#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h7l s LEU 2 N 0.00 2.91 -0.48 2.46 1.43 -0.30 -4.87 118.68 119.83 3h7l s LEU 2 Ca 0.00 -0.18 -0.06 0.00 -1.03 0.00 0.00 54.13 52.86 3h7l s LEU 2 Cb 0.00 -1.64 0.12 0.00 0.03 0.00 0.00 46.19 44.70 3h7l s LEU 2 CO 0.00 0.32 0.31 -0.22 0.23 0.00 0.00 176.35 176.99 3h7l s LEU 3 N -1.02 5.48 -0.00 1.79 2.96 -1.26 -0.55 118.68 126.09 3h7l s LEU 3 Ca 0.13 -2.13 -0.26 0.00 -0.22 0.00 0.00 54.13 51.66 3h7l s LEU 3 Cb -0.11 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.62 3h7l s LEU 3 CO 0.03 -0.58 0.80 -0.76 -1.32 0.00 0.00 176.35 174.52 3h7l s LEU 4 N 1.02 4.39 0.26 -0.68 1.43 0.18 -4.32 118.68 120.96 3h7l s LEU 4 Ca 0.09 1.42 0.03 0.00 -1.03 0.00 0.00 54.13 54.63 3h7l s LEU 4 Cb -0.23 -3.27 -0.04 0.00 0.03 0.00 0.00 46.19 42.68 3h7l s LEU 4 CO -0.03 -0.09 0.19 0.42 0.23 0.00 0.00 176.35 177.06 3h7l s THR 5 N 0.47 0.06 0.02 5.49 -4.23 -1.26 -1.35 115.64 114.84 3h7l s THR 5 Ca 0.41 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.62 3h7l s THR 5 Cb -0.20 -2.50 -0.08 0.00 1.34 0.00 0.00 72.50 71.06 3h7l s THR 5 CO 0.23 0.00 1.75 0.21 -0.54 0.00 0.00 174.62 176.26 3h7l s ASN 6 N -3.27 6.57 0.46 3.99 3.84 -1.26 -2.39 114.94 122.88 3h7l s ASN 6 Ca 0.39 2.47 0.19 0.00 0.21 0.00 0.00 52.86 56.12 3h7l s ASN 6 Cb 0.05 -2.54 1.10 0.00 -0.55 0.00 0.00 41.25 39.31 3h7l s ASN 6 CO 0.18 -0.95 1.98 0.45 -2.79 0.00 0.00 177.10 175.97 3h7l h HIS 7 N 9.37 0.00 0.00 0.43 3.86 -1.40 -3.32 115.15 124.09 3h7l h HIS 7 Ca -0.43 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.78 3h7l h HIS 7 Cb 1.20 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.67 3h7l h HIS 7 CO 0.86 0.21 -0.69 -0.89 0.86 0.00 0.00 177.93 178.28 3h7l n ILE 8 N -3.97 1.41 -0.75 2.45 5.41 -1.26 -4.71 119.36 117.94 3h7l n ILE 8 Ca -0.02 0.20 0.00 0.00 1.00 0.00 0.00 62.75 63.93 3h7l n ILE 8 Cb 0.29 -2.35 0.00 0.00 -0.71 0.00 0.00 39.64 36.86 3h7l n ILE 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3h7l n GLY 9 N 1.56 -2.27 3.22 7.39 0.00 -1.25 -2.09 105.19 111.75 3h7l n GLY 9 Ca -0.10 -1.23 -0.20 0.00 0.00 0.00 0.00 46.02 44.50 3h7l n GLY 9 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h7l s TYR 10 N -2.20 1.42 0.19 1.61 2.02 -0.29 -4.88 117.35 115.21 3h7l s TYR 10 Ca 0.00 -0.48 -0.30 0.00 -0.37 0.00 0.00 57.07 55.92 3h7l s TYR 10 Cb 0.00 -0.77 -0.09 0.00 -0.40 0.00 0.00 41.96 40.70 3h7l s TYR 10 CO 0.00 0.12 1.36 -1.21 -1.57 0.00 0.00 175.55 174.25 3h7l s GLU 11 N -2.08 4.35 0.27 -0.62 0.41 -1.26 -1.84 118.70 117.93 3h7l s GLU 11 Ca 0.04 2.11 -0.01 0.00 -0.41 0.00 0.00 54.97 56.70 3h7l s GLU 11 Cb -0.08 -3.19 0.47 0.00 -1.78 0.00 0.00 34.13 29.55 3h7l s GLU 11 CO 0.03 -0.33 1.86 -0.09 -0.49 0.00 0.00 175.26 176.24 3h7l h ARG 12 N 5.64 1.04 -2.54 1.61 2.43 -1.80 -2.74 114.38 118.02 3h7l h ARG 12 Ca -0.44 -0.06 -0.71 0.00 -0.81 0.00 0.00 59.98 57.96 3h7l h ARG 12 Cb 1.21 -0.23 -0.35 0.00 -0.42 0.00 0.00 29.97 30.18 3h7l h ARG 12 CO 0.80 0.69 0.11 1.28 -1.51 0.00 0.00 179.97 181.33 3h7l n LEU 13 N -4.57 5.15 -3.83 3.80 4.77 -1.26 -4.47 117.00 116.59 3h7l n LEU 13 Ca 0.17 -5.34 -0.07 0.00 -0.03 0.00 0.00 56.01 50.74 3h7l n LEU 13 Cb 0.27 -0.97 0.00 0.00 -2.33 0.00 0.00 43.42 40.39 3h7l n LEU 13 CO 0.30 1.89 0.56 -0.83 -1.33 0.00 0.00 177.39 177.98 3h7l s GLY 14 N -2.16 0.08 0.22 -0.72 0.00 -1.03 -5.08 107.32 98.62 3h7l s GLY 14 Ca 0.36 -0.42 -0.31 0.00 0.00 0.00 0.00 44.72 44.34 3h7l s GLY 14 CO 0.04 0.07 1.60 -4.14 0.00 0.00 0.00 173.10 170.67 3h7l s PRO 15 N -3.07 4.18 -0.19 2.90 0.02 -1.26 -4.71 135.00 132.87 3h7l s PRO 15 Ca 0.14 2.47 -0.00 0.00 0.02 0.00 0.00 61.00 63.62 3h7l s PRO 15 Cb -0.05 -3.10 0.05 0.00 0.02 0.00 0.00 34.50 31.43 3h7l s PRO 15 CO 0.08 -0.62 -0.04 0.15 -0.33 0.00 0.00 177.00 176.23 3h7l s LYS 16 N 0.57 1.42 0.03 5.54 1.02 -1.26 -4.76 119.74 122.29 3h7l s LYS 16 Ca 0.68 -0.68 0.06 0.00 0.02 0.00 0.00 55.97 56.06 3h7l s LYS 16 Cb -0.46 -2.24 -0.02 0.00 -0.52 0.00 0.00 37.83 34.59 3h7l s LYS 16 CO 0.37 -0.52 -0.18 0.21 -0.92 0.00 0.00 175.35 174.31 3h7l s LYS 17 N 1.57 1.27 0.07 1.68 2.20 -1.26 -0.70 119.74 124.58 3h7l s LYS 17 Ca -0.02 -0.82 0.02 0.00 -0.36 0.00 0.00 55.97 54.79 3h7l s LYS 17 Cb -0.17 -1.32 -0.03 0.00 -1.51 0.00 0.00 37.83 34.80 3h7l s LYS 17 CO -0.07 0.34 -0.08 0.00 -0.36 0.00 0.00 175.35 175.18 3h7l s ALA 18 N -0.73 0.82 -0.09 3.13 0.00 0.14 -4.66 121.76 120.37 3h7l s ALA 18 Ca 0.06 -1.05 -0.00 0.00 0.00 0.00 0.00 51.96 50.97 3h7l s ALA 18 Cb -0.08 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.14 3h7l s ALA 18 CO 0.01 -0.10 -0.05 0.42 0.00 0.00 0.00 175.76 176.04 3h7l s ILE 19 N -2.36 0.78 0.01 0.00 1.01 -0.46 -0.38 121.20 119.80 3h7l s ILE 19 Ca 0.00 -0.17 -0.28 0.00 0.00 0.00 0.00 60.65 60.21 3h7l s ILE 19 Cb -0.03 -0.83 -0.04 0.00 0.01 0.00 0.00 42.46 41.57 3h7l s ILE 19 CO -0.02 0.32 0.89 -0.63 0.00 0.00 0.00 174.94 175.50 3h7l s ILE 20 N 1.56 4.84 -0.14 2.92 1.01 0.48 0.50 121.20 132.36 3h7l s ILE 20 Ca 0.01 1.87 0.01 0.00 0.00 0.00 0.00 60.65 62.53 3h7l s ILE 20 Cb -0.13 -4.23 0.02 0.00 0.01 0.00 0.00 42.46 38.13 3h7l s ILE 20 CO -0.05 0.23 -0.17 -1.58 0.00 0.00 0.00 174.94 173.37 3h7l s GLN 21 N 0.67 2.52 0.19 2.79 0.74 0.29 -0.44 119.66 126.43 3h7l s GLN 21 Ca 0.46 -0.66 -0.19 0.00 0.05 0.00 0.00 55.36 55.03 3h7l s GLN 21 Cb -0.21 -2.17 0.03 0.00 1.10 0.00 0.00 33.01 31.77 3h7l s GLN 21 CO 0.25 -0.13 0.54 -0.08 -0.55 0.00 0.00 175.29 175.33 3h7l s THR 22 N 1.15 0.02 -1.16 -0.34 -1.32 -0.51 -1.15 115.64 112.33 3h7l s THR 22 Ca -0.01 -0.66 0.25 0.00 -1.21 0.00 0.00 61.69 60.05 3h7l s THR 22 Cb -0.14 -1.50 0.02 0.00 -1.51 0.00 0.00 72.50 69.37 3h7l s THR 22 CO -0.06 -0.10 1.36 -0.62 -2.21 0.00 0.00 174.62 172.99 3h7l n GLU 23 N -0.35 0.18 -1.82 7.08 1.02 -1.26 0.62 120.64 126.11 3h7l n GLU 23 Ca -0.11 -0.11 -0.42 0.00 -0.02 0.00 0.00 57.16 56.49 3h7l n GLU 23 Cb 0.63 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.52 3h7l n GLU 23 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3h7l s GLN 24 N -2.90 4.16 0.52 3.49 -0.21 -1.26 -4.80 119.66 118.66 3h7l s GLN 24 Ca 0.13 2.45 0.29 0.00 0.02 0.00 0.00 55.36 58.26 3h7l s GLN 24 Cb 0.18 -3.77 1.33 0.00 1.00 0.00 0.00 33.01 31.75 3h7l s GLN 24 CO 0.69 -0.83 1.99 -1.00 -2.12 0.00 0.00 175.29 174.02 3h7l h PRO 25 N 9.06 0.00 -3.97 2.91 0.13 -1.99 -3.44 132.00 134.70 3h7l h PRO 25 Ca -0.45 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.58 3h7l h PRO 25 Cb 1.21 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.19 3h7l h PRO 25 CO 0.94 0.11 -0.51 -1.01 -0.23 0.00 0.00 178.00 177.31 3h7l s HIS 26 N -3.86 0.30 0.43 1.56 3.76 -1.26 -5.06 115.29 111.16 3h7l s HIS 26 Ca -0.01 -0.76 0.08 0.00 -0.15 0.00 0.00 55.06 54.22 3h7l s HIS 26 Cb 0.11 -0.19 0.01 0.00 1.11 0.00 0.00 32.58 33.61 3h7l s HIS 26 CO 0.58 -0.46 0.52 -0.51 -0.85 0.00 0.00 174.74 174.01 3h7l s LEU 27 N -2.79 3.51 0.00 0.89 1.43 -1.26 -5.03 118.68 115.42 3h7l s LEU 27 Ca 0.04 -0.58 0.20 0.00 -1.03 0.00 0.00 54.13 52.77 3h7l s LEU 27 Cb 0.05 -2.35 -0.06 0.00 0.03 0.00 0.00 46.19 43.86 3h7l s LEU 27 CO -0.10 -0.78 0.96 -1.54 0.23 0.00 0.00 176.35 175.13 3h7l n SER 28 N -1.78 1.65 -3.82 2.29 3.41 -1.26 -4.93 113.62 109.18 3h7l n SER 28 Ca 0.07 -1.32 -0.12 0.00 -0.26 0.00 0.00 58.87 57.23 3h7l n SER 28 Cb 0.60 0.61 -0.11 0.00 -0.26 0.00 0.00 64.21 65.05 3h7l n SER 28 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3h7l s SER 29 N -2.42 -0.13 -0.13 4.04 0.15 -1.26 -5.05 113.70 108.91 3h7l s SER 29 Ca 0.14 0.17 0.17 0.00 0.70 0.00 0.00 55.95 57.13 3h7l s SER 29 Cb 0.16 0.33 0.42 0.00 -1.71 0.00 0.00 66.02 65.22 3h7l s SER 29 CO 0.59 -0.20 1.20 -1.22 1.20 0.00 0.00 173.24 174.80 3h7l n TYR 30 N 2.32 0.00 -5.22 3.44 4.01 -1.26 -4.97 117.16 115.48 3h7l n TYR 30 Ca -0.17 -1.09 -0.32 0.00 -0.16 0.00 0.00 57.90 56.16 3h7l n TYR 30 Cb 0.57 -0.21 -0.17 0.00 -0.31 0.00 0.00 39.34 39.23 3h7l n TYR 30 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 3h7l s THR 31 N -1.97 2.05 -0.09 -0.72 2.01 -1.26 -1.75 115.64 113.90 3h7l s THR 31 Ca 0.36 -1.02 -0.05 0.00 0.31 0.00 0.00 61.69 61.30 3h7l s THR 31 Cb 0.37 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 71.08 3h7l s THR 31 CO -0.10 0.56 0.09 0.00 -0.69 0.00 0.00 174.62 174.48 3h7l s ALA 32 N 0.30 3.66 -0.13 7.40 0.00 0.14 -4.70 121.76 128.42 3h7l s ALA 32 Ca -0.18 -0.72 -0.03 0.00 0.00 0.00 0.00 51.96 51.04 3h7l s ALA 32 Cb -0.18 -1.77 -0.03 0.00 0.00 0.00 0.00 23.12 21.14 3h7l s ALA 32 CO 0.08 0.62 -0.04 1.14 0.00 0.00 0.00 175.76 177.57 3h7l s GLN 33 N -1.09 3.46 -0.21 0.00 0.00 0.13 -0.54 119.66 121.42 3h7l s GLN 33 Ca 0.16 -0.52 -0.20 0.00 -0.00 0.00 0.00 55.36 54.80 3h7l s GLN 33 Cb -0.12 -2.85 -0.03 0.00 0.00 0.00 0.00 33.01 30.02 3h7l s GLN 33 CO 0.05 0.35 0.59 -1.17 0.00 0.00 0.00 175.29 175.11 3h7l s LEU 34 N 0.06 4.13 -0.10 2.60 2.96 -0.03 -0.83 118.68 127.46 3h7l s LEU 34 Ca -0.00 0.75 0.04 0.00 -0.22 0.00 0.00 54.13 54.69 3h7l s LEU 34 Cb -0.13 -2.81 0.00 0.00 0.50 0.00 0.00 46.19 43.75 3h7l s LEU 34 CO 0.03 -0.26 -0.22 -0.63 -1.32 0.00 0.00 176.35 173.95 3h7l s ILE 35 N 1.93 1.91 0.07 6.68 1.01 0.09 -1.03 121.20 131.86 3h7l s ILE 35 Ca 0.26 -0.93 -0.31 0.00 0.00 0.00 0.00 60.65 59.68 3h7l s ILE 35 Cb -0.16 -1.67 -0.09 0.00 0.01 0.00 0.00 42.46 40.56 3h7l s ILE 35 CO 0.10 0.53 1.75 0.00 0.00 0.00 0.00 174.94 177.31 3h7l h ALA 37 N 8.81 1.24 0.41 0.00 0.00 -1.43 0.13 119.26 128.43 3h7l h ALA 37 Ca -0.44 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.03 3h7l h ALA 37 Cb 1.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3h7l h ALA 37 CO 0.94 0.57 -0.20 1.15 0.00 0.00 0.00 179.25 181.71 3h7l h THR 38 N 0.02 0.00 0.00 0.00 2.02 -1.92 -3.38 112.91 109.65 3h7l h THR 38 Ca -0.00 -0.57 -0.11 0.00 0.77 0.00 0.00 66.41 66.50 3h7l h THR 38 Cb 0.81 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 3h7l h THR 38 CO 0.06 0.00 -0.86 0.77 0.37 0.00 0.00 175.52 175.86 3h7l h SER 39 N -1.12 0.00 -0.74 4.18 4.64 -1.95 -3.48 113.55 115.09 3h7l h SER 39 Ca -0.06 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.02 3h7l h SER 39 Cb 0.43 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.43 3h7l h SER 39 CO 0.09 0.43 -0.23 -0.62 -0.87 0.00 0.00 176.83 175.63 3h7l n GLU 40 N -3.02 -0.85 -3.21 4.77 1.02 0.46 -5.03 120.64 114.78 3h7l n GLU 40 Ca -0.02 0.87 -0.37 0.00 -0.02 0.00 0.00 57.16 57.61 3h7l n GLU 40 Cb 0.74 -4.90 -0.06 0.00 -0.02 0.00 0.00 31.44 27.20 3h7l n GLU 40 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3h7l s GLN 41 N -3.25 4.21 -0.10 3.49 -1.52 -1.25 -4.83 119.66 116.43 3h7l s GLN 41 Ca 0.00 0.77 -0.30 0.00 -1.95 0.00 0.00 55.36 53.88 3h7l s GLN 41 Cb 0.00 -3.10 -0.02 0.00 -0.22 0.00 0.00 33.01 29.67 3h7l s GLN 41 CO 0.00 0.54 1.20 0.99 -0.25 0.00 0.00 175.29 177.77 3h7l s THR 42 N -1.28 4.31 -0.08 -0.19 2.01 -1.26 -1.21 115.64 117.93 3h7l s THR 42 Ca 0.35 1.62 0.17 0.00 0.31 0.00 0.00 61.69 64.14 3h7l s THR 42 Cb -0.18 -4.04 -0.26 0.00 0.01 0.00 0.00 72.50 68.03 3h7l s THR 42 CO 0.20 -0.05 0.26 1.33 -0.69 0.00 0.00 174.62 175.68 3h7l n VAL 43 N 4.86 0.47 -3.50 3.82 0.24 -0.20 -4.95 118.33 119.07 3h7l n VAL 43 Ca 0.12 -0.54 -0.15 0.00 -2.04 0.00 0.00 64.34 61.73 3h7l n VAL 43 Cb 0.46 -0.17 -0.04 0.00 -1.47 0.00 0.00 33.84 32.61 3h7l n VAL 43 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3h7l s ALA 44 N -2.93 -1.75 0.18 2.33 0.00 -1.21 -5.05 121.76 113.33 3h7l s ALA 44 Ca -0.07 1.10 0.10 0.00 0.00 0.00 0.00 51.96 53.09 3h7l s ALA 44 Cb 0.09 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.35 3h7l s ALA 44 CO 0.74 -0.50 -0.20 0.95 0.00 0.00 0.00 175.76 176.74 3h7l s THR 45 N -2.05 2.02 0.04 0.00 -4.23 -1.26 -0.85 115.64 109.31 3h7l s THR 45 Ca -0.05 -1.95 -0.09 0.00 -1.18 0.00 0.00 61.69 58.41 3h7l s THR 45 Cb -0.00 -1.94 0.00 0.00 1.34 0.00 0.00 72.50 71.90 3h7l s THR 45 CO 0.01 -0.24 0.19 -0.36 -0.54 0.00 0.00 174.62 173.69 3h7l s PHE 46 N -1.89 0.05 0.40 3.99 0.08 0.30 -4.98 117.98 115.94 3h7l s PHE 46 Ca 0.17 -0.27 -0.20 0.00 0.12 0.00 0.00 56.93 56.76 3h7l s PHE 46 Cb -0.07 -0.03 -0.10 0.00 -0.57 0.00 0.00 43.02 42.25 3h7l s PHE 46 CO 0.08 -0.43 0.90 0.00 -0.10 0.00 0.00 175.22 175.67 3h7l s ALA 47 N -2.53 3.11 -0.21 5.36 0.00 -1.26 0.23 121.76 126.46 3h7l s ALA 47 Ca -0.05 0.32 -0.06 0.00 0.00 0.00 0.00 51.96 52.16 3h7l s ALA 47 Cb -0.01 -3.06 -0.03 0.00 0.00 0.00 0.00 23.12 20.02 3h7l s ALA 47 CO -0.04 0.18 0.04 0.08 0.00 0.00 0.00 175.76 176.02 3h7l s VAL 48 N -2.11 4.26 -0.16 0.00 1.01 -0.72 -4.37 120.40 118.32 3h7l s VAL 48 Ca 0.60 -0.20 -0.04 0.00 0.00 0.00 0.00 61.98 62.34 3h7l s VAL 48 Cb -0.10 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 3h7l s VAL 48 CO 0.14 0.40 -0.04 -1.61 0.00 0.00 0.00 175.10 174.00 3h7l s GLU 49 N 1.08 3.67 0.25 2.72 2.02 0.22 -4.92 118.70 123.74 3h7l s GLU 49 Ca 0.03 -0.52 -0.30 0.00 0.02 0.00 0.00 54.97 54.21 3h7l s GLU 49 Cb -0.14 -2.92 -0.10 0.00 0.10 0.00 0.00 34.13 31.07 3h7l s GLU 49 CO 0.02 0.23 1.33 -1.21 0.02 0.00 0.00 175.26 175.66 3h7l s GLU 50 N 0.38 4.36 -0.02 1.61 2.02 -1.26 -0.50 118.70 125.30 3h7l s GLU 50 Ca -0.04 2.14 0.01 0.00 0.02 0.00 0.00 54.97 57.10 3h7l s GLU 50 Cb -0.14 -3.14 -0.02 0.00 0.10 0.00 0.00 34.13 30.93 3h7l s GLU 50 CO 0.03 -0.25 -0.01 1.04 0.02 0.00 0.00 175.26 176.09 3h7l n GLN 51 N 2.02 1.99 0.00 1.61 1.13 -0.48 -4.87 117.38 118.78 3h7l n GLN 51 Ca 0.04 0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.11 3h7l n GLN 51 Cb 0.42 -1.04 0.00 0.00 0.11 0.00 0.00 30.24 29.72 3h7l n GLN 51 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3h7l n GLY 52 N 3.13 -1.38 3.80 1.08 0.00 -1.11 -4.92 105.19 105.80 3h7l n GLY 52 Ca -0.03 -1.81 -0.33 0.00 0.00 0.00 0.00 46.02 43.85 3h7l n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h7l s LYS 53 N 0.00 3.46 -0.14 1.61 -0.14 -1.26 -2.02 119.74 121.25 3h7l s LYS 53 Ca 0.00 1.22 0.02 0.00 -1.36 0.00 0.00 55.97 55.85 3h7l s LYS 53 Cb 0.00 -2.05 0.01 0.00 -1.68 0.00 0.00 37.83 34.11 3h7l s LYS 53 CO 0.00 -0.70 -0.21 0.08 -0.76 0.00 0.00 175.35 173.76 3h7l s VAL 54 N -2.37 2.15 0.00 3.17 1.01 -1.26 -4.81 120.40 118.29 3h7l s VAL 54 Ca 0.64 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.67 3h7l s VAL 54 Cb -0.16 -1.86 0.00 0.00 0.00 0.00 0.00 36.38 34.36 3h7l s VAL 54 CO 0.33 0.55 0.00 0.00 0.00 0.00 0.00 175.10 175.98 3h7l n ALA 55 N 4.04 0.00 -1.77 5.51 0.00 -1.26 -0.74 120.51 126.29 3h7l n ALA 55 Ca -0.20 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.30 3h7l n ALA 55 Cb 0.52 0.00 0.17 0.00 0.00 0.00 0.00 19.45 20.14 3h7l n ALA 55 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3h7l n ASN 56 N 2.65 1.57 -4.72 0.00 5.15 -0.83 -5.02 115.26 114.07 3h7l n ASN 56 Ca 0.00 -3.51 -0.42 0.00 -0.60 0.00 0.00 54.58 50.05 3h7l n ASN 56 Cb 0.00 -0.48 -0.03 0.00 -0.53 0.00 0.00 39.78 38.74 3h7l n ASN 56 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 3h7l s TRP 57 N -2.57 3.05 -1.56 1.20 0.52 0.08 -4.03 118.94 115.63 3h7l s TRP 57 Ca 0.37 0.60 0.28 0.00 0.02 0.00 0.00 56.10 57.37 3h7l s TRP 57 Cb 0.37 -3.95 1.46 0.00 -1.15 0.00 0.00 33.47 30.20 3h7l s TRP 57 CO -0.09 -3.50 1.97 -2.39 0.02 0.00 0.00 176.95 172.96 3h7l n HIS 58 N 3.93 0.00 0.52 -1.98 1.44 -1.26 -3.95 115.22 113.92 3h7l n HIS 58 Ca 0.14 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.98 3h7l n HIS 58 Cb 0.38 -0.22 0.44 0.00 0.12 0.00 0.00 29.99 30.71 3h7l n HIS 58 CO 0.00 0.00 0.00 1.96 -2.81 0.00 0.00 176.34 175.49 3h7l h GLN 59 N 0.00 0.00 0.00 -1.40 7.50 -1.96 -3.49 115.11 115.76 3h7l h GLN 59 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 3h7l h GLN 59 Cb 0.20 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.73 3h7l h GLN 59 CO 0.00 0.00 0.00 0.41 -1.50 0.00 0.00 178.83 177.74 3h7l n GLY 60 N 0.76 0.67 3.69 3.46 0.00 -1.25 -4.37 105.19 108.14 3h7l n GLY 60 Ca 0.04 -1.38 -0.33 0.00 0.00 0.00 0.00 46.02 44.35 3h7l n GLY 60 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h7l s TYR 61 N 0.00 3.10 -0.03 1.61 2.02 0.20 -4.39 117.35 119.87 3h7l s TYR 61 Ca 0.00 0.11 0.07 0.00 -0.37 0.00 0.00 57.07 56.88 3h7l s TYR 61 Cb 0.00 -1.70 -0.02 0.00 -0.40 0.00 0.00 41.96 39.84 3h7l s TYR 61 CO 0.00 0.47 -0.25 -0.06 -1.57 0.00 0.00 175.55 174.14 3h7l s PHE 62 N -1.05 2.28 -0.07 2.71 0.08 -0.86 -1.42 117.98 119.65 3h7l s PHE 62 Ca 0.18 -0.49 0.02 0.00 0.12 0.00 0.00 56.93 56.76 3h7l s PHE 62 Cb -0.11 -1.47 0.01 0.00 -0.57 0.00 0.00 43.02 40.88 3h7l s PHE 62 CO 0.09 -0.08 -0.12 0.71 -0.10 0.00 0.00 175.22 175.72 3h7l s TYR 63 N -0.49 1.47 -0.02 0.36 1.51 0.42 -1.39 117.35 119.21 3h7l s TYR 63 Ca 0.07 -0.56 -0.18 0.00 -1.01 0.00 0.00 57.07 55.38 3h7l s TYR 63 Cb -0.11 -1.09 -0.05 0.00 -0.11 0.00 0.00 41.96 40.60 3h7l s TYR 63 CO 0.00 -0.30 0.50 -1.17 -1.11 0.00 0.00 175.55 173.48 3h7l s LEU 64 N 0.75 4.41 -0.15 -1.29 2.96 0.35 -0.39 118.68 125.31 3h7l s LEU 64 Ca -0.13 1.02 0.02 0.00 -0.22 0.00 0.00 54.13 54.82 3h7l s LEU 64 Cb -0.16 -2.76 0.02 0.00 0.50 0.00 0.00 46.19 43.79 3h7l s LEU 64 CO 0.03 0.16 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.39 3h7l s ILE 65 N -0.35 1.98 -0.40 6.68 1.01 0.49 -0.61 121.20 130.00 3h7l s ILE 65 Ca 0.27 -0.91 -0.05 0.00 0.00 0.00 0.00 60.65 59.96 3h7l s ILE 65 Cb -0.17 -1.77 0.09 0.00 0.01 0.00 0.00 42.46 40.61 3h7l s ILE 65 CO 0.14 0.53 0.20 -0.62 0.00 0.00 0.00 174.94 175.19 3h7l s ASP 66 N 1.06 5.37 -0.20 3.58 2.15 -1.26 -0.69 116.67 126.69 3h7l s ASP 66 Ca -0.01 -1.69 0.16 0.00 0.43 0.00 0.00 52.55 51.43 3h7l s ASP 66 Cb -0.14 -1.88 0.66 0.00 -0.30 0.00 0.00 42.92 41.25 3h7l s ASP 66 CO -0.07 -0.50 1.57 2.22 -0.17 0.00 0.00 175.17 178.22 3h7l n PHE 67 N 4.74 1.44 -0.35 -5.34 1.16 0.12 -4.71 117.46 114.51 3h7l n PHE 67 Ca -0.07 -0.80 0.25 0.00 -1.87 0.00 0.00 57.45 54.96 3h7l n PHE 67 Cb 0.42 -0.39 0.51 0.00 -1.61 0.00 0.00 39.48 38.41 3h7l n PHE 67 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 3h7l h SER 68 N 2.82 0.46 1.05 5.98 0.02 -1.77 -0.98 113.55 121.14 3h7l h SER 68 Ca 0.00 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3h7l h SER 68 Cb 1.66 0.08 0.00 0.00 0.14 0.00 0.00 62.40 64.28 3h7l h SER 68 CO 0.33 -0.03 0.00 0.77 -1.14 0.00 0.00 176.83 176.76 3h7l h SER 69 N 0.34 0.00 -3.19 3.07 4.64 -1.88 -3.43 113.55 113.10 3h7l h SER 69 Ca 0.69 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 61.48 3h7l h SER 69 Cb 1.