#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mhs n ALA 2 N 0.00 0.20 -0.02 3.04 0.00 -1.26 -0.71 120.51 121.76 1mhs n ALA 2 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1mhs n ALA 2 Cb 0.00 -0.15 -0.00 0.00 0.00 0.00 0.00 19.45 19.30 1mhs n ALA 2 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1mhs h ASP 3 N 0.00 -0.03 0.23 0.00 3.32 -2.00 -3.38 116.42 114.57 1mhs h ASP 3 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1mhs h ASP 3 Cb 0.26 0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.82 1mhs h ASP 3 CO 0.00 0.33 -0.11 0.45 -1.72 0.00 0.00 179.24 178.19 1mhs h HIS 4 N -0.74 -0.29 -1.47 4.55 3.86 -1.35 -3.02 115.15 116.69 1mhs h HIS 4 Ca -0.00 -0.01 0.48 0.00 -1.16 0.00 0.00 60.37 59.68 1mhs h HIS 4 Cb 0.03 0.10 -0.12 0.00 1.06 0.00 0.00 27.41 28.47 1mhs h HIS 4 CO 0.00 -0.06 0.97 0.66 0.86 0.00 0.00 177.93 180.36 1mhs h SER 5 N -0.47 0.17 1.58 2.45 4.64 -1.77 5.56 113.55 125.71 1mhs h SER 5 Ca -0.03 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1mhs h SER 5 Cb 0.36 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1mhs h SER 5 CO 0.05 -0.19 -0.28 0.00 -0.87 0.00 0.00 176.83 175.55 1mhs h ALA 6 N 1.50 0.85 0.10 5.18 0.00 -1.70 -2.66 119.26 122.53 1mhs h ALA 6 Ca 0.87 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 55.51 1mhs h ALA 6 Cb 2.92 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 20.70 1mhs h ALA 6 CO -0.37 0.00 -1.43 0.77 0.00 0.00 0.00 179.25 178.22 1mhs h SER 7 N 0.00 0.34 0.11 0.00 0.02 1.11 -3.28 113.55 111.84 1mhs h SER 7 Ca 0.00 -0.83 -0.01 0.00 -0.84 0.00 0.00 61.79 60.11 1mhs h SER 7 Cb 0.93 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.36 1mhs h SER 7 CO 0.00 1.62 -0.05 1.23 -1.14 0.00 0.00 176.83 178.49 1mhs h GLY 8 N 0.05 -0.15 -0.00 -3.77 0.00 -0.18 -3.10 103.07 95.92 1mhs h GLY 8 Ca -0.32 0.06 0.02 0.00 0.00 0.00 0.00 47.33 47.08 1mhs h GLY 8 CO 0.03 -0.05 -0.39 0.00 0.00 0.00 0.00 176.54 176.13 1mhs h ALA 9 N 0.67 -0.82 0.00 3.60 0.00 -1.65 -2.39 119.26 118.67 1mhs h ALA 9 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1mhs h ALA 9 Cb 0.17 0.83 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1mhs h ALA 9 CO 0.02 -0.94 0.00 -0.35 0.00 0.00 0.00 179.25 177.98 1mhs n PRO 10 N -4.63 0.25 -2.33 0.00 -0.05 -1.21 -4.83 135.00 122.20 1mhs n PRO 10 Ca -0.05 0.00 -0.03 0.00 -0.05 0.00 0.00 63.50 63.37 1mhs n PRO 10 Cb 0.29 -1.14 -0.01 0.00 -0.05 0.00 0.00 33.50 32.58 1mhs n PRO 10 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1mhs n ALA 11 N -0.64 0.11 -0.27 0.55 0.00 -0.90 -5.08 120.51 114.27 1mhs n ALA 11 Ca 0.02 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.16 1mhs n ALA 11 Cb 0.01 0.24 0.00 0.00 0.00 0.00 0.00 19.45 19.69 1mhs n ALA 11 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1mhs n LEU 12 N 0.00 -1.26 -2.72 0.00 7.99 -1.26 -4.92 117.00 114.83 1mhs n LEU 12 Ca 0.01 0.00 -0.03 0.00 -0.01 0.00 0.00 56.01 55.98 1mhs n LEU 12 Cb 0.09 -0.45 0.02 0.00 -0.11 0.00 0.00 43.42 42.97 1mhs n LEU 12 CO 0.05 0.00 0.32 -0.94 -1.51 0.00 0.00 177.39 175.30 1mhs s SER 13 N -0.09 -0.82 0.16 -1.43 1.04 -1.26 -4.44 113.70 106.86 1mhs s SER 13 Ca 0.00 -0.97 -0.20 0.00 0.48 0.00 0.00 55.95 55.26 1mhs s SER 13 Cb 0.00 1.07 0.07 0.00 0.10 0.00 0.00 66.02 67.26 1mhs s SER 13 CO 0.00 -0.03 1.64 0.71 0.98 0.00 0.00 173.24 176.54 1mhs h THR 14 N 3.70 0.43 -3.52 2.02 1.35 -1.99 -3.38 112.91 111.52 1mhs h THR 14 Ca 0.02 0.00 -0.70 0.00 -0.55 0.00 0.00 66.41 65.18 1mhs h THR 14 Cb 1.14 0.43 -0.32 0.00 -1.73 0.00 0.00 68.15 67.67 1mhs h THR 14 CO -0.05 0.00 -0.55 0.20 -0.25 0.00 0.00 175.52 174.87 1mhs s ASN 15 N -5.10 5.32 0.06 5.36 0.01 -1.26 -4.90 114.94 114.43 1mhs s ASN 15 Ca -0.14 -1.74 0.05 0.00 -0.71 0.00 0.00 52.86 50.31 1mhs s ASN 15 Cb 0.13 -1.86 0.20 0.00 0.41 0.00 0.00 41.25 40.13 1mhs s ASN 15 CO 0.69 -0.50 0.20 -0.38 -1.51 0.00 0.00 177.10 175.60 1mhs n ILE 16 N 4.71 -0.03 0.00 0.60 5.41 -1.26 -4.42 119.36 124.37 1mhs n ILE 16 Ca -0.07 0.22 0.00 0.00 1.00 0.00 0.00 62.75 63.90 1mhs n ILE 16 Cb 0.42 -0.36 0.00 0.00 -0.71 0.00 0.00 39.64 38.99 1mhs n ILE 16 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1mhs n GLU 17 N -2.74 0.00 -2.12 0.38 1.02 -1.26 -4.72 120.64 111.20 1mhs n GLU 17 Ca 0.05 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.84 1mhs n GLU 17 Cb 0.21 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.59 1mhs n GLU 17 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1mhs n SER 18 N 0.00 3.64 -3.95 1.62 7.64 -1.26 -4.86 113.62 116.45 1mhs n SER 18 Ca 0.00 -2.77 -0.31 0.00 1.01 0.00 0.00 58.87 56.80 1mhs n SER 18 Cb 0.00 -1.68 -0.15 0.00 -1.01 0.00 0.00 64.21 61.37 1mhs n SER 18 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1mhs s GLY 19 N 5.47 1.65 1.03 0.23 0.00 -1.26 -5.12 107.32 109.33 1mhs s GLY 19 Ca 0.62 -2.15 -0.17 0.00 0.00 0.00 0.00 44.72 43.01 1mhs s GLY 19 CO 0.11 1.07 -0.12 0.28 0.00 0.00 0.00 173.10 174.44 1mhs n LYS 20 N 4.45 -0.78 0.00 2.90 4.01 -1.26 -4.87 118.16 122.61 1mhs n LYS 20 Ca -0.00 -0.21 0.00 0.00 -0.51 0.00 0.00 58.31 57.59 1mhs n LYS 20 Cb 0.42 -1.60 0.00 0.00 -0.51 0.00 0.00 35.03 33.34 1mhs n LYS 20 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 1mhs n PHE 21 N -3.82 0.00 0.00 2.13 3.01 -1.26 -4.29 117.46 113.24 1mhs n PHE 21 Ca 0.02 -0.46 0.00 0.00 1.01 0.00 0.00 57.45 58.03 1mhs n PHE 21 Cb 0.60 -0.24 0.00 0.00 -0.01 0.00 0.00 39.48 39.83 1mhs n PHE 21 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1mhs n ASP 22 N 0.52 0.00 -0.14 4.37 8.00 -1.26 -4.08 116.55 123.96 1mhs n ASP 22 Ca 0.00 0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.61 1mhs n ASP 22 Cb 0.46 0.00 0.17 0.00 -0.02 0.00 0.00 41.12 41.74 1mhs n ASP 22 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1mhs n GLU 23 N -0.72 0.00 -0.07 -1.24 -0.58 -1.26 0.50 120.64 117.27 1mhs n GLU 23 Ca 0.00 0.25 -0.13 0.00 -0.42 0.00 0.00 57.16 56.86 1mhs n GLU 23 Cb 0.00 -0.59 -0.06 0.00 -0.57 0.00 0.00 31.44 30.22 1mhs n GLU 23 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 1mhs h LYS 24 N 0.00 0.52 -0.59 3.49 2.10 -1.80 -1.79 116.57 118.51 1mhs h LYS 24 Ca 0.20 -0.28 0.03 0.00 -2.00 0.00 0.00 60.65 58.60 1mhs h LYS 24 Cb 0.85 0.01 -0.04 0.00 -0.90 0.00 0.00 32.23 32.15 1mhs h LYS 24 CO -0.00 0.86 0.36 0.00 -2.00 0.00 0.00 179.45 178.67 1mhs h ALA 25 N 0.65 0.76 -0.17 0.07 0.00 1.17 0.44 119.26 122.18 1mhs h ALA 25 Ca 0.03 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1mhs h ALA 25 Cb 0.77 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1mhs h ALA 25 CO 0.05 0.09 -0.29 0.00 0.00 0.00 0.00 179.25 179.10 1mhs h ALA 26 N 1.26 0.26 0.11 0.00 0.00 -1.57 -3.20 119.26 116.11 1mhs h ALA 26 Ca 0.24 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1mhs h ALA 26 Cb 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1mhs h ALA 26 CO -0.10 0.27 -0.05 0.93 0.00 0.00 0.00 179.25 180.30 1mhs h GLU 27 N 0.12 -0.14 0.00 0.00 5.08 -1.15 -3.12 114.58 115.38 1mhs h GLU 27 Ca 0.01 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1mhs h GLU 27 Cb 0.88 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.16 1mhs h GLU 27 CO 0.07 0.16 -0.01 0.00 -1.00 0.00 0.00 179.01 178.23 1mhs h ALA 28 N 0.42 1.21 -0.61 3.43 0.00 -1.01 -3.12 119.26 119.57 1mhs h ALA 28 Ca -0.01 -0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.32 1mhs h ALA 28 Cb 0.36 -0.00 -0.18 0.00 0.00 0.00 0.00 17.79 17.97 1mhs h ALA 28 CO 0.02 0.01 0.77 0.00 0.00 0.00 0.00 179.25 180.05 1mhs n ALA 29 N -2.18 6.51 0.00 0.00 0.00 -1.18 -3.15 120.51 120.51 1mhs n ALA 29 Ca -0.03 -3.34 0.00 0.00 0.00 0.00 0.00 53.44 50.07 1mhs n ALA 29 Cb 0.09 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.31 1mhs n ALA 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mhs n ALA 30 N 0.85 0.00 -2.38 0.00 0.00 -1.18 -5.04 120.51 112.75 1mhs n ALA 30 Ca 0.51 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.61 1mhs n ALA 30 Cb 0.47 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.86 1mhs n ALA 30 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1mhs s TYR 31 N 0.00 3.57 0.00 0.00 5.04 -1.19 -4.27 117.35 120.50 1mhs s TYR 31 Ca 0.00 1.01 0.00 0.00 -2.44 0.00 0.00 57.07 55.64 1mhs s TYR 31 Cb 0.00 -2.34 0.00 0.00 0.35 0.00 0.00 41.96 39.97 1mhs s TYR 31 CO 0.00 0.40 0.00 0.94 -1.34 0.00 0.00 175.55 175.55 1mhs n GLN 32 N 0.62 0.00 -0.00 4.97 7.27 -1.26 -5.00 117.38 123.98 1mhs n GLN 32 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.03 1mhs n GLN 32 Cb 0.52 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.17 1mhs n GLN 32 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 1mhs n PRO 33 N 0.00 1.03 0.00 3.69 -0.05 -1.26 -5.03 135.00 133.38 1mhs n PRO 33 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.45 1mhs n PRO 33 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 33.45 1mhs n PRO 33 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 175.50 177.08 1mhs n LYS 34 N -0.05 0.00 0.00 0.54 4.76 -1.26 -4.84 118.16 117.30 1mhs n LYS 34 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1mhs n LYS 34 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1mhs n LYS 34 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 1mhs n PRO 35 N 7.50 0.00 -2.36 1.97 -0.04 -1.26 -4.90 135.00 135.91 1mhs n PRO 35 Ca 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 1mhs n PRO 35 Cb 0.00 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.47 1mhs n PRO 35 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1mhs n LYS 36 N 0.00 -0.62 -1.32 0.54 4.76 -1.26 -4.63 118.16 115.62 1mhs n LYS 36 Ca 0.00 0.66 -0.43 0.00 -2.87 0.00 0.00 58.31 55.67 1mhs n LYS 36 Cb 0.00 -0.89 -0.04 0.00 -1.84 0.00 0.00 35.03 32.26 1mhs n LYS 36 CO 0.00 0.00 0.00 1.55 -1.37 0.00 0.00 177.40 177.58 1mhs n VAL 37 N 0.50 2.33 0.00 -0.18 3.14 -1.26 -4.55 118.33 118.31 1mhs n VAL 37 Ca -0.03 -2.03 0.00 0.00 -2.96 0.00 0.00 64.34 59.33 1mhs n VAL 37 Cb 0.37 -2.41 0.00 0.00 -1.06 0.00 0.00 33.84 30.74 1mhs n VAL 37 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1mhs n GLU 38 N 6.68 0.00 -2.97 1.45 -0.58 -1.26 -5.09 120.64 118.87 1mhs n GLU 38 Ca 0.50 0.00 -0.21 0.00 -0.42 0.00 0.00 57.16 57.04 1mhs n GLU 38 Cb 0.40 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 31.24 1mhs n GLU 38 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 1mhs n ASP 39 N 0.00 2.53 -4.43 1.62 5.75 -1.26 -5.09 116.55 115.67 1mhs n ASP 39 Ca 0.00 -3.27 -0.29 0.00 -0.01 0.00 0.00 54.79 51.22 1mhs n ASP 39 Cb 0.00 -0.57 0.16 0.00 -1.03 0.00 0.00 41.12 39.68 1mhs n ASP 39 CO 0.00 0.00 0.00 1.51 -0.11 0.00 0.00 177.20 178.60 1mhs s ASP 40 N -2.98 3.02 0.42 -1.12 -4.77 -1.26 -5.00 116.67 104.98 1mhs s ASP 40 Ca 0.42 0.68 -0.25 0.00 -3.30 0.00 0.00 52.55 50.10 1mhs s ASP 40 Cb 0.35 -1.02 -0.08 0.00 -1.09 0.00 0.00 42.92 41.07 1mhs s ASP 40 CO -0.10 -2.82 1.23 -0.70 0.70 0.00 0.00 175.17 173.48 1mhs s GLU 41 N -5.52 3.94 0.51 2.11 -6.30 -1.26 -4.88 118.70 107.31 1mhs s GLU 41 Ca 0.68 1.97 0.26 0.00 -2.50 0.00 0.00 54.97 55.38 1mhs s GLU 41 Cb -0.10 -2.65 1.37 0.00 0.00 0.00 0.00 34.13 32.75 1mhs s GLU 41 CO 0.53 -0.45 1.94 0.22 0.02 0.00 0.00 175.26 177.52 1mhs h ASP 42 N 2.52 0.07 0.18 -1.70 1.82 -2.00 -1.78 116.42 115.52 1mhs h ASP 42 Ca -0.49 0.01 0.01 0.00 -0.39 0.00 0.00 57.03 56.16 1mhs h ASP 42 Cb 1.24 -0.01 -0.02 0.00 0.68 0.00 0.00 39.33 41.23 1mhs h ASP 42 CO 0.62 0.03 -0.19 -0.08 -1.61 0.00 0.00 179.24 178.01 1mhs h GLU 43 N 0.07 -0.38 0.00 0.28 4.22 -2.02 -2.29 114.58 114.46 1mhs h GLU 43 Ca 0.35 0.03 -0.01 0.00 0.08 0.00 0.00 59.36 59.80 1mhs h GLU 43 Cb 1.27 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.61 1mhs h GLU 43 CO -0.03 -0.26 -0.06 -0.44 -2.18 0.00 0.00 179.01 176.04 1mhs h ASP 44 N -0.40 0.00 0.09 1.04 3.32 -1.70 -2.72 116.42 116.05 1mhs h ASP 44 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1mhs h ASP 44 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1mhs h ASP 44 CO -0.05 0.06 -0.05 0.16 -1.72 0.00 0.00 179.24 177.64 1mhs h ILE 45 N 0.00 1.00 -0.11 0.35 -0.00 -1.23 -0.05 117.51 117.47 1mhs h ILE 45 Ca -0.00 -0.32 -0.00 0.00 -0.00 0.00 0.00 64.86 64.54 1mhs h ILE 45 Cb 0.12 1.20 -0.01 0.00 -0.00 0.00 0.00 36.82 38.14 1mhs h ILE 45 CO 0.01 0.08 0.06 -0.78 -0.00 0.00 0.00 178.15 177.52 1mhs h ASP 46 N -0.27 0.13 -0.73 2.16 1.82 -1.26 -2.36 116.42 115.91 1mhs h ASP 46 Ca -0.01 -0.07 0.07 0.00 -0.39 0.00 0.00 57.03 56.63 1mhs h ASP 46 Cb 0.23 -0.03 -0.05 0.00 0.68 0.00 0.00 39.33 40.16 1mhs h ASP 46 CO 0.02 0.16 0.48 0.00 -1.61 0.00 0.00 179.24 178.29 1mhs h ALA 47 N 0.98 1.71 -0.42 -0.78 0.00 -1.45 -1.10 119.26 118.20 1mhs h ALA 47 Ca 0.04 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1mhs h ALA 47 Cb 0.06 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1mhs h ALA 47 CO -0.01 0.17 0.06 -0.07 0.00 0.00 0.00 179.25 179.40 1mhs h LEU 48 N 0.75 0.60 -0.04 0.00 -0.00 -0.49 -0.21 115.31 115.92 1mhs h LEU 48 Ca 0.32 -0.11 -0.01 0.00 -0.00 0.00 0.00 57.88 58.08 1mhs h LEU 48 Cb 0.28 -0.16 -0.00 0.00 -0.00 0.00 0.00 40.66 40.78 1mhs h LEU 48 CO -0.11 0.63 -0.01 0.16 -0.00 0.00 0.00 178.44 179.11 1mhs h ILE 49 N 0.62 1.31 0.00 1.22 3.07 -0.79 0.82 117.51 123.76 1mhs h ILE 49 Ca 0.14 -0.96 0.00 0.00 1.55 0.00 0.00 64.86 65.59 1mhs h ILE 49 Cb 0.30 1.88 0.00 0.00 -0.27 0.00 0.00 36.82 38.73 1mhs h ILE 49 CO 0.00 0.26 0.00 -1.84 -1.05 0.00 0.00 178.15 175.52 1mhs n GLU 50 N -4.84 0.19 0.01 0.16 0.28 -1.00 -1.79 120.64 113.65 1mhs n GLU 50 Ca -0.08 0.35 0.11 0.00 -0.16 0.00 0.00 57.16 57.39 1mhs n GLU 50 Cb 0.23 -1.82 -0.12 0.00 1.43 0.00 0.00 31.44 31.15 1mhs n GLU 50 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1mhs n ASP 51 N -2.17 0.26 -0.09 -1.84 8.00 -0.10 -4.43 116.55 116.18 1mhs n ASP 51 Ca 0.03 -0.01 -0.17 0.00 0.71 0.00 0.00 54.79 55.35 1mhs n ASP 51 Cb 0.28 1.57 -0.11 0.00 -0.02 0.00 0.00 41.12 42.83 1mhs n ASP 51 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1mhs h LEU 52 N 0.00 0.00 -8.30 0.64 3.38 -0.43 -3.37 115.31 107.23 1mhs h LEU 52 Ca 0.00 -0.62 -0.02 0.00 0.09 0.00 0.00 57.88 57.33 1mhs h LEU 52 Cb 0.95 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 1mhs h LEU 52 CO 0.00 1.22 0.14 -0.62 0.09 0.00 0.00 178.44 179.27 1mhs n GLU 53 N -4.52 0.50 0.00 1.13 1.02 -0.74 -3.54 120.64 114.48 1mhs n GLU 53 Ca -0.21 -0.84 0.00 0.00 -0.02 0.00 0.00 57.16 56.09 1mhs n GLU 53 Cb 0.55 -3.53 0.00 0.00 -0.02 0.00 0.00 31.44 28.44 1mhs n GLU 53 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1mhs n SER 54 N 17.94 0.00 0.00 1.62 3.41 -1.20 -4.80 113.62 130.59 1mhs n SER 54 Ca 0.48 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.09 1mhs n SER 54 Cb 0.41 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 1mhs n SER 54 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1mhs n HIS 55 N 0.00 0.00 -0.46 7.33 8.25 -1.23 -4.57 115.22 124.53 1mhs n HIS 55 Ca 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1mhs n HIS 55 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1mhs n HIS 55 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1mhs n ASP 56 N 0.00 -1.29 -3.73 0.41 8.00 -1.26 -4.91 116.55 113.76 1mhs n ASP 56 Ca 0.00 -0.01 -0.30 0.00 0.71 0.00 0.00 54.79 55.19 1mhs n ASP 56 Cb 0.00 -0.32 -0.15 0.00 -0.02 0.00 0.00 41.12 40.64 1mhs n ASP 56 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1mhs s GLY 57 N -0.67 1.22 0.45 0.44 0.00 -1.26 -5.02 107.32 102.48 1mhs s GLY 57 Ca 0.01 -1.89 -0.09 0.00 0.00 0.00 0.00 44.72 42.74 1mhs s GLY 57 CO 0.01 1.58 0.81 0.30 0.00 0.00 0.00 173.10 175.80 1mhs s HIS 58 N 1.33 3.51 0.18 1.90 3.76 -1.26 -5.05 115.29 119.66 1mhs s HIS 58 Ca 0.12 1.03 -0.30 0.00 -0.15 0.00 0.00 55.06 55.75 1mhs s HIS 58 Cb -0.19 -2.45 -0.07 0.00 1.11 0.00 0.00 32.58 30.98 1mhs s HIS 58 CO -0.19 -0.23 0.98 -0.51 -0.85 0.00 0.00 174.74 173.94 1mhs s ASP 59 N -3.53 7.52 0.00 1.40 1.01 -1.26 -4.95 116.67 116.86 1mhs s ASP 59 Ca 0.51 1.92 0.00 0.00 0.71 0.00 0.00 52.55 55.69 1mhs s ASP 59 Cb -0.10 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.23 1mhs s ASP 59 CO 0.37 0.00 0.00 0.00 0.21 0.00 0.00 175.17 175.76 1mhs n ALA 60 N 2.13 1.83 -2.40 5.23 0.00 -1.26 -5.02 120.51 121.02 1mhs n ALA 60 Ca 0.00 -0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 1mhs n ALA 60 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 1mhs n ALA 60 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1mhs n GLU 61 N -0.90 -1.72 -3.93 0.00 1.02 -1.26 -5.00 120.64 108.84 1mhs n GLU 61 Ca 0.00 0.68 -0.10 0.00 -0.02 0.00 0.00 57.16 57.72 1mhs n GLU 61 Cb 0.00 -4.96 -0.10 0.00 -0.02 0.00 0.00 31.44 26.35 1mhs n GLU 61 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1mhs s GLU 62 N -4.87 0.42 0.14 3.49 2.02 -1.26 -5.13 118.70 113.51 1mhs s GLU 62 Ca 0.05 -0.57 -0.30 0.00 0.02 0.00 0.00 54.97 54.17 1mhs s GLU 62 Cb -0.02 0.16 -0.07 0.00 0.10 0.00 0.00 34.13 34.30 1mhs s GLU 62 CO 0.07 -0.09 1.18 -1.21 0.02 0.00 0.00 175.26 175.23 1mhs s GLU 63 N -1.66 4.49 0.00 1.61 2.02 -1.26 -4.77 118.70 119.12 1mhs s GLU 63 Ca -0.13 1.82 0.00 0.00 0.02 0.00 0.00 54.97 56.67 1mhs s GLU 63 Cb -0.07 -3.28 0.00 0.00 0.10 0.00 0.00 34.13 30.88 1mhs s GLU 63 CO -0.01 -0.12 0.00 0.39 0.02 0.00 0.00 175.26 175.54 1mhs n GLU 64 N 2.97 0.00 -2.54 1.61 1.02 -1.26 -5.07 120.64 117.38 1mhs n GLU 64 Ca 0.06 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.10 1mhs n GLU 64 Cb 0.45 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.85 1mhs n GLU 64 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 1mhs n GLU 65 N 0.00 -0.95 -3.74 3.49 0.28 -1.26 -4.88 120.64 113.58 1mhs n GLU 65 Ca 0.00 0.03 -0.30 0.00 -0.16 0.00 0.00 57.16 56.73 1mhs n GLU 65 Cb 0.00 -1.09 -0.15 0.00 1.43 0.00 0.00 31.44 31.63 1mhs n GLU 65 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 1mhs s GLU 66 N -3.17 0.84 0.00 3.44 0.41 -1.26 -4.58 118.70 114.38 1mhs s GLU 66 Ca 0.13 -1.27 0.00 0.00 -0.41 0.00 0.00 54.97 53.43 1mhs s GLU 66 Cb -0.08 -2.09 0.00 0.00 -1.78 0.00 0.00 34.13 30.18 1mhs s GLU 66 CO 0.26 -1.02 0.00 0.00 -0.49 0.00 0.00 175.26 174.01 1mhs n ALA 67 N 4.60 0.00 -0.13 5.21 0.00 -1.26 -4.87 120.51 124.06 1mhs n ALA 67 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1mhs n ALA 67 Cb 0.41 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.85 1mhs n ALA 67 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1mhs h THR 68 N 0.00 1.18 0.00 0.00 1.35 -1.83 -2.02 112.91 111.59 1mhs h THR 68 Ca 0.00 -0.53 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 1mhs h THR 68 Cb 0.00 0.79 0.00 0.00 -1.73 0.00 0.00 68.15 67.21 1mhs h THR 68 CO 0.00 0.20 0.00 -0.81 -0.25 0.00 0.00 175.52 174.66 1mhs n PRO 69 N -4.68 0.10 -0.03 4.72 -0.05 -1.26 -2.29 135.00 131.52 1mhs n PRO 69 Ca -0.00 0.56 -0.17 0.00 -0.05 0.00 0.00 63.50 63.85 1mhs n PRO 69 Cb 0.12 -1.80 -0.08 0.00 -0.05 0.00 0.00 33.50 31.70 1mhs n PRO 69 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 175.50 176.23 1mhs h GLY 70 N 0.30 0.68 -1.64 0.55 0.00 -1.57 -3.03 103.07 98.37 1mhs h GLY 70 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 47.33 46.36 1mhs h GLY 70 CO 0.00 0.86 0.00 0.61 0.00 0.00 0.00 176.54 178.01 1mhs n GLY 71 N 0.71 2.86 0.03 4.60 0.00 -0.97 -4.35 105.19 108.07 1mhs n GLY 71 Ca -0.08 -0.54 -0.01 0.00 0.00 0.00 0.00 46.02 45.40 1mhs n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mhs n GLY 72 N 0.62 -0.47 3.45 -0.02 0.00 -0.99 -4.03 105.19 103.74 1mhs n GLY 72 Ca 0.15 -0.20 -0.10 0.00 0.00 0.00 0.00 46.02 45.88 1mhs n GLY 72 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1mhs s ARG 73 N -2.43 1.28 0.00 1.61 1.70 -1.14 -4.93 118.95 115.02 1mhs s ARG 73 Ca -0.04 -0.80 0.00 0.00 -0.47 0.00 0.00 55.73 54.41 1mhs s ARG 73 Cb 0.04 0.51 0.00 0.00 -0.57 0.00 0.00 34.95 34.93 1mhs s ARG 73 CO 0.41 -0.53 0.45 1.33 -1.08 0.00 0.00 175.30 175.88 1mhs n VAL 74 N -0.31 0.00 -0.30 4.99 0.24 -1.26 -4.41 118.33 117.29 1mhs n VAL 74 Ca -0.12 0.80 0.00 0.00 -2.04 0.00 0.00 64.34 62.98 1mhs n VAL 74 Cb 0.63 -1.15 0.00 0.00 -1.47 0.00 0.00 33.84 31.85 1mhs n VAL 74 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1mhs n VAL 75 N -1.40 0.00 0.00 3.34 0.31 -1.26 -4.78 118.33 114.54 1mhs n VAL 75 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1mhs n VAL 75 Cb 0.00 -0.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.91 1mhs n VAL 75 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1mhs n PRO 76 N -2.30 0.00 -0.09 5.55 -0.04 -1.26 -3.44 135.00 133.42 1mhs n PRO 76 Ca 0.00 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.44 1mhs n PRO 76 Cb 0.00 -0.72 -0.02 0.00 -0.04 0.00 0.00 33.50 32.72 1mhs n PRO 76 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1mhs n GLU 77 N -0.32 -0.09 -2.63 0.54 4.07 -1.26 -3.62 120.64 117.33 1mhs n GLU 77 Ca 0.00 1.06 -0.43 0.00 -0.06 0.00 0.00 57.16 57.73 1mhs n GLU 77 Cb 0.00 -1.58 -0.02 0.00 -0.06 0.00 0.00 31.44 29.78 1mhs n GLU 77 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1mhs s ASP 78 N -3.56 6.69 0.00 4.31 1.01 -1.26 -3.55 116.67 120.32 1mhs s ASP 78 Ca -0.03 0.58 0.00 0.00 0.71 0.00 0.00 52.55 53.82 1mhs s ASP 78 Cb 0.02 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.41 1mhs s ASP 78 CO 0.13 -1.15 0.00 0.80 0.21 0.00 0.00 175.17 175.17 1mhs n MET 79 N 7.56 0.00 0.14 8.23 1.56 -1.22 -4.12 117.12 129.27 1mhs n MET 79 Ca 0.11 0.00 0.07 0.00 -0.27 0.00 0.00 57.70 57.62 1mhs n MET 79 Cb 0.48 0.00 0.05 0.00 2.15 0.00 0.00 33.22 35.91 1mhs n MET 79 CO 0.00 0.00 0.00 1.37 -0.73 0.00 0.00 175.97 176.61 1mhs h LEU 80 N 0.00 0.00 0.00 -0.89 -0.00 -1.67 -3.05 115.31 109.70 1mhs h LEU 80 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1mhs h LEU 80 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1mhs h LEU 80 CO 0.00 0.23 0.00 0.00 -0.00 0.00 0.00 178.44 178.67 1mhs n GLN 81 N -3.00 0.00 -0.02 0.17 1.13 -1.26 -3.30 117.38 111.10 1mhs n GLN 81 Ca 0.00 0.00 -0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1mhs n GLN 81 Cb 0.64 -0.40 0.00 0.00 0.11 0.00 0.00 30.24 30.59 1mhs n GLN 81 CO 0.00 0.00 0.00 -2.37 -1.44 0.00 0.00 177.06 173.25 1mhs n THR 82 N -0.08 -0.03 0.00 5.09 5.66 -1.26 -4.81 114.28 118.85 1mhs n THR 82 Ca 0.00 0.13 0.00 0.00 -3.05 0.00 0.00 64.05 61.13 1mhs n THR 82 Cb 0.00 -0.17 0.00 0.00 -1.55 0.00 0.00 70.33 68.61 1mhs n THR 82 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1mhs n ASP 83 N -4.08 0.00 0.00 1.09 -0.08 -1.15 -5.05 116.55 107.28 1mhs n ASP 83 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1mhs n ASP 83 Cb 0.02 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.48 1mhs n ASP 83 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1mhs n THR 84 N 0.57 0.00 0.00 5.18 -2.24 -1.26 -4.86 114.28 111.67 1mhs n THR 84 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1mhs n THR 84 Cb 0.00 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.00 1mhs n THR 84 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1mhs n ARG 85 N 0.00 0.00 0.00 -0.78 0.63 -1.26 -4.95 116.66 110.29 1mhs n ARG 85 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1mhs n ARG 85 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 1mhs n ARG 85 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1mhs n VAL 86 N 0.00 0.00 -4.12 5.15 0.31 -1.26 -5.09 118.33 113.32 1mhs n VAL 86 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 1mhs n VAL 86 Cb 0.00 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.84 1mhs n VAL 86 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1mhs s GLY 87 N 0.00 1.02 0.00 2.92 0.00 -1.26 -4.26 107.32 105.74 1mhs s GLY 87 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 44.72 43.32 1mhs s GLY 87 CO 0.00 -1.21 0.00 1.47 0.00 0.00 0.00 173.10 173.36 1mhs n LEU 88 N -0.21 0.00 -1.92 0.66 -0.00 -0.84 -4.88 117.00 109.81 1mhs n LEU 88 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.99 1mhs n LEU 88 Cb 0.64 0.00 0.03 0.00 -0.00 0.00 0.00 43.42 44.09 1mhs n LEU 88 CO 0.30 -0.43 0.16 0.35 -0.00 0.00 0.00 177.39 177.77 1mhs n THR 89 N -1.38 0.36 0.00 1.47 -2.24 -1.26 -4.97 114.28 106.26 1mhs n THR 89 Ca 0.00 -1.37 0.00 0.00 -2.27 0.00 0.00 64.05 60.41 1mhs n THR 89 Cb 0.00 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 1mhs n THR 89 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1mhs n SER 90 N -0.13 0.00 0.39 3.42 3.41 -1.26 -4.43 113.62 115.02 1mhs n SER 90 Ca -0.02 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.43 1mhs n SER 90 Cb 0.94 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.82 1mhs n SER 90 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1mhs h GLU 91 N 0.00 -0.97 -0.98 4.33 4.81 -2.01 -3.05 114.58 116.71 1mhs h GLU 91 Ca 0.00 0.07 0.29 0.00 -0.13 0.00 0.00 59.36 59.59 1mhs h GLU 91 Cb 0.00 0.22 -0.14 0.00 0.63 0.00 0.00 28.75 29.46 1mhs h GLU 91 CO 0.00 -0.64 0.50 0.93 -0.73 0.00 0.00 179.01 179.07 1mhs h GLU 92 N -1.06 0.32 -0.26 1.92 4.39 -1.95 0.28 114.58 118.22 1mhs h GLU 92 Ca -0.10 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.58 1mhs h GLU 92 Cb 0.77 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.33 1mhs h GLU 92 CO 0.17 0.21 0.17 0.28 -1.16 0.00 0.00 179.01 178.68 1mhs h VAL 93 N 0.33 1.08 -0.71 3.13 2.07 -1.90 0.31 116.25 120.56 1mhs h VAL 93 Ca 0.69 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 68.06 1mhs h VAL 93 Cb 1.50 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 31.96 1mhs h VAL 93 CO -0.60 0.08 0.47 1.62 0.02 0.00 0.00 177.57 179.16 1mhs h VAL 94 N 0.34 1.11 0.00 2.57 3.04 -0.84 -0.87 116.25 121.61 1mhs h VAL 94 Ca 0.10 -0.30 -0.05 0.00 -1.01 0.00 0.00 66.70 65.44 1mhs h VAL 94 Cb -0.01 0.16 -0.01 0.00 -2.01 0.00 0.00 31.29 29.42 1mhs h VAL 94 CO -0.02 0.16 -0.29 1.56 -1.01 0.00 0.00 177.57 177.97 1mhs h GLN 95 N 0.87 0.00 -0.83 4.17 4.20 -1.20 -3.19 115.11 119.14 1mhs h GLN 95 Ca 0.28 0.00 0.17 0.00 0.06 0.00 0.00 58.65 59.16 1mhs h GLN 95 Cb 0.05 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 27.72 1mhs h GLN 95 CO -0.08 0.75 0.36 0.00 -0.67 0.00 0.00 178.83 179.20 1mhs h ARG 96 N -1.00 0.46 -0.11 1.46 3.08 -0.33 -0.26 114.38 117.69 1mhs h ARG 96 Ca -0.07 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 59.98 1mhs h ARG 96 Cb 0.85 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.77 1mhs h ARG 96 CO -0.04 0.31 -0.05 0.00 -1.07 0.00 0.00 179.97 179.12 1mhs h ARG 97 N 0.48 -0.03 -0.17 0.04 3.08 -1.29 1.44 114.38 117.93 1mhs h ARG 97 Ca 0.47 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.53 1mhs h ARG 97 Cb 0.77 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 1mhs h ARG 97 CO -0.44 -0.02 0.11 0.00 -1.07 0.00 0.00 179.97 178.56 1mhs h ARG 98 N -0.04 0.21 0.00 0.04 3.08 -1.06 0.98 114.38 117.59 1mhs h ARG 98 Ca 0.06 -0.01 -0.32 0.00 0.07 0.00 0.00 59.98 59.77 1mhs h ARG 98 Cb 0.12 -0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.07 1mhs h ARG 98 CO -0.13 0.14 -2.22 1.63 -1.07 0.00 0.00 179.97 178.32 1mhs n LYS 99 N -4.51 1.03 -0.08 0.04 5.02 -0.72 -4.75 118.16 114.18 1mhs n LYS 99 Ca -0.00 0.02 -0.10 0.00 -2.02 0.00 0.00 58.31 56.20 1mhs n LYS 99 Cb 0.09 -1.45 -0.03 0.00 -0.02 0.00 0.00 35.03 33.62 1mhs n LYS 99 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 1mhs n TYR 100 N -2.75 0.00 0.00 2.13 9.36 0.49 -4.62 117.16 121.78 1mhs n TYR 100 Ca -0.31 0.00 0.00 0.00 3.32 0.00 0.00 57.90 60.91 1mhs n TYR 100 Cb 1.04 -0.50 0.00 0.00 -0.63 0.00 0.00 39.34 39.25 1mhs n TYR 100 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1mhs n GLY 101 N 1.64 1.17 2.77 2.98 0.00 0.34 -3.99 105.19 110.10 1mhs n GLY 101 Ca -0.17 0.29 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 1mhs n GLY 101 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1mhs n LEU 102 N 0.00 5.90 0.00 0.99 4.77 -1.26 -3.80 117.00 123.60 1mhs n LEU 102 Ca 0.00 -5.41 0.00 0.00 -0.03 0.00 0.00 56.01 50.57 1mhs n LEU 102 Cb 0.00 -0.99 0.00 0.00 -2.33 0.00 0.00 43.42 40.10 1mhs n LEU 102 CO 0.00 2.01 0.00 -0.46 -1.33 0.00 0.00 177.39 177.61 1mhs n ASN 103 N 0.47 0.00 -3.64 -1.43 0.23 -1.26 -4.57 115.26 105.07 1mhs n ASN 103 Ca 0.35 0.00 -0.06 0.00 -0.53 0.00 0.00 54.58 54.34 1mhs n ASN 103 Cb 0.33 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 37.97 1mhs n ASN 103 CO 0.00 0.00 0.00 -1.10 -0.93 0.00 0.00 177.26 175.23 1mhs s GLN 104 N 0.00 0.49 -0.13 -3.83 -0.21 -1.26 -5.01 119.66 109.71 1mhs s GLN 104 Ca 0.00 0.74 -0.20 0.00 0.02 0.00 0.00 55.36 55.92 1mhs s GLN 104 Cb 0.00 0.15 -0.04 0.00 1.00 0.00 0.00 33.01 34.12 1mhs s GLN 104 CO 0.00 -0.09 0.58 -1.64 -2.12 0.00 0.00 175.29 172.02 1mhs s MET 105 N 1.03 4.32 -0.03 2.91 -1.94 -1.26 -5.00 119.30 119.33 1mhs s MET 105 Ca -0.05 0.61 0.01 0.00 -1.71 0.00 0.00 55.69 54.54 1mhs s MET 105 Cb -0.04 -3.48 -0.03 0.00 2.01 0.00 0.00 34.83 33.28 1mhs s MET 105 CO -0.13 0.01 -0.03 0.15 -0.01 0.00 0.00 175.02 175.02 1mhs s LYS 106 N 1.06 2.77 -0.19 2.03 1.02 -1.26 -5.08 119.74 120.09 1mhs s LYS 106 Ca 0.30 -0.58 -0.10 0.00 0.02 0.00 0.00 55.97 55.61 1mhs s LYS 106 Cb -0.16 -2.65 -0.05 0.00 -0.52 0.00 0.00 37.83 34.45 1mhs s LYS 106 CO 0.12 0.64 0.13 -1.21 -0.92 0.00 0.00 175.35 174.12 1mhs s GLU 107 N -1.25 4.10 -0.23 1.68 2.02 -1.26 -5.06 118.70 118.70 1mhs s GLU 107 Ca 0.16 -0.21 -0.00 0.00 0.02 0.00 0.00 54.97 54.94 1mhs s GLU 107 Cb -0.11 -3.39 0.03 0.00 0.10 0.00 0.00 34.13 30.76 1mhs s GLU 107 CO 0.06 0.36 -0.11 -1.21 0.02 0.00 0.00 175.26 174.38 1mhs s GLU 108 N 0.19 2.82 0.07 1.61 2.02 -1.26 -5.09 118.70 119.06 1mhs s GLU 108 Ca 0.09 -0.97 0.01 0.00 0.02 0.00 0.00 54.97 54.12 1mhs s GLU 108 Cb -0.11 -2.86 -0.04 0.00 0.10 0.00 0.00 34.13 31.23 1mhs s GLU 108 CO -0.01 -0.36 -0.06 0.15 0.02 0.00 0.00 175.26 175.00 1mhs s LYS 109 N 1.29 0.66 -0.19 1.61 1.02 -1.26 -5.13 119.74 117.74 1mhs s LYS 109 Ca 0.01 -1.11 -0.05 0.00 0.02 0.00 0.00 55.97 54.83 1mhs s LYS 109 Cb -0.16 -0.08 -0.03 0.00 -0.52 0.00 0.00 37.83 37.04 1mhs s LYS 109 CO -0.07 -0.03 0.01 -1.21 -0.92 0.00 0.00 175.35 173.13 1mhs s GLU 110 N -3.14 3.73 0.00 1.68 0.41 -1.26 -4.96 118.70 115.16 1mhs s GLU 110 Ca 0.03 -0.47 0.00 0.00 -0.41 0.00 0.00 54.97 54.12 1mhs s GLU 110 Cb 0.01 -3.09 0.00 0.00 -1.78 0.00 0.00 34.13 29.27 1mhs s GLU 110 CO -0.05 0.13 0.66 0.09 -0.49 0.00 0.00 175.26 175.60 1mhs n ASN 111 N 3.92 0.25 0.00 -0.19 3.02 -1.26 -4.75 115.26 116.24 1mhs n ASN 111 Ca -0.17 -1.56 0.00 0.00 -0.03 0.00 0.00 54.58 52.82 1mhs n ASN 111 Cb 0.52 -0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.57 1mhs n ASN 111 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mhs n HIS 112 N -0.31 0.00 0.00 3.10 1.44 -1.26 -5.03 115.22 113.16 1mhs n HIS 112 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1mhs n HIS 112 Cb 0.06 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.17 1mhs n HIS 112 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 1mhs n PHE 113 N 0.00 0.00 0.12 -1.40 3.01 -1.26 0.17 117.46 118.09 1mhs n PHE 113 Ca 0.00 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.53 1mhs n PHE 113 Cb 0.00 -0.09 0.55 0.00 -0.01 0.00 0.00 39.48 39.93 1mhs n PHE 113 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1mhs h LEU 114 N 0.00 0.22 0.00 4.37 5.85 -1.95 -0.05 115.31 123.75 1mhs h LEU 114 Ca 0.00 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 1mhs h LEU 114 Cb 0.00 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 1mhs h LEU 114 CO 0.00 0.15 -1.03 0.29 -0.34 0.00 0.00 178.44 177.51 1mhs n LYS 115 N -4.50 0.44 0.32 1.25 5.02 0.44 -2.37 118.16 118.76 1mhs n LYS 115 Ca 0.01 0.18 0.22 0.00 -2.02 0.00 0.00 58.31 56.69 1mhs n LYS 115 Cb 0.12 -1.27 1.10 0.00 -0.02 0.00 0.00 35.03 34.97 1mhs n LYS 115 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 