#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1obf s ILE 2 N 0.00 4.96 -0.19 12.58 1.01 -0.87 -4.93 121.20 133.75 1obf s ILE 2 Ca 0.00 1.43 -0.19 0.00 0.00 0.00 0.00 60.65 61.89 1obf s ILE 2 Cb 0.00 -4.05 -0.03 0.00 0.01 0.00 0.00 42.46 38.39 1obf s ILE 2 CO 0.00 0.09 0.55 -0.13 0.00 0.00 0.00 174.94 175.44 1obf s ARG 3 N 1.90 4.21 -0.01 2.79 0.52 -1.26 -1.42 118.95 125.67 1obf s ARG 3 Ca 0.34 0.47 0.08 0.00 -0.52 0.00 0.00 55.73 56.11 1obf s ARG 3 Cb -0.16 -3.56 -0.02 0.00 0.52 0.00 0.00 34.95 31.73 1obf s ARG 3 CO 0.12 -0.15 -0.26 0.08 0.02 0.00 0.00 175.30 175.11 1obf s VAL 4 N 1.64 2.04 0.12 3.52 1.01 0.11 -1.15 120.40 127.69 1obf s VAL 4 Ca 0.25 -1.13 0.11 0.00 0.00 0.00 0.00 61.98 61.21 1obf s VAL 4 Cb -0.16 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 1obf s VAL 4 CO 0.10 0.55 -0.27 0.00 0.00 0.00 0.00 175.10 175.48 1obf s ALA 5 N -0.63 2.36 -0.23 5.51 0.00 -0.68 -1.00 121.76 127.10 1obf s ALA 5 Ca 0.10 -1.44 -0.05 0.00 0.00 0.00 0.00 51.96 50.57 1obf s ALA 5 Cb -0.10 -0.39 -0.02 0.00 0.00 0.00 0.00 23.12 22.61 1obf s ALA 5 CO -0.01 0.54 0.00 0.42 0.00 0.00 0.00 175.76 176.71 1obf s ILE 6 N -1.03 3.78 -0.42 0.00 1.01 -0.52 -1.04 121.20 122.99 1obf s ILE 6 Ca 0.14 -0.36 -0.16 0.00 0.00 0.00 0.00 60.65 60.27 1obf s ILE 6 Cb -0.10 -2.73 0.02 0.00 0.01 0.00 0.00 42.46 39.66 1obf s ILE 6 CO 0.05 0.40 0.37 0.21 0.00 0.00 0.00 174.94 175.97 1obf s ASN 7 N 1.45 6.16 0.00 3.58 2.47 -0.65 -0.91 114.94 127.03 1obf s ASN 7 Ca 0.05 -0.79 0.00 0.00 0.42 0.00 0.00 52.86 52.54 1obf s ASN 7 Cb -0.15 -2.19 0.00 0.00 -1.45 0.00 0.00 41.25 37.46 1obf s ASN 7 CO -0.00 -0.52 0.00 0.61 -3.72 0.00 0.00 177.10 173.46 1obf n GLY 8 N 5.14 0.24 2.48 1.21 0.00 -0.22 -0.93 105.19 113.10 1obf n GLY 8 Ca -0.09 -0.93 -0.31 0.00 0.00 0.00 0.00 46.02 44.68 1obf n GLY 8 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1obf n TYR 9 N 2.44 3.13 -0.07 1.61 4.19 -1.26 -4.10 117.16 123.09 1obf n TYR 9 Ca 0.00 -2.70 0.00 0.00 3.31 0.00 0.00 57.90 58.51 1obf n TYR 9 Cb 0.00 -0.67 0.00 0.00 0.49 0.00 0.00 39.34 39.16 1obf n TYR 9 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1obf n GLY 10 N -0.62 -0.85 0.24 2.98 0.00 -1.26 -4.63 105.19 101.05 1obf n GLY 10 Ca 0.48 -1.62 -0.03 0.00 0.00 0.00 0.00 46.02 44.85 1obf n GLY 10 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1obf h ARG 11 N 0.00 0.62 -0.06 1.61 3.08 -1.96 -1.58 114.38 116.10 1obf h ARG 11 Ca 0.00 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.03 1obf h ARG 11 Cb 0.00 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 1obf h ARG 11 CO 0.00 0.41 -0.05 0.82 -1.07 0.00 0.00 179.97 180.08 1obf h ILE 12 N 0.64 0.85 -0.81 2.04 2.04 -1.92 -0.55 