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.82 3h7l h SER 69 CO -0.44 0.00 0.56 0.12 -0.87 0.00 0.00 176.83 176.20 3h7l s PHE 70 N -3.54 3.44 -0.10 4.77 5.36 -0.37 -4.95 117.98 122.58 3h7l s PHE 70 Ca 0.03 1.30 0.23 0.00 -0.96 0.00 0.00 56.93 57.53 3h7l s PHE 70 Cb 0.09 -3.42 0.45 0.00 -0.34 0.00 0.00 43.02 39.80 3h7l s PHE 70 CO 0.52 -1.28 1.16 0.25 -1.46 0.00 0.00 175.22 174.41 3h7l n THR 71 N 3.93 0.64 -4.37 0.12 -2.24 -1.26 -4.92 114.28 106.19 3h7l n THR 71 Ca 0.09 -1.87 -0.35 0.00 -2.27 0.00 0.00 64.05 59.66 3h7l n THR 71 Cb 0.46 0.92 -0.10 0.00 -2.10 0.00 0.00 70.33 69.51 3h7l n THR 71 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3h7l s ASP 72 N -2.70 5.14 0.59 3.42 1.01 -1.26 -4.92 116.67 117.95 3h7l s ASP 72 Ca 0.33 0.07 -0.16 0.00 0.71 0.00 0.00 52.55 53.50 3h7l s ASP 72 Cb 0.37 -1.55 -0.04 0.00 1.01 0.00 0.00 42.92 42.70 3h7l s ASP 72 CO -0.12 0.32 1.05 -0.44 0.21 0.00 0.00 175.17 176.20 3h7l s SER 73 N -0.53 5.84 0.00 0.27 0.01 -1.26 -4.76 113.70 113.27 3h7l s SER 73 Ca 0.09 1.81 0.00 0.00 1.31 0.00 0.00 55.95 59.16 3h7l s SER 73 Cb -0.12 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.58 3h7l s SER 73 CO 0.02 -1.13 0.00 0.61 0.41 0.00 0.00 173.24 173.16 3h7l n GLY 74 N -0.98 0.92 3.53 3.44 0.00 -0.77 -4.94 105.19 106.39 3h7l n GLY 74 Ca 0.09 -2.01 -0.34 0.00 0.00 0.00 0.00 46.02 43.76 3h7l n GLY 74 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3h7l s ASP 75 N -2.01 4.68 0.13 1.61 1.11 -1.26 -0.32 116.67 120.61 3h7l s ASP 75 Ca 0.00 -0.09 -0.02 0.00 0.18 0.00 0.00 52.55 52.63 3h7l s ASP 75 Cb 0.00 -1.49 -0.04 0.00 1.07 0.00 0.00 42.92 42.47 3h7l s ASP 75 CO 0.00 0.26 0.07 -0.31 1.18 0.00 0.00 175.17 176.37 3h7l s TYR 76 N -0.22 0.80 0.06 4.23 2.02 -0.41 -1.12 117.35 122.71 3h7l s TYR 76 Ca 0.03 -1.18 -0.02 0.00 -0.37 0.00 0.00 57.07 55.53 3h7l s TYR 76 Cb -0.13 -0.44 -0.04 0.00 -0.40 0.00 0.00 41.96 40.96 3h7l s TYR 76 CO 0.03 -0.53 0.01 -0.59 -1.57 0.00 0.00 175.55 172.90 3h7l s PHE 77 N -4.03 0.50 0.11 2.71 -0.12 -0.09 -0.99 117.98 116.08 3h7l s PHE 77 Ca 0.22 -1.02 0.01 0.00 -0.05 0.00 0.00 56.93 56.09 3h7l s PHE 77 Cb 0.07 -0.35 -0.04 0.00 -0.63 0.00 0.00 43.02 42.07 3h7l s PHE 77 CO 0.01 -0.42 0.26 -0.51 -0.05 0.00 0.00 175.22 174.51 3h7l s LEU 78 N -2.92 4.34 -0.09 -1.99 1.43 -1.26 -0.73 118.68 117.45 3h7l s LEU 78 Ca 0.08 0.23 -0.06 0.00 -1.03 0.00 0.00 54.13 53.35 3h7l s LEU 78 Cb 0.08 -2.95 0.03 0.00 0.03 0.00 0.00 46.19 43.38 3h7l s LEU 78 CO -0.09 0.10 0.23 -1.58 0.23 0.00 0.00 176.35 175.24 3h7l s GLN 79 N -2.91 0.23 -0.04 1.70 0.74 -0.01 -0.84 119.66 118.52 3h7l s GLN 79 Ca 0.35 0.41 -0.01 0.00 0.05 0.00 0.00 55.36 56.16 3h7l s GLN 79 Cb -0.12 0.00 0.03 0.00 1.10 0.00 0.00 33.01 34.02 3h7l s GLN 79 CO 0.28 -0.10 0.04 0.08 -0.55 0.00 0.00 175.29 175.05 3h7l s VAL 80 N 0.67 0.02 0.00 1.34 1.01 -0.59 -0.69 120.40 122.16 3h7l s VAL 80 Ca -0.05 0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.25 3h7l s VAL 80 Cb -0.06 -0.24 0.00 0.00 0.00 0.00 0.00 36.38 36.08 3h7l s VAL 80 CO -0.04 0.19 0.00 1.21 0.00 0.00 0.00 175.10 176.46 3h7l n GLU 81 N 5.07 0.00 -0.05 2.72 4.07 -1.26 0.05 120.64 131.24 3h7l n GLU 81 Ca -0.08 0.00 -0.10 0.00 -0.06 0.00 0.00 57.16 56.92 3h7l n GLU 81 Cb 0.50 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.85 3h7l n GLU 81 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 3h7l h ASP 82 N 0.00 0.26 -2.37 4.31 3.45 -2.00 -3.47 116.42 116.60 3h7l h ASP 82 Ca 0.00 -0.06 -0.60 0.00 0.43 0.00 0.00 57.03 56.80 3h7l h ASP 82 Cb 0.00 -0.07 -0.13 0.00 -0.56 0.00 0.00 39.33 38.57 3h7l h ASP 82 CO 0.00 0.24 -0.74 -0.55 -1.57 0.00 0.00 179.24 176.63 3h7l s SER 83 N -5.46 3.84 -0.03 6.45 0.15 0.11 -5.12 113.70 113.63 3h7l s SER 83 Ca -0.13 -0.89 -0.02 0.00 0.70 0.00 0.00 55.95 55.60 3h7l s SER 83 Cb 0.08 -0.45 0.01 0.00 -1.71 0.00 0.00 66.02 63.96 3h7l s SER 83 CO 0.70 0.04 0.08 -0.60 1.20 0.00 0.00 173.24 174.66 3h7l s ARG 84 N -3.41 0.07 0.68 5.44 3.00 -1.26 -1.54 118.95 121.93 3h7l s ARG 84 Ca 0.29 0.14 -0.08 0.00 -1.00 0.00 0.00 55.73 55.08 3h7l s ARG 84 Cb -0.06 -0.01 0.04 0.00 0.00 0.00 0.00 34.95 34.92 3h7l s ARG 84 CO 0.16 -0.04 1.02 -1.54 0.00 0.00 0.00 175.30 174.89 3h7l s SER 85 N 0.28 5.13 0.91 -2.12 1.04 -0.02 -4.49 113.70 114.43 3h7l s SER 85 Ca -0.02 0.70 -0.12 0.00 0.48 0.00 0.00 55.95 56.99 3h7l s SER 85 Cb -0.03 -1.46 0.14 0.00 0.10 0.00 0.00 66.02 64.76 3h7l s SER 85 CO -0.01 -1.43 1.14 -0.94 0.98 0.00 0.00 173.24 172.98 3h7l s SER 86 N -4.43 3.52 -0.19 7.02 1.04 -1.26 -4.56 113.70 114.83 3h7l s SER 86 Ca 0.58 0.95 -0.25 0.00 0.48 0.00 0.00 55.95 57.71 3h7l s SER 86 Cb -0.11 -1.52 -0.01 0.00 0.10 0.00 0.00 66.02 64.48 3h7l s SER 86 CO 0.47 -2.54 0.81 -0.89 0.98 0.00 0.00 173.24 172.07 3h7l s THR 87 N -3.29 4.88 0.31 2.02 2.01 -1.26 -4.60 115.64 115.71 3h7l s THR 87 Ca 0.64 1.57 0.09 0.00 0.31 0.00 0.00 61.69 64.31 3h7l s THR 87 Cb -0.15 -4.11 -0.05 0.00 0.01 0.00 0.00 72.50 68.20 3h7l s THR 87 CO 0.53 0.01 0.00 0.72 -0.69 0.00 0.00 174.62 175.19 3h7l s PHE 88 N 2.33 2.59 -0.03 4.92 -0.12 -0.16 -4.88 117.98 122.63 3h7l s PHE 88 Ca 0.36 -0.34 -0.03 0.00 -0.05 0.00 0.00 56.93 56.87 3h7l s PHE 88 Cb -0.16 -1.35 -0.04 0.00 -0.63 0.00 0.00 43.02 40.84 3h7l s PHE 88 CO 0.11 0.54 0.14 0.99 -0.05 0.00 0.00 175.22 176.94 3h7l s THR 89 N -2.44 5.19 -0.18 -4.49 2.01 -0.89 -1.29 115.64 113.55 3h7l s THR 89 Ca 0.33 -0.16 -0.02 0.00 0.31 0.00 0.00 61.69 62.15 3h7l s THR 89 Cb -0.03 -3.37 -0.01 0.00 0.01 0.00 0.00 72.50 69.10 3h7l s THR 89 CO 0.19 0.40 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.76 3h7l s VAL 90 N -1.21 3.29 -0.09 3.82 1.01 0.56 -1.14 120.40 126.63 3h7l s VAL 90 Ca 0.23 -0.55 -0.32 0.00 0.00 0.00 0.00 61.98 61.34 3h7l s VAL 90 Cb -0.12 -2.45 0.13 0.00 0.00 0.00 0.00 36.38 33.94 3h7l s VAL 90 CO 0.14 0.47 1.42 -0.83 0.00 0.00 0.00 175.10 176.29 3h7l s GLY 91 N 0.93 -0.40 0.19 4.51 0.00 -0.76 -1.84 107.32 109.95 3h7l s GLY 91 Ca -0.01 0.66 -0.30 0.00 0.00 0.00 0.00 44.72 45.07 3h7l s GLY 91 CO 0.00 2.69 1.36 -0.54 0.00 0.00 0.00 173.10 176.61 3h7l s GLU 92 N -2.02 4.35 -1.45 2.90 8.01 -1.26 -2.39 118.70 126.85 3h7l s GLU 92 Ca 0.21 2.11 -0.10 0.00 0.01 0.00 0.00 54.97 57.20 3h7l s GLU 92 Cb 0.05 -3.19 0.05 0.00 -4.31 0.00 0.00 34.13 26.73 3h7l s GLU 92 CO -0.05 -0.33 0.99 0.72 0.01 0.00 0.00 175.26 176.60 3h7l n HIS 93 N 2.87 -2.37 -0.01 1.61 8.25 -1.26 -4.89 115.22 119.42 3h7l n HIS 93 Ca 0.07 0.92 -0.12 0.00 -0.26 0.00 0.00 57.72 58.34 3h7l n HIS 93 Cb 0.42 -4.33 -0.08 0.00 1.12 0.00 0.00 29.99 27.12 3h7l n HIS 93 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 3h7l h ILE 94 N -2.19 1.21 -0.31 1.59 6.09 -1.88 0.10 117.51 122.13 3h7l h ILE 94 Ca -0.58 -0.65 -0.09 0.00 -1.37 0.00 0.00 64.86 62.16 3h7l h ILE 94 Cb 1.37 1.56 -0.02 0.00 0.47 0.00 0.00 36.82 40.20 3h7l h ILE 94 CO 0.62 0.18 -0.19 -0.07 -3.07 0.00 0.00 178.15 175.62 3h7l h LEU 95 N -0.17 0.56 0.55 2.19 3.38 -1.91 -1.46 115.31 118.46 3h7l h LEU 95 Ca 0.02 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 3h7l h LEU 95 Cb 0.28 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3h7l h LEU 95 CO 0.00 0.77 -0.28 0.25 0.09 0.00 0.00 178.44 179.27 3h7l h LEU 96 N 0.51 -0.68 -1.00 1.67 5.85 -1.78 -1.51 115.31 118.36 3h7l h LEU 96 Ca 0.08 0.03 0.24 0.00 0.84 0.00 0.00 57.88 59.07 3h7l h LEU 96 Cb 0.62 0.18 -0.12 0.00 0.37 0.00 0.00 40.66 41.71 3h7l h LEU 96 CO 0.04 -0.46 0.60 0.78 -0.34 0.00 0.00 178.44 179.06 3h7l h ASN 97 N -0.76 0.70 0.50 1.25 4.21 -0.74 -2.46 115.58 118.27 3h7l h ASN 97 Ca -0.07 0.13 -0.25 0.00 1.21 0.00 0.00 56.30 57.32 3h7l h ASN 97 Cb 0.59 0.02 -0.04 0.00 -1.12 0.00 0.00 38.32 37.77 3h7l h ASN 97 CO 0.11 0.13 -1.69 0.00 -1.29 0.00 0.00 177.43 174.69 3h7l n GLN 98 N -4.87 0.64 0.00 0.81 1.13 -0.56 -4.72 117.38 109.81 3h7l n GLN 98 Ca 0.26 0.22 0.00 0.00 -1.94 0.00 0.00 57.00 55.54 3h7l n GLN 98 Cb 0.72 -1.76 0.00 0.00 0.11 0.00 0.00 30.24 29.31 3h7l n GLN 98 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3h7l n THR 99 N -2.93 0.00 0.11 5.09 -2.24 -0.57 -4.80 114.28 108.95 3h7l n THR 99 Ca -0.16 -0.05 -0.13 0.00 -2.27 0.00 0.00 64.05 61.44 3h7l n THR 99 Cb 0.97 0.47 -0.08 0.00 -2.10 0.00 0.00 70.33 69.59 3h7l n THR 99 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3h7l h LEU 100 N 0.00 -0.18 -1.07 3.22 5.85 -1.52 -2.73 115.31 118.88 3h7l h LEU 100 Ca 0.00 -0.03 0.15 0.00 0.84 0.00 0.00 57.88 58.83 3h7l h LEU 100 Cb 0.00 0.05 -0.09 0.00 0.37 0.00 0.00 40.66 40.99 3h7l h LEU 100 CO 0.00 -0.08 0.62 -1.28 -0.34 0.00 0.00 178.44 177.35 3h7l h SER 101 N -0.26 0.82 0.37 1.25 0.87 -1.88 -0.52 113.55 114.20 3h7l h SER 101 Ca -0.02 0.06 -0.12 0.00 -1.23 0.00 0.00 61.79 60.48 3h7l h SER 101 Cb 0.20 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 3h7l h SER 101 CO 0.04 0.39 -0.51 0.44 -0.53 0.00 0.00 176.83 176.65 3h7l h ASP 102 N 0.86 0.18 -0.09 6.23 3.32 -1.83 -2.15 116.42 122.94 3h7l h ASP 102 Ca 0.51 -0.09 -0.14 0.00 0.02 0.00 0.00 57.03 57.33 3h7l h ASP 102 Cb 0.68 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.17 3h7l h ASP 102 CO -0.29 0.66 -0.43 0.58 -1.72 0.00 0.00 179.24 178.05 3h7l h VAL 103 N 0.13 1.30 0.13 -1.35 2.07 -0.82 -1.15 116.25 116.56 3h7l h VAL 103 Ca 0.00 -1.61 -0.01 0.00 0.82 0.00 0.00 66.70 65.91 3h7l h VAL 103 Cb 0.95 1.56 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 3h7l h VAL 103 CO 0.08 0.51 -0.06 0.40 0.02 0.00 0.00 177.57 178.51 3h7l h ILE 104 N 0.51 0.95 -0.40 4.57 2.04 -1.24 -1.68 117.51 122.27 3h7l h ILE 104 Ca 0.04 -0.32 0.09 0.00 1.00 0.00 0.00 64.86 65.67 3h7l h ILE 104 Cb 0.95 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 38.16 3h7l h ILE 104 CO 0.09 0.08 0.28 0.45 0.00 0.00 0.00 178.15 179.04 3h7l h HIS 105 N -0.33 0.11 -0.18 1.37 3.86 -1.38 -0.03 115.15 118.57 3h7l h HIS 105 Ca -0.02 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 3h7l h HIS 105 Cb 0.27 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.69 3h7l h HIS 105 CO -0.02 0.06 0.09 -0.92 0.86 0.00 0.00 177.93 178.00 3h7l h TYR 106 N 0.11 0.25 -0.27 2.45 3.20 -0.70 -0.51 116.97 121.50 3h7l h TYR 106 Ca 0.19 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.01 3h7l h TYR 106 Cb 0.60 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.78 3h7l h TYR 106 CO -0.00 0.26 0.01 0.74 -1.64 0.00 0.00 178.16 177.52 3h7l h PHE 107 N 0.17 0.51 -0.99 -3.82 0.04 -0.14 -2.20 116.94 110.53 3h7l h PHE 107 Ca 0.06 -0.09 0.04 0.00 2.80 0.00 0.00 57.97 60.79 3h7l h PHE 107 Cb 0.09 -0.14 -0.06 0.00 2.20 0.00 0.00 35.95 38.05 3h7l h PHE 107 CO -0.03 0.62 0.65 -0.22 -0.60 0.00 0.00 178.31 178.72 3h7l h LYS 108 N 0.26 1.20 0.00 1.51 3.64 -1.18 -0.39 116.57 121.61 3h7l h LYS 108 Ca 0.08 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 3h7l h LYS 108 Cb 0.41 -0.27 -0.00 0.00 -0.41 0.00 0.00 32.23 31.95 3h7l h LYS 108 CO 0.01 0.79 -0.09 0.66 -2.27 0.00 0.00 179.45 178.56 3h7l h SER 109 N 1.24 0.00 -0.06 4.20 4.64 -0.87 -3.05 113.55 119.65 3h7l h SER 109 Ca 0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.72 3h7l h SER 109 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3h7l h SER 109 CO -0.13 0.09 0.00 0.00 -0.87 0.00 0.00 176.83 175.92 3h7l n GLN 110 N -3.43 2.28 -1.67 4.77 1.13 -0.21 -4.97 117.38 115.28 3h7l n GLN 110 Ca -0.01 -1.86 -0.41 0.00 -1.94 0.00 0.00 57.00 52.77 3h7l n GLN 110 Cb 0.24 -1.47 0.01 0.00 0.11 0.00 0.00 30.24 29.13 3h7l n GLN 110 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3h7l n ARG 111 N 1.25 1.71 -2.08 -1.09 1.74 -0.89 -1.07 116.66 116.23 3h7l n ARG 111 Ca 0.15 0.61 -0.42 0.00 -0.77 0.00 0.00 57.85 57.42 3h7l n ARG 111 Cb 0.58 -2.26 -0.03 0.00 -1.02 0.00 0.00 32.46 29.73 3h7l n ARG 111 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3h7l s GLY 113 N 0.59 1.05 0.00 0.00 0.00 -1.26 -4.73 107.32 102.97 3h7l s GLY 113 Ca 0.61 -1.22 0.00 0.00 0.00 0.00 0.00 44.72 44.11 3h7l s GLY 113 CO 0.38 -0.70 0.00 0.61 0.00 0.00 0.00 173.10 173.39 3h7l n GLY 114 N -0.57 2.66 0.28 0.20 0.00 -1.26 -1.94 105.19 104.57 3h7l n GLY 114 Ca -0.03 -0.27 0.13 0.00 0.00 0.00 0.00 46.02 45.85 3h7l n GLY 114 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3h7l h VAL 115 N 0.00 0.64 0.01 1.61 -1.51 -2.01 -1.58 116.25 113.41 3h7l h VAL 115 Ca 0.00 -0.11 -0.00 0.00 -1.23 0.00 0.00 66.70 65.36 3h7l h VAL 115 Cb 0.00 1.07 0.00 0.00 -2.13 0.00 0.00 31.29 30.23 3h7l h VAL 115 CO 0.00 0.03 -0.00 -0.26 -1.23 0.00 0.00 177.57 176.10 3h7l h PHE 116 N 0.00 -0.01 -0.67 5.19 0.04 -1.92 -2.97 116.94 116.60 3h7l h PHE 116 Ca -0.00 -0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.70 3h7l h PHE 116 Cb 0.07 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.19 3h7l h PHE 116 CO 0.00 0.77 0.15 0.22 -0.60 0.00 0.00 178.31 178.85 3h7l h ASP 117 N -0.82 1.02 -0.54 2.17 3.58 -1.05 -1.47 116.42 119.32 3h7l h ASP 117 Ca -0.00 -0.22 -0.02 0.00 0.42 0.00 0.00 57.03 57.21 3h7l h ASP 117 Cb 0.78 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 41.54 3h7l h ASP 117 CO 0.00 0.99 0.26 1.56 -2.88 0.00 0.00 179.24 179.17 3h7l h GLN 118 N 1.02 0.77 -0.49 0.28 4.20 -1.42 -2.02 115.11 117.45 3h7l h GLN 118 Ca 0.21 -0.11 -0.02 0.00 0.06 0.00 0.00 58.65 58.80 3h7l h GLN 118 Cb 0.38 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 3h7l h GLN 118 CO 0.00 0.63 0.23 0.37 -0.67 0.00 0.00 178.83 179.39 3h7l h GLN 119 N 0.72 0.68 0.00 1.46 5.75 -1.36 -2.92 115.11 119.44 3h7l h GLN 119 Ca 0.18 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.60 3h7l h GLN 119 Cb 0.11 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 28.52 3h7l h GLN 119 CO -0.02 0.53 0.00 -0.25 -2.65 0.00 0.00 178.83 176.44 3h7l n ASP 120 N -4.38 0.00 -0.56 -0.69 8.00 -0.57 -1.33 116.55 117.02 3h7l n ASP 120 Ca 0.04 -0.61 0.13 0.00 0.71 0.00 0.00 54.79 55.07 3h7l n ASP 120 Cb 0.13 0.00 0.42 0.00 -0.02 0.00 0.00 41.12 41.65 3h7l n ASP 120 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3h7l n ARG 121 N -0.97 1.74 -2.73 -1.24 1.74 -1.10 0.33 116.66 114.42 3h7l n ARG 121 Ca 0.13 -1.12 -0.09 0.00 -0.77 0.00 0.00 57.85 55.99 3h7l n ARG 121 Cb 0.06 -1.48 0.07 0.00 -1.02 0.00 0.00 32.46 30.10 3h7l n ARG 121 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3h7l n GLN 122 N 0.35 1.14 -3.43 5.56 1.13 -0.44 -3.87 117.38 117.81 3h7l n GLN 122 Ca 0.17 -2.42 -0.37 0.00 -1.94 0.00 0.00 57.00 52.45 3h7l n GLN 122 Cb 0.40 -0.69 -0.07 0.00 0.11 0.00 0.00 30.24 29.99 3h7l n GLN 122 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3h7l s VAL 123 N -1.06 5.25 -0.07 5.09 1.01 -0.48 -4.82 120.40 125.33 3h7l s VAL 123 Ca 0.25 0.72 -0.32 0.00 0.00 0.00 0.00 61.98 62.63 3h7l s VAL 123 Cb 0.40 -3.72 -0.10 0.00 0.00 0.00 0.00 36.38 32.96 3h7l s VAL 123 CO -0.04 0.35 1.95 -2.65 0.00 0.00 0.00 175.10 174.70 3h7l n PRO 124 N 3.74 2.36 -2.99 2.72 -0.02 -1.26 -1.33 135.00 138.22 3h7l n PRO 124 Ca -0.10 0.85 -0.42 0.00 -2.02 0.00 0.00 63.50 61.81 3h7l n PRO 124 Cb 0.52 -2.80 -0.05 0.00 -0.02 0.00 0.00 33.50 31.14 3h7l n PRO 124 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3h7l s VAL 125 N 4.63 4.77 0.17 -1.45 1.01 -1.11 -0.72 120.40 127.70 3h7l s VAL 125 Ca 0.93 0.84 -0.33 0.00 0.00 0.00 0.00 61.98 63.42 3h7l s VAL 125 Cb -0.59 -4.18 -0.13 0.00 0.00 0.00 0.00 36.38 31.48 3h7l s VAL 125 CO 0.47 -0.39 1.62 -0.11 0.00 0.00 0.00 175.10 176.69 3h7l n LEU 126 N 6.32 3.30 -4.00 3.92 7.94 -0.90 -2.20 117.00 131.38 3h7l n LEU 126 Ca 0.02 1.08 -0.32 0.00 -1.11 0.00 0.00 56.01 55.68 3h7l n LEU 126 Cb 0.48 -1.46 0.01 0.00 0.53 0.00 0.00 43.42 42.98 3h7l n LEU 126 CO 0.52 -0.18 0.06 0.59 -1.11 0.00 0.00 177.39 177.27 3h7l n ASN 127 N 3.61 -4.21 0.00 1.96 3.02 -1.26 -4.85 115.26 113.54 3h7l n ASN 127 Ca 0.17 -0.85 0.00 0.00 -0.03 0.00 0.00 54.58 53.87 3h7l n ASN 127 Cb 0.30 -3.55 0.00 0.00 -0.61 0.00 0.00 39.78 35.92 3h7l n ASN 127 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h7l n ALA 128 N -4.59 0.95 -3.92 5.41 0.00 -0.93 -5.04 120.51 112.39 3h7l n ALA 128 Ca 0.04 -0.14 -0.31 0.00 0.00 0.00 0.00 53.44 53.03 3h7l n ALA 128 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 3h7l n ALA 128 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3h7l n ASN 129 N -0.13 -4.22 -0.82 0.00 5.15 -1.26 -4.92 115.26 109.07 3h7l n ASN 129 Ca 0.00 -0.79 0.00 0.00 -0.60 0.00 0.00 54.58 53.19 3h7l n ASN 129 Cb 0.10 -3.40 0.00 0.00 -0.53 0.00 0.00 39.78 35.95 3h7l n ASN 129 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3h7l n GLN 130 N -4.43 0.00 -3.78 1.20 10.64 -1.26 -5.10 117.38 114.66 3h7l n GLN 130 Ca 0.05 0.00 -0.13 0.00 -1.83 0.00 0.00 57.00 55.09 3h7l n GLN 130 Cb 0.52 0.00 -0.11 0.00 -0.86 0.00 0.00 30.24 29.79 3h7l n GLN 130 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 3h7l s THR 131 N -2.62 0.02 0.07 -0.39 2.01 -1.26 -2.77 115.64 110.70 3h7l s THR 131 Ca 0.00 -0.14 0.08 0.00 0.31 0.00 0.00 61.69 61.94 3h7l s THR 131 Cb 0.00 -0.46 -0.03 0.00 0.01 0.00 0.00 72.50 72.02 3h7l s THR 131 CO 0.00 -0.07 -0.21 0.00 -0.69 0.00 0.00 174.62 173.64 3h7l s ALA 132 N -0.23 1.82 -0.76 7.40 0.00 -0.44 -4.89 121.76 124.67 3h7l s ALA 132 Ca -0.04 -1.16 -0.18 0.00 0.00 0.00 0.00 51.96 50.58 3h7l s ALA 132 Cb -0.03 -0.31 0.13 0.00 0.00 0.00 0.00 23.12 22.91 3h7l s ALA 132 CO 0.01 0.39 0.88 0.34 0.00 0.00 0.00 175.76 177.38 3h7l s ASP 133 N -1.51 6.45 -0.34 0.00 2.15 -1.25 -1.38 116.67 120.79 3h7l s ASP 133 Ca 0.07 -1.87 0.06 0.00 0.43 0.00 0.00 52.55 51.25 3h7l s ASP 133 Cb -0.09 -2.32 0.46 0.00 -0.30 0.00 0.00 42.92 40.66 3h7l s ASP 133 CO 0.03 -1.01 1.27 1.33 -0.17 0.00 0.00 175.17 176.62 3h7l n VAL 134 N 5.23 2.64 -1.81 1.11 0.24 0.15 -4.81 118.33 121.07 3h7l n VAL 134 Ca 0.07 -4.13 -0.33 0.00 -2.04 0.00 0.00 64.34 57.90 3h7l n VAL 134 Cb 0.46 -1.15 0.04 0.00 -1.47 0.00 0.00 33.84 31.72 3h7l n VAL 134 CO 0.00 0.00 0.00 -1.38 -2.14 0.00 0.00 176.83 173.31 3h7l s HIS 135 N -3.62 2.60 0.00 6.34 -3.43 -0.88 -4.87 115.29 111.43 3h7l s HIS 135 Ca 0.52 1.55 0.00 0.00 -0.80 0.00 0.00 55.06 56.33 3h7l s HIS 135 Cb 0.42 -3.20 0.00 0.00 -1.43 0.00 0.00 32.58 28.37 3h7l s HIS 135 CO 0.02 -1.71 0.00 0.41 -2.00 0.00 0.00 174.74 171.46 3h7l n GLY 136 N -0.39 -1.26 3.92 -1.38 0.00 -1.26 -4.70 105.19 100.13 3h7l n GLY 136 Ca 0.11 -2.13 0.01 0.00 0.00 0.00 0.00 46.02 44.01 3h7l n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h7l n GLY 137 N -0.02 -2.06 3.58 -0.02 0.00 -1.26 -4.58 105.19 100.84 3h7l n GLY 137 Ca 0.00 -1.42 -0.27 0.00 0.00 0.00 0.00 46.02 44.33 3h7l n GLY 137 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3h7l s TRP 138 N -0.54 2.68 0.53 1.61 0.51 -1.26 -0.62 118.94 121.84 3h7l s TRP 138 Ca 0.00 -0.20 -0.21 0.00 -2.12 0.00 0.00 56.10 53.57 3h7l s TRP 138 Cb 0.00 -1.33 -0.06 0.00 -0.81 0.00 0.00 33.47 31.28 3h7l s TRP 138 CO 0.00 0.49 1.21 0.71 -0.51 0.00 0.00 176.95 178.86 3h7l s TYR 139 N -1.60 2.59 0.00 -1.98 2.02 -0.23 -4.63 117.35 113.52 3h7l s TYR 139 Ca 0.24 1.50 -0.20 0.00 -0.37 0.00 0.00 57.07 58.24 3h7l s TYR 139 Cb -0.09 -3.48 -0.24 0.00 -0.40 0.00 0.00 41.96 37.75 3h7l s TYR 139 CO 0.15 -2.01 1.09 0.22 -1.57 0.00 0.00 175.55 173.44 3h7l h ASP 140 N 1.48 0.53 -5.31 2.29 3.58 -0.82 -3.45 116.42 114.73 3h7l h ASP 140 Ca -0.50 -0.76 -0.31 0.00 0.42 0.00 0.00 57.03 55.87 3h7l h ASP 140 Cb 1.27 -0.16 -0.15 0.00 1.72 0.00 0.00 39.33 42.02 3h7l h ASP 140 CO 0.58 1.23 -0.59 0.00 -2.88 0.00 0.00 179.24 177.57 3h7l s ALA 141 N -3.19 1.47 0.16 -0.78 0.00 -0.99 -1.49 121.76 116.94 3h7l s ALA 141 Ca -0.13 -1.78 0.32 0.00 0.00 0.00 0.00 51.96 50.36 3h7l s ALA 141 Cb 0.03 1.31 1.33 0.00 0.00 0.00 0.00 23.12 25.79 3h7l s ALA 141 CO 0.82 -0.56 1.98 0.77 0.00 0.00 0.00 175.76 178.76 3h7l h SER 142 N 2.46 0.00 -0.12 0.00 0.02 -1.83 -2.89 113.55 111.19 3h7l h SER 142 Ca -0.35 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.59 3h7l h SER 142 Cb 1.25 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.78 3h7l h SER 142 CO 0.52 0.06 -0.03 0.61 -1.14 0.00 0.00 176.83 176.85 3h7l n GLY 143 N -0.05 4.58 2.92 -3.77 0.00 -1.26 -4.41 105.19 103.20 3h7l n GLY 143 Ca 0.00 -1.12 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 3h7l n GLY 143 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3h7l s ASP 144 N -2.52 0.60 0.00 1.61 2.15 -1.09 -4.97 116.67 112.45 3h7l s ASP 144 Ca 0.37 0.26 0.28 0.00 0.43 0.00 0.00 52.55 53.89 3h7l s ASP 144 Cb 0.31 0.77 1.07 0.00 -0.30 0.00 0.00 42.92 44.77 3h7l s ASP 144 CO 0.05 -0.28 1.76 1.33 -0.17 0.00 0.00 175.17 177.85 3h7l n VAL 145 N 5.35 0.00 -1.04 1.11 0.24 -1.26 -2.11 118.33 120.62 3h7l n VAL 145 Ca -0.05 -0.12 -0.32 0.00 -2.04 0.00 0.00 64.34 61.80 3h7l n VAL 145 Cb 0.50 0.18 0.13 0.00 -1.47 0.00 0.00 33.84 33.18 3h7l n VAL 145 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 3h7l s SER 146 N -2.35 3.57 -0.09 -1.34 0.01 -1.26 -4.66 113.70 107.58 3h7l s SER 146 Ca 0.30 2.22 0.03 0.00 1.31 0.00 0.00 55.95 59.81 3h7l s SER 146 Cb 0.20 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.87 3h7l s SER 146 CO 0.45 -2.67 -0.17 -0.54 0.41 0.00 0.00 173.24 170.72 3h7l s LYS 147 N -4.39 2.30 -0.04 12.44 1.02 -0.32 -1.86 119.74 128.89 3h7l s LYS 147 Ca 0.69 -0.62 0.04 0.00 0.02 0.00 0.00 55.97 56.11 3h7l s LYS 147 Cb -0.25 -1.83 -0.00 0.00 -0.52 0.00 0.00 37.83 35.22 3h7l s LYS 147 CO 0.53 0.06 -0.17 0.71 -0.92 0.00 0.00 175.35 175.57 3h7l s TYR 148 N 0.61 1.62 -0.01 3.18 2.02 -1.26 -0.19 117.35 123.33 3h7l s TYR 148 Ca -0.15 -0.43 -0.01 0.00 -0.37 0.00 0.00 57.07 56.12 3h7l s TYR 148 Cb -0.16 -1.08 -0.27 0.00 -0.40 0.00 0.00 41.96 40.05 3h7l s TYR 148 CO 0.05 -0.13 0.81 -0.07 -1.57 0.00 0.00 175.55 174.64 3h7l h LEU 149 N 6.14 0.33 0.00 -1.29 4.07 -0.84 -2.06 115.31 121.66 3h7l h LEU 149 Ca -0.34 -0.49 0.09 0.00 0.08 0.00 0.00 57.88 57.22 3h7l h LEU 149 Cb 1.17 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 42.79 3h7l h LEU 149 CO 0.48 1.41 0.40 -0.24 -1.08 0.00 0.00 178.44 179.41 3h7l n SER 150 N -3.40 -1.46 -0.80 -0.43 2.88 -1.24 -1.85 113.62 107.31 3h7l n SER 150 Ca -0.17 -1.84 0.00 0.00 -1.33 0.00 0.00 58.87 55.53 3h7l n SER 150 Cb 1.04 2.39 0.00 0.00 -0.75 0.00 0.00 64.21 66.89 3h7l n SER 150 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3h7l n HIS 151 N -0.53 -0.74 -2.41 0.66 1.44 -1.26 -4.65 115.22 107.73 3h7l n HIS 151 Ca -0.03 0.00 -0.19 0.00 -2.01 0.00 0.00 57.72 55.49 3h7l n HIS 151 Cb 0.46 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.56 3h7l n HIS 151 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3h7l n LEU 152 N 0.00 -1.79 -0.04 2.39 4.77 -1.26 -4.18 117.00 116.89 3h7l n LEU 152 Ca 0.00 0.02 -0.00 0.00 -0.03 0.00 0.00 56.01 56.00 3h7l n LEU 152 Cb 0.00 -2.79 0.28 0.00 -2.33 0.00 0.00 43.42 38.59 3h7l n LEU 152 CO 0.00 -0.20 0.99 0.28 -1.33 0.00 0.00 177.39 177.13 3h7l h SER 153 N -0.01 0.57 0.06 -1.43 0.02 -1.95 -2.24 113.55 108.58 3h7l h SER 153 Ca -0.46 -0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 60.40 3h7l h SER 153 Cb 1.34 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 63.73 3h7l h SER 153 CO 0.54 0.58 -0.01 0.10 -1.14 0.00 0.00 176.83 176.90 3h7l h TYR 154 N 0.60 0.00 0.00 3.45 -0.00 -1.90 -1.29 116.97 117.83 3h7l h TYR 154 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.87 3h7l h TYR 154 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.98 3h7l h TYR 154 CO 0.01 0.01 -0.39 0.00 -0.00 0.00 0.00 178.16 177.79 3h7l n ALA 155 N -2.18 2.69 0.00 0.10 0.00 -0.84 -4.94 120.51 115.33 3h7l n ALA 155 Ca -0.03 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.25 3h7l n ALA 155 Cb 0.09 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.26 3h7l n ALA 155 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3h7l n ASN 156 N -2.17 0.00 -0.75 0.00 3.02 -0.49 -4.41 115.26 110.46 3h7l n ASN 156 Ca 0.04 0.00 0.07 0.00 -0.03 0.00 0.00 54.58 54.66 3h7l n ASN 156 Cb 0.44 0.00 0.16 0.00 -0.61 0.00 0.00 39.78 39.77 3h7l n ASN 156 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3h7l n TYR 157 N 0.00 0.45 0.00 3.10 4.01 -1.26 -4.58 117.16 118.88 3h7l n TYR 157 Ca 0.00 -0.39 0.05 0.00 -0.16 0.00 0.00 57.90 57.40 3h7l n TYR 157 Cb 0.00 -0.02 -0.08 0.00 -0.31 0.00 0.00 39.34 38.94 3h7l n TYR 157 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3h7l n LEU 158 N 0.77 0.01 -3.26 7.72 4.32 -1.26 -4.89 117.00 120.42 3h7l n LEU 158 Ca 0.13 -0.01 -0.37 0.00 -0.02 0.00 0.00 56.01 55.74 3h7l n LEU 158 Cb 0.44 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.14 3h7l n LEU 158 CO 0.10 0.00 1.48 0.59 -1.22 0.00 0.00 177.39 178.34 3h7l n ASN 159 N -1.84 0.38 -4.80 -1.43 4.13 -1.26 -4.95 115.26 105.49 3h7l n ASN 159 Ca -0.02 0.31 -0.39 0.00 1.68 0.00 0.00 54.58 56.17 3h7l n ASN 159 Cb 0.26 -0.68 -0.06 0.00 -1.54 0.00 0.00 39.78 37.77 3h7l n ASN 159 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 3h7l s PRO 160 N 5.61 4.38 -0.22 3.52 0.05 -1.26 -4.97 135.00 142.11 3h7l s PRO 160 Ca 0.95 0.95 -0.25 0.00 0.05 0.00 0.00 61.00 62.70 3h7l s PRO 160 Cb -1.02 -3.21 -0.01 0.00 0.05 0.00 0.00 34.50 30.31 3h7l s PRO 160 CO 0.43 0.58 0.83 -0.65 0.05 0.00 0.00 177.00 178.24 3h7l s GLN 161 N -1.23 4.22 0.00 4.56 -1.52 -1.26 -4.31 119.66 120.12 3h7l s GLN 161 Ca 0.34 0.97 0.00 0.00 -1.95 0.00 0.00 55.36 54.72 3h7l s GLN 161 Cb -0.21 -3.62 0.00 0.00 -0.22 0.00 0.00 33.01 28.96 3h7l s GLN 161 CO 0.23 -0.46 0.00 1.04 -0.25 0.00 0.00 175.29 175.84 3h7l n GLN 162 N 5.79 0.00 -0.27 2.91 6.02 -0.77 -4.56 117.38 126.49 3h7l n GLN 162 Ca 0.05 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.12 3h7l n GLN 162 Cb 0.48 0.00 0.22 0.00 1.02 0.00 0.00 30.24 31.96 3h7l n GLN 162 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 3h7l h THR 163 N 0.00 0.54 0.00 5.09 2.02 -1.55 -0.58 112.91 118.43 3h7l h THR 163 Ca 0.00 -0.12 -0.08 0.00 0.77 0.00 0.00 66.41 66.98 3h7l h THR 163 Cb 0.00 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.54 3h7l h THR 163 CO 0.00 0.07 -0.39 -0.65 0.37 0.00 0.00 175.52 174.92 3h7l h PRO 164 N 0.36 0.00 -0.76 6.66 0.11 -1.82 -2.75 132.00 133.80 3h7l h PRO 164 Ca 0.46 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.54 3h7l h PRO 164 Cb 0.80 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.88 3h7l h PRO 164 CO -0.49 0.39 0.36 1.98 -0.21 0.00 0.00 178.00 180.02 3h7l h MET 165 N 0.00 1.11 -0.35 1.05 4.05 -1.37 0.16 114.93 119.58 3h7l h MET 165 Ca -0.00 -0.17 0.07 0.00 -0.28 0.00 0.00 59.70 59.32 3h7l h MET 165 Cb 0.70 -0.20 -0.07 0.00 -0.80 0.00 0.00 31.60 31.24 3h7l h MET 165 CO 0.05 0.87 -0.07 0.28 0.23 0.00 0.00 176.91 178.27 3h7l h VAL 166 N 1.08 0.66 -0.14 -5.77 2.07 -1.13 0.14 116.25 113.17 3h7l h VAL 166 Ca 0.26 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.76 3h7l h VAL 166 Cb 0.13 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 3h7l h VAL 166 CO -0.03 0.00 0.02 0.58 0.02 0.00 0.00 177.57 178.17 3h7l h VAL 167 N 0.02 1.22 -0.16 2.57 2.07 -1.22 -2.44 116.25 118.31 3h7l h VAL 167 Ca 0.17 -0.68 0.03 0.00 0.82 0.00 0.00 66.70 67.04 3h7l h VAL 167 Cb 0.26 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 3h7l h VAL 167 CO -0.35 0.20 -0.05 -0.25 0.02 0.00 0.00 177.57 177.14 3h7l h TRP 168 N 0.01 -0.12 -0.74 1.57 7.01 -0.54 -2.40 115.95 120.75 3h7l h TRP 168 Ca 0.04 0.02 0.04 0.00 2.11 0.00 0.00 58.89 61.09 3h7l h TRP 168 Cb 0.29 0.08 -0.05 0.00 -2.10 0.00 0.00 29.16 27.38 3h7l h TRP 168 CO 0.02 -0.09 0.46 -0.91 -2.79 0.00 0.00 178.44 175.13 3h7l h ASN 169 N -0.02 0.75 -0.37 2.65 4.21 -0.64 0.30 115.58 122.45 3h7l h ASN 169 Ca 0.08 0.00 -0.06 0.00 1.21 0.00 0.00 56.30 57.54 3h7l h ASN 169 Cb 0.14 -0.16 -0.01 0.00 -1.12 0.00 0.00 38.32 37.17 3h7l h ASN 169 CO -0.17 0.51 0.01 0.40 -1.29 0.00 0.00 177.43 176.89 3h7l h ILE 170 N 0.89 1.26 -0.67 2.81 2.04 -1.39 -0.00 117.51 122.44 3h7l h ILE 170 Ca 0.30 -0.96 -0.06 0.00 1.00 0.00 0.00 64.86 65.14 3h7l h ILE 170 Cb 0.05 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 3h7l h ILE 170 CO -0.12 0.32 0.17 -0.07 0.00 0.00 0.00 178.15 178.45 3h7l h LEU 171 N 0.47 1.00 -0.17 1.44 3.38 -0.97 0.96 115.31 121.43 3h7l h LEU 171 Ca 0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3h7l h LEU 171 Cb 0.44 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 3h7l h LEU 171 CO 0.02 0.97 0.07 0.50 0.09 0.00 0.00 178.44 180.09 3h7l h LYS 172 N 0.99 0.25 -0.65 1.13 1.63 -0.28 -1.72 116.57 117.92 3h7l h LYS 172 Ca 0.21 -0.04 0.01 0.00 -0.85 0.00 0.00 60.65 59.98 3h7l h LYS 172 Cb 0.35 -0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 31.90 3h7l h LYS 172 CO 0.00 0.31 0.43 0.78 -3.45 0.00 0.00 179.45 177.52 3h7l h GLY 173 N 0.13 0.92 0.43 5.01 0.00 -0.82 -0.90 103.07 107.84 3h7l h GLY 173 Ca 0.06 -0.34 0.09 0.00 0.00 0.00 0.00 47.33 47.13 3h7l h GLY 173 CO -0.01 0.33 0.21 1.41 0.00 0.00 0.00 176.54 178.48 3h7l h LEU 174 N 0.88 0.20 -0.76 3.11 4.07 -0.68 -2.23 115.31 119.90 3h7l h LEU 174 Ca 0.24 0.07 -0.13 0.00 0.08 0.00 0.00 57.88 58.14 3h7l h LEU 174 Cb -0.09 0.06 -0.01 0.00 1.08 0.00 0.00 40.66 41.69 3h7l h LEU 174 CO -0.06 0.13 -0.57 0.77 -1.08 0.00 0.00 178.44 177.64 3h7l h SER 175 N 0.38 0.19 -0.45 -0.43 4.64 -0.84 -1.85 113.55 115.19 3h7l h SER 175 Ca 0.28 -0.10 -0.10 0.00 -0.47 0.00 0.00 61.79 61.41 3h7l h SER 175 Cb 0.34 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.36 3h7l h SER 175 CO -0.29 0.71 -0.07 -0.07 -0.87 0.00 0.00 176.83 176.24 3h7l h LEU 176 N 0.13 0.89 -2.91 5.97 3.38 -0.73 -3.12 115.31 118.92 3h7l h LEU 176 Ca -0.00 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3h7l h LEU 176 Cb 1.04 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.55 3h7l h LEU 176 CO 0.08 0.99 0.00 0.18 0.09 0.00 0.00 178.44 179.78 3h7l n LEU 177 N -4.17 4.08 -4.69 1.67 4.77 -0.88 -4.90 117.00 112.89 3h7l n LEU 177 Ca 0.02 -2.17 -0.42 0.00 -0.03 0.00 0.00 56.01 53.41 3h7l n LEU 177 Cb 0.36 -0.48 -0.03 0.00 -2.33 0.00 0.00 43.42 40.94 3h7l n LEU 177 CO 0.44 0.89 1.23 -0.70 -1.33 0.00 0.00 177.39 177.92 3h7l s GLU 178 N -1.32 4.23 0.00 3.23 2.12 -0.70 -2.37 118.70 123.89 3h7l s GLU 178 Ca 0.46 2.15 0.00 0.00 0.36 0.00 0.00 54.97 57.94 3h7l s GLU 178 Cb 0.26 -3.61 0.00 0.00 0.26 0.00 0.00 34.13 31.04 3h7l s GLU 178 CO 0.28 -0.67 0.00 0.41 -0.54 0.00 0.00 175.26 174.74 3h7l n GLY 179 N 3.84 1.25 3.97 -1.50 0.00 -1.26 -5.04 105.19 106.45 3h7l n GLY 179 Ca 0.15 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 3h7l n GLY 179 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h7l s SER 180 N -3.14 6.32 -0.06 1.61 1.04 -1.00 -5.01 113.70 113.46 3h7l s SER 180 Ca 0.00 0.09 0.15 0.00 0.48 0.00 0.00 55.95 56.67 3h7l s SER 180 Cb 0.00 -1.87 0.54 0.00 0.10 0.00 0.00 66.02 64.79 3h7l s SER 180 CO 0.00 -0.08 1.43 -0.62 0.98 0.00 0.00 173.24 174.95 3h7l n GLU 181 N -1.41 2.86 -0.06 4.02 1.02 -1.26 -4.48 120.64 121.34 3h7l n GLU 181 Ca -0.09 -2.16 -0.09 0.00 -0.02 0.00 0.00 57.16 54.80 3h7l n GLU 181 Cb 0.57 -1.65 -0.02 0.00 -0.02 0.00 0.00 31.44 30.32 3h7l n GLU 181 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 3h7l h ASP 182 N 3.23 0.13 -2.24 1.62 3.32 -1.95 -3.42 116.42 117.12 3h7l h ASP 182 Ca 0.00 0.02 -0.51 0.00 0.02 0.00 0.00 57.03 56.56 3h7l h ASP 182 Cb 1.04 -0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.54 3h7l h ASP 182 CO 0.12 0.11 -0.53 0.27 -1.72 0.00 0.00 179.24 177.49 3h7l s ILE 183 N -6.17 4.42 0.55 0.35 -4.36 -1.26 -4.94 121.20 109.79 3h7l s ILE 183 Ca -0.13 -1.39 -0.05 0.00 -0.26 0.00 0.00 60.65 58.82 3h7l s ILE 183 Cb 0.10 -3.38 -0.01 0.00 1.25 0.00 0.00 42.46 40.42 3h7l s ILE 183 CO 0.70 -0.33 0.86 0.00 0.24 0.00 0.00 174.94 176.40 3h7l s ALA 184 N -2.10 3.36 0.24 2.27 0.00 -1.26 -4.94 121.76 119.32 3h7l s ALA 184 Ca 0.33 -0.66 -0.06 0.00 0.00 0.00 0.00 51.96 51.57 3h7l s ALA 184 Cb -0.08 -2.57 0.34 0.00 0.00 0.00 0.00 23.12 20.80 3h7l s ALA 184 CO 0.25 -0.65 1.84 0.00 0.00 0.00 0.00 175.76 177.19 3h7l h ALA 185 N -0.03 1.14 -0.03 0.00 0.00 -1.97 -1.87 119.26 116.49 3h7l h ALA 185 Ca -0.46 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.35 3h7l h ALA 185 Cb 1.24 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 3h7l h ALA 185 CO 0.61 0.20 -0.48 0.35 0.00 0.00 0.00 179.25 179.93 3h7l h PHE 186 N 0.89 0.10 -0.39 0.00 3.57 -1.99 -1.45 116.94 117.67 3h7l h PHE 186 Ca 0.37 -0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.76 3h7l h PHE 186 Cb 0.22 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 3h7l h PHE 186 CO -0.04 0.55 -0.07 1.15 -2.23 0.00 0.00 178.31 177.67 3h7l h THR 187 N 0.07 1.27 -0.01 4.41 2.02 -1.75 -1.26 112.91 117.66 3h7l h THR 187 Ca 0.00 -1.13 0.02 0.00 0.77 0.00 0.00 66.41 66.07 3h7l h THR 187 Cb 0.88 1.21 -0.03 0.00 -1.74 0.00 0.00 68.15 68.47 3h7l h THR 187 CO 0.07 0.38 -0.15 -0.09 0.37 0.00 0.00 175.52 176.10 3h7l h ARG 188 N 0.55 -0.24 -0.56 6.66 2.43 -1.08 0.17 114.38 122.31 3h7l h ARG 188 Ca 0.10 0.02 0.11 0.00 -0.81 0.00 0.00 59.98 59.40 3h7l h ARG 188 Cb 0.57 0.05 -0.11 0.00 -0.42 0.00 0.00 29.97 30.07 3h7l h ARG 188 CO 0.03 -0.16 -0.14 1.15 -1.51 0.00 0.00 179.97 179.34 3h7l h THR 189 N -0.24 0.43 -0.60 0.20 2.02 -1.18 0.26 112.91 113.80 3h7l h THR 189 Ca 0.05 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.17 3h7l h THR 189 Cb 0.31 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 3h7l h THR 189 CO -0.15 0.00 0.10 0.03 0.37 0.00 0.00 175.52 175.87 3h7l h ARG 190 N -0.00 0.96 -0.19 6.66 3.08 -0.88 -0.56 114.38 123.45 3h7l h ARG 190 Ca 0.27 -0.24 -0.07 0.00 0.07 0.00 0.00 59.98 60.02 3h7l h ARG 190 Cb 0.42 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 3h7l h ARG 190 CO -0.58 0.89 -0.15 -0.07 -1.07 0.00 0.00 179.97 178.99 3h7l h LEU 191 N 0.91 0.46 -0.43 3.04 3.38 -0.36 -2.20 115.31 120.11 3h7l h LEU 191 Ca 0.19 -0.45 0.08 0.00 0.09 0.00 0.00 57.88 57.78 3h7l h LEU 191 Cb 0.39 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 40.95 3h7l h LEU 191 CO 0.01 0.81 0.02 0.40 0.09 0.00 0.00 178.44 179.77 3h7l h ILE 192 N 0.10 0.69 -0.76 1.22 2.04 -0.82 -0.53 117.51 119.45 3h7l h ILE 192 Ca 0.03 -0.04 0.10 0.00 1.00 0.00 0.00 64.86 65.95 3h7l h ILE 192 Cb 0.67 0.55 -0.08 0.00 -0.74 0.00 0.00 36.82 37.22 3h7l h ILE 192 CO 0.04 0.02 0.40 -0.08 0.00 0.00 0.00 178.15 178.53 3h7l h GLU 193 N 0.13 0.63 -0.07 2.37 4.81 -1.04 0.06 114.58 121.48 3h7l h GLU 193 Ca 0.21 -0.04 -0.18 0.00 -0.13 0.00 0.00 59.36 59.23 3h7l h GLU 193 Cb 0.30 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 3h7l h GLU 193 CO -0.34 0.42 -0.72 1.49 -0.73 0.00 0.00 179.01 179.13 3h7l h GLU 194 N 0.65 0.34 0.05 1.92 4.57 -0.72 -1.28 114.58 120.11 3h7l h GLU 194 Ca 0.38 -0.28 -0.00 0.00 -1.18 0.00 0.00 59.36 58.28 3h7l h GLU 194 Cb 0.41 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.06 3h7l h GLU 194 CO -0.28 0.92 -0.02 0.00 -1.18 0.00 0.00 179.01 178.45 3h7l h ALA 195 N 1.00 -0.07 -0.30 2.92 0.00 -0.79 -3.03 119.26 118.99 3h7l h ALA 195 Ca -0.03 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 3h7l h ALA 195 Cb 1.28 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 3h7l h ALA 195 CO 0.12 -0.34 0.10 -0.07 0.00 0.00 0.00 179.25 179.05 3h7l h LEU 196 N -0.46 0.39 -0.32 0.00 3.38 -0.96 -0.16 115.31 117.17 3h7l h LEU 196 Ca -0.01 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 57.95 3h7l h LEU 196 Cb 0.41 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 3h7l h LEU 196 CO 0.01 0.38 0.14 0.15 0.09 0.00 0.00 178.44 179.21 3h7l h PHE 197 N 0.43 0.26 -0.10 1.13 3.57 -1.23 -1.74 116.94 119.26 3h7l h PHE 197 Ca 0.11 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.48 3h7l h PHE 197 Cb 0.13 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 3h7l h PHE 197 CO 0.00 0.14 -0.53 0.78 -2.23 0.00 0.00 178.31 176.47 3h7l h GLY 198 N 0.31 0.30 0.74 2.40 0.00 -1.28 -3.16 103.07 102.38 3h7l h GLY 198 Ca 0.14 -0.34 0.04 0.00 0.00 0.00 0.00 47.33 47.16 3h7l h GLY 198 CO -0.11 0.31 0.15 0.00 0.00 0.00 0.00 176.54 176.89 3h7l h ALA 199 N 1.22 0.44 -0.45 3.60 0.00 -0.69 -1.35 119.26 122.04 3h7l h ALA 199 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3h7l h ALA 199 Cb 1.01 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 3h7l h ALA 199 CO 0.08 -0.23 0.23 -0.44 0.00 0.00 0.00 179.25 178.90 3h7l h ASP 200 N 0.32 0.55 0.50 0.00 3.32 -1.35 -1.55 116.42 118.21 3h7l h ASP 200 Ca 0.16 -0.04 -0.13 0.00 0.02 0.00 0.00 57.03 57.05 3h7l h ASP 200 Cb 0.11 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 3h7l h ASP 200 CO -0.14 0.46 -0.57 0.15 -1.72 0.00 0.00 179.24 177.42 3h7l h PHE 201 N 0.63 0.09 -0.27 4.55 3.57 -1.36 -2.47 116.94 121.68 3h7l h PHE 201 Ca 0.16 -0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.49 3h7l h PHE 201 Cb 0.04 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 38.77 3h7l h PHE 201 CO 0.00 0.62 -0.36 -0.07 -2.23 0.00 0.00 178.31 176.27 3h7l h LEU 202 N 0.05 0.78 -0.42 0.59 3.38 -0.30 -1.33 115.31 118.07 3h7l h LEU 202 Ca -0.00 -0.50 0.09 0.00 0.09 0.00 0.00 57.88 57.55 3h7l h LEU 202 Cb 1.02 -0.22 -0.09 0.00 0.09 0.00 0.00 40.66 41.46 3h7l h LEU 202 CO 0.08 1.13 -0.23 0.58 0.09 0.00 0.00 178.44 180.09 3h7l h VAL 203 N 0.45 0.35 0.00 1.22 2.07 -1.30 -1.75 116.25 117.30 3h7l h VAL 203 Ca 0.03 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 3h7l h VAL 203 Cb 0.95 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 3h7l h VAL 203 CO 0.09 0.00 -0.11 0.03 0.02 0.00 0.00 177.57 177.60 3h7l h ARG 204 N -0.16 0.00 -0.01 1.57 3.08 -1.27 -2.15 114.38 115.45 3h7l h ARG 204 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.25 3h7l h ARG 204 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.52 3h7l h ARG 204 CO -0.51 0.11 -0.04 -1.33 -1.07 0.00 0.00 179.97 177.13 3h7l n MET 205 N -3.78 1.06 -3.18 0.04 2.81 -0.52 -4.66 117.12 108.90 3h7l n MET 205 Ca -0.02 -0.33 -0.40 0.00 -1.81 0.00 0.00 57.70 55.14 3h7l n MET 205 Cb 0.21 -1.49 -0.07 0.00 -0.71 0.00 0.00 33.22 31.16 3h7l n MET 205 CO 0.00 0.00 0.00 -1.14 1.51 0.00 0.00 175.97 176.34 3h7l s GLN 206 N -2.17 4.14 0.86 0.03 0.74 -0.81 0.42 119.66 122.88 3h7l s GLN 206 Ca 0.39 0.47 -0.10 0.00 0.05 0.00 0.00 55.36 56.16 3h7l s GLN 206 Cb 0.21 -3.61 0.11 0.00 1.10 0.00 0.00 33.01 30.82 3h7l s GLN 206 CO 0.40 -0.29 1.13 1.21 -0.55 0.00 0.00 175.29 177.19 3h7l s ASN 207 N 1.34 3.48 0.48 6.67 3.84 0.13 -4.96 114.94 125.93 3h7l s ASN 207 Ca 0.25 2.09 0.25 0.00 0.21 0.00 0.00 52.86 55.66 3h7l s ASN 207 Cb -0.16 -2.55 1.18 0.00 -0.55 0.00 0.00 41.25 39.17 3h7l s ASN 207 CO 0.09 -2.73 1.95 1.05 -2.79 0.00 0.00 177.10 174.67 3h7l h GLU 208 N -1.55 0.00 -0.02 0.43 4.11 -1.98 -2.74 114.58 112.82 3h7l h GLU 208 Ca -0.43 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 58.95 3h7l h GLU 208 Cb 1.