1mhs h PHE 116 N -0.82 0.00 0.00 2.13 -1.00 -1.69 -3.21 116.94 112.35 1mhs h PHE 116 Ca -0.08 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.70 1mhs h PHE 116 Cb 0.92 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.48 1mhs h PHE 116 CO -0.31 0.00 -0.93 1.28 -1.61 0.00 0.00 178.31 176.74 1mhs n LEU 117 N -3.09 0.82 0.00 1.54 4.77 -1.15 -4.68 117.00 115.21 1mhs n LEU 117 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 1mhs n LEU 117 Cb 0.13 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1mhs n LEU 117 CO 0.22 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 1mhs n GLY 118 N 3.03 0.00 2.24 -0.72 0.00 -0.04 -3.11 105.19 106.59 1mhs n GLY 118 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1mhs n GLY 118 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1mhs n PHE 119 N 0.00 3.07 -0.02 1.61 3.01 -1.11 -3.79 117.46 120.23 1mhs n PHE 119 Ca 0.00 -2.17 -0.08 0.00 1.01 0.00 0.00 57.45 56.21 1mhs n PHE 119 Cb 0.00 -1.09 -0.14 0.00 -0.01 0.00 0.00 39.48 38.25 1mhs n PHE 119 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1mhs n PHE 120 N -1.05 0.89 0.10 1.38 7.35 -1.18 -3.52 117.46 121.43 1mhs n PHE 120 Ca 0.60 0.32 -0.23 0.00 -0.76 0.00 0.00 57.45 57.38 1mhs n PHE 120 Cb 1.36 -1.15 -0.14 0.00 0.35 0.00 0.00 39.48 39.90 1mhs n PHE 120 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1mhs h VAL 121 N 0.00 1.34 -0.67 -2.13 2.07 -1.64 -3.29 116.25 111.93 1mhs h VAL 121 Ca -0.30 -2.54 0.12 0.00 0.82 0.00 0.00 66.70 64.80 1mhs h VAL 121 Cb 1.98 2.94 -0.09 0.00 -1.52 0.00 0.00 31.29 34.60 1mhs h VAL 121 CO 0.07 0.76 0.24 1.23 0.02 0.00 0.00 177.57 179.88 1mhs h GLY 122 N 0.06 0.96 0.99 2.17 0.00 -1.70 -1.83 103.07 103.73 1mhs h GLY 122 Ca -0.20 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 1mhs h GLY 122 CO 0.23 -0.07 0.34 -0.56 0.00 0.00 0.00 176.54 176.48 1mhs h PRO 123 N 0.39 0.82 -0.67 4.80 0.14 -1.63 -2.68 132.00 133.18 1mhs h PRO 123 Ca 0.35 -0.09 0.12 0.00 0.14 0.00 0.00 66.00 66.53 1mhs h PRO 123 Cb 0.50 -0.17 -0.09 0.00 0.14 0.00 0.00 31.00 31.39 1mhs h PRO 123 CO -0.37 0.61 0.23 0.82 0.14 0.00 0.00 178.00 179.43 1mhs h ILE 124 N 0.81 0.68 -0.11 -3.56 2.04 -1.40 0.26 117.51 116.23 1mhs h ILE 124 Ca 0.21 -0.13 -0.06 0.00 1.00 0.00 0.00 64.86 65.88 1mhs h ILE 124 Cb 0.02 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 36.36 1mhs h ILE 124 CO -0.04 0.07 -0.20 1.56 0.00 0.00 0.00 178.15 179.54 1mhs h GLN 125 N 0.38 0.18 -0.10 2.37 4.20 -1.29 -0.63 115.11 120.20 1mhs h GLN 125 Ca 0.35 -0.05 -0.23 0.00 0.06 0.00 0.00 58.65 58.79 1mhs h GLN 125 Cb 0.50 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.27 1mhs h GLN 125 CO -0.38 0.38 -0.84 0.35 -0.67 0.00 0.00 178.83 177.67 1mhs h PHE 126 N 0.17 0.98 0.00 2.96 3.57 -0.31 -2.75 116.94 121.55 1mhs h PHE 126 Ca 0.03 -0.46 0.00 0.00 3.53 0.00 0.00 57.97 61.07 1mhs h PHE 126 Cb 0.45 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.05 1mhs h PHE 126 CO 0.01 1.29 0.00 0.28 -2.23 0.00 0.00 178.31 177.65 1mhs h VAL 127 N 0.46 0.00 -0.35 1.41 2.07 -0.46 -1.91 116.25 117.48 1mhs h VAL 127 Ca -0.07 -0.67 -0.12 0.00 0.82 0.00 0.00 66.70 66.66 1mhs h VAL 127 Cb 1.47 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 32.87 1mhs h VAL 127 CO 0.17 0.00 -0.26 0.24 0.02 0.00 0.00 177.57 177.74 1mhs h MET 128 N 0.00 0.79 -0.38 1.57 2.86 -0.96 -0.75 114.93 118.07 1mhs h MET 128 Ca 0.00 -0.39 -0.16 0.00 -2.06 0.00 0.00 59.70 57.10 1mhs h MET 128 Cb 0.76 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.41 1mhs h MET 128 CO 0.00 1.01 -0.38 1.49 1.06 0.00 0.00 176.91 180.10 1mhs h GLU 129 N 0.58 0.92 -0.43 1.72 4.81 -1.29 -1.72 114.58 119.17 1mhs h GLU 129 Ca 0.07 -0.49 0.05 0.00 -0.13 0.00 0.00 59.36 58.86 1mhs h GLU 129 Cb 0.83 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.18 1mhs h GLU 129 CO 0.07 1.14 0.18 0.78 -0.73 0.00 0.00 179.01 180.45 1mhs h GLY 130 N 0.74 0.58 1.37 1.92 0.00 -1.20 0.15 103.07 106.63 1mhs h GLY 130 Ca 0.06 -0.11 -0.06 0.00 0.00 0.00 0.00 47.33 47.22 1mhs h GLY 130 CO 0.09 0.05 0.05 0.00 0.00 0.00 0.00 176.54 176.74 1mhs h ALA 131 N 1.26 1.17 -0.38 3.60 0.00 -1.04 0.96 119.26 124.84 1mhs h ALA 131 Ca 0.20 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1mhs h ALA 131 Cb 0.16 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1mhs h ALA 131 CO -0.18 0.55 0.15 0.00 0.00 0.00 0.00 179.25 179.76 1mhs h ALA 132 N 1.32 0.49 0.00 0.00 0.00 -0.24 -2.75 119.26 118.08 1mhs h ALA 132 Ca 0.15 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1mhs h ALA 132 Cb 0.38 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1mhs h ALA 132 CO 0.01 0.10 -0.24 -0.24 0.00 0.00 0.00 179.25 178.88 1mhs h VAL 133 N 0.47 0.00 -0.03 0.00 3.04 -0.55 -3.27 116.25 115.92 1mhs h VAL 133 Ca 0.13 -0.61 -0.17 0.00 -1.01 0.00 0.00 66.70 65.03 1mhs h VAL 133 Cb 0.20 1.46 -0.01 0.00 -2.01 0.00 0.00 31.29 30.93 1mhs h VAL 133 CO -0.01 0.00 -0.75 0.25 -1.01 0.00 0.00 177.57 176.05 1mhs h LEU 134 N 0.00 0.25 -7.53 3.16 7.12 -0.55 -3.38 115.31 114.38 1mhs h LEU 134 Ca 0.00 -0.18 -0.71 0.00 0.13 0.00 0.00 57.88 57.12 1mhs h LEU 134 Cb 0.80 -0.08 -0.12 0.00 -0.53 0.00 0.00 40.66 40.74 1mhs h LEU 134 CO 0.00 0.91 1.98 0.00 -0.13 0.00 0.00 178.44 181.20 1mhs n ALA 135 N -2.46 3.99 -2.54 1.25 0.00 -1.06 -4.94 120.51 114.74 1mhs n ALA 135 Ca -0.03 -4.03 -0.43 0.00 0.00 0.00 0.00 53.44 48.95 1mhs n ALA 135 Cb 0.72 -3.36 -0.06 0.00 0.00 0.00 0.00 19.45 16.75 1mhs n ALA 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mhs s ALA 136 N 2.90 3.33 0.00 0.00 0.00 -1.26 -3.21 121.76 123.52 1mhs s ALA 136 Ca 0.48 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 51.42 1mhs s ALA 136 Cb 0.03 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.77 1mhs s ALA 136 CO 0.03 -1.79 0.00 0.41 0.00 0.00 0.00 175.76 174.41 1mhs n GLY 137 N 4.94 0.75 3.75 0.00 0.00 -1.26 -5.09 105.19 108.28 1mhs n GLY 137 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 1mhs n GLY 137 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1mhs s LEU 138 N 0.00 3.87 0.00 0.99 2.96 -1.20 -4.91 118.68 120.39 1mhs s LEU 138 Ca 0.00 2.71 0.28 0.00 -0.22 0.00 0.00 54.13 56.90 1mhs s LEU 138 Cb 0.00 -4.27 0.98 0.00 0.50 0.00 0.00 46.19 43.41 1mhs s LEU 138 CO 0.00 -1.49 1.71 -0.62 -1.32 0.00 0.00 176.35 174.62 1mhs n GLU 139 N -0.96 1.43 -2.63 1.98 1.02 -1.26 -4.78 120.64 115.44 1mhs n GLU 139 Ca 0.10 -0.82 -0.43 0.00 -0.02 0.00 0.00 57.16 55.99 1mhs n GLU 139 Cb 0.45 -1.48 -0.02 0.00 -0.02 0.00 0.00 31.44 30.37 1mhs n GLU 139 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1mhs s ASP 140 N -2.14 6.83 -0.56 1.62 1.11 -1.26 -4.99 116.67 117.29 1mhs s ASP 140 Ca 0.34 0.86 -0.17 0.00 0.18 0.00 0.00 52.55 53.76 1mhs s ASP 140 Cb 0.21 -2.54 0.12 0.00 1.07 0.00 0.00 42.92 41.77 1mhs s ASP 140 CO 0.39 -1.00 0.57 -1.66 1.18 0.00 0.00 175.17 174.64 1mhs s TRP 141 N 3.91 3.18 0.00 4.23 1.48 -1.26 -4.31 118.94 126.17 1mhs s TRP 141 Ca 0.46 -1.20 0.00 0.00 -1.06 0.00 0.00 56.10 54.30 1mhs s TRP 141 Cb -0.11 -3.87 0.00 0.00 -1.16 0.00 0.00 33.47 28.34 1mhs s TRP 141 CO 0.21 -1.11 0.00 0.28 -4.06 0.00 0.00 176.95 172.27 1mhs n VAL 142 N 5.33 0.00 -0.23 -0.66 0.31 -1.26 -4.97 118.33 116.85 1mhs n VAL 142 Ca -0.12 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.20 1mhs n VAL 142 Cb 0.41 0.00 0.11 0.00 -0.91 0.00 0.00 33.84 33.45 1mhs n VAL 142 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1mhs h ASP 143 N 0.00 0.45 -0.74 4.52 3.58 -1.99 0.14 116.42 122.39 1mhs h ASP 143 Ca 0.00 0.05 0.11 0.00 0.42 0.00 0.00 57.03 57.61 1mhs h ASP 143 Cb 0.00 -0.03 -0.08 0.00 1.72 0.00 0.00 39.33 40.94 1mhs h ASP 143 CO 0.00 0.28 0.35 2.19 -2.88 0.00 0.00 179.24 179.18 1mhs h PHE 144 N 0.60 0.62 -0.19 0.28 -5.15 -1.89 -0.73 116.94 110.47 1mhs h PHE 144 Ca 0.31 0.03 -0.02 0.00 -0.20 0.00 0.00 57.97 58.10 1mhs h PHE 144 Cb 0.28 -0.16 -0.01 0.00 0.22 0.00 0.00 35.95 36.27 1mhs h PHE 144 CO -0.10 0.17 0.06 0.78 -2.00 0.00 0.00 178.31 177.22 1mhs h GLY 145 N 0.56 0.31 0.82 6.09 0.00 -1.53 -1.85 103.07 107.48 1mhs h GLY 145 Ca 0.38 -0.19 0.01 0.00 0.00 0.00 0.00 47.33 47.53 1mhs h GLY 145 CO -0.32 0.18 -0.11 -0.39 0.00 0.00 0.00 176.54 175.90 1mhs h VAL 146 N 0.12 0.75 -0.58 4.60 -1.51 -0.19 0.20 116.25 119.64 1mhs h VAL 146 Ca 0.06 0.00 0.01 0.00 -1.23 0.00 0.00 66.70 65.54 1mhs h VAL 146 Cb 0.24 0.75 -0.03 0.00 -2.13 0.00 0.00 31.29 30.11 1mhs h VAL 146 CO -0.00 0.00 0.37 0.16 -1.23 0.00 0.00 177.57 176.87 1mhs h ILE 147 N -0.22 1.11 -0.99 7.19 -0.00 -1.17 0.19 117.51 123.63 1mhs h ILE 147 Ca 0.02 -0.26 0.04 0.00 -0.00 0.00 0.00 64.86 64.65 1mhs h ILE 147 Cb 0.23 0.29 -0.06 0.00 -0.00 0.00 0.00 36.82 37.29 1mhs h ILE 147 CO -0.05 0.14 0.65 0.00 -0.00 0.00 0.00 178.15 178.88 1mhs h GLY 149 N 1.26 -0.52 0.87 0.00 0.00 0.68 -2.11 103.07 103.25 1mhs h GLY 149 Ca 0.40 0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.92 1mhs h GLY 149 CO -0.13 -0.19 -0.15 -2.00 0.00 0.00 0.00 176.54 174.08 1mhs h LEU 150 N -0.56 -0.38 -1.48 3.11 5.85 -0.26 -2.19 115.31 119.39 1mhs h LEU 150 Ca -0.05 0.03 0.25 0.00 0.84 0.00 0.00 57.88 58.95 1mhs h LEU 150 Cb 0.42 0.12 -0.08 0.00 0.37 0.00 0.00 40.66 41.50 1mhs h LEU 150 CO 0.08 -0.23 0.66 -0.07 -0.34 0.00 0.00 178.44 178.54 1mhs h LEU 151 N -0.35 0.39 -0.32 2.25 3.38 -0.54 0.36 115.31 120.48 1mhs h LEU 151 Ca -0.01 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1mhs h LEU 151 Cb 0.31 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1mhs h LEU 151 CO -0.01 0.11 0.06 0.25 0.09 0.00 0.00 178.44 178.95 1mhs h LEU 152 N 0.36 0.49 -0.22 1.67 5.85 -0.76 -2.16 115.31 120.54 1mhs h LEU 152 Ca 0.54 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 59.03 1mhs h LEU 152 Cb 1.44 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.32 1mhs h LEU 152 CO -0.22 0.61 0.11 -0.07 -0.34 0.00 0.00 178.44 178.53 1mhs h LEU 153 N 0.35 0.17 -0.72 2.25 3.38 0.00 0.10 115.31 120.84 1mhs h LEU 153 Ca 0.10 0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.18 1mhs h LEU 153 Cb 0.32 -0.02 -0.08 0.00 0.09 0.00 0.00 40.66 40.97 1mhs h LEU 153 CO 0.00 0.13 0.34 -1.13 0.09 0.00 0.00 178.44 177.88 1mhs h ASN 154 N 0.24 0.42 0.50 -0.43 -0.00 -0.99 -2.55 115.58 112.77 1mhs h ASN 154 Ca 0.09 0.07 -0.02 0.00 -0.00 0.00 0.00 56.30 56.44 1mhs h ASN 154 Cb 0.02 0.01 0.00 0.00 -0.00 0.00 0.00 38.32 38.35 1mhs h ASN 154 CO -0.06 0.23 -0.24 0.00 -0.00 0.00 0.00 177.43 177.36 1mhs h ALA 155 N 1.46 -1.05 -0.37 1.57 0.00 -0.81 -0.87 119.26 119.19 1mhs h ALA 155 Ca 0.37 -0.15 0.11 0.00 0.00 0.00 0.00 54.91 55.24 1mhs h ALA 155 Cb 0.43 0.26 -0.07 0.00 0.00 0.00 0.00 17.79 18.41 1mhs h ALA 155 CO -0.30 -1.00 0.05 0.28 0.00 0.00 0.00 179.25 178.28 1mhs n VAL 156 N -4.01 -0.16 -0.13 0.00 0.31 0.30 1.14 118.33 115.78 1mhs n VAL 156 Ca -0.08 0.80 -0.12 0.00 -0.01 0.00 0.00 64.34 64.93 1mhs n VAL 156 Cb 0.26 -1.20 -0.02 0.00 -0.91 0.00 0.00 33.84 31.97 1mhs n VAL 156 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1mhs h VAL 157 N 0.00 1.28 -0.02 2.52 2.07 -1.27 -1.94 116.25 118.89 1mhs h VAL 157 Ca 0.24 -1.33 0.02 0.00 0.82 0.00 0.00 66.70 66.46 1mhs h VAL 157 Cb 0.54 1.30 -0.05 0.00 -1.52 0.00 0.00 31.29 31.56 1mhs h VAL 157 CO -0.34 0.44 -0.50 1.23 0.02 0.00 0.00 177.57 178.43 1mhs h GLY 158 N 0.62 -1.15 0.84 2.17 0.00 7.17 0.46 103.07 113.19 1mhs h GLY 158 Ca 0.09 0.67 -0.00 0.00 0.00 0.00 0.00 47.33 48.08 1mhs h GLY 158 CO 0.06 -0.25 0.01 0.74 0.00 0.00 0.00 176.54 177.10 1mhs h PHE 159 N -0.61 0.04 -0.54 5.60 0.04 -0.98 -2.93 116.94 117.56 1mhs h PHE 159 Ca 0.01 -0.00 0.11 0.00 2.80 0.00 0.00 57.97 60.89 1mhs h PHE 159 Cb 0.66 -0.01 -0.10 0.00 2.20 0.00 0.00 35.95 38.70 1mhs h PHE 159 CO -0.52 0.19 -0.11 0.28 -0.60 0.00 0.00 178.31 177.56 1mhs h VAL 160 N -0.13 0.48 -0.73 -0.55 2.07 -1.14 0.10 116.25 116.36 1mhs h VAL 160 Ca 0.01 -0.01 0.04 0.00 0.82 0.00 0.00 66.70 67.56 1mhs h VAL 160 Cb 0.17 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.36 1mhs h VAL 160 CO -0.00 0.00 0.48 1.56 0.02 0.00 0.00 177.57 179.63 1mhs h GLN 161 N 0.02 0.84 0.00 1.57 4.20 -0.84 -2.86 115.11 118.03 1mhs h GLN 161 Ca 0.26 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.87 1mhs h GLN 161 Cb 0.41 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1mhs h GLN 161 CO -0.53 0.55 -0.75 0.93 -0.67 0.00 0.00 178.83 178.36 1mhs h GLU 162 N 0.86 0.00 0.08 1.46 5.08 -0.85 -3.41 114.58 117.80 1mhs h GLU 162 Ca 0.29 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.46 1mhs h GLU 162 Cb 0.09 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.36 1mhs h GLU 162 CO -0.09 0.13 -0.80 0.35 -1.00 0.00 0.00 179.01 177.61 1mhs h PHE 163 N 0.00 0.66 -0.68 4.33 3.57 -0.64 -3.38 116.94 120.80 1mhs h PHE 163 Ca -0.03 -0.41 -0.03 0.00 3.53 0.00 0.00 57.97 61.03 1mhs h PHE 163 Cb 1.18 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.83 1mhs h PHE 163 CO 0.00 1.27 0.31 1.96 -2.23 0.00 0.00 178.31 179.62 1mhs h GLN 164 N -0.14 0.97 -0.22 1.11 4.20 -1.78 -2.93 115.11 116.32 1mhs h GLN 164 Ca -0.12 -0.14 -0.06 0.00 0.06 0.00 0.00 58.65 58.39 1mhs h GLN 164 Cb 1.55 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 29.14 1mhs h GLN 164 CO 0.15 0.76 -0.12 0.00 -0.67 0.00 0.00 178.83 178.95 1mhs h ALA 165 N 1.38 1.40 -0.13 3.87 0.00 -1.84 -2.00 119.26 121.93 1mhs h ALA 165 Ca 0.23 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1mhs h ALA 165 Cb 0.12 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1mhs h ALA 165 CO -0.03 0.42 0.04 0.78 0.00 0.00 0.00 179.25 180.46 1mhs h GLY 166 N 0.83 0.23 2.00 0.00 0.00 -1.71 -2.90 103.07 101.53 1mhs h GLY 166 Ca 0.07 -0.14 -0.09 0.00 0.00 0.00 0.00 47.33 47.16 1mhs h GLY 166 CO 0.02 0.13 -0.45 1.48 0.00 0.00 0.00 176.54 177.73 1mhs h SER 167 N 0.03 0.00 -0.59 0.19 4.64 -1.56 -3.03 113.55 113.23 1mhs h SER 167 Ca 0.04 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.34 1mhs h SER 167 Cb 0.24 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.30 1mhs h SER 167 CO -0.00 0.45 0.31 0.40 -0.87 0.00 0.00 176.83 177.11 1mhs h ILE 168 N 0.00 1.20 -0.13 0.95 2.04 -1.16 -2.50 117.51 117.90 1mhs h ILE 168 Ca -0.00 -0.54 -0.12 0.00 1.00 0.00 0.00 64.86 65.20 1mhs h ILE 168 Cb 0.80 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 1mhs h ILE 168 CO 0.06 0.23 -0.43 0.58 0.00 0.00 0.00 178.15 178.59 1mhs h VAL 169 N 0.86 1.32 -0.34 1.67 2.07 -1.40 -2.76 116.25 117.67 1mhs h VAL 169 Ca 0.22 -1.58 -0.04 0.00 0.82 0.00 0.00 66.70 66.12 1mhs h VAL 169 Cb 0.07 1.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 1mhs h VAL 169 CO -0.03 0.48 0.04 0.44 0.02 0.00 0.00 177.57 178.52 1mhs h ASP 170 N 0.26 0.48 -0.00 0.57 5.19 -1.52 -2.17 116.42 119.22 1mhs h ASP 170 Ca 0.02 -0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 1mhs h ASP 170 Cb 0.87 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 40.25 1mhs h ASP 170 CO 0.07 0.52 0.00 -0.62 -3.12 0.00 0.00 179.24 176.09 1mhs n GLU 171 N -4.31 1.02 0.02 3.56 1.02 -1.04 -3.12 120.64 117.78 1mhs n GLU 171 Ca 0.02 -0.03 0.11 0.00 -0.02 0.00 0.00 57.16 57.24 1mhs n GLU 171 Cb 0.21 -1.44 0.03 0.00 -0.02 0.00 0.00 31.44 30.23 1mhs n GLU 171 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1mhs n LEU 172 N -0.91 0.64 -4.78 -4.62 4.77 -0.82 -4.82 117.00 106.47 1mhs n LEU 172 Ca 0.21 -0.09 -0.35 0.00 -0.03 0.00 0.00 56.01 55.75 1mhs n LEU 172 Cb 0.10 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 1mhs n LEU 172 CO 0.16 0.09 0.78 -0.54 -1.33 0.00 0.00 177.39 176.55 1mhs s LYS 173 N -3.14 3.57 0.00 3.23 -0.14 -1.18 -3.92 119.74 118.16 1mhs s LYS 173 Ca 0.05 1.61 0.00 0.00 -1.36 0.00 0.00 55.97 56.27 1mhs s LYS 173 Cb 0.15 -2.15 0.00 0.00 -1.68 0.00 0.00 37.83 34.15 1mhs s LYS 173 CO 0.80 -0.67 0.00 1.17 -0.76 0.00 0.00 175.35 175.89 1mhs n LYS 174 N -0.97 0.00 -2.42 1.68 0.00 -1.26 -4.53 118.16 110.66 1mhs n LYS 174 Ca 0.10 0.30 -0.25 0.00 0.00 0.00 0.00 58.31 58.45 1mhs n LYS 174 Cb 0.50 -2.52 0.14 0.00 0.00 0.00 0.00 35.03 33.15 1mhs n LYS 174 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1mhs s THR 175 N -2.00 2.06 -0.25 3.15 -4.23 -1.25 -4.97 115.64 108.14 1mhs s THR 175 Ca 0.00 -0.44 0.01 0.00 -1.18 0.00 0.00 61.69 60.07 1mhs s THR 175 Cb 0.00 -2.61 0.07 0.00 1.34 0.00 0.00 72.50 71.30 1mhs s THR 175 CO 0.00 0.00 -0.02 -0.76 -0.54 0.00 0.00 174.62 173.30 1mhs s LEU 176 N -5.37 2.60 0.00 4.79 1.43 -1.26 -4.14 118.68 116.73 1mhs s LEU 176 Ca 0.69 -1.29 0.00 0.00 -1.03 0.00 0.00 54.13 52.50 1mhs s LEU 176 Cb -0.04 -1.12 0.00 0.00 0.03 0.00 0.00 46.19 45.05 1mhs s LEU 176 CO 0.47 -0.28 0.00 0.00 0.23 0.00 0.00 176.35 176.77 1mhs n ALA 177 N 4.69 0.00 -3.40 4.21 0.00 -1.26 -4.92 120.51 119.83 1mhs n ALA 177 Ca -0.09 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.19 1mhs n ALA 177 Cb 0.44 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.82 1mhs n ALA 177 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1mhs s LEU 178 N 0.00 -0.15 0.00 0.00 2.96 -1.26 -4.74 118.68 115.49 1mhs s LEU 178 Ca 0.00 0.43 0.00 0.00 -0.22 0.00 0.00 54.13 54.34 1mhs s LEU 178 Cb 0.00 2.13 0.00 0.00 0.50 0.00 0.00 46.19 48.82 1mhs s LEU 178 CO 0.00 -0.60 0.00 2.29 -1.32 0.00 0.00 176.35 176.72 1mhs n LYS 179 N 0.87 0.00 0.00 1.98 0.00 -1.26 -4.79 118.16 114.96 1mhs n LYS 179 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.12 1mhs n LYS 179 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.61 1mhs n LYS 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1mhs n ALA 180 N 0.24 0.00 -2.81 0.58 0.00 -1.24 -3.67 120.51 113.61 1mhs n ALA 180 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1mhs n ALA 180 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 1mhs n ALA 180 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1mhs s VAL 181 N 0.00 4.48 0.08 0.00 -7.23 -1.26 0.11 120.40 116.58 1mhs s VAL 181 Ca 0.00 -0.16 -0.00 0.00 -1.81 0.00 0.00 61.98 60.01 1mhs s VAL 181 Cb 0.00 -2.96 -0.04 0.00 0.56 0.00 0.00 36.38 33.94 1mhs s VAL 181 CO 0.00 0.53 -0.01 0.54 -0.31 0.00 0.00 175.10 175.85 1mhs s VAL 182 N -0.17 0.29 -0.33 1.32 0.11 2.26 -2.63 120.40 121.24 1mhs s VAL 182 Ca 0.06 -1.86 -0.12 0.00 -2.93 0.00 0.00 61.98 57.13 1mhs s VAL 182 Cb -0.12 -1.69 -0.01 0.00 -1.53 0.00 0.00 36.38 33.02 1mhs s VAL 182 CO 0.02 -0.84 0.21 -0.76 -3.33 0.00 0.00 175.10 170.40 1mhs s LEU 183 N -2.98 4.42 0.04 2.54 1.43 0.29 0.40 118.68 124.81 1mhs s LEU 183 Ca 0.12 -0.50 0.00 0.00 -1.03 0.00 0.00 54.13 52.72 1mhs s LEU 183 Cb 0.07 -2.09 0.00 0.00 0.03 0.00 0.00 46.19 44.21 1mhs s LEU 183 CO -0.06 -0.24 0.00 0.54 0.23 0.00 0.00 176.35 176.82 1mhs n ARG 184 N 5.06 0.00 0.00 1.70 1.74 -1.26 -4.24 116.66 119.66 1mhs n ARG 184 Ca -0.13 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 1mhs n ARG 184 Cb 0.49 -0.01 0.00 0.00 -1.02 0.00 0.00 32.46 31.92 1mhs n ARG 184 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1mhs n ASP 185 N -2.65 0.00 -0.29 0.55 9.92 -1.26 -4.85 116.55 117.97 1mhs n ASP 185 Ca 0.00 0.00 0.14 0.00 -0.53 0.00 0.00 54.79 54.40 1mhs n ASP 185 Cb 0.00 0.00 0.56 0.00 -0.64 0.00 0.00 41.12 41.04 1mhs n ASP 185 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1mhs n GLY 186 N 0.60 -0.46 3.15 0.44 0.00 -1.26 -4.86 105.19 102.80 1mhs n GLY 186 Ca 0.00 -0.37 -0.08 0.00 0.00 0.00 0.00 46.02 45.57 1mhs n GLY 186 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mhs s THR 187 N -2.22 0.18 0.33 2.61 2.01 -1.26 -5.13 115.64 112.15 1mhs s THR 187 Ca 0.34 -1.45 -0.29 0.00 0.31 0.00 0.00 61.69 60.60 1mhs s THR 187 Cb 0.20 -1.40 -0.12 0.00 0.01 0.00 0.00 72.50 71.19 1mhs s THR 187 CO 0.41 -0.80 1.40 0.18 -0.69 0.00 0.00 174.62 175.12 1mhs n LEU 188 N 0.04 3.89 -4.23 4.42 4.32 -1.26 -4.18 117.00 120.00 1mhs n LEU 188 Ca -0.15 1.19 -0.17 0.00 -0.02 0.00 0.00 56.01 56.87 1mhs n LEU 188 Cb 0.62 -1.52 -0.11 0.00 -1.62 0.00 0.00 43.42 40.78 1mhs n LEU 188 CO 0.25 -0.24 -0.44 -0.54 -1.22 0.00 0.00 177.39 175.20 1mhs s LYS 189 N -1.47 0.99 -0.07 3.23 1.02 1.31 -4.34 119.74 120.40 1mhs s LYS 189 Ca 0.58 -1.24 -0.08 0.00 0.02 0.00 0.00 55.97 55.26 1mhs s LYS 189 Cb -0.55 -0.81 -0.04 0.00 -0.52 0.00 0.00 37.83 35.90 1mhs s LYS 189 CO 0.58 0.15 0.21 -1.21 -0.92 0.00 0.00 175.35 174.16 1mhs s GLU 190 N -2.76 3.54 0.15 1.68 2.02 -1.26 0.56 118.70 122.63 1mhs s GLU 190 Ca 0.09 -0.04 -0.21 0.00 0.02 0.00 0.00 54.97 54.82 1mhs s GLU 190 Cb -0.04 -3.17 0.06 0.00 0.10 0.00 0.00 34.13 31.08 1mhs s GLU 190 CO 0.02 0.74 0.55 -1.50 0.02 0.00 0.00 175.26 175.10 1mhs s ILE 191 N -1.10 0.02 0.44 -1.63 -1.16 0.29 -4.79 121.20 113.27 1mhs s ILE 191 Ca 0.19 -0.14 -0.24 0.00 -0.51 0.00 0.00 60.65 59.96 1mhs s ILE 191 Cb -0.13 -1.04 -0.08 0.00 0.61 0.00 0.00 42.46 41.82 1mhs s ILE 191 CO 0.08 -0.07 1.18 -1.83 -2.81 0.00 0.00 174.94 171.49 1mhs s GLU 192 N -3.75 3.85 0.18 3.50 -1.05 -1.26 -3.72 118.70 116.45 1mhs s GLU 192 Ca 0.01 1.82 -0.14 0.00 -0.15 0.00 0.00 54.97 56.52 1mhs s GLU 192 Cb -0.00 -2.51 0.15 0.00 -0.44 0.00 0.00 34.13 31.33 1mhs s GLU 192 CO -0.13 -0.49 1.71 0.00 0.95 0.00 0.00 175.26 177.31 1mhs h ALA 193 N 2.26 0.47 -0.73 -0.84 0.00 -1.87 2.65 119.26 121.20 1mhs h ALA 193 Ca -0.49 0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.56 1mhs h ALA 193 Cb 1.24 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 19.14 1mhs h ALA 193 CO 0.61 -0.34 0.45 -1.35 0.00 0.00 0.00 179.25 178.63 1mhs h PRO 194 N 0.19 0.85 -0.14 0.00 0.11 -1.93 -1.28 132.00 129.80 1mhs h PRO 194 Ca 0.22 -0.05 -0.20 0.00 0.11 0.00 0.00 66.00 66.08 1mhs h PRO 194 Cb 0.30 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.22 1mhs h PRO 194 CO -0.31 0.56 -0.73 1.49 -0.21 0.00 0.00 178.00 178.81 1mhs h GLU 195 N 0.88 0.66 -5.13 1.05 4.81 -1.57 -3.39 114.58 111.89 1mhs h GLU 195 Ca 0.30 -0.52 -0.03 0.00 -0.13 0.00 0.00 59.36 58.98 1mhs h GLU 195 Cb 0.05 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1mhs h GLU 195 CO -0.12 1.14 0.31 1.33 -0.73 0.00 0.00 179.01 180.93 1mhs n VAL 196 N -3.91 0.00 -2.12 0.32 0.24 0.88 -4.83 118.33 108.90 1mhs n VAL 196 Ca -0.06 -0.25 -0.33 0.00 -2.04 0.00 0.00 64.34 61.67 1mhs n VAL 196 Cb 0.71 -1.55 0.00 0.00 -1.47 0.00 0.00 33.84 31.53 1mhs n VAL 196 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 1mhs s VAL 197 N 12.91 3.99 0.33 3.34 -7.23 -1.26 -4.85 120.40 127.64 1mhs s VAL 197 Ca 0.77 0.94 -0.29 0.00 -1.81 0.00 0.00 61.98 61.59 1mhs s VAL 197 Cb -0.13 -3.47 -0.11 0.00 0.56 0.00 0.00 36.38 33.23 1mhs s VAL 197 CO 0.16 -0.56 1.56 -2.16 -0.31 0.00 0.00 175.10 173.80 1mhs s PRO 198 N -4.09 4.10 0.00 4.82 0.04 -1.26 -3.50 135.00 135.11 1mhs s PRO 198 Ca 0.62 2.60 0.00 0.00 0.04 0.00 0.00 61.00 64.27 1mhs s PRO 198 Cb -0.14 -2.99 0.00 0.00 0.04 0.00 0.00 34.50 31.40 1mhs s PRO 198 CO 0.36 -0.61 0.00 0.41 0.04 0.00 0.00 177.00 177.20 1mhs n GLY 199 N 1.40 3.43 3.76 0.56 0.00 0.49 -1.98 105.19 112.86 1mhs n GLY 199 Ca 0.05 -0.84 -0.40 0.00 0.00 0.00 0.00 46.02 44.84 1mhs n GLY 199 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1mhs s ASP 200 N 0.00 5.75 -0.22 1.61 1.11 -1.23 -4.55 116.67 119.14 1mhs s ASP 200 Ca 0.00 2.91 -0.29 0.00 0.18 0.00 0.00 52.55 55.35 1mhs s ASP 200 Cb 0.00 -2.65 -0.00 0.00 1.07 0.00 0.00 42.92 41.34 1mhs s ASP 200 CO 0.00 -1.26 1.17 -0.63 1.18 0.00 0.00 175.17 175.63 1mhs s ILE 201 N -1.21 4.43 0.16 0.77 -1.09 -1.26 -3.21 121.20 119.78 1mhs s ILE 201 Ca 0.63 1.70 0.05 0.00 -2.23 0.00 0.00 60.65 60.79 1mhs s ILE 201 Cb -0.44 -4.18 -0.04 0.00 -1.58 0.00 0.00 42.46 36.23 1mhs s ILE 201 CO 0.55 -0.24 0.16 -0.76 -1.23 0.00 0.00 174.94 173.43 1mhs s LEU 202 N 3.53 3.89 -0.17 2.97 2.01 0.31 -0.55 118.68 130.67 1mhs s LEU 202 Ca 0.50 -0.08 -0.01 0.00 0.01 0.00 0.00 54.13 54.55 1mhs s LEU 202 Cb -0.18 -2.50 0.05 0.00 0.01 0.00 0.00 46.19 43.57 1mhs s LEU 202 CO 0.13 0.07 -0.01 -1.58 1.01 0.00 0.00 176.35 175.97 1mhs s GLN 203 N -3.12 1.03 -0.16 1.70 0.74 -1.08 -1.05 119.66 117.72 1mhs s GLN 203 Ca 0.32 -0.45 -0.08 0.00 0.05 0.00 0.00 55.36 55.20 1mhs s GLN 203 Cb -0.10 -1.97 -0.04 0.00 1.10 0.00 0.00 33.01 31.99 1mhs s GLN 203 CO 0.24 -0.52 0.10 0.54 -0.55 0.00 0.00 175.29 175.11 1mhs s VAL 204 N 1.74 5.16 0.00 1.34 0.11 -0.07 -4.67 120.40 124.02 1mhs s VAL 204 Ca -0.00 0.09 0.00 0.00 -2.93 0.00 0.00 61.98 59.14 1mhs s VAL 204 Cb -0.16 -3.30 0.00 0.00 -1.53 0.00 0.00 36.38 31.39 1mhs s VAL 204 CO -0.07 0.51 0.00 -0.62 -3.33 0.00 0.00 175.10 171.59 1mhs n GLU 205 N 2.96 2.92 -2.53 1.54 1.02 -1.26 0.57 120.64 125.85 1mhs n GLU 205 Ca -0.18 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.55 1mhs n GLU 205 Cb 0.53 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.92 1mhs n GLU 205 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1mhs s GLU 206 N -0.38 4.52 0.00 3.49 2.02 -1.22 -3.37 118.70 123.76 1mhs s GLU 206 Ca 0.00 1.66 0.00 0.00 0.02 0.00 0.00 54.97 56.65 1mhs s GLU 206 Cb 0.00 -3.35 0.00 0.00 0.10 0.00 0.00 34.13 30.88 1mhs s GLU 206 CO 0.00 -0.09 0.00 0.41 0.02 0.00 0.00 175.26 175.60 1mhs n GLY 207 N 2.77 2.11 3.87 -1.39 0.00 0.21 -4.74 105.19 108.01 1mhs n GLY 207 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 1mhs n GLY 207 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1mhs s THR 208 N -3.06 4.67 -0.10 2.61 -1.32 -1.22 -4.76 115.64 112.47 1mhs s THR 208 Ca 0.00 0.83 -0.01 0.00 -1.21 0.00 0.00 61.69 61.30 1mhs s THR 208 Cb 0.00 -3.85 -0.03 0.00 -1.51 0.00 0.00 72.50 67.11 1mhs s THR 208 CO 0.00 -1.11 -0.06 -0.51 -2.21 0.00 0.00 174.62 170.72 1mhs s ILE 209 N -3.16 3.72 -0.37 5.08 1.10 -1.26 -1.49 121.20 124.82 1mhs s ILE 209 Ca 0.55 -0.45 -0.28 0.00 -0.51 0.00 0.00 60.65 59.96 1mhs s ILE 209 Cb -0.11 -2.55 -0.03 0.00 0.15 0.00 0.00 42.46 39.91 1mhs s ILE 209 CO 0.53 0.57 1.99 -0.63 -2.11 0.00 0.00 174.94 175.29 1mhs s ILE 210 N -0.41 3.29 0.53 2.00 1.01 -1.08 -4.87 121.20 121.66 1mhs s ILE 210 Ca 0.06 0.26 0.19 0.00 0.00 0.00 0.00 60.65 61.16 1mhs s ILE 210 Cb -0.12 -3.46 0.30 0.00 0.01 0.00 0.00 42.46 39.18 1mhs s ILE 210 CO 0.02 -0.35 2.13 -0.65 0.00 0.00 0.00 174.94 176.09 1mhs h PRO 211 N 14.63 0.00 -2.69 2.79 0.11 -1.87 -3.37 132.00 141.60 1mhs h PRO 211 Ca -0.33 0.00 0.12 0.00 0.11 0.00 0.00 66.00 65.90 1mhs h PRO 211 Cb 1.20 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.24 1mhs h PRO 211 CO 1.06 0.00 0.35 0.00 -0.21 0.00 0.00 178.00 179.20 1mhs s ALA 212 N -5.03 -1.42 -0.12 -0.75 0.00 -1.25 -4.89 121.76 108.30 1mhs s ALA 212 Ca -0.05 -0.12 -0.29 0.00 0.00 0.00 0.00 51.96 51.50 1mhs s ALA 212 Cb 0.17 0.75 -0.06 0.00 0.00 0.00 0.00 23.12 23.99 1mhs s ALA 212 CO 0.67 -1.04 2.00 0.34 0.00 0.00 0.00 175.76 177.73 1mhs s ASP 213 N -2.93 6.02 -0.05 0.00 2.15 -0.78 -4.32 116.67 116.76 1mhs s ASP 213 Ca 0.12 2.13 0.05 0.00 0.43 0.00 0.00 52.55 55.28 1mhs s ASP 213 Cb -0.04 -2.52 -0.00 0.00 -0.30 0.00 0.00 42.92 40.06 1mhs s ASP 213 CO 0.05 -1.47 -0.18 -0.83 -0.17 0.00 0.00 175.17 172.56 1mhs s GLY 214 N 5.98 0.98 -0.50 2.66 0.00 0.85 -1.10 107.32 116.19 1mhs s GLY 214 Ca 0.90 -0.74 -0.22 0.00 0.00 0.00 0.00 44.72 44.66 1mhs s GLY 214 CO 0.36 -0.39 0.76 1.09 0.00 0.00 0.00 173.10 174.92 1mhs s ARG 215 N 0.03 3.25 0.35 2.90 1.04 0.78 0.42 118.95 127.72 1mhs s ARG 215 Ca -0.04 -0.50 -0.28 0.00 -1.04 0.00 0.00 55.73 53.87 1mhs s ARG 215 Cb -0.12 -4.04 -0.12 0.00 -2.04 0.00 0.00 34.95 28.63 1mhs s ARG 215 CO 0.03 -1.27 1.39 -0.89 -0.04 0.00 0.00 175.30 174.52 1mhs n ILE 216 N 5.92 1.90 -0.12 4.99 5.41 0.09 -2.22 119.36 135.33 1mhs n ILE 216 Ca -0.02 -0.48 -0.19 0.00 1.00 0.00 0.00 62.75 63.07 1mhs n ILE 216 Cb 0.47 -1.75 -0.10 0.00 -0.71 0.00 0.00 39.64 37.55 1mhs n ILE 216 CO 0.00 0.00 0.00 0.55 0.00 0.00 0.00 176.55 177.10 1mhs n VAL 217 N 0.53 1.30 -1.13 1.39 3.14 0.72 -3.12 118.33 121.17 1mhs n VAL 217 Ca 0.04 -0.45 0.00 0.00 -2.96 0.00 0.00 64.34 60.97 1mhs n VAL 217 Cb 0.37 -1.45 0.00 0.00 -1.06 0.00 0.00 33.84 31.70 1mhs n VAL 217 CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 1mhs n THR 218 N -3.43 0.00 0.00 1.55 5.66 -1.11 -4.69 114.28 112.26 1mhs n THR 218 Ca -0.42 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.58 1mhs n THR 218 Cb 0.90 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.68 1mhs n THR 218 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1mhs n ASP 219 N 3.00 0.00 -3.89 1.09 8.00 -1.26 0.45 116.55 123.94 1mhs n ASP 219 Ca 0.00 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.13 1mhs n ASP 219 Cb 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.13 1mhs n ASP 219 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1mhs n ASP 220 N 0.00 -2.90 0.00 -2.24 2.03 -0.81 -4.91 116.55 107.72 1mhs n ASP 220 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1mhs n ASP 220 Cb 0.00 -0.49 0.00 0.00 -0.72 0.00 0.00 41.12 39.91 1mhs n ASP 220 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1mhs n ALA 221 N -3.40 0.00 -2.71 -1.67 0.00 -1.26 -4.73 120.51 106.74 1mhs n ALA 221 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.08 1mhs n ALA 221 Cb 0.73 0.07 -0.08 0.00 0.00 0.00 0.00 19.45 20.16 1mhs n ALA 221 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1mhs s PHE 222 N -0.61 3.18 -0.28 0.00 0.40 -1.26 -5.09 117.98 114.32 1mhs s PHE 222 Ca 0.00 0.17 0.03 0.00 -0.60 0.00 0.00 56.93 56.53 1mhs s PHE 222 Cb 0.00 -1.74 0.07 0.00 0.51 0.00 0.00 43.02 41.86 1mhs s PHE 222 CO 0.00 0.50 -0.07 -1.17 0.70 0.00 0.00 175.22 175.18 1mhs s LEU 223 N -1.34 3.78 -0.03 -0.37 1.98 -1.26 -3.34 118.68 118.10 1mhs s LEU 223 Ca 0.18 -1.58 -0.02 0.00 -2.89 0.00 0.00 54.13 49.82 1mhs s LEU 223 Cb -0.12 -1.58 -0.04 0.00 0.66 0.00 0.00 46.19 45.12 1mhs s LEU 223 CO 0.08 -0.24 0.10 -1.10 -1.89 0.00 0.00 176.35 173.30 1mhs s GLN 224 N 1.06 3.17 -0.04 1.98 -1.52 -1.03 -1.90 119.66 121.38 1mhs s GLN 224 Ca -0.04 -0.39 -0.13 0.00 -1.95 0.00 0.00 55.36 52.85 1mhs s GLN 224 Cb -0.20 -2.94 0.02 0.00 -0.22 0.00 0.00 33.01 29.67 1mhs s GLN 224 CO -0.06 0.68 0.29 0.54 -0.25 0.00 0.00 175.29 176.50 1mhs s VAL 225 N -1.15 0.05 -0.30 1.09 0.11 -0.74 -3.54 120.40 115.92 1mhs s VAL 225 Ca 0.21 -0.38 -0.11 0.00 -2.93 0.00 0.00 61.98 58.77 1mhs s VAL 225 Cb -0.12 -0.55 -0.03 0.00 -1.53 0.00 0.00 36.38 34.15 1mhs s VAL 225 CO 0.12 -0.21 0.18 -0.62 -3.33 0.00 0.00 175.10 171.24 1mhs s ASP 226 N -0.96 5.82 0.00 3.54 2.15 0.29 0.12 116.67 127.62 1mhs s ASP 226 Ca -0.10 -0.27 0.22 0.00 0.43 0.00 0.00 52.55 52.82 1mhs s ASP 226 Cb -0.05 -2.07 0.60 0.00 -0.30 0.00 0.00 42.92 41.09 1mhs s ASP 226 CO 0.03 -0.14 1.50 0.00 -0.17 0.00 0.00 175.17 176.40 1mhs n GLN 227 N 5.04 2.70 -0.08 4.34 1.13 -1.26 -1.28 117.38 127.97 1mhs n GLN 227 Ca -0.14 -2.58 -0.09 0.00 -1.94 0.00 0.00 57.00 52.25 1mhs n GLN 227 Cb 0.51 -1.55 -0.03 0.00 0.11 0.00 0.00 30.24 29.28 1mhs n GLN 227 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 1mhs h SER 228 N 4.20 -1.15 -1.28 1.08 0.02 -1.76 0.36 113.55 115.02 1mhs h SER 228 Ca 0.00 0.18 0.44 0.00 -0.84 0.00 0.00 61.79 61.57 1mhs h SER 228 Cb 0.98 0.51 -0.14 0.00 0.14 0.00 0.00 62.40 63.89 1mhs h SER 228 CO 0.00 -0.35 0.81 0.00 -1.14 0.00 0.00 176.83 176.15 1mhs h ALA 229 N 0.56 2.65 -0.44 3.77 0.00 -1.94 -3.02 119.26 120.83 1mhs h ALA 229 Ca 0.14 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1mhs h ALA 229 Cb 0.56 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1mhs h ALA 229 CO -0.49 -1.32 0.00 -0.11 0.00 0.00 0.00 179.25 177.33 1mhs n LEU 230 N -4.80 0.16 0.00 0.00 7.94 -0.03 -5.03 117.00 115.24 1mhs n LEU 230 Ca 0.38 0.15 0.00 0.00 -1.11 0.00 0.00 56.01 55.43 1mhs n LEU 230 Cb 1.43 -0.43 0.00 0.00 0.53 0.00 0.00 43.42 44.95 1mhs n LEU 230 CO 0.17 -0.43 0.00 0.41 -1.11 0.00 0.00 177.39 176.43 1mhs n THR 231 N -2.15 0.00 -4.20 1.96 -1.04 0.11 -4.77 114.28 104.19 