496 N 0.61 0.00 -0.02 0.28 1.57 -1.94 -3.04 116.57 114.03 3h4k h LYS 496 Ca 0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 3h4k h LYS 496 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.79 3h4k h LYS 496 CO -0.11 0.00 -0.30 -3.47 -0.57 0.00 0.00 179.45 175.00 3h4k n ASP 497 N -2.36 2.27 -4.45 0.86 2.03 -0.68 -4.92 116.55 109.29 3h4k n ASP 497 Ca 0.03 -1.63 -0.35 0.00 0.52 0.00 0.00 54.79 53.36 3h4k n ASP 497 Cb 0.33 0.32 -0.12 0.00 -0.72 0.00 0.00 41.12 40.92 3h4k n ASP 497 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3h4k s ILE 498 N -2.20 4.08 -0.15 5.18 -1.09 -1.15 -0.28 121.20 125.60 3h4k s ILE 498 Ca 0.20 -0.26 -0.00 0.00 -2.23 0.00 0.00 60.65 58.36 3h4k s ILE 498 Cb 0.18 -2.87 -0.01 0.00 -1.58 0.00 0.00 42.46 38.18 3h4k s ILE 498 CO 0.45 0.40 -0.14 -0.70 -1.23 0.00 0.00 174.94 173.72 3h4k s GLU 499 N 1.19 3.28 -0.30 2.79 2.56 -0.43 -4.95 118.70 122.83 3h4k s GLU 499 Ca 0.03 -0.72 -0.02 0.00 0.00 0.00 0.00 54.97 54.26 3h4k s GLU 499 Cb -0.14 -2.65 0.05 0.00 2.00 0.00 0.00 34.13 33.38 3h4k s GLU 499 CO 0.02 0.06 0.01 0.08 -0.56 0.00 0.00 175.26 174.87 3h4k s VAL 500 N 0.71 3.07 -0.00 3.70 1.01 -1.26 -0.92 120.40 126.71 3h4k s VAL 500 Ca -0.06 -1.36 -0.20 0.00 0.00 0.00 0.00 61.98 60.36 3h4k s VAL 500 Cb -0.15 -2.76 -0.05 0.00 0.00 0.00 0.00 36.38 33.41 3h4k s VAL 500 CO 0.02 -0.11 0.57 -0.31 0.00 0.00 0.00 175.10 175.27 3h4k s TYR 501 N 1.27 3.69 0.09 5.22 2.02 -0.71 -1.28 117.35 127.65 3h4k s TYR 501 Ca -0.05 1.17 -0.14 0.00 -0.37 0.00 0.00 57.07 57.69 3h4k s TYR 501 Cb -0.20 -2.58 0.02 0.00 -0.40 0.00 0.00 41.96 38.81 3h4k s TYR 501 CO -0.01 0.38 0.32 -3.38 -1.57 0.00 0.00 175.55 171.29 3h4k s HIS 502 N -0.27 -0.09 -0.28 2.71 -3.43 -0.35 -0.21 115.29 113.37 3h4k s HIS 502 Ca 0.30 -0.20 -0.21 0.00 -0.80 0.00 0.00 55.06 54.15 3h4k s HIS 502 Cb -0.18 0.13 0.08 0.00 -1.43 0.00 0.00 32.58 31.19 3h4k s HIS 502 CO 0.17 -0.61 0.76 0.45 -2.00 0.00 0.00 174.74 173.50 3h4k s SER 503 N -2.61 -0.78 0.55 7.38 0.15 -0.79 -4.33 113.70 113.27 3h4k s SER 503 Ca 0.01 1.38 -0.17 0.00 0.70 0.00 0.00 55.95 57.87 3h4k s SER 503 Cb 0.02 1.37 -0.05 0.00 -1.71 0.00 0.00 66.02 65.64 3h4k s SER 503 CO -0.09 -0.23 1.05 0.20 1.20 0.00 0.00 173.24 175.37 3h4k s ASN 504 N 0.92 6.02 0.28 5.45 -0.87 0.10 -2.20 114.94 124.64 3h4k s ASN 504 Ca -0.04 1.84 -0.15 0.00 -1.57 0.00 0.00 52.86 52.94 3h4k s ASN 504 Cb -0.05 -2.54 0.01 0.00 -0.02 0.00 0.00 41.25 38.65 3h4k s ASN 504 CO -0.09 -1.00 0.59 0.72 -2.57 0.00 0.00 177.10 174.74 3h4k s PHE 505 N -2.31 0.22 -0.03 2.20 -0.71 0.16 -4.43 117.98 113.10 3h4k s PHE 505 Ca 0.65 -0.64 0.00 0.00 -1.04 0.00 0.00 56.93 55.90 3h4k s PHE 505 Cb -0.16 0.40 0.02 0.00 -1.21 0.00 0.00 43.02 42.07 3h4k s PHE 505 CO 0.31 -1.14 -0.00 0.21 -1.34 0.00 0.00 175.22 173.26 3h4k s LYS 506 N -3.72 0.27 0.40 1.99 2.20 -1.26 -3.15 119.74 116.45 3h4k s LYS 506 Ca 0.19 0.06 -0.27 0.00 -0.36 0.00 0.00 55.97 55.59 3h4k s LYS 506 Cb -0.03 -0.43 -0.10 0.00 -1.51 0.00 0.00 37.83 35.77 3h4k s LYS 506 CO 0.10 -0.11 1.41 -2.14 -0.36 0.00 0.00 175.35 174.25 3h4k s PRO 507 N 0.89 4.00 0.43 4.03 0.02 -1.26 -4.89 135.00 138.22 3h4k s PRO 507 Ca -0.09 2.41 0.14 0.00 0.02 0.00 0.00 61.00 63.49 3h4k s PRO 507 Cb -0.12 -2.86 1.04 0.00 0.02 0.00 0.00 34.50 32.58 