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 3h7l h GLU 208 CO 0.45 0.18 -0.19 0.87 0.07 0.00 0.00 179.01 180.39 3h7l h LYS 209 N 0.00 0.03 0.00 1.06 1.57 -2.02 -3.47 116.57 113.75 3h7l h LYS 209 Ca -0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3h7l h LYS 209 Cb 0.54 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 3h7l h LYS 209 CO 0.02 0.22 0.00 0.41 -0.57 0.00 0.00 179.45 179.54 3h7l n GLY 210 N -0.95 1.23 3.82 3.86 0.00 -1.03 -4.98 105.19 107.13 3h7l n GLY 210 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 3h7l n GLY 210 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3h7l s PHE 211 N -0.72 3.15 0.11 1.61 -0.12 -1.26 -3.95 117.98 116.81 3h7l s PHE 211 Ca 0.00 1.52 -0.12 0.00 -0.05 0.00 0.00 56.93 58.28 3h7l s PHE 211 Cb 0.00 -2.94 -0.06 0.00 -0.63 0.00 0.00 43.02 39.39 3h7l s PHE 211 CO 0.00 -0.77 0.47 -0.06 -0.05 0.00 0.00 175.22 174.81 3h7l s PHE 212 N -2.41 3.59 0.39 3.49 0.08 -1.26 -0.69 117.98 121.17 3h7l s PHE 212 Ca 0.63 0.91 -0.25 0.00 0.12 0.00 0.00 56.93 58.33 3h7l s PHE 212 Cb -0.14 -2.25 -0.09 0.00 -0.57 0.00 0.00 43.02 39.97 3h7l s PHE 212 CO 0.31 0.47 1.10 0.71 -0.10 0.00 0.00 175.22 177.71 3h7l s TYR 213 N -1.44 3.20 -0.15 0.36 2.02 0.17 -0.97 117.35 120.54 3h7l s TYR 213 Ca 0.36 1.61 -0.24 0.00 -0.37 0.00 0.00 57.07 58.43 3h7l s TYR 213 Cb -0.14 -3.25 -0.24 0.00 -0.40 0.00 0.00 41.96 37.92 3h7l s TYR 213 CO 0.19 -0.91 0.56 1.98 -1.57 0.00 0.00 175.55 175.79 3h7l h MET 214 N 2.65 0.06 -3.86 -0.62 4.05 -0.78 -3.43 114.93 113.00 3h7l h MET 214 Ca -0.48 -0.10 -0.21 0.00 -0.28 0.00 0.00 59.70 58.63 3h7l h MET 214 Cb 1.22 0.04 -0.25 0.00 -0.80 0.00 0.00 31.60 31.81 3h7l h MET 214 CO 0.63 1.05 -0.71 0.99 0.23 0.00 0.00 176.91 179.09 3h7l s THR 215 N -2.32 0.06 -0.41 -0.77 2.01 -1.15 -0.18 115.64 112.89 3h7l s THR 215 Ca -0.22 -0.41 -0.08 0.00 0.31 0.00 0.00 61.69 61.29 3h7l s THR 215 Cb 0.01 -0.13 0.08 0.00 0.01 0.00 0.00 72.50 72.47 3h7l s THR 215 CO 0.68 -0.22 0.24 -0.69 -0.69 0.00 0.00 174.62 173.94 3h7l s VAL 216 N -0.65 4.05 -0.01 3.82 1.01 0.74 -2.13 120.40 127.24 3h7l s VAL 216 Ca -0.07 -1.47 0.07 0.00 0.00 0.00 0.00 61.98 60.52 3h7l s VAL 216 Cb -0.04 -3.50 -0.02 0.00 0.00 0.00 0.00 36.38 32.81 3h7l s VAL 216 CO -0.00 -0.50 -0.24 0.12 0.00 0.00 0.00 175.10 174.48 3h7l s PHE 217 N 1.38 2.41 -0.01 5.22 5.36 -0.39 -1.18 117.98 130.77 3h7l s PHE 217 Ca 0.03 -0.37 0.01 0.00 -0.96 0.00 0.00 56.93 55.64 3h7l s PHE 217 Cb -0.23 -1.50 0.02 0.00 -0.34 0.00 0.00 43.02 40.98 3h7l s PHE 217 CO 0.01 0.06 0.96 -0.40 -1.46 0.00 0.00 175.22 174.39 3h7l n ASP 218 N 2.21 1.81 -2.68 6.13 5.75 -1.26 -1.14 116.55 127.37 3h7l n ASP 218 Ca -0.16 -1.97 -0.21 0.00 -0.01 0.00 0.00 54.79 52.43 3h7l n ASP 218 Cb 0.51 -0.03 0.01 0.00 -1.03 0.00 0.00 41.12 40.58 3h7l n ASP 218 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 3h7l n LYS 219 N -0.51 -3.07 -2.99 0.11 4.81 -1.26 -2.59 118.16 112.67 3h7l n LYS 219 Ca 0.01 0.95 -0.21 0.00 -0.87 0.00 0.00 58.31 58.19 3h7l n LYS 219 Cb 0.30 -5.70 0.01 0.00 0.02 0.00 0.00 35.03 29.67 3h7l n LYS 219 CO 0.00 0.00 0.00 0.91 1.17 0.00 0.00 177.40 179.48 3h7l n TRP 220 N -4.20 -1.75 0.06 5.64 8.01 -1.26 -4.91 117.44 119.04 3h7l n TRP 220 Ca -0.18 0.39 0.11 0.00 -1.31 0.00 0.00 57.50 56.50 3h7l n TRP 220 Cb 0.66 -3.76 -0.16 0.00 -2.01 0.00 0.00 31.31 26.03 3h7l n TRP 220 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 3h7l n SER 221 N -2.31 0.09 0.00 -0.99 3.41 -1.07 -4.96 113.62 107.79 3h7l n SER 221 Ca -0.10 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 3h7l n SER 221 Cb 0.60 1.88 0.00 0.00 -0.26 0.00 0.00 64.21 66.43 3h7l n SER 221 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3h7l n LYS 222 N -2.22 -0.64 -2.90 4.33 4.01 -1.26 -4.95 118.16 114.51 3h7l n LYS 222 Ca -0.03 0.16 -0.42 0.00 -0.51 0.00 0.00 58.31 57.51 3h7l n LYS 222 Cb 0.55 -4.24 -0.04 0.00 -0.51 0.00 0.00 35.03 30.79 3h7l n LYS 222 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 3h7l s ASP 223 N -2.14 6.73 0.50 4.39 2.15 -1.26 -4.96 116.67 122.08 3h7l s ASP 223 Ca 0.00 0.78 0.24 0.00 0.43 0.00 0.00 52.55 54.00 3h7l s ASP 223 Cb 0.00 -2.43 1.33 0.00 -0.30 0.00 0.00 42.92 41.53 3h7l s ASP 223 CO 0.00 -0.62 2.06 0.71 -0.17 0.00 0.00 175.17 177.15 3h7l h THR 224 N 5.57 0.74 -0.09 1.71 1.35 -1.92 -1.88 112.91 118.38 3h7l h THR 224 Ca -0.24 -0.54 0.01 0.00 -0.55 0.00 0.00 66.41 65.09 3h7l h THR 224 Cb 1.09 1.33 -0.00 0.00 -1.73 0.00 0.00 68.15 68.84 3h7l h THR 224 CO 0.90 0.13 0.06 0.00 -0.25 0.00 0.00 175.52 176.36 3h7l h ALA 225 N 1.86 1.99 -0.02 6.62 0.00 -1.98 -2.88 119.26 124.86 3h7l h ALA 225 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3h7l h ALA 225 Cb 0.32 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3h7l h ALA 225 CO 0.02 -0.00 -0.04 1.04 0.00 0.00 0.00 179.25 180.27 3h7l n GLN 226 N -4.52 1.60 -2.21 0.00 6.02 -0.71 -4.87 117.38 112.69 3h7l n GLN 226 Ca -0.01 -0.97 -0.43 0.00 -0.01 0.00 0.00 57.00 55.58 3h7l n GLN 226 Cb 0.12 -1.48 -0.02 0.00 1.02 0.00 0.00 30.24 29.87 3h7l n GLN 226 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3h7l s ARG 227 N -2.07 3.74 -0.02 -1.09 0.52 -1.09 -4.21 118.95 114.74 3h7l s ARG 227 Ca 0.35 1.43 0.01 0.00 -0.52 0.00 0.00 55.73 57.01 3h7l s ARG 227 Cb 0.21 -4.01 0.01 0.00 0.52 0.00 0.00 34.95 31.67 3h7l s ARG 227 CO 0.36 -1.35 -0.04 -1.21 0.02 0.00 0.00 175.30 173.07 3h7l s GLU 228 N 4.70 0.54 -0.26 3.54 2.02 -0.29 -4.22 118.70 124.72 3h7l s GLU 228 Ca 0.67 -0.12 -0.29 0.00 0.02 0.00 0.00 54.97 55.25 3h7l s GLU 228 Cb -0.21 -0.56 -0.02 0.00 0.10 0.00 0.00 34.13 33.44 3h7l s GLU 228 CO 0.29 0.01 1.61 0.42 0.02 0.00 0.00 175.26 177.61 3h7l s ILE 229 N 0.39 3.71 0.02 -1.63 1.01 0.10 -1.27 121.20 123.53 3h7l s ILE 229 Ca -0.04 0.78 -0.01 0.00 0.00 0.00 0.00 60.65 61.38 3h7l s ILE 229 Cb -0.08 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.62 3h7l s ILE 229 CO -0.00 -0.37 0.03 0.00 0.00 0.00 0.00 174.94 174.60 3h7l s ALA 231 N -1.13 2.56 0.10 0.00 0.00 -0.56 -2.95 121.76 119.79 3h7l s ALA 231 Ca 0.01 -1.80 -0.04 0.00 0.00 0.00 0.00 51.96 50.12 3h7l s ALA 231 Cb -0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.87 3h7l s ALA 231 CO 0.01 0.25 0.10 1.52 0.00 0.00 0.00 175.76 177.63 3h7l s TYR 232 N -2.53 0.53 0.07 0.00 -0.85 -1.26 -0.40 117.35 112.91 3h7l s TYR 232 Ca 0.27 -0.96 0.02 0.00 -0.52 0.00 0.00 57.07 55.89 3h7l s TYR 232 Cb -0.04 -0.29 -0.03 0.00 0.38 0.00 0.00 41.96 41.98 3h7l s TYR 232 CO 0.13 -0.52 -0.08 -1.21 -1.52 0.00 0.00 175.55 172.35 3h7l s GLU 233 N -3.96 0.69 0.53 -3.49 2.02 -0.62 -4.62 118.70 109.25 3h7l s GLU 233 Ca 0.14 -1.01 0.00 0.00 0.02 0.00 0.00 54.97 54.12 3h7l s GLU 233 Cb 0.06 -0.33 0.00 0.00 0.10 0.00 0.00 34.13 33.97 3h7l s GLU 233 CO -0.05 0.04 0.00 0.25 0.02 0.00 0.00 175.26 175.52 3h7l n THR 234 N 0.84 0.00 0.17 3.63 -2.24 -1.26 -1.97 114.28 113.45 3h7l n THR 234 Ca -0.18 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.65 3h7l n THR 234 Cb 0.57 -0.39 0.18 0.00 -2.10 0.00 0.00 70.33 68.59 3h7l n THR 234 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 3h7l h GLN 235 N 0.00 0.00 0.00 -0.78 4.15 -1.94 -3.21 115.11 113.33 3h7l h GLN 235 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.44 3h7l h GLN 235 Cb 1.04 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.73 3h7l h GLN 235 CO 0.01 0.40 0.00 -0.07 -1.93 0.00 0.00 178.83 177.24 3h7l h LEU 236 N 0.00 0.00 -0.83 -2.39 4.07 -2.03 -3.47 115.31 110.65 3h7l h LEU 236 Ca -0.00 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.86 3h7l h LEU 236 Cb 1.15 0.00 0.03 0.00 1.08 0.00 0.00 40.66 42.92 3h7l h LEU 236 CO 0.05 0.00 -0.17 0.61 -1.08 0.00 0.00 178.44 177.86 3h7l n GLY 237 N 0.45 0.55 3.67 0.83 0.00 -1.07 -4.98 105.19 104.64 3h7l n GLY 237 Ca 0.03 -0.46 -0.42 0.00 0.00 0.00 0.00 46.02 45.16 3h7l n GLY 237 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3h7l s HIS 238 N -3.02 2.03 -0.04 1.61 3.76 -0.83 -4.71 115.29 114.09 3h7l s HIS 238 Ca 0.14 0.10 -0.24 0.00 -0.15 0.00 0.00 55.06 54.90 3h7l s HIS 238 Cb -0.06 -4.02 -0.04 0.00 1.11 0.00 0.00 32.58 29.57 3h7l s HIS 238 CO 0.17 -4.28 0.74 0.15 -0.85 0.00 0.00 174.74 170.67 3h7l s LYS 239 N 3.45 4.45 0.26 1.40 1.02 -1.26 -1.59 119.74 127.47 3h7l s LYS 239 Ca 0.77 0.96 0.05 0.00 0.02 0.00 0.00 55.97 57.77 3h7l s LYS 239 Cb -0.39 -3.44 -0.06 0.00 -0.52 0.00 0.00 37.83 33.43 3h7l s LYS 239 CO 0.34 0.08 -0.02 -0.06 -0.92 0.00 0.00 175.35 174.77 3h7l s PHE 240 N 0.70 1.75 -0.38 3.18 0.08 0.47 -5.00 117.98 118.78 3h7l s PHE 240 Ca 0.39 -0.83 0.07 0.00 0.12 0.00 0.00 56.93 56.68 3h7l s PHE 240 Cb -0.18 -1.02 0.72 0.00 -0.57 0.00 0.00 43.02 41.97 3h7l s PHE 240 CO 0.20 0.10 1.87 -0.40 -0.10 0.00 0.00 175.22 176.88 3h7l n ASP 241 N -0.50 4.43 -3.65 1.36 5.75 -1.26 -1.49 116.55 121.18 3h7l n ASP 241 Ca -0.05 -3.39 -0.41 0.00 -0.01 0.00 0.00 54.79 50.93 3h7l n ASP 241 Cb 0.64 -0.79 0.01 0.00 -1.03 0.00 0.00 41.12 39.95 3h7l n ASP 241 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 3h7l n ASP 242 N -0.56 7.35 -0.44 -1.12 5.75 -1.26 -4.76 116.55 121.50 3h7l n ASP 242 Ca 0.49 -3.56 0.13 0.00 -0.01 0.00 0.00 54.79 51.85 3h7l n ASP 242 Cb 1.52 -1.22 0.54 0.00 -1.03 0.00 0.00 41.12 40.93 3h7l n ASP 242 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3h7l n TYR 243 N 0.47 0.04 -2.58 2.11 0.18 -1.26 -4.61 117.16 111.50 3h7l n TYR 243 Ca 0.47 -0.02 -0.42 0.00 1.88 0.00 0.00 57.90 59.81 3h7l n TYR 243 Cb 0.27 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.20 3h7l n TYR 243 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 3h7l s GLN 244 N -1.96 4.49 -0.30 -3.48 1.11 -1.26 -0.13 119.66 118.13 3h7l s GLN 244 Ca 0.38 1.56 -0.25 0.00 0.01 0.00 0.00 55.36 57.06 3h7l s GLN 244 Cb 0.20 -3.43 0.00 0.00 -1.01 0.00 0.00 33.01 28.77 3h7l s GLN 244 CO 0.32 -0.18 0.87 0.00 0.01 0.00 0.00 175.29 176.32 3h7l s ALA 245 N 1.20 3.54 0.96 6.09 0.00 -0.14 -4.84 121.76 128.57 3h7l s ALA 245 Ca 0.54 -0.27 -0.12 0.00 0.00 0.00 0.00 51.96 52.11 3h7l s ALA 245 Cb -0.24 -3.40 0.16 0.00 0.00 0.00 0.00 23.12 19.64 3h7l s ALA 245 CO 0.27 -1.23 1.10 0.20 0.00 0.00 0.00 175.76 176.10 3h7l s GLY 246 N 1.57 1.58 0.27 0.00 0.00 -1.26 -4.36 107.32 105.12 3h7l s GLY 246 Ca 0.36 -0.33 -0.01 0.00 0.00 0.00 0.00 44.72 44.74 3h7l s GLY 246 CO 0.12 0.24 1.67 0.74 0.00 0.00 0.00 173.10 175.87 3h7l h PHE 247 N -1.73 0.33 0.00 1.90 0.05 -1.90 0.74 116.94 116.33 3h7l h PHE 247 Ca -0.53 0.05 0.00 0.00 3.82 0.00 0.00 57.97 61.31 3h7l h PHE 247 Cb 1.32 -0.02 0.00 0.00 2.00 0.00 0.00 35.95 39.25 3h7l h PHE 247 CO 0.32 -0.14 -0.06 2.89 -0.18 0.00 0.00 178.31 181.14 3h7l n ARG 248 N -5.18 0.23 -1.28 1.51 1.85 -1.26 -1.49 116.66 111.02 3h7l n ARG 248 Ca 0.18 0.17 -0.28 0.00 -1.00 0.00 0.00 57.85 56.92 3h7l n ARG 248 Cb 0.57 -1.75 0.13 0.00 -1.05 0.00 0.00 32.46 30.36 3h7l n ARG 248 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 3h7l n GLN 249 N -2.13 2.48 0.00 2.89 6.02 0.13 -4.73 117.38 122.03 3h7l n GLN 249 Ca 0.06 -3.20 0.00 0.00 -0.01 0.00 0.00 57.00 53.85 3h7l n GLN 249 Cb 0.42 -2.21 0.00 0.00 1.02 0.00 0.00 30.24 29.46 3h7l n GLN 249 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3h7l n GLY 250 N -1.02 3.11 0.26 1.08 0.00 -1.22 -4.10 105.19 103.30 3h7l n GLY 250 Ca 0.59 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.54 3h7l n GLY 250 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3h7l h GLY 251 N 0.00 -0.06 0.94 -0.02 0.00 -1.31 -1.80 103.07 100.83 3h7l h GLY 251 Ca 0.00 0.27 -0.01 0.00 0.00 0.00 0.00 47.33 47.59 3h7l h GLY 251 CO 0.00 -0.19 0.14 -1.33 0.00 0.00 0.00 176.54 175.15 3h7l h GLY 252 N -0.19 0.42 1.67 4.60 0.00 -1.39 -2.47 103.07 105.71 3h7l h GLY 252 Ca 0.16 -0.21 -0.13 0.00 0.00 0.00 0.00 47.33 47.15 3h7l h GLY 252 CO -0.41 0.20 -0.48 -2.08 0.00 0.00 0.00 176.54 173.76 3h7l h VAL 253 N 0.31 1.33 -0.54 4.60 2.07 -1.73 -1.93 116.25 120.37 3h7l h VAL 253 Ca 0.09 -1.70 0.09 0.00 0.82 0.00 0.00 66.70 66.01 3h7l h VAL 253 Cb 0.11 1.76 -0.07 0.00 -1.52 0.00 0.00 31.29 31.56 3h7l h VAL 253 CO -0.01 0.51 0.13 0.00 0.02 0.00 0.00 177.57 178.22 3h7l h ALA 254 N 1.21 0.63 -0.17 1.67 0.00 -1.13 0.73 119.26 122.20 3h7l h ALA 254 Ca 0.02 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3h7l h ALA 254 Cb 0.95 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 3h7l h ALA 254 CO 0.08 -0.29 0.09 0.82 0.00 0.00 0.00 179.25 179.95 3h7l h ILE 255 N 0.27 1.11 -0.48 0.00 2.04 -1.19 -1.65 117.51 117.62 3h7l h ILE 255 Ca 0.27 -0.29 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 3h7l h ILE 255 Cb 0.37 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 3h7l h ILE 255 CO -0.34 0.10 0.27 0.00 0.00 0.00 0.00 178.15 178.18 3h7l h ALA 256 N 0.98 0.61 0.03 1.87 0.00 -0.61 -0.35 119.26 121.79 3h7l h ALA 256 Ca 0.06 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3h7l h ALA 256 Cb 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3h7l h ALA 256 CO -0.01 0.13 -0.01 0.00 0.00 0.00 0.00 179.25 179.35 3h7l h ALA 257 N 1.11 -0.04 -0.65 0.00 0.00 0.56 -0.33 119.26 119.91 3h7l h ALA 257 Ca 0.17 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3h7l h ALA 257 Cb 0.04 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3h7l h ALA 257 CO -0.03 -0.52 0.37 -0.07 0.00 0.00 0.00 179.25 179.00 3h7l h LEU 258 N -0.05 0.80 -0.47 0.00 3.38 -1.14 0.72 115.31 118.55 3h7l h LEU 258 Ca -0.00 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.89 3h7l h LEU 258 Cb 0.04 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 3h7l h LEU 258 CO 0.01 0.66 0.31 0.00 0.09 0.00 0.00 178.44 179.50 3h7l h ALA 259 N 1.18 0.60 -0.58 1.53 0.00 -0.92 -1.11 119.26 119.97 3h7l h ALA 259 Ca 0.23 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 3h7l h ALA 259 Cb 0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3h7l h ALA 259 CO -0.04 0.03 0.08 0.00 0.00 0.00 0.00 179.25 179.32 3h7l h ALA 260 N 1.18 0.77 -0.72 0.00 0.00 -0.73 -2.73 119.26 117.03 3h7l h ALA 260 Ca 0.18 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 54.88 3h7l h ALA 260 Cb -0.05 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 3h7l h ALA 260 CO -0.05 0.53 0.47 0.00 0.00 0.00 0.00 179.25 180.20 3h7l h ALA 261 N 1.00 1.64 0.00 0.00 0.00 -0.59 -2.41 119.26 118.90 3h7l h ALA 261 Ca 0.17 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3h7l h ALA 261 Cb 0.44 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3h7l h ALA 261 CO 0.01 0.27 0.00 0.66 0.00 0.00 0.00 179.25 180.19 3h7l h SER 262 N 0.81 0.00 1.16 0.00 4.64 -0.88 -2.74 113.55 116.55 3h7l h SER 262 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 3h7l h SER 262 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3h7l h SER 262 CO -0.09 0.00 -0.24 0.54 -0.87 0.00 0.00 176.83 176.16 3h7l n ARG 263 N -2.50 0.23 -2.15 4.77 1.74 -0.91 -4.82 116.66 113.02 3h7l n ARG 263 Ca 0.01 0.14 -0.37 0.00 -0.77 0.00 0.00 57.85 56.85 3h7l n ARG 263 Cb 0.19 -1.72 0.00 0.00 -1.02 0.00 0.00 32.46 29.92 3h7l n ARG 263 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3h7l s LEU 264 N -4.18 3.98 0.62 0.55 1.43 -1.04 -4.95 118.68 115.09 3h7l s LEU 264 Ca 0.09 2.41 0.40 0.00 -1.03 0.00 0.00 54.13 56.01 3h7l s LEU 264 Cb 0.14 -4.24 1.98 0.00 0.03 0.00 0.00 46.19 44.10 3h7l s LEU 264 CO 0.64 -1.05 2.21 1.23 0.23 0.00 0.00 176.35 179.61 3h7l h GLY 265 N 1.94 0.00 -1.63 -3.19 0.00 -1.91 -3.45 103.07 94.83 3h7l h GLY 265 Ca -0.50 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.31 3h7l h GLY 265 CO 0.60 0.00 -0.57 -1.34 0.00 0.00 0.00 176.54 175.22 3h7l s VAL 266 N -3.97 1.06 0.21 4.60 -7.23 -1.26 -5.14 120.40 108.67 3h7l s VAL 266 Ca -0.03 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.07 3h7l s VAL 266 Cb 0.11 -2.62 -0.02 0.00 0.56 0.00 0.00 36.38 34.41 3h7l s VAL 266 CO 0.47 0.00 0.29 -1.38 -0.31 0.00 0.00 175.10 174.17 3h7l s HIS 267 N -3.20 0.67 0.00 2.82 -3.43 -1.26 -4.91 115.29 105.98 3h7l s HIS 267 Ca 0.30 -0.98 0.00 0.00 -0.80 0.00 0.00 55.06 53.58 3h7l s HIS 267 Cb 0.06 -0.16 0.00 0.00 -1.43 0.00 0.00 32.58 31.05 3h7l s HIS 267 CO 0.14 -0.78 0.00 0.41 -2.00 0.00 0.00 174.74 172.51 3h7l n GLY 268 N -0.29 1.05 0.26 -1.38 0.00 -1.26 -4.91 105.19 98.66 3h7l n GLY 268 Ca -0.02 -1.00 -0.03 0.00 0.00 0.00 0.00 46.02 44.97 3h7l n GLY 268 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3h7l h GLU 269 N 0.00 0.57 -6.09 1.61 4.81 -1.98 -3.43 114.58 110.06 3h7l h GLU 269 Ca 0.00 -0.17 -0.56 0.00 -0.13 0.00 0.00 59.36 58.50 3h7l h GLU 269 Cb 0.00 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.28 3h7l h GLU 269 CO 0.00 0.68 -0.51 0.71 -0.73 0.00 0.00 179.01 179.16 3h7l s TYR 270 N -4.75 3.37 0.64 0.92 2.02 -1.26 -5.13 117.35 113.15 3h7l s TYR 270 Ca -0.08 0.08 0.02 0.00 -0.37 0.00 0.00 57.07 56.72 3h7l s TYR 270 Cb 0.14 -1.62 0.09 0.00 -0.40 0.00 0.00 41.96 40.17 3h7l s TYR 270 CO 0.79 0.52 0.88 0.16 -1.57 0.00 0.00 175.55 176.33 3h7l s ASP 271 N -3.11 4.78 0.18 2.29 -4.77 -1.26 -4.80 116.67 109.98 3h7l s ASP 271 Ca 0.33 -0.33 -0.13 0.00 -3.30 0.00 0.00 52.55 49.12 3h7l s ASP 271 Cb -0.11 -0.25 0.17 0.00 -1.09 0.00 0.00 42.92 41.64 3h7l s ASP 271 CO 0.27 -1.53 1.75 1.56 0.70 0.00 0.00 175.17 177.91 3h7l h GLN 272 N -0.20 0.34 -0.67 2.11 7.50 -1.90 -1.36 115.11 120.93 3h7l h GLN 272 Ca -0.37 -0.02 0.09 0.00 0.50 0.00 0.00 58.65 58.85 3h7l h GLN 272 Cb 1.28 -0.08 -0.07 0.00 0.05 0.00 0.00 27.48 28.66 3h7l h GLN 272 CO 0.44 0.23 0.31 0.37 -1.50 0.00 0.00 178.83 178.68 3h7l h GLN 273 N 0.35 0.52 -0.62 1.46 5.75 -1.95 0.06 115.11 120.68 3h7l h GLN 273 Ca 0.24 -0.03 -0.08 0.00 -0.15 0.00 0.00 58.65 58.62 3h7l h GLN 273 Cb 0.25 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.66 3h7l h GLN 273 CO -0.24 0.35 0.06 -0.22 -2.65 0.00 0.00 178.83 176.12 3h7l h LYS 274 N 0.54 1.05 0.04 1.69 1.63 -1.67 0.14 116.57 119.99 3h7l h LYS 274 Ca 0.33 -0.30 -0.00 0.00 -0.85 0.00 0.00 60.65 59.83 3h7l h LYS 274 Cb 0.36 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 31.87 3h7l h LYS 274 CO -0.27 0.99 -0.02 1.88 -3.45 0.00 0.00 179.45 178.58 3h7l h TYR 275 N 0.98 -0.05 -0.16 1.91 0.05 -0.82 -1.74 116.97 117.14 3h7l h TYR 275 Ca 0.19 -0.00 0.03 0.00 0.05 0.00 0.00 58.73 59.00 3h7l h TYR 275 Cb 0.48 0.02 -0.03 0.00 1.01 0.00 0.00 36.73 38.21 3h7l h TYR 275 CO 0.03 0.06 -0.04 -0.09 -1.05 0.00 0.00 178.16 177.08 3h7l h ARG 276 N -0.15 -0.00 -0.78 4.88 2.43 -0.84 -1.84 114.38 118.07 3h7l h ARG 276 Ca -0.01 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 3h7l h ARG 276 Cb 0.13 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 3h7l h ARG 276 CO 0.01 -0.00 0.30 -0.91 -1.51 0.00 0.00 179.97 177.85 3h7l h ASN 277 N -0.00 1.09 0.04 -3.80 -0.26 -0.97 -1.23 115.58 110.45 3h7l h ASN 277 Ca 0.08 -0.18 -0.05 0.00 -0.56 0.00 0.00 56.30 55.59 3h7l h ASN 277 Cb 0.12 -0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 37.09 3h7l h ASN 277 CO -0.17 0.98 -0.13 0.00 -1.06 0.00 0.00 177.43 177.05 3h7l h ALA 278 N 1.17 1.54 0.30 -0.83 0.00 -1.15 -2.06 119.26 118.23 3h7l h ALA 278 Ca 0.26 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3h7l h ALA 278 Cb 0.24 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3h7l h ALA 278 CO -0.02 0.33 -0.14 0.00 0.00 0.00 0.00 179.25 179.42 3h7l h ALA 279 N 1.68 -0.40 -0.51 0.00 0.00 -0.64 -2.40 119.26 116.98 3h7l h ALA 279 Ca 0.04 -0.16 0.10 0.00 0.00 0.00 0.00 54.91 54.89 3h7l h ALA 279 Cb 0.35 0.15 -0.10 0.00 0.00 0.00 0.00 17.79 18.20 3h7l h ALA 279 CO 0.02 -0.42 -0.19 0.93 0.00 0.00 0.00 179.25 179.59 3h7l h GLU 280 N -1.01 -0.07 -0.74 0.00 5.08 -1.25 0.08 114.58 116.67 3h7l h GLU 280 Ca -0.04 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 3h7l h GLU 280 Cb 0.46 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 3h7l h GLU 280 CO 0.07 -0.04 0.29 -0.91 -1.00 0.00 0.00 179.01 177.42 3h7l h ASN 281 N -0.07 1.01 -0.63 1.42 4.21 -1.48 -2.21 115.58 117.83 3h7l h ASN 281 Ca 0.24 -0.15 -0.08 0.00 1.21 0.00 0.00 56.30 57.52 3h7l h ASN 281 Cb 0.44 -0.26 -0.02 0.00 -1.12 0.00 0.00 38.32 37.36 3h7l h ASN 281 CO -0.56 0.90 0.08 1.23 -1.29 0.00 0.00 177.43 177.79 3h7l h GLY 282 N 1.12 1.15 0.71 2.83 0.00 -0.84 -2.28 103.07 105.75 3h7l h GLY 282 Ca 0.25 -0.78 -0.03 0.00 0.00 0.00 0.00 47.33 46.76 3h7l h GLY 282 CO -0.02 0.72 -0.34 -1.82 0.00 0.00 0.00 176.54 175.08 3h7l h TYR 283 N 0.98 -0.88 0.00 5.60 3.20 -0.67 -2.55 116.97 122.64 3h7l h TYR 283 Ca 0.19 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.02 3h7l h TYR 283 Cb 0.46 0.29 -0.00 0.00 1.54 0.00 0.00 36.73 39.02 3h7l h TYR 283 CO 0.03 -0.55 -0.11 -1.49 -1.64 0.00 0.00 178.16 174.40 3h7l h TRP 284 N -1.04 0.00 -0.54 -3.82 4.06 -1.49 0.10 115.95 113.22 3h7l h TRP 284 Ca -0.10 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.82 3h7l h TRP 284 Cb 0.73 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.87 3h7l h TRP 284 CO 0.04 0.11 0.22 1.25 -3.56 0.00 0.00 178.44 176.50 3h7l h HIS 285 N 0.00 0.82 -0.01 0.49 2.76 -1.43 -2.15 115.15 115.62 3h7l h HIS 285 Ca -0.00 -0.06 -0.22 0.00 -2.20 0.00 0.00 60.37 57.89 3h7l h HIS 285 Cb 0.26 -0.25 -0.00 0.00 1.55 0.00 0.00 27.41 28.98 3h7l h HIS 285 CO 0.00 0.67 -0.90 -0.07 -1.30 0.00 0.00 177.93 176.32 3h7l h LEU 286 N 0.73 0.48 -1.02 0.26 3.38 -0.61 0.18 115.31 118.71 3h7l h LEU 286 Ca 0.18 -0.37 0.23 0.00 0.09 0.00 0.00 57.88 58.01 3h7l h LEU 286 Cb 0.19 -0.15 -0.12 0.00 0.09 0.00 0.00 40.66 40.68 3h7l h LEU 286 CO -0.02 1.17 0.60 0.11 0.09 0.00 0.00 178.44 180.39 3h7l h LYS 287 N 0.21 0.60 0.19 1.13 1.79 -0.87 0.73 116.57 120.37 3h7l h LYS 287 Ca -0.07 -0.04 -0.32 0.00 -2.18 0.00 0.00 60.65 58.04 3h7l h LYS 287 Cb 1.53 -0.14 0.02 0.00 -1.58 0.00 0.00 32.23 32.06 3h7l h LYS 287 CO 0.15 0.40 -1.50 0.93 -1.08 0.00 0.00 179.45 178.35 3h7l h GLU 288 N 0.62 0.41 0.00 3.15 4.39 -0.97 -3.43 114.58 118.76 3h7l h GLU 288 Ca 0.63 -0.70 0.00 0.00 0.34 0.00 0.00 59.36 59.62 3h7l h GLU 288 Cb 1.15 0.26 0.00 0.00 -0.10 0.00 0.00 28.75 30.07 3h7l h GLU 288 CO -0.45 1.32 0.00 0.72 -1.16 0.00 0.00 179.01 179.44 3h7l n HIS 289 N -3.61 0.00 -0.36 4.33 8.25 0.60 -4.88 115.22 119.55 3h7l n HIS 289 Ca -0.17 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.29 3h7l n HIS 289 Cb 