1mhs n THR 231 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.90 1mhs n THR 231 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 1mhs n THR 231 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1mhs n GLY 232 N 5.00 3.65 2.05 3.41 0.00 -1.26 -4.58 105.19 113.46 1mhs n GLY 232 Ca 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.09 1mhs n GLY 232 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1mhs n GLU 233 N -0.38 -4.35 0.00 1.61 0.28 -1.26 -4.38 120.64 112.16 1mhs n GLU 233 Ca -0.01 3.08 0.09 0.00 -0.16 0.00 0.00 57.16 60.16 1mhs n GLU 233 Cb 0.28 -3.56 0.52 0.00 1.43 0.00 0.00 31.44 30.11 1mhs n GLU 233 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1mhs n SER 234 N 1.88 0.00 -4.67 -1.84 7.64 -1.26 -4.32 113.62 111.04 1mhs n SER 234 Ca 0.00 -0.36 -0.42 0.00 1.01 0.00 0.00 58.87 59.10 1mhs n SER 234 Cb 0.00 -0.11 -0.03 0.00 -1.01 0.00 0.00 64.21 63.07 1mhs n SER 234 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1mhs s LEU 235 N -2.21 4.39 0.54 -3.43 1.02 -1.26 -4.90 118.68 112.83 1mhs s LEU 235 Ca 0.24 2.59 -0.21 0.00 0.02 0.00 0.00 54.13 56.77 1mhs s LEU 235 Cb 0.13 -3.55 -0.06 0.00 0.02 0.00 0.00 46.19 42.73 1mhs s LEU 235 CO 0.24 -0.99 1.21 0.00 0.02 0.00 0.00 176.35 176.83 1mhs n ALA 236 N 6.56 1.03 -2.79 4.21 0.00 -1.26 -4.68 120.51 123.56 1mhs n ALA 236 Ca 0.18 0.11 -0.36 0.00 0.00 0.00 0.00 53.44 53.37 1mhs n ALA 236 Cb 0.40 -2.26 -0.08 0.00 0.00 0.00 0.00 19.45 17.52 1mhs n ALA 236 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1mhs s VAL 237 N -1.34 4.94 -0.66 0.00 1.01 0.32 -4.83 120.40 119.84 1mhs s VAL 237 Ca 0.72 -0.00 -0.18 0.00 0.00 0.00 0.00 61.98 62.51 1mhs s VAL 237 Cb -0.44 -3.15 0.12 0.00 0.00 0.00 0.00 36.38 32.92 1mhs s VAL 237 CO 0.50 0.58 0.75 -0.62 0.00 0.00 0.00 175.10 176.30 1mhs s ASP 238 N -0.64 6.31 -0.12 3.32 -1.08 -1.26 -1.78 116.67 121.42 1mhs s ASP 238 Ca 0.12 -1.68 -0.29 0.00 -0.52 0.00 0.00 52.55 50.17 1mhs s ASP 238 Cb -0.12 -2.30 -0.04 0.00 -1.46 0.00 0.00 42.92 39.01 1mhs s ASP 238 CO 0.02 -1.03 1.51 -0.54 0.52 0.00 0.00 175.17 175.65 1mhs s LYS 239 N 2.31 4.15 0.61 4.34 1.02 -0.80 -4.73 119.74 126.64 1mhs s LYS 239 Ca 0.14 1.92 0.00 0.00 0.02 0.00 0.00 55.97 58.06 1mhs s LYS 239 Cb -0.21 -3.91 0.06 0.00 -0.52 0.00 0.00 37.83 33.25 1mhs s LYS 239 CO 0.02 -0.86 0.85 -1.01 -0.92 0.00 0.00 175.35 173.44 1mhs s HIS 240 N 4.00 2.46 0.00 3.18 3.76 -1.26 -4.54 115.29 122.90 1mhs s HIS 240 Ca 0.66 -0.08 0.00 0.00 -0.15 0.00 0.00 55.06 55.50 1mhs s HIS 240 Cb -0.28 -2.84 0.00 0.00 1.11 0.00 0.00 32.58 30.57 1mhs s HIS 240 CO 0.24 -1.16 0.00 1.63 -0.85 0.00 0.00 174.74 174.60 1mhs n LYS 241 N -2.52 0.00 -0.79 1.40 4.76 -1.26 -2.55 118.16 117.21 1mhs n LYS 241 Ca 0.10 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.54 1mhs n LYS 241 Cb 0.60 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.79 1mhs n LYS 241 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1mhs n GLY 242 N 0.00 0.00 0.00 0.72 0.00 -1.25 -4.56 105.19 100.10 1mhs n GLY 242 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1mhs n GLY 242 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1mhs n ASP 243 N 0.22 -0.15 -3.68 1.61 2.03 -1.05 -3.88 116.55 111.64 1mhs n ASP 243 Ca 0.00 -0.44 -0.11 0.00 0.52 0.00 0.00 54.79 54.76 1mhs n ASP 243 Cb 0.00 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.28 1mhs n ASP 243 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1mhs s GLN 244 N -1.53 0.25 -0.50 -0.67 -0.21 -1.25 -0.74 119.66 115.02 1mhs s GLN 244 Ca 0.00 0.78 -0.07 0.00 0.02 0.00 0.00 55.36 56.08 1mhs s GLN 244 Cb 0.00 0.04 0.13 0.00 1.00 0.00 0.00 33.01 34.17 1mhs s GLN 244 CO 0.00 -0.23 0.35 0.54 -2.12 0.00 0.00 175.29 173.84 1mhs s VAL 245 N 2.03 4.05 0.00 1.09 0.11 1.41 -4.89 120.40 124.19 1mhs s VAL 245 Ca -0.04 -2.02 0.00 0.00 -2.93 0.00 0.00 61.98 57.00 1mhs s VAL 245 Cb -0.11 -3.67 0.00 0.00 -1.53 0.00 0.00 36.38 31.07 1mhs s VAL 245 CO -0.10 -0.79 0.21 2.22 -3.33 0.00 0.00 175.10 173.31 1mhs n PHE 246 N 4.63 0.00 -1.17 1.54 1.16 -1.26 0.29 117.46 122.65 1mhs n PHE 246 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.54 1mhs n PHE 246 Cb 0.41 -0.16 0.00 0.00 -1.61 0.00 0.00 39.48 38.12 1mhs n PHE 246 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1mhs n ALA 247 N -0.97 0.15 -0.59 1.98 0.00 -1.26 -2.20 120.51 117.62 1mhs n ALA 247 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1mhs n ALA 247 Cb 0.00 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.58 1mhs n ALA 247 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1mhs n SER 248 N 0.00 -2.75 -4.75 0.00 3.41 -1.26 -3.79 113.62 104.48 1mhs n SER 248 Ca 0.00 -0.38 -0.36 0.00 -0.26 0.00 0.00 58.87 57.87 1mhs n SER 248 Cb 0.18 -0.59 -0.08 0.00 -0.26 0.00 0.00 64.21 63.46 1mhs n SER 248 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1mhs s SER 249 N -2.05 5.83 -0.66 4.04 0.01 -0.40 -2.65 113.70 117.82 1mhs s SER 249 Ca 0.29 0.26 -0.21 0.00 1.31 0.00 0.00 55.95 57.60 1mhs s SER 249 Cb -0.05 -1.86 0.09 0.00 0.21 0.00 0.00 66.02 64.40 1mhs s SER 249 CO 0.25 0.33 0.89 0.00 0.41 0.00 0.00 173.24 175.11 1mhs s ALA 250 N -0.54 3.23 -0.54 1.44 0.00 -0.55 0.10 121.76 124.90 1mhs s ALA 250 Ca 0.11 -2.03 -0.13 0.00 0.00 0.00 0.00 51.96 49.90 1mhs s ALA 250 Cb -0.12 -3.76 -0.12 0.00 0.00 0.00 0.00 23.12 19.12 1mhs s ALA 250 CO 0.02 -2.65 1.74 1.55 0.00 0.00 0.00 175.76 176.42 1mhs n VAL 251 N 5.76 1.36 -2.35 0.00 3.14 -1.23 -0.62 118.33 124.40 1mhs n VAL 251 Ca -0.04 -0.96 -0.11 0.00 -2.96 0.00 0.00 64.34 60.28 1mhs n VAL 251 Cb 0.45 -2.03 -0.02 0.00 -1.06 0.00 0.00 33.84 31.18 1mhs n VAL 251 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 1mhs n LYS 252 N 5.77 -1.58 -4.07 1.45 5.02 -1.26 -4.82 118.16 118.66 1mhs n LYS 252 Ca 0.37 0.04 -0.32 0.00 -2.02 0.00 0.00 58.31 56.37 1mhs n LYS 252 Cb 0.23 -2.65 -0.15 0.00 -0.02 0.00 0.00 35.03 32.44 1mhs n LYS 252 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1mhs s ARG 253 N -3.63 2.27 0.16 1.97 0.52 -1.26 -4.79 118.95 114.19 1mhs s ARG 253 Ca 0.21 -1.33 0.00 0.00 -0.52 0.00 0.00 55.73 54.09 1mhs s ARG 253 Cb -0.12 -2.88 0.00 0.00 0.52 0.00 0.00 34.95 32.47 1mhs s ARG 253 CO 0.26 -0.56 0.00 0.41 0.02 0.00 0.00 175.30 175.43 1mhs n GLY 254 N 4.44 -1.78 3.14 -3.53 0.00 -1.21 -2.47 105.19 103.78 1mhs n GLY 254 Ca -0.14 -1.36 -0.17 0.00 0.00 0.00 0.00 46.02 44.34 1mhs n GLY 254 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mhs s GLU 255 N -1.87 0.76 -0.00 1.61 2.02 -1.26 -3.38 118.70 116.58 1mhs s GLU 255 Ca 0.00 -0.85 -0.06 0.00 0.02 0.00 0.00 54.97 54.08 1mhs s GLU 255 Cb 0.00 -0.72 -0.00 0.00 0.10 0.00 0.00 34.13 33.51 1mhs s GLU 255 CO 0.00 0.16 0.11 0.00 0.02 0.00 0.00 175.26 175.55 1mhs s ALA 256 N -1.19 -0.25 -0.06 5.21 0.00 0.19 -1.92 121.76 123.75 1mhs s ALA 256 Ca -0.03 -0.14 -0.03 0.00 0.00 0.00 0.00 51.96 51.76 1mhs s ALA 256 Cb -0.09 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.06 1mhs s ALA 256 CO 0.02 -0.18 0.09 0.12 0.00 0.00 0.00 175.76 175.81 1mhs s PHE 257 N -1.18 3.38 0.27 0.00 5.36 0.17 -0.89 117.98 125.08 1mhs s PHE 257 Ca -0.13 0.32 -0.21 0.00 -0.96 0.00 0.00 56.93 55.95 1mhs s PHE 257 Cb -0.07 -1.82 0.03 0.00 -0.34 0.00 0.00 43.02 40.82 1mhs s PHE 257 CO 0.01 0.60 0.76 0.54 -1.46 0.00 0.00 175.22 175.67 1mhs s VAL 258 N -1.09 0.00 -0.06 3.12 0.11 -0.22 -0.20 120.40 122.06 1mhs s VAL 258 Ca 0.19 -0.95 0.04 0.00 -2.93 0.00 0.00 61.98 58.33 1mhs s VAL 258 Cb -0.12 -2.05 -0.00 0.00 -1.53 0.00 0.00 36.38 32.68 1mhs s VAL 258 CO 0.09 0.00 -0.18 -0.69 -3.33 0.00 0.00 175.10 170.99 1mhs s VAL 259 N -3.74 1.56 -0.28 2.04 1.01 -0.94 -0.53 120.40 119.52 1mhs s VAL 259 Ca 0.11 -0.77 -0.29 0.00 0.00 0.00 0.00 61.98 61.04 1mhs s VAL 259 Cb -0.05 -1.35 0.01 0.00 0.00 0.00 0.00 36.38 34.98 1mhs s VAL 259 CO 0.07 0.45 1.15 -0.63 0.00 0.00 0.00 175.10 176.13 1mhs s ILE 260 N 0.20 4.41 -0.09 2.22 -1.09 -1.20 -0.16 121.20 125.50 1mhs s ILE 260 Ca -0.09 1.65 -0.07 0.00 -2.23 0.00 0.00 60.65 59.91 1mhs s ILE 260 Cb -0.14 -4.28 -0.02 0.00 -1.58 0.00 0.00 42.46 36.44 1mhs s ILE 260 CO 0.04 -0.39 -0.14 0.41 -1.23 0.00 0.00 174.94 173.63 1mhs n THR 261 N 5.80 0.84 -3.70 2.92 -1.04 -0.26 -0.38 114.28 118.47 1mhs n THR 261 Ca 0.13 0.32 -0.36 0.00 -2.04 0.00 0.00 64.05 62.10 1mhs n THR 261 Cb 0.46 -2.01 -0.07 0.00 -1.82 0.00 0.00 70.33 66.89 1mhs n THR 261 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1mhs s ALA 262 N -2.88 3.71 -0.45 2.41 0.00 -1.02 -4.71 121.76 118.82 1mhs s ALA 262 Ca -0.11 -0.59 0.07 0.00 0.00 0.00 0.00 51.96 51.33 1mhs s ALA 262 Cb 0.02 -2.19 0.25 0.00 0.00 0.00 0.00 23.12 21.19 1mhs s ALA 262 CO 0.17 0.28 0.78 0.25 0.00 0.00 0.00 175.76 177.24 1mhs n THR 263 N 3.04 -0.23 -0.78 0.00 -2.24 -1.26 -1.86 114.28 110.95 1mhs n THR 263 Ca -0.16 -2.39 0.00 0.00 -2.27 0.00 0.00 64.05 59.23 1mhs n THR 263 Cb 0.53 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.11 1mhs n THR 263 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mhs n GLY 264 N 1.45 -0.67 0.32 3.38 0.00 -1.26 -4.61 105.19 103.81 1mhs n GLY 264 Ca 0.13 -0.51 0.08 0.00 0.00 0.00 0.00 46.02 45.72 1mhs n GLY 264 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1mhs h ASP 265 N 0.00 0.37 0.18 1.61 3.04 -1.80 0.38 116.42 120.20 1mhs h ASP 265 Ca 0.00 -0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1mhs h ASP 265 Cb 0.00 -0.08 0.00 0.00 -1.04 0.00 0.00 39.33 38.21 1mhs h ASP 265 CO 0.00 0.25 0.00 0.59 -2.04 0.00 0.00 179.24 178.04 1mhs n ASN 266 N -4.48 0.00 -4.62 4.15 3.02 -1.26 -3.70 115.26 108.37 1mhs n ASN 266 Ca 0.05 -0.26 -0.31 0.00 -0.03 0.00 0.00 54.58 54.03 1mhs n ASN 266 Cb 0.18 -0.15 0.17 0.00 -0.61 0.00 0.00 39.78 39.37 1mhs n ASN 266 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1mhs n THR 267 N -1.15 0.00 0.00 3.41 -1.04 0.13 -4.79 114.28 110.84 1mhs n THR 267 Ca 0.11 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 1mhs n THR 267 Cb 0.11 -0.94 0.00 0.00 -1.82 0.00 0.00 70.33 67.67 1mhs n THR 267 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 1mhs n PHE 268 N -4.22 0.00 -0.13 -1.42 7.35 -1.26 -0.27 117.46 117.52 1mhs n PHE 268 Ca 0.11 0.00 -0.00 0.00 -0.76 0.00 0.00 57.45 56.80 1mhs n PHE 268 Cb 0.52 -0.49 0.20 0.00 0.35 0.00 0.00 39.48 40.07 1mhs n PHE 268 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1mhs n VAL 269 N -1.96 1.74 0.00 -2.13 0.31 -1.26 -2.51 118.33 112.51 1mhs n VAL 269 Ca 0.00 -0.87 0.00 0.00 -0.01 0.00 0.00 64.34 63.46 1mhs n VAL 269 Cb 0.00 -0.45 0.00 0.00 -0.91 0.00 0.00 33.84 32.48 1mhs n VAL 269 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1mhs n GLY 270 N 0.17 0.89 0.13 2.92 0.00 -1.24 -4.28 105.19 103.79 1mhs n GLY 270 Ca 0.20 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.04 1mhs n GLY 270 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1mhs n ARG 271 N -1.03 0.70 -0.03 1.61 3.00 0.63 -1.66 116.66 119.87 1mhs n ARG 271 Ca 0.00 0.20 0.11 0.00 -0.00 0.00 0.00 57.85 58.16 1mhs n ARG 271 Cb 0.00 -1.62 0.51 0.00 0.00 0.00 0.00 32.46 31.35 1mhs n ARG 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1mhs n ALA 272 N -3.07 2.58 -1.16 5.13 0.00 -1.15 -3.91 120.51 118.93 1mhs n ALA 272 Ca -0.37 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 52.74 1mhs n ALA 272 Cb 1.03 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 19.26 1mhs n ALA 272 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mhs n ALA 273 N -0.24 1.75 0.00 0.00 0.00 -1.26 -4.84 120.51 115.92 1mhs n ALA 273 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1mhs n ALA 273 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.66 1mhs n ALA 273 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mhs n ALA 274 N -1.34 0.96 -3.18 0.00 0.00 -0.67 -3.02 120.51 113.25 1mhs n ALA 274 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 1mhs n ALA 274 Cb 0.00 -0.67 -0.04 0.00 0.00 0.00 0.00 19.45 18.74 1mhs n ALA 274 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1mhs n LEU 275 N -0.90 0.81 0.00 0.00 4.32 -1.25 -4.96 117.00 115.02 1mhs n LEU 275 Ca 0.00 -4.95 0.00 0.00 -0.02 0.00 0.00 56.01 51.04 1mhs n LEU 275 Cb 0.02 0.64 0.00 0.00 -1.62 0.00 0.00 43.42 42.46 1mhs n LEU 275 CO 0.00 2.23 0.00 0.52 -1.22 0.00 0.00 177.39 178.92 1mhs n VAL 276 N 0.58 0.00 -3.03 4.08 0.31 -1.17 -4.44 118.33 114.66 1mhs n VAL 276 Ca 0.24 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.39 1mhs n VAL 276 Cb 0.61 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.52 1mhs n VAL 276 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1mhs n ASN 277 N 0.00 -0.89 -0.52 4.52 0.23 -1.26 -4.96 115.26 112.37 1mhs n ASN 277 Ca 0.00 -2.94 0.39 0.00 -0.53 0.00 0.00 54.58 51.50 1mhs n ASN 277 Cb 0.00 0.25 0.60 0.00 -2.08 0.00 0.00 39.78 38.55 1mhs n ASN 277 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1mhs n ALA 278 N 1.42 1.39 0.00 -2.53 0.00 -1.26 -4.94 120.51 114.58 1mhs n ALA 278 Ca 0.17 0.48 0.00 0.00 0.00 0.00 0.00 53.44 54.09 1mhs n ALA 278 Cb 0.57 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 19.19 1mhs n ALA 278 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mhs n ALA 279 N -2.67 0.00 0.00 0.00 0.00 -1.26 -5.14 120.51 111.43 1mhs n ALA 279 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1mhs n ALA 279 Cb 1.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.92 1mhs n ALA 279 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1mhs n SER 280 N 0.00 0.00 -4.06 0.00 7.64 -1.26 -5.10 113.62 110.83 1mhs n SER 280 Ca 0.00 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.69 1mhs n SER 280 Cb 0.00 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.06 1mhs n SER 280 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1mhs s GLY 281 N 0.00 0.55 0.00 0.23 0.00 -1.26 -5.13 107.32 101.71 1mhs s GLY 281 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 44.72 44.19 1mhs s GLY 281 CO 0.00 -0.47 0.00 0.61 0.00 0.00 0.00 173.10 173.24 1mhs n GLY 282 N 2.57 1.27 3.33 0.20 0.00 -1.26 -5.19 105.19 106.11 1mhs n GLY 282 Ca -0.15 0.37 -0.18 0.00 0.00 0.00 0.00 46.02 46.06 1mhs n GLY 282 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1mhs s SER 283 N 0.00 2.31 0.49 1.61 0.15 -1.26 -5.14 113.70 111.85 1mhs s SER 283 Ca 0.00 -1.06 -0.06 0.00 0.70 0.00 0.00 55.95 55.52 1mhs s SER 283 Cb 0.00 -0.09 -0.04 0.00 -1.71 0.00 0.00 66.02 64.18 1mhs s SER 283 CO 0.00 -0.28 0.81 -0.83 1.20 0.00 0.00 173.24 174.14 1mhs s GLY 284 N -3.29 1.56 0.00 9.45 0.00 -1.26 -5.01 107.32 108.76 1mhs s GLY 284 Ca 0.23 -0.43 0.00 0.00 0.00 0.00 0.00 44.72 44.52 1mhs s GLY 284 CO 0.06 -0.25 0.79 -2.39 0.00 0.00 0.00 173.10 171.31 1mhs n HIS 285 N -2.22 0.00 -0.38 1.90 1.44 -1.26 -2.24 115.22 112.47 1mhs n HIS 285 Ca 0.01 0.00 0.31 0.00 -2.01 0.00 0.00 57.72 56.04 1mhs n HIS 285 Cb 0.55 -0.29 0.62 0.00 0.12 0.00 0.00 29.99 30.99 1mhs n HIS 285 CO 0.00 0.00 0.00 0.35 -2.81 0.00 0.00 176.34 173.88 1mhs h PHE 286 N 0.00 0.45 -0.26 -1.40 3.57 -1.93 2.72 116.94 120.10 1mhs h PHE 286 Ca 0.00 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1mhs h PHE 286 Cb 0.00 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 1mhs h PHE 286 CO 0.10 -0.04 0.10 1.15 -2.23 0.00 0.00 178.31 177.39 1mhs h THR 287 N 0.20 1.11 -0.24 4.41 2.02 -1.96 0.26 112.91 118.71 1mhs h THR 287 Ca 0.68 -0.35 -0.08 0.00 0.77 0.00 0.00 66.41 67.43 1mhs h THR 287 Cb 2.11 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 69.32 1mhs h THR 287 CO -0.27 0.13 -0.17 -0.08 0.37 0.00 0.00 175.52 175.50 1mhs h GLU 288 N 0.37 0.54 -0.68 6.66 4.81 0.52 -0.31 114.58 126.49 1mhs h GLU 288 Ca 0.09 -0.26 -0.05 0.00 -0.13 0.00 0.00 59.36 59.01 1mhs h GLU 288 Cb 0.09 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 1mhs h GLU 288 CO -0.01 0.83 0.23 0.28 -0.73 0.00 0.00 179.01 179.61 1mhs h VAL 289 N 0.25 1.25 0.22 0.32 2.07 -0.59 -0.17 116.25 119.60 1mhs h VAL 289 Ca 0.05 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.71 1mhs h VAL 289 Cb 0.70 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1mhs h VAL 289 CO 0.05 0.33 -0.10 -0.07 0.02 0.00 0.00 177.57 177.79 1mhs h LEU 290 N 0.99 -0.24 -0.78 2.57 3.38 -0.46 -0.86 115.31 119.91 1mhs h LEU 290 Ca 0.22 -0.14 0.07 0.00 0.09 0.00 0.00 57.88 58.13 1mhs h LEU 290 Cb 0.28 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 1mhs h LEU 290 CO -0.01 0.00 0.45 0.78 0.09 0.00 0.00 178.44 179.75 1mhs h ASN 291 N -0.49 0.66 -0.59 -0.43 4.21 -0.96 0.15 115.58 118.13 1mhs h ASN 291 Ca -0.03 0.04 0.03 0.00 1.21 0.00 0.00 56.30 57.55 1mhs h ASN 291 Cb 0.37 -0.10 -0.04 0.00 -1.12 0.00 0.00 38.32 37.43 1mhs h ASN 291 CO 0.05 0.41 0.35 1.23 -1.29 0.00 0.00 177.43 178.18 1mhs h GLY 292 N 0.79 0.85 0.91 2.83 0.00 -0.84 -2.37 103.07 105.24 1mhs h GLY 292 Ca 0.36 -0.26 -0.10 0.00 0.00 0.00 0.00 47.33 47.33 1mhs h GLY 292 CO -0.21 0.21 -0.23 1.19 0.00 0.00 0.00 176.54 177.50 1mhs h ILE 293 N 0.69 1.31 -0.91 2.60 2.10 -0.14 -2.52 117.51 120.63 1mhs h ILE 293 Ca 0.24 -1.39 0.24 0.00 1.08 0.00 0.00 64.86 65.03 1mhs h ILE 293 Cb 0.05 1.62 -0.13 0.00 -1.09 0.00 0.00 36.82 37.28 1mhs h ILE 293 CO -0.12 0.44 0.38 1.23 -1.08 0.00 0.00 178.15 179.00 1mhs h GLY 294 N 0.34 1.57 0.67 8.18 0.00 -0.37 0.98 103.07 114.44 1mhs h GLY 294 Ca 0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.22 1mhs h GLY 294 CO 0.06 -0.32 -0.06 -0.84 0.00 0.00 0.00 176.54 175.38 1mhs h THR 295 N 0.35 1.02 0.00 4.70 2.02 -1.29 0.29 112.91 120.00 1mhs h THR 295 Ca 0.58 -0.69 0.00 0.00 0.77 0.00 0.00 66.41 67.07 1mhs h THR 295 Cb 1.15 1.44 0.00 0.00 -1.74 0.00 0.00 68.15 69.01 1mhs h THR 295 CO -0.57 0.16 0.01 -0.38 0.37 0.00 0.00 175.52 175.12 1mhs n ILE 296 N -5.02 1.22 -0.10 3.11 5.41 0.03 -0.22 119.36 123.80 1mhs n ILE 296 Ca -0.09 0.69 -0.17 0.00 1.00 0.00 0.00 62.75 64.18 1mhs n ILE 296 Cb 0.22 -1.69 -0.13 0.00 -0.71 0.00 0.00 39.64 37.33 1mhs n ILE 296 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1mhs n LEU 297 N -2.09 2.53 0.10 1.39 7.99 0.12 -3.34 117.00 123.70 1mhs n LEU 297 Ca -0.01 -0.05 -0.14 0.00 -0.01 0.00 0.00 56.01 55.80 1mhs n LEU 297 Cb 0.04 -0.76 -0.07 0.00 -0.11 0.00 0.00 43.42 42.52 1mhs n LEU 297 CO 0.07 0.86 0.59 0.25 -1.51 0.00 0.00 177.39 177.66 1mhs h LEU 298 N 0.01 -1.22 -0.03 2.23 6.46 0.29 -0.74 115.31 122.31 1mhs h LEU 298 Ca -0.54 0.14 -0.07 0.00 -0.12 0.00 0.00 57.88 57.28 1mhs h LEU 298 Cb 1.97 0.46 0.00 0.00 -0.73 0.00 0.00 40.66 42.36 1mhs h LEU 298 CO -0.04 -0.47 -0.27 -0.29 -0.62 0.00 0.00 178.44 176.75 1mhs h ILE 299 N -0.62 1.48 -0.26 4.05 2.10 -1.25 -2.69 117.51 120.32 1mhs h ILE 299 Ca 0.03 -1.80 0.06 0.00 1.08 0.00 0.00 64.86 64.23 1mhs h ILE 299 Cb 0.66 2.54 -0.07 0.00 -1.09 0.00 0.00 36.82 38.86 1mhs h ILE 299 CO -0.26 0.50 -0.25 0.25 -1.08 0.00 0.00 178.15 177.31 1mhs h LEU 300 N -0.35 -0.81 0.31 2.19 5.85 -1.54 -0.34 115.31 120.62 1mhs h LEU 300 Ca -0.03 0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 1mhs h LEU 300 Cb 0.96 0.38 0.00 0.00 0.37 0.00 0.00 40.66 42.38 1mhs h LEU 300 CO 0.05 -0.28 -0.15 1.62 -0.34 0.00 0.00 178.44 179.34 1mhs h VAL 301 N -0.25 0.71 0.00 1.05 3.04 -1.25 -1.62 116.25 117.93 1mhs h VAL 301 Ca 0.14 -0.44 0.00 0.00 -1.01 0.00 0.00 66.70 65.39 1mhs h VAL 301 Cb 0.47 0.94 0.00 0.00 -2.01 0.00 0.00 31.29 30.69 1mhs h VAL 301 CO -0.40 0.09 0.00 2.30 -1.01 0.00 0.00 177.57 178.55 1mhs n ILE 302 N -5.17 1.89 -0.10 3.17 -5.35 -1.01 -1.96 119.36 110.82 1mhs n ILE 302 Ca -0.10 0.47 -0.15 0.00 -0.27 0.00 0.00 62.75 62.71 1mhs n ILE 302 Cb 0.25 -1.44 -0.05 0.00 -1.74 0.00 0.00 39.64 36.66 1mhs n ILE 302 CO 0.00 0.00 0.00 0.33 -1.76 0.00 0.00 176.55 175.12 1mhs n PHE 303 N -1.50 0.00 -0.32 4.28 7.35 -0.16 -3.80 117.46 123.32 1mhs n PHE 303 Ca 0.00 0.00 0.21 0.00 -0.76 0.00 0.00 57.45 56.90 1mhs n PHE 303 Cb 0.02 -0.63 0.48 0.00 0.35 0.00 0.00 39.48 39.70 1mhs n PHE 303 CO 0.00 0.00 0.00 1.79 -0.76 0.00 0.00 176.76 177.79 1mhs h THR 304 N -0.95 0.57 -0.15 -2.13 1.35 -1.20 0.17 112.91 110.58 1mhs h THR 304 Ca -0.21 -0.16 -0.02 0.00 -0.55 0.00 0.00 66.41 65.47 1mhs h THR 304 Cb 1.15 0.07 -0.01 0.00 -1.73 0.00 0.00 68.15 67.64 1mhs h THR 304 CO -0.13 0.08 0.01 -0.07 -0.25 0.00 0.00 175.52 175.16 1mhs h LEU 305 N 0.46 0.25 -1.21 3.87 3.38 -1.62 -1.67 115.31 118.77 1mhs h LEU 305 Ca 0.58 -0.29 0.15 0.00 0.09 0.00 0.00 57.88 58.41 1mhs h LEU 305 Cb 1.36 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 41.96 1mhs h LEU 305 CO -0.30 0.48 0.59 -0.07 0.09 0.00 0.00 178.44 179.23 1mhs h LEU 306 N 0.01 0.70 -0.06 1.67 3.38 -0.80 -0.65 115.31 119.57 1mhs h LEU 306 Ca 0.04 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1mhs h LEU 306 Cb 0.35 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1mhs h LEU 306 CO 0.01 0.34 0.00 0.40 0.09 0.00 0.00 178.44 179.28 1mhs h ILE 307 N 0.73 1.23 0.00 1.22 2.04 -1.00 -2.19 117.51 119.54 1mhs h ILE 307 Ca 0.48 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1mhs h ILE 307 Cb 0.75 1.60 0.00 0.00 -0.74 0.00 0.00 36.82 38.44 1mhs h ILE 307 CO -0.24 0.20 0.06 0.52 0.00 0.00 0.00 178.15 178.69 1mhs n VAL 308 N -4.88 1.52 -0.06 1.67 0.31 -0.30 -1.23 118.33 115.35 1mhs n VAL 308 Ca -0.07 0.44 -0.06 0.00 -0.01 0.00 0.00 64.34 64.64 1mhs n VAL 308 Cb 0.18 -1.44 -0.02 0.00 -0.91 0.00 0.00 33.84 31.64 1mhs n VAL 308 CO 0.00 0.00 0.00 1.87 -1.32 0.00 0.00 176.83 177.38 1mhs n TRP 309 N -1.37 0.11 0.39 3.52 -0.00 -0.91 -4.51 117.44 114.67 1mhs n TRP 309 Ca 0.00 0.05 0.13 0.00 -0.00 0.00 0.00 57.50 57.68 1mhs n TRP 309 Cb 0.06 -0.41 0.40 0.00 -0.00 0.00 0.00 31.31 31.36 1mhs n TRP 309 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 177.69 177.45 1mhs h VAL 310 N -0.74 0.00 -0.48 5.87 3.04 -1.15 -2.92 116.25 119.87 1mhs h VAL 310 Ca 0.00 -0.60 0.00 0.00 -1.01 0.00 0.00 66.70 65.09 1mhs h VAL 310 Cb 0.69 1.55 0.00 0.00 -2.01 0.00 0.00 31.29 31.52 1mhs h VAL 310 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.57 176.32 1mhs n SER 311 N -2.67 3.15 -0.56 3.17 2.88 -0.37 -3.97 113.62 115.25 1mhs n SER 311 Ca 0.04 -2.18 0.06 0.00 -1.33 0.00 0.00 58.87 55.45 1mhs n SER 311 Cb 0.40 -0.42 0.10 0.00 -0.75 0.00 0.00 64.21 63.54 1mhs n SER 311 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1mhs n SER 312 N 0.83 2.42 0.10 -3.46 2.88 -1.10 -4.28 113.62 111.02 1mhs n SER 312 Ca 0.18 -1.72 0.11 0.00 -1.33 0.00 0.00 58.87 56.11 1mhs n SER 312 Cb 0.56 -0.11 0.46 0.00 -0.75 0.00 0.00 64.21 64.37 1mhs n SER 312 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 1mhs n PHE 313 N 0.62 0.67 0.08 0.66 7.35 -1.25 -1.27 117.46 124.32 1mhs n PHE 313 Ca 0.09 0.25 -0.08 0.00 -0.76 0.00 0.00 57.45 56.95 1mhs n PHE 313 Cb 0.36 -0.90 -0.07 0.00 0.35 0.00 0.00 39.48 39.22 1mhs n PHE 313 CO 0.00 0.00 0.00 -0.92 -0.76 0.00 0.00 176.76 175.08 1mhs h TYR 314 N 0.00 0.10 0.00 -5.13 3.20 -1.88 -2.99 116.97 110.27 1mhs h TYR 314 Ca 0.00 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.80 1mhs h TYR 314 Cb 0.42 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.69 1mhs h TYR 314 CO 0.00 0.98 0.00 -0.09 -1.64 0.00 0.00 178.16 177.41 1mhs h ARG 315 N 0.02 0.00 -0.07 1.82 9.65 -1.27 -3.47 114.38 121.06 1mhs h ARG 315 Ca -0.03 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 1mhs h ARG 315 Cb 1.68 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.26 1mhs h ARG 315 CO 0.13 0.00 0.00 -1.13 2.80 0.00 0.00 179.97 181.77 1mhs n SER 316 N -2.47 -0.69 -4.29 -3.80 3.41 -1.13 -4.93 113.62 99.72 1mhs n SER 316 Ca 0.02 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.33 1mhs n SER 316 Cb 0.28 -0.31 -0.16 0.00 -0.26 0.00 0.00 64.21 63.76 1mhs n SER 316 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1mhs s ASN 317 N -2.62 2.94 0.26 4.04 0.01 -1.22 -5.07 114.94 113.28 1mhs s ASN 317 Ca 0.00 -0.46 -0.31 0.00 -0.71 0.00 0.00 52.86 51.38 1mhs s ASN 317 Cb 0.00 -0.38 -0.12 0.00 0.41 0.00 0.00 41.25 41.16 1mhs s ASN 317 CO 0.00 0.30 1.64 -2.65 -1.51 0.00 0.00 177.10 174.88 1mhs n PRO 318 N 2.52 2.71 -0.39 -0.60 -0.02 -1.26 -4.42 135.00 133.54 1mhs n PRO 318 Ca -0.16 0.97 0.34 0.00 -2.02 0.00 0.00 63.50 62.63 1mhs n PRO 318 Cb 0.51 -2.77 0.52 0.00 -0.02 0.00 0.00 33.50 31.74 1mhs n PRO 318 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 1mhs n ILE 319 N 2.86 0.00 0.01 4.25 3.06 -1.26 0.11 119.36 128.39 1mhs n ILE 319 Ca 0.12 1.12 -0.10 0.00 -2.50 0.00 0.00 62.75 61.38 1mhs n ILE 319 Cb 0.36 -1.93 -0.05 0.00 0.54 0.00 0.00 39.64 38.56 1mhs n ILE 319 CO 0.00 0.00 0.00 0.58 -2.50 0.00 0.00 176.55 174.63 1mhs h VAL 320 N 0.00 0.88 -0.79 9.51 2.07 -1.95 0.64 116.25 126.60 1mhs h VAL 320 Ca 0.59 0.00 0.01 0.00 0.82 0.00 0.00 66.70 68.12 1mhs h VAL 320 Cb 2.75 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 33.36 1mhs h VAL 320 CO -0.01 0.00 0.52 -0.61 0.02 0.00 0.00 177.57 177.50 1mhs h GLN 321 N -0.03 1.04 -0.07 1.57 4.15 0.40 -0.69 115.11 121.47 1mhs h GLN 321 Ca 0.04 -0.06 -0.07 0.00 0.77 0.00 0.00 58.65 59.33 1mhs h GLN 321 Cb 0.09 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.54 1mhs h GLN 321 CO -0.10 0.69 -0.30 -0.84 -1.93 0.00 0.00 178.83 176.35 1mhs h ILE 322 N 1.07 1.24 0.15 2.39 3.07 -1.44 -2.42 117.51 121.57 1mhs h ILE 322 Ca 0.29 -1.15 -0.01 0.00 1.55 0.00 0.00 64.86 65.54 1mhs h ILE 322 Cb -0.12 1.53 0.00 0.00 -0.27 0.00 0.00 36.82 37.96 1mhs h ILE 322 CO -0.07 0.34 -0.07 0.25 -1.05 0.00 0.00 178.15 177.55 1mhs h LEU 323 N 0.11 -0.17 -0.01 0.16 5.85 0.17 -1.39 115.31 120.04 1mhs h LEU 323 Ca 0.02 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.54 1mhs h LEU 323 Cb 0.59 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.67 1mhs h LEU 323 CO 0.04 0.11 0.00 -1.84 -0.34 0.00 0.00 178.44 176.41 1mhs n GLU 324 N -5.06 0.88 -0.12 1.25 0.28 -0.43 -2.00 120.64 115.44 1mhs n GLU 324 Ca -0.09 0.00 -0.18 0.00 -0.16 0.00 0.00 57.16 56.74 1mhs n GLU 324 Cb 0.20 -1.00 -0.10 0.00 1.43 0.00 0.00 31.44 31.96 1mhs n GLU 324 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1mhs n PHE 325 N -0.50 0.00 -0.06 -1.84 7.35 -0.90 -3.42 117.46 118.10 1mhs n PHE 325 Ca 0.00 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.56 1mhs n PHE 325 Cb 0.00 -0.88 -0.07 0.00 0.35 0.00 0.00 39.48 38.88 1mhs n PHE 325 CO 0.00 0.00 0.00 1.79 -0.76 0.00 0.00 176.76 177.79 1mhs h THR 326 N -0.15 1.33 -0.62 -2.13 1.35 -0.93 0.14 112.91 111.90 1mhs h THR 326 Ca -0.53 -1.24 -0.07 0.00 -0.55 0.00 0.00 66.41 64.02 1mhs h THR 326 Cb 1.75 1.81 -0.03 0.00 -1.73 0.00 0.00 68.15 69.95 1mhs h THR 326 CO -0.13 0.37 0.09 -0.07 -0.25 0.00 0.00 175.52 175.53 1mhs h LEU 327 N 0.00 0.97 -0.26 3.87 4.07 -1.64 0.21 115.31 122.54 1mhs h LEU 327 Ca 0.03 -0.23 -0.02 0.00 0.08 0.00 0.00 57.88 57.74 1mhs h LEU 327 Cb 0.63 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.10 1mhs h LEU 327 CO 0.03 0.98 0.07 0.00 -1.08 0.00 0.00 178.44 178.43 1mhs h ALA 328 N 1.14 0.34 -0.14 1.53 0.00 -1.55 -2.09 119.26 118.49 1mhs h ALA 328 Ca 0.19 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1mhs h ALA 328 Cb 0.42 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1mhs h ALA 328 CO 0.01 -0.02 -0.07 0.82 0.00 0.00 0.00 179.25 179.99 1mhs h ILE 329 N 0.24 1.14 0.41 0.00 2.04 -0.46 -2.71 117.51 118.18 1mhs h ILE 329 Ca 0.08 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 65.34 1mhs h ILE 329 Cb 0.27 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.47 1mhs h ILE 329 CO -0.00 0.18 -0.20 0.74 0.00 0.00 0.00 178.15 178.88 1mhs h THR 330 N 0.20 0.60 -0.04 -0.27 2.02 -0.45 -0.93 112.91 114.03 1mhs h THR 330 Ca 0.04 -0.02 0.04 0.00 0.77 0.00 0.00 66.41 67.24 1mhs h THR 330 Cb 0.26 0.61 -0.05 0.00 -1.74 0.00 0.00 68.15 67.24 1mhs h THR 330 CO 0.01 0.00 -0.23 -0.29 0.37 0.00 0.00 175.52 175.39 1mhs h ILE 331 N -0.56 0.46 0.11 3.11 -0.00 -1.08 0.21 117.51 119.76 1mhs h ILE 331 Ca -0.06 0.00 -0.00 0.00 -0.00 0.00 0.00 64.86 64.80 1mhs h ILE 331 Cb 0.43 0.46 -0.00 0.00 -0.00 0.00 0.00 36.82 37.70 1mhs h ILE 331 CO 0.09 0.00 -0.06 -0.29 -0.00 0.00 0.00 178.15 177.89 1mhs h ILE 332 N -0.34 0.86 0.02 2.19 2.10 -1.50 -3.18 117.51 117.66 1mhs h ILE 332 Ca 0.07 0.00 0.01 0.00 1.08 0.00 0.00 64.86 66.03 1mhs h ILE 332 Cb 0.44 0.86 -0.03 0.00 -1.09 0.00 0.00 36.82 37.00 1mhs h ILE 332 CO -0.24 0.00 -0.35 1.23 -1.08 0.00 0.00 178.15 177.71 1mhs h GLY 333 N -0.17 -1.21 -4.81 8.18 0.00 -0.83 -3.40 103.07 100.83 1mhs h GLY 333 Ca -0.01 0.63 -0.18 0.00 0.00 0.00 0.00 47.33 47.77 1mhs h GLY 333 CO 0.02 -0.34 1.21 3.33 0.00 0.00 0.00 176.54 180.76 1mhs n VAL 334 N -4.42 0.00 -1.73 4.60 0.24 0.72 -4.66 118.33 113.07 1mhs n VAL 334 Ca -0.05 -0.34 -0.18 0.00 -2.04 0.00 0.00 64.34 61.73 1mhs n VAL 334 Cb 0.26 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.56 1mhs n VAL 334 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1mhs s PRO 335 N 4.44 1.81 0.53 7.34 0.04 -1.26 -4.89 135.00 143.01 1mhs s PRO 335 Ca 0.66 -0.01 -0.03 0.00 0.04 0.00 0.00 61.00 61.66 1mhs s PRO 335 Cb -0.43 -4.93 0.00 0.00 0.04 0.00 0.00 34.50 29.19 1mhs s PRO 335 CO 0.29 -4.38 0.81 0.54 0.04 0.00 0.00 177.00 174.29 1mhs s VAL 336 N 13.86 3.83 0.00 -0.36 0.11 -1.26 -4.41 120.40 132.17 1mhs s VAL 336 Ca 0.83 -0.19 0.00 0.00 -2.93 0.00 0.00 61.98 59.69 1mhs s VAL 336 Cb -0.09 -3.48 0.00 0.00 -1.53 0.00 0.00 36.38 31.28 1mhs s VAL 336 CO 0.08 -0.43 0.00 0.61 -3.33 0.00 0.00 175.10 172.03 1mhs n GLY 337 N -2.37 0.74 0.10 6.54 0.00 -1.26 -4.97 105.19 103.98 1mhs n GLY 337 Ca 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 1mhs n GLY 337 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1mhs h LEU 338 N 0.00 0.22 -0.26 0.99 6.46 -1.99 0.27 115.31 120.99 1mhs h LEU 338 Ca 0.00 -0.06 0.01 0.00 -0.12 0.00 0.00 57.88 57.72 1mhs h LEU 338 Cb 0.00 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 39.85 1mhs h LEU 338 CO 0.00 0.21 0.14 -0.65 -0.62 0.00 0.00 178.44 177.52 1mhs h PRO 339 N 0.21 0.28 -0.54 5.25 0.11 -1.94 -1.77 132.00 133.61 1mhs h PRO 339 Ca 0.07 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 66.07 1mhs h PRO 339 Cb 0.03 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.06 1mhs h PRO 339 CO -0.01 0.19 0.00 0.00 -0.21 0.00 0.00 178.00 177.97 1mhs h ALA 340 N 1.13 0.72 -0.35 -0.75 0.00 -1.80 -1.96 119.26 116.25 1mhs h ALA 340 Ca 0.11 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 1mhs h ALA 340 Cb 0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1mhs h ALA 340 CO -0.06 0.54 -0.02 -0.24 0.00 0.00 0.00 179.25 179.46 1mhs h VAL 341 N 0.82 1.27 0.00 0.00 3.04 -0.26 -1.51 116.25 119.61 1mhs h VAL 341 Ca 0.15 -1.02 0.00 0.00 -1.01 0.00 0.00 66.70 64.82 1mhs h VAL 341 Cb 0.53 1.24 0.00 0.00 -2.01 0.00 0.00 31.29 31.05 1mhs h VAL 341 CO 0.03 0.34 -0.18 0.58 -1.01 0.00 0.00 177.57 177.32 1mhs h VAL 342 N 0.43 0.00 0.16 1.51 2.07 -1.36 -2.58 116.25 116.49 1mhs h VAL 342 Ca 0.10 -0.84 -0.29 0.00 0.82 0.00 0.00 66.70 66.48 1mhs h VAL 342 Cb 0.49 1.74 0.02 0.00 -1.52 0.00 0.00 31.29 32.02 1mhs h VAL 342 CO 0.02 0.00 -1.31 0.00 0.02 0.00 0.00 177.57 176.30 1mhs h THR 343 N 0.00 1.42 -0.21 2.57 1.03 -1.26 -1.80 112.91 114.67 1mhs h THR 343 Ca 0.00 -2.91 -0.06 0.00 -0.01 0.00 0.00 66.41 63.43 1mhs h THR 343 Cb 0.92 2.95 -0.01 0.00 -1.07 0.00 0.00 68.15 70.94 1mhs h THR 343 CO 0.00 0.86 -0.10 0.00 -0.01 0.00 0.00 175.52 176.27 1mhs h THR 344 N 0.11 1.30 -0.58 0.00 1.03 -1.28 -0.20 112.91 113.30 1mhs h THR 344 Ca -0.17 -1.16 -0.05 0.00 -0.01 0.00 0.00 66.41 65.02 1mhs h THR 344 Cb 2.02 1.62 -0.02 0.00 -1.07 0.00 0.00 68.15 70.70 1mhs h THR 344 CO 0.23 0.35 0.18 0.71 -0.01 0.00 0.00 175.52 176.98 1mhs h THR 345 N 0.14 1.24 0.39 0.00 1.35 -1.54 0.53 112.91 115.01 1mhs h THR 345 Ca 0.05 -0.81 -0.02 0.00 -0.55 0.00 0.00 66.41 65.07 1mhs h THR 345 Cb 0.59 0.68 0.00 