#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dev n GLU 3 N 0.00 4.00 -0.29 1.45 -0.58 -1.26 -4.92 120.64 119.04 3dev n GLU 3 Ca 0.00 -4.56 0.24 0.00 -0.42 0.00 0.00 57.16 52.42 3dev n GLU 3 Cb 0.00 -2.48 0.44 0.00 -0.57 0.00 0.00 31.44 28.83 3dev n GLU 3 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 3dev n ILE 4 N 1.49 -0.37 -0.34 -3.67 -0.00 -1.26 -0.52 119.36 114.70 3dev n ILE 4 Ca 0.26 1.81 0.17 0.00 -0.00 0.00 0.00 62.75 64.99 3dev n ILE 4 Cb 0.35 -2.86 0.37 0.00 -0.00 0.00 0.00 39.64 37.50 3dev n ILE 4 CO 0.00 0.00 0.00 -0.26 -0.00 0.00 0.00 176.55 176.29 3dev h PHE 5 N 0.00 0.98 -0.27 1.39 0.05 -2.00 -0.00 116.94 117.09 3dev h PHE 5 Ca 0.68 0.04 -0.14 0.00 3.82 0.00 0.00 57.97 62.37 3dev h PHE 5 Cb 1.72 -0.28 -0.00 0.00 2.00 0.00 0.00 35.95 39.39 3dev h PHE 5 CO -0.13 0.07 -0.38 -0.91 -0.18 0.00 0.00 178.31 176.78 3dev h ASN 6 N 0.58 0.81 0.14 2.17 -0.26 -1.24 -3.03 115.58 114.75 3dev h ASN 6 Ca 0.63 -0.50 -0.06 0.00 -0.56 0.00 0.00 56.30 55.81 3dev h ASN 6 Cb 1.18 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 38.20 3dev h ASN 6 CO -0.47 1.15 -0.21 -0.08 -1.06 0.00 0.00 177.43 176.76 3dev h GLU 7 N 0.49 0.14 -0.86 0.81 4.81 -1.19 -0.43 114.58 118.35 3dev h GLU 7 Ca 0.03 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3dev h GLU 7 Cb 0.97 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.33 3dev h GLU 7 CO 0.09 0.35 0.00 -0.89 -0.73 0.00 0.00 179.01 177.83 3dev n ILE 8 N -4.23 0.18 0.00 2.32 5.41 -0.16 -1.92 119.36 120.96 3dev n ILE 8 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.74 3dev n ILE 8 Cb 0.31 -0.44 0.00 0.00 -0.71 0.00 0.00 39.64 38.80 3dev n ILE 8 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 3dev n GLN 10 N 0.41 0.00 -0.32 0.38 -0.06 -0.17 -0.98 117.38 116.63 3dev n GLN 10 Ca 0.00 0.00 0.32 0.00 -2.00 0.00 0.00 57.00 55.32 3dev n GLN 10 Cb 0.18 0.00 0.69 0.00 -4.06 0.00 0.00 30.24 27.05 3dev n GLN 10 CO 0.00 0.00 0.00 -0.09 -0.20 0.00 0.00 177.06 176.77 3dev h ARG 11 N 0.00 0.10 0.08 3.69 9.65 -1.64 -0.14 114.38 126.11 3dev h ARG 11 Ca 0.00 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.87 3dev h ARG 11 Cb 0.00 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.56 3dev h ARG 11 CO 0.00 0.06 -0.04 0.28 2.80 0.00 0.00 179.97 183.08 3dev h VAL 12 N 0.10 1.19 -0.05 0.20 2.07 -1.33 -3.16 116.25 115.26 3dev h VAL 12 Ca 0.58 -1.13 0.01 0.00 0.82 0.00 0.00 66.70 66.98 3dev h VAL 12 Cb 2.08 1.90 -0.00 0.00 -1.52 0.00 0.00 31.29 33.74 3dev h VAL 12 CO -0.09 0.27 0.08 0.11 0.02 0.00 0.00 177.57 177.95 3dev h LYS 13 N -0.64 0.00 -2.34 1.57 1.57 -1.31 -3.02 116.57 112.40 3dev h LYS 13 Ca -0.01 0.00 -0.76 0.00 -1.87 0.00 0.00 60.65 58.01 3dev h LYS 13 Cb 0.52 0.00 -0.31 0.00 0.08 0.00 0.00 32.23 32.53 3dev h LYS 13 CO 0.02 0.00 0.60 -0.85 -0.57 0.00 0.00 179.45 178.65 3dev n GLU 14 N -3.63 4.77 -3.43 3.15 0.28 -0.85 -4.87 120.64 116.07 3dev n GLU 14 Ca -0.02 -4.70 0.02 0.00 -0.16 0.00 0.00 57.16 52.30 3dev n GLU 14 Cb 0.16 -2.42 -0.05 0.00 1.43 0.00 0.00 31.44 30.57 3dev n GLU 14 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3dev s ALA 15 N -3.89 -2.79 -0.48 -1.84 0.00 -1.14 -4.94 121.76 106.68 3dev s ALA 15 Ca 0.40 1.99 0.26 0.00 0.00 0.00 0.00 51.96 54.61 3dev s ALA 15 Cb 0.19 -2.05 0.86 0.00 0.00 0.00 0.00 23.12 22.12 3dev s ALA 15 CO -0.10 -0.74 1.76 0.93 0.00 0.00 0.00 175.76 177.61 3dev h GLU 16 N 6.71 0.00 -2.73 0.00 4.39 -1.86 -3.44 114.58 117.64 3dev h GLU 16 Ca -0.19 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.38 3dev h GLU 16 Cb 1.14 0.00 -0.27 0.00 -0.10 0.00 0.00 28.75 29.52 3dev h GLU 16 CO 0.12 0.00 -0.34 0.99 -1.16 0.00 0.00 179.01 178.62 3dev s THR 17 N -3.27 -0.03 -0.01 1.13 2.01 -1.26 -0.16 115.64 114.06 3dev s THR 17 Ca 0.07 0.10 0.02 0.00 0.31 0.00 0.00 61.69 62.19 3dev s THR 17 Cb 0.10 -0.56 -0.00 0.00 0.01 0.00 0.00 72.50 72.05 3dev s THR 17 CO 0.54 0.04 -0.08 0.27 -0.69 0.00 0.00 174.62 174.71 3dev s ILE 18 N 1.33 0.62 0.05 1.82 -0.00 -0.61 -2.37 121.20 122.04 3dev s ILE 18 Ca -0.09 -0.32 0.08 0.00 -0.00 0.00 0.00 60.65 60.32 3dev s ILE 18 Cb -0.09 -0.53 -0.03 0.00 -0.00 0.00 0.00 42.46 41.82 3dev s ILE 18 CO -0.11 0.18 -0.23 0.27 -0.00 0.00 0.00 174.94 175.04 3dev s ILE 19 N -0.11 2.40 -0.02 8.37 -5.25 -0.35 -2.41 121.20 123.83 3dev s ILE 19 Ca 0.02 -1.33 0.03 0.00 -0.99 0.00 0.00 60.65 58.39 3dev s ILE 19 Cb -0.04 -1.97 -0.03 0.00 2.95 0.00 0.00 42.46 43.37 3dev s ILE 19 CO -0.00 0.34 -0.11 -0.63 -1.79 0.00 0.00 174.94 172.75 3dev s ILE 20 N -0.86 3.32 0.40 8.37 1.01 0.87 -1.04 121.20 133.26 3dev s ILE 20 Ca 0.13 -0.76 0.05 0.00 0.00 0.00 0.00 60.65 60.07 3dev s ILE 20 Cb -0.10 -2.37 -0.06 0.00 0.01 0.00 0.00 42.46 39.94 3dev s ILE 20 CO 0.03 0.50 0.03 -1.00 0.00 0.00 0.00 174.94 174.50 3dev s HIS 21 N -0.85 2.21 0.24 3.97 3.76 0.02 -1.98 115.29 122.65 3dev s HIS 21 Ca 0.14 -0.84 -0.15 0.00 -0.15 0.00 0.00 55.06 54.06 3dev s HIS 21 Cb -0.11 -1.56 0.00 0.00 1.11 0.00 0.00 32.58 32.03 3dev s HIS 21 CO 0.03 0.23 0.52 -0.98 -0.85 0.00 0.00 174.74 173.69 3dev s ARG 22 N -3.79 1.54 0.99 1.40 1.70 -1.25 0.01 118.95 119.55 3dev s ARG 22 Ca 0.31 -1.14 -0.12 0.00 -0.47 0.00 0.00 55.73 54.32 3dev s ARG 22 Cb 0.08 0.50 0.18 0.00 -0.57 0.00 0.00 34.95 35.14 3dev s ARG 22 CO 0.15 -0.65 1.08 -3.38 -1.08 0.00 0.00 175.30 171.42 3dev s HIS 23 N -3.97 1.90 0.00 5.89 -3.43 -1.13 -0.08 115.29 114.46 3dev s HIS 23 Ca 0.18 1.30 0.00 0.00 -0.80 0.00 0.00 55.06 55.74 3dev s HIS 23 Cb -0.01 -3.18 0.00 0.00 -1.43 0.00 0.00 32.58 27.95 3dev s HIS 23 CO 0.06 -2.94 0.00 1.33 -2.00 0.00 0.00 174.74 171.19 3dev n VAL 24 N -4.27 0.00 -1.47 -5.38 0.24 0.84 -4.25 118.33 104.03 3dev n VAL 24 Ca 0.06 0.00 -0.45 0.00 -2.04 0.00 0.00 64.34 61.92 3dev n VAL 24 Cb 0.55 -0.76 -0.09 0.00 -1.47 0.00 0.00 33.84 32.07 3dev n VAL 24 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3dev n ARG 25 N 0.00 0.71 -2.30 7.34 3.00 -1.26 -4.88 116.66 119.27 3dev n ARG 25 Ca 0.00 0.12 -0.34 0.00 -0.01 0.00 0.00 57.85 57.62 3dev n ARG 25 Cb 0.00 -2.39 -0.01 0.00 0.00 0.00 0.00 32.46 30.05 3dev n ARG 25 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 3dev s PRO 26 N 7.51 3.54 0.19 5.56 0.04 -1.26 -5.08 135.00 145.51 3dev s PRO 26 Ca 1.15 1.32 0.02 0.00 0.04 0.00 0.00 61.00 63.52 3dev s PRO 26 Cb -0.83 -2.06 -0.05 0.00 0.04 0.00 0.00 34.50 31.60 3dev s PRO 26 CO 0.44 -0.64 0.02 0.16 0.04 0.00 0.00 177.00 177.02 3dev s ASP 27 N -2.30 1.25 0.30 6.66 -4.77 -1.26 -5.02 116.67 111.53 3dev s ASP 27 Ca 0.66 -1.22 0.06 0.00 -3.30 0.00 0.00 52.55 48.76 3dev s ASP 27 Cb -0.17 0.12 0.80 0.00 -1.09 0.00 0.00 42.92 42.58 3dev s ASP 27 CO 0.28 -0.60 1.71 1.55 0.70 0.00 0.00 175.17 178.81 3dev h PRO 28 N 2.62 0.47 0.58 2.11 0.13 -1.89 0.37 132.00 136.38 3dev h PRO 28 Ca -0.37 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.70 3dev h PRO 28 Cb 1.21 -0.11 0.01 0.00 0.13 0.00 0.00 31.00 32.24 3dev h PRO 28 CO 0.62 0.31 -0.28 0.22 -0.23 0.00 0.00 178.00 178.64 3dev h ASP 29 N 0.48 -0.66 -0.53 1.44 -0.00 -1.82 0.60 116.42 115.93 3dev h ASP 29 Ca 0.60 -0.04 0.15 0.00 -0.00 0.00 0.00 57.03 57.75 3dev h ASP 29 Cb 1.15 0.17 -0.02 0.00 -0.00 0.00 0.00 39.33 40.62 3dev h ASP 29 CO -0.51 -0.31 0.54 0.00 -0.00 0.00 0.00 179.24 178.97 3dev h ALA 30 N -0.83 2.29 0.00 -0.78 0.00 -1.80 1.00 119.26 119.14 3dev h ALA 30 Ca -0.08 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 3dev h ALA 30 Cb 0.66 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3dev h ALA 30 CO 0.13 -0.82 -0.31 -0.92 0.00 0.00 0.00 179.25 177.33 3dev h TYR 31 N 0.00 0.00 -0.75 0.00 5.03 -0.45 -3.15 116.97 117.66 3dev h TYR 31 Ca 0.25 0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.56 3dev h TYR 31 Cb 1.34 0.00 -0.04 0.00 1.55 0.00 0.00 36.73 39.58 3dev h TYR 31 CO 0.00 0.65 0.46 0.78 -1.32 0.00 0.00 178.16 178.73 3dev h GLY 32 N -1.00 1.08 1.13 1.82 0.00 0.16 -0.93 103.07 105.32 3dev h GLY 32 Ca -0.07 -0.44 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 3dev h GLY 32 CO -0.04 0.42 0.38 1.48 0.00 0.00 0.00 176.54 178.78 3dev h SER 33 N 1.02 1.02 0.02 0.19 4.64 0.81 0.64 113.55 121.89 3dev h SER 33 Ca 0.27 -0.12 -0.00 0.00 -0.47 0.00 0.00 61.79 61.47 3dev h SER 33 Cb -0.06 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 61.77 3dev h SER 33 CO -0.05 0.86 -0.01 -0.61 -0.87 0.00 0.00 176.83 176.15 3dev h GLN 34 N 1.11 -0.03 -1.02 4.77 4.15 -1.41 -1.92 115.11 120.77 3dev h GLN 34 Ca 0.27 0.00 0.28 0.00 0.77 0.00 0.00 58.65 59.98 3dev h GLN 34 Cb 0.11 0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.75 3dev h GLN 34 CO -0.03 -0.02 0.71 -0.07 -1.93 0.00 0.00 178.83 177.49 3dev h LEU 35 N -0.06 0.13 0.38 -2.39 3.38 -1.23 -1.19 115.31 114.33 3dev h LEU 35 Ca -0.00 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 3dev h LEU 35 Cb 0.03 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3dev h LEU 35 CO 0.01 0.03 -0.18 1.23 0.09 0.00 0.00 178.44 179.62 3dev h GLY 36 N 0.12 -0.53 0.34 0.83 0.00 0.27 0.21 103.07 104.32 3dev h GLY 36 Ca 0.51 0.20 0.09 0.00 0.00 0.00 0.00 47.33 48.12 3dev h GLY 36 CO -0.08 -0.19 0.10 -2.00 0.00 0.00 0.00 176.54 174.37 3dev h LEU 37 N -0.85 0.01 0.30 3.11 6.46 -0.44 0.05 115.31 123.96 3dev h LEU 37 Ca -0.05 0.09 -0.01 0.00 -0.12 0.00 0.00 57.88 57.79 3dev h LEU 37 Cb 0.54 0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.58 3dev h LEU 37 CO 0.08 0.03 -0.28 0.50 -0.62 0.00 0.00 178.44 178.16 3dev h LYS 38 N 0.24 -0.55 -1.08 1.25 3.64 -1.21 -0.21 116.57 118.65 3dev h LYS 38 Ca 0.26 0.04 0.29 0.00 -1.27 0.00 0.00 60.65 59.97 3dev h LYS 38 Cb 0.34 0.13 -0.09 0.00 -0.41 0.00 0.00 32.23 32.20 3dev h LYS 38 CO -0.33 -0.37 0.71 -0.07 -2.27 0.00 0.00 179.45 177.12 3dev h LEU 39 N -0.58 0.37 0.42 5.20 -0.00 -0.30 0.12 115.31 120.56 3dev h LEU 39 Ca -0.04 0.08 -0.02 0.00 -0.00 0.00 0.00 57.88 57.90 3dev h LEU 39 Cb 0.49 0.02 0.00 0.00 -0.00 0.00 0.00 40.66 41.18 3dev h LEU 39 CO -0.02 0.05 -0.20 0.22 -0.00 0.00 0.00 178.44 178.48 3dev h TYR 40 N 0.32 -0.53 -0.01 1.13 3.20 -0.67 -2.97 116.97 117.44 3dev h TYR 40 Ca 0.61 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.50 3dev h TYR 40 Cb 1.70 0.17 -0.04 0.00 1.54 0.00 0.00 36.73 40.10 3dev h TYR 40 CO -0.00 -0.20 -0.25 -0.07 -1.64 0.00 0.00 178.16 175.99 3dev h LEU 41 N -0.94 -0.74 -1.55 2.82 3.38 0.50 0.52 115.31 119.29 3dev h LEU 41 Ca -0.06 0.10 0.03 0.00 0.09 0.00 0.00 57.88 58.05 3dev h LEU 41 Cb 0.56 0.31 -0.00 0.00 0.09 0.00 0.00 40.66 41.61 3dev h LEU 41 CO 0.10 -0.32 0.53 -0.33 0.09 0.00 0.00 178.44 178.50 3dev h GLU 42 N -0.38 0.00 0.00 1.13 5.08 -0.90 0.79 114.58 120.29 3dev h GLU 42 Ca 0.06 