1.07 0.00 0.05 0.00 1.12 0.00 0.00 29.99 32.23 3h7l n HIS 289 CO 0.00 0.00 0.00 -0.97 0.64 0.00 0.00 176.34 176.01 3h7l h ASN 290 N 0.00 -1.34 0.64 0.41 -1.24 -1.06 -1.56 115.58 111.44 3h7l h ASN 290 Ca 0.00 0.30 0.00 0.00 0.71 0.00 0.00 56.30 57.31 3h7l h ASN 290 Cb 0.01 0.72 0.00 0.00 0.73 0.00 0.00 38.32 39.78 3h7l h ASN 290 CO 0.00 -0.29 0.00 0.71 -1.29 0.00 0.00 177.43 176.56 3h7l h THR 291 N -0.02 0.00 0.00 -3.57 1.35 -1.84 -0.48 112.91 108.35 3h7l h THR 291 Ca 0.35 -0.28 -0.06 0.00 -0.55 0.00 0.00 66.41 65.87 3h7l h THR 291 Cb 0.61 1.13 -0.01 0.00 -1.73 0.00 0.00 68.15 68.15 3h7l h THR 291 CO -0.96 0.00 -0.31 1.56 -0.25 0.00 0.00 175.52 175.56 3h7l h GLN 292 N 0.00 0.00 0.00 4.72 4.20 -1.60 -3.30 115.11 119.13 3h7l h GLN 292 Ca 0.00 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.48 3h7l h GLN 292 Cb 0.32 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.06 3h7l h GLN 292 CO 0.00 0.31 -1.57 0.66 -0.67 0.00 0.00 178.83 177.56 3h7l n TYR 293 N -3.22 1.00 -2.48 2.96 4.01 -0.21 -4.89 117.16 114.34 3h7l n TYR 293 Ca 0.02 0.35 -0.42 0.00 -0.16 0.00 0.00 57.90 57.69 3h7l n TYR 293 Cb 0.62 -1.14 -0.03 0.00 -0.31 0.00 0.00 39.34 38.48 3h7l n TYR 293 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3h7l s LEU 294 N -5.95 4.33 0.39 7.72 1.43 -1.09 -4.79 118.68 120.71 3h7l s LEU 294 Ca -0.04 1.87 0.11 0.00 -1.03 0.00 0.00 54.13 55.04 3h7l s LEU 294 Cb 0.08 -3.57 0.89 0.00 0.03 0.00 0.00 46.19 43.62 3h7l s LEU 294 CO 0.82 -0.49 1.92 0.78 0.23 0.00 0.00 176.35 179.61 3h7l h ASN 295 N 7.09 0.55 0.28 2.29 2.35 -1.89 -0.92 115.58 125.32 3h7l h ASN 295 Ca -0.38 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.39 3h7l h ASN 295 Cb 1.19 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.47 3h7l h ASN 295 CO 0.83 0.31 -1.19 -0.90 -1.65 0.00 0.00 177.43 174.83 3h7l n ASP 296 N -4.51 0.58 0.00 5.81 5.68 -1.26 -4.99 116.55 117.87 3h7l n ASP 296 Ca 0.14 -0.32 0.00 0.00 -0.50 0.00 0.00 54.79 54.10 3h7l n ASP 296 Cb 0.41 1.04 0.00 0.00 -1.14 0.00 0.00 41.12 41.43 3h7l n ASP 296 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3h7l n GLY 297 N 1.37 3.17 3.72 6.12 0.00 -0.35 -5.02 105.19 114.19 3h7l n GLY 297 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 3h7l n GLY 297 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3h7l s GLU 298 N -0.45 4.31 0.31 1.61 2.12 -1.26 -4.70 118.70 120.65 3h7l s GLU 298 Ca 0.00 0.39 -0.29 0.00 0.36 0.00 0.00 54.97 55.43 3h7l s GLU 298 Cb 0.00 -3.45 -0.10 0.00 0.26 0.00 0.00 34.13 30.84 3h7l s GLU 298 CO 0.00 0.14 1.27 -1.21 -0.54 0.00 0.00 175.26 174.92 3h7l s GLU 299 N 0.70 4.41 0.00 4.30 2.02 -1.26 -4.98 118.70 123.89 3h7l s GLU 299 Ca 0.24 2.13 0.00 0.00 0.02 0.00 0.00 54.97 57.36 3h7l s GLU 299 Cb -0.15 -3.10 0.00 0.00 0.10 0.00 0.00 34.13 30.98 3h7l s GLU 299 CO 0.09 -0.12 0.00 0.27 0.02 0.00 0.00 175.26 175.52 3h7l n ASN 300 N 1.01 1.97 -0.34 -0.19 0.23 -1.26 -4.99 115.26 111.69 3h7l n ASN 300 Ca 0.00 -0.07 -0.02 0.00 -0.53 0.00 0.00 54.58 53.96 3h7l n ASN 300 Cb 0.42 0.00 0.13 0.00 -2.08 0.00 0.00 39.78 38.26 3h7l n ASN 300 CO 0.00 0.00 0.00 -0.29 -0.93 0.00 0.00 177.26 176.04 3h7l h ILE 301 N 0.07 1.25 -0.36 1.53 2.10 -1.82 -2.46 117.51 117.81 3h7l h ILE 301 Ca 0.00 -0.49 -0.05 0.00 1.08 0.00 0.00 64.86 65.40 3h7l h ILE 301 Cb 0.00 -0.10 -0.01 0.00 -1.09 0.00 0.00 36.82 35.61 3h7l h ILE 301 CO 0.00 0.25 0.03 0.40 -1.08 0.00 0.00 178.15 177.75 3h7l h ILE 302 N 1.28 1.25 -0.65 2.19 2.04 -1.94 -0.11 117.51 121.56 3h7l h ILE 302 Ca 0.34 -0.91 0.09 0.00 1.00 0.00 0.00 64.86 65.38 3h7l h ILE 302 Cb -0.11 1.14 -0.07 0.00 -0.74 0.00 0.00 36.82 37.04 3h7l h ILE 302 CO -0.07 0.30 0.30 0.44 0.00 0.00 0.00 178.15 179.12 3h7l h ASP 303 N 0.44 0.36 -0.23 1.72 3.32 -1.81 -1.78 116.42 118.45 3h7l h ASP 303 Ca 0.11 0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.11 3h7l h ASP 303 Cb 0.41 0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.96 3h7l h ASP 303 CO 0.01 0.22 -0.27 -0.33 -1.72 0.00 0.00 179.24 177.15 3h7l h GLU 304 N 0.52 0.58 -0.09 3.56 5.08 -0.95 -0.64 114.58 122.63 3h7l h GLU 304 Ca 0.32 -0.32 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 3h7l h GLU 304 Cb 0.34 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 3h7l h GLU 304 CO -0.27 0.92 -0.60 0.10 -1.00 0.00 0.00 179.01 178.16 3h7l h TYR 305 N 0.27 0.40 -0.23 4.33 -0.00 -0.93 -0.65 116.97 120.16 3h7l h TYR 305 Ca 0.03 -0.15 -0.05 0.00 0.00 0.00 0.00 58.73 58.56 3h7l h TYR 305 Cb 0.83 -0.07 -0.01 0.00 0.00 0.00 0.00 36.73 37.48 3h7l h TYR 305 CO 0.08 0.83 -0.06 0.00 -0.00 0.00 0.00 178.16 179.01 3h7l h ALA 307 N 0.75 1.27 -0.11 0.00 0.00 -1.11 -1.40 119.26 118.66 3h7l h ALA 307 Ca 0.06 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.77 3h7l h ALA 307 Cb 0.53 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3h7l h ALA 307 CO 0.02 0.50 0.04 1.25 0.00 0.00 0.00 179.25 181.07 3h7l h LEU 308 N 0.66 0.06 -0.26 0.00 5.85 -1.03 0.32 115.31 120.90 3h7l h LEU 308 Ca 0.14 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.91 3h7l h LEU 308 Cb 0.33 -0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 3h7l h LEU 308 CO 0.01 0.05 0.03 -0.07 -0.34 0.00 0.00 178.44 178.11 3h7l h LEU 309 N 0.10 -0.04 0.12 2.25 3.38 -1.17 0.12 115.31 120.07 3h7l h LEU 309 Ca 0.04 0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.08 3h7l h LEU 309 Cb 0.02 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 3h7l h LEU 309 CO -0.04 0.01 -0.47 0.00 0.09 0.00 0.00 178.44 178.03 3h7l h ALA 310 N 1.21 -0.87 -0.24 1.53 0.00 -1.02 -0.55 119.26 119.32 3h7l h ALA 310 Ca 0.12 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3h7l h ALA 310 Cb 0.14 0.80 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 3h7l h ALA 310 CO -0.19 -1.06 -0.11 0.66 0.00 0.00 0.00 179.25 178.56 3h7l h SER 311 N -0.71 0.36 0.03 0.00 4.64 -0.72 -0.35 113.55 116.80 3h7l h SER 311 Ca 0.01 -0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 61.25 3h7l h SER 311 Cb 0.73 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 3h7l h SER 311 CO -0.27 0.51 -0.01 0.58 -0.87 0.00 0.00 176.83 176.77 3h7l h VAL 312 N 0.36 1.26 -0.74 0.95 2.07 -0.57 -1.83 116.25 117.76 3h7l h VAL 312 Ca 0.07 -0.93 -0.04 0.00 0.82 0.00 0.00 66.70 66.62 3h7l h VAL 312 Cb 0.41 1.88 -0.03 0.00 -1.52 0.00 0.00 31.29 32.03 3h7l h VAL 312 CO 0.02 0.24 0.29 -0.33 0.02 0.00 0.00 177.57 177.81 3h7l h GLU 313 N -0.45 1.11 -0.83 1.57 4.39 -0.95 -1.64 114.58 117.78 3h7l h GLU 313 Ca -0.00 -0.21 0.06 0.00 0.34 0.00 0.00 59.36 59.55 3h7l h GLU 313 Cb 0.42 -0.18 -0.06 0.00 -0.10 0.00 0.00 28.75 28.83 3h7l h GLU 313 CO 0.01 0.91 0.51 -0.07 -1.16 0.00 0.00 179.01 179.21 3h7l h LEU 314 N 1.07 0.80 -0.99 1.33 3.38 -1.08 -1.59 115.31 118.23 3h7l h LEU 314 Ca 0.25 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 3h7l h LEU 314 Cb 0.22 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 3h7l h LEU 314 CO -0.02 0.51 0.48 0.15 0.09 0.00 0.00 178.44 179.65 3h7l h PHE 315 N 0.93 1.16 -0.26 1.13 3.57 -0.74 -1.01 116.94 121.73 3h7l h PHE 315 Ca 0.37 -0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.72 3h7l h PHE 315 Cb 0.17 -0.37 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 3h7l h PHE 315 CO -0.04 0.80 -0.35 0.87 -2.23 0.00 0.00 178.31 177.36 3h7l h LYS 316 N 1.19 0.58 0.08 1.11 1.57 -0.49 -0.43 116.57 120.19 3h7l h LYS 316 Ca 0.30 -0.27 -0.15 0.00 -1.87 0.00 0.00 60.65 58.66 3h7l h LYS 316 Cb 0.01 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.32 3h7l h LYS 316 CO -0.05 0.85 -0.72 0.00 -0.57 0.00 0.00 179.45 178.96 3h7l h ALA 317 N 1.13 0.01 0.00 3.86 0.00 -1.24 -3.39 119.26 119.63 3h7l h ALA 317 Ca 0.05 -0.75 -0.25 0.00 0.00 0.00 0.00 54.91 53.95 3h7l h ALA 317 Cb 0.84 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.78 3h7l h ALA 317 CO 0.07 0.37 -1.50 1.79 0.00 0.00 0.00 179.25 179.99 3h7l h THR 318 N -0.60 0.96 -1.22 0.00 1.35 -1.27 -3.49 112.91 108.65 3h7l h THR 318 Ca -0.15 -2.72 -0.35 0.00 -0.55 0.00 0.00 66.41 62.64 3h7l h THR 318 Cb 1.45 2.44 -0.11 0.00 -1.73 0.00 0.00 68.15 70.20 3h7l h THR 318 CO 0.06 0.54 -0.35 0.29 -0.25 0.00 0.00 175.52 175.82 3h7l n LYS 319 N -3.08 -1.24 -3.08 4.72 5.02 -0.17 -5.00 118.16 115.32 3h7l n LYS 319 Ca -0.12 1.04 -0.40 0.00 -2.02 0.00 0.00 58.31 56.81 3h7l n LYS 319 Cb 0.99 -5.33 -0.05 0.00 -0.02 0.00 0.00 35.03 30.62 3h7l n LYS 319 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3h7l s GLU 320 N -3.80 4.31 0.60 1.97 2.02 -1.26 -4.96 118.70 117.57 3h7l s GLU 320 Ca 0.00 0.74 0.31 0.00 0.02 0.00 0.00 54.97 56.04 3h7l s GLU 320 Cb 0.00 -3.52 1.85 0.00 0.10 0.00 0.00 34.13 32.55 3h7l s GLU 320 CO 0.00 -0.12 2.22 1.15 0.02 0.00 0.00 175.26 178.54 3h7l h THR 321 N 5.00 0.44 0.00 3.63 2.02 -1.95 -1.61 112.91 120.44 3h7l h THR 321 Ca -0.35 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 66.79 3h7l h THR 321 Cb 1.16 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.52 3h7l h THR 321 CO 0.77 0.00 -0.18 0.08 0.37 0.00 0.00 175.52 176.56 3h7l h ARG 322 N 0.00 0.00 0.01 6.66 0.11 -1.99 -1.98 114.38 117.18 3h7l h ARG 322 Ca 0.02 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 59.90 3h7l h ARG 322 Cb 0.14 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.20 3h7l h ARG 322 CO -0.00 0.18 -0.95 1.88 0.10 0.00 0.00 179.97 181.19 3h7l h TYR 323 N 0.00 0.05 -0.50 4.08 0.05 -1.62 -1.40 116.97 117.63 3h7l h TYR 323 Ca -0.00 -0.03 -0.07 0.00 0.05 0.00 0.00 58.73 58.67 3h7l h TYR 323 Cb 0.50 -0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.22 3h7l h TYR 323 CO 0.00 0.96 0.03 1.25 -1.05 0.00 0.00 178.16 179.34 3h7l h LEU 324 N 0.01 0.78 -0.43 3.88 5.85 -1.50 0.27 115.31 124.18 3h7l h LEU 324 Ca -0.02 -0.18 -0.07 0.00 0.84 0.00 0.00 57.88 58.45 3h7l h LEU 324 Cb 1.66 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.47 3h7l h LEU 324 CO 0.13 0.83 0.01 -0.33 -0.34 0.00 0.00 178.44 178.73 3h7l h GLU 325 N 0.77 0.75 -0.78 1.25 4.39 -1.31 -0.09 114.58 119.56 3h7l h GLU 325 Ca 0.15 -0.24 -0.03 0.00 0.34 0.00 0.00 59.36 59.59 3h7l h GLU 325 Cb 0.43 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.97 3h7l h GLU 325 CO 0.02 0.82 0.39 0.93 -1.16 0.00 0.00 179.01 180.01 3h7l h GLU 326 N 0.59 1.12 -0.23 2.33 4.39 -1.11 0.82 114.58 122.49 3h7l h GLU 326 Ca 0.12 -0.16 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 3h7l h GLU 326 Cb 0.48 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 3h7l h GLU 326 CO 0.02 0.86 0.12 0.77 -1.16 0.00 0.00 179.01 179.62 3h7l h SER 327 N 1.10 0.29 -0.61 1.42 0.02 -0.79 -0.26 113.55 114.72 3h7l h SER 327 Ca 0.27 -0.10 0.06 0.00 -0.84 0.00 0.00 61.79 61.18 3h7l h SER 327 Cb 0.10 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 62.51 3h7l h SER 327 CO -0.04 0.31 0.32 0.03 -1.14 0.00 0.00 176.83 176.30 3h7l h ARG 328 N 0.25 0.57 0.14 3.45 3.08 -0.73 0.91 114.38 122.04 3h7l h ARG 328 Ca 0.08 -0.03 0.02 0.00 0.07 0.00 0.00 59.98 60.11 3h7l h ARG 328 Cb 0.09 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 3h7l h ARG 328 CO -0.01 0.38 -0.26 1.25 -1.07 0.00 0.00 179.97 180.26 3h7l h LEU 329 N 0.59 -0.72 -0.48 3.04 6.46 -0.48 -2.35 115.31 121.36 3h7l h LEU 329 Ca 0.28 0.08 -0.16 0.00 -0.12 0.00 0.00 57.88 57.96 3h7l h LEU 329 Cb 0.20 0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 40.39 3h7l h LEU 329 CO -0.19 -0.35 -0.44 -0.50 -0.62 0.00 0.00 178.44 176.34 3h7l h TRP 330 N -0.48 0.92 0.24 1.25 4.06 -0.68 -2.39 115.95 118.88 3h7l h TRP 330 Ca 0.02 -0.29 0.01 0.00 2.06 0.00 0.00 58.89 60.69 3h7l h TRP 330 Cb 0.49 -0.19 -0.04 0.00 -1.00 0.00 0.00 29.16 28.42 3h7l h TRP 330 CO -0.23 1.07 -0.49 0.00 -3.56 0.00 0.00 178.44 175.23 3h7l h ALA 331 N 0.89 -0.97 -0.67 1.49 0.00 -0.82 0.35 119.26 119.53 3h7l h ALA 331 Ca 0.04 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3h7l h ALA 331 Cb 1.00 0.79 -0.03 0.00 0.00 0.00 0.00 17.79 19.55 3h7l h ALA 331 CO 0.10 -1.11 0.41 1.96 0.00 0.00 0.00 179.25 180.61 3h7l h GLN 332 N -0.81 0.89 -0.27 0.00 1.08 -1.36 0.27 115.11 114.90 3h7l h GLN 332 Ca -0.02 -0.07 -0.12 0.00 -1.45 0.00 0.00 58.65 56.99 3h7l h GLN 332 Cb 0.78 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 28.00 3h7l h GLN 332 CO -0.20 0.61 -0.34 0.00 -0.95 0.00 0.00 178.83 177.95 3h7l h ARG 333 N 0.91 0.59 -0.07 1.46 3.08 -1.30 -2.72 114.38 116.34 3h7l h ARG 333 Ca 0.24 -0.27 -0.10 0.00 0.07 0.00 0.00 59.98 59.92 3h7l h ARG 333 Cb -0.06 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 29.99 3h7l h ARG 333 CO -0.05 0.85 -0.35 1.25 -1.07 0.00 0.00 179.97 180.61 3h7l h LEU 334 N 0.50 0.43 -0.86 3.04 5.85 0.23 -3.23 115.31 121.27 3h7l h LEU 334 Ca 0.06 -0.65 0.22 0.00 0.84 0.00 0.00 57.88 58.34 3h7l h LEU 334 Cb 0.83 -0.13 -0.13 0.00 0.37 0.00 0.00 40.66 41.60 3h7l h LEU 334 CO 0.07 1.01 0.27 0.58 -0.34 0.00 0.00 178.44 180.03 3h7l h VAL 335 N -0.13 0.40 0.00 1.05 2.07 -0.51 0.28 116.25 119.42 3h7l h VAL 335 Ca -0.02 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.40 3h7l h VAL 335 Cb 1.00 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 3h7l h VAL 335 CO 0.07 0.05 0.00 0.00 0.02 0.00 0.00 177.57 177.71 3h7l n ALA 336 N -2.63 1.31 0.28 1.67 0.00 -1.03 -1.42 120.51 118.69 3h7l n ALA 336 Ca 0.20 -0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.75 3h7l n ALA 336 Cb 0.64 -1.08 0.19 0.00 0.00 0.00 0.00 19.45 19.20 3h7l n ALA 336 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h7l h ARG 337 N 0.00 0.00 -6.40 0.00 2.47 -1.04 -3.44 114.38 105.97 3h7l h ARG 337 Ca 0.00 0.00 -0.57 0.00 -1.26 0.00 0.00 59.98 58.15 3h7l h ARG 337 Cb 0.06 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.34 3h7l h ARG 337 CO 0.00 0.00 1.06 -1.14 0.56 0.00 0.00 179.97 180.45 3h7l s GLN 338 N -3.21 3.73 0.07 0.04 0.74 -0.51 -1.37 119.66 119.15 3h7l s GLN 338 Ca 0.07 1.21 0.03 0.00 0.05 0.00 0.00 55.36 56.72 3h7l s GLN 338 Cb 0.07 -3.98 -0.03 0.00 1.10 0.00 0.00 33.01 30.17 3h7l s GLN 338 CO 0.68 -1.37 -0.10 -1.64 -0.55 0.00 0.00 175.29 172.31 3h7l s MET 339 N 4.65 0.70 0.26 1.67 -1.94 -0.97 -4.96 119.30 118.71 3h7l s MET 339 Ca 0.62 -0.95 0.07 0.00 -1.71 0.00 0.00 55.69 53.73 3h7l s MET 339 Cb -0.17 -0.48 -0.03 0.00 2.01 0.00 0.00 34.83 36.15 3h7l s MET 339 CO 0.28 0.09 0.22 -1.12 -0.01 0.00 0.00 175.02 174.48 3h7l s SER 340 N -1.93 5.53 0.00 3.03 0.01 -1.26 -1.17 113.70 117.91 3h7l s SER 340 Ca -0.03 -0.27 0.00 0.00 1.31 0.00 0.00 55.95 56.97 3h7l s SER 340 Cb -0.07 -1.37 0.00 0.00 0.21 0.00 0.00 66.02 64.79 3h7l s SER 340 CO 0.00 -0.08 0.00 -0.90 0.41 0.00 0.00 173.24 172.68 3h7l n ASP 341 N -1.21 0.00 0.28 2.44 5.75 0.24 -4.92 116.55 119.13 3h7l n ASP 341 Ca -0.07 0.00 -0.17 0.00 -0.01 0.00 0.00 54.79 54.54 3h7l n ASP 341 Cb 0.58 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.59 3h7l n ASP 341 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 3h7l h GLU 342 N 0.00 -0.80 0.02 0.11 4.39 -2.02 -3.36 114.58 112.91 3h7l h GLU 342 Ca 0.00 0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.75 3h7l h GLU 342 Cb 0.00 0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 3h7l h GLU 342 CO 0.00 -0.53 -0.01 1.96 -1.16 0.00 0.00 179.01 179.27 3h7l h GLN 343 N -0.83 -0.02 -6.73 2.33 4.20 -1.99 -3.47 115.11 108.59 3h7l h GLN 343 Ca -0.05 0.00 -0.69 0.00 0.06 0.00 0.00 58.65 57.97 3h7l h GLN 343 Cb 0.71 0.00 -0.26 0.00 0.30 0.00 0.00 27.48 28.23 3h7l h GLN 343 CO -0.00 0.74 -0.88 0.42 -0.67 0.00 0.00 178.83 178.44 3h7l s ILE 344 N -2.56 2.19 -0.10 2.54 -1.09 -1.26 -5.12 121.20 115.80 3h7l s ILE 344 Ca -0.16 -1.38 -0.17 0.00 -2.23 0.00 0.00 60.65 56.71 3h7l s ILE 344 Cb -0.02 -1.86 -0.04 0.00 -1.58 0.00 0.00 42.46 38.96 3h7l s ILE 344 CO 0.59 0.36 0.45 -1.10 -1.23 0.00 0.00 174.94 174.01 3h7l s GLN 345 N -1.26 4.28 -1.32 2.79 -1.52 -1.26 -0.59 119.66 120.77 3h7l s GLN 345 Ca 0.12 0.41 -0.08 0.00 -1.95 0.00 0.00 55.36 53.86 3h7l s GLN 345 Cb -0.10 -3.40 0.01 0.00 -0.22 0.00 0.00 33.01 29.29 3h7l s GLN 345 CO 0.02 0.24 1.01 0.72 -0.25 0.00 0.00 175.29 177.04 3h7l n HIS 346 N 3.39 -2.56 -1.41 0.91 8.25 -1.14 -4.85 115.22 117.81 3h7l n HIS 346 Ca -0.09 0.87 -0.30 0.00 -0.26 0.00 0.00 57.72 57.94 3h7l n HIS 346 Cb 0.52 -4.72 0.23 0.00 1.12 0.00 0.00 29.99 27.14 3h7l n HIS 346 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 3h7l s PHE 347 N -3.27 0.60 -0.16 4.41 -0.12 -0.32 -4.62 117.98 114.50 3h7l s PHE 347 Ca 0.50 0.33 -0.05 0.00 -0.05 0.00 0.00 56.93 57.65 3h7l s PHE 347 Cb -0.22 -3.79 -0.03 0.00 -0.63 0.00 0.00 43.02 38.34 3h7l s PHE 347 CO 0.62 -3.59 0.01 -1.58 -0.05 0.00 0.00 175.22 170.63 3h7l s TRP 348 N -3.39 3.14 -0.08 3.49 0.52 -1.26 -2.30 118.94 119.06 3h7l s TRP 348 Ca 0.74 -0.09 -0.08 0.00 0.02 0.00 0.00 56.10 56.69 3h7l s TRP 348 Cb -0.05 -2.00 -0.04 0.00 -1.15 0.00 0.00 33.47 30.22 3h7l s TRP 348 CO 0.55 0.08 0.20 -1.54 0.02 0.00 0.00 176.95 176.26 3h7l s SER 349 N 0.29 6.46 -0.09 2.95 1.04 -0.47 0.96 113.70 124.85 3h7l s SER 349 Ca 0.00 0.54 -0.10 0.00 0.48 0.00 0.00 55.95 56.88 3h7l s SER 349 Cb -0.13 -2.09 -0.07 0.00 0.10 0.00 0.00 66.02 63.82 3h7l s SER 349 CO 0.02 0.37 0.35 0.00 0.98 0.00 0.00 173.24 174.95 3h7l h ALA 350 N 4.71 -0.13 -3.40 5.32 0.00 -0.46 -3.41 119.26 121.90 3h7l h ALA 350 Ca -0.53 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.25 3h7l h ALA 350 Cb 1.22 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3h7l h ALA 350 CO 0.60 -0.14 0.00 0.27 0.00 0.00 0.00 179.25 179.99 3h7l n ASN 351 N -4.84 0.00 -0.02 0.00 0.23 -1.19 -3.46 115.26 105.99 3h7l n ASN 351 Ca -0.04 -0.89 -0.17 0.00 -0.53 0.00 0.00 54.58 52.95 3h7l n ASN 351 Cb 0.14 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 37.76 3h7l n ASN 351 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 3h7l h GLN 352 N 0.00 0.67 0.00 -3.83 5.75 -1.92 -3.35 115.11 112.43 3h7l h GLN 352 Ca 0.00 -0.57 0.00 0.00 -0.15 0.00 0.00 58.65 57.93 3h7l h GLN 352 Cb 0.00 0.13 0.00 0.00 1.07 0.00 0.00 27.48 28.68 3h7l h GLN 352 CO 0.00 1.19 -0.93 -0.40 -2.65 0.00 0.00 178.83 176.04 3h7l n ASP 353 N -4.05 0.63 0.00 -0.69 5.75 -1.26 -4.96 116.55 111.97 3h7l n ASP 353 Ca -0.08 -0.16 0.00 0.00 -0.01 0.00 0.00 54.79 54.54 3h7l n ASP 353 Cb 0.71 0.66 0.00 0.00 -1.03 0.00 0.00 41.12 41.45 3h7l n ASP 353 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3h7l n GLY 354 N 1.37 0.51 0.30 6.12 0.00 -1.26 -4.95 105.19 107.27 3h7l n GLY 354 Ca 0.02 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.23 3h7l n GLY 354 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3h7l h SER 355 N 0.00 0.00 -3.36 1.61 4.64 -1.92 -3.38 113.55 111.14 3h7l h SER 355 Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 3h7l h SER 355 Cb 0.00 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 61.70 3h7l h SER 355 CO 0.00 0.01 -0.77 -0.60 -0.87 0.00 0.00 176.83 174.59 3h7l s ARG 356 N -3.83 1.02 0.60 4.77 3.00 -1.26 -4.94 118.95 118.31 3h7l s ARG 356 Ca -0.01 -0.52 -0.14 0.00 -1.00 0.00 0.00 55.73 54.06 3h7l s ARG 356 Cb 0.10 -2.11 -0.04 0.00 0.00 0.00 0.00 34.95 32.90 3h7l s ARG 356 CO 0.51 -0.56 1.03 -1.25 0.00 0.00 0.00 175.30 175.02 3h7l s PRO 357 N 1.72 3.50 -0.21 5.12 0.04 -1.26 0.15 135.00 144.06 3h7l s PRO 357 Ca -0.01 0.97 -0.27 0.00 0.04 0.00 0.00 61.00 61.73 3h7l s PRO 357 Cb -0.17 -2.07 -0.00 0.00 0.04 0.00 0.00 34.50 32.31 3h7l s PRO 357 CO -0.07 -0.65 0.95 -0.47 0.04 0.00 0.00 177.00 176.80 3h7l s TYR 358 N -2.79 3.36 -0.08 0.56 5.04 0.27 -4.16 117.35 119.56 3h7l s TYR 358 Ca 0.59 1.36 -0.03 0.00 -2.44 0.00 0.00 57.07 56.54 3h7l s TYR 358 Cb -0.13 -3.16 0.04 0.00 0.35 0.00 0.00 41.96 39.07 3h7l s TYR 358 CO 0.43 -0.40 0.16 -0.59 -1.34 0.00 0.00 175.55 173.81 3h7l s PHE 359 N 2.82 -0.18 -0.17 4.97 -0.12 -1.26 -4.70 117.98 119.34 3h7l s PHE 359 Ca 0.41 0.56 -0.02 0.00 -0.05 0.00 0.00 56.93 57.83 3h7l s PHE 359 Cb -0.16 -0.14 0.05 0.00 -0.63 0.00 0.00 43.02 42.14 3h7l s PHE 359 CO 0.09 -0.21 -0.00 -1.58 -0.05 0.00 0.00 175.22 173.46 3h7l s HIS 360 N 1.63 1.30 -0.89 3.49 2.46 -1.26 -4.97 115.29 117.05 3h7l s HIS 360 Ca -0.04 -0.90 0.03 0.00 0.47 0.00 0.00 55.06 54.62 3h7l s HIS 360 Cb -0.12 -1.13 0.16 0.00 -0.13 0.00 0.00 32.58 31.36 3h7l s HIS 360 CO -0.06 -0.58 1.09 0.00 -2.47 0.00 0.00 174.74 172.71 3h7l n ALA 361 N 4.98 1.00 0.00 1.58 0.00 -1.26 -2.93 120.51 123.89 3h7l n ALA 361 Ca -0.10 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.37 3h7l n ALA 361 Cb 0.47 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.88 3h7l n ALA 361 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h7l n ALA 362 N -1.54 1.98 -2.13 0.00 0.00 -1.26 -3.25 120.51 114.32 3h7l n ALA 362 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.42 3h7l n ALA 362 Cb 0.01 0.20 -0.02 0.00 0.00 0.00 0.00 19.45 19.63 3h7l n ALA 362 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3h7l n GLU 363 N -1.87 0.00 0.32 0.00 0.28 -1.21 -3.11 120.64 115.04 3h7l n GLU 363 Ca 0.00 -1.02 0.11 0.00 -0.16 0.00 0.00 57.16 56.09 3h7l n GLU 363 Cb 0.39 0.08 0.57 0.00 1.43 0.00 0.00 31.44 33.91 3h7l n GLU 363 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3h7l h ALA 364 N 0.25 1.49 -0.22 -1.84 0.00 -1.78 0.25 119.26 117.41 3h7l h ALA 364 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3h7l h ALA 364 Cb 1.