0.00 -1.73 0.00 0.00 68.15 67.69 1mhs h THR 345 CO 0.03 0.31 -0.19 -0.03 -0.25 0.00 0.00 175.52 175.39 1mhs h MET 346 N 0.81 -0.50 0.39 4.72 -1.53 -1.25 0.25 114.93 117.82 1mhs h MET 346 Ca 0.19 0.03 -0.01 0.00 -3.44 0.00 0.00 59.70 56.47 1mhs h MET 346 Cb 0.28 0.11 -0.00 0.00 -0.55 0.00 0.00 31.60 31.45 1mhs h MET 346 CO -0.01 -0.29 -0.23 0.00 0.14 0.00 0.00 176.91 176.53 1mhs h ALA 347 N -0.02 -0.58 0.03 0.39 0.00 -0.96 -1.19 119.26 116.94 1mhs h ALA 347 Ca -0.05 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1mhs h ALA 347 Cb 0.45 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1mhs h ALA 347 CO 0.09 -0.84 -0.02 -0.39 0.00 0.00 0.00 179.25 178.10 1mhs h VAL 348 N -0.59 1.04 -0.74 0.00 -1.51 -0.92 -2.16 116.25 111.38 1mhs h VAL 348 Ca -0.05 -0.24 0.13 0.00 -1.23 0.00 0.00 66.70 65.31 1mhs h VAL 348 Cb 0.47 1.20 -0.05 0.00 -2.13 0.00 0.00 31.29 30.79 1mhs h VAL 348 CO 0.05 0.06 0.49 1.23 -1.23 0.00 0.00 177.57 178.18 1mhs h GLY 349 N -0.15 0.79 2.00 5.19 0.00 -0.47 0.15 103.07 110.58 1mhs h GLY 349 Ca -0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1mhs h GLY 349 CO 0.01 0.09 -0.05 0.00 0.00 0.00 0.00 176.54 176.59 1mhs h ALA 350 N 1.64 0.97 -0.03 3.60 0.00 -0.90 -2.80 119.26 121.75 1mhs h ALA 350 Ca 0.36 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.12 1mhs h ALA 350 Cb 0.69 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.48 1mhs h ALA 350 CO -0.12 0.07 -0.35 0.00 0.00 0.00 0.00 179.25 178.84 1mhs h ALA 351 N 1.95 0.08 -0.64 0.00 0.00 -0.08 -2.30 119.26 118.27 1mhs h ALA 351 Ca -0.00 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 1mhs h ALA 351 Cb 0.93 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1mhs h ALA 351 CO 0.01 0.18 0.26 1.88 0.00 0.00 0.00 179.25 181.58 1mhs h TYR 352 N -0.28 0.93 -0.08 0.00 -1.99 -1.42 1.41 116.97 115.53 1mhs h TYR 352 Ca -0.04 -0.05 0.01 0.00 2.00 0.00 0.00 58.73 60.66 1mhs h TYR 352 Cb 1.06 -0.29 -0.01 0.00 2.00 0.00 0.00 36.73 39.49 1mhs h TYR 352 CO 0.15 0.71 -0.01 -0.07 -0.00 0.00 0.00 178.16 178.94 1mhs h LEU 353 N 0.91 -0.05 -0.88 3.88 3.38 -1.50 -1.67 115.31 119.38 1mhs h LEU 353 Ca 0.22 0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.11 1mhs h LEU 353 Cb 0.16 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1mhs h LEU 353 CO -0.02 -0.01 -0.16 0.00 0.09 0.00 0.00 178.44 178.34 1mhs h ALA 354 N 1.08 1.05 -0.09 1.53 0.00 -0.73 -2.83 119.26 119.27 1mhs h ALA 354 Ca 0.04 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 1mhs h ALA 354 Cb 0.05 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1mhs h ALA 354 CO -0.07 0.58 -0.01 -0.22 0.00 0.00 0.00 179.25 179.52 1mhs h LYS 355 N 0.59 0.13 -3.26 0.00 3.64 0.26 -3.36 116.57 114.57 1mhs h LYS 355 Ca 0.10 -0.01 -0.79 0.00 -1.27 0.00 0.00 60.65 58.68 1mhs h LYS 355 Cb 0.61 -0.03 -0.29 0.00 -0.41 0.00 0.00 32.23 32.11 1mhs h LYS 355 CO 0.04 0.16 0.47 1.63 -2.27 0.00 0.00 179.45 179.48 1mhs n LYS 356 N -4.44 3.74 -0.38 1.90 5.02 -0.69 -4.86 118.16 118.45 1mhs n LYS 356 Ca -0.01 -4.51 0.00 0.00 -2.02 0.00 0.00 58.31 51.77 1mhs n LYS 356 Cb 0.15 -2.51 0.00 0.00 -0.02 0.00 0.00 35.03 32.65 1mhs n LYS 356 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1mhs n LYS 357 N 2.09 -0.43 -3.79 1.97 4.76 -1.26 -4.68 118.16 116.82 1mhs n LYS 357 Ca 0.25 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.39 1mhs n LYS 357 Cb 0.37 -1.21 -0.15 0.00 -1.84 0.00 0.00 35.03 32.20 1mhs n LYS 357 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1mhs s ALA 358 N -0.33 1.98 -0.33 7.82 0.00 -1.23 0.17 121.76 129.83 1mhs s ALA 358 Ca 0.00 -2.08 -0.26 0.00 0.00 0.00 0.00 51.96 49.62 1mhs s ALA 358 Cb 0.00 -1.76 0.01 0.00 0.00 0.00 0.00 23.12 21.37 1mhs s ALA 358 CO 0.00 -1.77 0.93 0.42 0.00 0.00 0.00 175.76 175.34 1mhs s ILE 359 N 1.16 4.63 -0.12 0.00 1.01 -0.78 -2.92 121.20 124.18 1mhs s ILE 359 Ca 0.12 1.37 0.03 0.00 0.00 0.00 0.00 60.65 62.17 1mhs s ILE 359 Cb -0.19 -4.30 0.01 0.00 0.01 0.00 0.00 42.46 37.99 1mhs s ILE 359 CO -0.16 -0.42 -0.21 -0.69 0.00 0.00 0.00 174.94 173.46 1mhs s VAL 360 N 3.35 1.93 -0.00 2.92 1.01 -1.26 0.50 120.40 128.85 1mhs s VAL 360 Ca 0.39 -0.92 0.07 0.00 0.00 0.00 0.00 61.98 61.52 1mhs s VAL 360 Cb -0.13 -1.70 -0.02 0.00 0.00 0.00 0.00 36.38 34.53 1mhs s VAL 360 CO 0.15 0.53 -0.23 -1.58 0.00 0.00 0.00 175.10 173.97 1mhs s GLN 361 N 0.68 2.09 -0.01 2.72 0.74 -1.26 -4.83 119.66 119.79 1mhs s GLN 361 Ca -0.11 -0.95 -0.01 0.00 0.05 0.00 0.00 55.36 54.34 1mhs s GLN 361 Cb -0.16 -2.10 0.00 0.00 1.10 0.00 0.00 33.01 31.85 1mhs s GLN 361 CO 0.02 0.56 0.02 1.17 -0.55 0.00 0.00 175.29 176.51 1mhs n LYS 362 N 2.13 -0.67 0.00 1.67 4.81 -1.26 -4.74 118.16 120.09 1mhs n LYS 362 Ca -0.16 0.93 0.01 0.00 -0.87 0.00 0.00 58.31 58.22 1mhs n LYS 362 Cb 0.52 -1.37 0.06 0.00 0.02 0.00 0.00 35.03 34.26 1mhs n LYS 362 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1mhs n LEU 363 N 0.24 0.00 -0.08 3.14 4.32 -1.26 -1.48 117.00 121.88 1mhs n LEU 363 Ca -0.04 0.41 0.15 0.00 -0.02 0.00 0.00 56.01 56.51 1mhs n LEU 363 Cb 0.05 -0.41 0.69 0.00 -1.62 0.00 0.00 43.42 42.14 1mhs n LEU 363 CO 0.03 -0.37 0.94 -1.20 -1.22 0.00 0.00 177.39 175.58 1mhs n SER 364 N -1.41 0.31 -0.00 -1.43 7.64 -1.26 -3.34 113.62 114.13 1mhs n SER 364 Ca 0.01 -0.54 0.11 0.00 1.01 0.00 0.00 58.87 59.46 1mhs n SER 364 Cb 0.03 -0.12 -0.15 0.00 -1.01 0.00 0.00 64.21 62.96 1mhs n SER 364 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1mhs n ALA 365 N -1.01 3.11 -0.20 -0.43 0.00 -0.55 -4.36 120.51 117.07 1mhs n ALA 365 Ca 0.16 -0.52 -0.07 0.00 0.00 0.00 0.00 53.44 53.01 1mhs n ALA 365 Cb 0.25 -0.77 0.03 0.00 0.00 0.00 0.00 19.45 18.96 1mhs n ALA 365 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 1mhs h ILE 366 N 0.00 1.16 -0.40 0.00 3.07 -1.72 -0.95 117.51 118.68 1mhs h ILE 366 Ca 0.00 -0.35 0.06 0.00 1.55 0.00 0.00 64.86 66.12 1mhs h ILE 366 Cb 0.92 0.37 -0.08 0.00 -0.27 0.00 0.00 36.82 37.76 1mhs h ILE 366 CO 0.00 0.17 -0.52 -0.33 -1.05 0.00 0.00 178.15 176.42 1mhs h GLU 367 N 0.77 -0.37 -0.11 0.16 5.08 -1.76 0.11 114.58 118.45 1mhs h GLU 367 Ca 0.20 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1mhs h GLU 367 Cb -0.04 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1mhs h GLU 367 CO -0.04 -0.25 0.07 0.66 -1.00 0.00 0.00 179.01 178.45 1mhs h SER 368 N -0.39 0.13 -0.84 1.42 4.64 -1.76 -2.82 113.55 113.94 1mhs h SER 368 Ca 0.09 -0.03 0.13 0.00 -0.47 0.00 0.00 61.79 61.51 1mhs h SER 368 Cb 0.60 -0.03 -0.09 0.00 -0.31 0.00 0.00 62.40 62.57 1mhs h SER 368 CO -0.58 0.12 0.45 0.25 -0.87 0.00 0.00 176.83 176.20 1mhs h LEU 369 N 0.13 0.58 -1.94 5.97 5.85 -0.48 0.96 115.31 126.37 1mhs h LEU 369 Ca 0.04 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 1mhs h LEU 369 Cb 0.01 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.02 1mhs h LEU 369 CO -0.01 0.28 -0.02 0.00 -0.34 0.00 0.00 178.44 178.35 1mhs h ALA 370 N 1.52 1.95 -0.32 1.25 0.00 -0.55 -1.39 119.26 121.73 1mhs h ALA 370 Ca 0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1mhs h ALA 370 Cb 0.55 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1mhs h ALA 370 CO -0.32 0.04 0.00 0.41 0.00 0.00 0.00 179.25 179.37 1mhs n GLY 371 N -1.47 1.06 3.64 0.00 0.00 0.29 -4.48 105.19 104.22 1mhs n GLY 371 Ca -0.03 -0.57 -0.48 0.00 0.00 0.00 0.00 46.02 44.94 1mhs n GLY 371 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1mhs n VAL 372 N 0.91 0.05 -0.06 1.61 0.31 -0.52 -4.72 118.33 115.90 1mhs n VAL 372 Ca 0.17 -0.01 -0.07 0.00 -0.01 0.00 0.00 64.34 64.42 1mhs n VAL 372 Cb 0.46 -1.25 -0.07 0.00 -0.91 0.00 0.00 33.84 32.06 1mhs n VAL 372 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1mhs n GLU 373 N 3.00 1.26 -4.33 5.55 -0.58 -1.26 -4.73 120.64 119.54 1mhs n GLU 373 Ca 0.17 0.04 -0.18 0.00 -0.42 0.00 0.00 57.16 56.77 1mhs n GLU 373 Cb 0.25 -1.27 -0.14 0.00 -0.57 0.00 0.00 31.44 29.71 1mhs n GLU 373 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1mhs s ILE 374 N -2.26 0.84 -0.25 -3.67 -1.09 -1.24 0.31 121.20 113.83 1mhs s ILE 374 Ca -0.12 -0.69 -0.02 0.00 -2.23 0.00 0.00 60.65 57.59 1mhs s ILE 374 Cb 0.04 -0.75 0.08 0.00 -1.58 0.00 0.00 42.46 40.25 1mhs s ILE 374 CO 0.37 0.06 0.06 -0.76 -1.23 0.00 0.00 174.94 173.44 1mhs s LEU 375 N -0.70 1.75 -0.48 2.97 1.02 0.98 -1.61 118.68 122.60 1mhs s LEU 375 Ca 0.01 -1.22 -0.20 0.00 0.02 0.00 0.00 54.13 52.74 1mhs s LEU 375 Cb -0.06 -0.76 0.04 0.00 0.02 0.00 0.00 46.19 45.43 1mhs s LEU 375 CO 0.00 -0.35 0.65 0.00 0.02 0.00 0.00 176.35 176.68 1mhs s SER 377 N 2.39 3.03 0.42 0.00 1.04 0.75 -3.74 113.70 117.60 1mhs s SER 377 Ca 0.19 -0.52 -0.23 0.00 0.48 0.00 0.00 55.95 55.88 1mhs s SER 377 Cb -0.16 -0.31 -0.09 0.00 0.10 0.00 0.00 66.02 65.56 1mhs s SER 377 CO 0.15 0.28 1.02 -1.81 0.98 0.00 0.00 173.24 173.87 1mhs s ASP 378 N -0.90 6.74 0.00 7.02 1.01 -1.26 -1.10 116.67 128.19 1mhs s ASP 378 Ca 0.10 1.95 0.00 0.00 0.71 0.00 0.00 52.55 55.31 1mhs s ASP 378 Cb -0.10 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.26 1mhs s ASP 378 CO 0.00 -0.50 0.00 1.17 0.21 0.00 0.00 175.17 176.05 1mhs n LYS 379 N -0.29 0.00 -1.57 8.23 4.81 -1.04 -3.15 118.16 125.15 1mhs n LYS 379 Ca 0.06 0.00 -0.61 0.00 -0.87 0.00 0.00 58.31 56.89 1mhs n LYS 379 Cb 0.51 -0.23 -0.09 0.00 0.02 0.00 0.00 35.03 35.24 1mhs n LYS 379 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1mhs n THR 380 N 0.00 0.00 0.00 3.15 -2.24 -1.26 0.03 114.28 113.96 1mhs n THR 380 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1mhs n THR 380 Cb 0.00 -0.45 0.00 0.00 -2.10 0.00 0.00 70.33 67.78 1mhs n THR 380 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mhs n GLY 381 N 3.69 2.79 0.12 3.38 0.00 -0.26 -4.73 105.19 110.17 1mhs n GLY 381 Ca 0.29 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.23 1mhs n GLY 381 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1mhs n THR 382 N -0.22 1.35 -0.03 2.61 -1.04 0.15 -4.39 114.28 112.71 1mhs n THR 382 Ca 0.00 0.18 -0.19 0.00 -2.04 0.00 0.00 64.05 62.01 1mhs n THR 382 Cb 0.00 -2.24 -0.13 0.00 -1.82 0.00 0.00 70.33 66.14 1mhs n THR 382 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1mhs h LEU 383 N -0.87 0.20 -9.48 -4.42 3.38 -0.34 -0.21 115.31 103.56 1mhs h LEU 383 Ca 0.00 -0.87 -0.66 0.00 0.09 0.00 0.00 57.88 56.45 1mhs h LEU 383 Cb 0.87 -0.06 -0.12 0.00 0.09 0.00 0.00 40.66 41.44 1mhs h LEU 383 CO 0.00 1.32 -0.61 0.28 0.09 0.00 0.00 178.44 179.53 1mhs s THR 384 N -2.35 4.45 0.24 0.22 -1.32 -1.10 -4.65 115.64 111.12 1mhs s THR 384 Ca -0.20 -0.53 0.19 0.00 -1.21 0.00 0.00 61.69 59.95 1mhs s THR 384 Cb 0.01 -3.02 0.16 0.00 -1.51 0.00 0.00 72.50 68.14 1mhs s THR 384 CO 0.72 0.34 1.81 0.11 -2.21 0.00 0.00 174.62 175.39 1mhs h LYS 385 N 4.15 0.00 -5.90 7.08 1.57 -1.66 -0.68 116.57 121.12 1mhs h LYS 385 Ca -0.49 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 57.70 1mhs h LYS 385 Cb 1.18 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.40 1mhs h LYS 385 CO 0.60 0.33 0.54 -0.80 -0.57 0.00 0.00 179.45 179.55 1mhs s ASN 386 N -6.45 6.81 1.37 0.86 0.02 -1.26 -4.74 114.94 111.55 1mhs s ASN 386 Ca -0.01 0.93 -0.20 0.00 -1.02 0.00 0.00 52.86 52.56 1mhs s ASN 386 Cb 0.12 -2.45 0.34 0.00 0.02 0.00 0.00 41.25 39.28 1mhs s ASN 386 CO 0.67 -0.63 0.86 0.29 0.02 0.00 0.00 177.10 178.31 1mhs n LYS 387 N 6.26 -4.04 -1.39 -0.60 5.02 -1.26 -3.67 118.16 118.47 1mhs n LYS 387 Ca 0.07 -1.19 -0.41 0.00 -2.02 0.00 0.00 58.31 54.75 1mhs n LYS 387 Cb 0.47 -1.96 -0.05 0.00 -0.02 0.00 0.00 35.03 33.48 1mhs n LYS 387 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1mhs n LEU 388 N -5.23 4.39 -4.02 -0.35 7.94 -1.26 -4.79 117.00 113.67 1mhs n LEU 388 Ca 0.10 -3.14 -0.31 0.00 -1.11 0.00 0.00 56.01 51.55 1mhs n LEU 388 Cb 0.57 -1.28 -0.16 0.00 0.53 0.00 0.00 43.42 43.08 1mhs n LEU 388 CO 0.45 -0.31 -0.46 -0.94 -1.11 0.00 0.00 177.39 175.01 1mhs s SER 389 N 4.90 3.72 -0.41 1.96 1.04 -1.26 -4.88 113.70 118.77 1mhs s SER 389 Ca 0.57 -1.05 -0.23 0.00 0.48 0.00 0.00 55.95 55.73 1mhs s SER 389 Cb 0.12 -1.34 0.02 0.00 0.10 0.00 0.00 66.02 64.92 1mhs s SER 389 CO 0.09 -0.15 0.76 -0.76 0.98 0.00 0.00 173.24 174.16 1mhs s LEU 390 N 1.30 4.21 0.03 2.42 1.43 -1.25 -4.68 118.68 122.15 1mhs s LEU 390 Ca -0.03 0.09 0.22 0.00 -1.03 0.00 0.00 54.13 53.37 1mhs s LEU 390 Cb -0.17 -2.96 -0.11 0.00 0.03 0.00 0.00 46.19 42.98 1mhs s LEU 390 CO -0.08 -0.80 0.85 1.41 0.23 0.00 0.00 176.35 177.96 1mhs n HIS 391 N 6.51 0.22 -1.70 0.29 8.25 -1.25 -4.46 115.22 123.08 1mhs n HIS 391 Ca 0.02 0.06 -0.37 0.00 -0.26 0.00 0.00 57.72 57.17 1mhs n HIS 391 Cb 0.48 -0.44 0.05 0.00 1.12 0.00 0.00 29.99 31.20 1mhs n HIS 391 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1mhs n ASP 392 N -2.06 7.52 -4.48 0.41 9.92 -1.26 -5.00 116.55 121.61 1mhs n ASP 392 Ca 0.00 -3.78 -0.29 0.00 -0.53 0.00 0.00 54.79 50.19 1mhs n ASP 392 Cb 0.47 -1.05 0.24 0.00 -0.64 0.00 0.00 41.12 40.14 1mhs n ASP 392 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 1mhs n PRO 393 N -0.57 -2.19 -3.65 -0.24 -0.04 -1.26 -4.03 135.00 123.03 1mhs n PRO 393 Ca 0.56 -0.60 -0.01 0.00 -0.04 0.00 0.00 63.50 63.40 1mhs n PRO 393 Cb 0.38 -2.16 -0.06 0.00 -0.04 0.00 0.00 33.50 31.61 1mhs n PRO 393 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1mhs s TYR 394 N -2.42 -0.42 0.11 0.54 -0.85 0.22 -4.94 117.35 109.59 1mhs s TYR 394 Ca 0.68 0.85 0.05 0.00 -0.52 0.00 0.00 57.07 58.12 1mhs s TYR 394 Cb -0.25 0.26 -0.04 0.00 0.38 0.00 0.00 41.96 42.32 1mhs s TYR 394 CO 0.64 -0.21 -0.12 0.95 -1.52 0.00 0.00 175.55 175.30 1mhs s THR 395 N 1.19 1.10 0.37 -3.49 -4.23 -1.26 -2.23 115.64 107.09 1mhs s THR 395 Ca -0.08 -1.68 -0.10 0.00 -1.18 0.00 0.00 61.69 58.65 1mhs s THR 395 Cb -0.03 -1.44 -0.06 0.00 1.34 0.00 0.00 72.50 72.31 1mhs s THR 395 CO -0.13 -0.51 0.72 -0.69 -0.54 0.00 0.00 174.62 173.48 1mhs s VAL 396 N -2.34 4.82 0.00 2.29 1.01 -1.26 -5.01 120.40 119.91 1mhs s VAL 396 Ca 0.07 0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.60 1mhs s VAL 396 Cb -0.04 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.63 1mhs s VAL 396 CO 0.01 -0.44 0.00 0.00 0.00 0.00 0.00 175.10 174.67 1mhs n ALA 397 N -1.12 0.00 -3.60 5.51 0.00 -1.26 -4.90 120.51 115.13 1mhs n ALA 397 Ca 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.42 1mhs n ALA 397 Cb 0.54 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.99 1mhs n ALA 397 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mhs n GLY 398 N 0.00 1.66 1.28 0.00 0.00 -1.26 -5.06 105.19 101.80 1mhs n GLY 398 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1mhs n GLY 398 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1mhs n VAL 399 N -0.38 0.00 0.00 1.61 0.31 -1.26 -5.04 118.33 113.57 1mhs n VAL 399 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 1mhs n VAL 399 Cb 0.41 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.34 1mhs n VAL 399 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1mhs n ASP 400 N -2.14 0.00 -4.57 4.52 -0.08 -1.26 -4.94 116.55 108.08 1mhs n ASP 400 Ca 0.00 0.00 -0.44 0.00 -1.51 0.00 0.00 54.79 52.84 1mhs n ASP 400 Cb 0.00 -0.67 -0.04 0.00 2.34 0.00 0.00 41.12 42.75 1mhs n ASP 400 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1mhs n PRO 401 N -1.83 1.77 0.00 -0.67 -0.02 -1.26 -4.79 135.00 128.20 1mhs n PRO 401 Ca 0.00 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 1mhs n PRO 401 Cb 0.00 -3.10 0.00 0.00 -0.02 0.00 0.00 33.50 30.38 1mhs n PRO 401 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1mhs n GLU 402 N 8.67 0.00 0.00 -0.52 1.02 -1.26 -0.04 120.64 128.51 1mhs n GLU 402 Ca 0.32 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 1mhs n GLU 402 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.83 1mhs n GLU 402 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1mhs n ASP 403 N 0.00 0.00 -0.20 1.62 9.92 -1.26 -0.06 116.55 126.56 1mhs n ASP 403 Ca 0.00 0.00 -0.09 0.00 -0.53 0.00 0.00 54.79 54.17 1mhs n ASP 403 Cb 0.00 0.00 0.02 0.00 -0.64 0.00 0.00 41.12 40.50 1mhs n ASP 403 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 1mhs h LEU 404 N 0.00 0.92 -0.30 0.64 5.85 -0.77 -1.99 115.31 119.66 1mhs h LEU 404 Ca 0.00 -0.27 -0.20 0.00 0.84 0.00 0.00 57.88 58.26 1mhs h LEU 404 Cb 0.86 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1mhs h LEU 404 CO 0.00 0.96 -0.86 -0.03 -0.34 0.00 0.00 178.44 178.17 1mhs h MET 405 N 0.85 0.23 0.49 1.25 4.05 -0.67 -3.13 114.93 118.01 1mhs h MET 405 Ca 0.17 -0.24 -0.02 0.00 -0.28 0.00 0.00 59.70 59.33 1mhs h MET 405 Cb 0.44 0.07 -0.00 0.00 -0.80 0.00 0.00 31.60 31.30 1mhs h MET 405 CO 0.01 0.96 -0.30 1.25 0.23 0.00 0.00 176.91 179.06 1mhs h LEU 406 N 0.13 -0.75 -0.21 3.39 5.85 -1.59 -1.06 115.31 121.09 1mhs h LEU 406 Ca -0.04 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1mhs h LEU 406 Cb 1.47 0.22 -0.03 0.00 0.37 0.00 0.00 40.66 42.69 1mhs h LEU 406 CO 0.13 -0.47 0.03 0.71 -0.34 0.00 0.00 178.44 178.50 1mhs h THR 407 N -0.75 0.89 -0.84 1.05 1.35 -1.46 -0.73 112.91 112.42 1mhs h THR 407 Ca -0.06 -0.04 0.01 0.00 -0.55 0.00 0.00 66.41 65.78 1mhs h THR 407 Cb 0.61 0.78 -0.04 0.00 -1.73 0.00 0.00 68.15 67.77 1mhs h THR 407 CO 0.06 0.02 0.56 0.00 -0.25 0.00 0.00 175.52 175.91 1mhs h ALA 408 N 1.16 1.42 0.01 6.62 0.00 -1.48 -1.93 119.26 125.06 1mhs h ALA 408 Ca 0.09 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1mhs h ALA 408 Cb 0.10 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1mhs h ALA 408 CO -0.14 0.53 -0.16 0.00 0.00 0.00 0.00 179.25 179.48 1mhs h LEU 410 N -0.69 -0.43 -4.89 0.00 3.38 -1.14 -3.34 115.31 108.20 1mhs h LEU 410 Ca -0.02 -0.12 -0.60 0.00 0.09 0.00 0.00 57.88 57.23 1mhs h LEU 410 Cb 0.99 0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.85 1mhs h LEU 410 CO 0.03 -0.00 3.03 0.00 0.09 0.00 0.00 178.44 181.59 1mhs n ALA 411 N -2.62 7.32 -1.78 1.53 0.00 -0.73 -3.72 120.51 120.50 1mhs n ALA 411 Ca -0.09 -3.30 0.06 0.00 0.00 0.00 0.00 53.44 50.11 1mhs n ALA 411 Cb 0.27 -3.14 0.14 0.00 0.00 0.00 0.00 19.45 16.71 1mhs n ALA 411 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mhs n ALA 412 N 3.21 3.00 -0.87 0.00 0.00 -1.26 -4.48 120.51 120.12 1mhs n ALA 412 Ca 0.72 -2.80 0.00 0.00 0.00 0.00 0.00 53.44 51.36 1mhs n ALA 412 Cb 0.34 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 19.33 1mhs n ALA 412 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1mhs n SER 413 N -0.68 0.00 0.00 0.00 7.64 -1.24 -5.01 113.62 114.33 1mhs n SER 413 Ca 0.14 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.02 1mhs n SER 413 Cb 0.80 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.00 1mhs n SER 413 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1mhs n ARG 414 N 0.00 0.00 0.00 1.43 1.85 -1.26 -5.04 116.66 113.64 1mhs n ARG 414 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1mhs n ARG 414 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1mhs n ARG 414 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1mhs n LYS 415 N 0.00 0.00 0.00 2.89 5.02 -1.26 -4.91 118.16 119.90 1mhs n LYS 415 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1mhs n LYS 415 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1mhs n LYS 415 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1mhs n LYS 416 N -2.34 0.00 0.00 1.97 5.02 -1.26 -5.06 118.16 116.48 1mhs n LYS 416 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1mhs n LYS 416 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1mhs n LYS 416 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1mhs n LYS 417 N 0.00 0.00 0.00 1.97 5.02 -1.26 -5.15 118.16 118.74 1mhs n LYS 417 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1mhs n LYS 417 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1mhs n LYS 417 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mhs n GLY 418 N 0.00 0.00 3.85 0.72 0.00 -1.26 -4.80 105.19 103.71 1mhs n GLY 418 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1mhs n GLY 418 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1mhs s ILE 419 N 0.00 1.88 0.00 -0.61 -4.36 -1.26 -5.08 121.20 111.77 1mhs s ILE 419 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 60.65 60.39 1mhs s ILE 419 Cb 0.00 -2.88 0.00 0.00 1.25 0.00 0.00 42.46 40.83 1mhs s ILE 419 CO 0.00 0.00 0.00 -0.67 0.24 0.00 0.00 174.94 174.51 1mhs n ASP 420 N -4.11 0.00 0.00 4.36 -0.08 -1.26 -5.01 116.55 110.45 1mhs n ASP 420 Ca 0.16 0.00 0.11 0.00 -1.51 0.00 0.00 54.79 53.55 1mhs n ASP 420 Cb 0.59 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.99 1mhs n ASP 420 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1mhs n ALA 421 N -3.00 4.22 -0.32 -1.67 0.00 -1.26 -4.25 120.51 114.24 1mhs n ALA 421 Ca 0.00 -0.53 -0.04 0.00 0.00 0.00 0.00 53.44 52.87 1mhs n ALA 421 Cb 0.00 -0.84 0.08 0.00 0.00 0.00 0.00 19.45 18.69 1mhs n ALA 421 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1mhs h ILE 422 N 0.00 1.24 -0.08 0.00 2.10 -1.95 -2.43 117.51 116.39 1mhs h ILE 422 Ca 0.00 -0.52 -0.20 0.00 1.08 0.00 0.00 64.86 65.22 1mhs h ILE 422 Cb 0.58 0.02 -0.00 0.00 -1.09 0.00 0.00 36.82 36.33 1mhs h ILE 422 CO 0.00 0.25 -0.78 0.44 -1.08 0.00 0.00 178.15 176.98 1mhs h ASP 423 N 1.19 0.59 -0.99 2.19 5.19 -1.91 -3.14 116.42 119.55 1mhs h ASP 423 Ca 0.31 -0.40 0.07 0.00 -0.62 0.00 0.00 57.03 56.39 1mhs h ASP 423 Cb -0.05 -0.18 -0.07 0.00 0.18 0.00 0.00 39.33 39.22 1mhs h ASP 423 CO -0.06 1.16 0.64 0.50 -3.12 0.00 0.00 179.24 178.36 1mhs h LYS 424 N 0.32 1.11 -0.82 3.56 3.64 -1.65 0.71 116.57 123.45 1mhs h LYS 424 Ca -0.05 -0.07 0.09 0.00 -1.27 0.00 0.00 60.65 59.35 1mhs h LYS 424 Cb 1.38 -0.25 -0.06 0.00 -0.41 0.00 0.00 32.23 32.89 1mhs h LYS 424 CO 0.14 0.73 0.53 0.00 -2.27 0.00 0.00 179.45 178.59 1mhs h ALA 425 N 1.47 1.69 -0.31 5.00 0.00 -1.41 0.79 119.26 126.49 1mhs h ALA 425 Ca 0.43 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.19 1mhs h ALA 425 Cb 0.20 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1mhs h ALA 425 CO -0.18 0.16 -0.36 0.74 0.00 0.00 0.00 179.25 179.62 1mhs h PHE 426 N 0.81 0.95 0.20 0.00 -1.00 -0.98 -0.76 116.94 116.16 1mhs h PHE 426 Ca 0.37 -0.30 0.00 0.00 2.81 0.00 0.00 57.97 60.85 1mhs h PHE 426 Cb 0.37 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 39.72 1mhs h PHE 426 CO -0.00 1.08 -0.19 1.25 -1.61 0.00 0.00 178.31 178.84 1mhs h LEU 427 N 0.54 -0.49 -0.97 1.54 5.85 0.41 -1.06 115.31 121.13 1mhs h LEU 427 Ca 0.04 0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.73 1mhs h LEU 427 Cb 0.94 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.12 1mhs h LEU 427 CO 0.09 -0.28 -0.13 0.50 -0.34 0.00 0.00 178.44 178.28 1mhs h LYS 428 N -0.41 0.61 -0.03 1.25 3.64 -0.96 -2.88 116.57 117.79 1mhs h LYS 428 Ca -0.00 -0.19 0.03 0.00 -1.27 0.00 0.00 60.65 59.22 1mhs h LYS 428 Cb 0.38 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.10 1mhs h LYS 428 CO -0.04 0.72 -0.21 0.77 -2.27 0.00 0.00 179.45 178.42 1mhs h SER 429 N 0.55 -0.63 -0.51 4.20 0.02 -0.69 0.03 113.55 116.53 1mhs h SER 429 Ca 0.10 0.09 0.10 0.00 -0.84 0.00 0.00 61.79 61.24 1mhs h SER 429 Cb 0.54 0.26 -0.09 0.00 0.14 0.00 0.00 62.40 63.26 1mhs h SER 429 CO 0.03 -0.27 -0.02 -0.07 -1.14 0.00 0.00 176.83 175.36 1mhs h LEU 430 N -0.32 -0.26 -0.39 5.07 -0.00 -1.05 -0.34 115.31 118.01 1mhs h LEU 430 Ca 0.07 0.13 0.08 0.00 -0.00 0.00 0.00 57.88 58.16 1mhs h LEU 430 Cb 0.41 0.23 -0.09 0.00 -0.00 0.00 0.00 40.66 41.22 1mhs h LEU 430 CO -0.21 -0.09 -0.25 0.11 -0.00 0.00 0.00 178.44 177.99 1mhs h LYS 431 N 0.09 -0.18 -0.81 1.13 1.57 -1.11 0.91 116.57 118.18 1mhs h LYS 431 Ca 0.26 0.01 0.14 0.00 -1.87 0.00 0.00 60.65 59.18 1mhs h LYS 431 Cb 0.39 0.04 -0.14 0.00 0.08 0.00 0.00 32.23 32.60 1mhs h LYS 431 CO -0.44 -0.12 -0.34 1.88 -0.57 0.00 0.00 179.45 179.85 1mhs h TYR 432 N -0.18 -0.94 0.00 -1.35 0.05 0.70 -3.31 116.97 111.94 1mhs h TYR 432 Ca 0.19 0.09 0.00 0.00 0.05 0.00 0.00 58.73 59.05 1mhs h TYR 432 Cb 0.48 0.53 0.00 0.00 1.01 0.00 0.00 36.73 38.75 1mhs h TYR 432 CO -0.47 -0.39 0.00 0.66 -1.05 0.00 0.00 178.16 176.91 1mhs n TYR 433 N -5.47 0.00 0.00 4.88 4.01 0.31 -4.80 117.16 116.09 1mhs n TYR 433 Ca 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 1mhs n TYR 433 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.42 1mhs n TYR 433 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1mhs n PRO 434 N 0.00 0.00 0.00 -0.72 -0.02 -1.22 -4.98 135.00 128.07 1mhs n PRO 434 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1mhs n PRO 434 Cb 0.00 -0.06 0.00 0.00 -0.02 0.00 0.00 33.50 33.42 1mhs n PRO 434 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1mhs n ARG 435 N 0.00 0.00 0.00 -0.52 1.74 -1.25 -4.95 116.66 111.69 1mhs n ARG 435 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1mhs n ARG 435 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1mhs n ARG 435 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1mhs n ALA 436 N 0.00 0.00 -2.19 7.54 0.00 -1.26 -4.97 120.51 119.64 1mhs n ALA 436 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1mhs n ALA 436 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1mhs n ALA 436 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1mhs n LYS 437 N 0.00 0.00 -0.21 0.00 0.00 -1.26 -5.07 118.16 111.63 1mhs n LYS 437 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 58.31 58.29 1mhs n LYS 437 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 1mhs n LYS 437 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1mhs n SER 438 N 0.00 -0.39 0.00 -5.58 3.41 -1.26 -4.42 113.62 105.37 1mhs n SER 438 Ca 0.00 0.92 0.00 0.00 -0.26 0.00 0.00 58.87 59.53 1mhs n SER 438 Cb 0.00 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 1mhs n SER 438 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1mhs n VAL 439 N -4.74 0.00 0.00 -3.33 3.14 -1.26 -1.28 118.33 110.86 1mhs n VAL 439 Ca 0.04 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.42 1mhs n VAL 439 Cb 0.19 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.97 1mhs n VAL 439 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 1mhs n LEU 440 N 0.00 0.00 -4.62 6.55 7.94 -1.26 -4.09 117.00 121.52 1mhs n LEU 440 Ca 0.00 0.11 -0.43 0.00 -1.11 0.00 0.00 56.01 54.58 1mhs n LEU 440 Cb 0.00 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 43.93 1mhs n LEU 440 CO 0.00 0.00 1.37 -0.44 -1.11 0.00 0.00 177.39 177.21 1mhs s SER 441 N -2.72 6.30 0.00 1.96 0.01 -0.40 -4.81 113.70 114.04 1mhs s SER 441 Ca 0.00 1.44 0.00 0.00 1.31 0.00 0.00 55.95 58.70 1mhs s SER 441 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1mhs s SER 441 CO 0.00 -1.35 0.00 1.17 0.41 0.00 0.00 173.24 173.47 1mhs n LYS 442 N 7.83 0.00 -0.92 12.44 4.81 -1.26 -4.24 118.16 136.83 1mhs n LYS 442 Ca 0.19 0.00 0.09 0.00 -0.87 0.00 0.00 58.31 57.72 1mhs n LYS 442 Cb 0.46 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.46 1mhs n LYS 442 CO 0.00 0.00 0.00 2.48 1.17 0.00 0.00 177.40 181.05 1mhs n TYR 443 N 7.66 -2.48 -3.66 5.64 0.18 -1.26 -4.92 117.16 118.32 1mhs n TYR 443 Ca 0.00 1.36 -0.39 0.00 1.88 0.00 0.00 57.90 60.75 1mhs n TYR 443 Cb 0.00 -2.25 -0.11 0.00 -0.38 0.00 0.00 39.34 36.60 1mhs n TYR 443 CO 0.00 0.00 0.00 0.21 -2.08 0.00 0.00 176.86 174.99 1mhs s LYS 444 N -4.04 2.56 -0.13 -3.48 2.20 -1.26 -5.08 119.74 110.51 1mhs s LYS 444 Ca 0.00 -1.40 0.00 0.00 -0.36 0.00 0.00 55.97 54.21 1mhs s LYS 444 Cb 0.00 -3.67 -0.01 0.00 -1.51 0.00 0.00 37.83 32.64 1mhs s LYS 444 CO 0.00 -0.88 -0.14 0.08 -0.36 0.00 0.00 175.35 174.05 1mhs s VAL 445 N 1.40 2.91 0.00 4.02 1.01 -1.26 -2.34 120.40 126.13 1mhs s VAL 445 Ca 0.02 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.29 1mhs s VAL 445 Cb -0.22 -2.21 0.00 0.00 0.00 0.00 0.00 36.38 33.95 1mhs s VAL 445 CO 0.02 0.53 0.00 -0.11 0.00 0.00 0.00 175.10 175.53 1mhs n LEU 446 N 3.59 0.74 -4.64 3.92 7.94 -1.26 -5.08 117.00 122.21 1mhs n LEU 446 Ca -0.18 0.00 -0.31 0.00 -1.11 0.00 0.00 56.01 54.41 1mhs n LEU 446 Cb 0.53 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.38 1mhs n LEU 446 CO 0.30 0.04 -0.36 -1.10 -1.11 0.00 0.00 177.39 175.16 1mhs s GLN 447 N -1.91 2.53 -0.07 1.96 -0.21 -1.25 -5.09 119.66 115.62 1mhs s GLN 447 Ca 0.00 -0.78 -0.02 0.00 0.02 0.00 0.00 55.36 54.57 1mhs s GLN 447 Cb 0.00 -2.52 0.04 0.00 1.00 0.00 0.00 33.01 31.53 1mhs s GLN 447 CO 0.00 0.57 0.05 -0.06 -2.12 0.00 0.00 175.29 173.73 1mhs s PHE 448 N -1.15 0.25 -0.53 0.91 0.40 -1.26 -2.52 117.98 114.08 1mhs s PHE 448 Ca 0.21 0.04 -0.27 0.00 -0.60 0.00 0.00 56.93 56.30 1mhs s PHE 448 Cb -0.11 -0.60 0.03 0.00 0.51 0.00 0.00 43.02 42.84 1mhs s PHE 448 CO 0.13 -0.28 1.10 -1.01 0.70 0.00 0.00 175.22 175.86 1mhs s HIS 449 N 2.11 2.74 0.26 0.36 3.76 -0.40 -4.97 115.29 119.14 1mhs s HIS 449 Ca 0.04 0.43 -0.31 0.00 -0.15 0.00 0.00 55.06 55.08 1mhs s HIS 449 Cb -0.13 -4.36 -0.12 0.00 1.11 0.00 0.00 32.58 29.08 1mhs s HIS 449 CO -0.05 -1.40 1.53 -2.30 -0.85 0.00 0.00 174.74 171.68 1mhs n PRO 450 N 7.95 2.42 -1.52 8.40 -0.01 -1.26 -3.39 135.00 147.59 1mhs n PRO 450 Ca 0.08 0.86 -0.45 0.00 -0.01 0.00 0.00 63.50 63.99 1mhs n PRO 450 Cb 0.49 -2.60 -0.05 0.00 -0.01 0.00 0.00 33.50 31.32 1mhs n PRO 450 CO 0.00 0.00 0.00 1.97 -0.01 0.00 0.00 175.50 177.46 1mhs n PHE 451 N 2.28 1.64 -3.40 6.00 1.16 -1.26 -4.93 117.46 118.96 1mhs n PHE 451 Ca 0.11 0.11 -0.34 0.00 -1.87 0.00 0.00 57.45 55.46 1mhs n PHE 451 Cb 0.34 -2.61 -0.06 0.00 -1.61 0.00 0.00 39.48 35.54 1mhs n PHE 451 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 1mhs s ASP 452 N 8.66 6.73 0.15 5.98 -4.77 -1.25 -4.91 116.67 127.27 1mhs s ASP 452 Ca 1.06 0.99 -0.16 0.00 -3.30 0.00 0.00 52.55 51.14 1mhs s ASP 452 Cb -0.57 -2.26 0.03 0.00 -1.09 0.00 0.00 42.92 39.03 1mhs s ASP 452 CO 0.40 0.04 1.79 -0.65 0.70 0.00 0.00 175.17 177.45 1mhs h PRO 453 N 3.17 0.40 0.00 2.11 0.10 -1.93 -2.95 132.00 132.91 1mhs h PRO 453 Ca -0.48 -0.02 0.00 0.00 0.10 0.00 0.00 66.00 65.60 1mhs h PRO 453 Cb 1.18 -0.09 0.00 0.00 0.10 0.00 0.00 31.00 32.19 1mhs h PRO 453 CO 0.67 0.27 0.00 0.28 0.10 0.00 0.00 178.00 179.32 1mhs n VAL 454 N -4.90 0.00 0.19 3.15 0.31 -1.26 -2.29 118.33 113.53 1mhs n VAL 454 Ca 0.01 1.01 0.18 0.00 -0.01 0.00 0.00 64.34 65.52 1mhs n VAL 454 Cb 0.07 -1.71 0.82 0.00 -0.91 0.00 0.00 33.84 32.12 1mhs n VAL 454 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1mhs h SER 455 N 0.00 0.00 -5.45 4.52 0.02 -2.02 -3.47 113.55 107.15 1mhs h SER 455 Ca 0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 1mhs h SER 455 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1mhs h SER 455 CO 0.00 0.00 -0.57 1.17 -1.14 0.00 0.00 176.83 176.29 1mhs n LYS 456 N -3.68 -2.27 0.00 3.45 4.81 -0.97 -4.66 118.16 114.84 1mhs n LYS 456 Ca 0.03 2.00 0.00 0.00 -0.87 0.00 0.00 58.31 59.47 1mhs n LYS 456 Cb 0.39 -5.22 0.00 0.00 0.02 0.00 0.00 35.03 30.23 1mhs n LYS 456 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 1mhs n LYS 457 N -0.38 0.00 -2.92 1.64 2.85 -1.25 -4.17 118.16 113.93 1mhs n LYS 457 Ca 0.09 0.00 -0.18 0.00 -1.05 0.00 0.00 58.31 57.16 1mhs n LYS 457 Cb 0.49 0.00 0.02 0.00 -0.65 0.00 0.00 35.03 34.89 1mhs n LYS 457 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 177.40 177.49 1mhs s VAL 458 N -1.83 2.94 -0.12 0.58 -7.23 0.46 -3.75 120.40 111.45 1mhs s VAL 458 Ca 0.00 -0.91 -0.31 0.00 -1.81 0.00 0.00 61.98 58.95 1mhs s VAL 458 Cb 0.00 -3.01 0.12 0.00 0.56 0.00 0.00 36.38 34.05 1mhs s VAL 458 CO 0.00 -0.01 1.04 -0.69 -0.31 0.00 0.00 175.10 175.13 1mhs s VAL 459 N -2.46 0.00 -0.05 1.32 1.01 -1.22 -2.23 120.40 116.77 1mhs s VAL 459 Ca 0.55 0.00 -0.02 0.00 0.00 0.00 0.00 61.98 62.51 1mhs s VAL 459 Cb -0.10 -1.00 0.04 0.00 0.00 0.00 0.00 36.38 35.32 1mhs s VAL 459 CO 0.34 0.00 0.11 0.00 0.00 0.00 0.00 175.10 175.55 1mhs s ALA 460 N -2.25 -0.10 -0.46 5.51 0.00 -0.84 -1.27 121.76 