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.18 3dev h GLU 42 Cb 0.47 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.68 3dev h GLU 42 CO -0.23 0.00 -1.62 -2.13 -1.00 0.00 0.00 179.01 174.04 3dev n ARG 43 N -2.94 0.63 -0.02 2.33 3.00 0.09 -3.79 116.66 115.96 3dev n ARG 43 Ca 0.01 0.26 -0.21 0.00 -0.00 0.00 0.00 57.85 57.91 3dev n ARG 43 Cb 0.59 -1.79 -0.13 0.00 0.00 0.00 0.00 32.46 31.13 3dev n ARG 43 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.63 177.41 3dev h LYS 44 N 0.00 0.18 -2.16 -0.14 3.64 0.13 -3.42 116.57 114.80 3dev h LYS 44 Ca -0.24 -0.30 -0.59 0.00 -1.27 0.00 0.00 60.65 58.25 3dev h LYS 44 Cb 1.86 0.11 -0.41 0.00 -0.41 0.00 0.00 32.23 33.37 3dev h LYS 44 CO 0.07 1.14 -0.73 1.19 -2.27 0.00 0.00 179.45 178.85 3dev n PHE 45 N -4.04 2.76 0.22 1.91 3.72 0.59 -4.93 117.46 117.69 3dev n PHE 45 Ca -0.26 -4.00 0.11 0.00 -0.05 0.00 0.00 57.45 53.24 3dev n PHE 45 Cb 0.84 -0.50 0.57 0.00 -0.94 0.00 0.00 39.48 39.44 3dev n PHE 45 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3dev h PRO 46 N 3.94 0.00 0.00 -1.08 0.13 -1.77 0.19 132.00 133.40 3dev h PRO 46 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3dev h PRO 46 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 3dev h PRO 46 CO 0.75 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.67 3dev n GLU 47 N -2.37 0.11 -3.25 0.86 0.28 -1.26 -4.84 120.64 110.17 3dev n GLU 47 Ca -0.01 0.19 -0.21 0.00 -0.16 0.00 0.00 57.16 56.96 3dev n GLU 47 Cb 0.27 -1.66 0.03 0.00 1.43 0.00 0.00 31.44 31.52 3dev n GLU 47 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 3dev s LYS 48 N -3.09 2.37 -0.28 3.44 1.02 0.66 -5.01 119.74 118.86 3dev s LYS 48 Ca 0.10 -1.67 0.03 0.00 0.02 0.00 0.00 55.97 54.45 3dev s LYS 48 Cb 0.13 -2.52 0.07 0.00 -0.52 0.00 0.00 37.83 34.99 3dev s LYS 48 CO 0.48 -0.70 -0.07 -0.80 -0.92 0.00 0.00 175.35 173.34 3dev s ASN 49 N -4.51 4.52 -0.16 2.83 0.01 0.78 -4.98 114.94 113.43 3dev s ASN 49 Ca 0.54 -1.57 -0.05 0.00 -0.71 0.00 0.00 52.86 51.07 3dev s ASN 49 Cb -0.05 -1.57 -0.03 0.00 0.41 0.00 0.00 41.25 40.01 3dev s ASN 49 CO 0.34 -0.23 0.01 -0.63 -1.51 0.00 0.00 177.10 175.08 3dev s ILE 50 N 1.06 4.35 0.07 0.60 1.09 -1.26 -1.57 121.20 125.54 3dev s ILE 50 Ca -0.05 -0.20 0.04 0.00 -1.10 0.00 0.00 60.65 59.35 3dev s ILE 50 Cb -0.20 -2.93 -0.03 0.00 -1.06 0.00 0.00 42.46 38.24 3dev s ILE 50 CO -0.06 0.49 -0.12 -0.31 -0.10 0.00 0.00 174.94 174.84 3dev s TYR 51 N 0.27 1.05 -0.20 3.97 4.12 -1.01 -5.02 117.35 120.52 3dev s TYR 51 Ca 0.00 -0.53 0.00 0.00 0.02 0.00 0.00 57.07 56.57 3dev s TYR 51 Cb -0.13 -0.59 0.05 0.00 -1.52 0.00 0.00 41.96 39.77 3dev s TYR 51 CO 0.02 0.01 -0.05 0.00 0.02 0.00 0.00 175.55 175.54 3dev s ALA 52 N -1.65 1.74 0.12 3.71 0.00 -1.26 -0.09 121.76 124.34 3dev s ALA 52 Ca -0.02 -1.11 -0.10 0.00 0.00 0.00 0.00 51.96 50.73 3dev s ALA 52 Cb -0.08 -1.29 -0.06 0.00 0.00 0.00 0.00 23.12 21.69 3dev s ALA 52 CO 0.01 -1.00 0.44 0.99 0.00 0.00 0.00 175.76 176.21 3dev s THR 53 N 1.51 5.04 0.00 0.00 2.01 -0.84 -0.42 115.64 122.94 3dev s THR 53 Ca -0.03 0.46 0.00 0.00 0.31 0.00 0.00 61.69 62.43 3dev s THR 53 Cb -0.17 -3.65 0.00 0.00 0.01 0.00 0.00 72.50 68.69 3dev s THR 53 CO -0.07 0.19 0.00 0.61 -0.69 0.00 0.00 174.62 174.66 3dev n GLY 54 N 0.62 0.53 0.23 4.40 0.00 -1.26 -4.52 105.19 105.19 3dev n GLY 54 Ca -0.05 -0.76 -0.04 0.00 0.00 0.00 0.00 46.02 45.17 3dev n GLY 54 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3dev h GLU 55 N 0.00 0.44 -2.71 1.61 4.57 -1.96 -3.48 114.58 113.05 3dev h GLU 55 Ca 0.00 -0.18 0.00 0.00 -1.18 0.00 0.00 59.36 58.00 3dev h GLU 55 Cb 0.00 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.57 3dev h GLU 55 CO 0.00 0.70 0.00 0.00 -1.18 0.00 0.00 179.01 178.53 3dev n ALA 56 N -2.49 -2.71 -2.60 2.92 0.00 -1.26 -5.01 120.51 109.37 3dev n ALA 56 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.00 3dev n ALA 56 Cb 0.44 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.85 3dev n ALA 56 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3dev s GLU 57 N -0.29 3.75 0.67 0.00 2.56 -1.26 -4.92 118.70 119.21 3dev s GLU 57 Ca 0.00 0.51 0.33 0.00 0.00 0.00 0.00 54.97 55.81 3dev s GLU 57 Cb 0.00 -3.85 1.80 0.00 2.00 0.00 0.00 34.13 34.08 3dev s GLU 57 CO 0.00 -1.11 2.02 -1.00 -0.56 0.00 0.00 175.26 174.60 3dev h PRO 58 N 8.76 0.00 -0.61 4.30 0.13 -1.99 0.64 132.00 143.24 3dev h PRO 58 Ca -0.23 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.85 3dev h PRO 58 Cb 1.07 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.18 3dev h PRO 58 CO 1.03 0.00 0.18 1.03 -0.23 0.00 0.00 178.00 180.01 3dev h SER 59 N 0.00 0.90 -0.62 1.44 0.87 -2.02 -2.83 113.55 111.28 3dev h SER 59 Ca 0.00 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.34 3dev h SER 59 Cb 0.52 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.25 3dev h SER 59 CO 0.00 0.87 0.00 0.18 -0.53 0.00 0.00 176.83 177.35 3dev n LEU 60 N -4.38 5.11 -0.34 2.23 7.99 0.19 -4.56 117.00 123.24 3dev n LEU 60 Ca 0.03 -2.62 0.15 0.00 -0.01 0.00 0.00 56.01 53.56 3dev n LEU 60 Cb 0.22 -0.62 0.36 0.00 -0.11 0.00 0.00 43.42 43.27 3dev n LEU 60 CO 0.40 0.75 1.20 -1.28 -1.51 0.00 0.00 177.39 176.96 3dev h SER 61 N 4.05 0.71 0.28 -1.43 0.87 -1.23 -0.97 113.55 115.85 3dev h SER 61 Ca 0.00 0.09 -0.03 0.00 -1.23 0.00 0.00 61.79 60.62 3dev h SER 61 Cb 1.64 -0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 63.56 3dev h SER 61 CO 0.32 0.24 -0.15 2.19 -0.53 0.00 0.00 176.83 178.91 3dev h PHE 62 N 0.69 0.00 -0.31 2.24 -0.00 -1.82 -2.81 116.94 114.93 3dev h PHE 62 Ca 0.57 0.00 -0.03 0.00 -0.00 0.00 0.00 57.97 58.51 3dev h PHE 62 Cb 0.99 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.93 3dev h PHE 62 CO -0.00 0.15 0.07 0.82 -0.00 0.00 0.00 178.31 179.34 3dev h ILE 63 N 0.00 1.22 0.00 0.88 2.04 -1.53 -3.48 117.51 116.65 3dev h ILE 63 Ca -0.00 -0.74 0.00 0.00 1.00 0.00 0.00 64.86 65.12 3dev h ILE 63 Cb 0.33 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.53 3dev h ILE 63 CO 0.02 0.24 0.00 0.61 0.00 0.00 0.00 178.15 179.02 3dev n GLY 64 N -0.54 2.79 3.89 5.37 0.00 -1.06 -4.84 105.19 110.80 3dev n GLY 64 Ca -0.02 -0.53 -0.29 0.00 0.00 0.00 0.00 46.02 45.19 3dev n GLY 64 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3dev s ASP 65 N 0.00 6.35 0.67 1.61 1.01 -1.26 -4.73 116.67 120.32 3dev s ASP 65 Ca 0.00 1.02 0.05 0.00 0.71 0.00 0.00 52.55 54.33 3dev s ASP 65 Cb 0.00 -2.28 0.12 0.00 1.01 0.00 0.00 42.92 41.77 3dev s ASP 65 CO 0.00 -0.52 0.92 0.18 0.21 0.00 0.00 175.17 175.96 3dev n LEU 66 N -1.93 0.00 -4.62 1.23 4.77 -1.26 -5.01 117.00 110.18 3dev n LEU 66 Ca 0.01 -2.37 -0.30 0.00 -0.03 0.00 0.00 56.01 53.32 3dev n LEU 66 Cb 0.55 -0.55 -0.09 0.00 -2.33 0.00 0.00 43.42 41.00 3dev n LEU 66 CO 0.51 -0.86 -0.38 -1.81 -1.33 0.00 0.00 177.39 173.53 3dev s ASP 67 N -4.92 4.68 -0.63 -1.43 1.01 0.44 -4.97 116.67 110.85 3dev s ASP 67 Ca 0.65 -0.27 -0.18 0.00 0.71 0.00 0.00 52.55 53.47 3dev s ASP 67 Cb -0.04 -1.02 0.12 0.00 1.01 0.00 0.00 42.92 42.99 3dev s ASP 67 CO 0.42 0.19 0.69 -0.70 0.21 0.00 0.00 175.17 175.99 3dev s GLU 68 N -2.12 3.13 0.17 8.23 2.56 -1.26 -4.40 118.70 125.01 3dev s GLU 68 Ca 0.22 -1.56 -0.30 0.00 0.00 0.00 0.00 54.97 53.34 3dev s GLU 68 Cb -0.11 -4.33 -0.07 0.00 2.00 0.00 0.00 34.13 31.61 3dev s GLU 68 CO 0.14 -1.48 1.07 -1.50 -0.56 0.00 0.00 175.26 172.93 3dev s ILE 69 N 2.18 3.99 -0.55 -3.70 1.10 -1.26 -4.95 121.20 118.01 3dev s ILE 69 Ca 0.12 1.72 0.05 0.00 -0.51 0.00 0.00 60.65 62.02 3dev s ILE 69 Cb -0.23 -4.10 0.35 0.00 0.15 0.00 0.00 42.46 38.64 3dev s ILE 69 CO 0.03 0.29 1.14 0.47 -2.11 0.00 0.00 174.94 174.76 3dev n ASP 70 N 2.42 3.16 0.00 4.50 9.92 -1.26 -4.90 116.55 130.40 3dev n ASP 70 Ca 0.02 -2.48 0.00 0.00 -0.53 0.00 0.00 54.79 51.80 3dev n ASP 70 Cb 0.47 -0.60 0.00 0.00 -0.64 0.00 0.00 41.12 40.35 3dev n ASP 70 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 3dev n ASP 71 N 0.16 0.00 -0.58 -2.24 -0.08 -1.26 -4.30 116.55 108.24 3dev n ASP 71 Ca 0.16 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.54 3dev n ASP 71 Cb 0.76 -0.66 0.03 0.00 2.34 0.00 0.00 41.12 43.58 3dev n ASP 71 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 3dev n SER 72 N 0.00 2.18 0.17 1.67 3.41 -1.26 -3.96 113.62 115.84 3dev n SER 72 Ca 0.00 -1.59 0.12 0.00 -0.26 0.00 0.00 58.87 57.14 3dev n SER 72 Cb 0.00 0.32 0.13 0.00 -0.26 0.00 0.00 64.21 64.40 3dev n SER 72 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3dev h VAL 73 N 2.87 0.00 0.00 -3.33 2.07 -1.97 -3.18 116.25 112.71 3dev h VAL 73 Ca 0.00 -0.96 0.00 0.00 0.82 0.00 0.00 66.70 66.56 3dev h VAL 73 Cb 0.75 1.78 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 3dev h VAL 73 CO 0.00 0.00 0.00 -1.22 0.02 0.00 0.00 177.57 176.37 3dev n TYR 74 N -2.89 0.00 0.00 1.57 4.02 -1.25 -3.86 117.16 114.75 3dev n TYR 74 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 3dev n TYR 74 Cb 0.53 -0.33 0.00 0.00 -0.02 0.00 0.00 39.34 39.52 3dev n TYR 74 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 3dev n SER 75 N -1.33 0.00 -3.57 7.72 2.88 -1.20 -3.84 113.62 114.27 3dev n SER 75 Ca 0.02 0.83 -0.27 0.00 -1.33 0.00 0.00 58.87 58.12 3dev n SER 75 Cb 0.05 -0.33 -0.10 0.00 -0.75 0.00 0.00 64.21 63.09 3dev n SER 75 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 3dev n ASP 76 N -2.11 2.32 -3.99 -3.46 4.64 -1.25 -4.32 116.55 108.38 3dev n ASP 76 Ca 0.00 -3.08 -0.08 0.00 -1.38 0.00 0.00 54.79 50.25 3dev n ASP 76 Cb 0.00 -0.68 -0.09 0.00 -1.04 0.00 0.00 41.12 39.31 3dev n ASP 76 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3dev s ALA 77 N -1.51 0.18 -0.18 -1.67 0.00 -1.25 -4.65 121.76 112.69 3dev s ALA 77 Ca 0.32 -0.91 -0.15 0.00 0.00 0.00 0.00 51.96 51.22 3dev s ALA 77 Cb 0.06 0.34 -0.04 0.00 0.00 0.00 0.00 23.12 23.47 3dev s ALA 77 CO -0.12 -0.40 0.34 -1.17 0.00 0.00 0.00 175.76 174.41 3dev s LEU 78 N -2.76 4.21 -0.20 0.00 2.96 -1.00 -0.55 118.68 121.34 3dev s LEU 78 Ca 0.04 0.52 -0.08 0.00 -0.22 0.00 0.00 54.13 54.39 3dev s LEU 78 Cb 0.05 -2.44 -0.04 0.00 0.50 0.00 0.00 46.19 44.26 3dev s LEU 78 CO -0.09 0.02 0.09 -0.69 -1.32 0.00 0.00 176.35 174.36 3dev s VAL 79 N 0.82 4.94 -0.34 1.68 1.01 -0.87 -1.21 120.40 126.43 3dev s VAL 79 Ca 0.18 0.02 0.04 0.00 0.00 0.00 0.00 61.98 62.22 3dev s VAL 79 Cb -0.14 -3.25 0.10 0.00 0.00 0.00 0.00 36.38 33.10 3dev s VAL 79 CO 0.06 0.43 0.06 -0.63 0.00 0.00 0.00 175.10 175.02 3dev s ILE 80 N 0.54 2.31 -0.94 2.22 1.01 -0.21 -1.21 121.20 124.92 3dev s ILE 80 Ca 0.05 -2.35 -0.23 0.00 0.00 0.00 0.00 60.65 58.11 3dev s ILE 80 Cb -0.12 -2.71 0.06 0.00 0.01 0.00 0.00 42.46 39.70 3dev s ILE 80 CO 0.01 -0.60 1.35 -0.69 0.00 0.00 0.00 174.94 175.00 3dev s VAL 81 N 0.89 4.03 -0.02 2.92 1.01 -0.59 -0.80 120.40 127.84 3dev s VAL 81 Ca 0.11 -0.66 -0.29 0.00 0.00 0.00 0.00 61.98 61.14 3dev s VAL 81 Cb -0.19 -4.98 -0.03 0.00 0.00 0.00 0.00 36.38 31.18 3dev s VAL 81 CO -0.08 -1.84 0.95 0.00 0.00 0.00 0.00 175.10 174.14 3dev n ASP 83 N 4.05 -7.14 -3.25 0.00 2.03 0.89 -3.89 116.55 109.24 3dev n ASP 83 Ca 0.06 0.65 0.03 0.00 0.52 0.00 0.00 54.79 56.05 3dev n ASP 83 Cb 0.51 -3.63 -0.02 0.00 -0.72 0.00 0.00 41.12 37.26 3dev n ASP 83 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 3dev s THR 84 N -1.65 -0.72 0.00 5.18 2.01 -1.26 -2.86 115.64 116.34 3dev s THR 84 Ca 0.13 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.13 3dev s THR 84 Cb -0.02 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.49 3dev s THR 84 CO 0.59 0.00 0.71 0.00 -0.69 0.00 0.00 174.62 175.24 3dev n ALA 85 N 5.38 -0.11 -2.74 7.40 0.00 -1.26 -4.70 120.51 124.47 3dev n ALA 85 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.05 3dev n ALA 85 Cb 0.52 0.18 -0.08 0.00 0.00 0.00 0.00 19.45 20.07 3dev n ALA 85 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3dev s ASN 86 N -2.50 5.50 0.15 0.00 -0.87 -1.26 -4.44 114.94 111.53 3dev s ASN 86 Ca 0.00 0.13 -0.19 0.00 -1.57 0.00 0.00 52.86 51.22 3dev s ASN 86 Cb 0.00 -1.55 0.05 0.00 -0.02 0.00 0.00 41.25 39.73 3dev s ASN 86 CO 0.00 0.30 1.66 0.00 -2.57 0.00 0.00 177.10 176.49 3dev h ALA 87 N 4.40 0.11 -0.85 0.60 0.00 -1.97 -1.66 119.26 119.90 3dev h ALA 87 Ca -0.50 0.12 0.25 0.00 0.00 0.00 0.00 54.91 54.77 3dev h ALA 87 Cb 1.19 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 19.28 3dev h ALA 87 CO 0.59 -0.53 0.64 -1.00 0.00 0.00 0.00 179.25 178.95 3dev h PRO 88 N -0.09 0.00 -0.06 0.00 0.13 -1.99 0.45 132.00 130.44 3dev h PRO 88 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3dev h PRO 88 Cb 0.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.46 3dev h PRO 88 CO -0.37 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 177.94 3dev n ARG 89 N -4.18 1.22 -2.62 0.86 5.12 -0.63 -4.85 116.66 111.58 3dev n ARG 89 Ca 0.17 -0.33 -0.35 0.00 -1.93 0.00 0.00 57.85 55.41 3dev n ARG 89 Cb 0.94 -1.27 -0.05 0.00 -1.16 0.00 0.00 32.46 30.92 3dev n ARG 89 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3dev s ILE 90 N -1.92 3.91 0.00 0.55 1.01 0.16 -0.11 121.20 124.79 3dev s ILE 90 Ca 0.24 1.35 0.00 0.00 0.00 0.00 0.00 60.65 62.24 3dev s ILE 90 Cb 0.12 -3.64 0.00 0.00 0.01 0.00 0.00 42.46 38.95 3dev s ILE 90 CO 0.19 -0.10 0.00 -0.67 0.00 0.00 0.00 174.94 174.36 3dev n ASP 91 N -0.35 0.00 -4.68 3.58 4.64 0.88 -4.52 116.55 116.10 3dev n ASP 91 Ca 0.06 0.00 -0.45 0.00 -1.38 0.00 0.00 54.79 53.02 3dev n ASP 91 Cb 0.51 0.00 -0.04 0.00 -1.04 0.00 0.00 41.12 40.55 3dev n ASP 91 CO 0.00 0.00 0.00 -0.67 -0.82 0.00 0.00 177.20 175.71 3dev n ASP 92 N 0.00 3.76 -0.11 1.67 -0.08 -1.26 -4.86 116.55 115.68 3dev n ASP 92 Ca 0.00 0.96 0.15 0.00 -1.51 0.00 0.00 54.79 54.39 3dev n ASP 92 Cb 0.00 -1.46 0.75 0.00 2.34 0.00 0.00 41.12 42.75 3dev n ASP 92 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3dev n GLN 93 N 6.38 0.91 -0.29 -0.67 1.13 -1.26 -3.75 117.38 119.84 3dev n GLN 93 Ca 0.20 -0.21 0.02 0.00 -1.94 0.00 0.00 57.00 55.07 3dev n GLN 93 Cb 0.34 -1.50 0.13 0.00 0.11 0.00 0.00 30.24 29.33 3dev n GLN 93 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 3dev n ARG 94 N -0.86 2.24 -0.13 -1.09 1.85 -1.26 -4.01 116.66 113.41 3dev n ARG 94 Ca 0.19 -1.00 -0.11 0.00 -1.00 0.00 0.00 57.85 55.93 3dev n ARG 94 Cb 0.22 -1.75 0.02 0.00 -1.05 0.00 0.00 32.46 29.91 3dev n ARG 94 CO 0.00 0.00 0.00 0.10 -0.01 0.00 0.00 177.63 177.72 3dev h TYR 95 N 1.27 1.06 0.00 2.89 -0.00 -1.97 -2.34 116.97 117.87 3dev h TYR 95 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 58.73 58.46 3dev h TYR 95 Cb 0.97 -0.24 0.00 0.00 0.00 0.00 0.00 36.73 37.46 3dev h TYR 95 CO 0.35 1.07 0.00 -0.11 -0.00 0.00 0.00 178.16 179.47 3dev n LEU 96 N -4.09 0.00 -2.38 0.10 0.00 -1.26 -2.87 117.00 106.50 3dev n LEU 96 Ca -0.00 0.03 -0.35 0.00 0.00 0.00 0.00 56.01 55.69 3dev n LEU 96 Cb 0.48 -0.03 0.07 0.00 0.00 0.00 0.00 43.42 43.93 3dev n LEU 96 CO 0.47 -0.02 1.35 0.59 0.00 0.00 0.00 177.39 179.77 3dev n ASN 97 N -1.03 7.43 -4.53 1.96 3.02 -0.88 -4.95 115.26 116.27 3dev n ASN 97 Ca 0.09 -3.79 -0.28 0.00 -0.03 0.00 0.00 54.58 50.57 3dev n ASN 97 Cb 0.05 -0.93 -0.09 0.00 -0.61 0.00 0.00 39.78 38.20 3dev n ASN 97 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3dev s GLY 98 N -1.91 2.64 0.00 7.41 0.00 -1.14 -4.41 107.32 109.92 3dev s GLY 98 Ca 0.62 -1.34 0.00 0.00 0.00 0.00 0.00 44.72 44.00 3dev s GLY 98 CO -0.06 -2.03 0.88 -0.18 0.00 0.00 0.00 173.10 171.71 3dev n GLN 99 N -1.01 0.00 -4.29 2.90 0.00 0.29 -4.85 117.38 110.42 3dev n GLN 99 Ca -0.10 0.50 -0.19 0.00 -0.00 0.00 0.00 57.00 57.21 3dev n GLN 99 Cb 0.66 -1.38 -0.11 0.00 0.00 0.00 0.00 30.24 29.42 3dev n GLN 99 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 3dev s SER 100 N -2.24 2.29 -0.09 1.69 1.04 -1.25 -5.05 113.70 110.08 3dev s SER 100 Ca 0.00 -0.88 0.02 0.00 0.48 0.00 0.00 55.95 55.57 3dev s SER 100 Cb 0.00 -0.10 -0.02 0.00 0.10 0.00 0.00 66.02 66.00 3dev s SER 100 CO 0.00 -0.13 -0.13 -0.22 0.98 0.00 0.00 173.24 173.74 3dev s LEU 101 N -2.72 2.76 -0.03 2.42 2.96 -1.26 -2.06 118.68 120.76 3dev s LEU 101 Ca 0.14 -0.25 0.01 0.00 -0.22 0.00 0.00 54.13 53.81 3dev s LEU 101 Cb -0.04 -1.59 0.02 0.00 0.50 0.00 0.00 46.19 45.08 3dev s LEU 101 CO 0.05 0.26 -0.00 -0.51 -1.32 0.00 0.00 176.35 174.82 3dev s ILE 102 N -0.21 0.19 0.04 6.68 -1.16 -0.35 0.36 121.20 126.75 3dev s ILE 102 Ca 0.01 0.05 0.08 0.00 -0.51 0.00 0.00 60.65 60.28 3dev s ILE 102 Cb -0.13 -0.26 -0.03 0.00 0.61 0.00 0.00 42.46 42.65 3dev s ILE 102 CO 0.03 0.13 -0.23 -1.59 -2.81 0.00 0.00 174.94 170.47 3dev s LYS 103 N 0.85 1.61 -0.13 3.50 -2.85 -0.87 -1.54 119.74 120.32 3dev s LYS 103 Ca -0.09 -0.99 -0.01 0.00 -1.00 0.00 0.00 55.97 53.89 3dev s LYS 103 Cb -0.12 -1.73 0.03 0.00 -2.06 0.00 0.00 37.83 33.95 3dev s LYS 103 CO -0.01 0.45 -0.06 0.42 0.10 0.00 0.00 175.35 176.25 3dev s ILE 104 N -0.76 0.98 0.24 3.79 1.01 -1.17 -2.01 121.20 123.28 3dev s ILE 104 Ca 0.09 -0.37 -0.08 0.00 0.00 0.00 0.00 60.65 60.29 3dev s ILE 104 Cb -0.09 -1.08 -0.02 0.00 0.01 0.00 0.00 42.46 41.29 3dev s ILE 104 CO 0.02 0.26 0.36 -0.62 0.00 0.00 0.00 174.94 174.96 3dev s ASP 105 N 1.71 0.07 -0.02 3.58 2.15 -0.94 -0.08 116.67 123.14 3dev s ASP 105 Ca 0.03 -1.13 0.04 0.00 0.43 0.00 0.00 52.55 51.92 3dev s ASP 105 Cb -0.14 0.52 0.05 0.00 -0.30 0.00 0.00 42.92 43.06 3dev s ASP 105 CO -0.08 -1.05 0.95 0.00 -0.17 0.00 0.00 175.17 174.82 3dev n HIS 106 N -0.36 0.00 -3.25 -5.34 1.44 -1.26 -2.30 115.22 104.15 3dev n HIS 106 Ca -0.00 -0.49 -0.23 0.00 -2.01 0.00 0.00 57.72 54.99 3dev n HIS 106 Cb 0.63 -0.06 -0.00 0.00 0.12 0.00 0.00 29.99 30.68 3dev n HIS 106 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 3dev s HIS 107 N -1.14 3.34 0.23 -1.40 3.76 -1.26 -4.42 115.29 114.40 3dev s HIS 107 Ca 0.06 0.22 -0.31 0.00 -0.15 0.00 0.00 55.06 54.88 3dev s HIS 107 Cb 0.05 -2.06 -0.14 0.00 1.11 0.00 0.00 32.58 31.54 3dev s HIS 107 CO 0.01 -0.08 1.35 -0.35 -0.85 0.00 0.00 174.74 174.81 3dev n PRO 108 N -1.87 1.84 -2.15 8.40 -0.04 -1.26 -4.79 135.00 135.13 3dev n PRO 108 Ca -0.02 0.66 -0.30 0.00 -0.04 0.00 0.00 63.50 63.79 3dev n PRO 108 Cb 0.57 -2.27 -0.05 0.00 -0.04 0.00 0.00 33.50 31.71 3dev n PRO 108 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dev s ALA 109 N -0.13 1.90 -0.03 0.55 0.00 -1.26 -4.62 121.76 118.18 3dev s ALA 109 Ca 0.69 -1.62 0.05 0.00 0.00 0.00 0.00 51.96 51.08 3dev s ALA 109 Cb -0.69 -4.54 -0.07 0.00 0.00 0.00 0.00 23.12 17.82 3dev s ALA 109 CO 0.51 -4.52 0.07 0.25 0.00 0.00 0.00 175.76 172.06 3dev n THR 110 N 7.64 0.16 -0.11 0.00 -2.24 -1.26 -4.79 114.28 113.67 3dev n THR 110 Ca 0.37 -0.16 -0.21 0.00 -2.27 0.00 0.00 64.05 61.78 3dev n THR 110 Cb 0.48 -0.20 -0.09 0.00 -2.10 0.00 0.00 70.33 68.43 3dev n THR 110 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3dev n ASP 111 N -1.92 1.90 -1.94 3.42 2.03 -1.26 -4.98 116.55 113.81 3dev n ASP 111 Ca -0.04 0.41 -0.20 0.00 0.52 0.00 0.00 54.79 55.47 3dev n ASP 111 Cb 0.38 -0.87 -0.05 0.00 -0.72 0.00 0.00 41.12 39.86 3dev n ASP 111 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3dev n GLN 112 N -4.39 -1.56 -1.26 -0.67 1.13 -1.26 -4.94 117.38 104.42 3dev n GLN 112 Ca -0.35 1.11 -0.34 0.00 -1.94 0.00 0.00 57.00 55.48 3dev n GLN 112 Cb 0.68 -5.61 0.11 0.00 0.11 0.00 0.00 30.24 25.54 3dev n GLN 112 CO 0.00 0.00 0.00 1.52 -1.44 0.00 0.00 177.06 177.14 3dev s TYR 113 N -2.85 1.89 0.00 1.08 -0.85 -1.26 -4.83 117.35 110.54 3dev s TYR 113 Ca 0.00 1.63 0.00 0.00 -0.52 0.00 0.00 57.07 58.18 3dev s TYR 113 Cb 0.00 -3.50 0.00 0.00 0.38 0.00 0.00 41.96 38.84 3dev s TYR 113 CO 0.00 -2.80 0.00 0.41 -1.52 0.00 0.00 175.55 171.64 3dev n GLY 114 N 0.50 -0.77 0.17 5.49 0.00 -1.26 -4.61 105.19 104.71 3dev n GLY 114 Ca 0.14 -1.44 -0.06 0.00 0.00 0.00 0.00 46.02 44.65 3dev n GLY 114 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3dev h ASP 115 N 0.00 -0.46 -3.68 1.61 3.45 -0.42 -3.40 116.42 113.52 3dev h ASP 115 Ca 0.00 0.03 -0.62 0.00 0.43 0.00 0.00 57.03 56.87 3dev h ASP 115 Cb 0.00 0.15 -0.14 0.00 -0.56 0.00 0.00 39.33 38.77 3dev h ASP 115 CO 0.00 -0.23 -0.31 -0.69 -1.57 0.00 0.00 179.24 176.43 3dev s VAL 116 N -3.97 5.23 -0.18 -1.35 1.01 -1.18 -5.04 120.40 114.93 3dev s VAL 116 Ca -0.06 0.48 0.00 0.00 0.00 0.00 0.00 61.98 62.40 3dev s VAL 116 Cb 0.01 -3.65 0.01 0.00 0.00 0.00 0.00 36.38 32.76 3dev s VAL 116 CO 0.20 0.22 -0.16 0.20 0.00 0.00 0.00 175.10 175.56 3dev s ASN 117 N 1.44 3.44 -0.27 3.32 0.01 -1.26 -2.06 114.94 119.57 3dev s ASN 117 Ca 0.13 -0.57 0.02 0.00 -0.71 0.00 0.00 52.86 51.73 3dev s ASN 117 Cb -0.15 -1.54 0.07 0.00 0.41 0.00 0.00 41.25 40.04 3dev s ASN 117 CO 0.09 0.02 -0.03 0.12 -1.51 0.00 0.00 177.10 175.79 3dev s PHE 118 N 1.21 2.78 -0.29 2.20 2.19 -0.85 -5.04 117.98 120.19 3dev s PHE 118 Ca 0.02 -2.13 0.03 0.00 0.33 0.00 0.00 56.93 55.18 3dev s PHE 118 Cb -0.14 -1.94 0.08 0.00 -1.31 0.00 0.00 43.02 39.71 3dev s PHE 118 CO -0.08 -0.84 -0.02 0.14 1.83 0.00 0.00 175.22 176.24 3dev s VAL 119 N 1.26 1.97 -1.16 3.12 -7.23 -1.26 -2.21 120.40 114.88 3dev s VAL 119 Ca -0.01 -1.79 -0.14 0.00 -1.81 0.00 0.00 61.98 58.23 3dev s VAL 119 Cb -0.19 -2.28 0.17 0.00 0.56 0.00 0.00 36.38 34.65 3dev s VAL 119 CO -0.08 -0.31 1.37 0.21 -0.31 0.00 0.00 175.10 175.98 3dev s ASN 120 N 1.13 7.02 0.33 4.85 3.84 -0.97 -4.83 114.94 126.31 3dev s ASN 120 Ca 0.00 -2.90 0.11 0.00 0.21 0.00 0.00 52.86 50.29 