117.51 119.80 1obf h ILE 12 Ca 0.27 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.08 1obf h ILE 12 Cb 0.14 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 37.03 1obf h ILE 12 CO -0.16 0.00 0.33 1.23 0.00 0.00 0.00 178.15 179.55 1obf h GLY 13 N -0.06 1.29 1.27 5.37 0.00 -1.65 -1.41 103.07 107.88 1obf h GLY 13 Ca 0.04 -0.69 -0.14 0.00 0.00 0.00 0.00 47.33 46.54 1obf h GLY 13 CO -0.10 0.65 -0.36 3.21 0.00 0.00 0.00 176.54 179.95 1obf h ARG 14 N 1.17 0.81 -0.13 4.80 3.08 -1.12 -2.24 114.38 120.75 1obf h ARG 14 Ca 0.27 -0.40 -0.12 0.00 0.07 0.00 0.00 59.98 59.80 1obf h ARG 14 Cb 0.20 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1obf h ARG 14 CO -0.02 1.03 -0.46 -0.91 -1.07 0.00 0.00 179.97 178.54 1obf h ASN 15 N 0.67 0.33 -0.21 7.04 2.35 -0.88 -1.07 115.58 123.81 1obf h ASN 15 Ca 0.06 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.65 1obf h ASN 15 Cb 0.91 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 39.18 1obf h ASN 15 CO 0.08 0.74 0.08 0.40 -1.65 0.00 0.00 177.43 177.08 1obf h ILE 16 N 0.25 1.17 -0.37 2.81 2.04 -1.12 -0.30 117.51 122.00 1obf h ILE 16 Ca 0.02 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.37 1obf h ILE 16 Cb 0.90 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 38.09 1obf h ILE 16 CO 0.07 0.16 0.24 0.25 0.00 0.00 0.00 178.15 178.88 1obf h LEU 17 N 0.18 0.43 -0.82 1.44 6.46 -1.28 -2.13 115.31 119.59 1obf h LEU 17 Ca 0.07 -0.02 -0.05 0.00 -0.12 0.00 0.00 57.88 57.76 1obf h LEU 17 Cb 0.18 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 39.98 1obf h LEU 17 CO -0.01 0.32 0.26 0.03 -0.62 0.00 0.00 178.44 178.42 1obf h ARG 18 N 0.50 1.14 -0.71 1.25 3.08 -1.13 -2.33 114.38 116.17 1obf h ARG 18 Ca 0.13 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 1obf h ARG 18 Cb -0.05 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 29.79 1obf h ARG 18 CO -0.03 0.95 0.38 0.00 -1.07 0.00 0.00 179.97 180.20 1obf h ALA 19 N 1.18 1.32 0.24 0.04 0.00 -0.76 -0.21 119.26 121.07 1obf h ALA 19 Ca 0.24 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1obf h ALA 19 Cb 0.27 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1obf h ALA 19 CO -0.01 0.55 -0.11 1.25 0.00 0.00 0.00 179.25 180.92 1obf h HIS 20 N 1.00 -0.30 -0.17 0.00 -0.00 -1.05 -2.81 115.15 111.82 1obf h HIS 20 Ca 0.25 -0.01 -0.20 0.00 -0.00 0.00 0.00 60.37 60.42 1obf h HIS 20 Cb 0.05 0.10 0.01 0.00 -0.00 0.00 0.00 27.41 27.56 1obf h HIS 20 CO 0.01 -0.04 -0.66 1.88 -0.00 0.00 0.00 177.93 179.12 1obf h TYR 21 N -0.53 1.00 0.00 5.26 -1.99 -1.28 -1.93 116.97 117.50 1obf h TYR 21 Ca -0.03 -0.42 -0.06 0.00 2.00 0.00 0.00 58.73 60.22 1obf h TYR 21 Cb 0.39 -0.16 -0.01 0.00 2.00 0.00 0.00 36.73 