3h4k s PRO 507 CO -0.02 -0.56 1.97 1.25 -0.33 0.00 0.00 177.00 179.31 3h4k h LEU 508 N 2.81 0.37 -2.13 -5.54 5.85 -1.95 -1.35 115.31 113.36 3h4k h LEU 508 Ca -0.50 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.22 3h4k h LEU 508 Cb 1.25 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.21 3h4k h LEU 508 CO 0.63 0.21 -0.01 -0.33 -0.34 0.00 0.00 178.44 178.60 3h4k h GLU 509 N 0.40 0.00 0.00 1.25 3.07 -2.00 -2.64 114.58 114.67 3h4k h GLU 509 Ca 0.29 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 3h4k h GLU 509 Cb 0.60 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.51 3h4k h GLU 509 CO -0.08 0.01 -0.46 0.91 -1.40 0.00 0.00 179.01 177.99 3h4k n TRP 510 N -3.15 0.07 0.20 4.33 7.02 -0.51 -3.72 117.44 121.68 3h4k n TRP 510 Ca -0.01 0.02 -0.12 0.00 -1.02 0.00 0.00 57.50 56.37 3h4k n TRP 510 Cb 0.20 -0.33 -0.06 0.00 -2.42 0.00 0.00 31.31 28.70 3h4k n TRP 510 CO 0.00 0.00 0.00 1.79 -2.02 0.00 0.00 177.69 177.46 3h4k h THR 511 N 0.00 0.34 -0.26 -0.99 1.35 -1.53 -1.51 112.91 110.30 3h4k h THR 511 Ca 0.00 -0.62 -0.08 0.00 -0.55 0.00 0.00 66.41 65.16 3h4k h THR 511 Cb 0.53 0.52 -0.01 0.00 -1.73 0.00 0.00 68.15 67.46 3h4k h THR 511 CO 0.00 0.07 -0.20 0.58 -0.25 0.00 0.00 175.52 175.72 3h4k h VAL 512 N -1.02 1.25 0.00 6.82 2.07 -1.75 -2.76 116.25 120.86 3h4k h VAL 512 Ca -0.06 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.31 3h4k h VAL 512 Cb 0.54 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 3h4k h VAL 512 CO 0.09 0.37 0.00 0.00 0.02 0.00 0.00 177.57 178.05 3h4k n ALA 513 N -2.48 2.08 -3.60 1.67 0.00 -1.22 -4.81 120.51 112.14 3h4k n ALA 513 Ca -0.00 -0.10 -0.20 0.00 0.00 0.00 0.00 53.44 53.14 3h4k n ALA 513 Cb 0.37 -1.33 0.06 0.00 0.00 0.00 0.00 19.45 18.55 3h4k n ALA 513 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3h4k n HIS 514 N -1.26 -2.06 -3.52 0.00 8.25 -0.85 -4.91 115.22 110.88 3h4k n HIS 514 Ca 0.10 0.89 -0.20 0.00 -0.26 0.00 0.00 57.72 58.25 3h4k n HIS 514 Cb 0.15 -4.66 -0.01 0.00 1.12 0.00 0.00 29.99 26.60 3h4k n HIS 514 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3h4k s ARG 515 N -5.78 3.19 0.28 -0.41 0.52 -0.63 -5.05 118.95 111.07 3h4k s ARG 515 Ca 0.04 -0.89 -0.30 0.00 -0.52 0.00 0.00 55.73 54.07 3h4k s ARG 515 Cb -0.02 -2.80 -0.11 0.00 0.52 0.00 0.00 34.95 32.54 3h4k s ARG 515 CO 0.78 0.10 1.51 -1.21 0.02 0.00 0.00 175.30 176.50 3h4k s GLU 516 N -4.18 4.19 0.55 3.54 8.01 -1.26 -4.86 118.70 124.69 3h4k s GLU 516 Ca 0.43 2.44 -0.18 0.00 0.01 0.00 0.00 54.97 57.67 3h4k s GLU 516 Cb -0.09 -3.06 -0.05 0.00 -4.31 0.00 0.00 34.13 26.61 3h4k s GLU 516 CO 0.31 -0.51 1.08 -0.51 0.01 0.00 0.00 175.26 175.64 3h4k s ASP 517 N 0.36 5.86 -1.38 -0.19 1.01 -1.26 -4.23 116.67 116.84 3h4k s ASP 517 Ca 0.60 1.99 -0.09 0.00 0.71 0.00 0.00 52.55 55.76 3h4k s ASP 517 Cb -0.45 -2.56 0.02 0.00 1.01 0.00 0.00 42.92 40.95 3h4k s ASP 517 CO 0.47 -1.12 1.13 0.59 0.21 0.00 0.00 175.17 176.45 3h4k n ASN 518 N -1.51 -5.68 -0.13 0.27 3.02 -1.26 -4.90 115.26 105.08 3h4k n ASN 518 Ca 0.10 -0.60 -0.18 0.00 -0.03 0.00 0.00 54.58 53.88 3h4k n ASN 518 Cb 0.52 -4.81 -0.12 0.00 -0.61 0.00 0.00 39.78 34.76 3h4k n ASN 518 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3h4k n VAL 519 N -4.88 1.46 -2.50 2.41 0.31 -1.26 -4.91 118.33 