122.35 1mhs s ALA 460 Ca 0.05 0.51 -0.24 0.00 0.00 0.00 0.00 51.96 52.27 1mhs s ALA 460 Cb -0.01 -0.49 0.03 0.00 0.00 0.00 0.00 23.12 22.65 1mhs s ALA 460 CO -0.05 -0.26 0.85 0.08 0.00 0.00 0.00 175.76 176.39 1mhs s VAL 461 N 1.46 4.56 0.17 0.00 1.01 -1.05 -2.61 120.40 123.95 1mhs s VAL 461 Ca -0.05 0.56 0.10 0.00 0.00 0.00 0.00 61.98 62.59 1mhs s VAL 461 Cb -0.12 -4.38 -0.04 0.00 0.00 0.00 0.00 36.38 31.83 1mhs s VAL 461 CO -0.05 -0.79 -0.20 0.68 0.00 0.00 0.00 175.10 174.74 1mhs s VAL 462 N 3.52 2.61 -0.07 2.92 -7.23 -0.99 -3.86 120.40 117.30 1mhs s VAL 462 Ca 0.33 -1.85 -0.01 0.00 -1.81 0.00 0.00 61.98 58.64 1mhs s VAL 462 Cb -0.11 -2.24 0.03 0.00 0.56 0.00 0.00 36.38 34.61 1mhs s VAL 462 CO 0.24 -0.06 -0.00 -0.70 -0.31 0.00 0.00 175.10 174.27 1mhs s GLU 463 N -2.57 0.60 1.15 4.82 2.12 -0.99 -3.61 118.70 120.22 1mhs s GLU 463 Ca 0.21 0.10 -0.16 0.00 0.36 0.00 0.00 54.97 55.47 1mhs s GLU 463 Cb -0.09 -0.94 0.26 0.00 0.26 0.00 0.00 34.13 33.63 1mhs s GLU 463 CO 0.11 -0.28 1.07 -1.54 -0.54 0.00 0.00 175.26 174.07 1mhs s SER 464 N 1.87 1.28 0.00 -1.70 1.04 -1.26 -4.31 113.70 110.62 1mhs s SER 464 Ca 0.03 1.00 0.00 0.00 0.48 0.00 0.00 55.95 57.46 1mhs s SER 464 Cb -0.12 -1.51 0.00 0.00 0.10 0.00 0.00 66.02 64.49 1mhs s SER 464 CO -0.05 -3.94 0.33 -2.65 0.98 0.00 0.00 173.24 167.91 1mhs n PRO 465 N -4.69 0.00 -3.31 4.02 -0.02 -1.26 -4.38 135.00 125.36 1mhs n PRO 465 Ca 0.08 0.04 -0.45 0.00 -2.02 0.00 0.00 63.50 61.15 1mhs n PRO 465 Cb 0.58 -0.83 -0.06 0.00 -0.02 0.00 0.00 33.50 33.17 1mhs n PRO 465 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1mhs s GLN 466 N -0.66 3.00 0.17 -0.52 -0.21 -1.26 -5.01 119.66 115.17 1mhs s GLN 466 Ca 0.00 -1.52 -0.24 0.00 0.02 0.00 0.00 55.36 53.62 1mhs s GLN 466 Cb 0.00 -4.23 0.06 0.00 1.00 0.00 0.00 33.01 29.84 1mhs s GLN 466 CO 0.00 -1.24 0.95 0.20 -2.12 0.00 0.00 175.29 173.07 1mhs s GLY 467 N 3.23 -0.19 0.00 3.09 0.00 -1.26 -5.12 107.32 107.07 1mhs s GLY 467 Ca 0.05 0.04 0.00 0.00 0.00 0.00 0.00 44.72 44.81 1mhs s GLY 467 CO 0.05 0.13 0.00 1.18 0.00 0.00 0.00 173.10 174.45 1mhs n GLU 468 N -0.49 0.00 -3.56 2.90 1.02 -1.26 -4.92 120.64 114.33 1mhs n GLU 468 Ca -0.06 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.01 1mhs n GLU 468 Cb 0.60 -0.34 -0.03 0.00 -0.02 0.00 0.00 31.44 31.65 1mhs n GLU 468 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1mhs s ARG 469 N 0.00 0.52 -0.22 3.49 0.52 -1.26 -5.00 118.95 117.00 1mhs s ARG 469 Ca 0.00 -0.10 -0.27 0.00 -0.52 0.00 0.00 55.73 54.84 1mhs s ARG 469 Cb 0.00 0.24 0.08 0.00 0.52 0.00 0.00 34.95 35.80 1mhs s ARG 469 CO 0.00 -0.21 0.79 -1.50 0.02 0.00 0.00 175.30 174.40 1mhs s ILE 470 N -2.22 0.00 -0.12 1.52 1.10 -1.24 -5.00 121.20 115.24 1mhs s ILE 470 Ca 0.05 0.00 -0.04 0.00 -0.51 0.00 0.00 60.65 60.15 1mhs s ILE 470 Cb -0.01 -1.00 0.05 0.00 0.15 0.00 0.00 42.46 41.65 1mhs s ILE 470 CO -0.05 0.00 0.09 -0.89 -2.11 0.00 0.00 174.94 171.99 1mhs s THR 471 N -0.07 -0.13 -0.00 4.00 2.01 -1.26 -2.35 115.64 117.83 1mhs s THR 471 Ca -0.02 0.10 -0.15 0.00 0.31 0.00 0.00 61.69 61.93 1mhs s THR 471 Cb -0.04 -0.41 -0.06 0.00 0.01 0.00 0.00 72.50 72.01 1mhs s THR 471 CO 0.02 -0.07 0.42 0.00 -0.69 0.00 0.00 174.62 174.29 1mhs s VAL 473 N -0.96 1.79 0.01 0.00 1.01 -1.26 -1.99 120.40 119.00 1mhs s VAL 473 Ca 0.24 -1.46 -0.07 0.00 0.00 0.00 0.00 61.98 60.70 1mhs s VAL 473 Cb -0.17 -1.60 -0.00 0.00 0.00 0.00 0.00 36.38 34.61 1mhs s VAL 473 CO 0.13 0.06 0.12 -1.59 0.00 0.00 0.00 175.10 173.83 1mhs s LYS 474 N -1.67 0.49 0.00 2.72 -2.85 -0.94 -3.06 119.74 114.43 1mhs s LYS 474 Ca 0.08 -0.47 0.00 0.00 -1.00 0.00 0.00 55.97 54.58 1mhs s LYS 474 Cb -0.10 0.20 0.00 0.00 -2.06 0.00 0.00 37.83 35.87 1mhs s LYS 474 CO 0.04 -0.12 0.00 0.41 0.10 0.00 0.00 175.35 175.78 1mhs n GLY 475 N 1.34 -0.89 3.44 0.59 0.00 -0.94 -0.40 105.19 108.33 1mhs n GLY 475 Ca -0.22 -1.50 -0.46 0.00 0.00 0.00 0.00 46.02 43.84 1mhs n GLY 475 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mhs n ALA 476 N -0.35 -2.08 0.11 4.61 0.00 -1.26 -0.10 120.51 121.44 1mhs n ALA 476 Ca 0.00 0.37 -0.04 0.00 0.00 0.00 0.00 53.44 53.76 1mhs n ALA 476 Cb 0.00 -1.72 -0.02 0.00 0.00 0.00 0.00 19.45 17.71 1mhs n ALA 476 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1mhs h PRO 477 N 1.15 -0.28 -0.30 0.00 0.10 -1.87 -3.07 132.00 127.73 1mhs h PRO 477 Ca -0.33 0.02 0.03 0.00 0.10 0.00 0.00 66.00 65.82 1mhs h PRO 477 Cb 1.41 0.06 -0.04 0.00 0.10 0.00 0.00 31.00 32.54 1mhs h PRO 477 CO 0.56 -0.19 -0.18 1.28 0.10 0.00 0.00 178.00 179.58 1mhs n LEU 478 N -2.78 -0.32 -0.12 2.35 4.77 -1.26 -1.53 117.00 118.10 1mhs n LEU 478 Ca -0.04 1.03 -0.08 0.00 -0.03 0.00 0.00 56.01 56.90 1mhs n LEU 478 Cb 0.11 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1mhs n LEU 478 CO 0.09 -0.69 1.02 -0.26 -1.33 0.00 0.00 177.39 176.22 1mhs h PHE 479 N 0.00 0.44 0.22 -1.77 -1.00 -1.92 -1.92 116.94 110.99 1mhs h PHE 479 Ca 0.05 0.01 0.01 0.00 2.81 0.00 0.00 57.97 60.85 1mhs h PHE 479 Cb 0.12 -0.15 -0.03 0.00 3.61 0.00 0.00 35.95 39.51 1mhs h PHE 479 CO -0.77 0.27 -0.28 0.28 -1.61 0.00 0.00 178.31 176.19 1mhs h VAL 480 N 0.48 0.40 0.00 -0.55 2.07 -1.29 -1.72 116.25 115.64 1mhs h VAL 480 Ca 0.15 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.67 1mhs h VAL 480 Cb -0.02 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1mhs h VAL 480 CO -0.05 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.72 1mhs n LEU 481 N -5.40 0.16 0.20 2.57 4.32 -0.58 -1.81 117.00 116.46 1mhs n LEU 481 Ca -0.08 0.54 0.04 0.00 -0.02 0.00 0.00 56.01 56.49 1mhs n LEU 481 Cb 0.30 -0.52 0.41 0.00 -1.62 0.00 0.00 43.42 41.99 1mhs n LEU 481 CO 0.27 -0.34 0.79 0.50 -1.22 0.00 0.00 177.39 177.38 1mhs h LYS 482 N 0.00 0.00 0.00 3.23 3.64 -0.48 -3.31 116.57 119.65 1mhs h LYS 482 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1mhs h LYS 482 Cb 0.26 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1mhs h LYS 482 CO 0.00 0.31 0.00 2.41 -2.27 0.00 0.00 179.45 179.90 1mhs n THR 483 N -4.16 0.00 0.00 1.00 -1.04 -0.75 -5.03 114.28 104.30 1mhs n THR 483 Ca -0.02 0.21 0.00 0.00 -2.04 0.00 0.00 64.05 62.20 1mhs n THR 483 Cb 0.35 -0.65 0.00 0.00 -1.82 0.00 0.00 70.33 68.21 1mhs n THR 483 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 1mhs n VAL 484 N -1.16 0.00 0.00 12.58 3.14 -1.17 -4.64 118.33 127.08 1mhs n VAL 484 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1mhs n VAL 484 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1mhs n VAL 484 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 1mhs n GLU 485 N 0.00 0.00 -0.30 1.45 2.13 0.17 -4.62 120.64 119.47 1mhs n GLU 485 Ca 0.00 0.00 0.02 0.00 0.66 0.00 0.00 57.16 57.84 1mhs n GLU 485 Cb 0.00 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 31.70 1mhs n GLU 485 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87 1mhs n GLU 486 N -2.11 -0.74 0.00 5.31 0.28 -0.16 -2.88 120.64 120.34 1mhs n GLU 486 Ca 0.00 0.59 0.00 0.00 -0.16 0.00 0.00 57.16 57.59 1mhs n GLU 486 Cb 0.00 -0.80 0.00 0.00 1.43 0.00 0.00 31.44 32.07 1mhs n GLU 486 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1mhs n ASP 487 N -2.17 0.00 -4.77 -1.84 -0.08 -1.26 -3.98 116.55 102.45 1mhs n ASP 487 Ca -0.01 0.01 -0.34 0.00 -1.51 0.00 0.00 54.79 52.94 1mhs n ASP 487 Cb 0.12 0.00 0.02 0.00 2.34 0.00 0.00 41.12 43.60 1mhs n ASP 487 CO 0.00 0.00 0.00 -2.28 0.12 0.00 0.00 177.20 175.04 1mhs s HIS 488 N -0.27 2.68 0.79 -0.67 2.46 -1.26 -4.96 115.29 114.06 1mhs s HIS 488 Ca 0.00 1.55 -0.14 0.00 0.47 0.00 0.00 55.06 56.93 1mhs s HIS 488 Cb 0.00 -3.22 0.05 0.00 -0.13 0.00 0.00 32.58 29.28 1mhs s HIS 488 CO 0.00 -1.57 1.01 -2.30 -2.47 0.00 0.00 174.74 169.41 1mhs n PRO 489 N -1.80 0.25 -2.10 2.88 -0.02 -1.26 -4.81 135.00 128.14 1mhs n PRO 489 Ca 0.11 0.15 -0.29 0.00 -2.02 0.00 0.00 63.50 61.45 1mhs n PRO 489 Cb 0.52 -2.28 -0.06 0.00 -0.02 0.00 0.00 33.50 31.66 1mhs n PRO 489 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1mhs s ILE 490 N -2.04 3.57 0.84 4.25 1.09 -1.14 -4.96 121.20 122.82 1mhs s ILE 490 Ca 0.71 -0.92 -0.12 0.00 -1.10 0.00 0.00 60.65 59.22 1mhs s ILE 490 Cb -0.30 -4.55 0.10 0.00 -1.06 0.00 0.00 42.46 36.65 1mhs s ILE 490 CO 0.53 -1.06 1.18 -2.16 -0.10 0.00 0.00 174.94 173.33 1mhs s PRO 491 N 6.37 1.44 0.08 2.79 0.05 -1.26 -4.87 135.00 139.59 1mhs s PRO 491 Ca 0.67 1.68 -0.29 0.00 0.05 0.00 0.00 61.00 63.11 1mhs s PRO 491 Cb -0.01 -1.76 -0.17 0.00 0.05 0.00 0.00 34.50 32.60 1mhs s PRO 491 CO 0.11 -2.34 1.66 0.93 0.05 0.00 0.00 177.00 177.40 1mhs h GLU 492 N -1.23 -0.55 -0.10 4.56 5.08 -1.99 -2.50 114.58 117.85 1mhs h GLU 492 Ca -0.45 0.04 0.01 0.00 -1.00 0.00 0.00 59.36 57.96 1mhs h GLU 492 Cb 1.29 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.64 1mhs h GLU 492 CO 0.45 -0.36 -0.11 0.93 -1.00 0.00 0.00 179.01 178.92 1mhs h GLU 493 N -0.58 -0.06 -0.99 2.33 5.08 -1.99 0.73 114.58 119.10 1mhs h GLU 493 Ca -0.06 0.00 0.22 0.00 -1.00 0.00 0.00 59.36 58.53 1mhs h GLU 493 Cb 0.44 0.01 -0.19 0.00 0.50 0.00 0.00 28.75 29.52 1mhs h GLU 493 CO 0.10 -0.04 -0.16 0.28 -1.00 0.00 0.00 179.01 178.18 1mhs h VAL 494 N -0.06 0.01 0.00 3.13 2.07 -1.94 0.15 116.25 119.61 1mhs h VAL 494 Ca 0.02 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1mhs h VAL 494 Cb 0.11 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.88 1mhs h VAL 494 CO -0.13 0.00 0.00 -0.67 0.02 0.00 0.00 177.57 176.79 1mhs n ASP 495 N -5.59 0.00 -0.32 0.57 2.03 -0.49 -1.46 116.55 111.30 1mhs n ASP 495 Ca 0.18 0.75 -0.03 0.00 0.52 0.00 0.00 54.79 56.21 1mhs n ASP 495 Cb 0.58 -0.25 0.01 0.00 -0.72 0.00 0.00 41.12 40.74 1mhs n ASP 495 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1mhs n GLN 496 N -1.30 -0.23 -0.01 -0.67 6.02 0.13 -0.07 117.38 121.25 1mhs n GLN 496 Ca 0.00 1.25 -0.10 0.00 -0.01 0.00 0.00 57.00 58.14 1mhs n GLN 496 Cb 0.00 -1.85 -0.03 0.00 1.02 0.00 0.00 30.24 29.38 1mhs n GLN 496 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1mhs h ALA 497 N 0.97 -0.26 -0.32 -1.58 0.00 -0.77 -2.06 119.26 115.24 1mhs h ALA 497 Ca 0.25 0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.27 1mhs h ALA 497 Cb 0.45 0.54 -0.08 0.00 0.00 0.00 0.00 17.79 18.70 1mhs h ALA 497 CO -0.80 -0.73 -0.32 -0.92 0.00 0.00 0.00 179.25 176.47 1mhs h TYR 498 N -0.33 -0.90 0.00 0.00 3.20 0.67 -2.31 116.97 117.31 1mhs h TYR 498 Ca 0.11 0.05 0.00 0.00 3.14 0.00 0.00 58.73 62.03 1mhs h TYR 498 Cb 0.50 0.44 0.00 0.00 1.54 0.00 0.00 36.73 39.21 1mhs h TYR 498 CO -0.39 -0.39 0.00 1.17 -1.64 0.00 0.00 178.16 176.92 1mhs n LYS 499 N -5.41 0.00 -0.26 1.82 0.00 -0.82 -2.28 118.16 111.21 1mhs n LYS 499 Ca -0.00 0.68 -0.02 0.00 0.00 0.00 0.00 58.31 58.98 1mhs n LYS 499 Cb 0.33 -1.46 0.01 0.00 0.00 0.00 0.00 35.03 33.91 1mhs n LYS 499 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1mhs n ASN 500 N -2.32 -0.47 -0.00 3.14 3.02 -0.81 0.24 115.26 118.07 1mhs n ASN 500 Ca 0.00 1.17 -0.09 0.00 -0.03 0.00 0.00 54.58 55.63 1mhs n ASN 500 Cb 0.00 -0.25 -0.03 0.00 -0.61 0.00 0.00 39.78 38.89 1mhs n ASN 500 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1mhs h LYS 501 N 0.00 -0.15 -0.83 3.52 3.64 -1.27 0.31 116.57 121.80 1mhs h LYS 501 Ca 0.22 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.67 1mhs h LYS 501 Cb 0.38 0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 32.17 1mhs h LYS 501 CO -0.66 -0.10 0.50 -0.24 -2.27 0.00 0.00 179.45 176.69 1mhs h VAL 502 N -0.15 1.00 0.03 2.00 3.04 0.23 0.13 116.25 122.53 1mhs h VAL 502 Ca 0.09 -0.31 -0.00 0.00 -1.01 0.00 0.00 66.70 65.47 1mhs h VAL 502 Cb 0.28 0.03 0.00 0.00 -2.01 0.00 0.00 31.29 29.59 1mhs h VAL 502 CO -0.22 0.16 -0.02 0.00 -1.01 0.00 0.00 177.57 176.49 1mhs h ALA 503 N 1.41 -0.04 -0.82 3.17 0.00 -0.24 0.98 119.26 123.71 1mhs h ALA 503 Ca 0.37 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.35 1mhs h ALA 503 Cb 0.22 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.94 1mhs h ALA 503 CO -0.19 -0.49 0.44 0.93 0.00 0.00 0.00 179.25 179.95 1mhs h GLU 504 N -0.12 0.69 -0.12 0.00 5.08 0.44 -1.40 114.58 119.15 1mhs h GLU 504 Ca -0.00 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1mhs h GLU 504 Cb 0.10 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.19 1mhs h GLU 504 CO 0.01 0.45 -0.03 0.74 -1.00 0.00 0.00 179.01 179.18 1mhs h PHE 505 N 0.71 0.27 -0.00 4.33 0.04 -0.43 -3.29 116.94 118.57 1mhs h PHE 505 Ca 0.42 -0.06 0.00 0.00 2.80 0.00 0.00 57.97 61.13 1mhs h PHE 505 Cb 0.47 -0.06 0.00 0.00 2.20 0.00 0.00 35.95 38.56 1mhs h PHE 505 CO -0.08 0.54 -0.02 0.00 -0.60 0.00 0.00 178.31 178.15 1mhs n ALA 506 N -2.34 2.60 1.08 2.45 0.00 0.31 -2.60 120.51 122.01 1mhs n ALA 506 Ca -0.06 -0.19 0.12 0.00 0.00 0.00 0.00 53.44 53.31 1mhs n ALA 506 Cb 0.25 -1.46 0.31 0.00 0.00 0.00 0.00 19.45 18.55 1mhs n ALA 506 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1mhs n THR 507 N -1.10 0.13 -2.21 0.00 -2.24 -0.57 -3.74 114.28 104.55 1mhs n THR 507 Ca 0.17 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1mhs n THR 507 Cb 0.21 0.88 -0.01 0.00 -2.10 0.00 0.00 70.33 69.31 1mhs n THR 507 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1mhs n ARG 508 N 0.81 0.00 0.00 -0.78 1.74 -1.22 -5.00 116.66 112.21 1mhs n ARG 508 Ca 0.17 -1.29 0.00 0.00 -0.77 0.00 0.00 57.85 55.96 1mhs n ARG 508 Cb 0.47 -0.03 0.00 0.00 -1.02 0.00 0.00 32.46 31.89 1mhs n ARG 508 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1mhs n GLY 509 N 0.21 0.13 1.82 -0.13 0.00 -1.15 -4.95 105.19 101.12 1mhs n GLY 509 Ca -0.03 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.34 1mhs n GLY 509 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1mhs n PHE 510 N 0.00 -4.38 -3.62 1.61 7.35 0.78 -2.08 117.46 117.12 1mhs n PHE 510 Ca 0.00 2.55 -0.39 0.00 -0.76 0.00 0.00 57.45 58.85 1mhs n PHE 510 Cb 0.00 -3.49 -0.08 0.00 0.35 0.00 0.00 39.48 36.26 1mhs n PHE 510 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 1mhs s ARG 511 N -1.27 2.85 0.33 -4.13 3.00 0.31 -4.24 118.95 115.79 1mhs s ARG 511 Ca 0.00 -2.55 -0.28 0.00 -1.00 0.00 0.00 55.73 51.89 1mhs s ARG 511 Cb 0.00 -3.91 -0.10 0.00 0.00 0.00 0.00 34.95 30.94 1mhs s ARG 511 CO 0.00 -1.21 1.25 -1.54 0.00 0.00 0.00 175.30 173.80 1mhs s SER 512 N 0.99 6.85 -0.03 -2.12 1.04 -1.26 -3.40 113.70 115.77 1mhs s SER 512 Ca 0.18 2.56 0.04 0.00 0.48 0.00 0.00 55.95 59.21 1mhs s SER 512 Cb -0.17 -2.64 -0.00 0.00 0.10 0.00 0.00 66.02 63.30 1mhs s SER 512 CO -0.05 -0.47 -0.15 -0.22 0.98 0.00 0.00 173.24 173.34 1mhs s LEU 513 N -1.79 1.92 -0.22 2.42 1.98 -1.26 -4.68 118.68 117.05 1mhs s LEU 513 Ca 0.49 -0.30 -0.06 0.00 -2.89 0.00 0.00 54.13 51.37 1mhs s LEU 513 Cb -0.37 -0.83 -0.03 0.00 0.66 0.00 0.00 46.19 45.62 1mhs s LEU 513 CO 0.49 0.15 0.04 -0.83 -1.89 0.00 0.00 176.35 174.30 1mhs s GLY 514 N -0.05 1.76 -0.05 7.98 0.00 0.86 -3.82 107.32 114.00 1mhs s GLY 514 Ca -0.01 -1.00 0.03 0.00 0.00 0.00 0.00 44.72 43.74 1mhs s GLY 514 CO 0.01 0.32 -0.13 -1.34 0.00 0.00 0.00 173.10 171.96 1mhs s VAL 515 N 1.13 1.17 0.00 1.40 -7.23 -1.02 -2.21 120.40 113.63 1mhs s VAL 515 Ca 0.03 -0.53 0.00 0.00 -1.81 0.00 0.00 61.98 59.68 1mhs s VAL 515 Cb -0.14 -1.04 0.00 0.00 0.56 0.00 0.00 36.38 35.75 1mhs s VAL 515 CO 0.02 0.35 0.00 0.00 -0.31 0.00 0.00 175.10 175.17 1mhs n ALA 516 N 3.56 0.00 0.00 1.32 0.00 -1.17 0.05 120.51 124.27 1mhs n ALA 516 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1mhs n ALA 516 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1mhs n ALA 516 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1mhs n ARG 517 N 0.00 0.00 0.07 0.00 3.00 -1.03 -4.46 116.66 114.25 1mhs n ARG 517 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1mhs n ARG 517 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1mhs n ARG 517 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 1mhs n LYS 518 N 0.00 0.00 0.00 -0.14 3.00 0.19 -3.91 118.16 117.30 1mhs n LYS 518 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1mhs n LYS 518 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 1mhs n LYS 518 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1mhs n ARG 519 N -2.88 0.00 -0.00 1.64 1.74 -1.25 -4.40 116.66 111.50 1mhs n ARG 519 Ca 0.00 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1mhs n ARG 519 Cb 0.00 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.43 1mhs n ARG 519 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1mhs n GLY 520 N 0.00 -0.03 0.00 -0.13 0.00 -1.26 -4.69 105.19 99.08 1mhs n GLY 520 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1mhs n GLY 520 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1mhs n GLU 521 N -2.07 0.00 0.36 1.61 1.02 -1.26 -4.99 120.64 115.31 1mhs n GLU 521 Ca -0.01 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 56.95 1mhs n GLU 521 Cb 0.52 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 31.85 1mhs n GLU 521 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1mhs h GLY 522 N 0.00 -1.06 -2.88 0.62 0.00 -1.96 -3.44 103.07 94.35 1mhs h GLY 522 Ca 0.00 0.43 -0.55 0.00 0.00 0.00 0.00 47.33 47.21 1mhs h GLY 522 CO 0.00 -0.37 -1.41 -1.26 0.00 0.00 0.00 176.54 173.50 1mhs n SER 523 N -5.53 -4.58 -4.00 0.19 2.88 -1.26 -4.87 113.62 96.45 1mhs n SER 523 Ca -0.13 0.30 -0.24 0.00 -1.33 0.00 0.00 58.87 57.48 1mhs n SER 523 Cb 0.42 -0.90 -0.16 0.00 -0.75 0.00 0.00 64.21 62.82 1mhs n SER 523 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1mhs s TRP 524 N -2.07 1.31 -0.39 0.66 -0.00 -1.26 -4.64 118.94 112.54 1mhs s TRP 524 Ca 0.47 -0.46 0.01 0.00 -0.00 0.00 0.00 56.10 56.13 1mhs s TRP 524 Cb -0.24 -0.98 0.19 0.00 -0.00 0.00 0.00 33.47 32.44 1mhs s TRP 524 CO 0.76 -0.25 0.81 -1.21 -0.00 0.00 0.00 176.95 177.06 1mhs s GLU 525 N 0.69 0.61 0.05 3.25 2.02 -1.25 0.46 118.70 124.52 1mhs s GLU 525 Ca -0.14 -0.31 -0.31 0.00 0.02 0.00 0.00 54.97 54.24 1mhs s GLU 525 Cb -0.15 0.04 -0.06 0.00 0.10 0.00 0.00 34.13 34.07 1mhs s GLU 525 CO 0.03 -0.84 1.24 0.96 0.02 0.00 0.00 175.26 176.67 1mhs s ILE 526 N 1.67 3.95 -0.25 -1.63 -4.36 -1.26 -2.46 121.20 116.86 1mhs s ILE 526 Ca 0.18 1.38 -0.15 0.00 -0.26 0.00 0.00 60.65 61.80 1mhs s ILE 526 Cb 0.00 -3.89 -0.11 0.00 1.25 0.00 0.00 42.46 39.72 1mhs s ILE 526 CO -0.09 0.08 -0.33 0.18 0.24 0.00 0.00 174.94 175.02 1mhs n LEU 527 N 4.21 1.95 0.00 0.37 4.77 0.11 -4.86 117.00 123.55 1mhs n LEU 527 Ca 0.10 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 1mhs n LEU 527 Cb 0.46 -0.81 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 1mhs n LEU 527 CO 0.56 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.60 1mhs n GLY 528 N 1.31 -1.40 3.08 -0.72 0.00 -1.22 -4.41 105.19 101.83 1mhs n GLY 528 Ca -0.45 -0.98 -0.11 0.00 0.00 0.00 0.00 46.02 44.48 1mhs n GLY 528 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1mhs s ILE 529 N -2.72 0.47 -0.51 -0.61 -4.36 -0.95 -2.44 121.20 110.08 1mhs s ILE 529 Ca 0.00 -1.41 0.05 0.00 -0.26 0.00 0.00 60.65 59.03 1mhs s ILE 529 Cb 0.00 -0.99 0.18 0.00 1.25 0.00 0.00 42.46 42.90 1mhs s ILE 529 CO 0.00 -0.63 0.43 1.15 0.24 0.00 0.00 174.94 176.12 1mhs n MET 530 N 0.85 0.86 0.00 0.37 0.00 -1.25 -0.61 117.12 117.35 1mhs n MET 530 Ca -0.19 -3.65 0.00 0.00 0.00 0.00 0.00 57.70 53.86 1mhs n MET 530 Cb 0.57 -1.84 0.00 0.00 0.00 0.00 0.00 33.22 31.96 1mhs n MET 530 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1mhs n PRO 531 N 2.31 -0.38 -3.61 3.17 -0.05 -1.22 -4.43 135.00 130.78 1mhs n PRO 531 Ca 0.26 0.00 -0.00 0.00 -0.05 0.00 0.00 63.50 63.71 1mhs n PRO 531 Cb 0.44 0.00 -0.01 0.00 -0.05 0.00 0.00 33.50 33.88 1mhs n PRO 531 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1mhs n MET 533 N -0.34 0.00 0.00 0.00 0.00 -1.26 0.27 117.12 115.80 1mhs n MET 533 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.65 1mhs n MET 533 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.83 1mhs n MET 533 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 175.97 175.57 1mhs n ASP 534 N 0.00 0.00 -4.65 3.17 5.68 -1.26 -4.77 116.55 114.71 1mhs n ASP 534 Ca 0.00 0.00 -0.42 0.00 -0.50 0.00 0.00 54.79 53.87 1mhs n ASP 534 Cb 0.00 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 39.95 1mhs n ASP 534 CO 0.00 0.00 0.00 -2.16 -1.33 0.00 0.00 177.20 173.71 1mhs s PRO 535 N 0.00 3.99 0.00 0.11 0.05 -1.26 -4.79 135.00 133.10 1mhs s PRO 535 Ca 0.00 2.38 0.00 0.00 0.05 0.00 0.00 61.00 63.43 1mhs s PRO 535 Cb 0.00 -4.14 0.00 0.00 0.05 0.00 0.00 34.50 30.41 1mhs s PRO 535 CO 0.00 -1.11 0.00 -2.30 0.05 0.00 0.00 177.00 173.64 1mhs n PRO 536 N 7.62 0.00 -3.61 0.56 -0.02 -1.26 -2.86 135.00 135.44 1mhs n PRO 536 Ca 0.21 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1mhs n PRO 536 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.90 1mhs n PRO 536 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1mhs n ARG 537 N 0.00 -2.28 0.00 -0.52 0.63 -1.26 -4.02 116.66 109.20 1mhs n ARG 537 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1mhs n ARG 537 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 1mhs n ARG 537 CO 0.00 0.00 0.00 1.58 -2.51 0.00 0.00 177.63 176.70 1mhs n HIS 538 N 6.30 0.00 0.31 -0.14 -0.00 -1.26 -3.11 115.22 117.31 1mhs n HIS 538 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 57.72 57.84 1mhs n HIS 538 Cb 0.00 -0.06 0.03 0.00 -0.00 0.00 0.00 29.99 29.96 1mhs n HIS 538 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 1mhs n ASP 539 N -1.05 0.70 -0.06 0.26 8.00 -1.26 -3.91 116.55 119.24 1mhs n ASP 539 Ca 0.00 0.14 -0.13 0.00 0.71 0.00 0.00 54.79 55.51 1mhs n ASP 539 Cb 0.00 0.57 -0.07 0.00 -0.02 0.00 0.00 41.12 41.60 1mhs n ASP 539 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1mhs h THR 540 N 0.00 1.32 -0.74 -3.53 1.03 -1.88 1.46 112.91 110.57 1mhs h THR 540 Ca 0.00 -1.16 -0.05 0.00 -0.01 0.00 0.00 66.41 65.19 1mhs h THR 540 Cb 0.88 1.76 -0.03 0.00 -1.07 0.00 0.00 68.15 69.69 1mhs h THR 540 CO 0.00 0.34 0.25 0.22 -0.01 0.00 0.00 175.52 176.33 1mhs h TYR 541 N -0.01 1.15 0.19 0.00 3.20 -1.70 -0.10 116.97 119.71 1mhs h TYR 541 Ca 0.03 -0.10 -0.33 0.00 3.14 0.00 0.00 58.73 61.47 1mhs h TYR 541 Cb 0.58 -0.34 0.01 0.00 1.54 0.00 0.00 36.73 38.52 1mhs h TYR 541 CO 0.07 0.90 -1.55 -0.22 -1.64 0.00 0.00 178.16 175.71 1mhs h LYS 542 N 1.08 0.40 -0.63 1.82 3.64 -1.67 -3.21 116.57 118.01 1mhs h LYS 542 Ca 0.24 -0.68 0.02 0.00 -1.27 0.00 0.00 60.65 58.97 1mhs h LYS 542 Cb 0.27 0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 1mhs h LYS 542 CO -0.01 1.30 0.42 0.00 -2.27 0.00 0.00 179.45 178.89 1mhs h THR 543 N 0.11 1.11 -0.46 1.00 1.03 0.22 0.05 112.91 115.97 1mhs h THR 543 Ca -0.27 -0.27 -0.07 0.00 -0.01 0.00 0.00 66.41 65.79 1mhs h THR 543 Cb 2.09 0.26 -0.02 0.00 -1.07 0.00 0.00 68.15 69.41 1mhs h THR 543 CO 0.21 0.14 0.01 -0.37 -0.01 0.00 0.00 175.52 175.50 1mhs h VAL 544 N 0.79 1.26 -0.81 0.00 -1.51 -1.10 -0.72 116.25 114.16 1mhs h VAL 544 Ca 0.24 -1.04 -0.02 0.00 -1.23 0.00 0.00 66.70 64.66 1mhs h VAL 544 Cb 0.01 1.02 -0.04 0.00 -2.13 0.00 0.00 31.29 30.15 1mhs h VAL 544 CO -0.06 0.36 0.43 0.00 -1.23 0.00 0.00 177.57 177.07 1mhs h GLU 546 N 1.12 1.18 -0.26 0.00 5.08 -0.76 -2.42 114.58 118.52 1mhs h GLU 546 Ca 0.28 -0.20 0.05 0.00 -1.00 0.00 0.00 59.36 58.50 1mhs h GLU 546 Cb 0.05 -0.20 -0.05 0.00 0.50 0.00 0.00 28.75 29.05 1mhs h GLU 546 CO -0.04 0.94 -0.06 0.00 -1.00 0.00 0.00 179.01 178.85 1mhs h ALA 547 N 1.18 0.18 -0.59 3.43 0.00 -0.47 0.96 119.26 123.96 1mhs h ALA 547 Ca 0.27 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 1mhs h ALA 547 Cb 0.18 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1mhs h ALA 547 CO -0.03 -0.46 0.28 0.87 0.00 0.00 0.00 179.25 179.91 1mhs h LYS 548 N 0.01 0.86 0.00 0.00 1.79 -1.27 0.28 116.57 118.24 1mhs h LYS 548 Ca 0.13 -0.13 -0.01 0.00 -2.18 0.00 0.00 60.65 58.45 1mhs h LYS 548 Cb 0.19 -0.15 -0.00 0.00 -1.58 0.00 0.00 32.23 30.69 1mhs h LYS 548 CO -0.26 0.70 -0.05 1.79 -1.08 0.00 0.00 179.45 180.55 1mhs h THR 549 N 0.81 0.17 0.00 -0.16 1.35 -0.92 -1.96 112.91 112.21 1mhs h THR 549 Ca 0.20 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 1mhs h THR 549 Cb 0.13 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 67.99 1mhs h THR 549 CO -0.02 0.05 -1.23 -0.11 -0.25 0.00 0.00 175.52 173.96 1mhs n LEU 550 N -3.22 0.62 0.00 3.87 7.94 0.28 -3.72 117.00 122.77 1mhs n LEU 550 Ca -0.00 -0.22 0.00 0.00 -1.11 0.00 0.00 56.01 54.68 1mhs n LEU 550 Cb 0.27 -0.04 0.00 0.00 0.53 0.00 0.00 43.42 44.19 1mhs n LEU 550 CO 0.27 0.12 0.00 0.61 -1.11 0.00 0.00 177.39 177.29 1mhs n GLY 551 N 1.40 3.14 3.61 -3.96 0.00 0.79 -2.98 105.19 107.19 1mhs n GLY 551 Ca 0.01 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.53 1mhs n GLY 551 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1mhs n LEU 552 N 0.00 1.99 -4.68 0.99 7.94 -0.08 -4.85 117.00 118.32 1mhs n LEU 552 Ca 0.00 1.11 -0.36 0.00 -1.11 0.00 0.00 56.01 55.64 1mhs n LEU 552 Cb 0.00 -1.24 -0.09 0.00 0.53 0.00 0.00 43.42 42.62 1mhs n LEU 552 CO 0.00 -0.86 -0.13 -0.55 -1.11 0.00 0.00 177.39 174.74 1mhs s SER 553 N 0.65 6.18 -0.18 1.96 0.15 0.92 -3.94 113.70 119.45 1mhs s SER 553 Ca 0.83 0.20 -0.03 0.00 0.70 0.00 0.00 55.95 57.65 1mhs s SER 553 Cb -0.89 -2.12 -0.02 0.00 -1.71 0.00 0.00 66.02 61.28 1mhs s SER 553 CO 0.45 0.07 -0.05 -0.51 1.20 0.00 0.00 173.24 174.40 1mhs s ILE 554 N 0.95 3.57 -0.10 6.45 1.10 -1.26 0.33 121.20 132.25 1mhs s ILE 554 Ca 0.09 -0.45 0.02 0.00 -0.51 0.00 0.00 60.65 59.80 1mhs s ILE 554 Cb -0.13 -2.59 -0.02 0.00 0.15 0.00 0.00 42.46 39.88 1mhs s ILE 554 CO 0.04 0.46 -0.16 -0.54 -2.11 0.00 0.00 174.94 172.63 1mhs s LYS 555 N 0.87 3.04 -0.15 3.50 3.01 0.36 -4.67 119.74 125.70 1mhs s LYS 555 Ca -0.01 -0.73 -0.05 0.00 -1.01 0.00 0.00 55.97 54.17 1mhs s LYS 555 Cb -0.15 -2.49 -0.03 0.00 -1.01 0.00 0.00 37.83 34.15 1mhs s LYS 555 CO 0.01 0.34 0.02 1.41 0.51 0.00 0.00 175.35 177.64 1mhs s MET 556 N 0.01 3.67 -0.27 1.68 -2.45 -1.25 0.27 119.30 120.96 1mhs s MET 556 Ca -0.05 -0.41 -0.01 0.00 -1.25 0.00 0.00 55.69 53.97 1mhs s MET 556 Cb -0.14 -3.02 0.04 0.00 1.25 0.00 0.00 34.83 32.95 1mhs s MET 556 CO 0.04 0.36 -0.05 -0.51 1.05 0.00 0.00 175.02 175.92 1mhs s LEU 557 N 0.09 3.56 0.26 4.11 1.02 -0.26 -1.97 118.68 125.50 1mhs s LEU 557 Ca 0.03 -1.17 0.03 0.00 0.02 0.00 0.00 54.13 53.03 1mhs s LEU 557 Cb -0.13 -1.66 -0.05 0.00 0.02 0.00 0.00 46.19 44.37 1mhs s LEU 557 CO 0.02 -0.20 0.06 0.28 0.02 0.00 0.00 176.35 176.52 1mhs s THR 558 N 1.24 0.85 -0.26 5.49 -1.32 -1.08 -2.50 115.64 118.07 1mhs s THR 558 Ca -0.04 -2.01 0.13 0.00 -1.21 0.00 0.00 61.69 58.56 1mhs s THR 558 Cb -0.19 -2.58 0.66 0.00 -1.51 0.00 0.00 72.50 68.89 1mhs s THR 558 CO -0.03 -0.11 1.63 0.61 -2.21 0.00 0.00 174.62 174.52 1mhs n GLY 559 N -0.50 3.81 3.90 6.08 0.00 -1.26 -3.13 105.19 114.09 1mhs n GLY 559 Ca -0.02 -1.03 -0.22 0.00 0.00 0.00 0.00 46.02 44.75 1mhs n GLY 559 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1mhs s ASP 560 N -1.47 5.96 0.67 1.61 1.11 -1.26 -4.67 116.67 118.62 1mhs s ASP 560 Ca 0.50 -0.06 -0.15 0.00 0.18 0.00 0.00 52.55 53.02 1mhs s ASP 560 Cb 0.40 -1.66 0.01 0.00 1.07 0.00 0.00 42.92 42.74 1mhs s ASP 560 CO 0.11 -0.04 1.13 0.00 1.18 0.00 0.00 175.17 177.55 1mhs s ALA 561 N -2.00 2.40 0.22 5.23 0.00 -1.26 -4.22 121.76 122.13 1mhs s ALA 561 Ca 0.33 0.60 -0.07 0.00 0.00 0.00 0.00 51.96 52.82 1mhs s ALA 561 Cb -0.09 -3.34 0.36 0.00 0.00 0.00 0.00 23.12 20.05 1mhs s ALA 561 CO 0.27 -1.39 1.72 -0.39 0.00 0.00 0.00 175.76 175.97 1mhs h VAL 562 N -0.06 0.67 -0.15 0.00 -1.51 -1.86 0.80 116.25 114.14 1mhs h VAL 562 Ca -0.47 -0.12 0.05 0.00 -1.23 0.00 0.00 66.70 64.92 1mhs h VAL 562 Cb 1.25 0.28 -0.07 0.00 -2.13 0.00 0.00 31.29 30.62 1mhs h VAL 562 CO 0.53 0.07 -0.40 1.23 -1.23 0.00 0.00 177.57 177.77 1mhs h GLY 563 N 0.36 -0.64 0.71 5.19 0.00 -1.91 0.67 103.07 107.45 1mhs h GLY 563 Ca 0.35 0.50 -0.04 0.00 0.00 0.00 0.00 47.33 48.14 1mhs h GLY 563 CO -0.39 -0.22 -0.07 1.19 0.00 0.00 0.00 176.54 177.05 1mhs h ILE 564 N -0.46 1.33 -0.67 2.60 2.10 -1.52 -3.03 117.51 117.86 1mhs h ILE 564 Ca 0.08 -1.13 0.11 0.00 1.08 0.00 0.00 64.86 65.01 1mhs h ILE 564 Cb 0.61 1.82 -0.12 0.00 -1.09 0.00 0.00 36.82 38.04 1mhs h ILE 564 CO -0.40 0.32 -0.37 0.00 -1.08 0.00 0.00 178.15 176.62 1mhs h ALA 565 N 0.64 -0.07 -0.45 0.18 0.00 0.98 0.70 119.26 121.24 1mhs h ALA 565 Ca 0.03 0.17 0.05 0.00 0.00 0.00 0.00 54.91 55.16 1mhs h ALA 565 Cb 0.54 0.87 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 1mhs h ALA 565 CO 0.02 -0.70 0.30 -0.09 0.00 0.00 0.00 179.25 178.78 1mhs h ARG 566 N -0.14 0.37 -0.21 0.00 1.12 -0.10 0.16 114.38 115.57 1mhs h ARG 566 Ca 0.24 -0.02 -0.04 0.00 -1.11 0.00 0.00 59.98 59.05 1mhs h ARG 566 Cb 0.56 -0.08 -0.01 0.00 -0.01 0.00 0.00 29.97 30.43 1mhs h ARG 566 CO -0.74 0.25 -0.03 0.93 -3.11 0.00 0.00 179.97 177.26 1mhs h GLU 567 N 0.38 0.39 -0.37 0.20 4.39 0.38 -0.13 114.58 119.83 1mhs h GLU 567 Ca 0.19 -0.14 -0.04 0.00 0.34 0.00 0.00 59.36 59.71 1mhs h GLU 567 Cb 0.28 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 1mhs h GLU 567 CO -0.05 0.62 0.07 1.15 -1.16 0.00 0.00 179.01 179.65 1mhs h THR 568 N 0.13 1.23 -0.71 1.13 2.02 0.25 0.16 112.91 117.12 1mhs h THR 568 Ca 0.06 -0.82 0.06 0.00 0.77 0.00 0.00 66.41 66.48 1mhs h THR 568 Cb 0.46 1.05 -0.06 0.00 -1.74 0.00 0.00 68.15 67.87 1mhs h THR 568 CO 0.02 0.28 0.40 0.28 0.37 0.00 0.00 175.52 176.86 1mhs h SER 569 N 0.45 0.59 -0.21 4.18 0.02 -0.65 0.16 113.55 118.10 1mhs h SER 569 Ca 0.11 0.03 -0.15 0.00 -0.84 0.00 0.00 61.79 60.95 1mhs h SER 569 Cb 0.34 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 1mhs h SER 569 CO 0.00 0.37 -0.41 0.08 -1.14 0.00 0.00 176.83 175.74 1mhs h ARG 570 N 0.72 0.76 0.09 3.45 0.11 0.03 -0.97 114.38 118.58 1mhs h ARG 570 Ca 0.32 -0.40 -0.00 0.00 0.10 0.00 0.00 59.98 59.99 1mhs h ARG 570 Cb 0.21 0.02 0.00 0.00 1.11 0.00 0.00 29.97 31.31 1mhs h ARG 570 CO -0.19 1.03 -0.05 0.37 0.10 0.00 0.00 179.97 181.23 1mhs h GLN 571 N 0.62 -0.12 0.28 0.08 4.15 0.31 -3.27 115.11 117.15 1mhs h GLN 571 Ca 0.05 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.46 1mhs h GLN 571 Cb 0.97 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.69 1mhs h GLN 571 CO 0.09 0.08 -0.14 -0.07 -1.93 0.00 0.00 178.83 176.86 1mhs h LEU 572 N -0.30 -0.32 0.00 -2.39 -0.00 -0.76 -3.48 115.31 108.06 1mhs h LEU 572 Ca -0.01 -0.10 0.00 0.00 -0.00 0.00 0.00 57.88 57.77 1mhs h LEU 572 Cb 0.25 0.08 0.00 0.00 -0.00 0.00 0.00 40.66 41.00 1mhs h LEU 572 CO 0.02 -0.09 0.00 0.61 -0.00 0.00 0.00 178.44 178.98 1mhs n GLY 573 N -0.80 0.76 0.00 0.83 0.00 -0.81 -4.70 105.19 100.47 1mhs n GLY 573 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1mhs n GLY 573 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1mhs n LEU 574 N 0.00 0.00 -4.64 0.99 4.77 -0.49 -3.82 117.00 113.80 1mhs n LEU 574 Ca 0.00 0.84 -0.38 0.00 -0.03 0.00 0.00 56.01 56.44 1mhs n LEU 574 Cb 0.00 -0.34 -0.09 0.00 -2.33 0.00 0.00 43.42 40.66 1mhs n LEU 574 CO 0.00 -0.34 -0.02 -0.83 -1.33 0.00 0.00 177.39 174.87 1mhs s GLY 575 N -0.68 1.99 0.00 -0.72 0.00 -0.49 -4.90 107.32 102.52 1mhs s GLY 575 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 44.72 43.96 1mhs s GLY 575 CO 0.00 0.70 0.00 -1.30 0.00 0.00 0.00 173.10 172.50 1mhs n THR 576 N 4.57 0.00 0.35 0.90 -2.24 -1.25 -1.56 114.28 115.05 1mhs n THR 576 Ca -0.11 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.72 1mhs n THR 576 Cb 0.51 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.68 1mhs n THR 576 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1mhs n ASN 577 N 0.00 1.09 -4.59 3.42 5.03 -1.26 -3.79 115.26 115.16 1mhs n ASN 577 Ca 0.00 -0.53 -0.43 0.00 0.87 0.00 0.00 54.58 54.50 1mhs n ASN 577 Cb 0.00 1.15 -0.03 0.00 -1.02 0.00 0.00 39.78 39.88 1mhs n ASN 577 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.26 