3dev s ASN 120 Cb -0.19 -2.39 0.93 0.00 -0.55 0.00 0.00 41.25 39.05 3dev s ASN 120 CO -0.08 -0.76 1.73 0.00 -2.79 0.00 0.00 177.10 175.20 3dev h THR 121 N 4.77 0.52 0.00 -5.21 1.03 -1.83 0.12 112.91 112.32 3dev h THR 121 Ca 0.29 -0.19 0.00 0.00 -0.01 0.00 0.00 66.41 66.50 3dev h THR 121 Cb 0.90 -0.07 0.00 0.00 -1.07 0.00 0.00 68.15 67.90 3dev h THR 121 CO 1.21 0.10 0.00 -0.62 -0.01 0.00 0.00 175.52 176.20 3dev n GLU 122 N -4.86 0.93 -2.85 0.00 -0.58 -1.26 -4.85 120.64 107.17 3dev n GLU 122 Ca 0.27 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.65 3dev n GLU 122 Cb 0.78 -1.32 -0.07 0.00 -0.57 0.00 0.00 31.44 30.26 3dev n GLU 122 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3dev s ALA 123 N -2.00 3.20 0.19 0.62 0.00 0.42 -4.95 121.76 119.24 3dev s ALA 123 Ca 0.29 0.42 0.25 0.00 0.00 0.00 0.00 51.96 52.92 3dev s ALA 123 Cb 0.13 -3.11 1.03 0.00 0.00 0.00 0.00 23.12 21.17 3dev s ALA 123 CO 0.22 0.19 1.88 0.66 0.00 0.00 0.00 175.76 178.71 3dev h SER 124 N 2.85 0.00 -4.82 0.00 4.64 -1.88 -3.47 113.55 110.87 3dev h SER 124 Ca -0.48 0.00 0.25 0.00 -0.47 0.00 0.00 61.79 61.10 3dev h SER 124 Cb 1.19 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.12 3dev h SER 124 CO 0.64 0.21 0.75 -0.94 -0.87 0.00 0.00 176.83 176.62 3dev s SER 125 N -6.18 -0.14 0.25 4.97 1.04 -1.26 -4.78 113.70 107.59 3dev s SER 125 Ca -0.00 -0.07 -0.05 0.00 0.48 0.00 0.00 55.95 56.31 3dev s SER 125 Cb 0.11 0.21 0.28 0.00 0.10 0.00 0.00 66.02 66.71 3dev s SER 125 CO 0.63 -0.35 1.80 0.74 0.98 0.00 0.00 173.24 177.03 3dev h THR 126 N 2.00 1.24 -0.58 2.02 2.02 -1.91 -2.03 112.91 115.67 3dev h THR 126 Ca -0.18 -0.83 0.11 0.00 0.77 0.00 0.00 66.41 66.29 3dev h THR 126 Cb 1.19 0.50 -0.09 0.00 -1.74 0.00 0.00 68.15 68.01 3dev h THR 126 CO 0.26 0.32 0.06 0.28 0.37 0.00 0.00 175.52 176.81 3dev h SER 127 N 0.98 -0.14 -0.88 4.18 0.02 -1.91 0.29 113.55 116.09 3dev h SER 127 Ca 0.22 0.13 0.07 0.00 -0.84 0.00 0.00 61.79 61.37 3dev h SER 127 Cb 0.26 0.20 -0.07 0.00 0.14 0.00 0.00 62.40 62.94 3dev h SER 127 CO -0.01 -0.05 0.54 -0.08 -1.14 0.00 0.00 176.83 176.09 3dev h GLU 128 N 0.18 0.94 -0.62 3.45 4.81 -1.69 -0.18 114.58 121.46 3dev h GLU 128 Ca 0.30 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.45 3dev h GLU 128 Cb 0.47 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 3dev h GLU 128 CO -0.44 0.62 0.28 0.82 -0.73 0.00 0.00 179.01 179.55 3dev h ILE 129 N 0.96 1.21 -0.49 2.32 2.04 -0.17 -1.58 117.51 121.81 3dev h ILE 129 Ca 0.40 -0.61 -0.05 0.00 1.00 0.00 0.00 64.86 65.60 3dev h ILE 129 Cb 0.24 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.74 3dev h ILE 129 CO -0.20 0.25 0.11 0.40 0.00 0.00 0.00 178.15 178.72 3dev h ILE 130 N 0.87 1.24 -0.95 -0.67 1.08 0.65 -0.56 117.51 119.17 3dev h ILE 130 Ca 0.21 -0.85 -0.00 0.00 -0.39 0.00 0.00 64.86 63.83 3dev h ILE 130 Cb 0.12 0.86 -0.05 0.00 -3.07 0.00 0.00 36.82 34.68 3dev h ILE 130 CO -0.03 0.31 0.58 0.15 -0.69 0.00 0.00 178.15 178.47 3dev h PHE 131 N 0.67 1.25 -0.34 1.37 3.57 -0.44 -1.22 116.94 121.80 3dev h PHE 131 Ca 0.15 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.67 3dev h PHE 131 Cb 0.34 -0.41 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 3dev h PHE 131 CO 0.02 0.83 0.19 -0.44 -2.23 0.00 0.00 178.31 176.68 3dev h ASP 132 N 1.31 0.30 0.70 0.41 3.45 -0.86 0.98 116.42 122.71 3dev h ASP 132 Ca 0.34 0.01 -0.03 0.00 0.43 0.00 0.00 57.03 57.78 3dev h ASP 132 Cb -0.06 -0.06 -0.00 0.00 -0.56 0.00 0.00 39.33 38.65 3dev h ASP 132 CO -0.06 0.22 -0.43 0.15 -1.57 0.00 0.00 179.24 177.54 3dev h PHE 133 N 0.39 -1.16 -0.14 4.55 3.57 -0.49 -0.44 116.94 123.23 3dev h PHE 133 Ca 0.14 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.59 3dev h PHE 133 Cb 0.02 0.41 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 3dev h PHE 133 CO -0.08 -0.65 -0.06 -0.84 -2.23 0.00 0.00 178.31 174.45 3dev h ILE 134 N -1.07 1.13 0.00 1.41 3.07 -1.20 -0.42 117.51 120.43 3dev h ILE 134 Ca -0.09 -0.54 -0.04 0.00 1.55 0.00 0.00 64.86 65.74 3dev h ILE 134 Cb 0.86 1.09 -0.01 0.00 -0.27 0.00 0.00 36.82 38.49 3dev h ILE 134 CO 0.09 0.17 -0.19 -1.28 -1.05 0.00 0.00 178.15 175.89 3dev h SER 135 N 0.21 0.00 0.53 2.16 0.87 -0.47 -1.70 113.55 115.15 3dev h SER 135 Ca 0.05 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 3dev h SER 135 Cb 0.24 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.20 3dev h SER 135 CO 0.01 0.19 0.00 1.57 -0.53 0.00 0.00 176.83 178.07 3dev n HIS 136 N -3.46 0.00 -1.22 2.24 -0.00 -0.17 -2.89 115.22 109.71 3dev n HIS 136 Ca -0.01 0.00 0.09 0.00 -0.00 0.00 0.00 57.72 57.80 3dev n HIS 136 Cb 0.37 -0.28 0.15 0.00 -0.00 0.00 0.00 29.99 30.23 3dev n HIS 136 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 3dev n PHE 137 N -1.28 0.00 -2.20 1.57 3.72 -0.66 -4.96 117.46 113.65 3dev n PHE 137 Ca 0.14 -1.09 -0.06 0.00 -0.05 0.00 0.00 57.45 56.39 3dev n PHE 137 Cb 0.23 -0.17 -0.01 0.00 -0.94 0.00 0.00 39.48 38.59 3dev n PHE 137 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3dev n ASN 138 N -1.33 -2.27 -1.43 4.37 4.05 -1.14 -4.80 115.26 112.71 3dev n ASN 138 Ca 0.16 0.31 -0.03 0.00 0.45 0.00 0.00 54.58 55.47 3dev n ASN 138 Cb 0.66 -2.08 0.17 0.00 1.23 0.00 0.00 39.78 39.76 3dev n ASN 138 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 3dev n ASP 139 N -1.24 3.53 0.00 1.20 10.43 -1.08 -4.27 116.55 125.12 3dev n ASP 139 Ca -0.07 -2.66 0.07 0.00 2.57 0.00 0.00 54.79 54.70 3dev n ASP 139 Cb 0.48 -0.64 0.41 0.00 1.84 0.00 0.00 41.12 43.21 3dev n ASP 139 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 3dev n LEU 140 N 0.05 0.00 -0.10 0.64 4.77 -1.26 -2.12 117.00 118.98 3dev n LEU 140 Ca 0.22 0.13 -0.12 0.00 -0.03 0.00 0.00 56.01 56.21 3dev n LEU 140 Cb 0.92 -0.13 -0.11 0.00 -2.33 0.00 0.00 43.42 41.77 3dev n LEU 140 CO 0.24 -0.07 -1.14 -1.54 -1.33 0.00 0.00 177.39 173.55 3dev n SER 141 N -1.13 1.73 0.19 -1.43 3.41 -1.26 -4.37 113.62 110.76 3dev n SER 141 Ca 0.09 -0.07 0.03 0.00 -0.26 0.00 0.00 58.87 58.66 3dev n SER 141 Cb 0.08 0.16 0.37 0.00 -0.26 0.00 0.00 64.21 64.56 3dev n SER 141 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 3dev h ILE 142 N 0.00 1.19 -4.20 -1.33 5.03 -1.73 -3.43 117.51 113.04 3dev h ILE 142 Ca -0.47 -1.32 -0.49 0.00 -0.12 0.00 0.00 64.86 62.46 3dev h ILE 142 Cb 1.87 1.73 0.05 0.00 -3.03 0.00 0.00 36.82 37.44 3dev h ILE 142 CO -0.04 0.37 0.38 -0.51 -0.68 0.00 0.00 178.15 177.67 3dev s ILE 143 N -4.08 3.97 0.13 -0.67 2.07 -0.94 -4.95 121.20 116.74 3dev s ILE 143 Ca -0.02 0.93 0.03 0.00 -1.41 0.00 0.00 60.65 60.18 3dev s ILE 143 Cb 0.14 -3.46 -0.01 0.00 0.13 0.00 0.00 42.46 39.26 3dev s ILE 143 CO 0.71 -0.55 0.12 -0.90 -1.91 0.00 0.00 174.94 172.41 3dev n ASP 144 N -1.95 -0.29 -0.32 4.50 3.85 -1.26 -4.99 116.55 116.09 3dev n ASP 144 Ca 0.08 -1.87 0.17 0.00 -0.71 0.00 0.00 54.79 52.47 3dev n ASP 144 Cb 0.53 0.68 0.42 0.00 -1.35 0.00 0.00 41.12 41.40 3dev n ASP 144 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 3dev h GLU 145 N 0.00 0.56 -0.64 0.11 3.07 -1.91 -1.68 114.58 114.08 3dev h GLU 145 Ca -0.09 -0.03 -0.07 0.00 -0.50 0.00 0.00 59.36 58.66 3dev h GLU 145 Cb 0.48 -0.13 -0.03 0.00 -0.84 0.00 0.00 28.75 28.23 3dev h GLU 145 CO 0.14 0.37 0.12 0.45 -1.40 0.00 0.00 179.01 178.69 3dev h HIS 146 N 0.57 1.12 -0.00 4.33 3.86 -1.96 -2.47 115.15 120.60 3dev h HIS 146 Ca 0.56 -0.15 -0.00 0.00 -1.16 0.00 0.00 60.37 59.62 3dev h HIS 146 Cb 1.14 -0.31 0.00 0.00 1.06 0.00 0.00 27.41 29.30 3dev h HIS 146 CO -0.00 0.94 -0.01 0.28 0.86 0.00 0.00 177.93 179.99 3dev h VAL 147 N 0.97 1.47 -0.71 2.45 2.07 -1.69 -3.24 116.25 117.57 3dev h VAL 147 Ca 0.20 -1.39 0.08 0.00 0.82 0.00 0.00 66.70 66.41 3dev h VAL 147 Cb 0.41 2.40 -0.05 0.00 -1.52 0.00 0.00 31.29 32.53 3dev h VAL 147 CO 0.01 0.36 0.47 0.00 0.02 0.00 0.00 177.57 178.43 3dev h ALA 148 N 0.42 1.80 -0.24 1.67 0.00 -1.47 -2.88 119.26 118.56 3dev h ALA 148 Ca 0.00 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.93 3dev h ALA 148 Cb 0.60 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.16 3dev h ALA 148 CO 0.00 0.07 -0.52 0.00 0.00 0.00 0.00 179.25 178.80 3dev h ARG 149 N 0.65 -0.46 -0.15 0.00 3.08 -1.46 0.18 114.38 116.22 3dev h ARG 149 Ca 0.32 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.40 3dev h ARG 149 Cb 0.38 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 3dev h ARG 149 CO -0.11 -0.31 0.10 -0.39 -1.07 0.00 0.00 179.97 178.19 3dev h VAL 150 N -0.48 1.04 -0.46 2.04 -1.51 -1.62 -1.81 116.25 113.45 3dev h VAL 150 Ca 0.05 -0.08 0.08 0.00 -1.23 0.00 0.00 66.70 65.52 3dev h VAL 150 Cb 0.61 0.83 -0.07 0.00 -2.13 0.00 0.00 31.29 30.53 3dev h VAL 150 CO -0.48 0.04 0.06 -0.07 -1.23 0.00 0.00 177.57 175.89 3dev h LEU 151 N 0.20 -0.07 0.00 4.19 3.38 -1.29 0.39 115.31 122.12 3dev h LEU 151 Ca 0.05 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3dev h LEU 151 Cb -0.02 0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.87 3dev h LEU 151 CO -0.01 -0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.51 3dev n TYR 152 N -5.15 0.00 -0.29 1.13 9.36 0.58 -1.21 117.16 121.58 3dev n TYR 152 Ca 0.04 0.00 0.22 0.00 3.32 0.00 0.00 57.90 61.48 3dev n TYR 152 Cb 0.23 -0.43 0.41 0.00 -0.63 0.00 0.00 39.34 38.92 3dev n TYR 152 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 3dev n LEU 153 N -1.97 0.15 0.32 2.98 4.32 -0.70 -0.03 117.00 122.06 3dev n LEU 153 Ca 0.00 1.45 -0.17 0.00 -0.02 0.00 0.00 56.01 57.28 3dev n LEU 153 Cb 0.00 -0.64 -0.09 0.00 -1.62 0.00 0.00 43.42 41.08 3dev n LEU 153 CO 0.00 -1.57 0.65 1.23 -1.22 0.00 0.00 177.39 176.48 3dev h GLY 154 N 0.00 -0.81 0.90 -0.72 0.00 0.24 -0.01 103.07 102.67 3dev h GLY 154 Ca 0.66 0.30 0.02 0.00 0.00 0.00 0.00 47.33 48.30 3dev h GLY 154 CO -0.73 -0.29 0.28 -2.22 0.00 0.00 0.00 176.54 173.58 3dev h ILE 155 N -0.83 1.06 -0.22 2.60 2.04 0.88 -2.28 117.51 120.77 3dev h ILE 155 Ca -0.08 -0.20 0.04 0.00 1.00 0.00 0.00 64.86 65.63 3dev h ILE 155 Cb 0.62 0.44 -0.07 0.00 -0.74 0.00 0.00 36.82 37.06 3dev h ILE 155 CO 0.13 0.10 -0.48 0.58 0.00 0.00 0.00 178.15 178.48 3dev h VAL 156 N 0.57 0.07 -0.17 1.67 2.07 -0.22 -1.96 116.25 118.28 3dev h VAL 156 Ca 0.19 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.70 3dev h VAL 156 Cb 0.00 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 29.83 3dev h VAL 156 CO -0.08 0.00 0.09 1.23 0.02 0.00 0.00 177.57 178.83 3dev h GLY 157 N -0.49 0.26 2.00 2.17 0.00 -0.88 0.33 103.07 106.47 3dev h GLY 157 Ca 0.07 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.28 3dev h GLY 157 CO -0.47 0.12 0.00 -1.80 0.00 0.00 0.00 176.54 174.39 3dev h ASP 158 N 0.16 0.00 -0.02 0.19 3.58 -1.19 -1.94 