108.97 3h4k n VAL 519 Ca -0.01 -0.56 -0.42 0.00 -0.01 0.00 0.00 64.34 63.33 3h4k n VAL 519 Cb 0.56 -1.39 -0.03 0.00 -0.91 0.00 0.00 33.84 32.08 3h4k n VAL 519 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h4k s TYR 521 N 0.98 0.62 0.02 0.00 5.04 -0.93 -0.66 117.35 122.41 3h4k s TYR 521 Ca 0.57 -0.16 -0.02 0.00 -2.44 0.00 0.00 57.07 55.02 3h4k s TYR 521 Cb -0.27 -0.39 -0.02 0.00 0.35 0.00 0.00 41.96 41.63 3h4k s TYR 521 CO 0.29 -0.02 0.00 0.00 -1.34 0.00 0.00 175.55 174.49 3h4k s MET 522 N -0.35 0.39 0.03 4.97 0.23 -0.94 0.06 119.30 123.70 3h4k s MET 522 Ca 0.01 -0.68 -0.12 0.00 -1.03 0.00 0.00 55.69 53.88 3h4k s MET 522 Cb -0.04 0.14 0.01 0.00 -1.53 0.00 0.00 34.83 33.42 3h4k s MET 522 CO -0.00 -0.07 0.25 -1.59 -2.03 0.00 0.00 175.02 171.58 3h4k s LYS 523 N -1.87 0.72 -0.20 3.16 -2.85 -0.14 -1.88 119.74 116.68 3h4k s LYS 523 Ca -0.12 -0.49 0.01 0.00 -1.00 0.00 0.00 55.97 54.37 3h4k s LYS 523 Cb -0.07 0.31 0.03 0.00 -2.06 0.00 0.00 37.83 36.04 3h4k s LYS 523 CO -0.02 -0.21 -0.16 -0.51 0.10 0.00 0.00 175.35 174.54 3h4k s LEU 524 N -1.89 2.50 -0.16 2.77 1.43 0.70 -1.84 118.68 122.20 3h4k s LEU 524 Ca -0.07 -0.80 -0.22 0.00 -1.03 0.00 0.00 54.13 52.01 3h4k s LEU 524 Cb -0.02 -1.52 -0.03 0.00 0.03 0.00 0.00 46.19 44.65 3h4k s LEU 524 CO -0.02 -0.05 0.68 -0.69 0.23 0.00 0.00 176.35 176.50 3h4k s VAL 525 N 1.27 5.01 0.09 -1.59 1.01 0.20 -1.73 120.40 124.65 3h4k s VAL 525 Ca 0.02 1.33 0.05 0.00 0.00 0.00 0.00 61.98 63.37 3h4k s VAL 525 Cb -0.15 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.20 3h4k s VAL 525 CO -0.10 0.14 -0.13 0.00 0.00 0.00 0.00 175.10 175.01 3h4k s ARG 527 N -2.20 3.22 0.21 0.00 3.52 -0.06 -1.31 118.95 122.34 3h4k s ARG 527 Ca 0.02 -0.81 -0.09 0.00 -0.13 0.00 0.00 55.73 54.71 3h4k s ARG 527 Cb -0.07 -3.70 0.17 0.00 -1.56 0.00 0.00 34.95 29.79 3h4k s ARG 527 CO 0.02 -0.52 1.85 0.87 -0.81 0.00 0.00 175.30 176.70 3h4k h LYS 528 N 8.43 1.10 0.00 5.12 1.57 -0.97 -2.11 116.57 129.71 3h4k h LYS 528 Ca -0.30 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 3h4k h LYS 528 Cb 1.14 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.22 3h4k h LYS 528 CO 0.64 0.79 0.00 -1.13 -0.57 0.00 0.00 179.45 179.18 3h4k n SER 529 N -4.45 0.00 -2.92 0.86 3.41 -1.26 -3.58 113.62 105.68 3h4k n SER 529 Ca 0.08 0.44 -0.34 0.00 -0.26 0.00 0.00 58.87 58.79 3h4k n SER 529 Cb 0.07 -0.48 0.01 0.00 -0.26 0.00 0.00 64.21 63.55 3h4k n SER 529 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3h4k n ASP 530 N -1.48 6.02 -4.00 4.04 2.03 -1.04 -4.88 116.55 117.24 3h4k n ASP 530 Ca 0.07 -3.74 -0.33 0.00 0.52 0.00 0.00 54.79 51.31 3h4k n ASP 530 Cb 0.31 -0.80 -0.00 0.00 -0.72 0.00 0.00 41.12 39.91 3h4k n ASP 530 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3h4k n ASN 531 N -0.37 -3.98 -3.65 1.67 5.03 -1.24 -1.47 115.26 111.24 3h4k n ASN 531 Ca 0.43 -0.84 -0.21 0.00 0.87 0.00 0.00 54.58 54.83 3h4k n ASN 531 Cb 0.40 -3.22 0.05 0.00 -1.02 0.00 0.00 39.78 35.99 3h4k n ASN 531 CO 0.00 0.00 0.00 0.80 -1.83 0.00 0.00 177.26 176.23 3h4k n MET 532 N -4.41 -5.59 -1.92 3.52 1.56 -0.82 -4.50 117.12 104.95 3h4k n MET 532 Ca 0.06 0.69 -0.42 0.00 -0.27 0.00 0.00 57.70 57.75 3h4k n MET 532 Cb 0.51 -5.42 -0.03 0.00 2.15 0.00 0.00 33.22 30.43 3h4k n MET 532 CO 0.00 0.00 