#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x1b n ASN 3 N 0.00 1.56 -0.05 -3.46 2.85 -1.26 -2.90 115.26 112.00 1x1b n ASN 3 Ca 0.00 -1.41 0.01 0.00 -0.11 0.00 0.00 54.58 53.07 1x1b n ASN 3 Cb 0.00 0.05 -0.16 0.00 1.24 0.00 0.00 39.78 40.91 1x1b n ASN 3 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1x1b n ASN 4 N 0.09 0.18 -0.19 1.20 5.15 -1.26 -3.01 115.26 117.42 1x1b n ASN 4 Ca 0.17 0.00 -0.10 0.00 -0.60 0.00 0.00 54.58 54.05 1x1b n ASN 4 Cb 0.38 1.48 0.01 0.00 -0.53 0.00 0.00 39.78 41.12 1x1b n ASN 4 CO 0.00 0.00 0.00 0.44 1.40 0.00 0.00 177.26 179.10 1x1b h ASP 5 N 0.00 0.99 -0.23 1.20 5.19 -1.97 -1.85 116.42 119.76 1x1b h ASP 5 Ca -0.26 -0.33 -0.17 0.00 -0.62 0.00 0.00 57.03 55.65 1x1b h ASP 5 Cb 1.58 -0.27 -0.00 0.00 0.18 0.00 0.00 39.33 40.81 1x1b h ASP 5 CO 0.01 1.09 -0.48 -0.07 -3.12 0.00 0.00 179.24 176.68 1x1b h LEU 6 N 0.88 0.87 0.00 1.55 3.38 -1.66 -2.01 115.31 118.32 1x1b h LEU 6 Ca 0.15 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1x1b h LEU 6 Cb 0.61 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1x1b h LEU 6 CO 0.04 1.20 0.00 -0.11 0.09 0.00 0.00 178.44 179.66 1x1b n LEU 7 N -4.02 0.00 -0.08 1.67 7.94 -1.04 -0.64 117.00 120.84 1x1b n LEU 7 Ca -0.03 0.33 -0.22 0.00 -1.11 0.00 0.00 56.01 54.98 1x1b n LEU 7 Cb 0.58 -0.33 -0.12 0.00 0.53 0.00 0.00 43.42 44.08 1x1b n LEU 7 CO 0.48 -0.18 -0.63 0.59 -1.11 0.00 0.00 177.39 176.55 1x1b n ASN 8 N -1.33 1.93 0.02 1.96 3.02 -0.72 -2.87 115.26 117.28 1x1b n ASN 8 Ca 0.06 0.36 -0.10 0.00 -0.03 0.00 0.00 54.58 54.87 1x1b n ASN 8 Cb 0.12 -0.94 -0.04 0.00 -0.61 0.00 0.00 39.78 38.32 1x1b n ASN 8 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 1x1b h TYR 9 N -0.72 -0.55 -0.28 3.10 0.99 -0.75 0.29 116.97 119.04 1x1b h TYR 9 Ca -0.38 0.02 0.07 0.00 2.00 0.00 0.00 58.73 60.44 1x1b h TYR 9 Cb 1.51 0.25 -0.08 0.00 1.00 0.00 0.00 36.73 39.41 1x1b h TYR 9 CO 0.09 -0.29 -0.31 -0.92 -0.00 0.00 0.00 178.16 176.73 1x1b h TYR 10 N -0.29 -0.85 -0.80 4.88 3.20 -1.05 0.21 116.97 122.28 1x1b h TYR 10 Ca 0.08 0.05 0.03 0.00 3.14 0.00 0.00 58.73 62.03 1x1b h TYR 10 Cb 0.41 0.41 -0.04 0.00 1.54 0.00 0.00 36.73 39.05 1x1b h TYR 10 CO -0.29 -0.38 0.53 0.45 -1.64 0.00 0.00 178.16 176.83 1x1b h HIS 11 N -0.30 0.97 -0.00 -3.82 3.86 -1.04 -1.90 115.15 112.92 1x1b h HIS 11 Ca 0.14 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.37 1x1b h HIS 11 Cb 0.53 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.67 1x1b h HIS 11 CO -0.47 0.58 -0.01 -0.09 0.86 0.00 0.00 177.93 178.80 1x1b h ARG 12 N 1.01 0.01 -0.74 2.45 9.65 0.49 -2.25 114.38 125.00 1x1b h ARG 12 Ca 0.31 -0.01 0.13 0.00 -1.10 0.00 0.00 59.98 59.31 1x1b h ARG 12 Cb -0.01 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 28.52 1x1b h ARG 12 CO -0.08 0.59 0.49 0.00 2.80 0.00 0.00 179.97 183.77 1x1b h ALA 13 N 0.42 2.04 0.01 2.80 0.00 -0.42 0.10 119.26 124.21 1x1b h ALA 13 Ca 0.00 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 1x1b h ALA 13 Cb 0.59 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1x1b h ALA 13 CO 0.00 -0.23 -0.90 -0.91 0.00 0.00 0.00 179.25 177.21 1x1b h ASN 14 N 0.46 0.09 -0.42 0.00 -0.26 -1.30 -2.36 115.58 111.80 1x1b h ASN 14 Ca 0.36 -0.08 -0.04 0.00 -0.56 0.00 0.00 56.30 55.98 1x1b h ASN 14 Cb 0.74 -0.03 -0.02 0.00 -1.06 0.00 0.00 38.32 37.96 1x1b h ASN 14 CO -0.12 0.94 0.12 -0.08 -1.06 0.00 0.00 177.43 177.24 1x1b h GLU 15 N 0.03 0.65 0.41 0.81 4.81 -0.21 0.23 114.58 121.31 1x1b h GLU 15 Ca -0.03 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.04 1x1b h GLU 15 Cb 1.57 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.87 1x1b h GLU 15 CO 0.12 0.65 -0.20 -0.07 -0.73 0.00 0.00 179.01 178.79 1x1b h LEU 16 N 0.53 -0.46 -0.19 1.64 4.07 -1.30 -2.43 115.31 117.16 1x1b h LEU 16 Ca 0.13 -0.02 -0.21 0.00 0.08 0.00 0.00 57.88 57.86 1x1b h LEU 16 Cb 0.28 0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.12 1x1b h LEU 16 CO -0.00 -0.28 -0.94 0.58 -1.08 0.00 0.00 178.44 176.72 1x1b h VAL 17 N -0.62 1.54 0.00 1.22 2.07 -1.37 -3.40 116.25 115.70 1x1b h VAL 17 Ca -0.06 -2.81 -0.12 0.00 0.82 0.00 0.00 66.70 64.53 1x1b h VAL 17 Cb 0.46 2.59 -0.02 0.00 -1.52 0.00 0.00 31.29 32.80 1x1b h VAL 17 CO 0.09 0.82 -1.38 0.49 0.02 0.00 0.00 177.57 177.61 1x1b n PHE 18 N -3.59 0.00 0.25 1.57 3.01 0.80 -4.65 117.46 114.85 1x1b n PHE 18 Ca -0.03 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.27 1x1b n PHE 18 Cb 0.85 -0.27 -0.08 0.00 -0.01 0.00 0.00 39.48 39.97 1x1b n PHE 18 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1x1b h LYS 19 N -0.28 -0.58 -0.58 -1.08 3.64 -1.47 0.90 116.57 117.11 1x1b h LYS 19 Ca -0.19 0.04 0.11 0.00 -1.27 0.00 0.00 60.65 59.34 1x1b h LYS 19 Cb 1.13 0.13 -0.09 0.00 -0.41 0.00 0.00 32.23 32.99 1x1b h LYS 19 CO -0.11 -0.33 0.10 0.78 -2.27 0.00 0.00 179.45 177.62 1x1b h GLY 20 N -0.72 0.72 0.73 5.01 0.00 -1.64 -0.82 103.07 106.35 1x1b h GLY 20 Ca -0.06 -0.01 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 1x1b h GLY 20 CO 0.10 -0.12 -0.24 -2.00 0.00 0.00 0.00 176.54 174.28 1x1b h LEU 21 N 0.23 -0.57 -0.73 3.11 5.85 -1.76 -2.20 115.31 119.24 1x1b h LEU 21 Ca 0.31 -0.07 0.04 0.00 0.84 0.00 0.00 57.88 59.00 1x1b h LEU 21 Cb 0.46 0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.58 1x1b h LEU 21 CO -0.41 -0.22 0.45 0.40 -0.34 0.00 0.00 178.44 178.32 1x1b h ILE 22 N -0.94 1.05 -0.48 4.05 2.04 -0.70 0.12 117.51 122.65 1x1b h ILE 22 Ca -0.07 -0.29 -0.11 0.00 1.00 0.00 0.00 64.86 65.39 1x1b h ILE 22 Cb 0.60 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 1x1b h ILE 22 CO 0.11 0.15 -0.13 -0.33 0.00 0.00 0.00 178.15 177.96 1x1b h GLU 23 N 0.85 0.94 -0.12 2.37 5.08 -1.22 -0.58 114.58 121.88 1x1b h GLU 23 Ca 0.31 -0.36 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1x1b h GLU 23 Cb 0.10 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 1x1b h GLU 23 CO -0.14 1.02 -0.03 0.35 -1.00 0.00 0.00 179.01 179.21 1x1b h PHE 24 N 0.79 0.27 -0.58 4.33 3.04 -1.09 -1.12 116.94 122.58 1x1b h PHE 24 Ca 0.12 -0.06 0.10 0.00 3.98 0.00 0.00 57.97 62.11 1x1b h PHE 24 Cb 0.68 -0.07 -0.07 0.00 2.56 0.00 0.00 35.95 39.05 1x1b h PHE 24 CO 0.05 0.54 0.17 0.77 -2.02 0.00 0.00 178.31 177.82 1x1b h SER 25 N -0.07 0.12 -0.08 0.41 0.02 -0.72 1.01 113.55 114.24 1x1b h SER 25 Ca 0.03 0.09 -0.13 0.00 -0.84 0.00 0.00 61.79 60.94 1x1b h SER 25 Cb 0.45 0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.08 1x1b h SER 25 CO 0.01 0.08 -0.37 0.00 -1.14 0.00 0.00 176.83 175.41 1x1b h MET 27 N 0.49 0.82 -0.45 0.00 2.86 0.02 -1.39 114.93 117.28 1x1b h MET 27 Ca 0.05 -0.35 -0.02 0.00 -2.06 0.00 0.00 59.70 57.32 1x1b h MET 27 Cb 0.86 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.48 1x1b h MET 27 CO 0.07 0.98 0.22 -0.22 1.06 0.00 0.00 176.91 179.03 1x1b h LYS 28 N 0.62 0.64 -0.92 1.72 3.64 0.13 -0.10 116.57 122.30 1x1b h LYS 28 Ca 0.09 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1x1b h LYS 28 Cb 0.74 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.39 1x1b h LYS 28 CO 0.06 0.54 0.56 0.00 -2.27 0.00 0.00 179.45 178.34 1x1b h ALA 29 N 1.06 1.26 -0.36 5.00 0.00 -0.19 -1.18 119.26 124.85 1x1b h ALA 29 Ca 0.15 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 1x1b h ALA 29 Cb 0.11 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1x1b h ALA 29 CO -0.02 0.64 -0.33 0.00 0.00 0.00 0.00 179.25 179.54 1x1b h ALA 30 N 1.36 0.53 0.08 0.00 0.00 -0.95 0.86 119.26 121.13 1x1b h ALA 30 Ca 0.33 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.82 1x1b h ALA 30 Cb -0.07 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1x1b h ALA 30 CO -0.06 0.59 -0.10 0.82 0.00 0.00 0.00 179.25 180.49 1x1b h ILE 31 N 0.66 0.76 -0.18 0.00 1.08 -0.60 0.29 117.51 119.52 1x1b h ILE 31 Ca 0.06 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.48 1x1b h ILE 31 Cb 0.92 0.76 -0.01 0.00 -3.07 0.00 0.00 36.82 35.42 1x1b h ILE 31 CO 0.08 0.00 -0.12 -0.33 -0.69 0.00 0.00 178.15 177.09 1x1b h GLU 32 N -0.21 0.29 0.00 2.37 5.08 -1.12 -0.82 114.58 120.18 1x1b h GLU 32 Ca 0.01 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1x1b h GLU 32 Cb 0.22 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1x1b h GLU 32 CO -0.05 0.42 0.00 1.28 -1.00 0.00 0.00 179.01 179.67 1x1b n LEU 33 N -4.26 0.17 -0.53 1.33 4.32 0.28 -4.86 117.00 113.45 1x1b n LEU 33 Ca -0.00 0.52 -0.07 0.00 -0.02 0.00 0.00 56.01 56.44 1x1b n LEU 33 Cb 0.28 -0.47 -0.03 0.00 -1.62 0.00 0.00 43.42 41.58 1x1b n LEU 33 CO 0.38 -0.07 -0.07 -0.67 -1.22 0.00 0.00 177.39 175.75 1x1b n ASP 34 N -1.66 -4.03 -0.14 -1.43 2.03 -0.27 -4.72 116.55 106.34 1x1b n ASP 34 Ca 0.06 0.17 -0.08 0.00 0.52 0.00 0.00 54.79 55.47 1x1b n ASP 34 Cb 0.34 -2.14 -0.06 0.00 -0.72 0.00 0.00 41.12 38.54 1x1b n ASP 34 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1x1b h LEU 35 N 0.00 -1.17 -1.60 -2.67 6.46 -1.24 -1.51 115.31 113.59 1x1b h LEU 35 Ca -0.14 0.16 0.22 0.00 -0.12 0.00 0.00 57.88 58.00 1x1b h LEU 35 Cb 0.52 0.49 -0.06 0.00 -0.73 0.00 0.00 40.66 40.88 1x1b h LEU 35 CO 0.21 -0.21 0.62 -0.26 -0.62 0.00 0.00 178.44 178.18 1x1b h PHE 36 N -0.16 0.44 -0.59 1.25 0.04 -1.88 0.25 116.94 116.28 1x1b h PHE 36 Ca 0.06 0.01 -0.10 0.00 2.80 0.00 0.00 57.97 60.74 1x1b h PHE 36 Cb 0.32 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.31 1x1b h PHE 36 CO -0.78 0.10 -0.02 1.03 -0.60 0.00 0.00 178.31 178.04 1x1b h SER 37 N 0.32 1.04 0.14 2.17 0.87 -1.57 0.20 113.55 116.71 1x1b h SER 37 Ca 0.48 -0.30 -0.19 0.00 -1.23 0.00 0.00 61.79 60.55 1x1b h SER 37 Cb 1.33 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 63.01 1x1b h SER 37 CO -0.15 1.10 -0.70 0.45 -0.53 0.00 0.00 176.83 177.00 1x1b h HIS 38 N 0.96 0.67 0.00 2.24 3.86 -0.23 -3.02 115.15 119.63 1x1b h HIS 38 Ca 0.17 -0.28 0.00 0.00 -1.16 0.00 0.00 60.37 59.09 1x1b h HIS 38 Cb 0.58 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 28.94 1x1b h HIS 38 CO 0.04 1.04 0.00 0.52 0.86 0.00 0.00 177.93 180.39 1x1b h MET 39 N 0.35 0.00 -0.21 2.45 2.07 -1.09 -3.02 114.93 115.49 1x1b h MET 39 Ca -0.03 0.00 0.06 0.00 -2.07 0.00 0.00 59.70 57.66 1x1b h MET 39 Cb 1.27 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 31.00 1x1b h MET 39 CO 0.13 0.00 0.16 0.00 1.07 0.00 0.00 176.91 178.26 1x1b h ALA 40 N 2.15 2.14 0.21 6.32 0.00 -0.46 -2.61 119.26 127.00 1x1b h ALA 40 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1x1b h ALA 40 Cb 0.82 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1x1b h ALA 40 CO 0.00 -0.26 -0.12 0.93 0.00 0.00 0.00 179.25 179.80 1x1b h GLU 41 N 0.00 -0.29 0.00 0.00 4.39 -1.64 -3.49 114.58 113.56 1x1b h GLU 41 Ca 0.10 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.82 1x1b h GLU 41 Cb 0.41 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 1x1b h GLU 41 CO -0.00 -0.19 0.00 0.41 -1.16 0.00 0.00 179.01 178.07 1x1b n GLY 42 N -1.15 1.30 2.52 -3.84 0.00 -0.99 -5.13 105.19 97.91 1x1b n GLY 42 Ca -0.04 -0.73 -0.40 0.00 0.00 0.00 0.00 46.02 44.86 1x1b n GLY 42 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1x1b n PRO 43 N -0.28 0.00 -4.06 1.61 -0.02 -1.25 -4.85 135.00 126.15 1x1b n PRO 43 Ca 0.00 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.40 1x1b n PRO 43 Cb 0.00 -0.97 -0.10 0.00 -0.02 0.00 0.00 33.50 32.41 1x1b n PRO 43 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1x1b s LYS 44 N -0.24 0.53 0.42 -0.52 1.02 -0.43 -4.86 119.74 115.65 1x1b s LYS 44 Ca 0.60 -1.01 -0.06 0.00 0.02 0.00 0.00 55.97 55.52 1x1b s LYS 44 Cb -0.84 0.11 -0.05 0.00 -0.52 0.00 0.00 37.83 36.53 1x1b s LYS 44 CO 0.41 -0.07 0.72 0.16 -0.92 0.00 0.00 175.35 175.65 1x1b s ASP 45 N -2.39 6.37 0.18 2.83 1.47 -1.26 0.75 