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.22 3h7l h ALA 364 CO -0.07 -0.49 0.00 0.41 0.00 0.00 0.00 179.25 179.10 3h7l n GLY 365 N -1.29 0.41 0.20 0.00 0.00 -1.26 -4.42 105.19 98.82 3h7l n GLY 365 Ca -0.01 -0.42 -0.19 0.00 0.00 0.00 0.00 46.02 45.40 3h7l n GLY 365 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3h7l h LEU 366 N 2.22 0.85 -0.70 0.99 5.85 -0.79 -2.95 115.31 120.78 3h7l h LEU 366 Ca 0.00 -0.69 0.14 0.00 0.84 0.00 0.00 57.88 58.17 3h7l h LEU 366 Cb 0.49 -0.26 -0.13 0.00 0.37 0.00 0.00 40.66 41.13 3h7l h LEU 366 CO 0.00 1.42 -0.17 -0.65 -0.34 0.00 0.00 178.44 178.70 3h7l h PRO 367 N 0.35 0.00 -0.21 5.25 0.11 -1.80 0.92 132.00 136.63 3h7l h PRO 367 Ca -0.09 -0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.85 3h7l h PRO 367 Cb 1.50 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.60 3h7l h PRO 367 CO 0.17 0.00 -0.58 1.15 -0.21 0.00 0.00 178.00 178.54 3h7l h THR 368 N 0.00 1.31 -0.25 -1.15 2.02 -1.88 -2.18 112.91 110.78 3h7l h THR 368 Ca 0.34 -1.81 -0.01 0.00 0.77 0.00 0.00 66.41 65.70 3h7l h THR 368 Cb 0.52 1.76 -0.01 0.00 -1.74 0.00 0.00 68.15 68.68 3h7l h THR 368 CO -0.72 0.57 0.12 0.40 0.37 0.00 0.00 175.52 176.26 3h7l h ILE 369 N 0.50 1.14 -0.46 3.11 2.04 -1.25 -0.37 117.51 122.22 3h7l h ILE 369 Ca 0.00 -0.41 0.05 0.00 1.00 0.00 0.00 64.86 65.50 3h7l h ILE 369 Cb 1.15 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 38.14 3h7l h ILE 369 CO 0.11 0.14 0.21 0.00 0.00 0.00 0.00 178.15 178.61 3h7l h ALA 370 N 0.98 0.57 -0.59 1.87 0.00 -0.78 0.01 119.26 121.33 3h7l h ALA 370 Ca 0.09 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 3h7l h ALA 370 Cb 0.12 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3h7l h ALA 370 CO -0.01 -0.16 0.22 -0.07 0.00 0.00 0.00 179.25 179.22 3h7l h LEU 371 N 0.41 0.79 -1.00 0.00 3.38 -1.16 -2.26 115.31 115.46 3h7l h LEU 371 Ca 0.21 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 3h7l h LEU 371 Cb 0.15 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3h7l h LEU 371 CO -0.17 0.72 -0.33 0.00 0.09 0.00 0.00 178.44 178.75 3h7l h GLU 373 N 0.00 0.67 -0.30 0.00 4.39 -0.48 -3.09 114.58 115.76 3h7l h GLU 373 Ca -0.00 -0.26 0.00 0.00 0.34 0.00 0.00 59.36 59.44 3h7l h GLU 373 Cb 0.84 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.44 3h7l h GLU 373 CO 0.04 0.84 0.20 -0.92 -1.16 0.00 0.00 179.01 178.01 3h7l h TYR 374 N 0.46 0.39 0.00 4.33 3.20 -1.11 -3.11 116.97 121.12 3h7l h TYR 374 Ca 0.09 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.96 3h7l h TYR 374 Cb 0.59 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.74 3h7l h TYR 374 CO 0.05 0.25 0.00 -0.07 -1.64 0.00 0.00 178.16 176.75 3h7l h LEU 375 N 0.41 0.00 0.00 2.82 3.38 -1.28 -1.52 115.31 119.11 3h7l h LEU 375 Ca 0.11 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.88 3h7l h LEU 375 Cb -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3h7l h LEU 375 CO -0.02 0.00 -1.37 0.00 0.09 0.00 0.00 178.44 177.14 3h7l h ALA 376 N 2.10 0.67 0.00 1.53 0.00 -1.47 -3.36 119.26 118.73 3h7l h ALA 376 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 54.91 53.91 3h7l h ALA 376 Cb 0.18 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3h7l h ALA 376 CO 0.00 1.12 -1.47 0.44 0.00 0.00 0.00 179.25 179.34 3h7l n ILE 377 N -3.01 0.26 -2.35 0.00 -5.35 -0.77 -4.94 119.36 103.20 3h7l n ILE 377 Ca -0.10 -0.48 -0.41 0.00 -0.27 0.00 0.00 62.75 61.50 3h7l n ILE 377 Cb 0.90 -0.08 -0.03 0.00 -1.74 0.00 0.00 39.64 38.68 3h7l n ILE 377 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 3h7l s GLU 378 N -3.41 4.48 -0.26 6.28 2.56 -0.64 -5.00 118.70 122.72 3h7l s GLU 378 Ca -0.03 1.92 -0.14 0.00 0.00 0.00 0.00 54.97 56.72 3h7l s GLU 378 Cb 0.12 -3.22 -0.14 0.00 2.00 0.00 0.00 34.13 32.89 3h7l s GLU 378 CO 0.85 -0.08 -0.21 -0.40 -0.56 0.00 0.00 175.26 174.85 3h7l n ASP 379 N 2.27 1.95 -4.85 -1.70 5.68 -1.26 -4.97 116.55 113.66 3h7l n ASP 379 Ca 0.04 0.30 -0.34 0.00 -0.50 0.00 0.00 54.79 54.28 3h7l n ASP 379 Cb 0.44 -0.81 -0.06 0.00 -1.14 0.00 0.00 41.12 39.56 3h7l n ASP 379 CO 0.00 0.00 0.00 1.51 -1.33 0.00 0.00 177.20 177.38 3h7l s ASP 380 N -7.26 6.79 0.34 -1.12 -4.77 -1.26 -5.01 116.67 104.38 3h7l s ASP 380 Ca -0.36 1.08 0.03 0.00 -3.30 0.00 0.00 52.55 50.00 3h7l s ASP 380 Cb 0.12 -2.29 0.61 0.00 -1.09 0.00 0.00 42.92 40.28 3h7l s ASP 380 CO 0.53 0.04 1.93 -1.28 0.70 0.00 0.00 175.17 177.09 3h7l h SER 381 N 3.23 0.60 0.63 2.11 0.87 -2.03 -3.29 113.55 115.67 3h7l h SER 381 Ca -0.48 -0.07 -0.27 0.00 -1.23 0.00 0.00 61.79 59.73 3h7l h SER 381 Cb 1.19 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.99 3h7l h SER 381 CO 0.66 0.56 -1.26 1.62 -0.53 0.00 0.00 176.83 177.88 3h7l h VAL 382 N 0.66 1.48 -0.68 2.23 3.04 -2.02 -3.32 116.25 117.64 3h7l h VAL 382 Ca 0.16 -3.06 0.04 0.00 -1.01 0.00 0.00 66.70 62.84 3h7l h VAL 382 Cb 0.15 2.93 -0.05 0.00 -2.01 0.00 0.00 31.29 32.31 3h7l h VAL 382 CO -0.01 0.89 0.40 1.56 -1.01 0.00 0.00 177.57 179.40 3h7l h GLN 383 N 0.07 0.74 0.00 4.17 1.08 -2.00 -3.16 115.11 116.01 3h7l h GLN 383 Ca -0.14 -0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 56.98 3h7l h GLN 383 Cb 1.97 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 29.23 3h7l h GLN 383 CO 0.20 0.49 -0.19 1.79 -0.95 0.00 0.00 178.83 180.17 3h7l h THR 384 N 0.77 0.73 0.00 -0.54 1.35 -1.71 -3.37 112.91 110.14 3h7l h THR 384 Ca 0.29 -0.79 -0.06 0.00 -0.55 0.00 0.00 66.41 65.30 3h7l h THR 384 Cb 0.10 1.48 -0.01 0.00 -1.73 0.00 0.00 68.15 68.00 3h7l h THR 384 CO -0.14 0.19 -0.29 -0.33 -0.25 0.00 0.00 175.52 174.69 3h7l h GLU 385 N 0.00 0.00 0.00 4.72 4.39 -1.71 -0.46 114.58 121.52 3h7l h GLU 385 Ca -0.00 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.65 3h7l h GLU 385 Cb 0.47 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.11 3h7l h GLU 385 CO 0.02 0.29 -0.22 0.66 -1.16 0.00 0.00 179.01 178.61 3h7l h SER 386 N 0.00 0.00 0.11 1.42 4.64 -1.82 -3.17 113.55 114.73 3h7l h SER 386 Ca -0.00 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.97 3h7l h SER 386 Cb 0.56 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.63 3h7l h SER 386 CO 0.04 0.22 -1.92 0.52 -0.87 0.00 0.00 176.83 174.82 3h7l n VAL 387 N -3.41 1.75 -0.36 0.95 0.31 -0.48 -3.74 118.33 113.35 3h7l n VAL 387 Ca -0.00 -0.58 0.28 0.00 -0.01 0.00 0.00 64.34 64.03 3h7l n VAL 387 Cb 0.41 -1.77 0.57 0.00 -0.91 0.00 0.00 33.84 32.14 3h7l n VAL 387 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 3h7l h LYS 388 N -0.07 0.26 0.00 5.55 1.63 -1.11 0.18 116.57 123.01 3h7l h LYS 388 Ca -0.42 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.36 3h7l h LYS 388 Cb 1.94 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 33.51 3h7l h LYS 388 CO 0.05 0.17 -1.35 0.00 -3.45 0.00 0.00 179.45 174.87 3h7l h ILE 390 N 0.00 1.37 0.75 0.00 1.08 -0.99 0.12 117.51 119.84 3h7l h ILE 390 Ca 0.00 -1.88 -0.04 0.00 -0.39 0.00 0.00 64.86 62.55 3h7l h ILE 390 Cb 0.66 1.93 0.01 0.00 -3.07 0.00 0.00 36.82 36.34 3h7l h ILE 390 CO 0.00 0.56 -0.36 0.58 -0.69 0.00 0.00 178.15 178.24 3h7l h VAL 391 N 0.20 0.25 -0.90 1.67 2.07 -0.88 -1.75 116.25 116.90 3h7l h VAL 391 Ca -0.00 -0.04 0.18 0.00 0.82 0.00 0.00 66.70 67.66 3h7l h VAL 391 Cb 1.05 0.26 -0.10 0.00 -1.52 0.00 0.00 31.29 30.97 3h7l h VAL 391 CO 0.09 0.00 0.48 0.78 0.02 0.00 0.00 177.57 178.94 3h7l h ASN 392 N -1.04 0.56 0.02 0.57 2.35 -1.44 -0.34 115.58 116.25 3h7l h ASN 392 Ca -0.10 0.11 -0.11 0.00 -0.55 0.00 0.00 56.30 55.65 3h7l h ASN 392 Cb 0.78 0.02 -0.01 0.00 0.05 0.00 0.00 38.32 39.16 3h7l h ASN 392 CO 0.17 0.18 -0.32 0.03 -1.65 0.00 0.00 177.43 175.84 3h7l h ARG 393 N 0.61 0.44 -0.09 0.81 3.08 -0.93 -2.28 114.38 116.02 3h7l h ARG 393 Ca 0.52 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 60.33 3h7l h ARG 393 Cb 0.82 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.86 3h7l h ARG 393 CO -0.41 0.72 -0.13 0.00 -1.07 0.00 0.00 179.97 179.08 3h7l h ALA 394 N 1.28 0.13 -0.21 0.04 0.00 -0.21 -1.70 119.26 118.60 3h7l h ALA 394 Ca 0.05 -0.33 0.05 0.00 0.00 0.00 0.00 54.91 54.68 3h7l h ALA 394 Cb 0.75 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.46 3h7l h ALA 394 CO 0.06 0.01 -0.18 0.00 0.00 0.00 0.00 179.25 179.14 3h7l h GLU 396 N -0.19 0.00 -0.42 0.00 5.08 -1.45 -2.07 114.58 115.53 3h7l h GLU 396 Ca 0.12 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.39 3h7l h GLU 396 Cb 0.38 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 3h7l h GLU 396 CO -0.32 0.17 -0.11 0.35 -1.00 0.00 0.00 179.01 178.09 3h7l h PHE 397 N 0.00 0.92 0.33 4.33 3.57 -0.60 -1.32 116.94 124.17 3h7l h PHE 397 Ca -0.00 -0.20 -0.02 0.00 3.53 0.00 0.00 57.97 61.28 3h7l h PHE 397 Cb 0.36 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.88 3h7l h PHE 397 CO 0.00 0.94 -0.16 0.93 -2.23 0.00 0.00 178.31 177.79 3h7l h GLU 398 N 0.64 -0.42 -0.36 1.11 4.39 -0.78 0.61 114.58 119.77 3h7l h GLU 398 Ca 0.11 0.03 0.08 0.00 0.34 0.00 0.00 59.36 59.91 3h7l h GLU 398 Cb 0.64 0.10 -0.08 0.00 -0.10 0.00 0.00 28.75 29.31 3h7l h GLU 398 CO 0.04 -0.24 -0.19 0.82 -1.16 0.00 0.00 179.01 178.28 3h7l h ILE 399 N -0.50 0.44 -0.29 3.13 2.04 -1.53 -1.56 117.51 119.24 3h7l h ILE 399 Ca -0.05 0.00 -0.16 0.00 1.00 0.00 0.00 64.86 65.65 3h7l h ILE 399 Cb 0.38 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 3h7l h ILE 399 CO 0.07 0.00 -0.46 0.11 0.00 0.00 0.00 178.15 177.87 3h7l h LYS 400 N -0.14 0.77 0.00 2.37 1.57 -1.09 -1.03 116.57 119.03 3h7l h LYS 400 Ca 0.18 -0.44 -0.05 0.00 -1.87 0.00 0.00 60.65 58.47 3h7l h LYS 400 Cb 0.41 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 3h7l h LYS 400 CO -0.44 1.07 -0.23 0.97 -0.57 0.00 0.00 179.45 180.24 3h7l h ILE 401 N 0.61 0.68 0.00 1.86 2.10 -0.78 -1.69 117.51 120.29 3h7l h ILE 401 Ca 0.03 -1.02 -0.01 0.00 1.08 0.00 0.00 64.86 64.95 3h7l h ILE 401 Cb 1.03 1.65 -0.00 0.00 -1.09 0.00 0.00 36.82 38.41 3h7l h ILE 401 CO 0.10 0.23 -0.27 0.28 -1.08 0.00 0.00 178.15 177.41 3h7l h SER 402 N 0.00 0.00 0.16 2.19 0.02 -0.92 -3.22 113.55 111.78 3h7l h SER 402 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3h7l h SER 402 Cb 0.63 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.17 3h7l h SER 402 CO 0.03 0.02 -0.32 0.59 -1.14 0.00 0.00 176.83 176.01 3h7l n ASN 403 N -3.00 1.32 0.17 3.07 5.03 -0.42 -4.55 115.26 116.88 3h7l n ASN 403 Ca 0.03 -1.08 0.02 0.00 0.87 0.00 0.00 54.58 54.42 3h7l n ASN 403 Cb 0.54 0.23 0.33 0.00 -1.02 0.00 0.00 39.78 39.87 3h7l n ASN 403 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 3h7l h LYS 404 N 1.57 0.04 0.00 3.52 3.64 -1.33 -3.44 116.57 120.56 3h7l h LYS 404 Ca 0.00 -0.01 -0.51 0.00 -1.27 0.00 0.00 60.65 58.86 3h7l h LYS 404 Cb 0.58 -0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 32.30 3h7l h LYS 404 CO 0.00 0.42 -0.39 1.33 -2.27 0.00 0.00 179.45 178.54 3h7l n VAL 405 N -4.07 0.00 -1.91 2.00 0.24 -1.26 -5.09 118.33 108.24 3h7l n VAL 405 Ca -0.02 -1.95 -0.42 0.00 -2.04 0.00 0.00 64.34 59.91 3h7l n VAL 405 Cb 0.43 0.50 -0.03 0.00 -1.47 0.00 0.00 33.84 33.27 3h7l n VAL 405 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3h7l s THR 406 N -2.60 3.29 -0.46 3.34 2.01 -1.26 -4.94 115.64 115.02 3h7l s THR 406 Ca 0.06 0.48 0.06 0.00 0.31 0.00 0.00 61.69 62.61 3h7l s THR 406 Cb 0.00 -3.31 0.20 0.00 0.01 0.00 0.00 72.50 69.41 3h7l s THR 406 CO 0.04 -0.03 0.60 -3.20 -0.69 0.00 0.00 174.62 171.34 3h7l n ASN 407 N 6.76 -1.75 -0.05 3.53 5.15 -1.26 -4.62 115.26 123.01 3h7l n ASN 407 Ca 0.17 -2.78 -0.02 0.00 -0.60 0.00 0.00 54.58 51.35 3h7l n ASN 407 Cb 0.42 0.60 0.23 0.00 -0.53 0.00 0.00 39.78 40.49 3h7l n ASN 407 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 3h7l h PRO 408 N 4.82 0.65 0.00 1.20 0.11 -1.95 -2.74 132.00 134.09 3h7l h PRO 408 Ca 0.09 -0.16 -0.07 0.00 0.11 0.00 0.00 66.00 65.97 3h7l h PRO 408 Cb 0.99 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 3h7l h PRO 408 CO 0.27 0.68 -0.34 0.74 -0.21 0.00 0.00 178.00 179.14 3h7l h PHE 409 N 0.61 0.00 -1.43 0.65 0.04 -1.96 -3.47 116.94 111.38 3h7l h PHE 409 Ca 0.12 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.71 3h7l h PHE 409 Cb 0.41 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.55 3h7l h PHE 409 CO 0.02 0.34 -0.24 0.41 -0.60 0.00 0.00 178.31 178.24 3h7l n GLY 410 N 0.24 0.02 3.70 -1.45 0.00 -1.04 -4.78 105.19 101.88 3h7l n GLY 410 Ca -0.00 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 45.11 3h7l n GLY 410 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3h7l s TYR 411 N -2.51 2.48 -0.02 1.61 5.04 -1.26 -4.50 117.35 118.19 3h7l s TYR 411 Ca 0.02 0.29 -0.30 0.00 -2.44 0.00 0.00 57.07 54.64 3h7l s TYR 411 Cb -0.01 -4.02 -0.07 0.00 0.35 0.00 0.00 41.96 38.22 3h7l s TYR 411 CO 0.02 -4.05 1.74 -1.25 -1.34 0.00 0.00 175.55 170.67 3h7l s PRO 412 N 2.35 4.17 0.56 4.97 0.04 -1.26 -4.87 135.00 140.95 3h7l s PRO 412 Ca 0.75 2.31 -0.00 0.00 0.04 0.00 0.00 61.00 64.10 3h7l s PRO 412 Cb -0.42 -4.02 0.03 0.00 0.04 0.00 0.00 34.50 30.13 3h7l s PRO 412 CO 0.33 -0.87 0.80 1.03 0.04 0.00 0.00 177.00 178.33 3h7l s ARG 413 N 4.09 2.57 0.12 4.56 0.52 -1.26 -4.86 118.95 124.68 3h7l s ARG 413 Ca 0.78 -0.66 -0.12 0.00 -0.52 0.00 0.00 55.73 55.21 3h7l s ARG 413 Cb -0.36 -2.45 0.01 0.00 0.52 0.00 0.00 34.95 32.67 3h7l s ARG 413 CO 0.33 -0.73 0.30 1.14 0.02 0.00 0.00 175.30 176.36 3h7l s GLN 414 N -4.81 1.01 -0.40 3.54 -2.07 0.62 -4.71 119.66 112.86 3h7l s GLN 414 Ca 0.56 -0.90 -0.15 0.00 -1.82 0.00 0.00 55.36 53.06 3h7l s GLN 414 Cb -0.10 0.41 0.01 0.00 -1.09 0.00 0.00 33.01 32.23 3h7l s GLN 414 CO 0.39 -0.37 0.30 -0.47 -1.32 0.00 0.00 175.29 173.82 3h7l s TYR 415 N -3.86 3.23 0.37 9.60 5.04 -1.26 -0.27 117.35 130.20 3h7l s TYR 415 Ca 0.06 -0.49 0.08 0.00 -2.44 0.00 0.00 57.07 54.29 3h7l s TYR 415 Cb 0.03 -2.59 -0.06 0.00 0.35 0.00 0.00 41.96 39.70 3h7l s TYR 415 CO -0.09 -0.55 0.04 0.14 -1.34 0.00 0.00 175.55 173.76 3h7l s VAL 416 N 1.72 2.42 -0.20 3.14 -7.23 0.44 -4.42 120.40 116.27 3h7l s VAL 416 Ca 0.06 -1.93 -0.12 0.00 -1.81 0.00 0.00 61.98 58.18 3h7l s VAL 416 Cb -0.19 -2.87 0.06 0.00 0.56 0.00 0.00 36.38 33.95 3h7l s VAL 416 CO 0.10 -0.12 0.49 -0.75 -0.31 0.00 0.00 175.10 174.51 3h7l s LYS 417 N -3.75 0.49 0.53 4.82 2.20 -1.26 -1.32 119.74 121.45 3h7l s LYS 417 Ca 0.36 0.90 -0.07 0.00 -0.36 0.00 0.00 55.97 56.81 3h7l s LYS 417 Cb 0.03 0.04 -0.03 0.00 -1.51 0.00 0.00 37.83 36.36 3h7l s LYS 417 CO 0.20 -0.15 0.86 0.20 -0.36 0.00 0.00 175.35 176.10 3h7l s GLY 418 N 1.40 1.55 0.10 5.54 0.00 -1.26 -4.87 107.32 109.78 3h7l s GLY 418 Ca -0.09 -0.46 -0.31 0.00 0.00 0.00 0.00 44.72 43.85 3h7l s GLY 418 CO -0.14 -0.25 1.60 0.54 0.00 0.00 0.00 173.10 174.85 3h7l s VAL 419 N -2.89 2.97 -1.35 1.40 0.11 -0.33 -2.75 120.40 117.56 3h7l s VAL 419 Ca 0.50 0.53 0.00 0.00 -2.93 0.00 0.00 61.98 60.08 3h7l s VAL 419 Cb -0.10 -3.34 0.00 0.00 -1.53 0.00 0.00 36.38 31.40 3h7l s VAL 419 CO 0.47 0.01 0.00 0.59 -3.33 0.00 0.00 175.10 172.84 3h7l n ASN 420 N 5.02 -4.50 -4.30 3.54 3.02 -1.26 -4.95 115.26 111.83 3h7l n ASN 420 Ca 0.15 0.25 -0.18 0.00 -0.03 0.00 0.00 54.58 54.76 3h7l n ASN 420 Cb 0.40 -3.31 -0.11 0.00 -0.61 0.00 0.00 39.78 36.16 3h7l n ASN 420 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3h7l s GLU 421 N -3.51 1.21 0.57 3.52 2.02 -1.11 -5.15 118.70 116.24 3h7l s GLU 421 Ca 0.00 -1.45 -0.12 0.00 0.02 0.00 0.00 54.97 53.43 3h7l s GLU 421 Cb 0.00 -1.04 -0.05 0.00 0.10 0.00 0.00 34.13 33.14 3h7l s GLU 421 CO 0.00 0.19 0.98 -1.54 0.02 0.00 0.00 175.26 174.90 3h7l s SER 422 N -2.95 6.34 0.50 -0.19 1.04 -1.26 -4.43 113.70 112.75 3h7l s SER 422 Ca 0.17 1.38 -0.23 0.00 0.48 0.00 0.00 55.95 57.75 3h7l s SER 422 Cb -0.02 -2.45 -0.07 0.00 0.10 0.00 0.00 66.02 63.58 3h7l s SER 422 CO 0.05 -0.75 1.27 0.29 0.98 0.00 0.00 173.24 175.08 3h7l n LYS 423 N -2.36 1.68 -3.73 4.02 5.02 -1.26 -4.58 118.16 116.94 3h7l n LYS 423 Ca 0.05 0.61 -0.14 0.00 -2.02 0.00 0.00 58.31 56.82 3h7l n LYS 423 Cb 0.54 -2.44 -0.08 0.00 -0.02 0.00 0.00 35.03 33.02 3h7l n LYS 423 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3h7l s ARG 424 N -2.59 0.69 0.38 1.97 1.70 -0.44 -5.02 118.95 115.64 3h7l s ARG 424 Ca 0.68 -0.07 -0.25 0.00 -0.47 0.00 0.00 55.73 55.63 3h7l s ARG 424 Cb -0.45 0.31 -0.09 0.00 -0.57 0.00 0.00 34.95 34.15 3h7l s ARG 424 CO 0.52 -0.19 1.03 0.16 -1.08 0.00 0.00 175.30 175.75 3h7l s ASP 425 N -1.15 6.90 0.16 -2.89 -4.77 -1.26 -0.42 116.67 113.24 3h7l s ASP 425 Ca -0.12 2.00 -0.14 0.00 -3.30 0.00 0.00 52.55 50.99 3h7l s ASP 425 Cb -0.04 -2.58 0.02 0.00 -1.09 0.00 0.00 42.92 39.22 3h7l s ASP 425 CO 0.04 -0.39 0.41 0.00 0.70 0.00 0.00 175.17 175.93 3h7l s ALA 426 N -1.65 -0.64 -0.05 2.11 0.00 0.63 -4.89 121.76 117.27 3h7l s ALA 426 Ca 0.56 -0.38 -0.26 0.00 0.00 0.00 0.00 51.96 51.88 3h7l s ALA 426 Cb -0.21 0.79 -0.21 0.00 0.00 0.00 0.00 23.12 23.49 3h7l s ALA 426 CO 0.27 -0.70 1.09 0.74 0.00 0.00 0.00 175.76 177.15 3h7l h PHE 427 N 2.37 -0.04 -2.09 0.00 0.04 -1.90 0.18 116.94 115.49 3h7l h PHE 427 Ca -0.31 -0.00 -0.55 0.00 2.80 0.00 0.00 57.97 59.91 3h7l h PHE 427 Cb 1.25 0.01 -0.08 0.00 2.20 0.00 0.00 35.95 39.33 3h7l h PHE 427 CO 0.36 0.54 -0.59 -0.06 -0.60 0.00 0.00 178.31 177.96 3h7l s PHE 428 N -3.67 2.76 0.66 -0.55 0.08 -1.26 -4.38 117.98 111.62 3h7l s PHE 428 Ca -0.16 -0.26 -0.17 0.00 0.12 0.00 0.00 56.93 56.46 3h7l s PHE 428 Cb 0.00 -1.38 -0.00 0.00 -0.57 0.00 0.00 43.02 41.07 3h7l s PHE 428 CO 0.64 0.51 1.25 0.14 -0.10 0.00 0.00 175.22 177.65 3h7l s VAL 429 N -2.33 2.26 0.22 -0.44 -7.23 -1.26 -4.94 120.40 106.67 3h7l s VAL 429 Ca 0.34 0.15 -0.30 0.00 -1.81 0.00 0.00 61.98 60.36 3h7l s VAL 429 Cb -0.05 -2.96 -0.08 0.00 0.56 0.00 0.00 36.38 33.84 3h7l s VAL 429 CO 0.22 -0.05 1.10 0.00 -0.31 0.00 0.00 175.10 176.06 3h7l s ALA 430 N -1.62 3.39 0.08 1.32 0.00 -1.26 -4.80 121.76 118.86 3h7l s ALA 430 Ca 0.79 0.85 -0.06 0.00 0.00 0.00 0.00 51.96 53.54 3h7l s ALA 430 Cb -0.33 -3.34 -0.27 0.00 0.00 0.00 0.00 23.12 19.18 3h7l s ALA 430 CO 0.40 -0.19 1.15 0.45 0.00 0.00 0.00 175.76 177.56 3h7l h HIS 431 N 4.63 0.57 -3.12 0.00 3.86 -1.94 -3.39 115.15 115.76 3h7l h HIS 431 Ca -0.45 -0.40 -0.76 0.00 -1.16 0.00 0.00 60.37 57.60 3h7l h HIS 431 Cb 1.21 -0.03 -0.23 0.00 1.06 0.00 0.00 27.41 29.42 3h7l h HIS 431 CO 0.61 1.30 0.61 1.21 0.86 0.00 0.00 177.93 182.52 3h7l s ASN 432 N -7.19 6.97 0.00 2.45 2.47 -1.26 -4.62 114.94 113.75 3h7l s ASN 432 Ca -0.05 -2.89 0.00 0.00 