116.42 117.21 3dev h ASP 158 Ca 0.06 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.51 3dev h ASP 158 Cb 0.10 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.15 3dev h ASP 158 CO -0.01 0.00 0.00 0.35 -2.88 0.00 0.00 179.24 176.70 3dev n THR 159 N -2.92 0.77 -3.63 2.25 -2.24 -0.75 -4.98 114.28 102.78 3dev n THR 159 Ca -0.02 -0.89 -0.24 0.00 -2.27 0.00 0.00 64.05 60.64 3dev n THR 159 Cb 0.09 0.62 0.04 0.00 -2.10 0.00 0.00 70.33 68.98 3dev n THR 159 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dev n GLY 160 N -0.33 -0.65 3.30 3.38 0.00 0.06 -0.76 105.19 110.19 3dev n GLY 160 Ca 0.01 0.31 -0.16 0.00 0.00 0.00 0.00 46.02 46.17 3dev n GLY 160 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dev n ARG 161 N -4.07 -2.69 -4.10 1.61 5.12 0.94 -3.07 116.66 110.40 3dev n ARG 161 Ca -0.20 0.84 -0.28 0.00 -1.93 0.00 0.00 57.85 56.28 3dev n ARG 161 Cb 0.64 -5.74 -0.05 0.00 -1.16 0.00 0.00 32.46 26.16 3dev n ARG 161 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 3dev n PHE 162 N -3.39 -1.53 -0.05 -1.55 3.72 -1.16 -4.85 117.46 108.64 3dev n PHE 162 Ca -0.10 0.71 -0.08 0.00 -0.05 0.00 0.00 57.45 57.93 3dev n PHE 162 Cb 0.62 -3.35 -0.05 0.00 -0.94 0.00 0.00 39.48 35.77 3dev n PHE 162 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 3dev n LEU 163 N -4.45 2.56 -4.61 4.37 7.94 0.06 -4.98 117.00 117.88 3dev n LEU 163 Ca -0.27 -0.02 -0.31 0.00 -1.11 0.00 0.00 56.01 54.30 3dev n LEU 163 Cb 0.67 -0.36 0.17 0.00 0.53 0.00 0.00 43.42 44.43 3dev n LEU 163 CO 0.80 0.59 0.55 0.49 -1.11 0.00 0.00 177.39 178.70 3dev n PHE 164 N -2.94 0.30 0.29 1.96 0.99 -0.74 -4.89 117.46 112.42 3dev n PHE 164 Ca -0.19 0.31 0.17 0.00 -0.00 0.00 0.00 57.45 57.74 3dev n PHE 164 Cb 0.69 -1.93 0.87 0.00 -1.00 0.00 0.00 39.48 38.10 3dev n PHE 164 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 3dev h SER 165 N -1.96 0.00 0.00 4.37 4.64 -1.96 -2.39 113.55 116.24 3dev h SER 165 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3dev h SER 165 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3dev h SER 165 CO 0.41 0.06 0.00 -0.46 -0.87 0.00 0.00 176.83 175.97 3dev n ASN 166 N -3.38 0.00 -4.59 4.97 2.04 -1.26 -4.66 115.26 108.37 3dev n ASN 166 Ca -0.02 -0.67 -0.42 0.00 -0.44 0.00 0.00 54.58 53.03 3dev n ASN 166 Cb 0.20 0.00 -0.05 0.00 -2.53 0.00 0.00 39.78 37.40 3dev n ASN 166 CO 0.00 0.00 0.00 -0.89 -0.44 0.00 0.00 177.26 175.93 3dev s THR 167 N -2.00 4.78 0.37 5.53 2.01 -0.90 -4.21 115.64 121.22 3dev s THR 167 Ca 0.18 0.95 0.08 0.00 0.31 0.00 0.00 61.69 63.21 3dev s THR 167 Cb 0.08 -4.17 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 3dev s THR 167 CO 0.14 -0.35 0.23 -0.94 -0.69 0.00 0.00 174.62 173.01 3dev s SER 168 N 1.76 4.80 0.56 3.53 1.04 -1.26 -4.98 113.70 119.15 3dev s SER 168 Ca 0.31 -0.79 0.26 0.00 0.48 0.00 0.00 55.95 56.21 3dev s SER 168 Cb -0.14 -0.67 1.65 0.00 0.10 0.00 0.00 66.02 66.96 3dev s SER 168 CO 0.15 -0.45 2.21 1.55 0.98 0.00 0.00 173.24 177.68 3dev h PRO 169 N 1.35 0.00 -0.11 4.02 0.13 -2.00 0.23 132.00 135.61 3dev h PRO 169 Ca -0.43 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.55 3dev h PRO 169 Cb 1.26 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.39 3dev h PRO 169 CO 0.63 0.02 -0.53 1.25 -0.23 0.00 0.00 178.00 179.14 3dev h HIS 170 N 0.00 0.75 0.00 1.56 -0.00 -2.00 -2.34 115.15 113.11 3dev h HIS 170 Ca -0.00 -0.33 0.00 0.00 -0.00 0.00 0.00 60.37 60.04 3dev h HIS 170 Cb 0.04 -0.12 0.00 0.00 -0.00 0.00 0.00 27.41 27.34 3dev h HIS 170 CO 0.00 1.11 0.00 2.41 -0.00 0.00 0.00 177.93 181.45 3dev n THR 171 N -4.20 0.00 0.00 6.26 -1.04 0.07 -0.66 114.28 114.71 3dev n THR 171 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 3dev n THR 171 Cb 0.61 -0.10 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 3dev n THR 171 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 3dev n GLU 173 N 0.47 0.00 -0.06 -2.82 2.13 -0.88 -1.39 120.64 118.09 3dev n GLU 173 Ca 0.00 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.72 3dev n GLU 173 Cb 0.00 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 31.67 3dev n GLU 173 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3dev h VAL 174 N 0.00 1.12 -0.57 6.31 2.07 -1.18 0.51 116.25 124.51 3dev h VAL 174 Ca 0.00 -0.33 0.06 0.00 0.82 0.00 0.00 66.70 67.26 3dev h VAL 174 Cb 0.00 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 3dev h VAL 174 CO 0.00 0.12 0.27 0.00 0.02 0.00 0.00 177.57 177.98 3dev h ALA 175 N 0.99 0.74 -0.20 1.67 0.00 -1.48 -0.85 119.26 120.14 3dev h ALA 175 Ca 0.08 0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.08 3dev h ALA 175 Cb 0.08 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 3dev h ALA 175 CO -0.01 -0.09 -0.22 1.03 0.00 0.00 0.00 179.25 179.96 3dev h SER 176 N 0.52 -0.69 -0.52 0.00 0.87 -1.65 -2.35 113.55 109.72 3dev h SER 176 Ca 0.26 0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.93 3dev h SER 176 Cb 0.21 0.33 -0.03 0.00 -0.44 0.00 0.00 62.40 62.47 3dev h SER 176 CO -0.20 -0.26 0.28 1.56 -0.53 0.00 0.00 176.83 177.68 3dev h GLN 177 N -0.24 0.77 -0.51 2.24 4.20 0.25 -2.94 115.11 118.88 3dev h GLN 177 Ca 0.12 -0.09 -0.10 0.00 0.06 0.00 0.00 58.65 58.65 3dev h GLN 177 Cb 0.43 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 3dev h GLN 177 CO -0.34 0.58 -0.07 -0.07 -0.67 0.00 0.00 178.83 178.26 3dev h LEU 178 N 0.77 0.95 -2.92 1.46 -0.00 -0.74 -2.88 115.31 111.95 3dev h LEU 178 Ca 0.19 -0.34 0.00 0.00 -0.00 0.00 0.00 57.88 57.73 3dev h LEU 178 Cb 0.06 -0.26 0.00 0.00 -0.00 0.00 0.00 40.66 40.46 3dev h LEU 178 CO -0.03 1.07 0.00 -0.07 -0.00 0.00 0.00 178.44 179.41 3dev h LEU 179 N 0.82 0.00 -0.65 1.67 3.38 -1.25 -1.63 115.31 117.65 3dev h LEU 179 Ca 0.14 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.18 3dev h LEU 179 Cb 0.62 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.31 3dev h LEU 179 CO 0.04 0.00 0.32 0.00 0.09 0.00 0.00 178.44 178.89 3dev h ALA 180 N 2.00 0.87 -2.62 1.53 0.00 -1.52 -3.41 119.26 116.10 3dev h ALA 180 Ca 0.00 0.04 -0.53 0.00 0.00 0.00 0.00 54.91 54.43 3dev h ALA 180 Cb 0.01 -0.05 0.04 0.00 0.00 0.00 0.00 17.79 17.79 3dev h ALA 180 CO 0.00 -0.06 0.78 0.71 0.00 0.00 0.00 179.25 180.69 3dev s TYR 181 N -6.09 3.13 -0.13 0.00 2.02 -0.62 -4.94 117.35 110.73 3dev s TYR 181 Ca -0.13 0.87 -0.29 0.00 -0.37 0.00 0.00 57.07 57.15 3dev s TYR 181 Cb 0.17 -3.80 -0.05 0.00 -0.40 0.00 0.00 41.96 37.87 3dev s TYR 181 CO 0.75 -2.80 1.88 -1.25 -1.57 0.00 0.00 175.55 172.57 3dev s PRO 182 N 0.71 3.76 0.00 -1.71 0.04 -1.26 -4.62 135.00 131.92 3dev s PRO 182 Ca 0.65 2.09 0.00 0.00 0.04 0.00 0.00 61.00 63.78 3dev s PRO 182 Cb -0.40 -4.16 0.00 0.00 0.04 0.00 0.00 34.50 29.98 3dev s PRO 182 CO 0.34 -1.36 0.00 1.97 0.04 0.00 0.00 177.00 177.98 3dev n PHE 183 N 8.90 0.00 -2.62 0.56 -1.74 -1.26 -4.64 117.46 116.66 3dev n PHE 183 Ca 0.22 0.00 -0.04 0.00 -0.56 0.00 0.00 57.45 57.07 3dev n PHE 183 Cb 0.44 0.00 -0.04 0.00 1.52 0.00 0.00 39.48 41.40 3dev n PHE 183 CO 0.00 0.00 0.00 -1.71 -0.56 0.00 0.00 176.76 174.49 3dev n ASN 184 N 0.00 -2.36 -0.14 5.98 5.15 -1.26 -4.72 115.26 117.90 3dev n ASN 184 Ca 0.00 1.37 -0.12 0.00 -0.60 0.00 0.00 54.58 55.23 3dev n ASN 184 Cb 0.01 -5.29 -0.01 0.00 -0.53 0.00 0.00 39.78 33.96 3dev n ASN 184 CO 0.00 0.00 0.00 1.12 1.40 0.00 0.00 177.26 179.78 3dev h HIS 185 N 3.80 1.04 -0.65 1.20 2.07 -1.96 -2.98 115.15 117.68 3dev h HIS 185 Ca -0.42 -0.27 0.13 0.00 -2.85 0.00 0.00 60.37 56.97 3dev h HIS 185 Cb 0.95 -0.24 -0.10 0.00 2.57 0.00 0.00 27.41 30.59 3dev h HIS 185 CO 0.00 1.06 0.09 -0.97 -3.07 0.00 0.00 177.93 175.04 3dev h ASN 186 N 0.73 -0.12 0.49 3.10 -0.00 -1.99 0.57 115.58 118.36 3dev h ASN 186 Ca 0.09 0.14 -0.02 0.00 -0.00 0.00 0.00 56.30 56.51 3dev h ASN 186 Cb 0.80 0.22 0.00 0.00 -0.00 0.00 0.00 38.32 39.34 3dev h ASN 186 CO 0.07 -0.06 -0.23 0.00 -0.00 0.00 0.00 177.43 177.20 3dev h ALA 187 N 1.56 -1.06 -0.78 1.57 0.00 -1.90 -2.16 119.26 116.49 3dev h ALA 187 Ca 0.35 -0.14 0.18 0.00 0.00 0.00 0.00 54.91 55.30 3dev h ALA 187 Cb 0.57 0.25 -0.13 0.00 0.00 0.00 0.00 17.79 18.48 3dev h ALA 187 CO -0.49 -1.01 0.04 0.93 0.00 0.00 0.00 179.25 178.71 3dev h GLU 188 N -0.72 0.11 -0.29 0.00 4.39 -1.30 -0.72 114.58 116.05 3dev h GLU 188 Ca -0.07 -0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.66 3dev h GLU 188 Cb 0.50 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.09 3dev h GLU 188 CO 0.11 0.08 0.07 -0.07 -1.16 0.00 0.00 179.01 178.03 3dev h LEU 189 N 0.12 0.04 -0.05 1.33 3.38 0.16 -3.05 115.31 117.24 3dev h LEU 189 Ca 0.44 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.46 3dev h LEU 189 Cb 0.79 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 3dev h LEU 189 CO -0.67 0.06 -0.01 0.78 0.09 0.00 0.00 178.44 178.69 3dev h ASN 190 N 0.18 -0.04 0.00 -0.43 -0.26 -0.47 -0.54 115.58 114.02 3dev h ASN 190 Ca 0.13 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.88 3dev h ASN 190 Cb 0.13 0.03 0.00 0.00 -1.06 0.00 0.00 38.32 37.42 3dev h ASN 190 CO -0.16 -0.01 0.00 1.17 -1.06 0.00 0.00 177.43 177.36 3dev n LYS 191 N -5.11 0.00 0.00 0.81 4.81 -0.83 -0.60 118.16 117.24 3dev n LYS 191 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.38 3dev n LYS 191 Cb 0.05 -1.36 0.00 0.00 0.02 0.00 0.00 35.03 33.74 3dev n LYS 191 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 3dev n SER 193 N 1.15 0.00 -4.39 3.14 7.64 -0.21 -5.01 113.62 115.93 3dev n SER 193 Ca 0.00 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.52 3dev n SER 193 Cb 0.00 0.00 0.07 0.00 -1.01 0.00 0.00 64.21 63.27 3dev n SER 193 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3dev n GLU 194 N 0.00 0.16 -4.11 1.43 1.02 0.23 -5.02 120.64 114.36 3dev n GLU 194 Ca 0.00 0.09 -0.09 0.00 -0.02 0.00 0.00 57.16 57.14 3dev n GLU 194 Cb 0.00 -1.67 -0.10 0.00 -0.02 0.00 0.00 31.44 29.64 3dev n GLU 194 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3dev s LYS 195 N -2.65 0.65 -0.32 3.49 1.02 -1.26 -5.13 119.74 115.54 3dev s LYS 195 Ca 0.61 -1.16 -0.20 0.00 0.02 0.00 0.00 55.97 55.24 3dev s LYS 195 Cb -0.33 0.01 -0.01 0.00 -0.52 0.00 0.00 37.83 36.99 3dev s LYS 195 CO 0.63 -0.06 0.60 0.34 -0.92 0.00 0.00 175.35 175.94 3dev s ASP 196 N -2.71 6.44 0.57 2.83 3.68 -1.26 -4.94 116.67 121.28 3dev s ASP 196 Ca 0.05 0.28 0.26 0.00 2.13 0.00 0.00 52.55 55.27 3dev s ASP 196 Cb 0.04 -2.31 1.58 0.00 -1.45 0.00 0.00 42.92 40.77 3dev s ASP 196 CO -0.06 -0.49 2.14 1.55 0.13 0.00 0.00 175.17 178.43 3dev h PRO 197 N 8.30 0.00 -0.62 4.34 0.13 -2.05 -2.26 132.00 139.83 3dev h PRO 197 Ca -0.27 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.97 3dev h PRO 197 Cb 1.12 