116.67 124.63 1x1b s ASP 45 Ca -0.01 0.91 -0.27 0.00 1.18 0.00 0.00 52.55 54.37 1x1b s ASP 45 Cb 0.01 -2.23 0.02 0.00 -0.34 0.00 0.00 42.92 40.38 1x1b s ASP 45 CO -0.06 -0.44 1.55 0.25 0.68 0.00 0.00 175.17 177.15 1x1b h LEU 46 N 0.82 -1.91 -0.98 2.11 6.46 -1.98 0.18 115.31 120.01 1x1b h LEU 46 Ca -0.47 0.32 0.30 0.00 -0.12 0.00 0.00 57.88 57.90 1x1b h LEU 46 Cb 1.20 0.88 -0.15 0.00 -0.73 0.00 0.00 40.66 41.86 1x1b h LEU 46 CO 0.63 -0.26 0.51 0.00 -0.62 0.00 0.00 178.44 178.70 1x1b h ALA 47 N 0.73 1.81 0.04 1.25 0.00 -1.95 0.22 119.26 121.36 1x1b h ALA 47 Ca 0.21 0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.31 1x1b h ALA 47 Cb 0.48 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1x1b h ALA 47 CO -0.92 -0.52 -0.02 1.15 0.00 0.00 0.00 179.25 178.94 1x1b h THR 48 N 0.33 1.32 -0.79 0.00 2.02 -1.04 -1.97 112.91 112.78 1x1b h THR 48 Ca 0.69 -1.26 0.04 0.00 0.77 0.00 0.00 66.41 66.66 1x1b h THR 48 Cb 1.52 2.15 -0.05 0.00 -1.74 0.00 0.00 68.15 70.03 1x1b h THR 48 CO -0.60 0.31 0.50 -0.07 0.37 0.00 0.00 175.52 176.03 1x1b h LEU 49 N -0.62 0.80 -1.70 2.58 3.38 -0.51 0.84 115.31 120.09 1x1b h LEU 49 Ca -0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1x1b h LEU 49 Cb 0.55 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1x1b h LEU 49 CO 0.01 0.54 -0.18 0.00 0.09 0.00 0.00 178.44 178.90 1x1b h ALA 50 N 1.35 1.49 0.19 1.53 0.00 -0.62 0.38 119.26 123.57 1x1b h ALA 50 Ca 0.33 -0.17 -0.31 0.00 0.00 0.00 0.00 54.91 54.76 1x1b h ALA 50 Cb 0.07 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 17.85 1x1b h ALA 50 CO -0.13 0.23 -1.36 0.00 0.00 0.00 0.00 179.25 177.99 1x1b h ALA 51 N 1.82 -0.04 -0.70 0.00 0.00 -0.32 -1.84 119.26 118.17 1x1b h ALA 51 Ca -0.00 -0.85 -0.05 0.00 0.00 0.00 0.00 54.91 54.01 1x1b h ALA 51 Cb 0.37 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1x1b h ALA 51 CO 0.02 0.77 0.23 -0.44 0.00 0.00 0.00 179.25 179.84 1x1b h ASP 52 N 0.15 1.01 0.26 0.00 3.45 -0.25 -3.17 116.42 117.87 1x1b h ASP 52 Ca -0.20 -0.20 0.00 0.00 0.43 0.00 0.00 57.03 57.05 1x1b h ASP 52 Cb 2.05 -0.26 0.00 0.00 -0.56 0.00 0.00 39.33 40.56 1x1b h ASP 52 CO 0.25 0.94 -0.36 0.35 -1.57 0.00 0.00 179.24 178.85 1x1b n THR 53 N -4.32 0.00 -2.94 0.35 -2.24 0.06 -4.95 114.28 100.25 1x1b n THR 53 Ca 0.05 -0.11 -0.17 0.00 -2.27 0.00 0.00 64.05 61.55 1x1b n THR 53 Cb 0.21 0.48 0.03 0.00 -2.10 0.00 0.00 70.33 68.96 1x1b n THR 53 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x1b n GLY 54 N 1.39 -0.19 3.87 3.38 0.00 -0.94 -4.99 105.19 107.71 1x1b n GLY 54 Ca 0.10 -0.08 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 1x1b n GLY 54 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x1b s SER 55 N -2.90 4.55 -0.19 1.61 1.04 -0.74 -5.06 113.70 112.02 1x1b s SER 55 Ca 0.28 -1.29 -0.15 0.00 0.48 0.00 0.00 55.95 55.27 1x1b s SER 55 Cb -0.12 0.35 -0.04 0.00 0.10 0.00 0.00 66.02 66.31 1x1b s SER 55 CO 0.34 -1.02 0.38 0.68 0.98 0.00 0.00 173.24 174.60 1x1b s VAL 56 N -2.77 5.22 0.17 5.02 -7.23 -1.26 -4.68 120.40 114.88 1x1b s VAL 56 Ca 0.30 0.67 -0.26 0.00 -1.81 0.00 0.00 61.98 60.89 1x1b s VAL 56 Cb -0.01 -3.71 0.04 0.00 0.56 0.00 0.00 36.38 33.26 1x1b s VAL 56 CO 0.19 0.28 1.56 -0.65 -0.31 0.00 0.00 175.10 176.17 1x1b h PRO 57 N 7.24 -0.17 0.00 4.82 0.11 -1.93 0.14 132.00 142.21 1x1b h PRO 57 Ca -0.37 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.74 1x1b h PRO 57 Cb 1.16 0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1x1b h PRO 57 CO 0.72 -0.11 -0.04 -1.00 -0.21 0.00 0.00 178.00 177.36 1x1b h PRO 58 N -0.18 0.00 0.17 1.05 0.13 -1.99 -0.03 132.00 131.15 1x1b h PRO 58 Ca 0.19 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.98 1x1b h PRO 58 Cb 0.55 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.69 1x1b h PRO 58 CO -0.76 0.04 -1.73 0.00 -0.23 0.00 0.00 178.00 175.31 1x1b h ARG 59 N 0.00 0.37 -0.63 0.86 3.08 -1.63 -3.35 114.38 113.08 1x1b h ARG 59 Ca -0.00 -0.63 -0.05 0.00 0.07 0.00 0.00 59.98 59.37 1x1b h ARG 59 Cb 0.25 0.23 -0.03 0.00 0.08 0.00 0.00 29.97 30.50 1x1b h ARG 59 CO 0.00 1.28 0.19 1.25 -1.07 0.00 0.00 179.97 181.63 1x1b h LEU 60 N 0.10 0.92 -2.01 3.04 5.85 -0.40 -2.67 115.31 120.14 1x1b h LEU 60 Ca -0.33 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.18 1x1b h LEU 60 Cb 2.09 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.88 1x1b h LEU 60 CO 0.17 0.89 0.28 -0.08 -0.34 0.00 0.00 178.44 179.36 1x1b h GLU 61 N 0.91 0.00 0.00 1.25 4.81 -1.14 0.14 114.58 120.55 1x1b h GLU 61 Ca 0.20 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.30 1x1b h GLU 61 Cb 0.30 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 1x1b h GLU 61 CO -0.01 0.00 -0.76 0.52 -0.73 0.00 0.00 179.01 178.04 1x1b h MET 62 N 0.00 0.00 -0.66 1.92 2.86 -1.61 -1.81 114.93 115.63 1x1b h MET 62 Ca 0.00 0.00 0.11 0.00 -2.06 0.00 0.00 59.70 57.75 1x1b h MET 62 Cb 0.57 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 32.14 1x1b h MET 62 CO 0.00 0.95 0.25 1.25 1.06 0.00 0.00 176.91 180.41 1x1b h LEU 63 N -1.00 0.23 0.29 1.22 5.85 -1.34 0.76 115.31 121.32 1x1b h LEU 63 Ca -0.21 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1x1b h LEU 63 Cb 1.14 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.22 1x1b h LEU 63 CO -0.12 0.12 -0.31 -0.07 -0.34 0.00 0.00 178.44 177.72 1x1b h LEU 64 N 0.42 -0.83 -1.34 2.25 4.07 -0.85 0.17 115.31 119.21 1x1b h LEU 64 Ca 0.34 0.08 0.11 0.00 0.08 0.00 0.00 57.88 58.49 1x1b h LEU 64 Cb 0.46 0.29 -0.06 0.00 1.08 0.00 0.00 40.66 42.43 1x1b h LEU 64 CO -0.35 -0.43 0.53 -0.08 -1.08 0.00 0.00 178.44 177.03 1x1b h GLU 65 N -0.63 0.70 -0.11 1.13 4.22 -0.34 0.05 114.58 119.60 1x1b h GLU 65 Ca -0.01 -0.04 -0.04 0.00 0.08 0.00 0.00 59.36 59.35 1x1b h GLU 65 Cb 0.58 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 1x1b h GLU 65 CO -0.07 0.46 -0.08 1.15 -2.18 0.00 0.00 179.01 178.29 1x1b h THR 66 N 0.72 1.34 -0.79 0.32 2.02 -0.06 -2.28 112.91 114.18 1x1b h THR 66 Ca 0.38 -1.18 0.16 0.00 0.77 0.00 0.00 66.41 66.54 1x1b h THR 66 Cb 0.50 1.88 -0.05 0.00 -1.74 0.00 0.00 68.15 68.74 1x1b h THR 66 CO -0.15 0.34 0.53 -0.07 0.37 0.00 0.00 175.52 176.53 1x1b h LEU 67 N -0.12 0.40 -0.42 2.58 4.07 0.27 0.26 115.31 122.35 1x1b h LEU 67 Ca 0.02 0.03 -0.02 0.00 0.08 0.00 0.00 57.88 57.99 1x1b h LEU 67 Cb 0.58 -0.05 -0.02 0.00 1.08 0.00 0.00 40.66 42.24 1x1b h LEU 67 CO 0.02 0.20 0.18 0.03 -1.08 0.00 0.00 178.44 177.79 1x1b h ARG 68 N 0.42 0.61 0.00 1.13 3.08 -0.55 -0.57 114.38 118.50 1x1b h ARG 68 Ca 0.39 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1x1b h ARG 68 Cb 0.91 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.85 1x1b h ARG 68 CO -0.13 0.56 0.00 1.96 -1.07 0.00 0.00 179.97 181.28 1x1b h GLN 69 N 0.53 0.00 -0.02 0.04 4.20 -0.44 -0.72 115.11 118.71 1x1b h GLN 69 Ca 0.14 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 1x1b h GLN 69 Cb 0.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.94 1x1b h GLN 69 CO -0.01 0.00 -0.05 -1.33 -0.67 0.00 0.00 178.83 176.76 1x1b n MET 70 N -2.68 1.58 -3.29 1.46 2.81 -0.66 -4.94 117.12 111.40 1x1b n MET 70 Ca 0.03 -0.97 -0.15 0.00 -1.81 0.00 0.00 57.70 54.79 1x1b n MET 70 Cb 0.35 -1.48 0.08 0.00 -0.71 0.00 0.00 33.22 31.46 1x1b n MET 70 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1x1b n ARG 71 N 0.14 -3.67 -0.06 0.03 1.74 -0.28 -4.93 116.66 109.63 1x1b n ARG 71 Ca 0.17 0.85 -0.07 0.00 -0.77 0.00 0.00 57.85 58.03 1x1b n ARG 71 Cb 0.38 -5.80 -0.08 0.00 -1.02 0.00 0.00 32.46 25.93 1x1b n ARG 71 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1x1b n VAL 72 N -3.51 0.80 -4.29 1.55 0.31 -0.27 -4.87 118.33 108.05 1x1b n VAL 72 Ca -0.14 -0.42 -0.15 0.00 -0.01 0.00 0.00 64.34 63.61 1x1b n VAL 72 Cb 0.64 -0.82 -0.10 0.00 -0.91 0.00 0.00 33.84 32.64 1x1b n VAL 72 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1x1b s ILE 73 N -2.28 0.69 0.17 2.52 -4.36 -1.22 -2.16 121.20 114.56 1x1b s ILE 73 Ca -0.11 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.36 1x1b s ILE 73 Cb 0.04 -2.38 -0.04 0.00 1.25 0.00 0.00 42.46 41.33 1x1b s ILE 73 CO 0.42 -0.25 -0.16 0.20 0.24 0.00 0.00 174.94 175.39 1x1b s ASN 74 N -3.26 2.50 -0.25 4.36 0.01 0.16 -4.30 114.94 114.16 1x1b s ASN 74 Ca 0.31 -0.92 0.02 0.00 -0.71 0.00 0.00 52.86 51.55 1x1b s ASN 74 Cb 0.07 -0.13 0.07 0.00 0.41 0.00 0.00 41.25 41.66 1x1b s ASN 74 CO 0.09 -0.11 -0.05 -0.22 -1.51 0.00 0.00 177.10 175.30 1x1b s LEU 75 N -2.89 2.98 -0.09 0.60 0.20 -1.26 -1.76 118.68 116.44 1x1b s LEU 75 Ca 0.17 -1.35 -0.01 0.00 0.69 0.00 0.00 54.13 53.64 1x1b s LEU 75 Cb -0.03 -1.30 0.03 0.00 -0.43 0.00 0.00 46.19 44.45 1x1b s LEU 75 CO 0.06 -0.25 -0.05 -1.61 -0.29 0.00 0.00 176.35 174.22 1x1b s GLU 76 N 1.29 1.15 -1.28 1.98 2.02 0.23 -4.83 118.70 119.25 1x1b s GLU 76 Ca -0.04 -0.11 -0.08 0.00 0.02 0.00 0.00 54.97 54.76 1x1b s GLU 76 Cb -0.19 -1.32 0.01 0.00 0.10 0.00 0.00 34.13 32.73 1x1b s GLU 76 CO -0.07 -0.27 1.12 -0.25 0.02 0.00 0.00 175.26 175.81 1x1b n ASP 77 N 4.97 -5.69 -0.24 -0.19 8.00 -1.26 -1.91 116.55 120.22 1x1b n ASP 77 Ca -0.11 -0.53 -0.03 0.00 0.71 0.00 0.00 54.79 54.83 1x1b n ASP 77 Cb 0.50 -4.86 -0.01 0.00 -0.02 0.00 0.00 41.12 36.73 1x1b n ASP 77 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x1b n GLY 78 N -1.85 0.56 3.18 0.44 0.00 -1.26 -4.99 105.19 101.27 1x1b n GLY 78 Ca -0.03 -0.22 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 1x1b n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x1b s LYS 79 N -1.52 2.37 -0.12 1.61 1.02 -0.81 -4.11 119.74 118.19 1x1b s LYS 79 Ca 0.00 -0.75 -0.10 0.00 0.02 0.00 0.00 55.97 55.14 1x1b s LYS 79 Cb 0.00 -1.93 -0.05 0.00 -0.52 0.00 0.00 37.83 35.33 1x1b s LYS 79 CO 0.00 0.23 0.21 -1.58 -0.92 0.00 0.00 175.35 173.30 1x1b s TRP 80 N 0.16 3.57 0.12 3.18 0.52 0.23 -0.60 118.94 126.13 1x1b s TRP 80 Ca -0.10 0.60 -0.04 0.00 0.02 0.00 0.00 56.10 56.58 1x1b s TRP 80 Cb -0.15 -2.10 -0.03 0.00 -1.15 0.00 0.00 33.47 30.04 1x1b s TRP 80 CO 0.05 0.57 0.12 -1.54 0.02 0.00 0.00 176.95 176.18 1x1b s SER 81 N -0.59 0.24 0.88 2.95 1.04 -0.72 -1.32 113.70 116.18 1x1b s SER 81 Ca 0.16 -1.02 -0.12 0.00 0.48 0.00 0.00 55.95 55.45 1x1b s SER 81 Cb -0.13 0.33 0.12 0.00 0.10 0.00 0.00 66.02 66.44 1x1b s SER 81 CO 0.05 -0.76 1.13 -0.76 0.98 0.00 0.00 173.24 173.88 1x1b s LEU 82 N -2.98 2.15 0.63 2.42 1.43 -1.26 -0.66 118.68 120.41 1x1b s LEU 82 Ca 0.17 1.04 0.06 0.00 -1.03 0.00 0.00 54.13 54.38 1x1b s LEU 82 Cb 0.06 -3.43 0.11 0.00 0.03 0.00 0.00 46.19 42.96 1x1b s LEU 82 CO -0.02 -2.42 0.88 0.42 0.23 0.00 0.00 176.35 175.44 1x1b s THR 83 N -3.25 2.08 0.17 5.49 -4.23 -0.92 -4.45 115.64 110.53 1x1b s THR 83 Ca 0.63 -0.87 -0.10 0.00 -1.18 0.00 0.00 61.69 60.17 1x1b s THR 83 Cb -0.15 -2.21 0.04 0.00 1.34 0.00 0.00 72.50 71.53 1x1b s THR 83 CO 0.53 0.00 1.60 -0.33 -0.54 0.00 0.00 174.62 175.89 1x1b h GLU 84 N -0.09 1.05 -0.08 3.99 5.08 -1.96 -0.25 114.58 122.32 1x1b h GLU 84 Ca -0.31 -0.38 -0.00 0.00 -1.00 0.00 0.00 59.36 57.67 1x1b h GLU 84 Cb 1.28 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.45 1x1b h GLU 84 CO 0.40 1.07 0.04 0.35 -1.00 0.00 0.00 179.01 179.87 1x1b h PHE 85 N 0.94 0.11 0.32 4.33 3.57 -1.93 -2.61 116.94 121.66 1x1b h PHE 85 Ca 0.15 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 1x1b h PHE 85 Cb 0.66 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.36 1x1b h PHE 85 CO 0.05 0.16 -0.15 0.00 -2.23 0.00 0.00 178.31 176.13 1x1b h ALA 86 N 0.94 -0.43 -0.92 2.41 0.00 -1.74 0.23 119.26 119.76 1x1b h ALA 86 Ca 0.03 -0.18 0.27 0.00 0.00 0.00 0.00 54.91 55.02 1x1b h ALA 86 Cb 0.09 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1x1b h ALA 86 CO -0.00 -0.58 0.70 0.22 0.00 