0.00 0.50 -0.73 0.00 0.00 175.97 175.74 3h4k s ARG 533 N -5.92 4.21 -0.39 2.12 6.06 -0.54 -1.24 118.95 123.24 3h4k s ARG 533 Ca 0.11 2.39 -0.29 0.00 -2.50 0.00 0.00 55.73 55.44 3h4k s ARG 533 Cb -0.05 -3.12 0.00 0.00 0.06 0.00 0.00 34.95 31.84 3h4k s ARG 533 CO 0.79 -0.57 1.50 0.08 -2.50 0.00 0.00 175.30 174.60 3h4k s VAL 534 N 0.69 3.81 -0.06 7.11 1.01 0.15 -0.88 120.40 132.22 3h4k s VAL 534 Ca 0.66 0.83 0.13 0.00 0.00 0.00 0.00 61.98 63.61 3h4k s VAL 534 Cb -0.44 -4.08 -0.23 0.00 0.00 0.00 0.00 36.38 31.63 3h4k s VAL 534 CO 0.37 -0.67 0.60 0.18 0.00 0.00 0.00 175.10 175.57 3h4k n LEU 535 N 9.11 0.76 -3.70 3.92 4.77 0.92 -4.77 117.00 128.02 3h4k n LEU 535 Ca 0.18 0.36 -0.12 0.00 -0.03 0.00 0.00 56.01 56.40 3h4k n LEU 535 Cb 0.48 0.21 -0.09 0.00 -2.33 0.00 0.00 43.42 41.68 3h4k n LEU 535 CO 0.70 0.39 0.17 -0.83 -1.33 0.00 0.00 177.39 176.49 3h4k s GLY 536 N -5.14 -0.38 -0.07 -0.72 0.00 -1.02 -1.46 107.32 98.53 3h4k s GLY 536 Ca -0.05 1.50 0.04 0.00 0.00 0.00 0.00 44.72 46.21 3h4k s GLY 536 CO 0.83 1.38 -0.19 -2.27 0.00 0.00 0.00 173.10 172.84 3h4k s LEU 537 N 0.55 2.41 -0.03 0.66 0.20 0.43 -0.63 118.68 122.26 3h4k s LEU 537 Ca -0.02 -0.38 -0.01 0.00 0.69 0.00 0.00 54.13 54.41 3h4k s LEU 537 Cb -0.04 -1.48 0.03 0.00 -0.43 0.00 0.00 46.19 44.27 3h4k s LEU 537 CO -0.03 0.26 0.04 -1.00 -0.29 0.00 0.00 176.35 175.33 3h4k s HIS 538 N -0.25 0.14 -0.05 5.38 3.76 -0.77 -1.09 115.29 122.41 3h4k s HIS 538 Ca -0.00 0.14 0.00 0.00 -0.15 0.00 0.00 55.06 55.05 3h4k s HIS 538 Cb -0.13 -0.41 0.02 0.00 1.11 0.00 0.00 32.58 33.18 3h4k s HIS 538 CO 0.03 -0.16 -0.03 0.54 -0.85 0.00 0.00 174.74 174.27 3h4k s VAL 539 N 1.58 0.49 -0.25 -0.90 0.11 0.37 -0.97 120.40 120.83 3h4k s VAL 539 Ca -0.02 -0.05 -0.05 0.00 -2.93 0.00 0.00 61.98 58.93 3h4k s VAL 539 Cb -0.13 -0.56 0.00 0.00 -1.53 0.00 0.00 36.38 34.17 3h4k s VAL 539 CO -0.03 0.24 -0.00 -0.22 -3.33 0.00 0.00 175.10 171.76 3h4k s LEU 540 N 1.25 3.26 0.00 2.54 2.96 0.11 -0.27 118.68 128.52 3h4k s LEU 540 Ca -0.06 -0.54 0.00 0.00 -0.22 0.00 0.00 54.13 53.31 3h4k s LEU 540 Cb -0.14 -1.78 0.00 0.00 0.50 0.00 0.00 46.19 44.77 3h4k s LEU 540 CO -0.02 -0.09 0.00 0.61 -1.32 0.00 0.00 176.35 175.54 3h4k n GLY 541 N 4.81 -1.73 3.77 7.98 0.00 -0.26 -2.19 105.19 117.57 3h4k n GLY 541 Ca -0.17 -1.11 -0.39 0.00 0.00 0.00 0.00 46.02 44.36 3h4k n GLY 541 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3h4k s PRO 542 N -1.79 4.16 -1.42 1.61 0.02 -1.26 -2.94 135.00 133.38 3h4k s PRO 542 Ca 0.00 1.91 -0.04 0.00 0.02 0.00 0.00 61.00 62.88 3h4k s PRO 542 Cb 0.00 -2.80 0.02 0.00 0.02 0.00 0.00 34.50 31.74 3h4k s PRO 542 CO 0.00 -0.24 0.37 0.09 -0.33 0.00 0.00 177.00 176.89 3h4k n ASN 543 N 0.32 -5.02 0.11 2.53 3.02 -1.26 -4.86 115.26 110.09 3h4k n ASN 543 Ca 0.03 -0.18 0.19 0.00 -0.03 0.00 0.00 54.58 54.58 3h4k n ASN 543 Cb 0.45 -4.13 0.75 0.00 -0.61 0.00 0.00 39.78 36.25 3h4k n ASN 543 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h4k h ALA 544 N 1.00 2.13 -0.18 5.41 0.00 -1.84 -0.16 119.26 125.61 3h4k h ALA 544 Ca -0.45 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.37 3h4k h ALA 544 Cb 1.32 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 3h4k h ALA 544 CO 0.52 -0.51 -0.19 0.78 0.00 0.00 0.00 179.25 179.85 3h4k h GLY 545 