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.17 3dev h PRO 197 CO 0.80 0.00 0.20 0.87 -0.23 0.00 0.00 178.00 179.64 3dev h LYS 198 N 0.00 0.35 -2.99 0.86 1.79 -2.03 -3.34 116.57 111.20 3dev h LYS 198 Ca 0.07 -0.02 -0.69 0.00 -2.18 0.00 0.00 60.65 57.82 3dev h LYS 198 Cb 0.33 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.88 3dev h LYS 198 CO -0.00 0.23 3.42 1.28 -1.08 0.00 0.00 179.45 183.30 3dev n LEU 199 N -5.05 8.42 0.00 2.94 4.77 -0.85 -4.60 117.00 122.63 3dev n LEU 199 Ca 0.09 -4.49 0.00 0.00 -0.03 0.00 0.00 56.01 51.59 3dev n LEU 199 Cb 0.31 -1.52 0.00 0.00 -2.33 0.00 0.00 43.42 39.88 3dev n LEU 199 CO 0.20 1.99 0.00 -0.81 -1.33 0.00 0.00 177.39 177.44 3dev n PRO 201 N 3.32 0.00 -0.05 3.23 -0.04 -1.26 -1.94 135.00 138.26 3dev n PRO 201 Ca 0.72 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 64.09 3dev n PRO 201 Cb 0.25 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.68 3dev n PRO 201 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 3dev h PHE 202 N 0.00 0.24 -0.47 0.54 3.57 -1.92 -1.45 116.94 117.44 3dev h PHE 202 Ca 0.00 0.01 0.14 0.00 3.53 0.00 0.00 57.97 61.65 3dev h PHE 202 Cb 0.00 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.65 3dev h PHE 202 CO 0.00 0.14 0.41 0.37 -2.23 0.00 0.00 178.31 177.00 3dev h GLN 203 N 0.27 0.00 -0.12 1.11 4.15 -1.78 0.87 115.11 119.60 3dev h GLN 203 Ca 0.09 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.37 3dev h GLN 203 Cb -0.00 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 3dev h GLN 203 CO -0.04 0.00 -0.51 0.78 -1.93 0.00 0.00 178.83 177.12 3dev h GLY 204 N 0.00 0.37 0.90 2.39 0.00 -1.55 -2.56 103.07 102.63 3dev h GLY 204 Ca 0.23 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 3dev h GLY 204 CO -0.00 0.37 0.10 -1.82 0.00 0.00 0.00 176.54 175.19 3dev h TYR 205 N 0.27 0.40 -0.94 5.60 3.20 0.98 -0.98 116.97 125.51 3dev h TYR 205 Ca 0.01 -0.03 0.09 0.00 3.14 0.00 0.00 58.73 61.93 3dev h TYR 205 Cb 0.99 -0.12 -0.07 0.00 1.54 0.00 0.00 36.73 39.08 3dev h TYR 205 CO 0.03 0.42 0.60 0.28 -1.64 0.00 0.00 178.16 177.85 3dev h VAL 206 N 0.26 1.01 0.00 1.81 2.07 -1.25 0.85 116.25 121.01 3dev h VAL 206 Ca 0.09 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 67.20 3dev h VAL 206 Cb 0.20 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.88 3dev h VAL 206 CO -0.01 0.18 -0.31 -0.07 0.02 0.00 0.00 177.57 177.39 3dev h LEU 207 N 1.00 0.00 -0.04 2.57 3.38 -1.01 -3.04 115.31 118.17 3dev h LEU 207 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 3dev h LEU 207 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3dev h LEU 207 CO -0.18 0.31 -0.58 0.00 0.09 0.00 0.00 178.44 178.07 3dev n GLN 208 N -3.37 0.05 -3.65 1.13 6.02 -0.29 -4.58 117.38 112.70 3dev n GLN 208 Ca 0.01 -0.04 -0.28 0.00 -0.01 0.00 0.00 57.00 56.68 3dev n GLN 208 Cb 0.52 -1.50 -0.11 0.00 1.02 0.00 0.00 30.24 30.17 3dev n GLN 208 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 3dev s ASN 209 N -2.97 3.20 0.00 1.08 -0.87 0.14 -5.07 114.94 110.45 3dev s ASN 209 Ca 0.11 -3.26 0.00 0.00 -1.57 0.00 0.00 52.86 48.14 3dev s ASN 209 Cb 0.17 -1.01 0.00 0.00 -0.02 0.00 0.00 41.25 40.39 3dev s ASN 209 CO 0.72 -0.16 0.00 0.49 -2.57 0.00 0.00 177.10 175.58 3dev n PHE 210 N 2.68 0.00 0.00 2.20 0.99 -1.26 -4.72 117.46 117.35 3dev n PHE 210 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.66 3dev n PHE 210 Cb 0.40 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.88 3dev n PHE 210 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.76 174.85 3dev n GLU 211 N 0.00 0.00 -3.61 -1.08 4.07 -1.18 -4.78 120.64 114.06 3dev n GLU 211 Ca 0.00 0.00 -0.34 0.00 -0.06 0.00 0.00 57.16 56.76 3dev n GLU 211 Cb 0.00 0.00 -0.05 0.00 -0.06 0.00 0.00 31.44 31.33 3dev n GLU 211 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 3dev s LEU 212 N 0.00 4.34 0.95 4.31 1.02 -1.26 -2.39 118.68 125.65 3dev s LEU 212 Ca 0.00 0.73 -0.12 0.00 0.02 0.00 0.00 54.13 54.76 3dev s LEU 212 Cb 0.00 -2.98 0.16 0.00 0.02 0.00 0.00 46.19 43.39 3dev s LEU 212 CO 0.00 0.17 1.09 -0.55 0.02 0.00 0.00 176.35 177.08 3dev s SER 213 N -1.84 2.99 0.56 2.29 0.15 0.35 -4.84 113.70 113.36 3dev s SER 213 Ca 0.33 1.46 0.33 0.00 0.70 0.00 0.00 55.95 58.78 3dev s SER 213 Cb -0.14 -2.13 1.67 0.00 -1.71 0.00 0.00 66.02 63.71 3dev s SER 213 CO 0.19 -2.94 2.13 0.44 1.20 0.00 0.00 173.24 174.25 3dev h ASP 214 N -1.76 0.00 0.22 5.45 3.45 -1.98 -1.32 116.42 120.49 3dev h ASP 214 Ca -0.51 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.95 3dev h ASP 214 Cb 1.30 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.07 3dev h ASP 214 CO 0.54 0.06 -0.59 -1.54 -1.57 0.00 0.00 179.24 176.14 3dev n SER 215 N -3.38 0.99 0.00 6.45 3.41 -1.26 -4.96 113.62 114.87 3dev n SER 215 Ca -0.02 -0.79 0.00 0.00 -0.26 0.00 0.00 58.87 57.80 3dev n SER 215 Cb 0.21 0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.64 3dev n SER 215 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3dev n HIS 216 N -1.10 0.00 0.18 7.33 8.25 -0.50 -4.87 115.22 124.51 3dev n HIS 216 Ca 0.07 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.56 3dev n HIS 216 Cb 0.36 -0.48 0.31 0.00 1.12 0.00 0.00 29.99 31.30 3dev n HIS 216 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 3dev h GLU 217 N 1.81 0.00 -6.47 -0.41 5.08 -1.83 -3.15 114.58 109.62 3dev h GLU 217 Ca 0.00 0.00 -0.69 0.00 -1.00 0.00 0.00 59.36 57.67 3dev h GLU 217 Cb 0.00 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 28.95 3dev h GLU 217 CO 0.00 0.44 -0.89 -0.47 -1.00 0.00 0.00 179.01 177.09 3dev s TYR 218 N -3.85 2.33 -0.10 4.33 6.14 -1.26 0.03 117.35 124.97 3dev s TYR 218 Ca -0.02 -0.49 -0.08 0.00 0.64 0.00 0.00 57.07 57.13 3dev s TYR 218 Cb 0.13 -1.51 0.03 0.00 0.42 0.00 0.00 41.96 41.04 3dev s TYR 218 CO 0.72 -0.08 0.26 0.00 0.64 0.00 0.00 175.55 177.09 3dev s GLN 220 N 0.62 0.94 -0.13 0.00 -2.07 -1.00 -4.14 119.66 113.87 3dev s GLN 220 Ca -0.04 -1.44 -0.04 0.00 -1.82 0.00 0.00 55.36 52.02 3dev s GLN 220 Cb -0.05 0.09 0.06 0.00 -1.09 0.00 0.00 33.01 32.02 3dev s GLN 220 CO -0.04 -0.20 0.17 0.42 -1.32 0.00 0.00 175.29 174.32 3dev s ILE 221 N -3.92 -0.26 -0.38 3.63 1.09 -1.26 -3.09 121.20 117.00 3dev s ILE 221 Ca 0.22 0.14 -0.18 0.00 -1.10 0.00 0.00 60.65 59.72 3dev s ILE 221 Cb 0.07 -0.46 0.01 0.00 -1.06 0.00 0.00 42.46 41.02 3dev s ILE 221 CO 0.01 -0.02 0.52 -0.54 -0.10 0.00 0.00 174.94 174.81 3dev s LYS 222 N 2.29 3.44 -0.83 2.79 1.02 -1.26 -2.14 119.74 125.05 3dev s LYS 222 Ca 0.04 -0.33 -0.14 0.00 0.02 0.00 0.00 55.97 55.56 3dev s LYS 222 Cb -0.14 -3.87 0.22 0.00 -0.52 0.00 0.00 37.83 33.52 3dev s LYS 222 CO -0.08 -0.76 0.78 0.42 -0.92 0.00 0.00 175.35 174.79 3dev s ILE 223 N 2.42 5.59 0.64 2.17 -1.09 0.07 -5.03 121.20 125.97 3dev s ILE 223 Ca 0.18 -2.44 -0.16 0.00 -2.23 0.00 0.00 60.65 56.00 3dev s ILE 223 Cb -0.15 -4.48 -0.01 0.00 -1.58 0.00 0.00 42.46 36.24 3dev s ILE 223 CO 0.14 -1.04 1.15 0.28 -1.23 0.00 0.00 174.94 174.24 3dev s THR 224 N 0.25 2.91 0.48 2.92 -1.32 -1.26 -1.33 115.64 118.29 3dev s THR 224 Ca 0.18 0.48 0.24 0.00 -1.21 0.00 0.00 61.69 61.38 3dev s THR 224 Cb -0.10 -3.05 0.42 0.00 -1.51 0.00 0.00 72.50 68.25 3dev s THR 224 CO -0.09 -0.21 1.90 -1.13 -2.21 0.00 0.00 174.62 172.89 3dev h ASN 225 N 0.31 0.18 0.44 8.08 -0.73 -1.97 -2.13 115.58 119.76 3dev h ASN 225 Ca -0.48 0.02 -0.01 0.00 1.87 0.00 0.00 56.30 57.70 3dev h ASN 225 Cb 1.27 -0.02 -0.02 0.00 0.27 0.00 0.00 38.32 39.82 3dev h ASN 225 CO 0.54 0.08 -0.44 0.44 -0.37 0.00 0.00 177.43 177.67 3dev h ASP 226 N 0.18 -1.21 -0.07 1.15 3.32 -1.97 -1.90 116.42 115.94 3dev h ASP 226 Ca 0.40 0.10 0.02 0.00 0.02 0.00 0.00 57.03 57.57 3dev h ASP 226 Cb 1.29 0.40 -0.00 0.00 0.22 0.00 0.00 39.33 41.24 3dev h ASP 226 CO -0.08 -0.60 0.05 -0.37 -1.72 0.00 0.00 179.24 176.52 3dev h VAL 227 N -0.90 0.97 0.00 -1.35 -1.51 -1.76 0.29 116.25 111.99 3dev h VAL 227 Ca -0.04 -0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.41 3dev h VAL 227 Cb 0.79 0.96 -0.00 0.00 -2.13 0.00 0.00 31.29 30.91 3dev h VAL 227 CO -0.06 0.00 -0.04 -0.07 -1.23 0.00 0.00 177.57 176.16 3dev h LEU 228 N 0.01 0.00 0.00 4.19 3.38 -0.95 -1.69 115.31 120.25 3dev h LEU 228 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3dev h LEU 228 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3dev h LEU 228 CO -0.00 0.04 -1.43 0.29 0.09 0.00 0.00 178.44 177.43 3dev n LYS 229 N -3.63 0.50 -0.06 1.13 4.76 -0.24 -1.19 118.16 119.43 3dev n LYS 229 Ca -0.02 -0.09 -0.05 0.00 -2.87 0.00 0.00 58.31 55.27 3dev n LYS 229 Cb 0.15 -1.24 0.15 0.00 -1.84 0.00 0.00 35.03 32.25 3dev n LYS 229 CO 0.00 0.00 0.00 0.37 -1.37 0.00 0.00 177.40 176.40 3dev h GLN 230 N 0.00 0.68 -0.24 1.97 4.15 -0.17 -2.52 115.11 118.98 3dev h GLN 230 Ca 0.00 -0.23 0.00 0.00 0.77 0.00 0.00 58.65 59.19 3dev h GLN 230 Cb 0.47 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.11 3dev h GLN 230 CO 0.00 0.80 0.00 1.19 -1.93 0.00 0.00 178.83 178.89 3dev n PHE 231 N -4.15 0.30 -3.35 3.99 3.72 -0.67 -5.02 117.46 112.28 3dev n PHE 231 Ca 0.01 -0.17 -0.23 0.00 -0.05 0.00 0.00 57.45 57.01 3dev n PHE 231 Cb 0.38 -0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.93 3dev n PHE 231 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3dev n ASP 232 N 1.29 -6.28 -3.79 4.37 2.03 -0.95 -4.94 116.55 108.28 3dev n ASP 232 Ca 0.16 -0.16 -0.13 0.00 0.52 0.00 0.00 54.79 55.18 3dev n ASP 232 Cb 0.55 -3.09 -0.11 0.00 -0.72 0.00 0.00 41.12 37.76 3dev n ASP 232 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 3dev s ILE 233 N -2.31 0.02 0.60 5.18 -4.36 -0.33 -5.01 121.20 114.99 3dev s ILE 233 Ca 0.21 -0.19 -0.16 0.00 -0.26 0.00 0.00 60.65 60.25 3dev s ILE 233 Cb -0.03 -0.44 -0.03 0.00 1.25 0.00 0.00 42.46 43.20 3dev s ILE 233 CO 0.84 -0.10 1.07 -1.10 0.24 0.00 0.00 174.94 175.88 3dev s GLN 234 N -0.36 3.25 0.42 0.37 -1.52 -1.26 -4.63 119.66 115.92 3dev s GLN 234 Ca -0.05 1.26 0.12 0.00 -1.95 0.00 0.00 55.36 54.74 3dev s GLN 234 Cb -0.03 -2.02 0.96 0.00 -0.22 0.00 0.00 33.01 31.69 3dev s GLN 234 CO 0.01 -0.88 1.98 -1.00 -0.25 0.00 0.00 175.29 175.15 3dev h PRO 235 N 0.44 0.48 0.53 2.91 0.13 -1.92 -2.30 132.00 132.27 3dev h PRO 235 Ca -0.47 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.60 3dev h PRO 235 Cb 1.23 -0.11 0.01 0.00 0.13 0.00 0.00 31.00 32.25 3dev h PRO 235 CO 0.57 0.32 -0.25 -0.91 -0.23 0.00 0.00 178.00 177.49 3dev h ASN 236 N 0.49 -0.60 -0.46 1.44 -0.26 -1.98 -2.72 115.58 111.49 3dev h ASN 236 Ca 0.28 -0.05 0.09 0.00 -0.56 0.00 0.00 56.30 56.07 3dev h ASN 236 Cb 0.46 0.16 -0.10 0.00 -1.06 0.00 0.00 38.32 37.78 3dev h ASN 236 CO -0.08 -0.30 -0.22 -0.33 -1.06 0.00 0.00 177.43 