0.00 0.00 179.25 179.58 1x1b h ASP 87 N -0.74 0.00 0.12 0.00 3.58 -1.09 0.57 116.42 118.86 1x1b h ASP 87 Ca -0.04 0.00 -0.36 0.00 0.42 0.00 0.00 57.03 57.04 1x1b h ASP 87 Cb 0.50 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.51 1x1b h ASP 87 CO 0.07 0.00 -2.13 0.00 -2.88 0.00 0.00 179.24 174.30 1x1b n TYR 88 N -4.14 0.78 0.04 0.28 9.36 -0.98 -3.82 117.16 118.68 1x1b n TYR 88 Ca 0.19 0.18 0.08 0.00 3.32 0.00 0.00 57.90 61.67 1x1b n TYR 88 Cb 1.02 -1.11 -0.08 0.00 -0.63 0.00 0.00 39.34 38.53 1x1b n TYR 88 CO 0.00 0.00 0.00 -1.33 0.22 0.00 0.00 176.86 175.75 1x1b n MET 89 N -3.32 0.63 -0.04 2.98 2.81 0.79 -4.43 117.12 116.54 1x1b n MET 89 Ca -0.34 0.02 0.01 0.00 -1.81 0.00 0.00 57.70 55.57 1x1b n MET 89 Cb 1.04 -1.70 0.01 0.00 -0.71 0.00 0.00 33.22 31.87 1x1b n MET 89 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1x1b n PHE 90 N -2.57 0.00 -1.61 2.03 3.72 0.19 -0.46 117.46 118.75 1x1b n PHE 90 Ca -0.05 -0.38 -0.29 0.00 -0.05 0.00 0.00 57.45 56.68 1x1b n PHE 90 Cb 0.65 -0.05 0.14 0.00 -0.94 0.00 0.00 39.48 39.28 1x1b n PHE 90 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1x1b s SER 91 N -0.90 3.52 0.05 4.37 1.04 -1.19 -4.72 113.70 115.87 1x1b s SER 91 Ca 0.03 0.85 -0.26 0.00 0.48 0.00 0.00 55.95 57.05 1x1b s SER 91 Cb 0.03 -1.35 -0.17 0.00 0.10 0.00 0.00 66.02 64.63 1x1b s SER 91 CO 0.00 -2.53 1.52 1.55 0.98 0.00 0.00 173.24 174.76 1x1b h PRO 92 N -1.49 -0.34 -5.96 4.02 0.13 -1.92 -3.43 132.00 123.01 1x1b h PRO 92 Ca -0.49 0.02 -0.60 0.00 -0.87 0.00 0.00 66.00 64.06 1x1b h PRO 92 Cb 1.32 0.08 -0.06 0.00 0.13 0.00 0.00 31.00 32.47 1x1b h PRO 92 CO 0.59 -0.12 -0.19 0.95 -0.23 0.00 0.00 178.00 179.00 1x1b s THR 93 N -5.52 5.04 0.34 1.56 -4.23 -1.26 -4.99 115.64 106.57 1x1b s THR 93 Ca -0.15 0.87 -0.28 0.00 -1.18 0.00 0.00 61.69 60.95 1x1b s THR 93 Cb 0.04 -3.73 -0.10 0.00 1.34 0.00 0.00 72.50 70.05 1x1b s THR 93 CO 0.62 0.53 1.25 -2.16 -0.54 0.00 0.00 174.62 174.33 1x1b s PRO 94 N -0.77 4.34 0.11 3.99 0.04 -1.26 -4.93 135.00 136.52 1x1b s PRO 94 Ca 0.24 2.10 0.15 0.00 0.04 0.00 0.00 61.00 63.53 1x1b s PRO 94 Cb -0.16 -3.02 -0.10 0.00 0.04 0.00 0.00 34.50 31.25 1x1b s PRO 94 CO 0.13 -0.16 0.99 0.87 0.04 0.00 0.00 177.00 178.88 1x1b h LYS 95 N 3.32 0.00 -3.43 4.56 1.79 -1.84 -3.43 116.57 117.55 1x1b h LYS 95 Ca -0.49 0.00 -0.46 0.00 -2.18 0.00 0.00 60.65 57.53 1x1b h LYS 95 Cb 1.23 0.00 -0.40 0.00 -1.58 0.00 0.00 32.23 31.48 1x1b h LYS 95 CO 0.65 0.40 -0.76 -2.00 -1.08 0.00 0.00 179.45 176.66 1x1b s GLU 96 N -2.90 0.37 0.30 3.15 2.12 -1.26 -5.05 118.70 115.44 1x1b s GLU 96 Ca -0.01 -0.06 0.09 0.00 0.36 0.00 0.00 54.97 55.35 1x1b s GLU 96 Cb 0.08 -1.47 0.90 0.00 0.26 0.00 0.00 34.13 33.91 1x1b s GLU 96 CO 0.80 -0.50 1.40 -2.30 -0.54 0.00 0.00 175.26 174.12 1x1b n PRO 97 N 5.18 -0.06 -0.85 4.30 -0.02 -1.26 -1.53 135.00 140.75 1x1b n PRO 97 Ca -0.07 1.29 -0.03 0.00 -2.02 0.00 0.00 63.50 62.67 1x1b n PRO 97 Cb 0.49 -2.16 0.27 0.00 -0.02 0.00 0.00 33.50 32.07 1x1b n PRO 97 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1x1b n ASN 98 N -5.19 4.05 -3.26 2.55 3.02 -1.26 -4.29 115.26 110.89 1x1b n ASN 98 Ca 0.26 -3.31 -0.05 0.00 -0.03 0.00 0.00 54.58 51.44 1x1b n ASN 98 Cb 0.88 -0.68 -0.04 0.00 -0.61 0.00 0.00 39.78 39.33 1x1b n ASN 98 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1x1b s LEU 99 N -3.03 -1.00 -0.28 3.41 2.96 -0.58 -0.92 118.68 119.24 1x1b s LEU 99 Ca 0.50 -0.70 -0.11 0.00 -0.22 0.00 0.00 54.13 53.60 1x1b s LEU 99 Cb 0.41 1.41 0.11 0.00 0.50 0.00 0.00 46.19 48.63 1x1b s LEU 99 CO 0.09 -0.26 0.63 -2.28 -1.32 0.00 0.00 176.35 173.21 1x1b s HIS 100 N 2.10 -1.21 -0.11 5.38 2.46 0.45 -4.32 115.29 120.04 1x1b s HIS 100 Ca 0.13 2.19 0.15 0.00 0.47 0.00 0.00 55.06 58.00 1x1b s HIS 100 Cb -0.10 0.71 -0.04 0.00 -0.13 0.00 0.00 32.58 33.02 1x1b s HIS 100 CO -0.16 -0.61 1.21 0.37 -2.47 0.00 0.00 174.74 173.08 1x1b h GLN 101 N 7.76 0.00 -0.73 2.88 5.75 -1.04 -3.41 115.11 126.32 1x1b h GLN 101 Ca -0.21 0.00 0.13 0.00 -0.15 0.00 0.00 58.65 58.42 1x1b h GLN 101 Cb 1.13 0.00 -0.13 0.00 1.07 0.00 0.00 27.48 29.55 1x1b h GLN 101 CO 0.12 0.49 -0.30 1.15 -2.65 0.00 0.00 178.83 177.65 1x1b h THR 102 N 0.00 0.15 -0.57 2.39 2.02 -1.83 0.22 112.91 115.31 1x1b h THR 102 Ca -0.06 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.15 1x1b h THR 102 Cb 1.51 0.15 -0.04 0.00 -1.74 0.00 0.00 68.15 68.03 1x1b h THR 102 CO 0.07 0.00 0.33 -0.65 0.37 0.00 0.00 175.52 175.64 1x1b h PRO 103 N -0.08 0.62 0.00 6.66 0.11 -1.93 -1.45 132.00 135.93 1x1b h PRO 103 Ca 0.30 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 66.24 1x1b h PRO 103 Cb 0.57 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.52 1x1b h PRO 103 CO -0.78 0.41 -0.66 -0.24 -0.21 0.00 0.00 178.00 176.52 1x1b h VAL 104 N 0.64 1.44 -0.62 3.15 3.04 -1.67 -2.54 116.25 119.69 1x1b h VAL 104 Ca 0.24 -2.28 -0.03 0.00 -1.01 0.00 0.00 66.70 63.61 1x1b h VAL 104 Cb 0.07 2.24 -0.03 0.00 -2.01 0.00 0.00 31.29 31.56 1x1b h VAL 104 CO -0.12 0.65 0.28 0.00 -1.01 0.00 0.00 177.57 177.36 1x1b h ALA 105 N 1.34 0.81 -0.76 3.17 0.00 0.13 -0.56 119.26 123.39 1x1b h ALA 105 Ca -0.01 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 1x1b h ALA 105 Cb 1.19 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1x1b h ALA 105 CO 0.09 0.40 0.28 0.87 0.00 0.00 0.00 179.25 180.88 1x1b h LYS 106 N 0.86 1.14 -0.72 0.00 1.57 -1.03 0.37 116.57 118.77 1x1b h LYS 106 Ca 0.21 -0.21 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1x1b h LYS 106 Cb 0.16 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.26 1x1b h LYS 106 CO -0.02 0.94 0.27 0.00 -0.57 0.00 0.00 179.45 180.06 1x1b h ALA 107 N 1.20 0.94 -0.26 3.86 0.00 -1.05 -1.50 119.26 122.44 1x1b h ALA 107 Ca 0.25 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1x1b h ALA 107 Cb 0.24 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1x1b h ALA 107 CO -0.02 0.58 0.02 0.52 0.00 0.00 0.00 179.25 180.35 1x1b h MET 108 N 1.04 0.44 -0.98 0.00 2.86 -0.69 0.63 114.93 118.22 1x1b h MET 108 Ca 0.24 -0.13 0.18 0.00 -2.06 0.00 0.00 59.70 57.93 1x1b h MET 108 Cb 0.24 -0.05 -0.09 0.00 0.06 0.00 0.00 31.60 31.76 1x1b h MET 108 CO -0.02 0.58 0.61 0.00 1.06 0.00 0.00 176.91 179.15 1x1b h ALA 109 N 0.84 1.76 0.24 6.32 0.00 -0.61 0.60 119.26 128.42 1x1b h ALA 109 Ca 0.08 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1x1b h ALA 109 Cb 0.37 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1x1b h ALA 109 CO 0.01 -0.09 -0.12 0.35 0.00 0.00 0.00 179.25 179.40 1x1b h PHE 110 N 0.73 -0.30 -0.01 0.00 3.04 -0.90 -3.28 116.94 116.22 1x1b h PHE 110 Ca 0.54 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.49 1x1b h PHE 110 Cb 0.88 0.10 -0.00 0.00 2.56 0.00 0.00 35.95 39.49 1x1b h PHE 110 CO -0.00 0.08 0.01 -0.07 -2.02 0.00 0.00 178.31 176.30 1x1b h LEU 111 N -0.88 0.00 0.19 0.59 3.38 -0.11 0.11 115.31 118.59 1x1b h LEU 111 Ca -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1x1b h LEU 111 Cb 0.51 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1x1b h LEU 111 CO 0.05 0.00 -0.13 0.00 0.09 0.00 0.00 178.44 178.45 1x1b h ALA 112 N 1.98 -0.30 -0.07 1.53 0.00 -0.97 0.67 119.26 122.10 1x1b h ALA 112 Ca 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1x1b h ALA 112 Cb 0.03 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1x1b h ALA 112 CO -0.00 -0.68 -0.09 -0.44 0.00 0.00 0.00 179.25 178.04 1x1b h ASP 113 N -0.32 0.19 0.34 0.00 3.45 -1.44 -1.62 116.42 117.02 1x1b h ASP 113 Ca -0.01 -0.52 -0.08 0.00 0.43 0.00 0.00 57.03 56.85 1x1b h ASP 113 Cb 0.28 -0.05 -0.01 0.00 -0.56 0.00 0.00 39.33 38.99 1x1b h ASP 113 CO -0.00 0.67 -0.36 -0.78 -1.57 0.00 0.00 179.24 177.19 1x1b h ASP 114 N -0.28 0.03 0.00 6.45 1.82 -0.69 -3.44 116.42 120.31 1x1b h ASP 114 Ca 0.01 -0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1x1b h ASP 114 Cb 0.62 -0.01 0.00 0.00 0.68 0.00 0.00 39.33 40.62 1x1b h ASP 114 CO 0.02 0.39 0.00 0.33 -1.61 0.00 0.00 179.24 178.37 1x1b n PHE 115 N -4.10 -0.21 -0.18 0.28 -0.00 0.21 -4.90 117.46 108.55 1x1b n PHE 115 Ca -0.02 0.00 -0.06 0.00 -0.00 0.00 0.00 57.45 57.37 1x1b n PHE 115 Cb 0.40 0.15 0.03 0.00 -0.00 0.00 0.00 39.48 40.06 1x1b n PHE 115 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 176.76 178.64 1x1b h TYR 116 N 0.00 0.66 0.00 -5.13 0.99 -0.85 -2.02 116.97 110.62 1x1b h TYR 116 Ca 0.00 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.75 1x1b h TYR 116 Cb 0.00 -0.22 -0.00 0.00 1.00 0.00 0.00 36.73 37.51 1x1b h TYR 116 CO 0.00 0.41 -0.00 0.52 -0.00 0.00 0.00 178.16 179.09 1x1b h MET 117 N 0.71 0.00 -0.43 4.88 2.86 -1.54 -2.18 114.93 119.23 1x1b h MET 117 Ca 0.20 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.73 1x1b h MET 117 Cb -0.06 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.53 1x1b h MET 117 CO -0.06 0.00 0.07 0.41 1.06 0.00 0.00 176.91 178.39 1x1b n GLY 118 N -0.96 4.16 0.38 8.32 0.00 -0.77 -4.73 105.19 111.59 1x1b n GLY 118 Ca -0.03 -1.08 0.14 0.00 0.00 0.00 0.00 46.02 45.06 1x1b n GLY 118 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1x1b h LEU 119 N 1.84 0.63 -1.52 0.99 5.85 -1.31 0.82 115.31 122.60 1x1b h LEU 119 Ca 0.14 0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.87 1x1b h LEU 119 Cb 1.78 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.74 1x1b h LEU 119 CO 0.43 0.27 -0.24 0.77 -0.34 0.00 0.00 178.44 179.33 1x1b h SER 120 N 0.64 0.00 -0.07 1.25 4.64 -1.86 -0.09 113.55 118.06 1x1b h SER 120 Ca 0.50 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.63 1x1b h SER 120 Cb 0.92 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.02 1x1b h SER 120 CO -0.25 0.24 -0.70 1.56 -0.87 0.00 0.00 176.83 176.80 1x1b h GLN 121 N 0.00 0.59 0.14 4.77 4.20 -1.23 -1.85 115.11 121.73 1x1b h GLN 121 Ca -0.00 -0.55 -0.01 0.00 0.06 0.00 0.00 58.65 58.15 1x1b h GLN 121 Cb 0.52 0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.43 1x1b h GLN 121 CO 0.03 1.17 -0.07 0.00 -0.67 0.00 0.00 178.83 179.29 1x1b h ALA 122 N 0.43 -0.19 -0.74 3.87 0.00 -0.87 -1.56 119.26 120.20 1x1b h ALA 122 Ca -0.07 -0.10 0.15 0.00 0.00 0.00 0.00 54.91 54.89 1x1b h ALA 122 Cb 1.37 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 19.18 1x1b h ALA 122 CO 0.14 -0.54 0.50 0.28 0.00 0.00 0.00 179.25 179.63 1x1b h VAL 123 N -0.33 0.78 -0.04 0.00 2.07 -1.08 0.21 116.25 117.86 1x1b h VAL 123 Ca -0.02 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1x1b h VAL 123 Cb 0.27 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1x1b h VAL 123 CO 0.03 0.07 0.00 0.54 0.02 0.00 0.00 177.57 178.23 1x1b n ARG 124 N -4.47 1.14 0.00 1.57 1.74 -0.70 -4.89 116.66 111.06 1x1b n ARG 124 Ca 0.14 -0.22 0.00 0.00 -0.77 0.00 0.00 57.85 57.01 1x1b n ARG 124 Cb 0.55 -1.25 0.00 0.00 -1.02 0.00 0.00 32.46 30.75 1x1b n ARG 124 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1x1b n GLY 125 N 0.79 2.84 0.33 -0.13 0.00 0.75 -4.86 105.19 104.91 1x1b n GLY 125 Ca 0.11 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.31 1x1b n GLY 125 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1x1b h GLN 126 N 0.54 0.00 -4.61 1.61 4.20 -1.50 -3.44 115.11 111.92 1x1b h GLN 126 Ca 0.00 0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.43 1x1b h GLN 126 Cb 0.00 0.00 -0.21 0.00 0.30 0.00 0.00 27.48 27.57 1x1b h GLN 126 CO 0.00 0.00 -0.73 0.21 -0.67 0.00 0.00 178.83 177.64 1x1b s LYS 127 N -4.49 0.56 0.18 1.46 2.20 -0.98 -4.91 119.74 113.77 1x1b s LYS 127 Ca -0.05 -0.81 0.09 0.00 -0.36 0.00 0.00 55.97 54.84 1x1b s LYS 127 Cb 0.14 -0.31 -0.04 0.00 -1.51 0.00 0.00 37.83 36.11 1x1b s LYS 127 CO 0.49 0.05 -0.18 -0.80 -0.36 0.00 0.00 175.35 174.55 1x1b s ASN 128 N -1.69 2.72 0.04 1.43 0.02 -1.26 -4.18 114.94 112.02 1x1b s ASN 128 Ca -0.08 -0.89 -0.30 0.00 -1.02 0.00 0.00 52.86 50.57 1x1b s ASN 128 Cb -0.09 -0.16 -0.04 0.00 0.02 0.00 0.00 41.25 40.98 1x1b s ASN 128 CO 0.00 -0.05 0.95 0.12 0.02 0.00 0.00 177.10 178.15 1x1b s PHE 129 N -2.20 3.71 -0.05 2.20 2.19 -0.48 -4.91 117.98 118.44 1x1b s PHE 129 Ca 0.17 1.71 -0.05 0.00 0.33 0.00 0.00 56.93 59.09 1x1b s PHE 129 Cb -0.05 -3.07 -0.03 0.00 -1.31 0.00 0.00 43.02 38.56 1x1b s PHE 129 CO 0.07 0.08 -0.12 1.17 1.83 0.00 0.00 175.22 178.25 1x1b n LYS 130 N 3.47 0.19 0.00 10.12 4.81 -1.26 -4.96 118.16 130.53 1x1b n LYS 130 Ca 0.04 0.08 0.00 0.00 -0.87 0.00 0.00 58.31 57.56 1x1b n LYS 130 Cb 0.50 -0.83 0.00 0.00 0.02 0.00 0.00 35.03 34.72 1x1b n LYS 130 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x1b n GLY 131 N 2.58 -2.37 0.18 3.14 0.00 -1.26 -4.79 105.19 102.67 1x1b n GLY 131 Ca -0.13 -1.47 -0.07 0.00 0.00 0.00 0.00 46.02 44.35 1x1b n GLY 131 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1x1b h GLN 132 N 0.00 -0.43 -6.19 1.61 4.15 -1.98 -3.44 115.11 108.83 1x1b h GLN 132 Ca 0.00 0.03 -0.60 0.00 0.77 0.00 0.00 58.65 58.85 1x1b h GLN 132 Cb 0.00 0.10 -0.08 0.00 0.21 0.00 0.00 27.48 27.71 1x1b h GLN 132 CO 0.00 -0.29 -0.58 0.14 -1.93 0.00 0.00 178.83 176.17 1x1b s VAL 133 N -3.80 4.50 0.17 2.39 -7.23 -1.26 -5.08 120.40 110.10 1x1b s VAL 133 Ca -0.07 -0.95 -0.30 0.00 -1.81 0.00 0.00 61.98 58.85 1x1b s VAL 133 Cb 0.01 -3.24 -0.07 0.00 0.56 0.00 0.00 36.38 33.63 1x1b s VAL 133 CO 0.20 -0.01 1.06 -2.16 -0.31 0.00 0.00 175.10 173.88 1x1b s PRO 134 N -2.80 4.63 -0.03 4.82 0.04 -1.26 -5.03 135.00 135.36 1x1b s PRO 134 Ca 0.30 1.66 0.07 0.00 0.04 0.00 0.00 61.00 63.07 1x1b s PRO 134 Cb -0.11 -3.29 -0.02 0.00 0.04 0.00 0.00 34.50 31.12 1x1b s PRO 134 CO 0.23 0.13 -0.25 -0.47 0.04 0.00 0.00 177.00 176.68 1x1b s TYR 135 N -0.29 2.30 0.25 0.56 6.14 -1.26 -3.07 117.35 121.97 1x1b s TYR 135 Ca 0.48 -0.54 -0.30 0.00 0.64 0.00 0.00 57.07 57.35 1x1b s TYR 135 Cb -0.28 -1.49 -0.09 0.00 0.42 0.00 0.00 41.96 40.51 1x1b s TYR 135 CO 0.34 -0.11 1.29 -1.25 0.64 0.00 0.00 175.55 176.46 1x1b s PRO 136 N -0.41 4.40 0.52 4.97 0.04 -1.26 -5.13 135.00 138.14 1x1b s PRO 136 Ca 0.04 2.08 -0.22 0.00 0.04 0.00 0.00 61.00 62.95 1x1b s PRO 136 Cb -0.11 -3.16 -0.06 0.00 0.04 0.00 0.00 34.50 31.21 1x1b s PRO 136 CO 0.01 -0.19 1.19 -2.30 0.04 0.00 0.00 177.00 175.75 1x1b n PRO 137 N 1.94 1.47 -0.00 0.56 -0.02 -1.18 -4.97 135.00 132.81 1x1b n PRO 137 Ca 0.04 0.54 -0.00 0.00 -2.02 0.00 0.00 63.50 62.05 1x1b n PRO 137 Cb 0.43 -2.36 -0.00 0.00 -0.02 0.00 0.00 33.50 31.54 1x1b n PRO 137 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1x1b n VAL 138 N -1.02 0.02 -2.43 -1.45 0.31 -1.26 -4.69 118.33 107.81 1x1b n VAL 138 Ca 0.11 -0.01 -0.36 0.00 -0.01 0.00 0.00 64.34 64.06 1x1b n VAL 138 Cb 0.44 -0.68 -0.03 0.00 -0.91 0.00 0.00 33.84 32.66 1x1b n VAL 138 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1x1b s THR 139 N -2.01 3.48 0.19 2.52 2.01 -1.26 -4.34 115.64 116.23 1x1b s THR 139 Ca -0.01 1.10 -0.12 0.00 0.31 0.00 0.00 61.69 62.97 1x1b s THR 139 Cb 0.00 -3.55 0.10 0.00 0.01 0.00 0.00 72.50 69.06 1x1b s THR 139 CO 0.01 -0.03 1.78 -0.09 -0.69 0.00 0.00 174.62 175.60 1x1b h ARG 140 N 2.19 0.48 -0.84 4.92 2.43 -1.98 0.20 114.38 121.79 1x1b h ARG 140 Ca -0.49 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 58.65 1x1b h ARG 140 Cb 1.23 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 30.63 1x1b h ARG 140 CO 0.61 0.32 0.52 1.49 -1.51 0.00 0.00 179.97 181.39 1x1b h GLU 141 N 0.49 1.14 -0.13 0.20 4.81 -1.92 -0.42 114.58 118.75 1x1b h GLU 141 Ca 0.25 -0.10 -0.03 0.00 -0.13 0.00 0.00 59.36 59.35 1x1b h GLU 141 Cb 0.19 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 1x1b h GLU 141 CO -0.19 0.79 -0.05 -0.44 -0.73 0.00 0.00 179.01 178.38 1x1b h ASP 142 N 1.16 0.27 -0.28 1.04 3.32 -1.47 -1.37 116.42 119.09 1x1b h ASP 142 Ca 0.30 -0.40 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 1x1b h ASP 142 Cb -0.06 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 1x1b h ASP 142 CO -0.06 0.61 0.16 0.78 -1.72 0.00 0.00 179.24 179.01 1x1b h ASN 143 N -0.07 0.34 -0.65 6.45 -0.26 -0.53 -1.92 115.58 118.94 1x1b h ASN 143 Ca 0.03 -0.07 0.11 0.00 -0.56 0.00 0.00 56.30 55.80 1x1b h ASN 143 Cb 0.50 -0.09 -0.04 0.00 -1.06 0.00 0.00 38.32 37.64 1x1b h ASN 143 CO 0.02 0.32 0.44 0.25 -1.06 0.00 0.00 177.43 177.39 1x1b h LEU 144 N 0.34 0.41 -0.43 1.61 6.46 -1.04 0.11 115.31 122.78 1x1b h LEU 144 Ca 0.10 0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 57.87 1x1b h LEU 144 Cb 0.05 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 39.88 1x1b h LEU 144 CO -0.02 0.24 0.26 0.22 -0.62 0.00 0.00 178.44 178.53 1x1b h TYR 145 N 0.45 0.56 0.05 1.25 3.20 -0.44 -1.55 116.97 120.50 1x1b h TYR 145 Ca 0.30 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.17 1x1b h TYR 145 Cb 0.59 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.67 1x1b h TYR 145 CO -0.00 0.39 -0.02 0.74 -1.64 0.00 0.00 178.16 177.62 1x1b h PHE 146 N 0.57 -0.06 -0.41 -3.82 0.04 -1.04 -3.27 116.94 108.95 1x1b h PHE 146 Ca 0.15 -0.00 0.12 0.00 2.80 0.00 0.00 57.97 61.04 1x1b h PHE 146 Cb -0.01 0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.14 1x1b h PHE 146 CO -0.04 0.57 0.31 0.93 -0.60 0.00 0.00 178.31 179.48 1x1b h GLU 147 N -0.85 0.00 -0.09 1.51 4.39 -0.85 0.37 114.58 119.05 1x1b h GLU 147 Ca -0.01 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.61 1x1b h GLU 147 Cb 0.66 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 1x1b h GLU 147 CO 0.01 0.00 -0.31 1.49 -1.16 0.00 0.00 179.01 179.04 1x1b h GLU 148 N 0.00 0.17 0.03 2.33 4.81 -1.36 -0.89 114.58 119.67 1x1b h GLU 148 Ca 0.19 -0.06 -0.11 0.00 -0.13 0.00 0.00 59.36 59.25 1x1b h GLU 148 Cb 0.81 -0.01 0.01 0.00 0.63 0.00 0.00 28.75 30.19 1x1b h GLU 148 CO -0.00 0.47 -0.47 0.82 -0.73 0.00 0.00 179.01 179.10 1x1b h ILE 149 N 0.16 1.53 0.06 2.32 2.04 -0.36 -2.80 117.51 120.45 1x1b h ILE 149 Ca 0.02 -2.17 -0.00 0.00 1.00 0.00 0.00 64.86 63.71 1x1b h ILE 149 Cb 0.63 2.89 0.00 0.00 -0.74 0.00 0.00 36.82 39.60 1x1b h ILE 149 CO 0.05 0.61 -0.03 0.45 0.00 0.00 0.00 178.15 179.22 1x1b h HIS 150 N -0.40 -0.07 0.00 1.37 3.86 -1.20 -2.15 115.15 116.56 1x1b h HIS 150 Ca -0.07 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.13 1x1b h HIS 150 Cb 1.25 0.02 -0.00 0.00 1.06 0.00 0.00 27.41 29.75 1x1b h HIS 150 CO 0.18 -0.04 -0.03 0.07 0.86 0.00 0.00 177.93 178.98 1x1b h ARG 151 N -0.09 0.00 0.00 2.45 0.11 -1.28 -2.63 114.38 112.93 1x1b h ARG 151 Ca -0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.07 1x1b h ARG 151 Cb 0.07 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.15 1x1b h ARG 151 CO 0.01 0.03 0.00 0.43 0.10 0.00 0.00 179.97 180.55 1x1b n SER 152 N -3.99 0.00 -2.73 0.08 7.64 -0.81 -3.42 113.62 110.39 1x1b n SER 152 Ca -0.03 0.37 -0.05 0.00 1.01 0.00 0.00 58.87 60.17 1x1b n SER 152 Cb 0.12 -0.45 0.04 0.00 -1.01 0.00 0.00 64.21 62.91 1x1b n SER 152 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1x1b n ASN 153 N -1.45 1.65 -0.33 6.43 6.94 -1.00 -0.41 115.26 127.09 1x1b n ASN 153 Ca 0.07 -2.42 0.06 0.00 -0.02 0.00 0.00 54.58 52.27 1x1b n ASN 153 Cb 0.24 -0.50 0.01 0.00 -2.36 0.00 0.00 39.78 37.17 1x1b n ASN 153 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1x1b n ALA 154 N -0.35 2.86 -0.20 -2.53 0.00 -0.88 -4.72 120.51 114.69 1x1b n ALA 154 Ca 0.09 -0.50 -0.02 0.00 0.00 0.00 0.00 53.44 53.01 1x1b n ALA 154 Cb 0.81 -0.43 0.04 0.00 0.00 0.00 0.00 19.45 19.87 1x1b n ALA 154 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1x1b h LYS 155 N 1.63 -0.07 -0.05 0.00 3.64 -1.31 -1.04 116.57 119.38 1x1b h LYS 155 Ca 0.00 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.27 1x1b h LYS 155 Cb 0.45 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1x1b h LYS 155 CO 0.00 -0.05 -0.50 0.74 -2.27 0.00 0.00 179.45 177.38 1x1b h PHE 156 N -0.07 0.15 -0.34 1.91 -1.00 -1.84 0.81 116.94 116.56 1x1b h PHE 156 Ca 0.27 -0.05 -0.07 0.00 2.81 0.00 0.00 57.97 60.94 1x1b h PHE 156 Cb 0.50 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 40.02 1x1b h PHE 156 CO -0.55 0.60 -0.05 0.00 -1.61 0.00 0.00 178.31 176.69 1x1b h ALA 157 N 1.39 0.47 -0.42 2.45 0.00 -1.72 -1.44 119.26 119.99 1x1b h ALA 157 Ca 0.00 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.67 1x1b h ALA 157 Cb 0.91 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 1x1b h ALA 157 CO 0.07 0.29 0.20 0.82 0.00 0.00 0.00 179.25 180.62 1x1b h ILE 158 N 0.44 0.95 -0.27 0.00 2.04 -0.90 -2.00 117.51 117.77 1x1b h ILE 158 Ca 0.09 -0.14 0.05 0.00 1.00 0.00 0.00 64.86 65.86 1x1b h ILE 158 Cb 0.54 0.52 -0.05 0.00 -0.74 0.00 0.00 36.82 37.09 1x1b h ILE 158 CO 0.03 0.07 -0.03 -0.61 0.00 0.00 0.00 178.15 177.61 1x1b h GLN 159 N 0.40 0.04 -0.06 2.37 5.75 -0.60 -0.89 115.11 122.11 1x1b h GLN 159 Ca 0.18 -0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.58 1x1b h GLN 159 Cb 0.11 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.64 1x1b h GLN 159 CO -0.14 0.02 -0.41 1.25 -2.65 0.00 0.00 178.83 176.90 1x1b h LEU 160 N 0.04 0.14 0.19 -2.39 5.85 -0.99 -2.73 115.31 115.43 1x1b h LEU 160 Ca 0.13 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1x1b h LEU 160 Cb 0.18 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1x1b h LEU 160 CO -0.25 0.54 -0.09 -0.07 -0.34 0.00 0.00 178.44 178.24 1x1b h LEU 161 N 0.12 -0.22 -1.94 2.25 3.38 -0.72 -0.98 115.31 117.21 1x1b h LEU 161 Ca 0.01 -0.29 0.25 0.00 0.09 0.00 0.00 57.88 57.94 1x1b h LEU 161 Cb 0.78 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.55 1x1b h LEU 161 CO 0.06 0.22 0.62 -0.07 0.09 0.00 0.00 178.44 179.35 1x1b h LEU 162 N -0.70 0.05 0.10 1.67 3.38 -1.19 0.34 115.31 118.96 1x1b h LEU 162 Ca -0.03 0.01 -0.33 0.00 0.09 0.00 0.00 57.88 57.62 1x1b h LEU 162 Cb 0.49 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1x1b h LEU 162 CO 0.04 0.02 -1.80 -0.33 0.09 0.00 0.00 178.44 176.46 1x1b h GLU 163 N 0.05 0.21 0.00 1.13 5.08 -1.34 -3.42 114.58 116.29 1x1b h GLU 163 Ca 0.42 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1x1b h GLU 163 Cb 1.59 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.98 1x1b h GLU 163 CO -0.03 1.03 -0.71 0.39 -1.00 0.00 0.00 179.01 178.69 1x1b n GLU 164 N -3.38 2.26 -1.67 2.33 -0.58 -0.39 -5.03 120.64 114.18 1x1b n GLU 164 Ca -0.24 -0.01 -0.45 0.00 -0.42 0.00 0.00 57.16 56.04 1x1b n GLU 164 Cb 1.05 -0.87 -0.03 0.00 -0.57 0.00 0.00 31.44 31.02 1x1b n GLU 164 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1x1b n ALA 165 N -1.37 1.19 -3.59 0.62 0.00 0.12 -4.94 120.51 112.53 1x1b n ALA 165 Ca -0.00 0.42 -0.38 0.00 0.00 0.00 0.00 53.44 53.48 1x1b n ALA 165 Cb 0.02 -2.30 -0.11 0.00 0.00 0.00 0.00 19.45 17.07 1x1b n ALA 165 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1x1b s LYS 166 N -0.03 2.29 -0.05 0.00 1.02 -1.26 -4.90 119.74 116.82 1x1b s LYS 166 Ca 0.71 -1.65 0.07 0.00 0.02 0.00 0.00 55.97 55.12 1x1b s LYS 166 Cb -0.66 -3.65 0.10 0.00 -0.52 0.00 0.00 37.83 33.10 1x1b s LYS 166 CO 0.46 -1.01 1.00 1.28 -0.92 0.00 0.00 175.35 176.16 1x1b n LEU 167 N 4.74 0.97 -4.68 3.17 4.77 -1.26 -4.98 117.00 119.73 1x1b n LEU 167 Ca -0.07 -1.70 -0.45 0.00 -0.03 0.00 0.00 56.01 53.77 1x1b n LEU 167 Cb 0.42 -0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 41.33 1x1b n LEU 167 CO 0.36 0.40 1.15 -0.90 -1.33 0.00 0.00 177.39 177.07 1x1b n ASP 168 N -0.54 3.13 0.00 -1.43 5.68 -1.26 -0.19 116.55 121.93 1x1b n ASP 168 Ca 0.06 1.11 0.00 0.00 -0.50 0.00 0.00 54.79 55.45 1x1b n ASP 168 Cb 0.62 -1.46 0.00 0.00 -1.14 0.00 0.00 41.12 