N 0.00 0.49 1.76 0.00 0.00 -1.90 -1.59 103.07 101.82 3h4k h GLY 545 Ca 0.17 -0.51 -0.05 0.00 0.00 0.00 0.00 47.33 46.95 3h4k h GLY 545 CO -0.00 0.46 -0.08 0.83 0.00 0.00 0.00 176.54 177.74 3h4k h GLU 546 N 0.11 0.30 0.09 4.80 4.39 -1.46 -2.80 114.58 120.00 3h4k h GLU 546 Ca 0.03 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.66 3h4k h GLU 546 Cb 0.73 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 3h4k h GLU 546 CO 0.05 0.40 -0.04 0.82 -1.16 0.00 0.00 179.01 179.07 3h4k h ILE 547 N 0.29 1.16 -0.25 3.13 2.04 -1.18 -3.36 117.51 119.34 3h4k h ILE 547 Ca 0.06 -1.04 -0.10 0.00 1.00 0.00 0.00 64.86 64.78 3h4k h ILE 547 Cb 0.34 1.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.21 3h4k h ILE 547 CO 0.02 0.25 -0.29 0.74 0.00 0.00 0.00 178.15 178.87 3h4k h THR 548 N -0.61 1.27 -0.20 -0.27 2.02 -1.24 -3.36 112.91 110.53 3h4k h THR 548 Ca -0.01 -1.34 0.06 0.00 0.77 0.00 0.00 66.41 65.88 3h4k h THR 548 Cb 0.50 1.40 -0.07 0.00 -1.74 0.00 0.00 68.15 68.24 3h4k h THR 548 CO 0.02 0.42 -0.28 -0.61 0.37 0.00 0.00 175.52 175.45 3h4k h GLN 549 N 0.43 -0.30 -0.71 6.66 5.75 -1.64 -1.88 115.11 123.42 3h4k h GLN 549 Ca 0.06 0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.62 3h4k h GLN 549 Cb 0.72 0.07 -0.04 0.00 1.07 0.00 0.00 27.48 29.30 3h4k h GLN 549 CO 0.06 -0.20 0.46 0.78 -2.65 0.00 0.00 178.83 177.28 3h4k h GLY 550 N -0.31 0.95 1.78 2.39 0.00 -1.80 -2.11 103.07 103.97 3h4k h GLY 550 Ca 0.12 -0.32 -0.10 0.00 0.00 0.00 0.00 47.33 47.03 3h4k h GLY 550 CO -0.37 0.26 -0.38 -0.97 0.00 0.00 0.00 176.54 175.07 3h4k h TYR 551 N 0.80 0.29 -0.57 5.60 0.05 -1.55 -3.05 116.97 118.54 3h4k h TYR 551 Ca 0.29 -0.07 0.07 0.00 0.05 0.00 0.00 58.73 59.07 3h4k h TYR 551 Cb 0.15 -0.07 -0.03 0.00 1.01 0.00 0.00 36.73 37.79 3h4k h TYR 551 CO -0.00 0.60 0.38 0.00 -1.05 0.00 0.00 178.16 178.09 3h4k h ALA 552 N 1.39 1.92 -0.22 3.88 0.00 -0.94 0.79 119.26 126.08 3h4k h ALA 552 Ca 0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3h4k h ALA 552 Cb 0.77 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3h4k h ALA 552 CO 0.06 -0.02 0.06 0.28 0.00 0.00 0.00 179.25 179.62 3h4k h VAL 553 N 0.47 1.21 -0.44 0.00 2.07 -1.60 -2.04 116.25 115.93 3h4k h VAL 553 Ca 0.25 -0.67 -0.03 0.00 0.82 0.00 0.00 66.70 67.07 3h4k h VAL 553 Cb 0.38 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 3h4k h VAL 553 CO -0.07 0.21 0.16 0.00 0.02 0.00 0.00 177.57 177.89 3h4k h ALA 554 N 0.87 0.57 -0.84 1.67 0.00 -1.22 -2.21 119.26 118.10 3h4k h ALA 554 Ca 0.07 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3h4k h ALA 554 Cb 0.27 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 3h4k h ALA 554 CO 0.00 0.19 0.52 0.82 0.00 0.00 0.00 179.25 180.78 3h4k h ILE 555 N 0.56 1.23 -0.92 0.00 2.04 -0.94 -1.89 117.51 117.59 3h4k h ILE 555 Ca 0.14 -0.47 0.11 0.00 1.00 0.00 0.00 64.86 65.65 3h4k h ILE 555 Cb 0.22 0.04 -0.08 0.00 -0.74 0.00 0.00 36.82 36.25 3h4k h ILE 555 CO -0.01 0.23 0.55 0.50 0.00 0.00 0.00 178.15 179.42 3h4k h LYS 556 N 1.14 0.85 0.00 2.37 1.63 -1.08 -0.63 116.57 120.86 3h4k h LYS 556 Ca 0.30 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 60.05 3h4k h LYS 556 Cb -0.08 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 31.36 3h4k h LYS 556 CO -0.06 0.56 0.00 -1.33 -3.45 