0.42 0.00 0.00 52.86 50.34 3h7l s ASN 432 Cb 0.07 -2.29 0.00 0.00 -1.45 0.00 0.00 41.25 37.58 3h7l s ASN 432 CO 0.89 -0.62 0.00 -0.46 -3.72 0.00 0.00 177.10 173.19 3h7l n ASN 433 N 4.47 1.96 0.00 -4.21 0.23 -1.26 -1.19 115.26 115.26 3h7l n ASN 433 Ca 0.24 -0.45 0.10 0.00 -0.53 0.00 0.00 54.58 53.93 3h7l n ASN 433 Cb 0.44 0.00 0.58 0.00 -2.08 0.00 0.00 39.78 38.72 3h7l n ASN 433 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3h7l n GLU 434 N 0.00 0.62 -0.02 -3.83 4.71 -1.26 -2.66 120.64 118.21 3h7l n GLU 434 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.16 56.96 3h7l n GLU 434 Cb 0.00 -1.49 -0.14 0.00 -1.01 0.00 0.00 31.44 28.80 3h7l n GLU 434 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 3h7l n SER 435 N -0.99 1.90 0.00 1.62 3.41 -1.26 -4.41 113.62 113.89 3h7l n SER 435 Ca 0.15 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 3h7l n SER 435 Cb 0.07 -0.67 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 3h7l n SER 435 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h7l n GLY 436 N 1.96 0.72 0.00 5.00 0.00 -1.09 -4.73 105.19 107.06 3h7l n GLY 436 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.70 3h7l n GLY 436 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 3h7l n TYR 437 N -2.52 0.00 -2.91 1.61 0.18 -1.26 -4.99 117.16 107.27 3h7l n TYR 437 Ca 0.00 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.36 3h7l n TYR 437 Cb 0.00 0.00 -0.05 0.00 -0.38 0.00 0.00 39.34 38.91 3h7l n TYR 437 CO 0.00 0.00 0.00 -0.46 -2.08 0.00 0.00 176.86 174.32 3h7l s TRP 438 N -0.90 3.23 -0.09 -3.48 -0.00 -1.26 -5.00 118.94 111.44 3h7l s TRP 438 Ca 0.00 0.93 -0.30 0.00 -0.00 0.00 0.00 56.10 56.73 3h7l s TRP 438 Cb 0.00 -3.19 0.08 0.00 -0.00 0.00 0.00 33.47 30.37 3h7l s TRP 438 CO 0.00 -0.52 0.76 1.67 -0.00 0.00 0.00 176.95 178.85 3h7l s TRP 439 N 2.95 -0.60 0.36 5.86 1.48 -1.26 -4.86 118.94 122.87 3h7l s TRP 439 Ca 0.34 1.05 -0.17 0.00 -1.06 0.00 0.00 56.10 56.26 3h7l s TRP 439 Cb -0.14 0.41 0.05 0.00 -1.16 0.00 0.00 33.47 32.63 3h7l s TRP 439 CO 0.11 -0.54 0.78 1.14 -4.06 0.00 0.00 176.95 174.38 3h7l s GLN 440 N -1.09 2.13 0.71 3.25 -2.07 -1.26 -4.83 119.66 116.49 3h7l s GLN 440 Ca -0.08 -1.33 -0.16 0.00 -1.82 0.00 0.00 55.36 51.96 3h7l s GLN 440 Cb -0.00 0.62 -0.03 0.00 -1.09 0.00 0.00 33.01 32.51 3h7l s GLN 440 CO 0.08 -0.99 0.63 0.41 -1.32 0.00 0.00 175.29 174.10 3h7l n GLY 441 N -0.52 -1.27 1.42 2.60 0.00 -0.58 -4.83 105.19 102.01 3h7l n GLY 441 Ca -0.07 -0.35 -0.11 0.00 0.00 0.00 0.00 46.02 45.48 3h7l n GLY 441 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h7l n GLU 442 N -0.94 2.66 -0.02 1.61 1.02 -1.04 -4.54 120.64 119.39 3h7l n GLU 442 Ca 0.11 -3.73 0.02 0.00 -0.02 0.00 0.00 57.16 53.54 3h7l n GLU 442 Cb 0.50 -1.99 0.37 0.00 -0.02 0.00 0.00 31.44 30.30 3h7l n GLU 442 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 3h7l h ASN 443 N 1.62 0.51 -0.38 1.62 2.35 -1.54 -1.86 115.58 117.90 3h7l h ASN 443 Ca 0.22 -0.04 -0.05 0.00 -0.55 0.00 0.00 56.30 55.89 3h7l h ASN 443 Cb 1.32 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 39.54 3h7l h ASN 443 CO 0.47 0.43 0.05 0.00 -1.65 0.00 0.00 177.43 176.73 3h7l h ALA 444 N 1.65 0.51 -0.39 -0.83 0.00 -1.82 -1.43 119.26 116.95 3h7l h ALA 444 Ca 0.15 -0.22 0.08 0.00 0.00 0.00 0.00 54.91 54.92 3h7l h ALA 444 Cb 0.04 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 17.62 3h7l h ALA 444 CO -0.02 0.24 -0.06 -0.09 0.00 0.00 0.00 179.25 179.31 3h7l h ARG 445 N 0.49 0.04 -0.65 0.00 2.43 -1.30 0.11 114.38 115.49 3h7l h ARG 445 Ca 0.11 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.24 3h7l h ARG 445 Cb 0.39 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.90 3h7l h ARG 445 CO 0.01 0.02 0.22 -0.07 -1.51 0.00 0.00 179.97 178.65 3h7l h LEU 446 N 0.04 0.89 -0.69 3.80 4.07 -1.28 0.47 115.31 122.61 3h7l h LEU 446 Ca 0.19 -0.14 -0.03 0.00 0.08 0.00 0.00 57.88 57.98 3h7l h LEU 446 Cb 0.29 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 41.76 3h7l h LEU 446 CO -0.37 0.82 0.30 1.23 -1.08 0.00 0.00 178.44 179.34 3h7l h GLY 447 N 1.04 1.09 1.35 0.83 0.00 -0.54 -1.16 103.07 105.69 3h7l h GLY 447 Ca 0.21 -0.57 -0.13 0.00 0.00 0.00 0.00 47.33 46.84 3h7l h GLY 447 CO -0.01 0.54 -0.32 1.48 0.00 0.00 0.00 176.54 178.23 3h7l h SER 448 N 0.97 0.75 -0.16 0.19 4.64 -0.16 -1.59 113.55 118.20 3h7l h SER 448 Ca 0.23 -0.31 -0.17 0.00 -0.47 0.00 0.00 61.79 61.08 3h7l h SER 448 Cb 0.18 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 3h7l h SER 448 CO -0.02 1.01 -0.51 -0.07 -0.87 0.00 0.00 176.83 176.37 3h7l h LEU 449 N 0.61 0.82 -0.48 5.97 3.38 -0.83 0.16 115.31 124.94 3h7l h LEU 449 Ca 0.07 -0.42 -0.02 0.00 0.09 0.00 0.00 57.88 57.60 3h7l h LEU 449 Cb 0.84 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 3h7l h LEU 449 CO 0.07 1.18 0.23 0.00 0.09 0.00 0.00 178.44 180.01 3h7l h ALA 450 N 0.84 0.63 0.28 1.53 0.00 -1.20 -0.20 119.26 121.14 3h7l h ALA 450 Ca 0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3h7l h ALA 450 Cb 1.09 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 3h7l h ALA 450 CO 0.11 0.20 -0.17 1.15 0.00 0.00 0.00 179.25 180.54 3h7l h THR 451 N 0.64 0.65 -0.49 0.00 2.02 -1.07 -1.76 112.91 112.88 3h7l h THR 451 Ca 0.17 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.41 3h7l h THR 451 Cb 0.13 0.65 -0.09 0.00 -1.74 0.00 0.00 68.15 67.10 3h7l h THR 451 CO -0.02 0.00 -0.50 -0.03 0.37 0.00 0.00 175.52 175.34 3h7l h MET 452 N -0.43 -0.30 -0.49 6.66 -1.53 -0.57 0.83 114.93 119.10 3h7l h MET 452 Ca -0.03 0.02 0.10 0.00 -3.44 0.00 0.00 59.70 56.35 3h7l h MET 452 Cb 0.35 0.07 -0.03 0.00 -0.55 0.00 0.00 31.60 31.45 3h7l h MET 452 CO 0.03 -0.20 0.34 0.00 0.14 0.00 0.00 176.91 177.22 3h7l h ALA 453 N 0.29 2.17 0.16 0.39 0.00 -0.82 0.81 119.26 122.25 3h7l h ALA 453 Ca 0.12 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.72 3h7l h ALA 453 Cb 0.58 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.34 3h7l h ALA 453 CO -0.64 -0.29 -1.42 1.88 0.00 0.00 0.00 179.25 178.78 3h7l h TYR 454 N 0.22 0.60 0.00 0.00 0.05 -0.33 -3.35 116.97 114.15 3h7l h TYR 454 Ca 0.23 -0.44 0.00 0.00 0.05 0.00 0.00 58.73 58.58 3h7l h TYR 454 Cb 0.62 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.34 3h7l h TYR 454 CO -0.00 1.40 -0.67 -0.07 -1.05 0.00 0.00 178.16 177.77 3h7l h LEU 455 N 0.09 0.00 0.00 3.88 3.38 0.07 -3.23 115.31 119.50 3h7l h LEU 455 Ca -0.21 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3h7l h LEU 455 Cb 2.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.79 3h7l h LEU 455 CO 0.20 0.03 -0.26 0.00 0.09 0.00 0.00 178.44 178.51 3h7l n ALA 456 N -2.04 2.61 -0.25 1.53 0.00 0.19 -4.36 120.51 118.19 3h7l n ALA 456 Ca 0.02 -0.14 0.05 0.00 0.00 0.00 0.00 53.44 53.38 3h7l n ALA 456 Cb 0.51 -1.34 0.30 0.00 0.00 0.00 0.00 19.45 18.91 3h7l n ALA 456 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3h7l h GLN 457 N 0.00 0.87 0.00 0.00 4.20 -1.68 -0.94 115.11 117.56 3h7l h GLN 457 Ca 0.00 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.62 3h7l h GLN 457 Cb 0.70 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 3h7l h GLN 457 CO 0.00 0.57 -0.18 -1.35 -0.67 0.00 0.00 178.83 177.20 3h7l h PRO 458 N 0.89 0.00 -0.45 1.46 0.11 -1.83 -3.02 132.00 129.16 3h7l h PRO 458 Ca 0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.47 3h7l h PRO 458 Cb 0.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.36 3h7l h PRO 458 CO -0.13 0.18 0.00 0.72 -0.21 0.00 0.00 178.00 178.56 3h7l n HIS 459 N -3.88 0.60 -3.82 0.65 8.25 -0.38 -4.85 115.22 111.79 3h7l n HIS 459 Ca -0.02 -0.30 -0.35 0.00 -0.26 0.00 0.00 57.72 56.79 3h7l n HIS 459 Cb 0.27 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.30 3h7l n HIS 459 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3h7l s ILE 460 N -1.40 5.27 -0.04 1.59 -1.09 -1.10 -4.76 121.20 119.66 3h7l s ILE 460 Ca 0.33 0.14 -0.14 0.00 -2.23 0.00 0.00 60.65 58.75 3h7l s ILE 460 Cb 0.17 -3.38 -0.08 0.00 -1.58 0.00 0.00 42.46 37.59 3h7l s ILE 460 CO 0.23 0.47 0.58 0.00 -1.23 0.00 0.00 174.94 174.99 3h7l h ALA 461 N 6.44 -0.46 -2.63 9.38 0.00 -1.88 -3.46 119.26 126.65 3h7l h ALA 461 Ca -0.42 -0.12 -0.53 0.00 0.00 0.00 0.00 54.91 53.85 3h7l h ALA 461 Cb 1.16 0.18 0.03 0.00 0.00 0.00 0.00 17.79 19.16 3h7l h ALA 461 CO 0.72 -0.43 0.64 0.45 0.00 0.00 0.00 179.25 180.63 3h7l s SER 462 N -5.04 6.93 0.30 0.00 0.15 -1.26 -4.93 113.70 109.85 3h7l s SER 462 Ca -0.07 2.32 0.12 0.00 0.70 0.00 0.00 55.95 59.02 3h7l s SER 462 Cb 0.01 -2.60 0.46 0.00 -1.71 0.00 0.00 66.02 62.18 3h7l s SER 462 CO 0.23 -0.52 1.66 -0.61 1.20 0.00 0.00 173.24 175.20 3h7l h GLN 463 N 5.75 0.00 -0.34 5.44 4.15 -2.00 -2.76 115.11 125.35 3h7l h GLN 463 Ca -0.44 0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.05 3h7l h GLN 463 Cb 1.21 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 28.84 3h7l h GLN 463 CO 0.79 0.54 -0.10 1.49 -1.93 0.00 0.00 178.83 179.62 3h7l h GLU 464 N 0.00 -0.03 -0.01 1.69 4.57 -2.00 -2.69 114.58 116.11 3h7l h GLU 464 Ca -0.01 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 57.99 3h7l h GLU 464 Cb 1.01 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.59 3h7l h GLU 464 CO 0.07 -0.02 -0.83 0.82 -1.18 0.00 0.00 179.01 177.87 3h7l h ILE 465 N -0.03 1.48 -0.16 2.32 2.04 -1.94 -2.95 117.51 118.28 3h7l h ILE 465 Ca 0.17 -2.53 0.04 0.00 1.00 0.00 0.00 64.86 63.54 3h7l h ILE 465 Cb 0.28 2.39 -0.04 0.00 -0.74 0.00 0.00 36.82 38.72 3h7l h ILE 465 CO -0.37 0.74 -0.10 1.56 0.00 0.00 0.00 178.15 179.98 3h7l h GLN 466 N 0.11 -0.09 0.00 2.37 4.20 -1.40 -1.84 115.11 118.46 3h7l h GLN 466 Ca -0.04 0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 3h7l h GLN 466 Cb 1.44 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 29.23 3h7l h GLN 466 CO 0.13 -0.06 -0.09 1.96 -0.67 0.00 0.00 178.83 180.10 3h7l h GLN 467 N -0.09 0.00 -0.14 1.46 4.20 -1.45 -1.22 115.11 117.87 3h7l h GLN 467 Ca 0.09 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.67 3h7l h GLN 467 Cb 0.23 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 3h7l h GLN 467 CO -0.22 0.09 -0.50 1.96 -0.67 0.00 0.00 178.83 179.48 3h7l h GLN 468 N 0.00 0.37 -0.19 1.46 4.20 -1.29 -2.65 115.11 117.01 3h7l h GLN 468 Ca -0.00 -0.21 -0.19 0.00 0.06 0.00 0.00 58.65 58.31 3h7l h GLN 468 Cb 0.62 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.42 3h7l h GLN 468 CO 0.01 0.79 -0.63 -0.07 -0.67 0.00 0.00 178.83 178.26 3h7l h LEU 469 N 0.29 0.79 -1.01 1.46 3.38 -0.43 0.13 115.31 119.91 3h7l h LEU 469 Ca 0.01 -0.46 0.04 0.00 0.09 0.00 0.00 57.88 57.57 3h7l h LEU 469 Cb 0.99 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.45 3h7l h LEU 469 CO 0.09 1.22 0.66 0.28 0.09 0.00 0.00 178.44 180.78 3h7l h SER 470 N 0.51 1.09 -0.12 -0.43 0.02 -1.27 -0.62 113.55 112.72 3h7l h SER 470 Ca -0.01 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.91 3h7l h SER 470 Cb 1.22 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 63.51 3h7l h SER 470 CO 0.13 0.74 -0.02 0.58 -1.14 0.00 0.00 176.83 177.11 3h7l h VAL 471 N 1.26 1.28 -0.43 2.27 2.07 -1.32 -2.77 116.25 118.60 3h7l h VAL 471 Ca 0.41 -0.94 0.08 0.00 0.82 0.00 0.00 66.70 67.07 3h7l h VAL 471 Cb 0.03 1.66 -0.07 0.00 -1.52 0.00 0.00 31.29 31.39 3h7l h VAL 471 CO -0.13 0.27 -0.03 0.15 0.02 0.00 0.00 177.57 177.85 3h7l h PHE 472 N -0.07 -0.08 0.09 1.57 3.57 -0.59 -0.56 116.94 120.87 3h7l h PHE 472 Ca 0.03 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 3h7l h PHE 472 Cb 0.43 0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.27 3h7l h PHE 472 CO 0.05 -0.12 -0.05 0.00 -2.23 0.00 0.00 178.31 175.97 3h7l h ALA 473 N 1.39 -0.13 -0.75 2.41 0.00 -1.20 -2.67 119.26 118.32 3h7l h ALA 473 Ca 0.21 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 55.03 3h7l h ALA 473 Cb 0.32 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 3h7l h ALA 473 CO -0.38 -0.41 0.42 0.37 0.00 0.00 0.00 179.25 179.25 3h7l h GLN 474 N -0.45 0.72 -0.89 0.00 5.75 -1.38 -1.12 115.11 117.75 3h7l h GLN 474 Ca -0.01 -0.04 0.15 0.00 -0.15 0.00 0.00 58.65 58.60 3h7l h GLN 474 Cb 0.38 -0.16 -0.10 0.00 1.07 0.00 0.00 27.48 28.67 3h7l h GLN 474 CO 0.02 0.48 0.48 -0.44 -2.65 0.00 0.00 178.83 176.72 3h7l h ASP 475 N 0.75 0.60 -0.24 -0.69 3.32 -1.02 0.27 116.42 119.40 3h7l h ASP 475 Ca 0.35 0.09 -0.13 0.00 0.02 0.00 0.00 57.03 57.36 3h7l h ASP 475 Cb 0.27 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 3h7l h ASP 475 CO -0.22 0.24 -0.37 0.00 -1.72 0.00 0.00 179.24 177.18 3h7l h ALA 476 N 1.58 0.36 -0.09 3.45 0.00 -0.95 -2.58 119.26 121.03 3h7l h ALA 476 Ca 0.49 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3h7l h ALA 476 Cb 0.70 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 3h7l h ALA 476 CO -0.36 0.44 0.02 -0.07 0.00 0.00 0.00 179.25 179.27 3h7l h LEU 477 N 0.38 0.14 -0.72 0.00 3.38 -0.80 -2.95 115.31 114.74 3h7l h LEU 477 Ca 0.02 -0.25 0.16 0.00 0.09 0.00 0.00 57.88 57.90 3h7l h LEU 477 Cb 0.96 -0.04 -0.12 0.00 0.09 0.00 0.00 40.66 41.56 3h7l h LEU 477 CO 0.08 0.36 0.06 0.78 0.09 0.00 0.00 178.44 179.81 3h7l h ASN 478 N -0.09 -0.21 -0.30 -0.43 2.35 -0.52 -1.98 115.58 114.40 3h7l h ASN 478 Ca 0.03 0.17 0.03 0.00 -0.55 0.00 0.00 56.30 55.98 3h7l h ASN 478 Cb 0.28 0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.89 3h7l h ASN 478 CO 0.00 -0.12 0.10 -0.25 -1.65 0.00 0.00 177.43 175.51 3h7l h TRP 479 N 0.16 0.18 -0.96 1.19 2.91 -1.40 0.53 115.95 118.55 3h7l h TRP 479 Ca 0.39 0.02 -0.00 0.00 1.13 0.00 0.00 58.89 60.43 3h7l h TRP 479 Cb 0.68 -0.04 -0.05 0.00 -0.51 0.00 0.00 29.16 29.25 3h7l h TRP 479 CO -0.35 0.08 0.60 0.82 -1.03 0.00 0.00 178.44 178.55 3h7l h ILE 480 N 0.23 1.26 -0.99 2.65 2.04 -1.21 -3.16 117.51 118.33 3h7l h ILE 480 Ca 0.13 -0.54 -0.64 0.00 1.00 0.00 0.00 64.86 64.82 3h7l h ILE 480 Cb 0.10 -0.12 -0.34 0.00 -0.74 0.00 0.00 36.82 35.73 3h7l h ILE 480 CO -0.14 0.27 0.29 1.33 0.00 0.00 0.00 178.15 179.90 3h7l n VAL 481 N -4.37 3.24 0.00 1.67 0.24 -0.81 -0.65 118.33 117.65 3h7l n VAL 481 Ca 0.11 -3.48 0.00 0.00 -2.04 0.00 0.00 64.34 58.93 3h7l n VAL 481 Cb 0.04 -1.16 0.00 0.00 -1.47 0.00 0.00 33.84 31.25 3h7l n VAL 481 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h7l n GLY 482 N -0.82 1.06 3.58 7.63 0.00 -1.07 -1.02 105.19 114.55 3h7l n GLY 482 Ca 0.56 -0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.97 3h7l n GLY 482 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h7l s LEU 483 N 0.00 3.67 0.18 0.99 2.96 0.15 -3.57 118.68 123.06 3h7l s LEU 483 Ca 0.00 -2.10 -0.20 0.00 -0.22 0.00 0.00 54.13 51.61 3h7l s LEU 483 Cb 0.00 -2.58 0.05 0.00 0.50 0.00 0.00 46.19 44.16 3h7l s LEU 483 CO 0.00 -1.48 0.56 0.54 -1.32 0.00 0.00 176.35 174.65 3h7l s ASN 484 N 4.73 -0.40 0.00 3.68 2.20 -1.26 -3.52 114.94 120.37 3h7l s ASN 484 Ca 0.54 -0.25 0.00 0.00 -0.94 0.00 0.00 52.86 52.22 3h7l s ASN 484 Cb 0.02 0.59 0.00 0.00 -2.00 0.00 0.00 41.25 39.86 3h7l s ASN 484 CO 0.04 -1.01 0.79 -2.65 -2.94 0.00 0.00 177.10 171.33 3h7l n PRO 485 N -0.35 0.00 0.00 3.55 -0.02 -1.26 -1.35 135.00 135.57 3h7l n PRO 485 Ca -0.14 0.31 0.06 0.00 -2.02 0.00 0.00 63.50 61.71 3h7l n PRO 485 Cb 0.63 -1.64 0.03 0.00 -0.02 0.00 0.00 33.50 32.50 3h7l n PRO 485 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3h7l n TYR 486 N -1.29 0.00 -3.90 6.00 4.01 -1.26 -5.00 117.16 115.72 3h7l n TYR 486 Ca 0.00 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.46 3h7l n TYR 486 Cb 0.14 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.19 3h7l n TYR 486 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3h7l n ASP 487 N 0.24 -3.38 -3.94 7.72 2.03 -0.46 -4.95 116.55 113.81 3h7l n ASP 487 Ca 0.06 -0.83 -0.29 0.00 0.52 0.00 0.00 54.79 54.25 3h7l n ASP 487 Cb 0.29 -3.73 -0.17 0.00 -0.72 0.00 0.00 41.12 36.80 3h7l n ASP 487 CO 0.00 0.00 0.00 -0.32 -1.92 0.00 0.00 177.20 174.96 3h7l s MET 488 N -6.50 1.77 -0.04 -0.67 1.75 -1.23 -4.55 119.30 109.83 3h7l s MET 488 Ca 0.46 -0.50 -0.30 0.00 -1.25 0.00 0.00 55.69 54.10 3h7l s MET 488 Cb -0.23 -1.97 -0.03 0.00 2.84 0.00 0.00 34.83 35.43 3h7l s MET 488 CO 0.84 -0.33 1.15 0.00 -0.65 0.00 0.00 175.02 176.03 3h7l n MET 490 N 4.81 0.72 -2.73 0.00 2.81 0.18 -4.13 117.12 118.79 3h7l n MET 490 Ca 0.10 -0.54 -0.43 0.00 -1.81 0.00 0.00 57.70 55.02 3h7l n MET 490 Cb 0.47 -1.49 -0.03 0.00 -0.71 0.00 0.00 33.22 31.46 3h7l n MET 490 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 3h7l s LEU 491 N -2.66 3.90 0.11 4.03 2.96 -1.25 -2.97 118.68 122.80 3h7l s LEU 491 Ca 0.17 0.58 -0.31 0.00 -0.22 0.00 0.00 54.13 54.35 3h7l s LEU 491 Cb 0.18 -3.37 -0.08 0.00 0.50 0.00 0.00 46.19 43.42 3h7l s LEU 491 CO 0.64 -0.98 1.37 -0.62 -1.32 0.00 0.00 176.35 175.44 3h7l s ASP 492 N 2.02 6.86 0.00 3.68 2.15 0.00 -2.73 116.67 128.65 3h7l s ASP 492 Ca 0.42 2.28 0.00 0.00 0.43 0.00 0.00 52.55 55.68 3h7l s ASP 492 Cb -0.11 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.93 3h7l s ASP 492 CO 0.22 -0.63 0.00 0.61 -0.17 0.00 0.00 175.17 175.20 3h7l n GLY 493 N 3.46 0.56 3.15 2.66 0.00 -1.26 0.04 105.19 113.81 3h7l n GLY 493 Ca 0.11 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.98 3h7l n GLY 493 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3h7l s HIS 494 N -2.27 1.02 0.00 1.61 3.76 -1.10 -5.00 115.29 113.31 3h7l s HIS 494 Ca 0.00 -0.59 0.00 0.00 -0.15 0.00 0.00 55.06 54.32 3h7l s HIS 494 Cb 0.00 -0.57 0.00 0.00 1.11 0.00 0.00 32.58 33.12 3h7l s HIS 494 CO 0.00 -0.01 0.00 0.41 -0.85 0.00 0.00 174.74 174.29 3h7l n GLY 495 N 0.86 2.39 3.35 -2.22 0.00 -1.26 -4.76 105.19 103.54 3h7l n GLY 495 Ca -0.18 -0.29 -0.11 0.00 0.00 0.00 0.00 46.02 45.43 3h7l n GLY 495 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3h7l s ARG 496 N 0.00 1.36 -1.46 1.61 1.70 -1.26 -4.85 118.95 116.05 3h7l s ARG 496 Ca 0.00 -1.52 -0.07 0.00 -0.47 0.00 0.00 55.73 53.67 3h7l s ARG 496 Cb 0.00 0.35 0.03 0.00 -0.57 0.00 0.00 34.95 34.76 3h7l s ARG 496 CO 0.00 -0.50 0.64 0.09 -1.08 0.00 0.00 175.30 174.45 3h7l n ASN 497 N -0.40 -5.38 -4.67 -2.89 3.02 -1.26 -1.33 115.26 102.36 3h7l n ASN 497 Ca 0.01 -0.37 -0.50 0.00 -0.03 0.00 0.00 54.58 53.69 3h7l n ASN 497 Cb 0.64 -4.35 -0.05 0.00 -0.61 0.00 0.00 39.78 35.41 3h7l n ASN 497 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3h7l n ASN 498 N -2.51 2.92 -4.78 6.41 3.02 -1.26 -4.56 115.26 114.50 3h7l n ASN 498 Ca -0.07 1.04 -0.37 0.00 -0.03 0.00 0.00 54.58 55.16 3h7l n ASN 498 Cb 0.59 -1.32 -0.06 0.00 -0.61 0.00 0.00 39.78 38.38 3h7l n ASN 498 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3h7l s PRO 499 N 2.75 4.52 0.40 3.52 0.04 -1.26 -5.08 135.00 139.88 3h7l s PRO 499 Ca 0.89 1.34 0.08 0.00 0.04 0.00 0.00 61.00 63.35 3h7l s PRO 499 Cb -0.80 -2.74 0.01 0.00 0.04 0.00 0.00 34.50 31.01 3h7l s PRO 499 CO 0.50 0.21 0.55 0.34 0.04 0.00 0.00 177.00 178.65 3h7l s ASP 500 N -1.64 5.73 0.00 6.66 -1.08 -1.26 -4.87 116.67 120.21 3h7l s ASP 500 Ca 0.52 -0.36 0.00 0.00 -0.52 0.00 0.00 52.55 52.19 3h7l s ASP 500 Cb -0.18 -0.80 0.00 0.00 -1.46 0.00 0.00 42.92 40.48 3h7l s ASP 500 CO 0.24 -0.69 0.00 0.00 0.52 0.00 0.00 175.17 175.24 3h7l n TYR 501 N -1.81 0.00 -3.31 -5.34 9.36 -1.26 -4.76 117.16 110.04 3h7l n TYR 501 Ca 0.06 0.00 -0.25 0.00 3.32 0.00 0.00 57.90 61.03 3h7l n TYR 501 Cb 0.59 0.00 -0.08 0.00 -0.63 0.00 0.00 39.34 39.22 3h7l n TYR 501 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 3h7l n LEU 502 N 0.00 1.36 0.26 2.98 4.77 -0.27 -4.97 117.00 121.13 3h7l n LEU 502 Ca 0.00 -4.92 0.10 0.00 -0.03 0.00 0.00 56.01 51.16 3h7l n LEU 502 Cb 0.00 0.16 0.69 0.00 -2.33 0.00 0.00 43.42 41.94 3h7l n LEU 502 CO 0.00 2.03 1.04 1.55 -1.33 0.00 0.00 177.39 180.68 3h7l h PRO 503 N 4.26 0.00 0.00 3.23 0.13 -1.92 -1.08 132.00 136.63 3h7l h PRO 503 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3h7l h PRO 503 