39.15 1x1b n ASP 168 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1x1b n GLY 169 N 2.91 0.88 3.66 6.12 0.00 -1.26 -4.99 105.19 112.51 1x1b n GLY 169 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1x1b n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x1b s VAL 170 N -3.60 5.16 -0.19 1.61 1.01 0.73 -4.95 120.40 120.18 1x1b s VAL 170 Ca 0.00 0.78 -0.09 0.00 0.00 0.00 0.00 61.98 62.67 1x1b s VAL 170 Cb 0.00 -3.77 -0.08 0.00 0.00 0.00 0.00 36.38 32.53 1x1b s VAL 170 CO 0.00 0.20 -0.24 1.17 0.00 0.00 0.00 175.10 176.24 1x1b n LYS 171 N 4.76 0.39 -3.98 2.72 3.00 -1.26 -4.24 118.16 119.55 1x1b n LYS 171 Ca -0.07 0.17 -0.34 0.00 -0.00 0.00 0.00 58.31 58.07 1x1b n LYS 171 Cb 0.51 -1.16 -0.14 0.00 0.00 0.00 0.00 35.03 34.23 1x1b n LYS 171 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1x1b s LYS 172 N -2.34 2.69 0.03 1.64 1.02 -1.26 -0.50 119.74 121.02 1x1b s LYS 172 Ca -0.26 -1.07 0.02 0.00 0.02 0.00 0.00 55.97 54.68 1x1b s LYS 172 Cb 0.10 -2.97 -0.04 0.00 -0.52 0.00 0.00 37.83 34.40 1x1b s LYS 172 CO 0.33 -0.45 0.04 1.41 -0.92 0.00 0.00 175.35 175.76 1x1b s MET 173 N 1.28 2.83 -0.22 1.68 -2.45 0.87 0.66 119.30 123.95 1x1b s MET 173 Ca -0.02 -0.64 -0.03 0.00 -1.25 0.00 0.00 55.69 53.75 1x1b s MET 173 Cb -0.17 -2.70 -0.00 0.00 1.25 0.00 0.00 34.83 33.20 1x1b s MET 173 CO -0.05 0.60 -0.06 0.42 1.05 0.00 0.00 175.02 176.99 1x1b s ILE 174 N -1.21 3.18 -0.56 10.11 1.01 -0.86 -1.24 121.20 131.62 1x1b s ILE 174 Ca 0.23 -0.60 -0.15 0.00 0.00 0.00 0.00 60.65 60.13 1x1b s ILE 174 Cb -0.12 -2.46 0.14 0.00 0.01 0.00 0.00 42.46 40.03 1x1b s ILE 174 CO 0.15 0.41 0.52 -0.62 0.00 0.00 0.00 174.94 175.39 1x1b s ASP 175 N 1.44 6.21 -0.39 3.58 3.68 -0.34 -1.33 116.67 129.52 1x1b s ASP 175 Ca 0.05 -1.89 -0.28 0.00 2.13 0.00 0.00 52.55 52.56 1x1b s ASP 175 Cb -0.14 -2.20 -0.00 0.00 -1.45 0.00 0.00 42.92 39.13 1x1b s ASP 175 CO -0.04 -0.82 1.59 -0.69 0.13 0.00 0.00 175.17 175.34 1x1b s VAL 176 N 1.44 3.70 -0.43 1.11 1.01 -0.41 -1.50 120.40 125.31 1x1b s VAL 176 Ca 0.05 0.70 -0.02 0.00 0.00 0.00 0.00 61.98 62.70 1x1b s VAL 176 Cb -0.28 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.15 1x1b s VAL 176 CO 0.02 -0.62 0.37 0.61 0.00 0.00 0.00 175.10 175.47 1x1b n GLY 177 N 5.25 0.42 0.01 4.51 0.00 -0.68 -4.28 105.19 110.43 1x1b n GLY 177 Ca 0.19 -0.36 0.02 0.00 0.00 0.00 0.00 46.02 45.87 1x1b n GLY 177 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x1b n GLY 178 N -1.00 -0.60 7.00 -0.02 0.00 -0.96 -4.81 105.19 104.79 1x1b n GLY 178 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1x1b n GLY 178 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x1b n GLY 179 N -1.24 -0.48 0.02 -0.02 0.00 -1.26 -3.50 105.19 98.71 1x1b n GLY 179 Ca 0.00 -1.09 0.08 0.00 0.00 0.00 0.00 46.02 45.02 1x1b n GLY 179 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1x1b n ILE 180 N 0.00 0.89 -0.15 -0.61 3.06 -1.26 -4.80 119.36 116.49 1x1b n ILE 180 Ca 0.00 0.22 0.00 0.00 -2.50 0.00 0.00 62.75 60.47 1x1b n ILE 180 Cb 0.00 -0.98 0.00 0.00 0.54 0.00 0.00 39.64 39.20 1x1b n ILE 180 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1x1b n GLY 181 N 0.14 0.92 0.22 4.50 0.00 -1.23 -4.28 105.19 105.45 1x1b n GLY 181 Ca 0.04 -0.07 -0.03 0.00 0.00 0.00 0.00 46.02 45.96 1x1b n GLY 181 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1x1b h ASP 182 N 0.00 0.40 0.49 1.61 5.19 -1.89 -1.92 116.42 120.30 1x1b h ASP 182 Ca 0.00 -0.15 -0.02 0.00 -0.62 0.00 0.00 57.03 56.24 1x1b h ASP 182 Cb 0.00 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 39.40 1x1b h ASP 182 CO 0.00 0.71 -0.24 0.40 -3.12 0.00 0.00 179.24 176.99 1x1b h ILE 183 N 0.34 0.18 -0.53 0.35 5.03 -1.94 -1.55 117.51 119.40 1x1b h ILE 183 Ca 0.04 -0.53 0.04 0.00 -0.12 0.00 0.00 64.86 64.29 1x1b h ILE 183 Cb 0.74 0.27 -0.03 0.00 -3.03 0.00 0.00 36.82 34.77 1x1b h ILE 183 CO 0.06 0.04 0.35 0.28 -0.68 0.00 0.00 178.15 178.19 1x1b h SER 184 N -1.10 0.50 -0.56 1.72 0.02 -1.89 -1.67 113.55 110.57 1x1b h SER 184 Ca -0.07 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.81 1x1b h SER 184 Cb 0.56 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.97 1x1b h SER 184 CO 0.11 0.34 0.09 0.00 -1.14 0.00 0.00 176.83 176.24 1x1b h ALA 185 N 1.70 0.74 -0.40 3.77 0.00 -1.34 0.56 119.26 124.29 1x1b h ALA 185 Ca 0.21 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1x1b h ALA 185 Cb 0.13 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1x1b h ALA 185 CO -0.06 0.48 0.07 0.00 0.00 0.00 0.00 179.25 179.74 1x1b h ALA 186 N 1.00 1.37 -0.38 0.00 0.00 -0.39 -2.23 119.26 118.63 1x1b h ALA 186 Ca 0.17 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1x1b h ALA 186 Cb 0.41 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1x1b h ALA 186 CO 0.01 0.45 -0.06 0.52 0.00 0.00 0.00 179.25 180.16 1x1b h MET 187 N 0.59 0.72 -0.74 0.00 2.86 -0.79 -2.81 114.93 114.76 1x1b h MET 187 Ca 0.13 -0.26 0.21 0.00 -2.06 0.00 0.00 59.70 57.72 1x1b h MET 187 Cb 0.27 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 1x1b h MET 187 CO 0.00 0.85 0.54 -0.07 1.06 0.00 0.00 176.91 179.30 1x1b h LEU 188 N 0.53 0.00 -0.59 1.22 -0.00 -0.28 0.39 115.31 116.58 1x1b h LEU 188 Ca 0.10 0.00 -0.15 0.00 -0.00 0.00 0.00 57.88 57.83 1x1b h LEU 188 Cb 0.57 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.21 1x1b h LEU 188 CO 0.03 0.00 -0.69 0.11 -0.00 0.00 0.00 178.44 177.89 1x1b h LYS 189 N 0.00 0.09 -0.17 1.13 6.56 -1.36 -3.25 116.57 119.58 1x1b h LYS 189 Ca 0.35 -0.08 0.00 0.00 -1.06 0.00 0.00 60.65 59.87 1x1b h LYS 189 Cb 1.43 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 33.11 1x1b h LYS 189 CO -0.00 0.74 0.00 0.72 -2.06 0.00 0.00 179.45 178.85 1x1b n HIS 190 N -3.76 0.20 -3.37 -1.35 8.25 0.12 -4.53 115.22 110.78 1x1b n HIS 190 Ca -0.02 -0.10 -0.27 0.00 -0.26 0.00 0.00 57.72 57.08 1x1b n HIS 190 Cb 0.67 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.69 1x1b n HIS 190 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1x1b n PHE 191 N 1.20 -0.66 -0.04 4.41 3.01 -0.42 -5.01 117.46 119.94 1x1b n PHE 191 Ca 0.17 -3.39 0.20 0.00 1.01 0.00 0.00 57.45 55.44 1x1b n PHE 191 Cb 0.56 0.12 0.34 0.00 -0.01 0.00 0.00 39.48 40.49 1x1b n PHE 191 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1x1b h PRO 192 N 5.32 0.00 -0.02 -1.08 0.11 -1.80 0.84 132.00 135.38 1x1b h PRO 192 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 1x1b h PRO 192 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1x1b h PRO 192 CO 0.40 0.00 -0.24 0.39 -0.21 0.00 0.00 178.00 178.35 1x1b n GLU 193 N -3.06 1.59 -2.19 1.05 1.02 -1.26 -5.01 120.64 112.79 1x1b n GLU 193 Ca 0.16 -1.19 -0.33 0.00 -0.02 0.00 0.00 57.16 55.78 1x1b n GLU 193 Cb 1.32 -1.36 -0.00 0.00 -0.02 0.00 0.00 31.44 31.37 1x1b n GLU 193 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1x1b s LEU 194 N -1.98 3.58 -0.06 -4.62 2.96 0.29 -4.59 118.68 114.25 1x1b s LEU 194 Ca 0.18 1.79 -0.03 0.00 -0.22 0.00 0.00 54.13 55.85 1x1b s LEU 194 Cb 0.15 -4.53 0.04 0.00 0.50 0.00 0.00 46.19 42.35 1x1b s LEU 194 CO 0.38 -1.00 0.10 -0.62 -1.32 0.00 0.00 176.35 173.90 1x1b s ASP 195 N -2.71 0.94 -0.10 3.68 -1.08 0.34 -4.95 116.67 112.78 1x1b s ASP 195 Ca 0.63 0.19 0.01 0.00 -0.52 0.00 0.00 52.55 52.86 1x1b s ASP 195 Cb -0.15 0.04 -0.02 0.00 -1.46 0.00 0.00 42.92 41.33 1x1b s ASP 195 CO 0.33 -0.24 -0.12 -0.55 0.52 0.00 0.00 175.17 175.11 1x1b s SER 196 N 2.18 4.17 -0.26 -0.34 0.15 -0.31 -0.09 113.70 119.19 1x1b s SER 196 Ca 0.04 -0.24 -0.01 0.00 0.70 0.00 0.00 55.95 56.44 1x1b s SER 196 Cb -0.12 -1.36 0.04 0.00 -1.71 0.00 0.00 66.02 62.86 1x1b s SER 196 CO -0.04 0.24 -0.05 -0.89 1.20 0.00 0.00 173.24 173.70 1x1b s THR 197 N -0.08 2.84 -0.28 6.45 2.01 -0.38 -2.12 115.64 124.07 1x1b s THR 197 Ca -0.01 -1.19 -0.22 0.00 0.31 0.00 0.00 61.69 60.58 1x1b s THR 197 Cb -0.14 -2.52 -0.01 0.00 0.01 0.00 0.00 72.50 69.85 1x1b s THR 197 CO 0.03 0.09 0.71 -0.63 -0.69 0.00 0.00 174.62 174.13 1x1b s ILE 198 N 1.28 4.89 0.02 1.82 1.01 0.11 -1.20 121.20 129.12 1x1b s ILE 198 Ca -0.02 1.15 -0.28 0.00 0.00 0.00 0.00 60.65 61.49 1x1b s ILE 198 Cb -0.18 -4.05 -0.04 0.00 0.01 0.00 0.00 42.46 38.20 1x1b s ILE 198 CO -0.04 -0.12 0.89 -0.76 0.00 0.00 0.00 174.94 174.91 1x1b s LEU 199 N 2.74 4.40 0.20 2.97 1.43 -0.56 -1.20 118.68 128.65 1x1b s LEU 199 Ca 0.29 1.56 -0.23 0.00 -1.03 0.00 0.00 54.13 54.73 1x1b s LEU 199 Cb -0.15 -3.42 0.06 0.00 0.03 0.00 0.00 46.19 42.71 1x1b s LEU 199 CO 0.10 -0.14 0.91 0.21 0.23 0.00 0.00 176.35 177.67 1x1b s ASN 200 N 0.55 -0.15 0.68 2.29 3.04 -0.77 -1.68 114.94 118.91 1x1b s ASN 200 Ca 0.46 -0.55 -0.17 0.00 0.04 0.00 0.00 52.86 52.63 1x1b s ASN 200 Cb -0.21 0.57 0.01 0.00 -1.54 0.00 0.00 41.25 40.07 1x1b s ASN 200 CO 0.26 -1.07 1.27 -0.76 -3.04 0.00 0.00 177.10 173.76 1x1b s LEU 201 N -3.02 3.49 0.21 3.21 1.43 -1.26 -3.35 118.68 119.38 1x1b s LEU 201 Ca 0.14 2.56 -0.11 0.00 -1.03 0.00 0.00 54.13 55.68 1x1b s LEU 201 Cb -0.03 -4.61 0.28 0.00 0.03 0.00 0.00 46.19 41.86 1x1b s LEU 201 CO 0.04 -2.11 1.68 -0.65 0.23 0.00 0.00 176.35 175.54 1x1b h PRO 202 N 0.28 0.14 0.00 1.29 0.11 -1.94 0.44 132.00 132.32 1x1b h PRO 202 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1x1b h PRO 202 Cb 1.33 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1x1b h PRO 202 CO 0.52 0.09 0.00 0.41 -0.21 0.00 0.00 178.00 178.81 1x1b n GLY 203 N -1.34 -0.42 0.01 -0.55 0.00 -1.26 -2.80 105.19 98.83 1x1b n GLY 203 Ca 0.08 -0.08 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1x1b n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x1b n ALA 204 N -1.02 2.27 -0.25 4.61 0.00 0.13 -4.49 120.51 121.76 1x1b n ALA 204 Ca 0.09 -0.28 0.05 0.00 0.00 0.00 0.00 53.44 53.30 1x1b n ALA 204 Cb 0.05 -0.28 0.16 0.00 0.00 0.00 0.00 19.45 19.39 1x1b n ALA 204 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1x1b h ILE 205 N 0.00 0.41 -0.49 0.00 1.08 -1.35 0.12 117.51 117.27 1x1b h ILE 205 Ca -0.04 -0.05 -0.06 0.00 -0.39 0.00 0.00 64.86 64.32 1x1b h ILE 205 Cb 0.61 0.24 -0.02 0.00 -3.07 0.00 0.00 36.82 34.57 1x1b h ILE 205 CO 0.00 0.03 0.06 0.44 -0.69 0.00 0.00 178.15 177.99 1x1b h ASP 206 N 0.15 0.74 -0.38 1.72 3.45 -1.84 -0.71 116.42 119.55 1x1b h ASP 206 Ca 0.41 -0.15 -0.05 0.00 0.43 0.00 0.00 57.03 57.66 1x1b h ASP 206 Cb 0.71 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 39.27 1x1b h ASP 206 CO -0.60 0.77 0.07 -0.07 -1.57 0.00 0.00 179.24 177.84 1x1b h LEU 207 N 0.74 0.66 -0.20 1.55 3.38 -1.12 0.08 115.31 120.41 1x1b h LEU 207 Ca 0.16 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 1x1b h LEU 207 Cb 0.37 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 1x1b h LEU 207 CO 0.01 0.69 -0.18 0.58 0.09 0.00 0.00 178.44 179.63 1x1b h VAL 208 N 0.68 1.33 -0.13 1.22 2.07 -0.49 -2.60 116.25 118.33 1x1b h VAL 208 Ca 0.15 -1.33 -0.12 0.00 0.82 0.00 0.00 66.70 66.22 1x1b h VAL 208 Cb 0.32 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 1x1b h VAL 208 CO 0.00 0.40 -0.44 0.78 0.02 0.00 0.00 177.57 178.34 1x1b h ASN 209 N 0.14 0.34 0.55 0.57 2.35 -0.83 -0.55 115.58 118.15 1x1b h ASN 209 Ca 0.03 -0.15 -0.09 0.00 -0.55 0.00 0.00 56.30 55.55 1x1b h ASN 209 Cb 0.71 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.98 1x1b h ASN 209 CO 0.04 0.73 -0.42 -0.33 -1.65 0.00 0.00 177.43 175.81 1x1b h GLU 210 N 0.26 0.00 -0.05 0.81 5.08 -0.99 -1.54 114.58 118.16 1x1b h GLU 210 Ca 0.02 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.25 1x1b h GLU 210 Cb 0.88 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.14 1x1b h GLU 210 CO 0.07 0.42 -0.49 -0.97 -1.00 0.00 0.00 179.01 177.04 1x1b h ASN 211 N 0.00 0.51 -0.96 1.42 -1.24 -1.07 -1.47 