175.44 3dev h GLU 237 N -0.90 -0.12 -0.05 0.81 5.08 -1.80 -0.65 114.58 116.95 3dev h GLU 237 Ca -0.07 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 3dev h GLU 237 Cb 0.61 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.88 3dev h GLU 237 CO 0.12 -0.08 -0.03 0.00 -1.00 0.00 0.00 179.01 178.02 3dev h ALA 238 N 1.18 1.86 0.00 3.43 0.00 -1.49 -2.37 119.26 121.88 3dev h ALA 238 Ca 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3dev h ALA 238 Cb 0.46 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3dev h ALA 238 CO -0.54 0.11 0.00 0.43 0.00 0.00 0.00 179.25 179.25 3dev n SER 239 N -4.46 0.00 -0.19 0.00 7.64 -0.25 -2.08 113.62 114.28 3dev n SER 239 Ca -0.02 -0.02 0.13 0.00 1.01 0.00 0.00 58.87 59.97 3dev n SER 239 Cb 0.14 -0.19 0.32 0.00 -1.01 0.00 0.00 64.21 63.46 3dev n SER 239 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dev n GLN 240 N -1.19 0.62 -1.55 1.43 10.64 -0.89 -4.17 117.38 122.27 3dev n GLN 240 Ca 0.06 -0.38 -0.32 0.00 -1.83 0.00 0.00 57.00 54.54 3dev n GLN 240 Cb 0.07 -1.49 0.01 0.00 -0.86 0.00 0.00 30.24 27.97 3dev n GLN 240 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 3dev n PHE 241 N -0.86 2.32 -0.02 2.61 3.72 -0.88 -4.56 117.46 119.77 3dev n PHE 241 Ca 0.10 -2.23 -0.08 0.00 -0.05 0.00 0.00 57.45 55.19 3dev n PHE 241 Cb 0.35 -1.27 -0.06 0.00 -0.94 0.00 0.00 39.48 37.55 3dev n PHE 241 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3dev h VAL 242 N 1.74 0.81 0.00 -4.37 2.07 -1.83 -3.28 116.25 111.39 3dev h VAL 242 Ca 0.47 -1.47 0.00 0.00 0.82 0.00 0.00 66.70 66.53 3dev h VAL 242 Cb 0.50 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 3dev h VAL 242 CO 1.17 0.26 0.00 0.59 0.02 0.00 0.00 177.57 179.60 3dev n ASN 243 N -4.77 2.18 -0.41 0.57 5.03 -1.26 -3.70 115.26 112.89 3dev n ASN 243 Ca -0.05 -1.47 0.13 0.00 0.87 0.00 0.00 54.58 54.06 3dev n ASN 243 Cb 0.23 -0.37 0.54 0.00 -1.02 0.00 0.00 39.78 39.16 3dev n ASN 243 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 3dev n THR 244 N 0.63 0.06 -0.44 3.41 -1.04 -1.24 -3.61 114.28 112.05 3dev n THR 244 Ca 0.00 -0.23 0.00 0.00 -2.04 0.00 0.00 64.05 61.78 3dev n THR 244 Cb 0.36 0.29 0.00 0.00 -1.82 0.00 0.00 70.33 69.16 3dev n THR 244 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 3dev n VAL 245 N 0.01 0.00 -0.01 12.58 0.31 -1.24 -4.83 118.33 125.15 3dev n VAL 245 Ca 0.19 -0.24 0.11 0.00 -0.01 0.00 0.00 64.34 64.39 3dev n VAL 245 Cb 0.30 1.44 0.53 0.00 -0.91 0.00 0.00 33.84 35.19 3dev n VAL 245 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3dev h ALA 246 N 0.00 2.01 0.00 3.52 0.00 -1.81 -2.52 119.26 120.46 3dev h ALA 246 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dev h ALA 246 Cb 0.22 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3dev h ALA 246 CO 0.00 -0.10 0.00 -0.25 0.00 0.00 0.00 179.25 178.90 3dev n ASP 247 N -4.47 0.00 -4.76 0.00 10.43 -1.26 -4.85 116.55 111.64 3dev n ASP 247 Ca 0.07 -0.60 -0.41 0.00 2.57 0.00 0.00 54.79 56.42 3dev n ASP 247 Cb 0.30 -0.09 -0.01 0.00 1.84 0.00 0.00 41.12 43.16 3dev n ASP 247 CO 0.00 0.00 0.00 -0.38 -1.07 0.00 0.00 177.20 175.75 3dev n ILE 248 N -1.09 1.47 -1.89 0.53 5.41 -0.95 -4.86 119.36 117.98 3dev n ILE 248 Ca 0.18 -0.37 -0.43 0.00 1.00 0.00 0.00 62.75 63.13 3dev n ILE 248 Cb 0.13 -1.96 -0.03 0.00 -0.71 0.00 0.00 39.64 37.06 3dev n ILE 248 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 3dev s SER 249 N 0.21 6.28 0.00 4.38 1.04 -1.26 -2.39 113.70 121.95 3dev s SER 249 Ca 0.59 2.06 0.00 0.00 0.48 0.00 0.00 55.95 59.08 3dev s SER 249 Cb -0.49 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.10 3dev s SER 249 CO 0.56 -1.27 0.00 0.61 0.98 0.00 0.00 173.24 174.11 3dev n GLY 250 N 4.73 0.70 3.70 7.32 0.00 -1.26 -4.93 105.19 115.45 3dev n GLY 250 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 3dev n GLY 250 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3dev n LEU 251 N 0.00 3.85 -0.05 0.99 0.00 -1.01 -4.10 117.00 116.69 3dev n LEU 251 Ca 0.00 1.03 -0.06 0.00 0.00 0.00 0.00 56.01 56.98 3dev n LEU 251 Cb 0.00 -1.53 -0.06 0.00 0.00 0.00 0.00 43.42 41.83 3dev n LEU 251 CO 0.00 0.10 -0.81 0.29 0.00 0.00 0.00 177.39 176.97 3dev n LYS 252 N 4.73 1.42 -3.76 1.96 5.02 0.19 -4.73 118.16 122.98 3dev n LYS 252 Ca 0.17 0.03 -0.13 0.00 -2.02 0.00 0.00 58.31 56.37 3dev n LYS 252 Cb 0.35 -1.21 -0.12 0.00 -0.02 0.00 0.00 35.03 34.03 3dev n LYS 252 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 3dev s ILE 253 N -2.21 -0.01 0.10 -0.18 2.07 0.10 0.16 121.20 121.24 3dev s ILE 253 Ca -0.09 0.04 0.01 0.00 -1.41 0.00 0.00 60.65 59.20 3dev s ILE 253 Cb 0.03 -0.38 -0.00 0.00 0.13 0.00 0.00 42.46 42.23 3dev s ILE 253 CO 0.29 0.02 0.11 -2.67 -1.91 0.00 0.00 174.94 170.78 3dev n TRP 254 N 3.34 -0.46 -3.15 3.50 4.27 0.01 -1.78 117.44 123.17 3dev n TRP 254 Ca -0.17 -0.80 0.06 0.00 -3.89 0.00 0.00 57.50 52.70 3dev n TRP 254 Cb 0.57 0.12 -0.02 0.00 -1.36 0.00 0.00 31.31 30.63 3dev n TRP 254 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 3dev s PHE 256 N -3.27 -0.31 -0.20 -2.67 5.36 0.05 -1.12 117.98 115.82 3dev s PHE 256 Ca 0.11 0.31 -0.02 0.00 -0.96 0.00 0.00 56.93 56.36 3dev s PHE 256 Cb 0.00 0.10 -0.00 0.00 -0.34 0.00 0.00 43.02 42.78 3dev s PHE 256 CO 0.08 -0.17 -0.09 0.20 -1.46 0.00 0.00 175.22 173.78 3dev s GLY 257 N 2.97 1.56 -0.12 13.12 0.00 -0.91 -0.99 107.32 122.96 3dev s GLY 257 Ca 0.00 -1.12 0.03 0.00 0.00 0.00 0.00 44.72 43.62 3dev s GLY 257 CO -0.11 0.29 -0.21 0.54 0.00 0.00 0.00 173.10 173.61 3dev s VAL 258 N 1.24 2.31 -0.10 1.40 0.11 -1.15 -0.75 120.40 123.45 3dev s VAL 258 Ca 0.03 -0.92 -0.30 0.00 -2.93 0.00 0.00 61.98 57.86 3dev s VAL 258 Cb -0.14 -1.91 -0.03 0.00 -1.53 0.00 0.00 36.38 32.76 3dev s VAL 258 CO -0.03 0.55 1.33 -0.62 -3.33 0.00 0.00 175.10 172.99 3dev s ASP 259 N 0.44 6.91 0.00 3.54 2.15 -0.44 -2.63 116.67 126.64 3dev s ASP 259 Ca -0.15 1.86 0.23 0.00 0.43 0.00 0.00 52.55 54.92 3dev s ASP 259 Cb -0.17 -2.54 0.17 0.00 -0.30 0.00 0.00 42.92 40.08 3dev s ASP 259 CO 0.06 -0.74 1.18 -0.62 -0.17 0.00 0.00 175.17 174.88 3dev n GLU 260 N 6.23 0.30 0.00 4.34 1.02 -0.18 -4.60 120.64 127.75 3dev n GLU 260 Ca 0.14 -0.22 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 3dev n GLU 260 Cb 0.45 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 3dev n GLU 260 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dev n GLY 261 N 1.47 1.98 0.98 0.62 0.00 -1.26 -4.78 105.19 104.19 3dev n GLY 261 Ca 0.06 -0.54 0.08 0.00 0.00 0.00 0.00 46.02 45.63 3dev n GLY 261 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dev n ASP 262 N 0.00 2.84 -3.59 1.61 5.68 -1.26 -4.90 116.55 116.93 3dev n ASP 262 Ca 0.00 -2.05 -0.08 0.00 -0.50 0.00 0.00 54.79 52.15 3dev n ASP 262 Cb 0.00 -0.36 -0.05 0.00 -1.14 0.00 0.00 41.12 39.57 3dev n ASP 262 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3dev s GLN 263 N -1.39 0.48 -0.67 0.11 -2.07 -1.26 -4.87 119.66 109.98 3dev s GLN 263 Ca 0.34 0.09 -0.06 0.00 -1.82 0.00 0.00 55.36 53.92 3dev s GLN 263 Cb 0.19 0.22 0.17 0.00 -1.09 0.00 0.00 33.01 32.50 3dev s GLN 263 CO 0.22 -0.15 0.52 0.42 -1.32 0.00 0.00 175.29 174.98 3dev s ILE 264 N -1.20 4.21 -0.43 3.63 1.01 0.72 -1.01 121.20 128.14 3dev s ILE 264 Ca 0.01 -2.80 -0.27 0.00 0.00 0.00 0.00 60.65 57.59 3dev s ILE 264 Cb -0.01 -3.70 -0.03 0.00 0.01 0.00 0.00 42.46 38.73 3dev s ILE 264 CO -0.01 -0.91 1.97 -0.60 0.00 0.00 0.00 174.94 175.39 3dev s ARG 265 N 0.04 2.88 -0.16 2.79 3.52 -1.08 -2.91 118.95 124.03 3dev s ARG 265 Ca 0.17 1.24 -0.03 0.00 -0.13 0.00 0.00 55.73 56.98 3dev s ARG 265 Cb -0.18 -4.34 -0.02 0.00 -1.56 0.00 0.00 34.95 28.85 3dev s ARG 265 CO -0.05 -2.40 -0.06 0.00 -0.81 0.00 0.00 175.30 171.98 3dev s ARG 267 N 0.61 4.10 -0.18 0.00 0.52 -0.16 -0.88 118.95 122.96 3dev s ARG 267 Ca -0.04 -0.02 -0.00 0.00 -0.52 0.00 0.00 55.73 55.15 3dev s ARG 267 Cb -0.15 -3.57 0.01 0.00 0.52 0.00 0.00 34.95 31.77 3dev s ARG 267 CO 0.03 -0.05 -0.16 -1.50 0.02 0.00 0.00 175.30 173.63 3dev s ILE 268 N 1.38 2.47 0.06 1.52 -1.16 -0.60 -0.77 121.20 124.10 3dev s ILE 268 Ca 0.14 -0.81 0.07 0.00 -0.51 0.00 0.00 60.65 59.54 3dev s ILE 268 Cb -0.15 -2.05 -0.03 0.00 0.61 0.00 0.00 42.46 40.84 3dev s ILE 268 CO 0.07 0.51 -0.20 -0.13 -2.81 0.00 0.00 174.94 172.38 3dev s ARG 269 N 1.18 1.28 0.18 3.50 0.52 -0.28 -1.27 118.95 124.06 3dev s ARG 269 Ca 0.02 -0.99 0.08 0.00 -0.52 0.00 0.00 55.73 54.32 3dev s ARG 269 Cb -0.14 -1.42 -0.04 0.00 0.52 0.00 0.00 34.95 33.86 3dev s ARG 269 CO -0.07 0.35 -0.16 -1.54 0.02 0.00 0.00 175.30 173.91 3dev s SER 270 N -1.37 2.51 0.08 0.23 1.04 -0.81 -0.81 113.70 114.58 3dev s SER 270 Ca 0.07 -0.94 -0.25 0.00 0.48 0.00 0.00 55.95 55.31 3dev s SER 270 Cb -0.09 -0.13 -0.16 0.00 0.10 0.00 0.00 66.02 65.74 3dev s SER 270 CO 0.02 -0.12 1.71 0.50 0.98 0.00 0.00 173.24 176.33 3dev h LYS 271 N 2.94 -0.15 0.00 4.02 1.63 0.12 -3.42 116.57 121.71 3dev h LYS 271 Ca -0.40 0.01 -0.11 0.00 -0.85 0.00 0.00 60.65 59.30 3dev h LYS 271 Cb 1.21 0.03 -0.11 0.00 -0.60 0.00 0.00 32.23 32.77 3dev h LYS 271 CO 0.57 -0.09 0.07 0.41 -3.45 0.00 0.00 179.45 176.95 3dev n GLY 272 N -1.12 -0.58 2.96 5.01 0.00 -1.26 -5.11 105.19 105.09 3dev n GLY 272 Ca -0.08 0.18 -0.17 0.00 0.00 0.00 0.00 46.02 45.94 3dev n GLY 272 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dev s ILE 273 N 0.07 0.49 -0.33 -0.61 1.01 -1.26 -5.08 121.20 115.49 3dev s ILE 273 Ca 0.11 -0.23 -0.33 0.00 0.00 0.00 0.00 60.65 60.19 3dev s ILE 273 Cb 0.17 -0.44 -0.10 0.00 0.01 0.00 0.00 42.46 42.10 3dev s ILE 273 CO -0.07 0.16 2.21 0.35 0.00 0.00 0.00 174.94 177.58 3dev n THR 274 N 3.17 0.21 -0.03 2.92 -2.24 -1.26 -4.59 114.28 112.46 3dev n THR 274 Ca -0.16 -0.31 -0.04 0.00 -2.27 0.00 0.00 64.05 61.27 3dev n THR 274 Cb 0.56 -1.85 -0.05 0.00 -2.10 0.00 0.00 70.33 66.89 3dev n THR 274 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dev n ILE 275 N 7.34 0.45 0.01 2.28 0.13 0.83 -4.53 119.36 125.88 3dev n ILE 275 Ca 0.39 -0.25 0.01 0.00 -1.10 0.00 0.00 62.75 61.80 3dev n ILE 275 Cb 0.28 -0.82 0.04 0.00 -0.84 0.00 0.00 39.64 38.30 3dev n ILE 275 CO 0.00 0.00 0.00 -0.46 2.80 0.00 0.00 176.55 178.89 3dev n ASN 276 N -2.36 0.04 0.05 9.51 6.94 -1.25 -1.95 115.26 126.25 3dev n ASN 276 Ca -0.11 0.45 -0.02 0.00 -0.02 0.00 0.00 54.58 54.87 3dev n ASN 276 Cb 0.70 -0.45 -0.01 0.00 -2.36 0.00 0.00 39.78 37.66 3dev n ASN 276 CO 0.00 0.00 0.00 -0.78 -1.03 0.00 0.00 177.26 175.45 3dev h ASP 277 N 0.00 -0.13 -0.08 0.53 1.82 -1.91 -2.72 116.42 113.94 3dev h ASP 277 Ca 0.00 0.01 0.02 0.00 -0.39 0.00 0.00 57.03 56.67 3dev h ASP 277 Cb 0.16 0.04 -0.00 0.00 0.68 0.00 0.00 39.33 40.20 3dev h ASP 277 CO 0.00 -0.08 0.07 -0.37 -1.61 0.00 0.00 179.24 177.25 3dev h VAL 278 N -0.13 0.63 -0.42 2.25 -1.51 -1.71 -2.16 116.25 113.21 3dev h VAL 278 Ca -0.01 0.00 0.07 0.00 -1.23 0.00 0.00 66.70 65.53 3dev h VAL 278 Cb 0.10 0.94 -0.06 0.00 -2.13 0.00 0.00 31.29 30.14 3dev h VAL 278 CO 0.01 0.00 0.03 0.00 -1.23 0.00 0.00 177.57 176.38 3dev h ALA 279 N 1.92 0.41 -0.24 5.19 0.00 -1.39 -1.24 119.26 123.92 3dev h ALA 279 Ca 0.04 0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 3dev h ALA 279 Cb 0.18 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3dev h ALA 279 CO -0.00 -0.37 -0.09 -0.91 0.00 0.00 0.00 179.25 177.89 3dev h ASN 280 N 0.14 0.36 -0.49 0.00 -0.26 -1.09 0.92 115.58 115.15 3dev h ASN 280 Ca 0.21 -0.07 0.04 0.00 -0.56 0.00 0.00 56.30 55.92 3dev h ASN 280 Cb 0.28 -0.09 -0.03 0.00 -1.06 0.00 0.00 38.32 37.42 3dev h ASN 280 CO -0.32 0.49 0.33 -0.61 -1.06 0.00 0.00 177.43 176.26 3dev h GLN 281 N 0.36 0.48 -0.58 0.81 4.15 -1.22 -0.79 115.11 118.33 3dev h GLN 281 Ca 0.07 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.46 3dev h GLN 281 Cb 0.38 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.96 3dev h GLN 281 CO 0.02 0.32 0.00 1.19 -1.93 0.00 0.00 178.83 178.43 3dev n PHE 282 N -4.48 2.04 -1.13 3.99 3.72 -0.84 -4.90 117.46 115.87 3dev n PHE 282 Ca 0.06 -0.73 -0.04 0.00 -0.05 0.00 0.00 57.45 56.69 3dev n PHE 282 Cb 0.19 -0.50 -0.02 0.00 -0.94 0.00 0.00 39.48 38.21 3dev n PHE 282 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3dev n GLY 283 N 0.64 0.71 0.00 1.37 0.00 -0.30 -4.79 105.19 102.81 3dev n GLY 283 Ca 0.28 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.42 3dev n GLY 283 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dev n GLY 284 N -2.46 2.24 0.00 -0.02 0.00 0.31 -4.92 105.19 100.34 3dev n GLY 284 Ca -0.04 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.76 3dev n GLY 284 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dev n GLY 285 N 5.00 -0.13 0.00 -0.02 0.00 -1.17 -4.15 105.19 104.73 3dev n GLY 285 Ca 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.37 3dev n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dev n GLY 286 N -0.37 0.66 3.76 -0.02 0.00 -1.26 -1.98 105.19 105.98 3dev n GLY 286 Ca 0.00 -2.11 -0.33 0.00 0.00 0.00 0.00 46.02 43.58 3dev n GLY 286 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3dev s HIS 287 N -1.16 2.48 -0.78 1.61 3.76 -1.19 -4.76 115.29 115.27 3dev s HIS 287 Ca 0.00 1.57 0.15 0.00 -0.15 0.00 0.00 55.06 56.63 3dev s HIS 287 Cb 0.00 -3.20 0.65 0.00 1.11 0.00 0.00 32.58 31.14 3dev s HIS 287 CO 0.00 -1.89 1.46 -0.35 -0.85 0.00 0.00 174.74 173.11 3dev n PRO 288 N -2.71 0.07 0.00 8.40 -0.04 -1.26 -2.74 135.00 136.72 3dev n PRO 288 Ca 0.11 0.39 0.03 0.00 -0.04 0.00 0.00 63.50 63.99 3dev n PRO 288 Cb 0.52 -1.65 -0.01 0.00 -0.04 0.00 0.00 33.50 32.32 3dev n PRO 288 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3dev n ASN 289 N -1.77 0.85 -3.12 3.54 5.03 -1.26 -0.12 115.26 118.41 3dev n ASN 289 Ca 0.02 -0.93 0.02 0.00 0.87 0.00 0.00 54.58 54.56 3dev n ASN 289 Cb 0.14 0.58 -0.01 0.00 -1.02 0.00 0.00 39.78 39.48 3dev n ASN 289 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3dev s ALA 290 N -1.21 -2.81 0.34 5.41 0.00 -1.11 -1.93 121.76 120.46 3dev s ALA 290 Ca 0.05 0.55 0.02 0.00 0.00 0.00 0.00 51.96 52.59 3dev s ALA 290 Cb 0.05 -2.77 0.02 0.00 0.00 0.00 0.00 23.12 20.43 3dev s ALA 290 CO 0.20 -2.22 0.19 0.43 0.00 0.00 0.00 175.76 174.36 3dev n SER 291 N 4.44 2.31 -3.80 0.00 7.64 -0.39 -3.15 113.62 120.66 3dev n SER 291 Ca 0.09 -2.25 -0.12 0.00 1.01 0.00 0.00 58.87 57.60 3dev n SER 291 Cb 0.58 0.04 -0.09 0.00 -1.01 0.00 0.00 64.21 63.73 3dev n SER 291 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3dev s GLY 292 N -3.11 -0.07 0.05 0.23 0.00 -0.84 -1.55 107.32 102.02 3dev s GLY 292 Ca 0.15 0.14 -0.02 0.00 0.00 0.00 0.00 44.72 44.99 3dev s GLY 292 CO 0.09 -0.04 -0.01 0.14 0.00 0.00 0.00 173.10 173.28 3dev s VAL 293 N -1.37 0.19 -0.51 1.40 1.01 -0.06 -3.02 120.40 118.05 3dev s VAL 293 Ca -0.14 -1.59 0.06 0.00 0.00 0.00 0.00 61.98 60.31 3dev s VAL 293 Cb -0.06 -1.27 0.21 0.00 0.00 0.00 0.00 36.38 35.26 3dev s VAL 293 CO 0.03 -0.88 0.51 -1.20 0.00 0.00 0.00 175.10 173.56 3dev n SER 294 N 0.38 1.25 -4.66 3.32 7.64 -1.26 -0.13 113.62 120.15 3dev n SER 294 Ca -0.16 -2.85 -0.30 0.00 1.01 0.00 0.00 58.87 56.57 3dev n SER 294 Cb 0.60 -0.64 0.16 0.00 -1.01 0.00 0.00 64.21 63.32 3dev n SER 294 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 3dev s VAL 295 N -1.12 2.34 -2.58 0.44 -7.23 -1.14 -4.66 120.40 106.45 3dev s VAL 295 Ca 0.33 0.11 0.21 0.00 -1.81 0.00 0.00 61.98 60.83 3dev s VAL 295 Cb 0.08 -2.27 0.20 0.00 0.56 0.00 0.00 36.38 34.95 3dev s VAL 295 CO -0.13 -0.15 1.19 -1.22 -0.31 0.00 0.00 175.10 174.49 3dev n TYR 296 N -4.19 0.07 -3.56 2.82 4.01 -1.26 -0.20 117.16 114.85 3dev n TYR 296 Ca 0.09 -0.04 -0.08 0.00 -0.16 0.00 0.00 57.90 57.72 3dev n TYR 296 Cb 0.53 -0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.54 3dev n TYR 296 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 3dev s SER 297 N -1.71 -0.37 0.37 7.72 1.04 -1.26 -4.81 113.70 114.69 3dev s SER 297 Ca 0.26 -0.12 0.20 0.00 0.48 0.00 0.00 55.95 56.76 3dev s SER 297 Cb 0.18 0.48 0.61 0.00 0.10 0.00 0.00 66.02 67.38 3dev s SER 297 CO 0.27 -0.81 1.69 -0.50 0.98 0.00 0.00 173.24 174.87 3dev h TRP 298 N 2.00 0.00 -0.38 5.02 4.06 -1.98 -1.09 115.95 123.59 3dev h TRP 298 Ca -0.25 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.63 3dev h TRP 298 Cb 1.26 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.40 3dev h TRP 298 CO 0.29 0.35 -0.05 0.22 -3.56 0.00 0.00 178.44 175.69 3dev h ASP 299 N 0.00 0.60 0.52 -3.49 1.82 -1.99 -0.53 116.42 113.35 3dev h ASP 299 Ca -0.00 -0.14 -0.22 0.00 -0.39 0.00 0.00 57.03 56.27 3dev h ASP 299 Cb 0.97 -0.16 -0.00 0.00 0.68 0.00 0.00 39.33 40.81 3dev h ASP 299 CO 0.05 0.70 -0.98 -0.08 -1.61 0.00 0.00 179.24 177.32 3dev h GLU 300 N 0.59 0.28 -0.63 0.28 4.81 -1.90 -2.82 114.58 115.19 3dev h GLU 300 Ca 0.11 -0.34 0.00 0.00 -0.13 0.00 0.00 59.36 59.01 3dev h GLU 300 Cb 0.44 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.90 3dev h GLU 300 CO 0.02 1.06 0.41 0.35 -0.73 0.00 0.00 179.01 180.12 3dev h PHE 301 N 0.14 0.79 -0.13 0.92 3.57 -0.53 -0.97 116.94 120.72 3dev h PHE 301 Ca -0.07 0.02 -0.17 0.00 3.53 0.00 0.00 57.97 61.27 3dev h PHE 301 Cb 1.63 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 40.10 3dev h PHE 301 CO 0.05 0.50 -0.64 1.49 -2.23 0.00 0.00 178.31 177.48 3dev h GLU 302 N 0.85 0.50 -0.61 1.11 4.57 -1.02 -1.87 114.58 118.11 3dev h GLU 302 Ca 0.23 -0.36 -0.01 0.00 -1.18 0.00 0.00 59.36 58.04 3dev h GLU 302 Cb -0.09 0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.53 3dev h GLU 302 CO -0.05 0.98 0.32 0.93 -1.18 0.00 0.00 179.01 180.01 3dev h GLU 303 N 0.36 0.84 -0.56 1.92 5.08 -0.96 0.22 114.58 121.48 3dev h GLU 303 Ca -0.01 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 3dev h GLU 303 Cb 1.20 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.26 3dev h GLU 303 CO 0.12 0.63 0.17 1.25 -1.00 0.00 0.00 179.01 180.18 3dev h LEU 304 N 0.85 0.82 -0.58 1.33 6.46 -1.07 -0.44 115.31 122.68 3dev h LEU 304 Ca 0.22 -0.21 0.01 0.00 -0.12 0.00 0.00 57.88 57.78 3dev h LEU 304 Cb 0.04 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 39.72 3dev h LEU 304 CO -0.03 0.81 0.38 0.00 -0.62 0.00 0.00 178.44 178.98 3dev h ALA 305 N 1.04 0.74 -0.57 1.25 0.00 -0.39 0.98 119.26 122.31 3dev h ALA 305 Ca 0.18 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3dev h ALA 305 Cb 0.28 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3dev h ALA 305 CO -0.01 0.16 0.34 1.96 0.00 0.00 0.00 179.25 181.70 3dev h GLN 306 N 0.78 0.78 -0.49 0.00 1.08 -0.58 0.25 115.11 116.93 3dev h GLN 306 Ca 0.22 -0.08 -0.04 0.00 -1.45 0.00 0.00 58.65 57.30 3dev h GLN 306 Cb -0.07 -0.16 -0.02 0.00 -0.05 0.00 0.00 27.48 27.18 3dev h GLN 306 CO -0.06 0.57 0.14 0.00 -0.95 0.00 0.00 178.83 178.53 3dev h ALA 307 N 1.16 0.64 -0.21 3.87 0.00 -0.58 -1.10 119.26 123.03 3dev h ALA 307 Ca 0.20 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3dev h ALA 307 Cb -0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3dev h ALA 307 CO -0.04 0.31 0.05 -0.07 0.00 0.00 0.00 179.25 179.50 3dev h LEU 308 N 0.66 0.33 -1.14 0.00 3.38 -0.42 -2.91 115.31 115.21 3dev h LEU 308 Ca 0.15 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3dev h LEU 308 Cb 0.30 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 3dev h LEU 308 CO -0.00 0.48 0.40 -0.09 0.09 0.00 0.00 178.44 179.32 3dev h ARG 309 N 0.16 0.99 0.00 1.13 2.43 -0.41 -1.92 114.38 116.76 3dev h ARG 309 Ca 0.07 -0.11 -0.03 0.00 -0.81 0.00 0.00 59.98 59.10 3dev h ARG 309 Cb 0.29 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 29.63 3dev h ARG 309 CO 0.00 0.73 -0.13 0.37 -1.51 0.00 0.00 179.97 179.43 3dev h GLN 310 N 1.00 0.00 0.00 0.20 4.15 -1.07 -0.62 115.11 118.77 3dev h GLN 310 Ca 0.26 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.64 3dev h GLN 310 Cb 0.02 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.70 3dev h GLN 310 CO -0.04 0.13 -0.16 0.87 -1.93 0.00 0.00 178.83 177.70 3dev h LYS 311 N 0.00 0.00 0.00 1.69 1.79 -1.15 -1.47 116.57 117.43 3dev h LYS 311 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3dev h LYS 311 Cb 0.28 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.93 3dev h LYS 311 CO 0.02 0.16 0.00 1.28 -1.08 0.00 0.00 179.45 179.83 3dev n LEU 312 N -4.01 0.06 0.06 2.94 4.32 -0.24 -3.23 117.00 116.90 3dev n LEU 312 Ca -0.02 0.51 -0.09 0.00 -0.02 0.00 0.00 56.01 56.38 3dev n LEU 312 Cb 0.24 -0.49 -0.13 0.00 -1.62 0.00 0.00 43.42 41.43 3dev n LEU 312 CO 0.34 -0.08 0.04 0.25 -1.22 0.00 0.00 177.39 176.71 3dev h LEU 313 N 0.00 0.10 -1.61 2.23 5.85 -1.34 -3.21 115.31 117.34 3dev h LEU 313 Ca 0.00 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.60 3dev h LEU 313 Cb 0.45 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.44 3dev h LEU 313 CO 0.00 1.09 0.00 -0.33 -0.34 0.00 0.00 178.44 178.86 3dev h GLU 314 N 0.02 0.00 -6.50 1.25 5.08 -1.65 -3.42 114.58 109.36 3dev h GLU 314 Ca -0.06 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.62 3dev h GLU 314 Cb 1.84 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.90 3dev h GLU 314 CO 0.14 0.00 -0.76 -1.01 -1.00 0.00 0.00 179.01 176.39 3dev s HIS 315 N -3.71 2.70 0.00 4.33 3.76 -1.21 -5.18 115.29 115.98 3dev s HIS 315 Ca 0.01 -0.17 0.00 0.00 -0.15 0.00 0.00 55.06 54.75 3dev s HIS 315 Cb 0.09 -1.48 0.00 0.00 1.11 0.00 0.00 32.58 32.30 3dev s HIS 315 CO 0.52 0.35 0.00 0.72 -0.85 0.00 0.00 174.74 175.49