0.00 0.00 179.45 175.17 3h4k n MET 557 N -4.69 0.15 -0.28 1.90 2.81 -0.79 -4.91 117.12 111.32 3h4k n MET 557 Ca 0.17 0.25 0.00 0.00 -1.81 0.00 0.00 57.70 56.30 3h4k n MET 557 Cb 0.34 -1.72 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 3h4k n MET 557 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3h4k n GLY 558 N 0.74 0.51 3.77 3.03 0.00 -0.24 -5.06 105.19 107.93 3h4k n GLY 558 Ca 0.04 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 3h4k n GLY 558 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h4k s ALA 559 N -1.31 3.53 0.40 4.61 0.00 -0.78 -4.88 121.76 123.33 3h4k s ALA 559 Ca 0.00 1.31 0.08 0.00 0.00 0.00 0.00 51.96 53.34 3h4k s ALA 559 Cb 0.00 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.59 3h4k s ALA 559 CO 0.00 -0.70 0.36 0.95 0.00 0.00 0.00 175.76 176.37 3h4k s THR 560 N -0.94 2.77 0.32 0.00 -4.23 -1.26 -0.67 115.64 111.63 3h4k s THR 560 Ca 0.51 -1.35 0.01 0.00 -1.18 0.00 0.00 61.69 59.67 3h4k s THR 560 Cb -0.41 -3.02 0.27 0.00 1.34 0.00 0.00 72.50 70.68 3h4k s THR 560 CO 0.52 -0.03 1.95 0.50 -0.54 0.00 0.00 174.62 177.03 3h4k h LYS 561 N 1.07 0.97 -0.44 3.99 1.63 -1.40 -2.31 116.57 120.07 3h4k h LYS 561 Ca -0.42 -0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 59.29 3h4k h LYS 561 Cb 1.26 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 32.65 3h4k h LYS 561 CO 0.58 0.64 0.14 0.00 -3.45 0.00 0.00 179.45 177.36 3h4k h ALA 562 N 1.53 1.43 -0.20 5.00 0.00 -1.86 -1.49 119.26 123.66 3h4k h ALA 562 Ca 0.33 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 3h4k h ALA 562 Cb 0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3h4k h ALA 562 CO -0.10 0.43 -0.15 -0.44 0.00 0.00 0.00 179.25 178.99 3h4k h ASP 563 N 0.63 0.32 -0.21 0.00 3.32 -1.81 -1.48 116.42 117.18 3h4k h ASP 563 Ca 0.15 -0.08 -0.16 0.00 0.02 0.00 0.00 57.03 56.96 3h4k h ASP 563 Cb 0.18 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.65 3h4k h ASP 563 CO -0.01 0.50 -0.48 -0.26 -1.72 0.00 0.00 179.24 177.27 3h4k h PHE 564 N 0.31 0.89 -0.46 4.55 0.04 -1.30 -3.25 116.94 117.72 3h4k h PHE 564 Ca 0.06 -0.33 -0.07 0.00 2.80 0.00 0.00 57.97 60.43 3h4k h PHE 564 Cb 0.46 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.43 3h4k h PHE 564 CO 0.01 1.12 0.02 -0.44 -0.60 0.00 0.00 178.31 178.42 3h4k h ASP 565 N 0.41 0.79 1.38 2.17 3.32 -0.85 -3.05 116.42 120.59 3h4k h ASP 565 Ca 0.00 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 56.74 3h4k h ASP 565 Cb 1.09 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 40.43 3h4k h ASP 565 CO 0.11 0.89 -0.06 0.08 -1.72 0.00 0.00 179.24 178.54 3h4k h ARG 566 N 0.66 0.00 -6.92 3.56 0.11 -1.42 -3.44 114.38 106.93 3h4k h ARG 566 Ca 0.13 0.00 -0.49 0.00 0.10 0.00 0.00 59.98 59.72 3h4k h ARG 566 Cb 0.48 0.00 0.03 0.00 1.11 0.00 0.00 29.97 31.58 3h4k h ARG 566 CO 0.02 0.06 0.45 0.99 0.10 0.00 0.00 179.97 181.59 3h4k s THR 567 N -3.47 3.52 -0.07 0.08 2.01 -1.15 -5.03 115.64 111.52 3h4k s THR 567 Ca 0.03 1.27 -0.12 0.00 0.31 0.00 0.00 61.69 63.18 3h4k s THR 567 Cb 0.08 -3.71 -0.05 0.00 0.01 0.00 0.00 72.50 68.83 3h4k s THR 567 CO 0.61 0.11 0.30 -0.63 -0.69 0.00 0.00 174.62 174.32 3h4k s ILE 568 N -1.48 5.24 0.63 1.82 -1.09 -1.26 -4.92 121.20 120.14 3h4k s ILE 568 Ca 0.55 0.58 -0.14 0.00 -2.23 0.00 0.00 60.65 