115.58 112.78 1x1b h ASN 211 Ca -0.00 -0.70 0.10 0.00 0.71 0.00 0.00 56.30 56.41 1x1b h ASN 211 Cb 0.81 -0.15 -0.08 0.00 0.73 0.00 0.00 38.32 39.63 1x1b h ASN 211 CO 0.05 1.14 0.60 0.00 -1.29 0.00 0.00 177.43 177.93 1x1b h ALA 212 N 0.38 1.40 -0.23 1.57 0.00 -0.80 -0.87 119.26 120.72 1x1b h ALA 212 Ca -0.05 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1x1b h ALA 212 Cb 1.17 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1x1b h ALA 212 CO 0.10 0.25 0.04 0.00 0.00 0.00 0.00 179.25 179.63 1x1b h ALA 213 N 1.50 0.31 -0.84 0.00 0.00 -1.16 0.55 119.26 119.61 1x1b h ALA 213 Ca 0.46 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 55.23 1x1b h ALA 213 Cb 0.38 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 1x1b h ALA 213 CO -0.24 -0.02 0.53 0.93 0.00 0.00 0.00 179.25 180.45 1x1b h GLU 214 N 0.19 0.98 -0.57 0.00 5.08 -0.35 -2.07 114.58 117.84 1x1b h GLU 214 Ca 0.07 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1x1b h GLU 214 Cb 0.32 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1x1b h GLU 214 CO 0.00 0.65 0.00 1.63 -1.00 0.00 0.00 179.01 180.29 1x1b n LYS 215 N -4.59 2.13 -2.38 2.33 5.02 -0.42 -4.91 118.16 115.34 1x1b n LYS 215 Ca 0.11 -1.16 -0.20 0.00 -2.02 0.00 0.00 58.31 55.04 1x1b n LYS 215 Cb 0.12 -1.52 -0.01 0.00 -0.02 0.00 0.00 35.03 33.60 1x1b n LYS 215 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1x1b n GLY 216 N 0.61 -0.43 0.72 0.72 0.00 -0.78 -4.89 105.19 101.13 1x1b n GLY 216 Ca 0.11 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.18 1x1b n GLY 216 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1x1b n VAL 217 N -3.88 1.48 0.00 1.61 0.24 0.13 -4.80 118.33 113.12 1x1b n VAL 217 Ca -0.23 -2.33 0.10 0.00 -2.04 0.00 0.00 64.34 59.84 1x1b n VAL 217 Cb 0.68 0.10 0.53 0.00 -1.47 0.00 0.00 33.84 33.68 1x1b n VAL 217 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1x1b h ALA 218 N 0.76 1.99 0.00 2.33 0.00 -1.75 0.97 119.26 123.57 1x1b h ALA 218 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1x1b h ALA 218 Cb 1.24 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1x1b h ALA 218 CO 0.02 -0.08 0.00 -0.25 0.00 0.00 0.00 179.25 178.95 1x1b n ASP 219 N -4.47 0.15 0.00 0.00 9.92 -1.26 -3.65 116.55 117.24 1x1b n ASP 219 Ca 0.06 0.52 0.00 0.00 -0.53 0.00 0.00 54.79 54.84 1x1b n ASP 219 Cb 0.27 -0.56 0.00 0.00 -0.64 0.00 0.00 41.12 40.19 1x1b n ASP 219 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1x1b n ARG 220 N -1.65 1.91 -4.99 -1.24 1.74 0.21 -5.03 116.66 107.60 1x1b n ARG 220 Ca 0.05 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.87 1x1b n ARG 220 Cb 0.30 -0.84 -0.16 0.00 -1.02 0.00 0.00 32.46 30.74 1x1b n ARG 220 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 1x1b s MET 221 N -1.61 1.66 0.15 5.56 1.75 0.31 -1.16 119.30 125.96 1x1b s MET 221 Ca 0.00 -0.72 -0.22 0.00 -1.25 0.00 0.00 55.69 53.50 1x1b s MET 221 Cb 0.00 -1.60 0.06 0.00 2.84 0.00 0.00 34.83 36.14 1x1b s MET 221 CO 0.00 0.43 0.56 -0.98 -0.65 0.00 0.00 175.02 174.38 1x1b s ARG 222 N -0.46 1.23 0.39 4.11 1.70 -0.90 -4.44 118.95 120.59 1x1b s ARG 222 Ca 0.07 -0.50 0.04 0.00 -0.47 0.00 0.00 55.73 54.88 1x1b s ARG 222 Cb -0.08 0.56 -0.00 0.00 -0.57 0.00 0.00 34.95 34.86 1x1b s ARG 222 CO -0.01 -0.53 0.57 0.20 -1.08 0.00 0.00 175.30 174.45 1x1b s GLY 223 N -2.72 1.62 -0.27 3.88 0.00 -1.26 -0.71 107.32 107.86 1x1b s GLY 223 Ca 0.01 -1.33 -0.18 0.00 0.00 0.00 0.00 44.72 43.22 1x1b s GLY 223 CO -0.12 -1.19 0.68 -1.50 0.00 0.00 0.00 173.10 170.97 1x1b s ILE 224 N -2.36 -0.00 -0.33 0.90 2.07 -0.34 -4.82 121.20 116.32 1x1b s ILE 224 Ca 0.48 0.00 -0.24 0.00 -1.41 0.00 0.00 60.65 59.48 1x1b s ILE 224 Cb -0.10 -0.98 0.01 0.00 0.13 0.00 0.00 42.46 41.52 1x1b s ILE 224 CO 0.34 0.00 0.81 0.00 -1.91 0.00 0.00 174.94 174.18 1x1b s ALA 225 N 1.23 3.48 -0.18 1.50 0.00 -1.26 -1.84 121.76 124.70 1x1b s ALA 225 Ca -0.07 -0.50 -0.13 0.00 0.00 0.00 0.00 51.96 51.26 1x1b s ALA 225 Cb -0.05 -3.35 0.05 0.00 0.00 0.00 0.00 23.12 19.77 1x1b s ALA 225 CO -0.13 -1.34 0.45 0.08 0.00 0.00 0.00 175.76 174.82 1x1b s VAL 226 N 3.07 -0.01 -0.33 0.00 1.01 -1.21 -4.95 120.40 117.98 1x1b s VAL 226 Ca 0.33 0.04 -0.29 0.00 0.00 0.00 0.00 61.98 62.06 1x1b s VAL 226 Cb -0.14 -0.65 0.02 0.00 0.00 0.00 0.00 36.38 35.61 1x1b s VAL 226 CO 0.15 0.02 1.10 -0.62 0.00 0.00 0.00 175.10 175.74 1x1b s ASP 227 N 0.82 6.89 0.50 3.32 2.15 -1.26 -4.09 116.67 125.00 1x1b s ASP 227 Ca -0.05 1.03 0.16 0.00 0.43 0.00 0.00 52.55 54.12 1x1b s ASP 227 Cb -0.05 -2.54 1.22 0.00 -0.30 0.00 0.00 42.92 41.24 1x1b s ASP 227 CO -0.06 -0.92 2.10 0.16 -0.17 0.00 0.00 175.17 176.27 1x1b h ILE 228 N 5.79 0.96 0.00 4.11 3.07 -1.94 -2.75 117.51 126.75 1x1b h ILE 228 Ca -0.21 -0.04 0.00 0.00 1.55 0.00 0.00 64.86 66.16 1x1b h ILE 228 Cb 1.06 0.84 0.00 0.00 -0.27 0.00 0.00 36.82 38.46 1x1b h ILE 228 CO 1.04 0.02 -0.08 1.88 -1.05 0.00 0.00 178.15 179.96 1x1b h TYR 229 N 0.11 0.00 0.36 0.16 -1.99 -2.02 -3.43 116.97 110.16 1x1b h TYR 229 Ca 0.08 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.80 1x1b h TYR 229 Cb 0.20 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.92 1x1b h TYR 229 CO -0.00 0.00 -0.25 0.87 -0.00 0.00 0.00 178.16 178.78 1x1b h LYS 230 N -0.30 -0.55 -7.22 4.88 1.57 -2.00 -3.45 116.57 109.50 1x1b h LYS 230 Ca 0.00 0.04 -0.51 0.00 -1.87 0.00 0.00 60.65 58.31 1x1b h LYS 230 Cb 0.08 0.13 0.20 0.00 0.08 0.00 0.00 32.23 32.72 1x1b h LYS 230 CO 0.00 -0.37 0.13 0.39 -0.57 0.00 0.00 179.45 179.03 1x1b n GLU 231 N -3.83 -0.76 -3.47 3.15 1.02 -1.04 -5.03 120.64 110.69 1x1b n GLU 231 Ca -0.07 -0.16 -0.38 0.00 -0.02 0.00 0.00 57.16 56.53 1x1b n GLU 231 Cb 0.24 -2.32 -0.06 0.00 -0.02 0.00 0.00 31.44 29.29 1x1b n GLU 231 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1x1b s SER 232 N -2.57 6.84 0.72 1.62 1.04 -1.26 -4.80 113.70 115.29 1x1b s SER 232 Ca 0.67 1.01 -0.11 0.00 0.48 0.00 0.00 55.95 57.99 1x1b s SER 232 Cb -0.23 -2.26 0.02 0.00 0.10 0.00 0.00 66.02 63.65 1x1b s SER 232 CO 0.60 0.30 1.08 -0.31 0.98 0.00 0.00 173.24 175.89 1x1b s TYR 233 N -1.12 3.17 0.87 5.02 2.02 -1.26 -4.99 117.35 121.06 1x1b s TYR 233 Ca 0.25 1.17 -0.13 0.00 -0.37 0.00 0.00 57.07 58.00 1x1b s TYR 233 Cb -0.17 -3.01 0.13 0.00 -0.40 0.00 0.00 41.96 38.51 1x1b s TYR 233 CO 0.15 -1.32 1.21 -2.14 -1.57 0.00 0.00 175.55 171.88 1x1b s PRO 234 N -5.22 1.41 0.28 -1.71 0.02 -1.26 -4.87 135.00 123.65 1x1b s PRO 234 Ca 0.59 -0.01 -0.29 0.00 0.02 0.00 0.00 61.00 61.31 1x1b s PRO 234 Cb -0.13 -1.90 -0.10 0.00 0.02 0.00 0.00 34.50 32.40 1x1b s PRO 234 CO 0.53 -1.95 1.24 -1.83 -0.33 0.00 0.00 177.00 174.66 1x1b s GLU 235 N -5.62 4.45 -0.14 5.54 1.03 -1.26 -4.84 118.70 117.86 1x1b s GLU 235 Ca 0.66 2.04 -0.30 0.00 0.03 0.00 0.00 54.97 57.40 1x1b s GLU 235 Cb -0.10 -3.14 0.12 0.00 -0.80 0.00 0.00 34.13 30.21 1x1b s GLU 235 CO 0.51 -0.08 0.97 0.00 -1.33 0.00 0.00 175.26 175.33 1x1b s ALA 236 N -0.79 -1.92 0.29 -0.84 0.00 -1.21 -4.95 121.76 112.35 1x1b s ALA 236 Ca 0.50 1.52 0.30 0.00 0.00 0.00 0.00 51.96 54.28 1x1b s ALA 236 Cb -0.36 -0.56 1.41 0.00 0.00 0.00 0.00 23.12 23.61 1x1b s ALA 236 CO 0.45 -0.35 2.02 -0.44 0.00 0.00 0.00 175.76 177.44 1x1b h ASP 237 N 2.52 0.00 -5.14 0.00 3.32 -0.06 -3.41 116.42 113.65 1x1b h ASP 237 Ca -0.19 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.81 1x1b h ASP 237 Cb 1.17 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.61 1x1b h ASP 237 CO 0.31 0.10 -0.09 0.00 -1.72 0.00 0.00 179.24 177.85 1x1b s ALA 238 N -3.91 -0.64 -0.03 3.45 0.00 -1.06 -1.96 121.76 117.61 1x1b s ALA 238 Ca -0.01 -0.42 -0.01 0.00 0.00 0.00 0.00 51.96 51.52 1x1b s ALA 238 Cb 0.11 0.84 0.03 0.00 0.00 0.00 0.00 23.12 24.10 1x1b s ALA 238 CO 0.57 -0.74 0.04 0.08 0.00 0.00 0.00 175.76 175.70 1x1b s VAL 239 N -3.90 -0.03 -0.17 0.00 1.01 -1.00 -2.03 120.40 114.28 1x1b s VAL 239 Ca 0.11 0.30 -0.03 0.00 0.00 0.00 0.00 61.98 62.37 1x1b s VAL 239 Cb 0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 36.38 36.21 1x1b s VAL 239 CO -0.03 0.15 -0.07 -0.22 0.00 0.00 0.00 175.10 174.94 1x1b s LEU 240 N 1.67 2.96 -0.63 3.92 2.96 -0.44 -0.70 118.68 128.40 1x1b s LEU 240 Ca -0.01 -0.29 -0.05 0.00 -0.22 0.00 0.00 54.13 53.56 1x1b s LEU 240 Cb -0.13 -1.71 0.16 0.00 0.50 0.00 0.00 46.19 45.02 1x1b s LEU 240 CO -0.03 0.10 0.47 -0.36 -1.32 0.00 0.00 176.35 175.21 1x1b s PHE 241 N 0.76 3.48 -0.29 5.38 0.08 -0.74 -1.29 117.98 125.36 1x1b s PHE 241 Ca -0.03 -2.50 -0.15 0.00 0.12 0.00 0.00 56.93 54.38 1x1b s PHE 241 Cb -0.15 -3.34 -0.03 0.00 -0.57 0.00 0.00 43.02 38.93 1x1b s PHE 241 CO 0.02 -0.89 0.37 0.00 -0.10 0.00 0.00 175.22 174.62 1x1b n ARG 243 N 5.35 -3.91 -0.00 0.00 1.74 0.31 -4.85 116.66 115.31 1x1b n ARG 243 Ca -0.09 0.61 -0.01 0.00 -0.77 0.00 0.00 57.85 57.60 1x1b n ARG 243 Cb 0.50 -5.37 -0.00 0.00 -1.02 0.00 0.00 32.46 26.57 1x1b n ARG 243 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1x1b n ILE 244 N -4.13 0.22 0.39 0.55 5.41 -1.26 -4.72 119.36 115.82 1x1b n ILE 244 Ca -0.04 0.22 0.00 0.00 1.00 0.00 0.00 62.75 63.93 1x1b n ILE 244 Cb 0.57 -1.33 0.00 0.00 -0.71 0.00 0.00 39.64 38.17 1x1b n ILE 244 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1x1b n LEU 245 N -2.73 0.38 0.00 1.39 4.32 -1.26 -3.73 117.00 115.37 1x1b n LEU 245 Ca -0.01 -0.19 0.11 0.00 -0.02 0.00 0.00 56.01 55.90 1x1b n LEU 245 Cb 0.04 -0.19 0.59 0.00 -1.62 0.00 0.00 43.42 42.24 1x1b n LEU 245 CO 0.01 0.09 0.86 0.00 -1.22 0.00 0.00 177.39 177.14 1x1b n TYR 246 N 0.29 0.00 0.00 -1.77 0.18 -1.26 -4.13 117.16 110.47 1x1b n TYR 246 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 1x1b n TYR 246 Cb 0.09 -0.22 0.00 0.00 -0.38 0.00 0.00 39.34 38.84 1x1b n TYR 246 CO 0.00 0.00 0.00 0.43 -2.08 0.00 0.00 176.86 175.21 1x1b n SER 247 N -1.22 4.08 -4.78 9.48 7.64 -1.24 -4.93 113.62 122.65 1x1b n SER 247 Ca 0.12 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.65 1x1b n SER 247 Cb 0.15 0.17 -0.00 0.00 -1.01 0.00 0.00 64.21 63.52 1x1b n SER 247 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x1b s ALA 248 N -1.93 2.71 1.27 -0.43 0.00 -1.26 -1.83 121.76 120.30 1x1b s ALA 248 Ca 0.00 0.77 -0.18 0.00 0.00 0.00 0.00 51.96 52.55 1x1b s ALA 248 Cb 0.00 -3.34 0.27 0.00 0.00 0.00 0.00 23.12 20.06 1x1b s ALA 248 CO 0.00 -0.72 0.84 0.27 0.00 0.00 0.00 175.76 176.15 1x1b n ASN 249 N -1.31 -2.55 0.27 0.00 0.23 -1.26 -4.66 115.26 105.97 1x1b n ASN 249 Ca 0.11 -0.94 -0.12 0.00 -0.53 0.00 0.00 54.58 53.10 1x1b n ASN 249 Cb 0.51 -0.82 -0.06 0.00 -2.08 0.00 0.00 39.78 37.33 1x1b n ASN 249 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1x1b h GLU 250 N 0.00 -0.70 -0.53 -3.83 5.08 -1.97 0.15 114.58 112.78 1x1b h GLU 250 Ca -0.33 0.05 0.07 0.00 -1.00 0.00 0.00 59.36 58.15 1x1b h GLU 250 Cb 1.05 0.16 -0.06 0.00 0.50 0.00 0.00 28.75 30.40 1x1b h GLU 250 CO 0.21 -0.43 0.19 0.37 -1.00 0.00 0.00 179.01 178.35 1x1b h GLN 251 N -1.15 0.36 0.39 2.33 5.75 -1.95 4.39 115.11 125.23 1x1b h GLN 251 Ca -0.07 -0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.40 1x1b h GLN 251 Cb 0.59 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 29.03 1x1b h GLN 251 CO 0.12 0.24 -0.38 1.25 -2.65 0.00 0.00 178.83 177.41 1x1b h LEU 252 N 0.38 -1.03 -1.93 -2.39 6.46 -1.94 2.30 115.31 117.16 1x1b h LEU 252 Ca 0.25 0.09 0.04 0.00 -0.12 0.00 0.00 57.88 58.14 1x1b h LEU 252 Cb 0.28 0.34 -0.01 0.00 -0.73 0.00 0.00 40.66 40.54 1x1b h LEU 252 CO -0.26 -0.53 0.13 0.28 -0.62 0.00 0.00 178.44 177.45 1x1b h SER 253 N -0.79 0.08 -0.03 1.25 0.02 0.53 0.39 113.55 114.99 1x1b h SER 253 Ca -0.03 -0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.67 1x1b h SER 253 Cb 0.70 -0.02 0.02 0.00 0.14 0.00 0.00 62.40 63.24 1x1b h SER 253 CO -0.06 0.05 -0.95 0.74 -1.14 0.00 0.00 176.83 175.47 1x1b h THR 254 N 0.09 1.28 -0.04 -2.27 2.02 1.01 1.25 112.91 116.26 1x1b h THR 254 Ca 0.08 -2.16 -0.09 0.00 0.77 0.00 0.00 66.41 65.01 1x1b h THR 254 Cb 0.22 2.