175.70 1mhs s ILE 578 N -2.23 3.61 0.09 2.41 -4.36 -1.26 -4.95 121.20 114.51 1mhs s ILE 578 Ca 0.02 0.60 -0.31 0.00 -0.26 0.00 0.00 60.65 60.70 1mhs s ILE 578 Cb 0.08 -3.87 -0.09 0.00 1.25 0.00 0.00 42.46 39.82 1mhs s ILE 578 CO 0.44 -0.59 1.69 -0.47 0.24 0.00 0.00 174.94 176.26 1mhs s TYR 579 N 6.57 2.38 0.00 1.37 5.04 -1.26 -4.92 117.35 126.52 1mhs s TYR 579 Ca 0.72 0.25 0.00 0.00 -2.44 0.00 0.00 57.07 55.59 1mhs s TYR 579 Cb -0.18 -4.02 0.00 0.00 0.35 0.00 0.00 41.96 38.11 1mhs s TYR 579 CO 0.32 -4.10 0.00 0.09 -1.34 0.00 0.00 175.55 170.52 1mhs n ASN 580 N 5.55 0.00 0.00 4.32 3.02 -1.26 -4.99 115.26 121.90 1mhs n ASN 580 Ca 0.16 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.71 1mhs n ASN 580 Cb 0.40 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.57 1mhs n ASN 580 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mhs n ALA 581 N -3.00 0.00 -0.06 5.41 0.00 -1.26 -4.97 120.51 116.62 1mhs n ALA 581 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 1mhs n ALA 581 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.33 1mhs n ALA 581 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1mhs n GLU 582 N 0.00 0.67 0.00 0.00 1.02 -1.26 -4.80 120.64 116.27 1mhs n GLU 582 Ca 0.00 0.34 0.00 0.00 -0.02 0.00 0.00 57.16 57.48 1mhs n GLU 582 Cb 0.00 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 29.75 1mhs n GLU 582 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1mhs n ARG 583 N -3.82 0.00 -2.07 3.49 0.00 -1.26 -4.78 116.66 108.22 1mhs n ARG 583 Ca -0.37 0.00 -0.43 0.00 -0.00 0.00 0.00 57.85 57.05 1mhs n ARG 583 Cb 0.91 0.00 -0.03 0.00 -0.00 0.00 0.00 32.46 33.35 1mhs n ARG 583 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 1mhs s LEU 584 N 0.00 3.63 0.00 2.89 2.96 -1.23 -1.11 118.68 125.81 1mhs s LEU 584 Ca 0.00 1.34 0.00 0.00 -0.22 0.00 0.00 54.13 55.25 1mhs s LEU 584 Cb 0.00 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.16 1mhs s LEU 584 CO 0.00 -1.54 0.00 0.61 -1.32 0.00 0.00 176.35 174.10 1mhs n GLY 585 N 5.17 2.18 0.00 7.98 0.00 -1.26 -4.35 105.19 114.91 1mhs n GLY 585 Ca 0.21 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1mhs n GLY 585 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1mhs n LEU 586 N 0.00 0.19 0.00 0.99 7.94 -1.24 -1.84 117.00 123.03 1mhs n LEU 586 Ca 0.00 0.74 0.00 0.00 -1.11 0.00 0.00 56.01 55.64 1mhs n LEU 586 Cb 0.00 -0.41 0.00 0.00 0.53 0.00 0.00 43.42 43.54 1mhs n LEU 586 CO 0.00 -0.41 0.00 0.61 -1.11 0.00 0.00 177.39 176.48 1mhs n GLY 587 N 0.10 1.75 3.52 -3.96 0.00 -0.27 -4.40 105.19 101.94 1mhs n GLY 587 Ca 0.00 -0.69 -0.14 0.00 0.00 0.00 0.00 46.02 45.19 1mhs n GLY 587 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mhs s GLY 588 N 0.00 1.42 -0.22 -0.02 0.00 -1.21 -4.32 107.32 102.97 1mhs s GLY 588 Ca 0.00 -1.47 -0.04 0.00 0.00 0.00 0.00 44.72 43.22 1mhs s GLY 588 CO 0.00 -0.94 0.09 -0.32 0.00 0.00 0.00 173.10 171.93 1mhs s GLY 589 N -3.23 0.52 0.00 0.20 0.00 -1.26 -2.92 107.32 100.64 1mhs s GLY 589 Ca 0.29 -0.69 0.00 0.00 0.00 0.00 0.00 44.72 44.32 1mhs s GLY 589 CO 0.20 1.73 0.40 0.61 0.00 0.00 0.00 173.10 176.04 1mhs n GLY 590 N 5.18 0.84 3.83 0.20 0.00 0.16 -4.57 105.19 110.85 1mhs n GLY 590 Ca -0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.70 1mhs n GLY 590 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1mhs s ASP 591 N 2.58 5.67 0.00 1.61 2.15 -1.20 -4.15 116.67 123.34 1mhs s ASP 591 Ca 0.00 -0.11 0.00 0.00 0.43 0.00 0.00 52.55 52.87 1mhs s ASP 591 Cb 0.00 -1.52 0.00 0.00 -0.30 0.00 0.00 42.92 41.10 1mhs s ASP 591 CO 0.00 0.03 0.05 0.23 -0.17 0.00 0.00 175.17 175.31 1mhs n MET 592 N -0.66 0.00 0.00 4.34 2.81 -1.26 0.15 117.12 122.50 1mhs n MET 592 Ca -0.08 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.81 1mhs n MET 592 Cb 0.56 -0.55 0.00 0.00 -0.71 0.00 0.00 33.22 32.51 1mhs n MET 592 CO 0.00 0.00 0.00 -2.30 1.51 0.00 0.00 175.97 175.18 1mhs n PRO 593 N -0.05 0.00 0.00 0.03 -0.02 -1.26 0.30 135.00 134.00 1mhs n PRO 593 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1mhs n PRO 593 Cb 0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 1mhs n PRO 593 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mhs n GLY 594 N 2.54 0.80 0.14 -1.23 0.00 -1.12 -4.62 105.19 101.71 1mhs n GLY 594 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1mhs n GLY 594 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1mhs n SER 595 N 0.00 -0.21 0.00 1.61 7.64 0.87 0.29 113.62 123.82 1mhs n SER 595 Ca 0.00 0.64 0.00 0.00 1.01 0.00 0.00 58.87 60.52 1mhs n SER 595 Cb 0.17 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 1mhs n SER 595 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1mhs n GLU 596 N -4.56 0.00 0.00 1.43 -0.58 -1.26 -1.68 120.64 113.99 1mhs n GLU 596 Ca 0.04 0.00 0.11 0.00 -0.42 0.00 0.00 57.16 56.89 1mhs n GLU 596 Cb 0.16 -1.17 0.48 0.00 -0.57 0.00 0.00 31.44 30.34 1mhs n GLU 596 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1mhs n VAL 597 N -0.51 0.48 0.62 2.62 0.24 0.83 -2.84 118.33 119.76 1mhs n VAL 597 Ca 0.00 0.12 0.07 0.00 -2.04 0.00 0.00 64.34 62.49 1mhs n VAL 597 Cb 0.00 -0.75 0.34 0.00 -1.47 0.00 0.00 33.84 31.96 1mhs n VAL 597 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1mhs n TYR 598 N -1.46 0.00 -0.05 6.34 0.18 -0.67 0.32 117.16 121.82 1mhs n TYR 598 Ca 0.06 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.84 1mhs n TYR 598 Cb 0.24 -0.34 -0.14 0.00 -0.38 0.00 0.00 39.34 38.73 1mhs n TYR 598 CO 0.00 0.00 0.00 -3.47 -2.08 0.00 0.00 176.86 171.31 1mhs n ASP 599 N -1.34 0.89 0.04 9.48 2.03 -1.13 -4.01 116.55 122.51 1mhs n ASP 599 Ca 0.06 0.00 -0.19 0.00 0.52 0.00 0.00 54.79 55.18 1mhs n ASP 599 Cb 0.12 1.36 -0.14 0.00 -0.72 0.00 0.00 41.12 41.74 1mhs n ASP 599 CO 0.00 0.00 0.00 -0.26 -1.92 0.00 0.00 177.20 175.02 1mhs h PHE 600 N 0.00 0.49 0.19 -0.67 0.04 -0.99 -3.36 116.94 112.64 1mhs h PHE 600 Ca -0.23 -0.35 0.01 0.00 2.80 0.00 0.00 57.97 60.19 1mhs h PHE 600 Cb 1.43 -0.02 -0.04 0.00 2.20 0.00 0.00 35.95 39.52 1mhs h PHE 600 CO 0.00 1.52 -0.52 -0.24 -0.60 0.00 0.00 178.31 178.47 1mhs h VAL 601 N 0.07 0.00 0.00 -0.55 3.04 0.50 0.47 116.25 119.79 1mhs h VAL 601 Ca -0.32 0.00 -0.27 0.00 -1.01 0.00 0.00 66.70 65.10 1mhs h VAL 601 Cb 2.04 0.00 -0.01 0.00 -2.01 0.00 0.00 31.29 31.31 1mhs h VAL 601 CO 0.14 0.00 1.37 1.21 -1.01 0.00 0.00 177.57 179.28 1mhs n GLU 602 N -5.42 1.80 -0.29 4.17 2.13 -1.26 -3.85 120.64 117.92 1mhs n GLU 602 Ca -0.09 -1.10 0.12 0.00 0.66 0.00 0.00 57.16 56.75 1mhs n GLU 602 Cb 0.41 -2.16 0.28 0.00 0.27 0.00 0.00 31.44 30.25 1mhs n GLU 602 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1mhs n ALA 603 N 3.39 2.40 -2.57 4.31 0.00 0.15 -4.90 120.51 123.29 1mhs n ALA 603 Ca 0.38 -1.15 -0.04 0.00 0.00 0.00 0.00 53.44 52.64 1mhs n ALA 603 Cb 0.36 -0.92 0.01 0.00 0.00 0.00 0.00 19.45 18.91 1mhs n ALA 603 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mhs n ALA 604 N 1.55 -0.26 0.00 0.00 0.00 -1.25 -3.58 120.51 116.98 1mhs n ALA 604 Ca 0.22 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1mhs n ALA 604 Cb 0.61 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.83 1mhs n ALA 604 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1mhs n ASP 605 N 0.18 0.00 -4.67 0.00 9.92 -1.26 -4.87 116.55 115.85 1mhs n ASP 605 Ca -0.01 0.00 -0.64 0.00 -0.53 0.00 0.00 54.79 53.61 1mhs n ASP 605 Cb 0.52 0.00 -0.09 0.00 -0.64 0.00 0.00 41.12 40.91 1mhs n ASP 605 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1mhs n GLY 606 N 0.00 0.14 2.69 0.44 0.00 -1.26 -4.06 105.19 103.14 1mhs n GLY 606 Ca 0.00 0.92 -0.19 0.00 0.00 0.00 0.00 46.02 46.74 1mhs n GLY 606 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1mhs s PHE 607 N 2.08 0.03 -0.07 1.61 5.36 -0.83 -3.34 117.98 122.82 1mhs s PHE 607 Ca 0.99 0.28 -0.02 0.00 -0.96 0.00 0.00 56.93 57.23 1mhs s PHE 607 Cb -1.37 -0.44 0.03 0.00 -0.34 0.00 0.00 43.02 40.90 1mhs s PHE 607 CO 0.72 -0.19 0.02 0.00 -1.46 0.00 0.00 175.22 174.31 1mhs s ALA 608 N 2.10 0.59 -0.05 11.12 0.00 -1.15 -2.62 121.76 131.75 1mhs s ALA 608 Ca 0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 51.96 51.91 1mhs s ALA 608 Cb -0.12 -0.74 0.00 0.00 0.00 0.00 0.00 23.12 22.26 1mhs s ALA 608 CO -0.03 -0.52 0.06 -1.91 0.00 0.00 0.00 175.76 173.36 1mhs n GLU 609 N 5.18 -0.20 -4.50 0.00 2.13 -1.18 -2.94 120.64 119.13 1mhs n GLU 609 Ca -0.06 0.64 -0.23 0.00 0.66 0.00 0.00 57.16 58.16 1mhs n GLU 609 Cb 0.50 -1.89 -0.11 0.00 0.27 0.00 0.00 31.44 30.21 1mhs n GLU 609 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1mhs s VAL 610 N -1.63 1.43 0.12 6.31 1.01 -1.26 0.40 120.40 126.78 1mhs s VAL 610 Ca 0.02 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 60.00 1mhs s VAL 610 Cb -0.00 -2.85 0.00 0.00 0.00 0.00 0.00 36.38 33.52 1mhs s VAL 610 CO 0.07 -0.00 0.01 0.49 0.00 0.00 0.00 175.10 175.67 1mhs n PHE 611 N -0.77 0.04 0.00 5.22 3.01 -1.26 -5.01 117.46 118.69 1mhs n PHE 611 Ca -0.03 -0.57 0.00 0.00 1.01 0.00 0.00 57.45 57.86 1mhs n PHE 611 Cb 0.67 -0.08 0.00 0.00 -0.01 0.00 0.00 39.48 40.06 1mhs n PHE 611 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1mhs n PRO 612 N -0.36 0.00 0.00 -1.08 -0.04 -1.26 -4.22 135.00 128.04 1mhs n PRO 612 Ca -0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 1mhs n PRO 612 Cb 0.15 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.61 1mhs n PRO 612 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1mhs n GLN 613 N 0.00 0.00 -0.01 0.54 6.02 -1.26 -1.25 117.38 121.43 1mhs n GLN 613 Ca 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 57.00 57.00 1mhs n GLN 613 Cb 0.00 0.00 -0.12 0.00 1.02 0.00 0.00 30.24 31.14 1mhs n GLN 613 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1mhs n HIS 614 N 0.00 0.42 -0.28 1.08 8.25 -1.26 -4.01 115.22 119.42 1mhs n HIS 614 Ca 0.00 0.14 0.08 0.00 -0.26 0.00 0.00 57.72 57.68 1mhs n HIS 614 Cb 0.00 -0.88 0.23 0.00 1.12 0.00 0.00 29.99 30.46 1mhs n HIS 614 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 1mhs h LYS 615 N 0.00 0.48 -0.09 -0.41 1.79 -1.37 0.19 116.57 117.16 1mhs h LYS 615 Ca -0.21 -0.03 0.02 0.00 -2.18 0.00 0.00 60.65 58.25 1mhs h LYS 615 Cb 1.55 -0.11 -0.04 0.00 -1.58 0.00 0.00 32.23 32.05 1mhs h LYS 615 CO 0.02 0.32 -0.31 -0.92 -1.08 0.00 0.00 179.45 177.48 1mhs h TYR 616 N 0.49 -0.93 -0.73 -1.35 3.20 -1.82 -1.31 116.97 114.52 1mhs h TYR 616 Ca 0.47 0.04 -0.05 0.00 3.14 0.00 0.00 58.73 62.32 1mhs h TYR 616 Cb 0.74 0.42 -0.03 0.00 1.54 0.00 0.00 36.73 39.40 1mhs h TYR 616 CO -0.14 -0.31 0.25 -0.91 -1.64 0.00 0.00 178.16 175.42 1mhs h ASN 617 N -0.32 1.05 -0.50 -2.11 2.35 -1.55 -2.42 115.58 112.08 1mhs h ASN 617 Ca 0.02 -0.20 0.06 0.00 -0.55 0.00 0.00 56.30 55.63 1mhs h ASN 617 Cb 0.38 -0.27 -0.05 0.00 0.05 0.00 0.00 38.32 38.43 1mhs h ASN 617 CO -0.26 0.97 0.22 -0.37 -1.65 0.00 0.00 177.43 176.34 1mhs h VAL 618 N 1.08 0.89 -0.34 2.81 -1.51 -0.35 0.56 116.25 119.38 1mhs h VAL 618 Ca 0.24 -0.15 -0.06 0.00 -1.23 0.00 0.00 66.70 65.51 1mhs h VAL 618 Cb 0.28 0.43 -0.01 0.00 -2.13 0.00 0.00 31.29 29.85 1mhs h VAL 618 CO -0.01 0.08 -0.01 -0.37 -1.23 0.00 0.00 177.57 176.03 1mhs h VAL 619 N 0.43 1.26 -0.16 7.19 -1.51 -1.12 0.13 116.25 122.47 1mhs h VAL 619 Ca 0.23 -0.99 0.03 0.00 -1.23 0.00 0.00 66.70 64.74 1mhs h VAL 619 Cb 0.20 1.23 -0.03 0.00 -2.13 0.00 0.00 31.29 30.56 1mhs h VAL 619 CO -0.20 0.33 -0.03 -0.08 -1.23 0.00 0.00 177.57 176.35 1mhs h GLU 620 N 0.42 0.01 -0.47 5.19 4.81 -0.88 0.15 114.58 123.81 1mhs h GLU 620 Ca 0.10 -0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.28 1mhs h GLU 620 Cb 0.47 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 1mhs h GLU 620 CO 0.02 0.01 0.10 -0.84 -0.73 0.00 0.00 179.01 177.56 1mhs h ILE 621 N 0.01 1.24 -0.51 2.32 3.07 0.20 -1.29 117.51 122.55 1mhs h ILE 621 Ca 0.08 -0.86 -0.12 0.00 1.55 0.00 0.00 64.86 65.51 1mhs h ILE 621 Cb 0.11 0.90 -0.02 0.00 -0.27 0.00 0.00 36.82 37.55 1mhs h ILE 621 CO -0.16 0.30 -0.13 0.25 -1.05 0.00 0.00 178.15 177.36 1mhs h LEU 622 N 0.63 0.99 -1.28 0.16 5.85 -0.49 -2.66 115.31 118.52 1mhs h LEU 622 Ca 0.14 -0.34 -0.07 0.00 0.84 0.00 0.00 57.88 58.46 1mhs h LEU 622 Cb 0.35 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1mhs h LEU 622 CO 0.00 1.12 -0.30 -0.61 -0.34 0.00 0.00 178.44 178.31 1mhs h GLN 623 N 0.87 0.10 0.00 1.25 4.15 -0.56 -2.32 115.11 118.60 1mhs h GLN 623 Ca 0.13 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.52 1mhs h GLN 623 Cb 0.69 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.38 1mhs h GLN 623 CO 0.05 0.39 0.00 0.94 -1.93 0.00 0.00 178.83 178.29 1mhs n GLN 624 N -4.15 0.04 -0.14 1.69 7.27 -0.50 -0.01 117.38 121.58 1mhs n GLN 624 Ca -0.02 0.50 0.05 0.00 0.07 0.00 0.00 57.00 57.60 1mhs n GLN 624 Cb 0.37 -1.63 0.11 0.00 2.41 0.00 0.00 30.24 31.50 1mhs n GLN 624 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 1mhs n ARG 625 N -1.72 2.74 -3.02 3.69 3.00 -0.89 -4.97 116.66 115.49 1mhs n ARG 625 Ca 0.00 -2.03 -0.14 0.00 -0.00 0.00 0.00 57.85 55.68 1mhs n ARG 625 Cb 0.04 -1.28 0.04 0.00 0.00 0.00 0.00 32.46 31.26 1mhs n ARG 625 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1mhs n GLY 626 N -0.21 0.02 3.54 5.14 0.00 0.98 -4.99 105.19 109.66 1mhs n GLY 626 Ca 0.09 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 1mhs n GLY 626 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mhs s TYR 627 N -3.11 3.20 1.12 1.61 2.02 -1.11 -5.03 117.35 116.06 1mhs s TYR 627 Ca 0.30 -0.07 -0.19 0.00 -0.37 0.00 0.00 57.07 56.74 1mhs s TYR 627 Cb -0.13 -2.70 0.26 0.00 -0.40 0.00 0.00 41.96 38.99 1mhs s TYR 627 CO 0.37 -0.47 1.22 -0.51 -1.57 0.00 0.00 175.55 174.60 1mhs s LEU 628 N 2.04 1.60 -0.26 -1.29 1.43 -1.26 -4.27 118.68 116.67 1mhs s LEU 628 Ca 0.12 0.37 -0.27 0.00 -1.03 0.00 0.00 54.13 53.32 1mhs s LEU 628 Cb -0.17 -2.17 0.15 0.00 0.03 0.00 0.00 46.19 44.03 1mhs s LEU 628 CO 0.12 -3.61 1.19 -0.69 0.23 0.00 0.00 176.35 173.58 1mhs s VAL 629 N -3.46 0.00 -0.28 -1.59 1.01 -1.26 -3.94 120.40 110.88 1mhs s VAL 629 Ca 0.74 0.00 -0.01 0.00 0.00 0.00 0.00 61.98 62.71 1mhs s VAL 629 Cb -0.05 -1.00 0.04 0.00 0.00 0.00 0.00 36.38 35.37 1mhs s VAL 629 CO 0.55 0.00 -0.03 0.00 0.00 0.00 0.00 175.10 175.62 1mhs s ALA 630 N -0.25 2.75 0.43 5.51 0.00 -0.63 -2.62 121.76 126.94 1mhs s ALA 630 Ca 0.04 -1.68 0.07 0.00 0.00 0.00 0.00 51.96 50.39 1mhs s ALA 630 Cb -0.04 -1.83 -0.04 0.00 0.00 0.00 0.00 23.12 21.21 1mhs s ALA 630 CO -0.08 -1.14 0.20 1.41 0.00 0.00 0.00 175.76 176.16 1mhs s MET 631 N 1.26 2.25 -0.14 0.00 1.75 -0.95 -1.30 119.30 122.16 1mhs s MET 631 Ca -0.04 -1.86 0.00 0.00 -1.25 0.00 0.00 55.69 52.54 1mhs s MET 631 Cb -0.19 -2.00 0.02 0.00 2.84 0.00 0.00 34.83 35.51 1mhs s MET 631 CO -0.02 -0.17 -0.13 0.99 -0.65 0.00 0.00 175.02 175.04 1mhs s THR 632 N -2.61 1.45 0.00 10.11 2.01 -1.25 0.15 115.64 125.50 1mhs s THR 632 Ca 0.40 -0.56 0.00 0.00 0.31 0.00 0.00 61.69 61.84 1mhs s THR 632 Cb 0.03 -1.38 0.00 0.00 0.01 0.00 0.00 72.50 71.16 1mhs s THR 632 CO 0.22 0.44 0.00 0.61 -0.69 0.00 0.00 174.62 175.20 1mhs n GLY 633 N 4.78 -1.27 0.00 4.40 0.00 -1.25 -4.99 105.19 106.87 1mhs n GLY 633 Ca -0.16 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1mhs n GLY 633 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1mhs n ASP 634 N 0.00 0.00 -4.64 1.61 4.64 -1.26 -5.09 116.55 111.81 1mhs n ASP 634 Ca 0.00 0.00 -0.29 0.00 -1.38 0.00 0.00 54.79 53.12 1mhs n ASP 634 Cb 0.00 0.00 -0.10 0.00 -1.04 0.00 0.00 41.12 39.98 1mhs n ASP 634 CO 0.00 0.00 0.00 -0.83 -0.82 0.00 0.00 177.20 175.55 1mhs s GLY 635 N 0.00 2.59 0.47 0.27 0.00 -1.26 -5.02 107.32 104.37 1mhs s GLY 635 Ca 0.00 -1.96 0.22 0.00 0.00 0.00 0.00 44.72 42.99 1mhs s GLY 635 CO 0.00 -2.11 1.91 -0.39 0.00 0.00 0.00 173.10 172.51 1mhs h VAL 636 N 1.70 0.68 0.00 1.40 -1.51 -2.01 0.21 116.25 116.72 1mhs h VAL 636 Ca -0.44 -0.08 -0.01 0.00 -1.23 0.00 0.00 66.70 64.94 1mhs h VAL 636 Cb 1.25 0.44 -0.00 0.00 -2.13 0.00 0.00 31.29 30.86 1mhs h VAL 636 CO 0.79 0.04 -0.06 -0.55 -1.23 0.00 0.00 177.57 176.56 1mhs h ASN 637 N 0.22 0.00 -0.01 4.19 -1.07 -1.96 -2.52 115.58 114.43 1mhs h ASN 637 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.76 1mhs h ASN 637 Cb 1.21 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.46 1mhs h ASN 637 CO -0.08 0.06 -0.67 0.47 0.07 0.00 0.00 177.43 177.27 1mhs n ASP 638 N -3.25 1.56 -0.09 6.14 9.92 0.05 -3.98 116.55 126.90 1mhs n ASP 638 Ca -0.01 -1.28 -0.06 0.00 -0.53 0.00 0.00 54.79 52.91 1mhs n ASP 638 Cb 0.27 0.70 0.00 0.00 -0.64 0.00 0.00 41.12 41.45 1mhs n ASP 638 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1mhs h ALA 639 N 3.39 0.07 -0.52 2.24 0.00 -1.34 -1.05 119.26 122.06 1mhs h ALA 639 Ca 0.00 0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1mhs h ALA 639 Cb 0.63 0.41 -0.04 0.00 0.00 0.00 0.00 17.79 18.79 1mhs h ALA 639 CO 0.00 -0.56 0.27 -1.35 0.00 0.00 0.00 179.25 177.61 1mhs h PRO 640 N -0.12 0.51 -0.31 0.00 0.11 -1.80 -1.20 132.00 129.20 1mhs h PRO 640 Ca 0.17 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.20 1mhs h PRO 640 Cb 0.38 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.36 1mhs h PRO 640 CO -0.41 0.34 -0.00 0.66 -0.21 0.00 0.00 178.00 178.38 1mhs h SER 641 N 0.53 0.43 -0.25 -2.05 4.64 -1.68 -1.03 113.55 114.14 1mhs h SER 641 Ca 0.23 -0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.44 1mhs h SER 641 Cb 0.12 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.09 1mhs h SER 641 CO -0.15 0.50 0.05 -0.07 -0.87 0.00 0.00 176.83 176.30 1mhs h LEU 642 N 0.45 0.38 -0.73 5.97 3.38 -0.11 -0.64 115.31 124.01 1mhs h LEU 642 Ca 0.10 -0.24 -0.11 0.00 0.09 0.00 0.00 57.88 57.71 1mhs h LEU 642 Cb 0.30 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1mhs h LEU 642 CO 0.01 0.53 -0.25 0.07 0.09 0.00 0.00 178.44 178.89 1mhs h LYS 643 N 0.22 0.70 0.05 1.13 2.10 -0.98 -3.10 116.57 116.69 1mhs h LYS 643 Ca 0.08 -0.29 -0.00 0.00 -2.00 0.00 0.00 60.65 58.44 1mhs h LYS 643 Cb 0.30 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.60 1mhs h LYS 643 CO 0.00 0.88 -0.02 -0.22 -2.00 0.00 0.00 179.45 178.09 1mhs h LYS 644 N 0.61 -0.07 0.00 0.07 1.63 -1.03 -3.43 116.57 114.35 1mhs h LYS 644 Ca 0.08 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.89 1mhs h LYS 644 Cb 0.74 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.39 1mhs h LYS 644 CO 0.06 0.08 0.00 0.00 -3.45 0.00 0.00 179.45 176.14 1mhs n ALA 645 N -2.19 0.00 0.00 5.00 0.00 -0.26 -5.02 120.51 118.04 1mhs n ALA 645 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1mhs n ALA 645 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.56 1mhs n ALA 645 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1mhs n ASP 646 N -0.46 1.57 -4.23 0.00 9.92 -1.26 -5.02 116.55 117.07 1mhs n ASP 646 Ca 0.00 0.00 -0.31 0.00 -0.53 0.00 0.00 54.79 53.95 1mhs n ASP 646 Cb 0.00 0.13 -0.17 0.00 -0.64 0.00 0.00 41.12 40.45 1mhs n ASP 646 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1mhs s THR 647 N -1.33 1.93 -0.17 -3.53 2.01 -1.08 -4.81 115.64 108.68 1mhs s THR 647 Ca 0.00 -0.98 0.01 0.00 0.31 0.00 0.00 61.69 61.03 1mhs s THR 647 Cb 0.00 -1.65 0.02 0.00 0.01 0.00 0.00 72.50 70.88 1mhs s THR 647 CO 0.00 0.54 -0.18 -0.83 -0.69 0.00 0.00 174.62 173.46 1mhs s GLY 648 N 0.02 1.28 -0.31 4.40 0.00 -1.26 -2.25 107.32 109.20 1mhs s GLY 648 Ca -0.08 -1.08 -0.03 0.00 0.00 0.00 0.00 44.72 43.53 1mhs s GLY 648 CO 0.05 0.37 0.03 -0.42 0.00 0.00 0.00 173.10 173.13 1mhs s ILE 649 N 1.35 3.20 -0.03 0.90 1.01 0.12 -1.09 121.20 126.67 1mhs s ILE 649 Ca 0.05 -1.34 -0.00 0.00 0.00 0.00 0.00 60.65 59.35 1mhs s ILE 649 Cb -0.13 -2.84 -0.04 0.00 0.01 0.00 0.00 42.46 39.46 1mhs s ILE 649 CO -0.12 -0.14 0.04 0.00 0.00 0.00 0.00 174.94 174.72 1mhs s ALA 650 N 1.29 3.43 0.31 9.38 0.00 -1.19 -3.85 121.76 131.13 1mhs s ALA 650 Ca -0.04 -0.87 -0.28 0.00 0.00 0.00 0.00 51.96 50.76 1mhs s ALA 650 Cb -0.20 -1.49 -0.09 0.00 0.00 0.00 0.00 23.12 21.34 1mhs s ALA 650 CO -0.00 0.65 1.13 0.08 0.00 0.00 0.00 175.76 177.62 1mhs s VAL 651 N -1.08 3.35 0.25 0.00 1.01 -1.26 0.44 120.40 123.12 1mhs s VAL 651 Ca 0.19 1.30 -0.05 0.00 0.00 0.00 0.00 61.98 63.42 1mhs s VAL 651 Cb -0.12 -3.80 0.26 0.00 0.00 0.00 0.00 36.38 32.72 1mhs s VAL 651 CO 0.10 0.26 1.92 -0.08 0.00 0.00 0.00 175.10 177.30 1mhs h GLU 652 N 3.47 1.30 -0.91 2.72 4.22 0.65 -0.45 114.58 125.58 1mhs h GLU 652 Ca -0.47 -0.08 -0.14 0.00 0.08 0.00 0.00 59.36 58.74 1mhs h GLU 652 Cb 1.22 -0.29 -0.09 0.00 0.50 0.00 0.00 28.75 30.09 1mhs h GLU 652 CO 0.66 0.86 0.18 0.41 -2.18 0.00 0.00 179.01 178.94 1mhs n GLY 653 N -1.38 2.80 0.00 1.92 0.00 -1.26 -4.85 105.19 102.43 1mhs n GLY 653 Ca 0.13 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1mhs n GLY 653 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1mhs n SER 654 N -0.04 0.33 -4.86 1.61 3.41 -0.18 -5.14 113.62 108.75 1mhs n SER 654 Ca 0.23 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.49 1mhs n SER 654 Cb 0.93 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.82 1mhs n SER 654 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1mhs s SER 655 N 0.38 6.72 0.09 4.04 0.01 -1.26 -4.99 113.70 118.68 1mhs s SER 655 Ca 0.00 0.92 -0.10 0.00 1.31 0.00 0.00 55.95 58.08 1mhs s SER 655 Cb 0.00 -2.23 -0.19 0.00 0.21 0.00 0.00 66.02 63.81 1mhs s SER 655 CO 0.00 0.13 1.22 -0.78 0.41 0.00 0.00 173.24 174.22 1mhs h ASP 656 N 3.57 0.75 -0.63 2.44 1.82 -1.96 -3.28 116.42 119.13 1mhs h ASP 656 Ca -0.49 -0.62 0.13 0.00 -0.39 0.00 0.00 57.03 55.66 1mhs h ASP 656 Cb 1.19 -0.23 -0.12 0.00 0.68 0.00 0.00 39.33 40.85 1mhs h ASP 656 CO 0.66 1.42 -0.18 0.00 -1.61 0.00 0.00 179.24 179.54 1mhs h ALA 657 N 0.52 0.38 -0.59 -0.78 0.00 -2.00 0.81 119.26 117.59 1mhs h ALA 657 Ca -0.12 0.24 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1mhs h ALA 657 Cb 1.69 0.51 -0.04 0.00 0.00 0.00 0.00 17.79 19.96 1mhs h ALA 657 CO 0.19 -0.45 0.37 0.00 0.00 0.00 0.00 179.25 179.37 1mhs h ALA 658 N 1.58 0.76 0.00 0.00 0.00 -1.98 -1.26 119.26 118.36 1mhs h ALA 658 Ca 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1mhs h ALA 658 Cb 0.48 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1mhs h ALA 658 CO -0.66 0.13 0.00 0.54 0.00 0.00 0.00 179.25 179.26 1mhs n ARG 659 N -4.72 0.15 -0.09 0.00 1.74 0.20 -2.24 116.66 111.70 1mhs n ARG 659 Ca 0.05 0.60 -0.18 0.00 -0.77 0.00 0.00 57.85 57.55 1mhs n ARG 659 Cb 0.06 -1.94 -0.11 0.00 -1.02 0.00 0.00 32.46 29.45 1mhs n ARG 659 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 1mhs h SER 660 N 0.00 0.00 0.00 0.55 0.02 -0.38 -3.35 113.55 110.39 1mhs h SER 660 Ca 0.00 -0.56 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 1mhs h SER 660 Cb 0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.61 1mhs h SER 660 CO 0.00 1.27 0.00 0.00 -1.14 0.00 0.00 176.83 176.96 1mhs n ALA 661 N -3.22 2.27 -3.00 3.77 0.00 -0.96 -4.72 120.51 114.66 1mhs n ALA 661 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1mhs n ALA 661 Cb 0.57 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.02 1mhs n ALA 661 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mhs n ALA 662 N -0.20 0.00 -1.50 0.00 0.00 -0.95 -4.28 120.51 113.58 1mhs n ALA 662 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1mhs n ALA 662 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.55 1mhs n ALA 662 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1mhs n ASP 663 N 0.00 0.00 -3.64 0.00 8.00 -0.25 -4.58 116.55 116.08 1mhs n ASP 663 Ca 0.00 -1.00 -0.00 0.00 0.71 0.00 0.00 54.79 54.50 1mhs n ASP 663 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1mhs n ASP 663 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1mhs s ILE 664 N 0.00 0.00 0.01 0.53 1.09 -1.11 -4.04 121.20 117.67 1mhs s ILE 664 Ca 0.00 -0.40 -0.02 0.00 -1.10 0.00 0.00 60.65 59.14 1mhs s ILE 664 Cb 0.00 -2.31 -0.01 0.00 -1.06 0.00 0.00 42.46 39.08 1mhs s ILE 664 CO 0.00 0.00 0.02 -0.69 -0.10 0.00 0.00 174.94 174.17 1mhs s VAL 665 N -2.54 0.08 -0.44 2.92 1.01 0.18 -3.14 120.40 118.47 1mhs s VAL 665 Ca 0.17 -0.65 -0.16 0.00 0.00 0.00 0.00 61.98 61.35 1mhs s VAL 665 Cb 0.01 -0.25 0.04 0.00 0.00 0.00 0.00 36.38 36.18 1mhs s VAL 665 CO -0.00 -0.36 0.39 -0.36 0.00 0.00 0.00 175.10 174.77 1mhs s PHE 666 N -1.09 3.21 -0.16 5.22 0.08 0.17 -1.86 117.98 123.55 1mhs s PHE 666 Ca -0.12 -0.64 -0.13 0.00 0.12 0.00 0.00 56.93 56.16 1mhs s PHE 666 Cb -0.07 -2.92 -0.07 0.00 -0.57 0.00 0.00 43.02 39.39 1mhs s PHE 666 CO -0.00 -0.72 -0.11 -0.11 -0.10 0.00 0.00 175.22 174.18 1mhs n LEU 667 N 5.36 1.83 -4.58 -0.37 7.94 0.37 0.37 117.00 127.93 1mhs n LEU 667 Ca -0.10 0.56 -0.23 0.00 -1.11 0.00 0.00 56.01 55.13 1mhs n LEU 667 Cb 0.46 -0.88 -0.08 0.00 0.53 0.00 0.00 43.42 43.45 1mhs n LEU 667 CO 0.45 -0.26 1.34 0.00 -1.11 0.00 0.00 177.39 177.80 1mhs s ALA 668 N -2.66 1.30 0.00 1.96 0.00 0.44 -4.64 121.76 118.16 1mhs s ALA 668 Ca -0.20 -1.76 0.00 0.00 0.00 0.00 0.00 51.96 50.01 1mhs s ALA 668 Cb 0.03 -4.66 0.00 0.00 0.00 0.00 0.00 23.12 18.49 1mhs s ALA 668 CO 0.32 -5.73 0.00 -2.30 0.00 0.00 0.00 175.76 168.05 1mhs n PRO 669 N 8.37 0.00 -4.11 0.00 -0.01 -1.26 -4.64 135.00 133.35 1mhs n PRO 669 Ca 0.43 0.00 -0.29 0.00 -0.01 0.00 0.00 63.50 63.63 1mhs n PRO 669 Cb 0.46 -1.40 -0.07 0.00 -0.01 0.00 0.00 33.50 32.48 1mhs n PRO 669 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 175.50 175.69 1mhs s GLY 670 N 1.75 1.88 0.04 -1.23 0.00 -1.26 -3.15 107.32 105.35 1mhs s GLY 670 Ca 0.00 -1.15 -0.14 0.00 0.00 0.00 0.00 44.72 43.44 1mhs s GLY 670 CO 0.00 -1.14 1.05 -2.00 0.00 0.00 0.00 173.10 171.01 1mhs h LEU 671 N 3.11 0.79 -2.05 0.66 5.85 -1.29 -3.27 115.31 119.10 1mhs h LEU 671 Ca -0.47 -0.82 0.10 0.00 0.84 0.00 0.00 57.88 57.53 1mhs h LEU 671 Cb 1.18 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.94 1mhs h LEU 671 CO 0.62 1.63 0.27 1.23 -0.34 0.00 0.00 178.44 181.85 1mhs h GLY 672 N 0.43 0.00 1.01 3.75 0.00 -1.84 -1.53 103.07 104.89 1mhs h GLY 672 Ca -0.22 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 1mhs h GLY 672 CO 0.26 0.00 0.38 0.00 0.00 0.00 0.00 176.54 177.18 1mhs h ALA 673 N 1.78 0.92 -0.43 3.60 0.00 -1.86 -2.76 119.26 120.50 1mhs h ALA 673 Ca 0.16 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1mhs h ALA 673 Cb 0.71 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1mhs h ALA 673 CO -0.00 0.44 0.10 -0.84 0.00 0.00 0.00 179.25 178.96 1mhs h ILE 674 N 0.99 1.23 -0.50 0.00 -2.65 -1.45 -1.59 117.51 113.54 1mhs h ILE 674 Ca 0.25 -0.81 0.02 0.00 1.03 0.00 0.00 64.86 65.36 1mhs h ILE 674 Cb 0.06 0.93 -0.03 0.00 -2.05 0.00 0.00 36.82 35.73 1mhs h ILE 674 CO -0.04 0.28 0.33 0.40 0.03 0.00 0.00 178.15 179.16 1mhs h ILE 675 N 0.57 1.07 -0.39 0.16 1.08 -1.55 0.77 117.51 119.23 1mhs h ILE 675 Ca 0.14 -0.20 -0.08 0.00 -0.39 0.00 0.00 64.86 64.32 1mhs h ILE 675 Cb 0.32 0.43 -0.01 0.00 -3.07 0.00 0.00 36.82 34.48 1mhs h ILE 675 CO 0.00 0.11 -0.07 0.44 -0.69 0.00 0.00 178.15 177.94 1mhs h ASP 676 N 0.59 0.73 0.04 1.72 5.19 -1.17 -2.14 116.42 121.39 1mhs h ASP 676 Ca 0.20 -0.35 0.01 0.00 -0.62 0.00 0.00 57.03 56.27 1mhs h ASP 676 Cb 0.06 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.35 1mhs h ASP 676 CO -0.05 0.91 -0.09 0.00 -3.12 0.00 0.00 179.24 176.89 1mhs h ALA 677 N 0.84 -0.13 -0.71 3.45 0.00 -0.14 -1.18 119.26 121.40 1mhs h ALA 677 Ca 0.10 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.11 1mhs h ALA 677 Cb 0.58 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.47 1mhs h ALA 677 CO 0.03 -0.60 0.47 -0.07 0.00 0.00 0.00 179.25 179.09 1mhs h LEU 678 N -0.18 0.49 -0.05 0.00 4.07 -0.86 -1.06 115.31 117.72 1mhs h LEU 678 Ca 0.02 0.01 -0.00 0.00 0.08 0.00 0.00 57.88 57.99 1mhs h LEU 678 Cb 0.20 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 41.85 1mhs h LEU 678 CO -0.06 0.28 0.01 0.11 -1.08 0.00 0.00 178.44 177.71 1mhs h LYS 679 N 0.54 0.08 -0.15 1.13 1.57 -0.61 -1.69 116.57 117.43 1mhs h LYS 679 Ca 0.33 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.09 1mhs h LYS 679 Cb 0.57 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 1mhs h LYS 679 CO -0.11 0.26 0.09 1.79 -0.57 0.00 0.00 179.45 180.91 1mhs h THR 680 N -0.12 1.06 -0.40 -0.16 1.35 -0.32 -0.20 112.91 114.12 1mhs h THR 680 Ca 0.02 -0.15 0.08 0.00 -0.55 0.00 0.00 66.41 65.80 1mhs h THR 680 Cb 0.22 0.90 -0.07 0.00 -1.73 0.00 0.00 68.15 67.47 1mhs h THR 680 CO -0.00 0.06 -0.02 0.28 -0.25 0.00 0.00 175.52 175.58 1mhs h SER 681 N 0.17 -0.22 -0.37 5.36 0.02 -1.19 0.23 113.55 117.56 1mhs h SER 681 Ca 0.05 0.10 -0.05 0.00 -0.84 0.00 0.00 61.79 61.06 1mhs h SER 681 Cb 0.02 0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 1mhs h SER 681 CO -0.01 -0.07 0.08 0.08 -1.14 0.00 0.00 176.83 175.77 1mhs h ARG 682 N 0.08 0.68 -0.51 3.45 0.11 -1.06 -2.09 114.38 115.03 1mhs h ARG 682 Ca 0.20 -0.14 -0.02 0.00 0.10 0.00 0.00 59.98 60.12 1mhs h ARG 682 Cb 0.29 -0.10 -0.02 0.00 1.11 0.00 0.00 29.97 31.24 1mhs h ARG 682 CO -0.35 0.64 0.24 1.96 0.10 0.00 0.00 179.97 182.56 1mhs h GLN 683 N 0.66 0.73 -0.77 0.08 4.20 0.89 -2.92 115.11 117.98 1mhs h GLN 683 Ca 0.15 -0.11 0.05 0.00 0.06 0.00 0.00 58.65 58.79 1mhs h GLN 683 Cb 0.29 -0.13 -0.05 0.00 0.30 0.00 0.00 27.48 27.89 1mhs h GLN 683 CO 0.00 0.62 0.47 0.82 -0.67 0.00 0.00 178.83 180.07 1mhs h ILE 684 N 0.67 1.06 0.42 2.54 2.04 0.03 -2.67 117.51 121.60 1mhs h ILE 684 Ca 0.17 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.71 1mhs h ILE 684 Cb 0.13 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1mhs h ILE 684 CO -0.02 0.16 -0.20 0.15 0.00 0.00 0.00 178.15 178.24 1mhs h PHE 685 N 0.89 -0.52 -0.30 1.37 3.57 -1.36 -2.66 116.94 117.93 1mhs h PHE 685 Ca 0.32 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.87 1mhs h PHE 685 Cb 0.10 0.17 -0.08 0.00 2.79 0.00 0.00 35.95 38.93 1mhs h PHE 685 CO -0.04 -0.21 -0.39 0.45 -2.23 0.00 0.00 178.31 175.89 1mhs h HIS 686 N -1.01 -1.11 -0.83 0.41 3.86 -1.53 0.49 115.15 115.44 1mhs h HIS 686 Ca -0.06 0.06 0.20 0.00 -1.16 0.00 0.00 60.37 59.41 1mhs h HIS 686 Cb 0.55 0.53 -0.12 0.00 1.06 0.00 0.00 27.41 29.42 1mhs h HIS 686 CO 0.02 -0.43 0.26 0.00 0.86 0.00 0.00 177.93 178.64 1mhs h ARG 687 N -0.36 0.29 -0.46 2.45 3.08 -1.57 0.53 114.38 118.34 1mhs h ARG 687 Ca 0.12 -0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.17 1mhs h ARG 687 Cb 0.58 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.54 1mhs h ARG 687 CO -0.49 0.19 0.28 1.98 -1.07 0.00 0.00 179.97 180.86 1mhs h MET 688 N 0.30 0.55 0.19 0.04 4.05 -0.60 0.19 114.93 119.65 1mhs h MET 688 Ca 0.50 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.87 1mhs h MET 688 Cb 0.92 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 31.60 1mhs h MET 688 CO -0.55 0.37 -0.09 -0.92 0.23 0.00 0.00 176.91 175.94 1mhs h TYR 689 N 0.57 -0.24 -0.86 1.39 3.20 0.15 -0.43 116.97 120.76 1mhs h TYR 689 Ca 0.18 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.13 1mhs h TYR 689 Cb -0.00 0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.29 1mhs h TYR 689 CO -0.06 -0.11 0.56 0.00 -1.64 0.00 0.00 178.16 176.90 1mhs h ALA 690 N 0.50 1.65 -0.47 1.82 0.00 -0.32 0.58 119.26 123.02 1mhs h ALA 690 Ca -0.03 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1mhs h ALA 690 Cb 0.23 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1mhs h ALA 690 CO 0.04 0.19 0.07 -0.92 0.00 0.00 0.00 179.25 178.63 1mhs h TYR 691 N 0.86 0.84 -0.15 0.00 3.20 -0.53 -2.48 116.97 118.70 1mhs h TYR 691 Ca 0.39 -0.12 -0.07 0.00 3.14 0.00 0.00 58.73 62.07 1mhs h TYR 691 Cb 0.36 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.40 1mhs h TYR 691 CO -0.00 0.78 -0.16 -0.39 -1.64 0.00 0.00 178.16 176.74 1mhs h VAL 692 N 0.65 1.35 -0.31 1.81 -1.51 0.04 -2.79 116.25 115.50 1mhs h VAL 692 