59.40 3h4k s ILE 568 Cb -0.27 -3.60 -0.02 0.00 -1.58 0.00 0.00 42.46 37.00 3h4k s ILE 568 CO 0.33 0.55 1.06 -0.83 -1.23 0.00 0.00 174.94 174.82 3h4k s GLY 569 N -0.70 1.99 -0.26 6.18 0.00 -1.26 -5.05 107.32 108.22 3h4k s GLY 569 Ca 0.19 0.31 -0.11 0.00 0.00 0.00 0.00 44.72 45.12 3h4k s GLY 569 CO 0.08 0.63 0.17 -0.42 0.00 0.00 0.00 173.10 173.56 3h4k s ILE 570 N -2.62 5.28 -0.07 0.90 1.01 -1.26 -5.07 121.20 119.37 3h4k s ILE 570 Ca 0.62 0.16 0.01 0.00 0.00 0.00 0.00 60.65 61.44 3h4k s ILE 570 Cb -0.16 -3.48 -0.03 0.00 0.01 0.00 0.00 42.46 38.80 3h4k s ILE 570 CO 0.43 0.31 -0.07 -2.28 0.00 0.00 0.00 174.94 173.32 3h4k s HIS 571 N 1.38 2.92 -0.28 3.97 2.46 -1.26 -2.67 115.29 121.81 3h4k s HIS 571 Ca 0.07 -0.01 -0.17 0.00 0.47 0.00 0.00 55.06 55.42 3h4k s HIS 571 Cb -0.15 -1.71 -0.03 0.00 -0.13 0.00 0.00 32.58 30.56 3h4k s HIS 571 CO 0.07 0.30 0.45 -1.25 -2.47 0.00 0.00 174.74 171.85 3h4k s PRO 572 N -0.74 3.98 0.17 2.88 0.05 -1.26 -5.19 135.00 134.88 3h4k s PRO 572 Ca 0.11 0.13 0.01 0.00 0.05 0.00 0.00 61.00 61.31 3h4k s PRO 572 Cb -0.11 -3.68 -0.05 0.00 0.05 0.00 0.00 34.50 30.72 3h4k s PRO 572 CO 0.01 -0.36 0.02 0.95 0.05 0.00 0.00 177.00 177.66 3h4k s THR 573 N 2.22 0.58 0.05 1.26 -4.23 -1.09 -5.02 115.64 109.41 3h4k s THR 573 Ca 0.18 -1.97 -0.16 0.00 -1.18 0.00 0.00 61.69 58.56 3h4k s THR 573 Cb -0.16 -2.14 -0.21 0.00 1.34 0.00 0.00 72.50 71.34 3h4k s THR 573 CO 0.10 -0.45 1.19 0.00 -0.54 0.00 0.00 174.62 174.92 3h4k h SER 575 N 0.20 0.36 -0.11 0.00 0.87 -1.97 -2.68 113.55 110.22 3h4k h SER 575 Ca -0.08 -0.01 0.03 0.00 -1.23 0.00 0.00 61.79 60.51 3h4k h SER 575 Cb 1.41 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 63.28 3h4k h SER 575 CO 0.15 0.26 0.27 1.05 -0.53 0.00 0.00 176.83 178.02 3h4k h GLU 576 N 0.42 0.00 0.00 2.24 4.11 -1.80 -1.74 114.58 117.81 3h4k h GLU 576 Ca 0.15 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.57 3h4k h GLU 576 Cb 0.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 3h4k h GLU 576 CO -0.03 0.00 -0.01 1.15 0.07 0.00 0.00 179.01 180.18 3h4k h THR 577 N 0.00 0.69 0.00 -1.06 2.02 -1.72 -0.95 112.91 111.88 3h4k h THR 577 Ca 0.05 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 3h4k h THR 577 Cb 0.59 1.03 -0.00 0.00 -1.74 0.00 0.00 68.15 68.03 3h4k h THR 577 CO -0.00 0.01 -0.02 -0.26 0.37 0.00 0.00 175.52 175.63 3h4k h PHE 578 N 0.00 0.00 0.00 3.16 0.04 -1.56 -3.01 116.94 115.57 3h4k h PHE 578 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3h4k h PHE 578 Cb 0.03 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.18 3h4k h PHE 578 CO 0.00 0.02 -0.27 0.25 -0.60 0.00 0.00 178.31 177.70 3h4k n THR 579 N -3.13 0.26 -1.34 -1.55 -2.24 -0.36 -4.21 114.28 101.71 3h4k n THR 579 Ca -0.00 -0.15 0.05 0.00 -2.27 0.00 0.00 64.05 61.67 3h4k n THR 579 Cb 0.26 -0.27 0.07 0.00 -2.10 0.00 0.00 70.33 68.29 3h4k n THR 579 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3h4k n THR 580 N -1.88 0.97 -1.82 4.28 -2.24 -1.14 -4.15 114.28 108.31 3h4k n THR 580 Ca 0.05 -1.15 -0.41 0.00 -2.27 0.00 0.00 64.05 60.27 3h4k n THR 580 Cb 0.39 0.18 -0.01 0.00 -2.10 0.00 0.00 70.33 68.79 3h4k n THR 580 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3h4k s LEU 581 N -1.44 4.34 0.00 3.22 1.43 -1.22 -4.89 118.68 120.13 3h4k s