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.86 1x1b h THR 254 CO -0.01 0.67 -0.39 -0.29 0.37 0.00 0.00 175.52 175.88 1x1b h ILE 255 N 0.44 1.29 0.34 3.11 6.09 0.53 1.45 117.51 130.76 1x1b h ILE 255 Ca -0.10 -1.39 -0.02 0.00 -1.37 0.00 0.00 64.86 61.98 1x1b h ILE 255 Cb 1.60 1.70 0.00 0.00 0.47 0.00 0.00 36.82 40.59 1x1b h ILE 255 CO 0.19 0.40 -0.16 0.24 -3.07 0.00 0.00 178.15 175.75 1x1b h MET 256 N 0.07 -0.44 0.00 2.19 2.86 0.01 0.14 114.93 119.76 1x1b h MET 256 Ca 0.01 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1x1b h MET 256 Cb 0.72 0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.48 1x1b h MET 256 CO 0.05 -0.29 0.00 0.00 1.06 0.00 0.00 176.91 177.73 1x1b h LYS 258 N 0.00 0.23 -0.66 0.00 3.64 0.22 -0.78 116.57 119.21 1x1b h LYS 258 Ca 0.00 -0.39 -0.05 0.00 -1.27 0.00 0.00 60.65 58.94 1x1b h LYS 258 Cb 0.02 0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 1x1b h LYS 258 CO 0.00 1.08 0.21 0.87 -2.27 0.00 0.00 179.45 179.34 1x1b h LYS 259 N 0.06 1.01 -0.35 1.90 1.57 0.11 3.09 116.57 123.96 1x1b h LYS 259 Ca -0.37 -0.20 -0.11 0.00 -1.87 0.00 0.00 60.65 58.10 1x1b h LYS 259 Cb 2.04 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 34.18 1x1b h LYS 259 CO 0.10 0.86 -0.23 0.00 -0.57 0.00 0.00 179.45 179.62 1x1b h ALA 260 N 1.25 0.95 0.23 3.86 0.00 -1.36 -0.68 119.26 123.52 1x1b h ALA 260 Ca 0.22 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1x1b h ALA 260 Cb 0.27 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1x1b h ALA 260 CO -0.01 0.61 -0.11 0.35 0.00 0.00 0.00 179.25 180.09 1x1b h PHE 261 N 0.59 -0.29 0.00 0.00 3.04 0.54 -2.84 116.94 117.99 1x1b h PHE 261 Ca 0.08 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.03 1x1b h PHE 261 Cb 0.71 0.10 0.00 0.00 2.56 0.00 0.00 35.95 39.32 1x1b h PHE 261 CO 0.03 0.09 0.00 -0.25 -2.02 0.00 0.00 178.31 176.16 1x1b n ASP 262 N -5.01 0.25 -0.24 0.41 10.43 1.01 -2.17 116.55 121.24 1x1b n ASP 262 Ca -0.08 0.61 0.10 0.00 2.57 0.00 0.00 54.79 57.99 1x1b n ASP 262 Cb 0.26 -0.65 0.16 0.00 1.84 0.00 0.00 41.12 42.74 1x1b n ASP 262 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1x1b n ALA 263 N -1.62 2.41 0.04 2.24 0.00 -0.27 -4.78 120.51 118.53 1x1b n ALA 263 Ca -0.00 -2.56 0.00 0.00 0.00 0.00 0.00 53.44 50.88 1x1b n ALA 263 Cb 0.04 -0.45 -0.00 0.00 0.00 0.00 0.00 19.45 19.04 1x1b n ALA 263 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1x1b n MET 264 N -1.25 4.20 0.00 0.00 1.56 -0.92 -3.29 117.12 117.42 1x1b n MET 264 Ca 0.17 -0.18 0.00 0.00 -0.27 0.00 0.00 57.70 57.42 1x1b n MET 264 Cb 0.69 -0.70 0.00 0.00 2.15 0.00 0.00 33.22 35.36 1x1b n MET 264 CO 0.00 0.00 0.00 -2.13 -0.73 0.00 0.00 175.97 173.11 1x1b n ARG 265 N -0.66 0.00 -4.10 2.12 3.00 -1.26 -4.17 116.66 111.58 1x1b n ARG 265 Ca 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.51 1x1b n ARG 265 Cb 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 32.46 32.34 1x1b n ARG 265 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1x1b s SER 266 N -4.00 4.60 0.00 6.15 1.04 -1.26 -4.06 113.70 116.17 1x1b s SER 266 Ca 0.00 -0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.17 1x1b s SER 266 Cb 0.00 -1.78 0.00 0.00 0.10 0.00 0.00 66.02 64.34 1x1b s SER 266 CO 0.00 0.05 0.00 0.61 0.98 0.00 0.00 173.24 174.88 1x1b n GLY 267 N 4.31 1.13 3.67 7.32 0.00 0.11 -4.97 105.19 116.75 1x1b n GLY 267 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 1x1b n GLY 267 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1x1b s GLY 268 N -1.28 1.64 -0.18 -0.02 0.00 -1.26 -4.72 107.32 101.49 1x1b s GLY 268 Ca 0.00 0.82 -0.25 0.00 0.00 0.00 0.00 44.72 45.29 1x1b s GLY 268 CO 0.00 2.78 0.82 0.50 0.00 0.00 0.00 173.10 177.20 1x1b s ARG 269 N 3.46 4.27 -0.11 2.90 0.52 -0.83 -2.58 118.95 126.59 1x1b s ARG 269 Ca 0.67 0.98 -0.11 0.00 -0.52 0.00 0.00 55.73 56.75 1x1b s ARG 269 Cb -0.30 -3.59 -0.05 0.00 0.52 0.00 0.00 34.95 31.54 1x1b s ARG 269 CO 0.25 -0.35 0.25 -1.17 0.02 0.00 0.00 175.30 174.30 1x1b s LEU 270 N 2.24 4.36 0.05 2.53 1.98 -0.21 -2.37 118.68 127.26 1x1b s LEU 270 Ca 0.37 0.59 0.06 0.00 -2.89 0.00 0.00 54.13 52.26 1x1b s LEU 270 Cb -0.16 -2.29 -0.03 0.00 0.66 0.00 0.00 46.19 44.38 1x1b s LEU 270 CO 0.11 0.29 -0.17 -0.76 -1.89 0.00 0.00 176.35 173.93 1x1b s LEU 271 N -0.54 2.20 -0.20 -0.68 1.02 0.12 -1.57 118.68 119.03 1x1b s LEU 271 Ca 0.17 -0.52 -0.04 0.00 0.02 0.00 0.00 54.13 53.76 1x1b s LEU 271 Cb -0.13 -0.74 0.09 0.00 0.02 0.00 0.00 46.19 45.43 1x1b s LEU 271 CO 0.06 0.06 0.21 -0.63 0.02 0.00 0.00 176.35 176.07 1x1b s ILE 272 N -0.92 -0.30 -0.37 -0.59 1.01 -0.45 -1.80 121.20 117.77 1x1b s ILE 272 Ca 0.04 -0.12 -0.04 0.00 0.00 0.00 0.00 60.65 60.53 1x1b s ILE 272 Cb -0.09 -0.67 0.08 0.00 0.01 0.00 0.00 42.46 41.80 1x1b s ILE 272 CO 0.02 -0.21 0.15 -0.22 0.00 0.00 0.00 174.94 174.68 1x1b s LEU 273 N 2.31 4.78 0.55 2.97 1.98 -0.72 -1.17 118.68 129.39 1x1b s LEU 273 Ca 0.06 -1.65 0.08 0.00 -2.89 0.00 0.00 54.13 49.73 1x1b s LEU 273 Cb -0.16 -1.83 0.06 0.00 0.66 0.00 0.00 46.19 44.92 1x1b s LEU 273 CO -0.12 -0.45 0.59 -1.81 -1.89 0.00 0.00 176.35 172.68 1x1b s ASP 274 N 1.68 4.88 0.39 3.68 1.01 -0.54 0.11 116.67 127.89 1x1b s ASP 274 Ca 0.03 -1.03 0.01 0.00 0.71 0.00 0.00 52.55 52.27 1x1b s ASP 274 Cb -0.22 0.32 -0.01 0.00 1.01 0.00 0.00 42.92 44.02 1x1b s ASP 274 CO -0.02 -1.20 0.59 -0.04 0.21 0.00 0.00 175.17 174.71 1x1b s MET 275 N -4.46 3.22 -0.37 8.23 -1.94 -1.26 -1.15 119.30 121.57 1x1b s MET 275 Ca 0.48 -0.52 -0.29 0.00 -1.71 0.00 0.00 55.69 53.65 1x1b s MET 275 Cb -0.04 -2.64 0.02 0.00 2.01 0.00 0.00 34.83 34.18 1x1b s MET 275 CO 0.30 -0.06 1.12 0.08 -0.01 0.00 0.00 175.02 176.45 1x1b s VAL 276 N -2.41 4.37 -0.68 -6.03 1.01 0.19 -4.64 120.40 112.22 1x1b s VAL 276 Ca 0.45 1.53 0.06 0.00 0.00 0.00 0.00 61.98 64.02 1x1b s VAL 276 Cb -0.10 -4.45 0.10 0.00 0.00 0.00 0.00 36.38 31.94 1x1b s VAL 276 CO 0.36 -0.65 0.89 2.30 0.00 0.00 0.00 175.10 178.00 1x1b n ILE 277 N 6.22 0.42 0.43 2.22 -5.35 -1.26 -4.29 119.36 117.74 1x1b n ILE 277 Ca 0.12 -0.71 0.05 0.00 -0.27 0.00 0.00 62.75 61.94 1x1b n ILE 277 Cb 0.48 0.87 -0.01 0.00 -1.74 0.00 0.00 39.64 39.24 1x1b n ILE 277 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1x1b n ASP 278 N 0.24 1.12 -4.56 7.28 3.85 -1.26 -4.69 116.55 118.52 1x1b n ASP 278 Ca 0.05 -1.06 -0.39 0.00 -0.71 0.00 0.00 54.79 52.68 1x1b n ASP 278 Cb 0.24 0.52 -0.03 0.00 -1.35 0.00 0.00 41.12 40.50 1x1b n ASP 278 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1x1b s ASP 279 N -1.38 5.32 0.50 -1.12 2.15 -1.26 -4.86 116.67 116.02 1x1b s ASP 279 Ca 0.08 0.69 0.29 0.00 0.43 0.00 0.00 52.55 54.04 1x1b s ASP 279 Cb 0.08 -2.52 1.39 0.00 -0.30 0.00 0.00 42.92 41.56 1x1b s ASP 279 CO 0.26 -2.27 1.83 -0.65 -0.17 0.00 0.00 175.17 174.16 1x1b h PRO 280 N 15.03 0.12 0.00 4.34 0.11 -2.01 0.86 132.00 150.45 1x1b h PRO 280 Ca -0.28 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1x1b h PRO 280 Cb 1.18 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1x1b h PRO 280 CO 1.16 0.08 0.00 0.39 -0.21 0.00 0.00 178.00 179.42 1x1b n GLU 281 N -4.34 0.11 -3.35 1.05 4.71 -1.26 -4.47 120.64 113.09 1x1b n GLU 281 Ca 0.23 0.16 -0.15 0.00 -0.01 0.00 0.00 57.16 57.39 1x1b n GLU 281 Cb 1.03 -1.64 -0.07 0.00 -1.01 0.00 0.00 31.44 29.75 1x1b n GLU 281 CO 0.00 0.00 0.00 -0.80 0.09 0.00 0.00 177.13 176.42 1x1b s ASN 282 N -3.63 0.94 0.53 1.62 0.01 0.30 -5.14 114.94 109.57 1x1b s ASN 282 Ca 0.11 -1.31 -0.18 0.00 -0.71 0.00 0.00 52.86 50.77 1x1b s ASN 282 Cb 0.14 0.71 -0.07 0.00 0.41 0.00 0.00 41.25 42.45 1x1b s ASN 282 CO 0.49 -0.28 1.02 -2.84 -1.51 0.00 0.00 177.10 173.99 1x1b s PRO 283 N 1.68 3.70 -0.35 -0.60 0.02 -1.22 -4.32 135.00 133.91 1x1b s PRO 283 Ca 0.15 1.17 -0.20 0.00 0.02 0.00 0.00 61.00 62.14 1x1b s PRO 283 Cb -0.14 -2.09 0.00 0.00 0.02 0.00 0.00 34.50 32.29 1x1b s PRO 283 CO -0.10 -0.49 0.62 1.21 -0.33 0.00 0.00 177.00 177.91 1x1b s ASN 284 N -2.59 6.41 0.14 2.53 3.84 -1.26 -4.93 114.94 119.08 1x1b s ASN 284 Ca 0.63 0.14 -0.00 0.00 0.21 0.00 0.00 52.86 53.83 1x1b s ASN 284 Cb -0.14 -2.32 -0.09 0.00 -0.55 0.00 0.00 41.25 38.15 1x1b s ASN 284 CO 0.28 -0.57 1.31 -0.26 -2.79 0.00 0.00 177.10 175.07 1x1b h PHE 285 N 8.44 0.40 -0.90 0.43 -1.00 -1.95 -1.37 116.94 121.00 1x1b h PHE 285 Ca -0.27 -0.24 0.12 0.00 2.81 0.00 0.00 57.97 60.40 1x1b h PHE 285 Cb 1.11 -0.04 -0.07 0.00 3.61 0.00 0.00 35.95 40.57 1x1b h PHE 285 CO 0.75 1.08 0.58 0.22 -1.61 0.00 0.00 178.31 179.33 1x1b h ASP 286 N 0.13 0.74 -0.14 2.17 1.82 -1.99 0.86 116.42 120.00 1x1b h ASP 286 Ca -0.07 0.03 -0.14 0.00 -0.39 0.00 0.00 57.03 56.47 1x1b h ASP 286 Cb 1.63 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 41.53 1x1b h ASP 286 CO 0.15 0.40 -0.46 0.22 -1.61 0.00 0.00 179.24 177.94 1x1b h TYR 287 N 0.79 0.73 -0.54 0.28 3.20 -1.93 -3.12 116.97 116.39 1x1b h TYR 287 Ca 0.44 -0.30 -0.07 0.00 3.14 0.00 0.00 58.73 61.94 1x1b h TYR 287 Cb 0.58 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.70 1x1b h TYR 287 CO -0.00 1.06 0.05 -0.07 -1.64 0.00 0.00 178.16 177.56 1x1b h LEU 288 N 0.19 0.84 -0.89 2.82 4.07 0.01 0.88 115.31 123.22 1x1b h LEU 288 Ca -0.02 -0.19 0.07 0.00 0.08 0.00 0.00 57.88 57.82 1x1b h LEU 288 Cb 1.08 -0.22 -0.07 0.00 1.08 0.00 0.00 40.66 42.54 1x1b h LEU 288 CO 0.10 0.87 0.56 0.77 -1.08 0.00 0.00 178.44 179.65 1x1b h SER 289 N 0.82 0.86 -0.22 -0.43 4.64 0.70 0.75 113.55 120.68 1x1b h SER 289 Ca 0.16 0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 61.39 1x1b h SER 289 Cb 0.42 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1x1b h SER 289 CO 0.01 0.54 -0.33 0.45 -0.87 0.00 0.00 176.83 176.63 1x1b h HIS 290 N 0.99 0.75 -0.22 4.77 3.86 -1.37 -3.18 115.15 120.75 1x1b h HIS 290 Ca 0.40 -0.25 0.03 0.00 -1.16 0.00 0.00 60.37 59.39 1x1b h HIS 290 Cb 0.22 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 28.51 1x1b h HIS 290 CO -0.03 0.99 0.03 -0.92 0.86 0.00 0.00 177.93 178.86 1x1b h TYR 291 N 0.30 0.05 0.00 2.45 5.03 0.11 -1.43 116.97 123.48 1x1b h TYR 291 Ca 0.02 0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.34 1x1b h TYR 291 Cb 0.92 0.01 -0.00 0.00 1.55 0.00 0.00 36.73 39.21 1x1b h TYR 291 CO 0.08 0.01 -0.01 0.97 -1.32 0.00 0.00 178.16 177.89 1x1b h ILE 292 N 0.11 0.54 0.00 1.81 6.09 0.36 0.51 117.51 126.93 1x1b h ILE 292 Ca 0.10 -0.05 0.00 0.00 -1.37 0.00 0.00 64.86 63.54 1x1b h ILE 292 Cb 0.11 1.03 0.00 0.00 0.47 0.00 0.00 36.82 38.43 1x1b h ILE 292 CO -0.15 0.01 0.17 -0.07 -3.07 0.00 0.00 178.15 175.05 1x1b h LEU 293 N 0.00 0.00 -1.52 2.19 4.07 -1.24 0.25 115.31 119.06 1x1b h LEU 293 Ca -0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 1x1b h LEU 293 Cb 0.03 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.77 1x1b h LEU 293 CO 0.00 0.00 -0.03 1.23 -1.08 0.00 0.00 178.44 178.56 1x1b h GLY 294 N 0.00 0.00 2.00 0.83 0.00 -0.98 -1.95 103.07 102.97 1x1b h GLY 294 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1x1b h GLY 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 1x1b n ALA 295 N -2.11 1.73 0.86 3.60 0.00 0.87 -1.69 120.51 123.77 1x1b n ALA 295 Ca 0.00 -0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.54 1x1b n ALA 295 Cb 0.30 -1.31 0.09 0.00 0.00 0.00 0.00 19.45 18.54 1x1b n ALA 295 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x1b n GLY 296 N 0.15 0.75 3.71 0.00 0.00 -0.73 -3.67 105.19 105.40 1x1b n GLY 296 Ca 0.03 -0.61 -0.35 0.00 0.00 0.00 0.00 46.02 45.09 1x1b n GLY 296 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1x1b s MET 297 N -1.76 3.22 0.27 1.61 -1.94 -0.68 -1.39 119.30 118.63 1x1b s MET 297 Ca 0.25 -0.34 0.00 0.00 -1.71 0.00 0.00 55.69 53.89 1x1b s MET 297 Cb 0.18 -2.93 0.61 0.00 2.01 0.00 0.00 34.83 34.70 1x1b s MET 297 CO 0.27 0.65 1.70 -1.00 -0.01 0.00 0.00 175.02 176.63 1x1b h PRO 298 N 5.35 0.38 -2.52 2.03 0.13 -1.93 -3.36 132.00 132.08 1x1b h PRO 298 Ca -0.49 -0.02 -0.19 0.00 -0.87 0.00 0.00 66.00 64.42 1x1b h PRO 298 Cb 1.20 -0.09 -0.31 0.00 0.13 0.00 0.00 31.00 31.93 1x1b h PRO 298 CO 0.57 0.25 -0.50 -0.59 -0.23 0.00 0.00 178.00 177.50 1x1b s PHE 299 N -5.95 -0.56 0.43 1.56 -0.12 -1.26 -5.14 117.98 106.94 1x1b s PHE 299 Ca -0.12 0.93 -0.22 0.00 -0.05 0.00 0.00 56.93 57.47 1x1b s PHE 299 Cb 0.23 -0.01 -0.10 0.00 -0.63 0.00 0.00 43.02 42.52 1x1b s PHE 299 CO 0.77 -0.50 0.99 0.45 -0.05 0.00 0.00 175.22 176.88 1x1b s SER 300 N 2.47 6.77 -0.10 1.98 0.15 -1.26 -4.96 113.70 118.75 1x1b s SER 300 Ca 0.04 1.82 0.12 0.00 0.70 0.00 0.00 55.95 58.63 1x1b s SER 300 Cb -0.13 -2.56 -0.17 0.00 -1.71 0.00 0.00 66.02 61.45 1x1b s SER 300 CO -0.12 -0.48 0.10 1.33 1.20 0.00 0.00 173.24 175.27 1x1b n VAL 301 N -0.56 0.68 -2.12 4.45 0.24 -1.26 -4.98 118.33 114.79 1x1b n VAL 301 Ca 0.07 -0.49 -0.42 0.00 -2.04 0.00 0.00 64.34 61.46 1x1b n VAL 301 Cb 0.53 -0.48 -0.03 0.00 -1.47 0.00 0.00 33.84 32.39 1x1b n VAL 301 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1x1b s LEU 302 N -4.72 4.37 0.43 1.34 1.43 -1.26 -4.86 118.68 115.40 1x1b s LEU 302 Ca -0.06 2.38 0.04 0.00 -1.03 0.00 0.00 54.13 55.46 1x1b s LEU 302 Cb 0.05 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.66 1x1b s LEU 302 CO 0.53 -0.70 0.14 -0.83 0.23 0.00 0.00 176.35 175.72 1x1b s GLY 303 N 1.19 2.72 0.33 -3.19 0.00 -0.76 -5.05 107.32 102.56 1x1b s GLY 303 Ca 0.66 -1.10 0.08 0.00 0.00 0.00 0.00 44.72 44.36 1x1b s GLY 303 CO 0.30 -1.85 0.13 -0.12 0.00 0.00 0.00 173.10 171.56 1x1b s PHE 304 N -3.16 2.71 -0.13 1.90 5.36 -1.26 -4.60 117.98 118.81 1x1b s PHE 304 Ca 0.21 -0.36 -0.34 0.00 -0.96 0.00 0.00 56.93 55.48 1x1b s PHE 304 Cb 0.01 -1.59 0.14 0.00 -0.34 0.00 0.00 43.02 41.24 1x1b s PHE 304 CO 0.14 0.37 1.32 -1.59 -1.46 0.00 0.00 175.22 174.01 1x1b s LYS 305 N -3.83 0.22 -0.53 10.12 -2.85 -1.26 -4.95 119.74 116.66 1x1b s LYS 305 Ca 0.37 -0.11 -0.21 0.00 -1.00 0.00 0.00 55.97 55.02 1x1b s LYS 305 Cb -0.03 0.08 0.05 0.00 -2.06 0.00 0.00 37.83 35.88 1x1b s LYS 305 CO 0.22 -0.10 0.77 -1.21 0.10 0.00 0.00 175.35 175.13 1x1b s GLU 306 N -2.26 3.20 0.56 1.78 0.41 -1.26 -4.82 118.70 116.32 1x1b s GLU 306 Ca 0.13 -0.65 0.38 0.00 -0.41 0.00 0.00 54.97 54.42 1x1b s GLU 306 Cb 0.03 -4.09 1.50 0.00 -1.78 0.00 0.00 34.13 29.79 1x1b s GLU 306 CO -0.04 -1.36 1.67 1.96 -0.49 0.00 0.00 175.26 177.00 1x1b h GLN 307 N 9.15 0.00 0.00 1.61 4.20 -1.98 0.41 115.11 128.50 1x1b h GLN 307 Ca -0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.44 1x1b h GLN 307 Cb 1.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.87 1x1b h GLN 307 CO 1.03 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 179.19 1x1b h ALA 308 N 1.17 1.00 -0.06 3.87 0.00 -2.03 -2.98 119.26 120.22 1x1b h ALA 308 Ca 0.61 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.54 1x1b h ALA 308 Cb 2.65 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 20.44 1x1b h ALA 308 CO -0.01 0.00 0.22 0.00 0.00 0.00 0.00 179.25 179.47 1x1b h ARG 309 N 0.00 0.00 -0.36 0.00 2.47 -0.58 -3.13 114.38 112.78 1x1b h ARG 309 Ca 0.00 0.00 0.08 0.00 -1.26 0.00 0.00 59.98 58.80 1x1b h ARG 309 Cb 0.27 0.00 -0.08 0.00 -1.65 0.00 0.00 29.97 28.51 1x1b h ARG 309 CO 0.00 0.00 -0.24 1.88 0.56 0.00 0.00 179.97 182.17 1x1b h TYR 310 N 0.00 -0.62 -0.71 3.04 0.05 -1.74 -2.53 116.97 114.46 1x1b h TYR 310 Ca 0.03 0.05 0.14 0.00 0.05 0.00 0.00 58.73 59.00 1x1b h TYR 310 Cb 0.47 0.33 -0.13 0.00 1.01 0.00 0.00 36.73 38.41 1x1b h TYR 310 CO 0.00 -0.31 -0.20 1.57 -1.05 0.00 0.00 178.16 178.16 1x1b h LYS 311 N -0.19 -0.02 -0.58 4.88 2.10 -1.84 0.39 116.57 121.32 1x1b h LYS 311 Ca 0.18 0.00 0.09 0.00 -2.00 0.00 0.00 60.65 58.92 1x1b h LYS 311 Cb 0.46 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 31.73 1x1b h LYS 311 CO -0.47 -0.01 0.19 0.93 -2.00 0.00 0.00 179.45 178.08 1x1b h GLU 312 N -0.02 0.34 0.61 0.07 3.07 -1.69 -1.24 114.58 115.72 1x1b h GLU 312 Ca 0.33 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 59.14 1x1b h GLU 312 Cb 0.53 -0.08 0.01 0.00 -0.84 0.00 0.00 28.75 28.37 1x1b h GLU 312 CO -0.74 0.23 -0.29 0.82 -1.40 0.00 0.00 179.01 177.62 1x1b h ILE 313 N 0.35 0.00 -0.60 3.13 1.08 -0.19 1.09 117.51 122.37 1x1b h ILE 313 Ca 0.29 -0.01 0.12 0.00 -0.39 0.00 0.00 64.86 64.87 1x1b h ILE 313 Cb 0.38 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 34.02 1x1b h ILE 313 CO -0.32 0.00 -0.02 -0.07 -0.69 0.00 0.00 178.15 177.05 1x1b h LEU 314 N -0.84 -0.30 -0.35 1.44 3.38 -1.03 0.55 115.31 118.17 1x1b h LEU 314 Ca -0.08 0.15 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1x1b h LEU 314 Cb 0.63 0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 1x1b h LEU 314 CO 0.14 -0.12 0.07 -0.33 0.09 0.00 0.00 178.44 178.29 1x1b h GLU 315 N 0.10 0.56 0.00 1.13 5.08 -1.19 0.39 114.58 120.66 1x1b h GLU 315 Ca 0.31 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1x1b h GLU 315 Cb 0.49 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1x1b h GLU 315 CO -0.52 0.62 0.00 -1.13 -1.00 0.00 0.00 179.01 176.98 1x1b n SER 316 N -4.60 0.00 -0.01 1.42 3.41 0.37 -1.60 113.62 112.61 1x1b n SER 316 Ca -0.01 -0.15 -0.01 0.00 -0.26 0.00 0.00 58.87 58.43 1x1b n SER 316 Cb 0.21 -0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 64.12 1x1b n SER 316 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1x1b n LEU 317 N -1.01 0.00 0.00 1.04 4.32 -0.20 -5.01 117.00 116.14 1x1b n LEU 317 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.03 1x1b n LEU 317 Cb 0.02 0.06 0.00 0.00 -1.62 0.00 0.00 43.42 41.88 1x1b n LEU 317 CO 0.03 0.06 0.00 0.61 -1.22 0.00 0.00 177.39 176.87 1x1b n GLY 318 N 2.80 1.31 3.35 -0.72 0.00 0.20 -5.09 105.19 107.04 1x1b n GLY 318 Ca -0.04 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.52 1x1b n GLY 318 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1x1b s TYR 319 N -1.31 3.39 0.89 1.61 2.02 0.11 -3.90 117.35 120.17 1x1b s TYR 319 Ca 0.00 -1.53 -0.12 0.00 -0.37 0.00 0.00 57.07 55.05 1x1b s TYR 319 Cb 0.00 -3.92 0.13 0.00 -0.40 0.00 0.00 41.96 37.77 1x1b s TYR 319 CO 0.00 -1.13 1.12 -1.59 -1.57 0.00 0.00 175.55 172.38 1x1b s LYS 320 N 1.37 1.32 -1.65 -0.62 -2.85 -0.43 -3.94 119.74 112.93 1x1b s LYS 320 Ca 0.15 0.44 -0.02 0.00 -1.00 0.00 0.00 55.97 55.54 1x1b s LYS 320 Cb -0.17 -1.85 0.00 0.00 -2.06 0.00 0.00 37.83 33.76 1x1b s LYS 320 CO -0.03 -2.11 0.27 -0.25 0.10 0.00 0.00 175.35 173.33 1x1b n ASP 321 N -3.73 -5.89 -4.74 0.03 8.00 -1.26 -0.65 116.55 108.31 1x1b n ASP 321 Ca 0.06 -0.13 -0.42 0.00 0.71 0.00 0.00 54.79 55.02 1x1b n ASP 321 Cb 0.58 -4.84 -0.02 0.00 -0.02 0.00 0.00 41.12 36.82 1x1b n ASP 321 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1x1b s VAL 322 N -3.08 2.13 0.13 2.53 1.01 -1.25 -4.34 120.40 117.53 1x1b s VAL 322 Ca 0.14 0.10 -0.00 0.00 0.00 0.00 0.00 61.98 62.22 1x1b s VAL 322 Cb -0.06 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 1x1b s VAL 322 CO 0.17 0.01 0.02 0.42 0.00 0.00 0.00 175.10 175.72 1x1b s THR 323 N 0.54 0.29 -0.16 3.92 -4.23 0.14 -4.97 115.64 111.18 1x1b s THR 323 Ca 0.68 -1.91 -0.09 0.00 -1.18 0.00 0.00 61.69 59.18 1x1b s THR 323 Cb -0.48 -1.97 0.05 0.00 1.34 0.00 0.00 72.50 71.45 1x1b s THR 323 CO 0.40 -0.57 0.38 -0.04 -0.54 0.00 0.00 174.62 174.25 1x1b s MET 324 N -3.99 0.37 0.03 3.99 -1.94 -1.26 -1.77 119.30 114.74 1x1b s MET 324 Ca 0.21 0.71 0.01 0.00 -1.71 0.00 0.00 55.69 54.91 1x1b s MET 324 Cb 0.07 0.00 -0.02 0.00 2.01 0.00 0.00 34.83 36.89 1x1b s MET 324 CO 0.00 -0.14 -0.06 0.54 -0.01 0.00 0.00 175.02 175.35 1x1b s VAL 325 N 1.18 0.39 -0.01 -6.03 0.11 -0.94 -4.99 120.40 110.11 1x1b s VAL 325 Ca -0.08 -1.03 0.04 0.00 -2.93 0.00 0.00 61.98 57.98 1x1b s VAL 325 Cb -0.08 -0.50 -0.01 0.00 -1.53 0.00 0.00 36.38 34.26 1x1b s VAL 325 CO -0.10 -0.43 -0.13 -0.13 -3.33 0.00 0.00 175.10 170.98 1x1b s ARG 326 N -1.57 1.04 -0.27 1.54 0.52 -1.26 -0.96 118.95 117.99 1x1b s ARG 326 Ca -0.12 -0.49 -0.29 0.00 -0.52 0.00 0.00 55.73 54.32 1x1b s ARG 326 Cb -0.10 -1.01 0.18 0.00 0.52 0.00 0.00 34.95 34.55 1x1b s ARG 326 CO -0.00 0.27 1.30 0.21 0.02 0.00 0.00 175.30 177.10 1x1b s LYS 327 N -0.38 0.16 -1.37 3.54 2.20 -0.02 -4.97 119.74 118.90 1x1b s LYS 327 Ca 0.05 0.06 -0.05 0.00 -0.36 0.00 0.00 55.97 55.67 1x1b s LYS 327 Cb -0.05 0.08 0.03 0.00 -1.51 0.00 0.00 37.83 36.37 1x1b s LYS 327 CO -0.00 -0.05 0.82 0.66 -0.36 0.00 0.00 175.35 176.42 1x1b n TYR 328 N 0.72 -2.09 -0.93 4.03 0.53 -1.26 -0.65 117.16 117.50 1x1b n TYR 328 Ca -0.03 0.87 0.00 0.00 -1.02 0.00 0.00 57.90 57.72 1x1b n TYR 328 Cb 0.58 -4.34 0.00 0.00 -1.03 0.00 0.00 39.34 34.55 1x1b n TYR 328 CO 0.00 0.00 0.00 -0.25 -1.02 0.00 0.00 176.86 175.59 1x1b n ASP 329 N -2.99 -5.23 -4.54 7.72 9.92 -1.26 -4.88 116.55 115.29 1x1b n ASP 329 Ca -0.18 0.00 -0.27 0.00 -0.53 0.00 0.00 54.79 53.81 1x1b n ASP 329 Cb 0.63 -3.35 -0.10 0.00 -0.64 0.00 0.00 41.12 37.66 1x1b n ASP 329 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 1x1b s HIS 330 N -0.99 2.57 -0.10 1.24 3.76 0.18 0.57 115.29 122.50 1x1b s HIS 330 Ca 0.00 -0.25 0.02 0.00 -0.15 0.00 0.00 55.06 54.68 1x1b s HIS 330 Cb 0.00 -1.25 -0.01 0.00 1.11 0.00 0.00 32.58 32.42 1x1b s HIS 330 CO 0.00 0.51 -0.17 -1.17 -0.85 0.00 0.00 174.74 173.06 1x1b s LEU 331 N -2.82 2.50 -0.32 0.89 2.96 -0.30 -0.84 118.68 120.74 1x1b s LEU 331 Ca 0.24 -0.39 0.02 0.00 -0.22 0.00 0.00 54.13 53.79 1x1b s LEU 331 Cb -0.09 -1.53 0.10 0.00 0.50 0.00 0.00 46.19 45.17 1x1b s LEU 331 CO 0.14 0.20 0.06 -0.22 -1.32 0.00 0.00 176.35 175.21 1x1b s LEU 332 N 0.15 3.84 -0.22 -0.68 2.96 -0.13 -1.47 118.68 123.13 1x1b s LEU 332 Ca -0.09 -1.94 -0.09 0.00 -0.22 0.00 0.00 54.13 51.79 1x1b s LEU 332 Cb -0.15 -1.36 -0.04 0.00 0.50 0.00 0.00 46.19 45.13 1x1b s LEU 332 CO 0.06 -0.38 0.11 0.68 -1.32 0.00 0.00 176.35 175.49 1x1b s VAL 333 N 1.16 5.03 0.26 1.68 -7.23 -0.32 -2.21 120.40 118.77 1x1b s VAL 333 Ca 0.10 0.06 0.11 0.00 -1.81 0.00 0.00 61.98 60.44 1x1b s VAL 333 Cb -0.18 -3.31 -0.05 0.00 0.56 0.00 0.00 36.38 33.39 1x1b s VAL 333 CO -0.13 0.40 -0.15 -1.10 -0.31 0.00 0.00 175.10 173.80 1x1b s GLN 334 N 0.79 1.83 0.28 4.82 -0.21 -0.73 -1.35 119.66 125.10 1x1b s GLN 334 Ca 0.06 -1.62 -0.21 0.00 0.02 0.00 0.00 55.36 53.61 1x1b s GLN 334 Cb -0.13 -1.90 0.02 0.00 1.00 0.00 0.00 33.01 32.00 1x1b s GLN 334 CO 0.02 0.35 0.73 0.00 -2.12 0.00 0.00 175.29 174.28 1x1b s ALA 335 N -2.30 -1.21 0.18 6.09 0.00 -0.61 0.26 121.76 124.17 1x1b s ALA 335 Ca 0.29 -0.32 0.04 0.00 0.00 0.00 0.00 51.96 51.97 1x1b s ALA 335 Cb -0.06 0.83 -0.05 0.00 0.00 0.00 0.00 23.12 23.85 1x1b s ALA 335 CO 0.15 -1.04 -0.08 0.08 0.00 0.00 0.00 175.76 174.88 1x1b s VAL 336 N -3.80 1.17 -0.18 0.00 1.01 0.18 -1.05 120.40 117.74 1x1b s VAL 336 Ca 0.11 -2.07 -0.04 0.00 0.00 0.00 0.00 61.98 59.99 1x1b s VAL 336 Cb -0.06 -2.00 -0.02 0.00 0.00 0.00 0.00 36.38 34.29 1x1b s VAL 336 CO 0.07 -0.62 -0.03 -0.75 0.00 0.00 0.00 175.10 173.78 1x1b s LYS 337 N -3.77 3.62 0.00 2.72 2.20 -1.07 -1.32 119.74 122.13 1x1b s LYS 337 Ca 0.20 -0.53 0.00 0.00 -0.36 0.00 0.00 55.97 55.28 1x1b s LYS 337 Cb 0.03 -2.97 0.00 0.00 -1.51 0.00 0.00 37.83 33.38 1x1b s LYS 337 CO 0.03 0.13 0.00 -0.35 -0.36 0.00 0.00 175.35 174.80