Ca 0.14 -1.34 0.05 0.00 -1.23 0.00 0.00 66.70 64.32 1mhs h VAL 692 Cb 0.40 1.89 -0.04 0.00 -2.13 0.00 0.00 31.29 31.40 1mhs h VAL 692 CO 0.01 0.39 0.03 1.62 -1.23 0.00 0.00 177.57 178.40 1mhs h VAL 693 N 0.00 0.81 0.11 7.19 3.04 -0.92 0.99 116.25 127.48 1mhs h VAL 693 Ca 0.02 -0.04 0.01 0.00 -1.01 0.00 0.00 66.70 65.68 1mhs h VAL 693 Cb 0.70 0.67 -0.02 0.00 -2.01 0.00 0.00 31.29 30.64 1mhs h VAL 693 CO 0.04 0.02 -0.16 0.22 -1.01 0.00 0.00 177.57 176.68 1mhs h TYR 694 N 0.13 -0.41 0.58 3.17 3.20 -1.48 0.42 116.97 122.58 1mhs h TYR 694 Ca 0.15 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 1mhs h TYR 694 Cb 0.18 0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 1mhs h TYR 694 CO -0.20 -0.24 -0.47 -0.09 -1.64 0.00 0.00 178.16 175.52 1mhs h ARG 695 N -0.32 -0.98 0.21 1.82 9.65 -1.18 -1.69 114.38 121.88 1mhs h ARG 695 Ca 0.02 0.07 -0.01 0.00 -1.10 0.00 0.00 59.98 58.95 1mhs h ARG 695 Cb 0.33 0.22 0.00 0.00 -1.39 0.00 0.00 29.97 29.14 1mhs h ARG 695 CO -0.07 -0.65 -0.10 0.97 2.80 0.00 0.00 179.97 182.91 1mhs h ILE 696 N -1.02 0.85 0.10 1.20 2.10 -0.77 0.48 117.51 120.44 1mhs h ILE 696 Ca -0.08 -0.27 0.02 0.00 1.08 0.00 0.00 64.86 65.62 1mhs h ILE 696 Cb 0.85 1.01 -0.04 0.00 -1.09 0.00 0.00 36.82 37.55 1mhs h ILE 696 CO 0.00 0.06 -0.37 0.00 -1.08 0.00 0.00 178.15 176.77 1mhs h ALA 697 N 0.35 -0.63 -0.78 0.18 0.00 -0.20 0.20 119.26 118.38 1mhs h ALA 697 Ca -0.03 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1mhs h ALA 697 Cb 0.32 0.62 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 1mhs h ALA 697 CO 0.05 -0.92 0.35 1.25 0.00 0.00 0.00 179.25 179.98 1mhs h LEU 698 N -0.59 1.04 -0.67 0.00 5.85 -1.33 -2.90 115.31 116.71 1mhs h LEU 698 Ca 0.03 -0.14 -0.14 0.00 0.84 0.00 0.00 57.88 58.48 1mhs h LEU 698 Cb 0.63 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 1mhs h LEU 698 CO -0.23 0.89 -0.44 0.28 -0.34 0.00 0.00 178.44 178.61 1mhs h SER 699 N 1.12 0.55 -0.32 1.25 0.02 -0.45 -3.09 113.55 112.63 1mhs h SER 699 Ca 0.27 -0.26 -0.04 0.00 -0.84 0.00 0.00 61.79 60.92 1mhs h SER 699 Cb 0.15 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 1mhs h SER 699 CO -0.03 0.92 0.07 -0.29 -1.14 0.00 0.00 176.83 176.36 1mhs h ILE 700 N 0.42 1.20 -0.52 3.27 2.10 -0.41 -2.33 117.51 121.23 1mhs h ILE 700 Ca 0.03 -0.74 -0.03 0.00 1.08 0.00 0.00 64.86 65.21 1mhs h ILE 700 Cb 0.94 0.82 -0.02 0.00 -1.09 0.00 0.00 36.82 37.46 1mhs h ILE 700 CO 0.08 0.26 0.23 1.12 -1.08 0.00 0.00 178.15 178.76 1mhs h HIS 701 N 0.60 0.78 0.00 2.19 2.07 -1.50 -1.70 115.15 117.59 1mhs h HIS 701 Ca 0.13 -0.05 -0.05 0.00 -2.85 0.00 0.00 60.37 57.56 1mhs h HIS 701 Cb 0.28 -0.24 -0.01 0.00 2.57 0.00 0.00 27.41 30.02 1mhs h HIS 701 CO 0.01 0.63 -0.22 1.25 -3.07 0.00 0.00 177.93 176.52 1mhs h LEU 702 N 0.70 0.00 0.26 6.12 5.85 -1.50 0.14 115.31 126.88 1mhs h LEU 702 Ca 0.18 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1mhs h LEU 702 Cb 0.16 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1mhs h LEU 702 CO -0.02 0.22 -0.20 -0.33 -0.34 0.00 0.00 178.44 177.78 1mhs h GLU 703 N 0.00 -0.45 0.00 1.25 5.08 -0.79 -2.29 114.58 117.38 1mhs h GLU 703 Ca -0.00 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1mhs h GLU 703 Cb 0.43 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1mhs h GLU 703 CO 0.03 -0.30 -0.90 0.44 -1.00 0.00 0.00 179.01 177.29 1mhs n ILE 704 N -5.33 0.38 -0.26 3.13 -5.35 -1.12 -3.52 119.36 107.29 1mhs n ILE 704 Ca -0.09 -0.36 -0.04 0.00 -0.27 0.00 0.00 62.75 61.99 1mhs n ILE 704 Cb 0.24 -0.10 0.11 0.00 -1.74 0.00 0.00 39.64 38.14 1mhs n ILE 704 CO 0.00 0.00 0.00 0.15 -1.76 0.00 0.00 176.55 174.94 1mhs h PHE 705 N 0.00 1.13 -0.76 4.28 3.57 -0.60 0.60 116.94 125.17 1mhs h PHE 705 Ca 0.00 -0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.41 1mhs h PHE 705 Cb 0.83 -0.34 -0.04 0.00 2.79 0.00 0.00 35.95 39.19 1mhs h PHE 705 CO 0.00 0.85 0.41 -0.07 -2.23 0.00 0.00 178.31 177.27 1mhs h LEU 706 N 1.10 0.96 -0.15 0.59 3.38 -1.50 -2.81 115.31 116.88 1mhs h LEU 706 Ca 0.26 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1mhs h LEU 706 Cb 0.19 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1mhs h LEU 706 CO -0.02 0.79 0.06 1.23 0.09 0.00 0.00 178.44 180.59 1mhs h GLY 707 N 1.05 0.24 -0.15 0.83 0.00 -1.26 -2.15 103.07 101.63 1mhs h GLY 707 Ca 0.27 -0.13 0.02 0.00 0.00 0.00 0.00 47.33 47.49 1mhs h GLY 707 CO -0.04 0.12 -0.20 1.41 0.00 0.00 0.00 176.54 177.83 1mhs h LEU 708 N 0.10 -0.68 -1.26 3.11 4.07 0.40 0.92 115.31 121.97 1mhs h LEU 708 Ca 0.05 0.09 0.19 0.00 0.08 0.00 0.00 57.88 58.29 1mhs h LEU 708 Cb 0.16 0.28 -0.08 0.00 1.08 0.00 0.00 40.66 42.09 1mhs h LEU 708 CO -0.00 -0.15 0.61 4.11 -1.08 0.00 0.00 178.44 181.93 1mhs h TRP 709 N -0.15 0.81 -0.98 1.13 5.08 -1.56 0.52 115.95 120.81 1mhs h TRP 709 Ca 0.03 0.03 0.27 0.00 1.08 0.00 0.00 58.89 60.29 1mhs h TRP 709 Cb 0.22 -0.25 -0.05 0.00 -3.00 0.00 0.00 29.16 26.08 1mhs h TRP 709 CO -0.64 0.21 0.68 0.82 -1.28 0.00 0.00 178.44 178.22 1mhs h ILE 710 N 0.60 0.54 0.00 0.12 1.08 -0.14 -2.28 117.51 117.43 1mhs h ILE 710 Ca 0.52 -0.05 -0.40 0.00 -0.39 0.00 0.00 64.86 64.55 1mhs h ILE 710 Cb 1.01 0.39 -0.07 0.00 -3.07 0.00 0.00 36.82 35.09 1mhs h ILE 710 CO -0.27 0.02 -2.48 0.00 -0.69 0.00 0.00 178.15 174.74 1mhs n ALA 711 N -2.65 1.42 -2.99 1.87 0.00 0.15 -3.76 120.51 114.54 1mhs n ALA 711 Ca 0.21 -1.10 0.00 0.00 0.00 0.00 0.00 53.44 52.55 1mhs n ALA 711 Cb 0.96 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 20.35 1mhs n ALA 711 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1mhs n ILE 712 N -3.38 0.00 0.00 0.00 5.41 0.68 -4.20 119.36 117.88 1mhs n ILE 712 Ca -0.47 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.28 1mhs n ILE 712 Cb 0.97 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.90 1mhs n ILE 712 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1mhs n LEU 713 N 0.00 0.00 0.00 1.39 4.77 -1.26 -4.31 117.00 117.59 1mhs n LEU 713 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1mhs n LEU 713 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1mhs n LEU 713 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.39 176.65 1mhs n ASN 714 N 9.71 0.00 -0.42 -1.43 3.02 -1.26 -5.12 115.26 119.76 1mhs n ASN 714 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1mhs n ASN 714 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1mhs n ASN 714 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1mhs n ARG 715 N 0.00 3.23 -3.83 3.52 5.12 -1.26 -5.05 116.66 118.39 1mhs n ARG 715 Ca 0.00 0.00 -0.06 0.00 -1.93 0.00 0.00 57.85 55.86 1mhs n ARG 715 Cb 0.00 0.00 0.01 0.00 -1.16 0.00 0.00 32.46 31.31 1mhs n ARG 715 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1mhs s SER 716 N -2.59 -0.09 -0.13 0.55 1.04 -1.26 -5.08 113.70 106.15 1mhs s SER 716 Ca 0.00 -0.80 -0.00 0.00 0.48 0.00 0.00 55.95 55.63 1mhs s SER 716 Cb 0.00 0.69 -0.02 0.00 0.10 0.00 0.00 66.02 66.80 1mhs s SER 716 CO 0.00 -1.34 -0.12 -0.76 0.98 0.00 0.00 173.24 172.00 1mhs s LEU 717 N -3.07 2.77 -0.10 2.42 1.43 -1.26 -5.07 118.68 115.80 1mhs s LEU 717 Ca 0.15 -0.30 -0.15 0.00 -1.03 0.00 0.00 54.13 52.80 1mhs s LEU 717 Cb -0.04 -1.63 0.03 0.00 0.03 0.00 0.00 46.19 44.59 1mhs s LEU 717 CO 0.08 0.17 0.38 0.20 0.23 0.00 0.00 176.35 177.41 1mhs s ASN 718 N 0.30 -0.35 0.00 2.29 0.01 -1.26 -5.07 114.94 110.86 1mhs s ASN 718 Ca -0.09 0.55 0.00 0.00 -0.71 0.00 0.00 52.86 52.61 1mhs s ASN 718 Cb -0.16 0.63 0.00 0.00 0.41 0.00 0.00 41.25 42.13 1mhs s ASN 718 CO 0.05 -0.26 0.00 -0.38 -1.51 0.00 0.00 177.10 175.01 1mhs n ILE 719 N 2.27 0.00 0.00 0.60 2.08 -1.26 -1.81 119.36 121.25 1mhs n ILE 719 Ca -0.16 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.15 1mhs n ILE 719 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.46 1mhs n ILE 719 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1mhs n GLU 720 N -1.47 0.00 -0.28 0.38 1.02 -1.26 0.20 120.64 119.23 1mhs n GLU 720 Ca 0.00 0.00 0.19 0.00 -0.02 0.00 0.00 57.16 57.33 1mhs n GLU 720 Cb 0.00 -0.02 0.48 0.00 -0.02 0.00 0.00 31.44 31.88 1mhs n GLU 720 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1mhs h LEU 721 N 0.00 0.48 0.09 -4.62 3.38 -2.00 -0.87 115.31 111.76 1mhs h LEU 721 Ca 0.00 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1mhs h LEU 721 Cb 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1mhs h LEU 721 CO 0.00 0.17 -0.04 0.58 0.09 0.00 0.00 178.44 179.24 1mhs h VAL 722 N 0.46 1.00 -0.54 1.22 2.07 -1.08 -2.29 116.25 117.10 1mhs h VAL 722 Ca 0.51 -0.30 0.11 0.00 0.82 0.00 0.00 66.70 67.84 1mhs h VAL 722 Cb 1.19 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 32.13 1mhs h VAL 722 CO -0.23 0.08 0.37 -0.37 0.02 0.00 0.00 177.57 177.44 1mhs h VAL 723 N -0.25 0.85 0.64 2.57 -1.51 0.36 -1.31 116.25 117.59 1mhs h VAL 723 Ca -0.01 -0.09 -0.03 0.00 -1.23 0.00 0.00 66.70 65.34 1mhs h VAL 723 Cb 0.21 0.57 0.01 0.00 -2.13 0.00 0.00 31.29 29.95 1mhs h VAL 723 CO 0.02 0.05 -0.31 0.15 -1.23 0.00 0.00 177.57 176.25 1mhs h PHE 724 N 0.25 -0.79 -0.79 5.19 3.57 -0.87 -1.29 116.94 122.20 1mhs h PHE 724 Ca 0.25 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.85 1mhs h PHE 724 Cb 0.67 0.26 -0.08 0.00 2.79 0.00 0.00 35.95 39.59 1mhs h PHE 724 CO -0.00 -0.45 0.40 0.97 -2.23 0.00 0.00 178.31 177.00 1mhs h ILE 725 N -1.05 0.81 -0.81 1.41 -0.00 -0.88 -0.60 117.51 116.39 1mhs h ILE 725 Ca -0.09 -0.22 0.06 0.00 -0.00 0.00 0.00 64.86 64.61 1mhs h ILE 725 Cb 0.70 0.11 -0.06 0.00 -0.00 0.00 0.00 36.82 37.57 1mhs h ILE 725 CO 0.14 0.12 0.49 0.00 -0.00 0.00 0.00 178.15 178.91 1mhs h ALA 726 N 1.49 1.12 -0.21 0.18 0.00 -1.15 0.21 119.26 120.89 1mhs h ALA 726 Ca 0.40 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 55.11 1mhs h ALA 726 Cb 0.48 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1mhs h ALA 726 CO -0.30 0.22 -0.66 -0.84 0.00 0.00 0.00 179.25 177.66 1mhs h ILE 727 N 0.90 1.28 0.00 0.00 -0.00 0.07 -1.40 117.51 118.35 1mhs h ILE 727 Ca 0.36 -1.85 0.00 0.00 -0.00 0.00 0.00 64.86 63.37 1mhs h ILE 727 Cb 0.18 1.84 0.00 0.00 -0.00 0.00 0.00 36.82 38.84 1mhs h ILE 727 CO -0.18 0.59 -0.50 2.22 -0.00 0.00 0.00 178.15 180.29 1mhs n PHE 728 N -3.99 0.58 -0.08 0.16 -1.74 -0.58 -3.69 117.46 108.13 1mhs n PHE 728 Ca -0.06 0.17 -0.11 0.00 -0.56 0.00 0.00 57.45 56.89 1mhs n PHE 728 Cb 0.69 -0.68 -0.08 0.00 1.52 0.00 0.00 39.48 40.93 1mhs n PHE 728 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1mhs n ALA 729 N -1.80 1.66 1.08 1.98 0.00 0.71 -4.65 120.51 119.50 1mhs n ALA 729 Ca 0.04 -0.71 0.12 0.00 0.00 0.00 0.00 53.44 52.89 1mhs n ALA 729 Cb 0.43 0.11 0.15 0.00 0.00 0.00 0.00 19.45 20.14 1mhs n ALA 729 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1mhs n ASP 730 N -2.91 2.40 0.00 0.00 9.92 -0.53 -4.26 116.55 121.16 1mhs n ASP 730 Ca -0.28 -1.72 0.00 0.00 -0.53 0.00 0.00 54.79 52.26 1mhs n ASP 730 Cb 0.82 0.14 0.00 0.00 -0.64 0.00 0.00 41.12 41.44 1mhs n ASP 730 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1mhs n VAL 731 N 0.67 0.00 -0.24 2.53 0.31 -1.24 -4.74 118.33 115.62 1mhs n VAL 731 Ca 0.13 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.47 1mhs n VAL 731 Cb 0.51 0.00 0.08 0.00 -0.91 0.00 0.00 33.84 33.52 1mhs n VAL 731 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1mhs h ALA 732 N -1.94 0.47 -1.01 3.52 0.00 -1.89 -3.15 119.26 115.26 1mhs h ALA 732 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1mhs h ALA 732 Cb 0.00 0.53 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1mhs h ALA 732 CO 0.00 -0.42 0.00 0.25 0.00 0.00 0.00 179.25 179.08 1mhs n THR 733 N -5.47 0.00 0.01 0.00 -2.24 -1.26 0.22 114.28 105.55 1mhs n THR 733 Ca 0.09 1.22 0.22 0.00 -2.27 0.00 0.00 64.05 63.31 1mhs n THR 733 Cb 0.36 -1.68 0.59 0.00 -2.10 0.00 0.00 70.33 67.50 1mhs n THR 733 CO 0.00 0.00 0.00 0.17 -0.57 0.00 0.00 175.07 174.67 1mhs h LEU 734 N 0.00 0.00 0.00 3.22 -0.00 -1.72 -2.19 115.31 114.61 1mhs h LEU 734 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1mhs h LEU 734 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1mhs h LEU 734 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 178.44 178.44 1mhs n ALA 735 N -2.21 -0.24 0.00 0.17 0.00 0.61 -4.82 120.51 114.02 1mhs n ALA 735 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1mhs n ALA 735 Cb 0.98 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.43 1mhs n ALA 735 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1mhs n ILE 736 N -1.30 0.00 -3.60 0.00 5.41 -0.36 -5.01 119.36 114.50 1mhs n ILE 736 Ca 0.00 0.00 -0.16 0.00 1.00 0.00 0.00 62.75 63.59 1mhs n ILE 736 Cb 0.00 0.00 -0.06 0.00 -0.71 0.00 0.00 39.64 38.87 1mhs n ILE 736 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1mhs s ALA 737 N 0.00 -1.38 -0.11 -1.39 0.00 -1.26 -4.90 121.76 112.71 1mhs s ALA 737 Ca 0.00 0.84 -0.30 0.00 0.00 0.00 0.00 51.96 52.50 1mhs s ALA 737 Cb 0.00 0.13 0.11 0.00 0.00 0.00 0.00 23.12 23.37 1mhs s ALA 737 CO 0.00 -0.38 0.91 0.71 0.00 0.00 0.00 175.76 177.00 1mhs s TYR 738 N -1.60 -0.43 0.07 0.00 1.51 -1.26 -5.07 117.35 110.56 1mhs s TYR 738 Ca -0.10 0.68 -0.26 0.00 -1.01 0.00 0.00 57.07 56.37 1mhs s TYR 738 Cb -0.02 0.45 -0.06 0.00 -0.11 0.00 0.00 41.96 42.23 1mhs s TYR 738 CO 0.05 -0.43 0.82 -0.51 -1.11 0.00 0.00 175.55 174.37 1mhs s ASP 739 N -1.32 7.30 -0.28 2.29 1.01 -1.26 -4.67 116.67 119.74 1mhs s ASP 739 Ca -0.03 1.55 -0.11 0.00 0.71 0.00 0.00 52.55 54.67 1mhs s ASP 739 Cb -0.00 -2.50 -0.05 0.00 1.01 0.00 0.00 42.92 41.37 1mhs s ASP 739 CO 0.02 -0.01 0.19 0.20 0.21 0.00 0.00 175.17 175.78 1mhs s ASN 740 N -0.06 6.02 0.05 0.27 -0.87 -1.26 -5.00 114.94 114.09 1mhs s ASN 740 Ca 0.41 -0.02 -0.23 0.00 -1.57 0.00 0.00 52.86 51.44 1mhs s ASN 740 Cb -0.21 -2.12 -0.15 0.00 -0.02 0.00 0.00 41.25 38.74 1mhs s ASN 740 CO 0.25 -0.06 1.52 0.00 -2.57 0.00 0.00 177.10 176.24 1mhs h ALA 741 N 8.37 0.07 -0.17 0.60 0.00 -1.98 -3.23 119.26 122.93 1mhs h ALA 741 Ca -0.35 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1mhs h ALA 741 Cb 1.19 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1mhs h ALA 741 CO 0.55 -0.30 0.08 -1.00 0.00 0.00 0.00 179.25 178.59 1mhs h PRO 742 N -0.14 0.24 0.00 0.00 0.13 -1.98 -3.31 132.00 126.94 1mhs h PRO 742 Ca 0.02 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1mhs h PRO 742 Cb 0.26 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.34 1mhs h PRO 742 CO 0.00 0.28 0.00 2.48 -0.23 0.00 0.00 178.00 180.53 1mhs n TYR 743 N -4.89 0.00 1.17 1.56 -0.00 -1.22 0.23 117.16 114.00 1mhs n TYR 743 Ca -0.04 0.00 0.05 0.00 -0.00 0.00 0.00 57.90 57.91 1mhs n TYR 743 Cb 0.09 0.00 0.15 0.00 -0.00 0.00 0.00 39.34 39.58 1mhs n TYR 743 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.86 175.73 1mhs n SER 744 N -0.36 1.43 -0.80 9.48 3.41 -1.25 -3.00 113.62 122.52 1mhs n SER 744 Ca 0.00 -1.96 0.07 0.00 -0.26 0.00 0.00 58.87 56.72 1mhs n SER 744 Cb 0.00 -0.17 0.19 0.00 -0.26 0.00 0.00 64.21 63.97 1mhs n SER 744 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1mhs n GLN 745 N 0.27 2.71 -5.07 4.33 7.27 0.62 -2.05 117.38 125.46 1mhs n GLN 745 Ca 0.10 -2.15 -0.32 0.00 0.07 0.00 0.00 57.00 54.70 1mhs n GLN 745 Cb 0.23 -1.34 -0.15 0.00 2.41 0.00 0.00 30.24 31.39 1mhs n GLN 745 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 1mhs s THR 746 N -1.01 2.52 0.92 1.69 2.01 -1.16 -4.87 115.64 115.73 1mhs s THR 746 Ca 0.29 -0.90 -0.10 0.00 0.31 0.00 0.00 61.69 61.29 1mhs s THR 746 Cb 0.15 -1.96 0.14 0.00 0.01 0.00 0.00 72.50 70.84 1mhs s THR 746 CO 0.20 0.57 1.12 -2.65 -0.69 0.00 0.00 174.62 173.17 1mhs n PRO 747 N 2.86 -0.43 -1.95 4.92 -0.02 -1.25 -4.59 135.00 134.53 1mhs n PRO 747 Ca -0.17 -0.06 -0.37 0.00 -2.02 0.00 0.00 63.50 60.87 1mhs n PRO 747 Cb 0.52 -2.36 0.03 0.00 -0.02 0.00 0.00 33.50 31.67 1mhs n PRO 747 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1mhs s VAL 748 N -2.61 2.46 0.16 -1.45 1.01 -1.16 -5.00 120.40 113.81 1mhs s VAL 748 Ca 0.67 0.33 -0.17 0.00 0.00 0.00 0.00 61.98 62.81 1mhs s VAL 748 Cb -0.23 -3.16 -0.07 0.00 0.00 0.00 0.00 36.38 32.92 1mhs s VAL 748 CO 0.58 -0.02 0.61 -1.59 0.00 0.00 0.00 175.10 174.68 1mhs s LYS 749 N -2.96 4.10 -0.02 2.72 -2.85 -1.26 -5.05 119.74 114.40 1mhs s LYS 749 Ca 0.71 0.64 -0.27 0.00 -1.00 0.00 0.00 55.97 56.06 1mhs s LYS 749 Cb -0.35 -2.96 -0.03 0.00 -2.06 0.00 0.00 37.83 32.43 1mhs s LYS 749 CO 0.41 0.47 0.85 -0.46 0.10 0.00 0.00 175.35 176.73 1mhs s TRP 750 N -1.44 3.63 0.00 1.78 -0.11 -1.26 -4.67 118.94 116.87 1mhs s TRP 750 Ca 0.38 1.50 0.00 0.00 1.22 0.00 0.00 56.10 59.21 1mhs s TRP 750 Cb -0.16 -2.97 0.00 0.00 -1.50 0.00 0.00 33.47 28.83 1mhs s TRP 750 CO 0.20 0.05 0.00 0.09 -4.62 0.00 0.00 176.95 172.66 1mhs n ASN 751 N 3.78 0.00 0.00 5.86 3.02 -1.26 -3.76 115.26 122.90 1mhs n ASN 751 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.58 1mhs n ASN 751 Cb 0.51 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.68 1mhs n ASN 751 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1mhs n LEU 752 N 0.00 0.00 0.31 3.41 -0.00 -1.26 -0.44 117.00 119.02 1mhs n LEU 752 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 56.01 55.87 1mhs n LEU 752 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.35 1mhs n LEU 752 CO 0.00 0.00 0.52 -0.65 -0.00 0.00 0.00 177.39 177.26 1mhs h PRO 753 N 0.00 -0.83 -6.05 1.96 0.11 -2.01 -3.45 132.00 121.73 1mhs h PRO 753 Ca 0.00 0.06 -0.73 0.00 0.11 0.00 0.00 66.00 65.44 1mhs h PRO 753 Cb 0.00 0.19 0.07 0.00 0.11 0.00 0.00 31.00 31.37 1mhs h PRO 753 CO 0.00 -0.55 -0.08 1.17 -0.21 0.00 0.00 178.00 178.33 1mhs n LYS 754 N -4.54 0.20 -2.53 1.05 3.00 0.42 -4.90 118.16 110.85 1mhs n LYS 754 Ca -0.11 0.07 -0.38 0.00 -0.00 0.00 0.00 58.31 57.89 1mhs n LYS 754 Cb 0.35 -1.42 -0.04 0.00 0.00 0.00 0.00 35.03 33.92 1mhs n LYS 754 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 1mhs s LEU 755 N 1.03 4.35 0.00 3.14 0.20 -1.26 -4.80 118.68 121.34 1mhs s LEU 755 Ca 0.80 2.13 0.00 0.00 0.69 0.00 0.00 54.13 57.75 1mhs s LEU 755 Cb -1.10 -3.90 0.00 0.00 -0.43 0.00 0.00 46.19 40.76 1mhs s LEU 755 CO 0.56 -0.29 0.00 1.87 -0.29 0.00 0.00 176.35 178.19 1mhs n TRP 756 N 0.58 0.00 -0.53 5.38 -0.00 -1.26 -4.17 117.44 117.44 1mhs n TRP 756 Ca 0.02 0.00 -0.18 0.00 -0.00 0.00 0.00 57.50 57.34 1mhs n TRP 756 Cb 0.47 0.00 -0.05 0.00 -0.00 0.00 0.00 31.31 31.73 1mhs n TRP 756 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1mhs n GLY 757 N 0.00 -0.14 3.63 5.87 0.00 -1.26 -4.64 105.19 108.65 1mhs n GLY 757 Ca 0.00 0.43 -0.36 0.00 0.00 0.00 0.00 46.02 46.10 1mhs n GLY 757 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1mhs n MET 758 N 3.06 0.53 -0.24 1.61 2.81 -1.26 -4.69 117.12 118.94 1mhs n MET 758 Ca 0.23 0.24 -0.01 0.00 -1.81 0.00 0.00 57.70 56.36 1mhs n MET 758 Cb 0.00 -2.27 0.11 0.00 -0.71 0.00 0.00 33.22 30.35 1mhs n MET 758 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 1mhs h SER 759 N -0.24 0.55 -0.80 7.83 0.87 -1.90 0.40 113.55 120.26 1mhs h SER 759 Ca -0.48 0.04 0.02 0.00 -1.23 0.00 0.00 61.79 60.14 1mhs h SER 759 Cb 1.33 -0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 63.18 1mhs h SER 759 CO 0.47 0.35 0.52 -0.37 -0.53 0.00 0.00 176.83 177.28 1mhs h VAL 760 N 0.69 1.17 -0.59 2.23 -1.51 -1.98 0.06 116.25 116.33 1mhs h VAL 760 Ca 0.32 -0.36 -0.04 0.00 -1.23 0.00 0.00 66.70 65.38 1mhs h VAL 760 Cb 0.23 0.03 -0.03 0.00 -2.13 0.00 0.00 31.29 29.39 1mhs h VAL 760 CO -0.20 0.19 0.21 -0.07 -1.23 0.00 0.00 177.57 176.48 1mhs h LEU 761 N 1.05 0.83 -1.26 4.19 3.38 -1.45 0.12 115.31 122.18 1mhs h LEU 761 Ca 0.30 -0.19 0.12 0.00 0.09 0.00 0.00 57.88 58.20 1mhs h LEU 761 Cb -0.07 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 40.39 1mhs h LEU 761 CO -0.08 0.79 0.57 -0.07 0.09 0.00 0.00 178.44 179.74 1mhs h LEU 762 N 0.82 0.72 -0.36 1.67 3.38 0.68 0.11 115.31 122.33 1mhs h LEU 762 Ca 0.19 0.03 -0.16 0.00 0.09 0.00 0.00 57.88 58.03 1mhs h LEU 762 Cb 0.24 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 1mhs h LEU 762 CO -0.01 0.40 -0.41 1.23 0.09 0.00 0.00 178.44 179.74 1mhs h GLY 763 N 0.78 1.00 0.99 0.83 0.00 -0.03 -2.12 103.07 104.52 1mhs h GLY 763 Ca 0.42 -1.05 -0.00 0.00 0.00 0.00 0.00 47.33 46.70 1mhs h GLY 763 CO -0.18 0.95 0.26 -2.08 0.00 0.00 0.00 176.54 175.49 1mhs h VAL 764 N 0.73 1.13 0.14 4.60 2.07 0.16 0.10 116.25 125.18 1mhs h VAL 764 Ca 0.05 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 1mhs h VAL 764 Cb 1.01 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 1mhs h VAL 764 CO 0.10 0.13 -0.07 1.62 0.02 0.00 0.00 177.57 179.37 1mhs h VAL 765 N 0.57 1.01 -0.95 2.57 3.04 -1.05 -1.89 116.25 119.54 1mhs h VAL 765 Ca 0.15 -0.67 0.09 0.00 -1.01 0.00 0.00 66.70 65.26 1mhs h VAL 765 Cb -0.02 1.42 -0.07 0.00 -2.01 0.00 0.00 31.29 30.61 1mhs h VAL 765 CO -0.03 0.16 0.59 0.25 -1.01 0.00 0.00 177.57 177.53 1mhs h LEU 766 N -0.50 0.91 0.65 3.16 5.85 -1.26 0.56 115.31 124.67 1mhs h LEU 766 Ca -0.02 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 1mhs h LEU 766 Cb 0.40 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 41.28 1mhs h LEU 766 CO 0.03 0.54 -0.31 0.00 -0.34 0.00 0.00 178.44 178.36 1mhs h ALA 767 N 1.47 -1.18 -0.66 1.25 0.00 -0.73 0.69 119.26 120.10 1mhs h ALA 767 Ca 0.44 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 55.23 1mhs h ALA 767 Cb 0.30 0.34 -0.06 0.00 0.00 0.00 0.00 17.79 18.36 1mhs h ALA 767 CO -0.21 -1.11 0.33 -0.24 0.00 0.00 0.00 179.25 178.01 1mhs h VAL 768 N -0.91 0.88 0.67 0.00 3.04 -1.11 -1.95 116.25 116.87 1mhs h VAL 768 Ca -0.09 -0.20 -0.03 0.00 -1.01 0.00 0.00 66.70 65.37 1mhs h VAL 768 Cb 0.67 0.25 0.01 0.00 -2.01 0.00 0.00 31.29 30.20 1mhs h VAL 768 CO 0.15 0.11 -0.32 1.23 -1.01 0.00 0.00 177.57 177.72 1mhs h GLY 769 N 0.58 -0.95 -0.57 3.17 0.00 0.16 -2.85 103.07 102.62 1mhs h GLY 769 Ca 0.32 0.35 0.35 0.00 0.00 0.00 0.00 47.33 48.35 1mhs h GLY 769 CO -0.24 -0.34 0.81 -0.91 0.00 0.00 0.00 176.54 175.86 1mhs h THR 770 N -0.94 0.35 0.00 4.70 1.35 0.58 0.48 112.91 119.43 1mhs h THR 770 Ca -0.09 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.70 1mhs h THR 770 Cb 0.69 0.15 0.00 0.00 -1.73 0.00 0.00 68.15 67.26 1mhs h THR 770 CO 0.15 0.03 0.00 1.87 -0.25 0.00 0.00 175.52 177.33 1mhs n TRP 771 N -4.50 0.00 -0.35 4.73 -0.00 -0.75 -2.03 117.44 114.54 1mhs n TRP 771 Ca 0.30 0.00 0.28 0.00 -0.00 0.00 0.00 57.50 58.08 1mhs n TRP 771 Cb 1.19 -0.06 0.58 0.00 -0.00 0.00 0.00 31.31 33.02 1mhs n TRP 771 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 177.69 178.51 1mhs h ILE 772 N 0.00 0.42 0.05 5.87 5.03 -1.10 1.20 117.51 128.98 1mhs h ILE 772 Ca 0.00 -0.09 0.00 0.00 -0.12 0.00 0.00 64.86 64.65 1mhs h ILE 772 Cb 0.00 0.14 -0.01 0.00 -3.03 0.00 0.00 36.82 33.92 1mhs h ILE 772 CO 0.00 0.05 -0.06 0.00 -0.68 0.00 0.00 178.15 177.46 1mhs h THR 773 N 0.26 0.86 -0.18 -0.27 1.03 -0.12 -1.62 112.91 112.88 1mhs h THR 773 Ca 0.64 0.00 -0.15 0.00 -0.01 0.00 0.00 66.41 66.89 1mhs h THR 773 Cb 1.86 0.86 0.00 0.00 -1.07 0.00 0.00 68.15 69.81 1mhs h THR 773 CO -0.27 0.00 -0.46 0.58 -0.01 0.00 0.00 175.52 175.36 1mhs h VAL 774 N -0.13 1.33 0.00 0.00 2.07 0.16 -2.95 116.25 116.74 1mhs h VAL 774 Ca 0.01 -1.71 0.00 0.00 0.82 0.00 0.00 66.70 65.82 1mhs h VAL 774 Cb 0.13 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 1mhs h VAL 774 CO -0.03 0.53 0.01 0.35 0.02 0.00 0.00 177.57 178.45 1mhs n THR 775 N -4.20 0.91 -0.08 2.57 -2.24 0.38 -0.46 114.28 111.16 1mhs n THR 775 Ca -0.06 0.23 -0.22 0.00 -2.27 0.00 0.00 64.05 61.73 1mhs n THR 775 Cb 0.57 -1.23 -0.12 0.00 -2.10 0.00 0.00 70.33 67.45 1mhs n THR 775 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1mhs n THR 776 N -1.22 1.60 -0.10 4.28 -1.04 -0.63 -2.37 114.28 114.80 1mhs n THR 776 Ca 0.00 -0.19 0.06 0.00 -2.04 0.00 0.00 64.05 61.88 1mhs n THR 776 Cb 0.01 -1.96 0.40 0.00 -1.82 0.00 0.00 70.33 66.95 1mhs n THR 776 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1mhs h MET 777 N -0.74 0.62 -0.11 -2.82 -0.00 -0.82 -1.62 114.93 109.45 1mhs h MET 777 Ca -0.38 -0.04 0.00 0.00 -0.00 0.00 0.00 59.70 59.28 1mhs h MET 777 Cb 1.49 -0.14 0.00 0.00 -0.00 0.00 0.00 31.60 32.95 1mhs h MET 777 CO -0.15 0.41 0.00 0.98 -0.00 0.00 0.00 176.91 178.16 1mhs n TYR 778 N -4.47 0.12 -0.31 -0.10 9.36 -0.87 -2.14 117.16 118.75 1mhs n TYR 778 Ca 0.08 -0.08 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1mhs n TYR 778 Cb 0.17 -0.00 0.14 0.00 -0.63 0.00 0.00 39.34 39.02 1mhs n TYR 778 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1mhs h ALA 779 N 3.47 1.18 0.00 2.98 0.00 -0.90 -3.37 119.26 122.61 1mhs h ALA 779 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1mhs h ALA 779 Cb 0.76 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1mhs h ALA 779 CO 0.00 0.31 0.00 0.94 0.00 0.00 0.00 179.25 180.50 1mhs n GLN 780 N -4.60 0.70 0.00 0.00 7.27 -1.25 -4.67 117.38 114.83 1mhs n GLN 780 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.19 1mhs n GLN 780 Cb 0.16 -0.06 0.00 0.00 2.41 0.00 0.00 30.24 32.75 1mhs n GLN 780 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1mhs n GLY 781 N 0.00 -0.08 1.90 1.69 0.00 -0.91 -1.41 105.19 106.38 1mhs n GLY 781 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1mhs n GLY 781 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1mhs n GLU 782 N -0.39 0.00 0.00 1.61 0.28 -1.26 -4.83 120.64 116.06 1mhs n GLU 782 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1mhs n GLU 782 Cb 0.00 -0.05 0.00 0.00 1.43 0.00 0.00 31.44 32.82 1mhs n GLU 782 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 1mhs n ASN 783 N -3.17 0.00 0.00 -1.84 4.05 -0.50 -4.82 115.26 108.99 1mhs n ASN 783 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 1mhs n ASN 783 Cb 0.02 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.03 1mhs n ASN 783 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1mhs n GLY 784 N 0.00 2.56 3.28 8.20 0.00 -1.26 -5.10 105.19 112.88 1mhs n GLY 784 Ca 0.00 0.06 -0.20 0.00 0.00 0.00 0.00 46.02 45.88 1mhs n GLY 784 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mhs s GLY 785 N 0.00 1.21 -0.06 -0.02 0.00 -1.26 -5.04 107.32 102.15 1mhs s GLY 785 Ca 0.00 -1.38 0.16 0.00 0.00 0.00 0.00 44.72 43.50 1mhs s GLY 785 CO 0.00 -1.43 0.27 1.39 0.00 0.00 0.00 173.10 173.33 1mhs n ILE 786 N 0.43 0.29 -0.00 0.90 5.41 -1.26 -4.77 119.36 120.35 1mhs n ILE 786 Ca -0.14 -0.45 0.01 0.00 1.00 0.00 0.00 62.75 63.17 1mhs n ILE 786 Cb 0.57 -0.07 -0.02 0.00 -0.71 0.00 0.00 39.64 39.41 1mhs n ILE 786 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1mhs n VAL 787 N -2.21 0.00 0.00 1.39 0.31 -1.26 -5.03 118.33 111.54 1mhs n VAL 787 Ca -0.09 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1mhs n VAL 787 Cb 0.58 0.44 0.00 0.00 -0.91 0.00 0.00 33.84 33.96 1mhs n VAL 787 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1mhs n GLN 788 N -1.58 0.00 -3.11 5.55 6.02 -1.26 -5.00 117.38 118.00 1mhs n GLN 788 Ca -0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.56 1mhs n GLN 788 Cb 0.06 -0.39 -0.07 0.00 1.02 0.00 0.00 30.24 30.87 1mhs n GLN 788 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1mhs s ASN 789 N -1.02 6.40 -0.87 1.08 0.01 -1.26 -4.95 114.94 114.33 1mhs s ASN 789 Ca 0.00 0.02 -0.28 0.00 -0.71 0.00 0.00 52.86 51.89 1mhs s ASN 789 Cb 0.00 -2.33 -0.19 0.00 0.41 0.00 0.00 41.25 39.14 1mhs s ASN 789 CO 0.00 -0.65 2.58 0.49 -1.51 0.00 0.00 177.10 178.01 1mhs n PHE 790 N 6.12 0.74 -0.79 2.20 3.01 -1.26 -4.62 117.46 122.84 1mhs n PHE 790 Ca -0.01 0.27 0.00 0.00 1.01 0.00 0.00 57.45 58.72 1mhs n PHE 790 Cb 0.48 -2.28 0.00 0.00 -0.01 0.00 0.00 39.48 37.67 1mhs n PHE 790 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1mhs n GLY 791 N 6.30 -0.56 0.00 1.37 0.00 -1.26 -4.69 105.19 106.36 1mhs n GLY 791 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.61 1mhs n GLY 791 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1mhs n ASN 792 N -0.05 0.56 -0.13 1.61 3.02 -1.26 -4.37 115.26 114.63 1mhs n ASN 792 Ca 0.00 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.45 1mhs n ASN 792 Cb 0.31 0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.48 1mhs n ASN 792 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 1mhs h MET 793 N 0.00 0.62 0.42 3.52 2.86 -1.93 -2.97 114.93 117.45 1mhs h MET 793 Ca 0.00 -0.14 -0.02 0.00 -2.06 0.00 0.00 59.70 57.48 1mhs h MET 793 Cb 0.13 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.71 1mhs h MET 793 CO 0.00 0.63 -0.20 0.38 1.06 0.00 0.00 176.91 178.78 1mhs h ASP 794 N 0.49 -0.47 -0.74 1.22 3.04 -1.89 0.53 116.42 118.59 1mhs h ASP 794 Ca 0.12 -0.11 0.22 0.00 -3.24 0.00 0.00 57.03 54.02 1mhs h ASP 794 Cb 0.28 0.12 -0.03 0.00 -1.04 0.00 0.00 39.33 38.66 1mhs h ASP 794 CO -0.00 -0.06 0.86 -0.33 -2.04 0.00 0.00 179.24 177.66 1mhs h GLU 795 N -0.99 0.00 0.00 4.15 5.08 -1.84 -0.55 114.58 120.44 1mhs h GLU 795 Ca -0.06 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.11 1mhs h GLU 795 Cb 0.55 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.77 1mhs h GLU 795 CO 0.09 0.00 -1.72 0.28 -1.00 0.00 0.00 179.01 176.67 1mhs n VAL 796 N -3.45 0.72 -0.24 3.13 0.31 -1.12 -3.59 118.33 114.09 1mhs n VAL 796 Ca 0.16 -0.33 0.26 0.00 -0.01 0.00 0.00 64.34 64.41 1mhs n VAL 796 Cb 1.10 -0.88 0.63 0.00 -0.91 0.00 0.00 33.84 33.78 1mhs n VAL 796 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1mhs h LEU 797 N 0.00 0.19 0.06 7.52 5.85 0.16 0.76 115.31 129.86 1mhs h LEU 797 Ca -0.28 0.03 -0.36 0.00 0.84 0.00 0.00 57.88 58.11 1mhs h LEU 797 Cb 1.50 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.49 1mhs h LEU 797 CO -0.02 0.06 -2.04 0.33 -0.34 0.00 0.00 178.44 176.43 1mhs n PHE 798 N -4.39 0.79 -0.22 1.25 7.35 -0.63 -3.47 117.46 118.14 1mhs n PHE 798 Ca 0.21 0.21 -0.03 0.00 -0.76 0.00 0.00 57.45 57.08 1mhs n PHE 798 Cb 0.90 -1.10 0.16 0.00 0.35 0.00 0.00 39.48 39.80 1mhs n PHE 798 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1mhs h LEU 799 N -0.25 0.93 0.20 -2.13 3.38 -1.36 -1.48 115.31 114.60 1mhs h LEU 799 Ca -0.48 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.37 1mhs h LEU 799 Cb 1.83 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 42.34 1mhs h LEU 799 CO -0.06 0.80 -0.10 1.56 0.09 0.00 0.00 178.44 180.73 1mhs h GLN 800 N 1.01 -0.26 -0.66 1.13 4.20 0.31 -1.81 115.11 119.03 1mhs h GLN 800 Ca 0.24 0.02 0.13 0.00 0.06 0.00 0.00 58.65 59.10 1mhs h GLN 800 Cb 0.13 0.06 -0.10 0.00 0.30 0.00 0.00 27.48 27.87 1mhs h GLN 800 CO -0.03 0.09 0.13 0.82 -0.67 0.00 0.00 178.83 179.17 1mhs h ILE 801 N -0.67 0.57 -0.84 2.54 1.08 -1.55 0.57 117.51 119.21 1mhs h ILE 801 Ca -0.03 -0.08 -0.03 0.00 -0.39 0.00 0.00 64.86 64.33 1mhs h ILE 801 Cb 0.47 0.30 -0.04 0.00 -3.07 0.00 0.00 36.82 34.49 1mhs h ILE 801 CO 0.05 0.04 0.41 0.28 -0.69 0.00 0.00 178.15 178.24 1mhs h SER 802 N 0.24 1.09 -0.05 1.72 0.02 -1.27 -2.61 113.55 112.69 1mhs h SER 802 Ca 0.36 -0.13 -0.06 0.00 -0.84 0.00 0.00 61.79 61.12 1mhs h SER 802 Cb 0.57 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.83 1mhs h SER 802 CO -0.47 0.91 -0.21 0.25 -1.14 0.00 0.00 176.83 176.17 1mhs h LEU 803 N 1.19 0.27 0.13 5.07 5.85 0.09 -3.14 115.31 124.76 1mhs h LEU 803 Ca 0.29 -0.64 -0.01 0.00 0.84 0.00 0.00 57.88 58.36 1mhs h LEU 803 Cb 0.10 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.05 1mhs h LEU 803 CO -0.04 0.87 -0.09 0.71 -0.34 0.00 0.00 178.44 179.55 1mhs h THR 804 N -0.31 0.00 -1.10 1.05 1.35 0.03 -1.46 112.91 112.47 1mhs h THR 804 Ca -0.01 0.00 0.39 0.00 -0.55 0.00 0.00 66.41 66.24 1mhs h THR 804 Cb 0.86 0.00 -0.12 0.00 -1.73 0.00 0.00 68.15 67.16 1mhs h THR 804 CO 0.04 0.00 0.69 -0.62 -0.25 0.00 0.00 175.52 175.39 1mhs n GLU 805 N -2.77 -0.03 -0.16 4.72 1.02 -0.99 0.72 120.64 123.14 1mhs n GLU 805 Ca -0.03 1.07 -0.04 0.00 -0.02 0.00 