LEU 581 Ca 0.15 2.95 0.00 0.00 -1.03 0.00 0.00 54.13 56.20 3h4k s LEU 581 Cb 0.13 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.71 3h4k s LEU 581 CO 0.01 -0.87 0.00 0.00 0.23 0.00 0.00 176.35 175.72 3h4k n HIS 582 N 1.63 0.00 -2.47 0.29 1.44 -1.26 -5.02 115.22 109.83 3h4k n HIS 582 Ca 0.06 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.34 3h4k n HIS 582 Cb 0.38 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.47 3h4k n HIS 582 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 3h4k s VAL 583 N -0.97 4.31 0.31 0.61 1.01 -1.26 -4.97 120.40 119.44 3h4k s VAL 583 Ca 0.00 1.55 -0.01 0.00 0.00 0.00 0.00 61.98 63.52 3h4k s VAL 583 Cb 0.00 -4.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 3h4k s VAL 583 CO 0.00 -0.26 0.52 0.42 0.00 0.00 0.00 175.10 175.78 3h4k s THR 584 N 3.73 5.11 0.24 3.92 -4.23 -1.26 -1.21 115.64 121.94 3h4k s THR 584 Ca 0.53 -0.35 0.04 0.00 -1.18 0.00 0.00 61.69 60.74 3h4k s THR 584 Cb -0.19 -3.81 -0.03 0.00 1.34 0.00 0.00 72.50 69.81 3h4k s THR 584 CO 0.16 -0.45 1.58 0.11 -0.54 0.00 0.00 174.62 175.49 3h4k h LYS 585 N 1.15 0.27 0.00 3.99 1.57 -1.56 -3.12 116.57 118.87 3h4k h LYS 585 Ca -0.49 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.11 3h4k h LYS 585 Cb 1.21 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.54 3h4k h LYS 585 CO 0.63 0.75 -0.07 0.87 -0.57 0.00 0.00 179.45 181.06 3h4k h LYS 586 N 0.20 0.00 0.00 3.15 1.57 -1.96 -2.84 116.57 116.70 3h4k h LYS 586 Ca 0.00 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 3h4k h LYS 586 Cb 1.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.34 3h4k h LYS 586 CO 0.09 0.07 -0.45 0.66 -0.57 0.00 0.00 179.45 179.25 3h4k h SER 587 N 0.00 0.00 0.00 0.86 4.64 -1.95 -3.47 113.55 113.63 3h4k h SER 587 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h4k h SER 587 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 3h4k h SER 587 CO 0.01 0.45 0.00 0.61 -0.87 0.00 0.00 176.83 177.03 3h4k n GLY 588 N 0.47 1.64 3.75 -0.77 0.00 -1.07 -5.01 105.19 104.20 3h4k n GLY 588 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3h4k n GLY 588 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h4k s VAL 589 N -3.63 3.19 0.30 1.61 1.01 -1.26 -4.96 120.40 116.65 3h4k s VAL 589 Ca 0.00 1.10 -0.30 0.00 0.00 0.00 0.00 61.98 62.78 3h4k s VAL 589 Cb 0.00 -3.70 -0.12 0.00 0.00 0.00 0.00 36.38 32.56 3h4k s VAL 589 CO 0.00 0.23 1.54 -0.24 0.00 0.00 0.00 175.10 176.62 3h4k n SER 590 N 1.64 3.62 0.00 3.32 2.88 -1.26 -4.90 113.62 118.92 3h4k n SER 590 Ca 0.02 1.16 0.14 0.00 -1.33 0.00 0.00 58.87 58.86 3h4k n SER 590 Cb 0.43 -1.57 0.73 0.00 -0.75 0.00 0.00 64.21 63.06 3h4k n SER 590 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3h4k n PRO 591 N 1.80 0.55 -1.18 -1.46 -0.04 -1.26 -4.88 135.00 128.52 3h4k n PRO 591 Ca 0.08 0.02 -0.34 0.00 -0.04 0.00 0.00 63.50 63.22 3h4k n PRO 591 Cb 0.36 -1.50 0.12 0.00 -0.04 0.00 0.00 33.50 32.44 3h4k n PRO 591 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 3h4k n ILE 592 N -1.20 2.40 1.02 0.52 -5.35 -1.26 -0.72 119.36 114.77 3h4k n ILE 592 Ca 0.16 -0.25 0.12 0.00 -0.27 0.00 0.00 62.75 62.51 3h4k n ILE 592 Cb 0.18 -1.23 0.12 0.00 -1.74 0.00 0.00 39.64 36.97 3h4k n ILE 592 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12