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 3h7l h PRO 503 CO 0.58 0.05 0.00 -0.56 -0.23 0.00 0.00 178.00 177.85 3h7l h GLN 504 N 0.00 0.00 -0.17 0.86 -0.00 -1.93 -1.45 115.11 112.42 3h7l h GLN 504 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 3h7l h GLN 504 Cb 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.59 3h7l h GLN 504 CO 0.01 0.00 0.00 0.66 -0.00 0.00 0.00 178.83 179.50 3h7l n TYR 505 N -2.47 0.30 -1.44 0.06 4.01 -0.85 -4.98 117.16 111.79 3h7l n TYR 505 Ca 0.01 -0.60 -0.04 0.00 -0.16 0.00 0.00 57.90 57.11 3h7l n TYR 505 Cb 0.20 -0.08 -0.01 0.00 -0.31 0.00 0.00 39.34 39.13 3h7l n TYR 505 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3h7l n GLY 506 N -0.19 0.52 3.23 2.72 0.00 -0.55 -4.98 105.19 105.94 3h7l n GLY 506 Ca 0.09 -0.84 -0.43 0.00 0.00 0.00 0.00 46.02 44.84 3h7l n GLY 506 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h7l s PHE 507 N -2.16 3.62 0.00 1.61 0.08 -0.47 -4.97 117.98 115.69 3h7l s PHE 507 Ca 0.00 -2.28 -0.05 0.00 0.12 0.00 0.00 56.93 54.71 3h7l s PHE 507 Cb 0.00 -3.57 -0.05 0.00 -0.57 0.00 0.00 43.02 38.84 3h7l s PHE 507 CO 0.00 -0.93 0.24 -0.06 -0.10 0.00 0.00 175.22 174.37 3h7l s PHE 508 N 0.07 3.57 0.42 0.36 0.08 -1.26 -1.12 117.98 120.09 3h7l s PHE 508 Ca 0.17 0.51 -0.24 0.00 0.12 0.00 0.00 56.93 57.49 3h7l s PHE 508 Cb -0.14 -1.94 -0.08 0.00 -0.57 0.00 0.00 43.02 40.28 3h7l s PHE 508 CO -0.07 0.62 1.09 -0.80 -0.10 0.00 0.00 175.22 175.97 3h7l s ASN 509 N -1.78 6.57 -0.11 1.36 0.01 -1.26 -4.85 114.94 114.88 3h7l s ASN 509 Ca 0.28 2.14 -0.05 0.00 -0.71 0.00 0.00 52.86 54.52 3h7l s ASN 509 Cb -0.13 -2.59 -0.04 0.00 0.41 0.00 0.00 41.25 38.90 3h7l s ASN 509 CO 0.17 -0.63 0.06 0.00 -1.51 0.00 0.00 177.10 175.20 3h7l s ALA 510 N -1.60 3.54 0.20 0.60 0.00 -1.26 -5.01 121.76 118.22 3h7l s ALA 510 Ca 0.59 -0.73 -0.31 0.00 0.00 0.00 0.00 51.96 51.51 3h7l s ALA 510 Cb -0.25 -1.73 -0.16 0.00 0.00 0.00 0.00 23.12 20.99 3h7l s ALA 510 CO 0.31 0.55 1.05 1.63 0.00 0.00 0.00 175.76 179.29 3h7l n LYS 511 N 2.26 1.04 -0.24 0.00 4.76 -1.26 -1.63 118.16 123.10 3h7l n LYS 511 Ca -0.19 0.37 0.00 0.00 -2.87 0.00 0.00 58.31 55.62 3h7l n LYS 511 Cb 0.54 -1.78 0.00 0.00 -1.84 0.00 0.00 35.03 31.95 3h7l n LYS 511 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3h7l n GLY 512 N 1.78 1.47 3.94 0.72 0.00 0.11 -4.19 105.19 109.02 3h7l n GLY 512 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 3h7l n GLY 512 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h7l s GLY 513 N -1.86 1.69 -0.16 -0.02 0.00 -0.64 -4.03 107.32 102.30 3h7l s GLY 513 Ca 0.00 -1.00 -0.02 0.00 0.00 0.00 0.00 44.72 43.70 3h7l s GLY 513 CO 0.00 -0.99 -0.08 0.14 0.00 0.00 0.00 173.10 172.17 3h7l s VAL 514 N -1.79 3.34 1.00 1.40 1.01 -1.26 -0.82 120.40 123.28 3h7l s VAL 514 Ca 0.35 -0.54 -0.17 0.00 0.00 0.00 0.00 61.98 61.63 3h7l s VAL 514 Cb -0.11 -2.45 0.22 0.00 0.00 0.00 0.00 36.38 34.04 3h7l s VAL 514 CO 0.29 0.49 1.32 0.00 0.00 0.00 0.00 175.10 177.19 3h7l h ASN 516 N -1.78 -0.83 0.00 0.00 2.35 -0.83 -3.42 115.58 111.07 3h7l h ASN 516 Ca -0.44 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.35 3h7l h ASN 516 Cb 1.23 0.23 0.00 0.00 0.05 0.00 0.00 38.32 39.83 3h7l h ASN 516 CO 0.35 -0.54 0.00 0.61 -1.65 0.00 0.00 177.43 176.20 3h7l n GLY 517 N -1.44 0.23 3.79 2.83 0.00 -0.72 -1.58 105.19 108.30 3h7l n GLY 517 Ca -0.11 -2.11 -0.39 0.00 0.00 0.00 0.00 46.02 43.42 3h7l n GLY 517 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h7l s ILE 518 N 0.00 4.85 0.53 -0.61 1.01 -1.26 -3.96 121.20 121.76 3h7l s ILE 518 Ca 0.00 1.18 0.01 0.00 0.00 0.00 0.00 60.65 61.83 3h7l s ILE 518 Cb 0.00 -3.89 0.01 0.00 0.01 0.00 0.00 42.46 38.59 3h7l s ILE 518 CO 0.00 0.50 0.07 0.42 0.00 0.00 0.00 174.94 175.93 3h7l s THR 519 N -0.72 1.10 0.64 2.92 -4.23 -0.85 -4.03 115.64 110.47 3h7l s THR 519 Ca 0.29 -1.92 -0.16 0.00 -1.18 0.00 0.00 61.69 58.72 3h7l s THR 519 Cb -0.19 -2.02 -0.01 0.00 1.34 0.00 0.00 72.50 71.62 3h7l s THR 519 CO 0.17 0.00 1.12 -0.83 -0.54 0.00 0.00 174.62 174.54 3h7l s GLY 520 N -3.97 2.26 0.72 3.99 0.00 -1.26 -1.92 107.32 107.14 3h7l s GLY 520 Ca 0.06 0.62 -0.15 0.00 0.00 0.00 0.00 44.72 45.24 3h7l s GLY 520 CO 0.04 0.97 1.22 -0.32 0.00 0.00 0.00 173.10 175.01 3h7l s GLY 521 N -2.39 2.44 0.16 0.20 0.00 -0.27 -4.29 107.32 103.17 3h7l s GLY 521 Ca 0.68 0.95 -0.11 0.00 0.00 0.00 0.00 44.72 46.24 3h7l s GLY 521 CO 0.38 1.36 1.61 -2.75 0.00 0.00 0.00 173.10 173.71 3h7l h PHE 522 N -0.17 1.04 0.03 1.90 3.57 -1.92 -3.28 116.94 118.12 3h7l h PHE 522 Ca -0.48 -0.19 -0.36 0.00 3.53 0.00 0.00 57.97 60.47 3h7l h PHE 522 Cb 1.30 -0.27 -0.05 0.00 2.79 0.00 0.00 35.95 39.72 3h7l h PHE 522 CO 0.46 0.96 -2.18 0.39 -2.23 0.00 0.00 178.31 175.71 3h7l n GLU 523 N -4.26 0.68 -4.04 1.11 4.71 -1.26 -4.86 120.64 112.72 3h7l n GLU 523 Ca 0.02 0.17 -0.31 0.00 -0.01 0.00 0.00 57.16 57.02 3h7l n GLU 523 Cb 0.34 -1.62 -0.16 0.00 -1.01 0.00 0.00 31.44 28.98 3h7l n GLU 523 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 3h7l s ASP 524 N -6.31 3.17 0.10 1.62 -1.08 -1.24 -5.01 116.67 107.92 3h7l s ASP 524 Ca -0.19 -0.73 0.26 0.00 -0.52 0.00 0.00 52.55 51.37 3h7l s ASP 524 Cb 0.07 -1.31 1.00 0.00 -1.46 0.00 0.00 42.92 41.23 3h7l s ASP 524 CO 0.75 -0.08 1.81 -0.62 0.52 0.00 0.00 175.17 177.55 3h7l n GLU 525 N 4.68 0.12 0.16 4.34 1.02 -1.24 -2.20 120.64 127.51 3h7l n GLU 525 Ca -0.17 0.14 0.08 0.00 -0.02 0.00 0.00 57.16 57.19 3h7l n GLU 525 Cb 0.48 -1.65 0.08 0.00 -0.02 0.00 0.00 31.44 30.33 3h7l n GLU 525 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3h7l h GLU 526 N 0.00 0.00 -7.47 3.49 4.39 -1.94 -3.37 114.58 109.67 3h7l h GLU 526 Ca 0.00 0.00 -0.42 0.00 0.34 0.00 0.00 59.36 59.28 3h7l h GLU 526 Cb 0.56 0.00 0.19 0.00 -0.10 0.00 0.00 28.75 29.39 3h7l h GLU 526 CO 0.00 0.15 0.19 0.34 -1.16 0.00 0.00 179.01 178.53 3h7l s ASP 527 N -6.07 1.39 0.04 1.42 -1.08 -1.01 -1.97 116.67 109.40 3h7l s ASP 527 Ca 0.04 0.58 0.04 0.00 -0.52 0.00 0.00 52.55 52.69 3h7l s ASP 527 Cb 0.07 -0.80 -0.02 0.00 -1.46 0.00 0.00 42.92 40.71 3h7l s ASP 527 CO 0.73 -3.83 -0.12 -0.51 0.52 0.00 0.00 175.17 171.96 3h7l s ILE 528 N -3.17 0.89 -0.02 4.11 2.07 -1.26 -1.12 121.20 122.70 3h7l s ILE 528 Ca 0.71 -0.95 -0.04 0.00 -1.41 0.00 0.00 60.65 58.96 3h7l s ILE 528 Cb -0.09 -0.84 0.00 0.00 0.13 0.00 0.00 42.46 41.66 3h7l s ILE 528 CO 0.55 -0.09 0.08 0.00 -1.91 0.00 0.00 174.94 173.57 3h7l s ALA 529 N -0.93 -0.19 -0.18 1.50 0.00 -0.81 -4.49 121.76 116.67 3h7l s ALA 529 Ca -0.01 0.05 -0.04 0.00 0.00 0.00 0.00 51.96 51.96 3h7l s ALA 529 Cb -0.08 -0.05 0.09 0.00 0.00 0.00 0.00 23.12 23.07 3h7l s ALA 529 CO 0.01 -0.09 0.27 0.12 0.00 0.00 0.00 175.76 176.06 3h7l s PHE 530 N -0.46 -0.43 -0.94 0.00 5.36 -1.26 -2.00 117.98 118.25 3h7l s PHE 530 Ca -0.05 0.65 -0.22 0.00 -0.96 0.00 0.00 56.93 56.34 3h7l s PHE 530 Cb -0.03 -0.16 0.03 0.00 -0.34 0.00 0.00 43.02 42.52 3h7l s PHE 530 CO 0.00 -0.51 0.55 0.09 -1.46 0.00 0.00 175.22 173.89 3h7l n ASN 531 N 5.34 -3.57 -4.76 6.13 5.03 -1.26 -4.90 115.26 117.26 3h7l n ASN 531 Ca -0.05 -1.04 -0.38 0.00 0.87 0.00 0.00 54.58 53.98 3h7l n ASN 531 Cb 0.50 -1.33 0.02 0.00 -1.02 0.00 0.00 39.78 37.95 3h7l n ASN 531 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 3h7l s PRO 532 N -6.45 3.50 0.36 3.52 0.04 -1.26 -4.59 135.00 130.11 3h7l s PRO 532 Ca 0.31 2.14 0.17 0.00 0.04 0.00 0.00 61.00 63.67 3h7l s PRO 532 Cb -0.17 -2.43 1.17 0.00 0.04 0.00 0.00 34.50 33.11 3h7l s PRO 532 CO 0.80 -0.87 1.65 -1.35 0.04 0.00 0.00 177.00 177.27 3h7l h PRO 533 N 1.92 0.23 0.00 0.56 0.11 -2.00 -0.01 132.00 132.82 3h7l h PRO 533 Ca -0.50 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 3h7l h PRO 533 Cb 1.27 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 3h7l h PRO 533 CO 0.59 0.15 -0.01 0.00 -0.21 0.00 0.00 178.00 178.53 3h7l h ALA 534 N 1.85 0.99 0.00 -0.75 0.00 -2.03 -3.32 119.26 116.01 3h7l h ALA 534 Ca 0.76 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.66 3h7l h ALA 534 Cb 1.86 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.65 3h7l h ALA 534 CO -0.62 0.02 -0.57 1.04 0.00 0.00 0.00 179.25 179.12 3h7l n GLN 535 N -3.10 3.58 -0.30 0.00 3.00 -0.37 -4.68 117.38 115.50 3h7l n GLN 535 Ca 0.03 -0.01 0.10 0.00 -0.01 0.00 0.00 57.00 57.10 3h7l n GLN 535 Cb 0.46 -0.85 0.26 0.00 0.00 0.00 0.00 30.24 30.11 3h7l n GLN 535 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 3h7l h LYS 536 N 0.00 0.55 -0.00 -1.09 3.64 -1.17 -1.73 116.57 116.77 3h7l h LYS 536 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 3h7l h LYS 536 Cb 0.13 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 3h7l h LYS 536 CO 0.00 0.36 -0.92 -0.25 -2.27 0.00 0.00 179.45 176.37 3h7l n ASP 537 N -4.92 1.01 -4.61 4.20 8.00 -1.26 -4.75 116.55 114.22 3h7l n ASP 537 Ca 0.19 -0.96 -0.43 0.00 0.71 0.00 0.00 54.79 54.30 3h7l n ASP 537 Cb 0.52 0.90 -0.02 0.00 -0.02 0.00 0.00 41.12 42.49 3h7l n ASP 537 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3h7l s ASP 538 N -2.97 6.25 0.45 -2.24 -1.08 -0.65 -4.87 116.67 111.56 3h7l s ASP 538 Ca 0.09 1.32 0.28 0.00 -0.52 0.00 0.00 52.55 53.71 3h7l s ASP 538 Cb 0.16 -2.53 0.85 0.00 -1.46 0.00 0.00 42.92 39.94 3h7l s ASP 538 CO 0.84 -1.42 1.78 0.24 0.52 0.00 0.00 175.17 177.13 3h7l h MET 539 N 11.25 0.00 0.00 4.34 2.86 -1.89 0.11 114.93 131.60 3h7l h MET 539 Ca -0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.32 3h7l h MET 539 Cb 1.14 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.80 3h7l h MET 539 CO 1.03 0.00 0.00 1.28 1.06 0.00 0.00 176.91 180.28 3h7l n LEU 540 N -2.94 0.38 0.00 1.22 4.77 -1.26 -4.18 117.00 114.98 3h7l n LEU 540 Ca 0.03 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.57 3h7l n LEU 540 Cb 0.41 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 3h7l n LEU 540 CO 0.30 -0.26 -0.43 0.00 -1.33 0.00 0.00 177.39 175.66 3h7l n GLN 541 N -1.88 3.01 0.00 3.23 1.13 -0.60 -4.86 117.38 117.41 3h7l n GLN 541 Ca 0.04 0.00 0.10 0.00 -1.94 0.00 0.00 57.00 55.20 3h7l n GLN 541 Cb 0.29 -0.93 0.56 0.00 0.11 0.00 0.00 30.24 30.26 3h7l n GLN 541 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 3h7l n ASN 542 N -1.71 0.00 0.22 1.08 0.23 -0.08 -2.54 115.26 112.46 3h7l n ASN 542 Ca 0.00 -0.32 0.15 0.00 -0.53 0.00 0.00 54.58 53.88 3h7l n ASN 542 Cb 0.36 -0.14 0.52 0.00 -2.08 0.00 0.00 39.78 38.43 3h7l n ASN 542 CO 0.00 0.00 0.00 4.11 -0.93 0.00 0.00 177.26 180.44 3h7l h TRP 543 N 0.00 0.00 0.00 -2.53 5.08 -1.86 -3.33 115.95 113.31 3h7l h TRP 543 Ca 0.00 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 59.91 3h7l h TRP 543 Cb 0.09 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.25 3h7l h TRP 543 CO 0.00 0.00 -0.27 0.00 -1.28 0.00 0.00 178.44 176.89 3h7l h ARG 544 N 0.00 0.00 0.00 0.12 3.08 -1.81 -3.30 114.38 112.47 3h7l h ARG 544 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3h7l h ARG 544 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.64 3h7l h ARG 544 CO 0.00 0.27 -0.38 0.91 -1.07 0.00 0.00 179.97 179.70 3h7l n TRP 545 N -3.52 0.00 0.54 3.04 8.01 -1.25 -1.53 117.44 122.73 3h7l n TRP 545 Ca -0.00 0.00 0.13 0.00 -1.31 0.00 0.00 57.50 56.31 3h7l n TRP 545 Cb 0.42 -0.19 0.35 0.00 -2.01 0.00 0.00 31.31 29.89 3h7l n TRP 545 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.69 177.46 3h7l h GLY 546 N -0.38 0.00 -4.04 6.99 0.00 -1.75 -1.88 103.07 102.00 3h7l h GLY 546 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 3h7l h GLY 546 CO 0.00 0.00 0.48 1.85 0.00 0.00 0.00 176.54 178.87 3h7l s GLU 547 N -3.12 4.60 0.66 4.80 2.12 -1.24 -4.24 118.70 122.26 3h7l s GLU 547 Ca 0.10 1.74 -0.11 0.00 0.36 0.00 0.00 54.97 57.06 3h7l s GLU 547 Cb 0.11 -3.26 -0.02 0.00 0.26 0.00 0.00 34.13 31.22 3h7l s GLU 547 CO 0.61 0.09 1.05 -0.65 -0.54 0.00 0.00 175.26 175.82 3h7l s GLN 548 N -0.51 3.27 -0.29 4.30 -0.21 -1.26 -0.80 119.66 124.16 3h7l s GLN 548 Ca 0.49 0.80 -0.14 0.00 0.02 0.00 0.00 55.36 56.52 3h7l s GLN 548 Cb -0.30 -2.04 0.12 0.00 1.00 0.00 0.00 33.01 31.80 3h7l s GLN 548 CO 0.36 -0.82 0.81 -0.46 -2.12 0.00 0.00 175.29 173.06 3h7l s TRP 549 N -3.14 -0.93 0.45 0.91 -0.00 -1.24 -2.61 118.94 112.37 3h7l s TRP 549 Ca 0.56 1.75 0.20 0.00 -0.00 0.00 0.00 56.10 58.61 3h7l s TRP 549 Cb -0.12 0.56 1.17 0.00 -0.00 0.00 0.00 33.47 35.08 3h7l s TRP 549 CO 0.54 -0.46 1.89 -0.84 -0.00 0.00 0.00 176.95 178.08 3h7l h ILE 550 N 5.33 0.69 -0.36 5.86 3.07 -1.57 -2.47 117.51 128.06 3h7l h ILE 550 Ca -0.24 -0.10 0.06 0.00 1.55 0.00 0.00 64.86 66.13 3h7l h ILE 550 Cb 1.17 0.36 -0.06 0.00 -0.27 0.00 0.00 36.82 38.02 3h7l h ILE 550 CO 0.14 0.06 0.00 -0.65 -1.05 0.00 0.00 178.15 176.65 3h7l h PRO 551 N 0.30 0.10 -0.63 0.16 0.11 -1.88 -1.57 132.00 128.59 3h7l h PRO 551 Ca 0.42 -0.01 0.11 0.00 0.11 0.00 0.00 66.00 66.64 3h7l h PRO 551 Cb 1.17 -0.02 -0.12 0.00 0.11 0.00 0.00 31.00 32.14 3h7l h PRO 551 CO -0.12 0.06 -0.29 0.45 -0.21 0.00 0.00 178.00 177.89 3h7l h HIS 552 N 0.10 -0.79 -0.52 0.65 3.86 -1.73 0.41 115.15 117.13 3h7l h HIS 552 Ca 0.17 0.07 -0.05 0.00 -1.16 0.00 0.00 60.37 59.41 3h7l h HIS 552 Cb 0.24 0.44 -0.02 0.00 1.06 0.00 0.00 27.41 29.13 3h7l h HIS 552 CO -0.25 -0.36 0.14 0.78 0.86 0.00 0.00 177.93 179.10 3h7l h GLY 553 N -0.12 0.88 0.95 2.45 0.00 -1.59 -0.63 103.07 105.01 3h7l h GLY 553 Ca 0.26 -0.54 -0.06 0.00 0.00 0.00 0.00 47.33 46.99 3h7l h GLY 553 CO -0.70 0.50 0.01 0.00 0.00 0.00 0.00 176.54 176.36 3h7l h ALA 554 N 1.01 0.54 -0.37 3.60 0.00 -0.40 0.31 119.26 123.95 3h7l h ALA 554 Ca 0.17 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 3h7l h ALA 554 Cb 0.31 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3h7l h ALA 554 CO -0.00 0.30 -0.29 -1.49 0.00 0.00 0.00 179.25 177.77 3h7l h TRP 555 N 0.53 0.90 -0.76 0.00 -0.00 -0.12 -0.99 115.95 115.51 3h7l h TRP 555 Ca 0.12 -0.23 -0.02 0.00 -0.00 0.00 0.00 58.89 58.76 3h7l h TRP 555 Cb 0.45 -0.21 -0.04 0.00 -0.00 0.00 0.00 29.16 29.37 3h7l h TRP 555 CO 0.04 0.97 0.40 -0.92 -0.00 0.00 0.00 178.44 178.93 3h7l h TYR 556 N 0.66 1.06 -0.45 0.49 3.20 -0.97 -0.38 116.97 120.59 3h7l h TYR 556 Ca 0.08 -0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 3h7l h TYR 556 Cb 0.82 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 38.74 3h7l h TYR 556 CO 0.04 0.75 0.02 1.25 -1.64 0.00 0.00 178.16 178.59 3h7l h LEU 557 N 1.05 0.75 -0.43 2.82 6.46 -0.66 -1.63 115.31 123.68 3h7l h LEU 557 Ca 0.26 -0.29 -0.06 0.00 -0.12 0.00 0.00 57.88 57.68 3h7l h LEU 557 Cb 0.06 -0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 39.78 3h7l h LEU 557 CO -0.04 0.86 0.05 0.25 -0.62 0.00 0.00 178.44 178.94 3h7l h LEU 558 N 0.62 0.70 -1.13 2.25 5.85 -1.14 -2.50 115.31 119.95 3h7l h LEU 558 Ca 0.13 -0.28 0.10 0.00 0.84 0.00 0.00 57.88 58.68 3h7l h LEU 558 Cb 0.46 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 41.23 3h7l h LEU 558 CO 0.02 0.80 0.60 0.00 -0.34 0.00 0.00 178.44 179.52 3h7l h ALA 559 N 0.92 1.60 0.00 1.25 0.00 -0.83 0.33 119.26 122.53 3h7l h ALA 559 Ca 0.13 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.84 3h7l h ALA 559 Cb 0.41 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3h7l h ALA 559 CO 0.01 0.20 -1.02 -0.84 0.00 0.00 0.00 179.25 177.61 3h7l h ILE 560 N 0.93 1.33 -0.10 0.00 3.07 -1.23 -0.76 117.51 120.75 3h7l h ILE 560 Ca 0.44 -2.97 -0.23 0.00 1.55 0.00 0.00 64.86 63.64 3h7l h ILE 560 Cb 0.44 2.65 0.01 0.00 -0.27 0.00 0.00 36.82 39.65 3h7l h ILE 560 CO -0.20 0.76 -0.85 0.24 -1.05 0.00 0.00 178.15 177.04 3h7l h MET 561 N 0.00 0.76 -0.25 0.16 2.86 -0.99 -1.59 114.93 115.87 3h7l h MET 561 Ca -0.06 -0.68 0.03 0.00 -2.06 0.00 0.00 59.70 56.94 3h7l h MET 561 Cb 1.71 0.16 -0.03 0.00 0.06 0.00 0.00 31.60 33.50 3h7l h MET 561 CO 0.10 1.27 0.06 0.77 1.06 0.00 0.00 176.91 180.18 3h7l h SER 562 N 0.47 0.04 -0.39 1.22 0.02 -0.37 -1.77 113.55 112.76 3h7l h SER 562 Ca -0.08 0.04 0.05 0.00 -0.84 0.00 0.00 61.79 60.96 3h7l h SER 562 Cb 1.49 0.04 -0.05 0.00 0.14 0.00 0.00 62.40 64.02 3h7l h SER 562 CO 0.17 0.06 0.11 -0.61 -1.14 0.00 0.00 176.83 175.42 3h7l h GLN 563 N 0.16 0.25 -0.43 3.45 4.15 -1.11 -1.22 115.11 120.37 3h7l h GLN 563 Ca 0.11 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.49 3h7l h GLN 563 Cb 0.10 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.72 3h7l h GLN 563 CO -0.14 0.16 0.17 0.00 -1.93 0.00 0.00 178.83 177.09 3h7l h ALA 564 N 1.27 1.48 -0.00 3.38 0.00 -1.11 -0.31 119.26 123.97 3h7l h ALA 564 Ca 0.18 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 3h7l h ALA 564 Cb 0.19 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3h7l h ALA 564 CO -0.21 0.40 -0.00 0.37 0.00 0.00 0.00 179.25 179.81 3h7l h GLN 565 N 0.62 0.00 -0.93 0.00 -0.00 -0.84 -1.99 115.11 111.96 3h7l h GLN 565 Ca 0.15 -0.00 0.09 0.00 -0.00 0.00 0.00 58.65 58.88 3h7l h GLN 565 Cb 0.14 0.00 -0.07 0.00 0.00 0.00 0.00 27.48 27.55 3h7l h GLN 565 CO -0.01 0.50 0.58 1.25 0.00 0.00 0.00 178.83 181.15 3h7l h HIS 566 N -0.50 1.06 -0.22 3.99 2.76 -0.90 0.29 115.15 121.63 3h7l h HIS 566 Ca 0.00 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.16 3h7l h HIS 566 Cb 0.50 -0.34 -0.01 0.00 1.55 0.00 0.00 27.41 29.12 3h7l h HIS 566 CO 0.10 0.49 -0.00 0.82 -1.30 0.00 0.00 177.93 178.04 3h7l h ILE 567 N 1.00 1.26 -0.88 6.26 1.08 -1.07 -2.22 117.51 122.93 3h7l h ILE 567 Ca 0.43 -0.89 0.02 0.00 -0.39 0.00 0.00 64.86 64.03 3h7l h ILE 567 Cb 0.30 1.40 -0.05 0.00 -3.07 0.00 0.00 36.82 35.40 3h7l h ILE 567 CO -0.21 0.28 0.57 0.28 -0.69 0.00 0.00 178.15 178.37 3h7l h SER 568 N 0.16 0.97 -0.79 1.72 0.02 -0.98 -2.74 113.55 111.91 3h7l h SER 568 Ca 0.06 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.97 3h7l h SER 568 Cb 0.41 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 62.68 3h7l h SER 568 CO 0.01 0.68 0.38 -0.61 -1.14 0.00 0.00 176.83 176.16 3h7l h GLN 569 N 1.14 1.14 -0.36 3.45 5.75 -0.81 -1.21 115.11 124.20 3h7l h GLN 569 Ca 0.34 -0.16 -0.08 0.00 -0.15 0.00 0.00 58.65 58.60 3h7l h GLN 569 Cb -0.05 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.28 3h7l h GLN 569 CO -0.10 0.88 -0.07 -0.07 -2.65 0.00 0.00 178.83 176.82 3h7l h LEU 570 N 1.13 0.69 -1.22 -2.39 3.38 -1.17 -2.47 115.31 113.26 3h7l h LEU 570 Ca 0.28 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 3h7l h LEU 570 Cb 0.11 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3h7l h LEU 570 CO -0.04 0.88 -0.28 0.00 0.09 0.00 0.00 178.44 179.10 3h7l h ALA 571 N 0.83 1.10 -0.18 1.53 0.00 -1.32 -2.56 119.26 118.67 3h7l h ALA 571 Ca 0.09 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 3h7l h ALA 571 Cb 0.57 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3h7l h ALA 571 CO 0.03 0.35 -0.26 1.15 0.00 0.00 0.00 179.25 180.52 3h7l h THR 572 N 0.00 1.34 -0.04 0.00 2.02 -1.14 -3.26 112.91 111.83 3h7l h THR 572 Ca -0.00 -1.48 -0.07 0.00 0.77 0.00 0.00 66.41 65.63 3h7l h THR 572 Cb 0.72 1.88 -0.01 0.00 -1.74 0.00 0.00 68.15 69.00 3h7l h THR 572 CO 0.04 0.45 -0.28 0.28 0.37 0.00 0.00 175.52 176.37 3h7l h SER 573 N 0.14 0.07 0.21 4.18 0.02 -1.33 -3.12 113.55 113.72 3h7l h SER 573 Ca 0.02 -0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 3h7l h SER 573 Cb 0.84 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.35 3h7l h SER 573 CO 0.06 0.36 -0.22 0.11 -1.14 0.00 0.00 176.83 176.00 3h7l h LYS 574 N 0.06 0.03 -0.07 3.45 1.57 -1.50 -3.12 116.57 116.99 3h7l h LYS 574 Ca 0.01 -0.01 -0.21 0.00 -1.87 0.00 0.00 60.65 58.57 3h7l h LYS 574 Cb 0.54 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 3h7l h LYS 574 CO 0.04 0.26 -0.82 -0.91 -0.57 0.00 0.00 179.45 177.44 3h7l h ASN 575 N 0.03 0.67 -0.02 0.86 4.21 -1.63 -3.52 115.58 116.17 3h7l h ASN 575 Ca 0.00 -0.47 0.00 0.00 1.21 0.00 0.00 56.30 57.05 3h7l h ASN 575 Cb 0.41 -0.20 0.00 0.00 -1.12 0.00 0.00 38.32 37.41 3h7l h ASN 575 CO 0.03 1.24 0.00 0.00 -1.29 0.00 0.00 177.43 177.41