0.00 57.16 58.14 1mhs n GLU 805 Cb 0.09 -2.07 0.06 0.00 -0.02 0.00 0.00 31.44 29.50 1mhs n GLU 805 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1mhs h ASN 806 N 0.00 0.28 0.33 1.62 -0.26 -1.25 0.04 115.58 116.34 1mhs h ASN 806 Ca 0.73 0.04 -0.02 0.00 -0.56 0.00 0.00 56.30 56.50 1mhs h ASN 806 Cb 2.30 -0.00 0.00 0.00 -1.06 0.00 0.00 38.32 39.56 1mhs h ASN 806 CO -0.43 0.19 -0.16 -0.50 -1.06 0.00 0.00 177.43 175.47 1mhs h TRP 807 N 0.43 -0.41 -0.63 1.19 6.55 2.57 -3.01 115.95 122.65 1mhs h TRP 807 Ca 0.23 -0.01 0.09 0.00 0.95 0.00 0.00 58.89 60.15 1mhs h TRP 807 Cb 0.19 0.13 -0.07 0.00 -0.86 0.00 0.00 29.16 28.56 1mhs h TRP 807 CO -0.13 -0.19 0.27 1.25 -1.05 0.00 0.00 178.44 178.59 1mhs h LEU 808 N -0.53 0.33 -1.00 -4.49 5.85 -0.20 0.14 115.31 115.41 1mhs h LEU 808 Ca -0.04 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1mhs h LEU 808 Cb 0.39 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.44 1mhs h LEU 808 CO 0.07 0.20 0.00 0.00 -0.34 0.00 0.00 178.44 178.37 1mhs n ILE 809 N -4.93 1.31 0.89 4.05 3.06 -0.04 0.30 119.36 123.99 1mhs n ILE 809 Ca 0.09 0.65 0.11 0.00 -2.50 0.00 0.00 62.75 61.10 1mhs n ILE 809 Cb 0.25 -1.65 0.09 0.00 0.54 0.00 0.00 39.64 38.87 1mhs n ILE 809 CO 0.00 0.00 0.00 0.33 -2.50 0.00 0.00 176.55 174.38 1mhs n PHE 810 N -2.03 0.00 -0.03 9.51 7.35 0.48 -3.43 117.46 129.31 1mhs n PHE 810 Ca -0.01 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.80 1mhs n PHE 810 Cb 0.03 0.00 0.28 0.00 0.35 0.00 0.00 39.48 40.14 1mhs n PHE 810 CO 0.00 0.00 0.00 0.44 -0.76 0.00 0.00 176.76 176.44 1mhs n ILE 811 N 1.20 0.78 0.72 -2.13 -5.35 0.15 -3.94 119.36 110.79 1mhs n ILE 811 Ca 0.12 -0.87 0.07 0.00 -0.27 0.00 0.00 62.75 61.81 1mhs n ILE 811 Cb 0.54 0.64 -0.09 0.00 -1.74 0.00 0.00 39.64 38.99 1mhs n ILE 811 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1mhs n THR 812 N 1.52 0.00 -0.04 7.28 -2.24 -1.11 -4.89 114.28 114.80 1mhs n THR 812 Ca 0.22 -0.14 -0.01 0.00 -2.27 0.00 0.00 64.05 61.85 1mhs n THR 812 Cb 0.59 1.00 0.01 0.00 -2.10 0.00 0.00 70.33 69.83 1mhs n THR 812 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1mhs n ARG 813 N -1.36 -0.24 -1.35 -0.78 0.00 -1.25 -4.04 116.66 107.63 1mhs n ARG 813 Ca 0.03 -0.07 -0.53 0.00 -0.00 0.00 0.00 57.85 57.28 1mhs n ARG 813 Cb 0.24 -0.13 -0.08 0.00 0.00 0.00 0.00 32.46 32.49 1mhs n ARG 813 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1mhs n ALA 814 N -1.83 -0.95 0.26 5.13 0.00 -1.26 -4.65 120.51 117.21 1mhs n ALA 814 Ca -0.01 0.37 0.14 0.00 0.00 0.00 0.00 53.44 53.94 1mhs n ALA 814 Cb 0.03 -1.54 0.70 0.00 0.00 0.00 0.00 19.45 18.64 1mhs n ALA 814 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1mhs h ASN 815 N 4.32 0.00 0.00 0.00 -0.00 -1.80 -3.15 115.58 114.94 1mhs h ASN 815 Ca -0.32 0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 55.98 1mhs h ASN 815 Cb 1.09 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 39.41 1mhs h ASN 815 CO 0.79 0.11 -0.12 1.23 -0.00 0.00 0.00 177.43 179.44 1mhs h GLY 816 N 1.37 0.00 -1.90 1.57 0.00 -1.89 -3.46 103.07 98.75 1mhs h GLY 816 Ca -0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 1mhs h GLY 816 CO 0.01 0.00 0.44 2.56 0.00 0.00 0.00 176.54 179.55 1mhs s PRO 817 N -1.72 2.31 -0.12 4.80 0.04 -1.19 -4.81 135.00 134.31 1mhs s PRO 817 Ca -0.04 1.87 -0.00 0.00 0.04 0.00 0.00 61.00 62.87 1mhs s PRO 817 Cb 0.00 -1.84 0.02 0.00 0.04 0.00 0.00 34.50 32.73 1mhs s PRO 817 CO 0.07 -1.73 -0.08 -0.59 0.04 0.00 0.00 177.00 174.71 1mhs s PHE 818 N -1.76 1.55 0.00 0.56 -0.12 -1.26 -4.79 117.98 112.16 1mhs s PHE 818 Ca 0.77 -0.79 0.00 0.00 -0.05 0.00 0.00 56.93 56.87 1mhs s PHE 818 Cb -0.32 -1.27 0.00 0.00 -0.63 0.00 0.00 43.02 40.80 1mhs s PHE 818 CO 0.43 -0.53 0.00 1.87 -0.05 0.00 0.00 175.22 176.94 1mhs n TRP 819 N 4.93 0.00 -3.87 3.49 -0.00 -1.26 -4.87 117.44 115.86 1mhs n TRP 819 Ca -0.13 0.00 -0.24 0.00 -0.00 0.00 0.00 57.50 57.14 1mhs n TRP 819 Cb 0.50 -0.64 -0.17 0.00 -0.00 0.00 0.00 31.31 30.99 1mhs n TRP 819 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 177.69 176.15 1mhs s SER 820 N -1.89 1.66 0.27 5.87 1.04 -1.26 -5.06 113.70 114.33 1mhs s SER 820 Ca 0.00 -0.15 0.11 0.00 0.48 0.00 0.00 55.95 56.39 1mhs s SER 820 Cb 0.00 -0.55 -0.05 0.00 0.10 0.00 0.00 66.02 65.52 1mhs s SER 820 CO 0.00 -0.15 -0.13 -0.94 0.98 0.00 0.00 173.24 173.00 1mhs s SER 821 N 1.74 3.95 0.00 7.02 1.04 -1.26 -4.66 113.70 121.52 1mhs s SER 821 Ca 0.02 -0.87 0.00 0.00 0.48 0.00 0.00 55.95 55.59 1mhs s SER 821 Cb -0.13 -0.51 0.00 0.00 0.10 0.00 0.00 66.02 65.48 1mhs s SER 821 CO -0.05 0.03 0.00 -0.38 0.98 0.00 0.00 173.24 173.82 1mhs n ILE 822 N -0.65 0.00 0.00 -1.02 5.41 -1.26 -4.98 119.36 116.86 1mhs n ILE 822 Ca -0.06 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.69 1mhs n ILE 822 Cb 0.59 -0.48 0.00 0.00 -0.71 0.00 0.00 39.64 39.04 1mhs n ILE 822 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 1mhs n PRO 823 N -1.13 2.88 0.00 0.38 -0.04 -1.26 -4.59 135.00 131.25 1mhs n PRO 823 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1mhs n PRO 823 Cb 0.19 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.65 1mhs n PRO 823 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1mhs n SER 824 N 0.00 0.00 -0.03 3.54 3.41 -1.26 -4.32 113.62 114.96 1mhs n SER 824 Ca 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.48 1mhs n SER 824 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 1mhs n SER 824 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 1mhs h TRP 825 N 1.63 0.07 -0.69 7.33 2.91 -1.99 -1.25 115.95 123.96 1mhs h TRP 825 Ca 0.00 -0.02 0.04 0.00 1.13 0.00 0.00 58.89 60.04 1mhs h TRP 825 Cb 0.00 -0.01 -0.05 0.00 -0.51 0.00 0.00 29.16 28.59 1mhs h TRP 825 CO 0.00 0.60 0.42 0.37 -1.03 0.00 0.00 178.44 178.80 1mhs h GLN 826 N -0.48 0.77 -0.12 2.65 4.15 -1.97 0.98 115.11 121.10 1mhs h GLN 826 Ca 0.00 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 59.39 1mhs h GLN 826 Cb 0.60 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 1mhs h GLN 826 CO 0.01 0.51 0.04 1.25 -1.93 0.00 0.00 178.83 178.71 1mhs h LEU 827 N 0.80 0.04 -0.37 -2.39 7.12 -1.85 -1.16 115.31 117.49 1mhs h LEU 827 Ca 0.29 0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.32 1mhs h LEU 827 Cb 0.09 0.01 -0.02 0.00 -0.53 0.00 0.00 40.66 40.21 1mhs h LEU 827 CO -0.14 0.04 0.24 0.77 -0.13 0.00 0.00 178.44 179.23 1mhs h SER 828 N 0.10 0.43 -0.75 1.25 4.64 -0.64 -0.31 113.55 118.26 1mhs h SER 828 Ca 0.05 -0.02 0.14 0.00 -0.47 0.00 0.00 61.79 61.49 1mhs h SER 828 Cb 0.03 -0.11 -0.09 0.00 -0.31 0.00 0.00 62.40 61.92 1mhs h SER 828 CO -0.06 0.32 0.32 1.23 -0.87 0.00 0.00 176.83 177.78 1mhs h GLY 829 N 0.50 1.15 0.98 -0.77 0.00 -0.50 0.67 103.07 105.11 1mhs h GLY 829 Ca 0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 47.33 47.28 1mhs h GLY 829 CO -0.03 -0.08 0.25 0.00 0.00 0.00 0.00 176.54 176.69 1mhs h ALA 830 N 1.53 0.71 -0.01 3.60 0.00 -0.39 -1.55 119.26 123.16 1mhs h ALA 830 Ca 0.41 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.21 1mhs h ALA 830 Cb 0.60 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1mhs h ALA 830 CO -0.38 0.29 -0.21 0.82 0.00 0.00 0.00 179.25 179.76 1mhs h ILE 831 N 0.74 0.51 0.20 0.00 1.08 0.80 0.78 117.51 121.62 1mhs h ILE 831 Ca 0.19 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.65 1mhs h ILE 831 Cb 0.14 0.51 0.00 0.00 -3.07 0.00 0.00 36.82 34.39 1mhs h ILE 831 CO -0.02 0.00 -0.10 -0.26 -0.69 0.00 0.00 178.15 177.08 1mhs h PHE 832 N -0.33 -0.26 -0.30 1.37 0.04 -1.13 0.33 116.94 116.65 1mhs h PHE 832 Ca 0.06 -0.01 0.04 0.00 2.80 0.00 0.00 57.97 60.87 1mhs h PHE 832 Cb 0.41 0.09 -0.04 0.00 2.20 0.00 0.00 35.95 38.61 1mhs h PHE 832 CO -0.26 -0.16 0.07 1.25 -0.60 0.00 0.00 178.31 178.61 1mhs h LEU 833 N -0.28 0.02 -0.79 1.54 5.85 -0.98 0.39 115.31 121.07 1mhs h LEU 833 Ca -0.02 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.78 1mhs h LEU 833 Cb 0.22 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.26 1mhs h LEU 833 CO 0.04 0.05 0.49 0.58 -0.34 0.00 0.00 178.44 179.26 1mhs h VAL 834 N 0.18 1.09 -0.88 1.05 2.07 0.93 -0.62 116.25 120.07 1mhs h VAL 834 Ca 0.14 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1mhs h VAL 834 Cb 0.15 0.06 -0.04 0.00 -1.52 0.00 0.00 31.29 29.93 1mhs h VAL 834 CO -0.18 0.17 0.56 0.44 0.02 0.00 0.00 177.57 178.58 1mhs h ASP 835 N 0.95 1.03 -0.30 0.57 3.32 0.49 -2.44 116.42 120.05 1mhs h ASP 835 Ca 0.32 -0.04 0.03 0.00 0.02 0.00 0.00 57.03 57.36 1mhs h ASP 835 Cb 0.05 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.31 1mhs h ASP 835 CO -0.13 0.76 0.11 0.40 -1.72 0.00 0.00 179.24 178.67 1mhs h ILE 836 N 1.20 0.93 -0.71 0.35 1.08 0.62 -0.95 117.51 120.03 1mhs h ILE 836 Ca 0.32 -0.08 0.14 0.00 -0.39 0.00 0.00 64.86 64.84 1mhs h ILE 836 Cb -0.10 0.67 -0.10 0.00 -3.07 0.00 0.00 36.82 34.22 1mhs h ILE 836 CO -0.07 0.04 0.23 -0.07 -0.69 0.00 0.00 178.15 177.60 1mhs h LEU 837 N 0.25 0.15 -0.15 1.44 4.07 -0.94 -1.05 115.31 119.07 1mhs h LEU 837 Ca 0.13 0.12 0.00 0.00 0.08 0.00 0.00 57.88 58.21 1mhs h LEU 837 Cb 0.09 0.13 -0.01 0.00 1.08 0.00 0.00 40.66 41.95 1mhs h LEU 837 CO -0.13 0.05 0.09 0.00 -1.08 0.00 0.00 178.44 177.37 1mhs h ALA 838 N 1.54 0.19 0.14 1.53 0.00 -1.10 0.19 119.26 121.75 1mhs h ALA 838 Ca 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1mhs h ALA 838 Cb 0.60 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1mhs h ALA 838 CO -0.43 -0.34 -0.12 1.79 0.00 0.00 0.00 179.25 180.16 1mhs h THR 839 N 0.19 0.75 -0.76 0.00 1.35 -0.03 -0.45 112.91 113.95 1mhs h THR 839 Ca 0.06 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 65.92 1mhs h THR 839 Cb -0.01 0.75 -0.04 0.00 -1.73 0.00 0.00 68.15 67.11 1mhs h THR 839 CO -0.02 0.00 0.50 0.00 -0.25 0.00 0.00 175.52 175.75 1mhs h PHE 841 N 1.04 0.00 0.01 0.00 -1.00 -0.06 -2.71 116.94 114.21 1mhs h PHE 841 Ca 0.28 0.00 -0.39 0.00 2.81 0.00 0.00 57.97 60.67 1mhs h PHE 841 Cb -0.12 0.00 -0.07 0.00 3.61 0.00 0.00 35.95 39.38 1mhs h PHE 841 CO -0.02 0.00 -2.44 2.41 -1.61 0.00 0.00 178.31 176.65 1mhs n THR 842 N -4.10 1.51 0.00 -1.55 -1.04 -0.23 -4.56 114.28 104.31 1mhs n THR 842 Ca 0.02 -0.57 0.00 0.00 -2.04 0.00 0.00 64.05 61.46 1mhs n THR 842 Cb 0.31 -1.45 0.00 0.00 -1.82 0.00 0.00 70.33 67.37 1mhs n THR 842 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1mhs n ILE 843 N -3.29 0.00 -3.07 12.58 5.41 0.40 -3.71 119.36 127.68 1mhs n ILE 843 Ca -0.45 0.09 -0.40 0.00 1.00 0.00 0.00 62.75 62.99 1mhs n ILE 843 Cb 0.99 -0.93 -0.05 0.00 -0.71 0.00 0.00 39.64 38.94 1mhs n ILE 843 CO 0.00 0.00 0.00 0.26 0.00 0.00 0.00 176.55 176.81 1mhs s TRP 844 N 0.00 3.56 0.00 1.39 0.52 -1.20 0.13 118.94 123.33 1mhs s TRP 844 Ca 0.00 1.20 0.00 0.00 0.02 0.00 0.00 56.10 57.32 1mhs s TRP 844 Cb 0.00 -2.79 0.00 0.00 -1.15 0.00 0.00 33.47 29.53 1mhs s TRP 844 CO 0.00 0.07 0.00 0.41 0.02 0.00 0.00 176.95 177.45 1mhs n GLY 845 N 3.16 3.65 0.38 0.98 0.00 -1.26 -4.67 105.19 107.43 1mhs n GLY 845 Ca -0.02 -0.91 0.06 0.00 0.00 0.00 0.00 46.02 45.15 1mhs n GLY 845 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1mhs n TRP 846 N 0.00 0.34 0.18 1.61 7.02 -1.14 -4.79 117.44 120.65 1mhs n TRP 846 Ca 0.00 -0.73 0.19 0.00 -1.02 0.00 0.00 57.50 55.94 1mhs n TRP 846 Cb 0.00 -0.14 0.79 0.00 -2.42 0.00 0.00 31.31 29.54 1mhs n TRP 846 CO 0.00 0.00 0.00 0.35 -2.02 0.00 0.00 177.69 176.02 1mhs h PHE 847 N 0.90 0.00 -0.02 -5.99 3.57 0.95 -1.72 116.94 114.63 1mhs h PHE 847 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1mhs h PHE 847 Cb 0.92 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.66 1mhs h PHE 847 CO 0.17 0.00 -0.38 0.39 -2.23 0.00 0.00 178.31 176.26 1mhs n GLU 848 N -3.52 1.27 -0.05 1.11 1.02 -1.26 -4.33 120.64 114.88 1mhs n GLU 848 Ca 0.04 -1.01 0.05 0.00 -0.02 0.00 0.00 57.16 56.22 1mhs n GLU 848 Cb 0.49 -1.48 0.07 0.00 -0.02 0.00 0.00 31.44 30.50 1mhs n GLU 848 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1mhs n HIS 849 N 0.02 0.00 -3.15 -0.32 8.25 -0.65 -5.02 115.22 114.34 1mhs n HIS 849 Ca 0.10 -0.71 -0.39 0.00 -0.26 0.00 0.00 57.72 56.47 1mhs n HIS 849 Cb 0.46 -0.10 -0.05 0.00 1.12 0.00 0.00 29.99 31.42 1mhs n HIS 849 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1mhs s SER 850 N -1.88 6.82 0.00 0.41 1.04 -1.21 -4.39 113.70 114.49 1mhs s SER 850 Ca 0.16 0.99 0.00 0.00 0.48 0.00 0.00 55.95 57.57 1mhs s SER 850 Cb 0.14 -2.36 0.00 0.00 0.10 0.00 0.00 66.02 63.90 1mhs s SER 850 CO 0.01 -0.11 0.00 0.47 0.98 0.00 0.00 173.24 174.60 1mhs n ASP 851 N 3.99 1.77 0.03 7.02 9.92 -1.26 -4.79 116.55 133.23 1mhs n ASP 851 Ca -0.03 0.00 0.13 0.00 -0.53 0.00 0.00 54.79 54.36 1mhs n ASP 851 Cb 0.51 0.12 0.54 0.00 -0.64 0.00 0.00 41.12 41.65 1mhs n ASP 851 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 1mhs n THR 852 N -1.39 0.23 0.30 -3.53 -2.24 -1.26 -3.76 114.28 102.62 1mhs n THR 852 Ca 0.00 -0.05 0.16 0.00 -2.27 0.00 0.00 64.05 61.89 1mhs n THR 852 Cb 0.19 -0.56 0.64 0.00 -2.10 0.00 0.00 70.33 68.50 1mhs n THR 852 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1mhs h SER 853 N 0.00 0.00 0.00 3.42 4.64 -1.94 -0.25 113.55 119.42 1mhs h SER 853 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 1mhs h SER 853 Cb 0.54 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.62 1mhs h SER 853 CO 0.00 0.00 -0.63 0.40 -0.87 0.00 0.00 176.83 175.73 1mhs h ILE 854 N 0.00 0.49 0.00 0.95 2.04 -1.95 -3.38 117.51 115.66 1mhs h ILE 854 Ca 0.00 -1.53 0.00 0.00 1.00 0.00 0.00 64.86 64.33 1mhs h ILE 854 Cb 0.51 1.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1mhs h ILE 854 CO 0.00 0.16 0.00 1.33 0.00 0.00 0.00 178.15 179.64 1mhs n VAL 855 N -4.58 0.40 -0.03 1.67 0.24 -1.25 -4.31 118.33 110.47 1mhs n VAL 855 Ca -0.15 -0.64 -0.14 0.00 -2.04 0.00 0.00 64.34 61.37 1mhs n VAL 855 Cb 0.38 0.86 -0.14 0.00 -1.47 0.00 0.00 33.84 33.48 1mhs n VAL 855 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1mhs n ALA 856 N -0.20 1.27 -0.08 2.33 0.00 -0.20 -3.87 120.51 119.76 1mhs n ALA 856 Ca 0.00 -0.82 -0.13 0.00 0.00 0.00 0.00 53.44 52.50 1mhs n ALA 856 Cb 0.14 -0.62 -0.05 0.00 0.00 0.00 0.00 19.45 18.92 1mhs n ALA 856 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1mhs h VAL 857 N 0.03 1.31 -0.82 0.00 -1.51 -1.49 -2.94 116.25 110.83 1mhs h VAL 857 Ca -0.40 -1.24 0.00 0.00 -1.23 0.00 0.00 66.70 63.83 1mhs h VAL 857 Cb 2.04 1.63 -0.04 0.00 -2.13 0.00 0.00 31.29 32.79 1mhs h VAL 857 CO 0.06 0.38 0.53 0.58 -1.23 0.00 0.00 177.57 177.89 1mhs h VAL 858 N 0.20 1.22 -0.35 7.19 2.07 -1.75 -1.19 116.25 123.63 1mhs h VAL 858 Ca 0.05 -0.41 0.07 0.00 0.82 0.00 0.00 66.70 67.22 1mhs h VAL 858 Cb 0.66 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1mhs h VAL 858 CO 0.04 0.21 0.24 0.03 0.02 0.00 0.00 177.57 178.11 1mhs h ARG 859 N 1.11 0.18 0.23 1.57 3.08 -1.65 -1.20 114.38 117.70 1mhs h ARG 859 Ca 0.30 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.33 1mhs h ARG 859 Cb -0.11 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 29.91 1mhs h ARG 859 CO -0.06 0.12 -0.11 0.82 -1.07 0.00 0.00 179.97 179.66 1mhs h ILE 860 N 0.19 0.79 -0.42 2.04 2.04 -1.04 -2.12 117.51 118.99 1mhs h ILE 860 Ca 0.16 -0.11 0.02 0.00 1.00 0.00 0.00 64.86 65.93 1mhs h ILE 860 Cb 0.39 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 1mhs h ILE 860 CO -0.03 0.03 0.24 -0.50 0.00 0.00 0.00 178.15 177.89 1mhs h TRP 861 N -0.37 0.44 -0.07 1.37 4.06 -1.17 2.77 115.95 122.98 1mhs h TRP 861 Ca -0.03 0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.93 1mhs h TRP 861 Cb 0.28 -0.14 -0.00 0.00 -1.00 0.00 0.00 29.16 28.30 1mhs h TRP 861 CO -0.05 0.24 0.05 -0.84 -3.56 0.00 0.00 178.44 174.29 1mhs h ILE 862 N 0.47 1.02 -0.00 1.49 3.07 -1.16 -1.43 117.51 120.96 1mhs h ILE 862 Ca 0.17 -0.03 0.00 0.00 1.55 0.00 0.00 64.86 66.55 1mhs h ILE 862 Cb 0.04 0.92 0.00 0.00 -0.27 0.00 0.00 36.82 37.51 1mhs h ILE 862 CO -0.10 0.02 -0.61 0.49 -1.05 0.00 0.00 178.15 176.91 1mhs n PHE 863 N -4.53 0.00 1.49 0.16 3.01 -0.61 -4.16 117.46 112.82 1mhs n PHE 863 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 1mhs n PHE 863 Cb 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.56 1mhs n PHE 863 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1mhs n SER 864 N -1.07 0.00 -0.04 4.37 3.41 0.92 -3.15 113.62 118.06 1mhs n SER 864 Ca 0.04 -1.49 -0.07 0.00 -0.26 0.00 0.00 58.87 57.09 1mhs n SER 864 Cb 0.25 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.17 1mhs n SER 864 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1mhs n PHE 865 N -0.50 0.00 -0.13 7.33 7.35 -1.21 -4.60 117.46 125.70 1mhs n PHE 865 Ca 0.00 0.00 0.27 0.00 -0.76 0.00 0.00 57.45 56.96 1mhs n PHE 865 Cb 0.00 -0.29 0.60 0.00 0.35 0.00 0.00 39.48 40.14 1mhs n PHE 865 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 1mhs h GLY 866 N 0.28 0.00 1.09 7.13 0.00 -1.75 0.49 103.07 110.31 1mhs h GLY 866 Ca -0.18 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.01 1mhs h GLY 866 CO -0.06 0.00 -0.24 0.16 0.00 0.00 0.00 176.54 176.40 1mhs h ILE 867 N 0.00 1.27 -0.23 2.60 -0.00 -1.81 -0.64 117.51 118.69 1mhs h ILE 867 Ca 0.41 -1.40 -0.04 0.00 -0.00 0.00 0.00 64.86 63.83 1mhs h ILE 867 Cb 2.23 1.20 -0.01 0.00 -0.00 0.00 0.00 36.82 40.24 1mhs h ILE 867 CO -0.00 0.48 0.01 -0.26 -0.00 0.00 0.00 178.15 178.37 1mhs h PHE 868 N 0.80 0.44 -0.79 0.16 -1.00 -0.29 -2.86 116.94 113.41 1mhs h PHE 868 Ca 0.10 -0.07 -0.03 0.00 2.81 0.00 0.00 57.97 60.77 1mhs h PHE 868 Cb 0.82 -0.12 -0.04 0.00 3.61 0.00 0.00 35.95 40.23 1mhs h PHE 868 CO 0.06 0.57 0.37 0.00 -1.61 0.00 0.00 178.31 177.70 1mhs h ILE 870 N 1.12 0.99 -0.22 0.00 2.04 -1.01 -2.26 117.51 118.17 1mhs h ILE 870 Ca 0.27 -0.28 -0.05 0.00 1.00 0.00 0.00 64.86 65.80 1mhs h ILE 870 Cb 0.13 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.31 1mhs h ILE 870 CO -0.03 0.15 -0.07 0.24 0.00 0.00 0.00 178.15 178.44 1mhs h MET 871 N 0.81 0.43 -1.06 2.37 2.86 -1.23 -2.75 114.93 116.35 1mhs h MET 871 Ca 0.34 -0.17 0.29 0.00 -2.06 0.00 0.00 59.70 58.10 1mhs h MET 871 Cb 0.21 -0.02 -0.11 0.00 0.06 0.00 0.00 31.60 31.73 1mhs h MET 871 CO -0.19 0.68 0.66 0.78 1.06 0.00 0.00 176.91 179.91 1mhs h GLY 872 N 0.15 1.50 0.54 8.32 0.00 -0.67 0.41 103.07 113.32 1mhs h GLY 872 Ca 0.05 -0.22 -0.08 0.00 0.00 0.00 0.00 47.33 47.08 1mhs h GLY 872 CO 0.02 -0.24 -0.29 -1.33 0.00 0.00 0.00 176.54 174.71 1mhs h GLY 873 N 0.39 0.25 0.68 4.60 0.00 -1.36 -3.07 103.07 104.56 1mhs h GLY 873 Ca 0.65 -0.41 0.06 0.00 0.00 0.00 0.00 47.33 47.63 1mhs h GLY 873 CO -0.39 0.36 0.32 -2.08 0.00 0.00 0.00 176.54 174.75 1mhs h VAL 874 N -0.38 0.95 0.00 4.60 2.07 -0.53 -2.40 116.25 120.57 1mhs h VAL 874 Ca -0.03 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 1mhs h VAL 874 Cb 1.00 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1mhs h VAL 874 CO 0.06 0.11 -0.18 1.88 0.02 0.00 0.00 177.57 179.45 1mhs h TYR 875 N 0.61 0.00 0.00 1.57 -1.99 -0.37 -3.26 116.97 113.52 1mhs h TYR 875 Ca 0.27 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.00 1mhs h TYR 875 Cb 0.18 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.91 1mhs h TYR 875 CO -0.09 0.18 -0.66 -0.92 -0.00 0.00 0.00 178.16 176.67 1mhs h TYR 876 N 0.00 0.00 0.00 4.88 3.20 -1.33 -3.43 116.97 120.30 1mhs h TYR 876 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1mhs h TYR 876 Cb 0.36 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.63 1mhs h TYR 876 CO 0.00 0.00 0.00 -0.89 -1.64 0.00 0.00 178.16 175.63 1mhs n ILE 877 N -2.73 0.00 -3.89 1.81 5.41 -1.22 -5.06 119.36 113.68 1mhs n ILE 877 Ca 0.02 0.00 -0.17 0.00 1.00 0.00 0.00 62.75 63.59 1mhs n ILE 877 Cb 0.53 0.00 -0.16 0.00 -0.71 0.00 0.00 39.64 39.30 1mhs n ILE 877 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1mhs s LEU 878 N 0.00 1.06 0.26 1.39 1.43 -1.26 -5.16 118.68 116.39 1mhs s LEU 878 Ca 0.00 -0.02 -0.15 0.00 -1.03 0.00 0.00 54.13 52.94 1mhs s LEU 878 Cb 0.00 -0.22 -0.08 0.00 0.03 0.00 0.00 46.19 45.92 1mhs s LEU 878 CO 0.00 -0.12 0.66 -1.10 0.23 0.00 0.00 176.35 176.03 1mhs s GLN 879 N 1.15 4.00 -0.10 1.70 -0.21 -1.26 -5.08 119.66 119.86 1mhs s GLN 879 Ca -0.08 0.59 0.04 0.00 0.02 0.00 0.00 55.36 55.93 1mhs s GLN 879 Cb -0.13 -2.64 0.00 0.00 1.00 0.00 0.00 33.01 31.24 1mhs s GLN 879 CO -0.02 0.29 -0.22 -0.51 -2.12 0.00 0.00 175.29 172.70 1mhs s ASP 880 N -2.09 2.91 0.02 5.90 1.11 -1.26 -5.13 116.67 118.13 1mhs s ASP 880 Ca 0.48 -0.53 0.08 0.00 0.18 0.00 0.00 52.55 52.76 1mhs s ASP 880 Cb -0.12 -1.33 -0.02 0.00 1.07 0.00 0.00 42.92 42.51 1mhs s ASP 880 CO 0.19 0.13 -0.24 -0.94 1.18 0.00 0.00 175.17 175.50 1mhs s SER 881 N 0.43 2.86 -0.25 0.27 1.04 -1.26 -5.10 113.70 111.69 1mhs s SER 881 Ca -0.17 -0.51 -0.29 0.00 0.48 0.00 0.00 55.95 55.46 1mhs s SER 881 Cb -0.17 -0.28 -0.00 0.00 0.10 0.00 0.00 66.02 65.67 1mhs s SER 881 CO 0.07 0.25 1.25 -0.69 0.98 0.00 0.00 173.24 175.10 1mhs s VAL 882 N -0.70 4.26 0.00 5.02 1.01 -1.26 -4.81 120.40 123.91 1mhs s VAL 882 Ca 0.10 1.46 0.00 0.00 0.00 0.00 0.00 61.98 63.54 1mhs s VAL 882 Cb -0.09 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.15 1mhs s VAL 882 CO 0.01 -0.34 0.00 0.61 0.00 0.00 0.00 175.10 175.37 1mhs n GLY 883 N 3.98 0.00 0.09 4.51 0.00 -1.26 -0.96 105.19 111.54 1mhs n GLY 883 Ca 0.14 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.10 1mhs n GLY 883 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1mhs n PHE 884 N -0.11 0.42 -0.10 1.61 3.01 -1.26 -3.97 117.46 117.07 1mhs n PHE 884 Ca 0.00 0.15 -0.10 0.00 1.01 0.00 0.00 57.45 58.51 1mhs n PHE 884 Cb 0.00 -1.02 -0.03 0.00 -0.01 0.00 0.00 39.48 38.43 1mhs n PHE 884 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1mhs h ASP 885 N 0.00 0.44 0.39 4.37 5.19 -1.41 -2.82 116.42 122.58 1mhs h ASP 885 Ca -0.36 -0.22 -0.10 0.00 -0.62 0.00 0.00 57.03 55.73 1mhs h ASP 885 Cb 1.96 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 41.34 1mhs h ASP 885 CO 0.04 0.55 -0.45 0.78 -3.12 0.00 0.00 179.24 177.04 1mhs h ASN 886 N 0.32 0.08 -0.45 6.45 2.35 -1.80 -3.09 115.58 119.44 1mhs h ASN 886 Ca 0.09 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1mhs h ASN 886 Cb 0.27 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 1mhs h ASN 886 CO -0.00 0.52 0.29 -0.07 -1.65 0.00 0.00 177.43 176.53 1mhs h LEU 887 N 0.07 0.53 -2.00 1.61 3.38 -1.63 -0.94 115.31 116.33 1mhs h LEU 887 Ca 0.00 -0.03 0.13 0.00 0.09 0.00 0.00 57.88 58.07 1mhs h LEU 887 Cb 0.82 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 1mhs h LEU 887 CO 0.06 0.40 0.33 0.24 0.09 0.00 0.00 178.44 179.56 1mhs h MET 888 N 0.61 0.00 -0.33 1.13 2.86 -1.42 1.37 114.93 119.16 1mhs h MET 888 Ca 0.17 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.68 1mhs h MET 888 Cb -0.05 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 1mhs h MET 888 CO -0.03 0.00 -0.30 0.45 1.06 0.00 0.00 176.91 178.08 1mhs h HIS 889 N 0.00 0.80 -0.03 -0.22 3.86 -1.24 -0.96 115.15 117.36 1mhs h HIS 889 Ca 0.22 -0.20 0.01 0.00 -1.16 0.00 0.00 60.37 59.23 1mhs h HIS 889 Cb 0.87 -0.18 -0.00 0.00 1.06 0.00 0.00 27.41 29.15 1mhs h HIS 889 CO 0.00 0.91 0.05 0.78 0.86 0.00 0.00 177.93 180.53 1mhs h GLY 890 N 0.98 0.00 0.28 2.45 0.00 0.24 -1.82 103.07 105.20 1mhs h GLY 890 Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.18 1mhs h GLY 890 CO 0.07 0.00 -1.18 0.50 0.00 0.00 0.00 176.54 175.93 1mhs h LYS 891 N 0.00 0.12 -1.33 4.80 1.57 -0.89 -3.29 116.57 117.55 1mhs h LYS 891 Ca 0.02 -0.21 0.46 0.00 -1.87 0.00 0.00 60.65 59.05 1mhs h LYS 891 Cb 0.11 0.08 -0.14 0.00 0.08 0.00 0.00 32.23 32.37 1mhs h LYS 891 CO -0.00 1.10 0.85 0.43 -0.57 0.00 0.00 179.45 181.26 1mhs n SER 892 N -4.18 0.21 -4.67 0.86 7.64 -0.45 -4.08 113.62 108.95 1mhs n SER 892 Ca -0.26 1.35 -0.47 0.00 1.01 0.00 0.00 58.87 60.50 1mhs n SER 892 Cb 0.77 -0.66 -0.04 0.00 -1.01 0.00 0.00 64.21 63.26 1mhs n SER 892 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1mhs n PRO 893 N -4.66 2.30 0.00 1.43 -0.02 -1.13 -3.26 135.00 129.66 1mhs n PRO 893 Ca 0.39 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.71 1mhs n PRO 893 Cb 1.52 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 1mhs n PRO 893 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1mhs n LYS 894 N 6.89 0.00 0.00 -0.52 5.02 -1.26 -4.84 118.16 123.45 1mhs n LYS 894 Ca 0.22 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 1mhs n LYS 894 Cb 0.32 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.33 1mhs n LYS 894 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mhs n GLY 895 N -0.20 1.24 0.09 0.72 0.00 -1.26 -4.21 105.19 101.57 1mhs n GLY 895 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1mhs n GLY 895 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1mhs h ASN 896 N 0.00 0.23 -0.17 1.61 2.35 -1.87 0.21 115.58 117.94 1mhs h ASN 896 Ca 0.00 -0.98 -0.12 0.00 -0.55 0.00 0.00 56.30 54.66 1mhs h ASN 896 Cb 0.00 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.30 1mhs h ASN 896 CO 0.00 1.19 -0.35 1.56 -1.65 0.00 0.00 177.43 178.18 1mhs h GLN 897 N -0.70 0.53 -0.23 0.81 4.20 -1.82 -1.92 115.11 115.98 1mhs h GLN 897 Ca -0.07 -0.35 0.01 0.00 0.06 0.00 0.00 58.65 58.30 1mhs h GLN 897 Cb 1.31 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 29.12 1mhs h GLN 897 CO 0.07 0.96 0.13 0.87 -0.67 0.00 0.00 178.83 180.19 1mhs h LYS 898 N 0.17 0.26 -0.16 1.46 1.57 -1.84 0.77 116.57 118.80 1mhs h LYS 898 Ca 0.00 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1mhs h LYS 898 Cb 0.95 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 1mhs h LYS 898 CO 0.08 0.17 0.09 0.37 -0.57 0.00 0.00 179.45 179.59 1mhs h GLN 899 N 0.27 0.19 -0.27 3.15 4.15 -0.96 0.18 115.11 121.83 1mhs h GLN 899 Ca 0.09 -0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.53 1mhs h GLN 899 Cb 0.01 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.63 1mhs h GLN 899 CO -0.05 0.13 0.11 0.00 -1.93 0.00 0.00 178.83 177.08 1mhs h ARG 900 N 0.20 0.23 -0.29 1.69 3.08 -1.04 0.16 114.38 118.41 1mhs h ARG 900 Ca 0.06 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.12 1mhs h ARG 900 Cb -0.01 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1mhs h ARG 900 CO -0.03 0.15 0.14 0.66 -1.07 0.00 0.00 179.97 179.82 1mhs h SER 901 N 0.24 0.20 0.28 7.04 4.64 -0.53 0.10 113.55 125.52 1mhs h SER 901 Ca 0.12 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 1mhs h SER 901 Cb 0.07 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1mhs h SER 901 CO -0.11 0.15 -0.17 -0.07 -0.87 0.00 0.00 176.83 175.77 1mhs h LEU 902 N 0.29 -0.41 -0.56 5.97 3.38 -0.62 0.80 115.31 124.17 1mhs h LEU 902 Ca 0.12 0.02 0.11 0.00 0.09 0.00 0.00 57.88 58.22 1mhs h LEU 902 Cb 0.05 0.12 -0.11 0.00 0.09 0.00 0.00 40.66 40.81 1mhs h LEU 902 CO -0.09 -0.27 -0.14 -0.33 0.09 0.00 0.00 178.44 177.70 1mhs h GLU 903 N -0.43 -0.01 0.11 1.13 5.08 -0.45 -0.91 114.58 119.12 1mhs h GLU 903 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1mhs h GLU 903 Cb 0.35 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1mhs h GLU 903 CO 0.04 -0.00 -0.12 -0.44 -1.00 0.00 0.00 179.01 177.49 1mhs h ASP 904 N -0.01 -0.31 0.00 1.42 5.19 -0.17 1.58 116.42 124.12 1mhs h ASP 904 Ca 0.27 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.71 1mhs h ASP 904 Cb 0.41 0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.03 1mhs h ASP 904 CO -0.58 -0.18 0.00 0.49 -3.12 0.00 0.00 179.24 175.86 1mhs n PHE 905 N -5.24 0.00 -0.21 4.55 0.99 0.27 0.29 117.46 118.12 1mhs n PHE 905 Ca -0.07 0.00 0.02 0.00 -0.00 0.00 0.00 57.45 57.39 1mhs n PHE 905 Cb 0.16 -0.20 0.12 0.00 -1.00 0.00 0.00 39.48 38.56 1mhs n PHE 905 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 1mhs h VAL 906 N 0.00 0.59 -0.02 -4.37 2.07 -1.34 3.51 116.25 116.69 1mhs h VAL 906 Ca 0.00 -0.08 0.01 0.00 0.82 0.00 0.00 66.70 67.44 1mhs h VAL 906 Cb 0.00 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 30.10 1mhs h VAL 906 CO 0.00 0.04 0.32 0.58 0.02 0.00 0.00 177.57 178.53 1mhs h VAL 907 N 0.24 0.02 0.25 2.57 2.07 0.35 0.17 116.25 121.91 1mhs h VAL 907 Ca 0.33 0.00 -0.34 0.00 0.82 0.00 0.00 66.70 67.52 1mhs h VAL 907 Cb 0.52 0.69 0.03 0.00 -1.52 0.00 0.00 31.29 31.01 1mhs h VAL 907 CO -0.44 0.00 -1.52 0.28 0.02 0.00 0.00 177.57 175.91 1mhs h SER 908 N 0.00 0.82 -0.92 0.57 0.02 2.46 -3.26 113.55 113.23 1mhs h SER 908 Ca 0.01 -0.92 0.01 0.00 -0.84 0.00 0.00 61.79 60.05 1mhs h SER 908 Cb 0.65 -0.27 -0.05 0.00 0.14 0.00 0.00 62.40 62.87 1mhs h SER 908 CO -0.00 1.73 0.61 -0.07 -1.14 0.00 0.00 176.83 177.96 1mhs h LEU 909 N 0.13 1.05 -1.09 5.07 3.38 0.34 -2.41 115.31 121.78 1mhs h LEU 909 Ca -0.27 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1mhs h LEU 909 Cb 2.16 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 42.64 1mhs h LEU 909 CO 0.26 0.76 0.00 1.56 0.09 0.00 0.00 178.44 181.11 1mhs h GLN 910 N 1.24 0.00 0.00 1.13 4.20 -1.36 -1.82 115.11 118.50 1mhs h GLN 910 Ca 0.34 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.05 1mhs h GLN 910 Cb -0.14 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.64 1mhs h GLN 910 CO -0.07 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.09 1mhs h ARG 911 N 0.00 0.00 -0.38 1.46 3.08 -1.50 -3.37 114.38 113.67 1mhs h ARG 911 Ca 0.00 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.77 1mhs h ARG 911 Cb 0.23 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 30.09 1mhs h ARG 911 CO 0.00 0.00 -0.59 0.28 -1.07 0.00 0.00 179.97 178.59 1mhs n VAL 912 N -2.91 -0.07 -0.07 2.04 0.31 -0.71 -5.02 118.33 111.90 1mhs n VAL 912 Ca 0.02 -2.03 -0.08 0.00 -0.01 0.00 0.00 64.34 62.24 1mhs n VAL 912 Cb 0.37 1.04 -0.01 0.00 -0.91 0.00 0.00 33.84 34.33 1mhs n VAL 912 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1mhs h SER 913 N 3.41 0.06 -0.30 4.52 0.02 -1.65 -3.15 113.55 116.46 1mhs h SER 913 Ca -0.08 0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 60.87 1mhs h SER 913 Cb 1.05 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.61 1mhs h SER 913 CO 0.26 0.07 0.06 0.74 -1.14 0.00 0.00 176.83 176.82 1mhs h THR 914 N 0.18 1.22 -0.20 -2.27 2.02 -1.91 -2.36 112.91 109.60 1mhs h THR 914 Ca 0.12 -0.75 0.04 0.00 0.77 0.00 0.00 66.41 66.59 1mhs h THR 914 Cb 0.10 1.15 -0.07 0.00 -1.74 0.00 0.00 68.15 67.59 1mhs h THR 914 CO -0.14 0.25 -0.49 -0.61 0.37 0.00 0.00 175.52 174.90 1mhs h GLN 915 N 0.32 -0.48 -0.49 6.66 4.15 -1.95 0.71 115.11 124.02 1mhs h GLN 915 Ca 0.09 0.03 0.09 0.00 0.77 0.00 0.00 58.65 59.64 1mhs h GLN 915 Cb 0.31 0.11 -0.10 0.00 0.21 0.00 0.00 27.48 28.01 1mhs h GLN 915 CO 0.00 -0.32 -0.31 0.45 -1.93 0.00 0.00 178.83 176.72 1mhs h HIS 916 N -0.50 -0.86 -0.18 3.99 3.86 -1.51 0.37 115.15 120.31 1mhs h HIS 916 Ca 0.07 0.06 0.04 0.00 -1.16 0.00 0.00 60.37 59.38 1mhs h HIS 916 Cb 0.65 0.45 -0.04 0.00 1.06 0.00 0.00 27.41 29.53 1mhs h HIS 916 CO -0.58 -0.37 -0.05 0.93 0.86 0.00 0.00 177.93 178.72 1mhs h GLU 917 N -0.19 -0.01 -0.33 2.45 5.08 -0.82 0.20 114.58 120.96 1mhs h GLU 917 Ca 0.21 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.61 1mhs h GLU 917 Cb 0.53 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.75 1mhs h GLU 917 CO -0.60 -0.01 0.10 -0.22 -1.00 0.00 0.00 179.01 177.28 1mhs h LYS 918 N -0.01 0.22 -0.06 2.33 3.64 0.35 -2.46 116.57 120.58 1mhs h LYS 918 Ca 0.09 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1mhs h LYS 918 Cb 0.14 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 1mhs h LYS 918 CO -0.19 0.15 -0.03 0.77 -2.27 0.00 0.00 179.45 177.88 1mhs h SER 919 N 0.23 -0.09 0.00 4.20 0.02 0.20 -3.51 113.55 114.59 1mhs h SER 919 Ca 0.15 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 1mhs h SER 919 Cb 0.14 0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.73 1mhs h SER 919 CO -0.17 -0.04 0.00 0.00 -1.14 0.00 0.00 176.83 175.48