38.95 1obf h TYR 21 CO -0.00 1.24 -0.28 0.93 -0.00 0.00 0.00 178.16 180.04 1obf h GLU 22 N 0.47 0.00 -0.16 4.88 5.08 -1.12 -2.02 114.58 121.70 1obf h GLU 22 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1obf h GLU 22 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1obf h GLU 22 CO 0.14 0.28 0.00 0.41 -1.00 0.00 0.00 179.01 178.84 1obf n GLY 23 N -0.56 -0.22 2.08 -3.84 0.00 -1.06 -4.91 105.19 96.68 1obf n GLY 23 Ca -0.02 -0.19 -0.03 0.00 0.00 0.00 0.00 46.02 45.78 1obf n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1obf n GLY 24 N 0.79 0.36 3.92 -0.02 0.00 -0.76 -3.73 105.19 105.75 1obf n GLY 24 Ca 0.06 -0.80 -0.25 0.00 0.00 0.00 0.00 46.02 45.04 1obf n GLY 24 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1obf n LYS 25 N -1.83 -3.46 0.10 1.61 5.02 -0.73 -4.90 118.16 113.98 1obf n LYS 25 Ca -0.04 0.43 0.00 0.00 -2.02 0.00 0.00 58.31 56.68 1obf n LYS 25 Cb 0.40 -4.60 0.31 0.00 -0.02 0.00 0.00 35.03 31.12 1obf n LYS 25 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1obf h SER 26 N -1.84 0.24 -3.73 4.39 0.02 -1.79 -3.43 113.55 107.41 1obf h SER 26 Ca -0.63 -0.07 -0.49 0.00 -0.84 0.00 0.00 61.79 59.76 1obf h SER 26 Cb 1.37 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.82 1obf h SER 26 CO 0.62 0.51 0.25 -1.00 -1.14 0.00 0.00 176.83 176.06 1obf s HIS 27 N -4.44 3.71 -1.26 3.45 3.76 -1.26 -4.96 115.29 114.28 1obf s HIS 27 Ca -0.05 1.64 -0.16 0.00 -0.15 0.00 0.00 55.06 56.34 1obf s HIS 27 Cb 0.14 -2.81 -0.01 0.00 1.11 0.00 0.00 32.58 31.01 1obf s HIS 27 CO 0.75 0.30 2.12 -3.47 -0.85 0.00 0.00 174.74 173.59 1obf n ASP 28 N 0.77 3.55 -3.97 1.40 2.03 -1.26 -4.84 116.55 114.23 1obf n ASP 28 Ca -0.00 -2.80 -0.15 0.00 0.52 0.00 0.00 54.79 52.35 1obf n ASP 28 Cb 0.50 -1.52 -0.14 0.00 -0.72 0.00 0.00 41.12 39.24 1obf n ASP 28 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1obf s ILE 29 N 3.86 0.42 -0.12 5.18 1.01 -1.26 -2.04 121.20 128.25 1obf s ILE 29 Ca 0.50 -0.32 0.01 0.00 0.00 0.00 0.00 60.65 60.85 1obf s ILE 29 Cb 0.13 -0.37 0.02 0.00 0.01 0.00 0.00 42.46 42.25 1obf s ILE 29 CO -0.02 0.06 -0.15 -1.61 0.00 0.00 0.00 174.94 173.21 1obf s GLU 30 N -0.29 2.24 -0.39 2.79 0.41 -0.50 -4.93 118.70 118.02 1obf s GLU 30 Ca 0.01 -0.56 -0.29 0.00 -0.41 0.00 0.00 54.97 53.71 1obf s GLU 30 Cb -0.03 -1.94 0.02 0.00 -1.78 0.00 0.00 34.13 30.41 1obf s GLU 30 CO -0.00 -0.09 1.10 0.42 -0.49 0.00 0.00 175.26 176.19 1obf s ILE 31 N 1.08 4.37 -0.24 -1.63 1.01 -1.26 -0.72 121.20 123.81 1obf s ILE 31 Ca -0.04 1.49 0.17 0.00 0.00 0.00 0.00 60.65 62.26 1obf s ILE 31 Cb -0.15 -4.50 -0.24 0.00 0.01 0.00 0.00 42.46 37.58 1obf s ILE 31 CO -0.03 -0.73 0.47 1.33 0.00 0.00 0.00 174.94 175.98 1obf n VAL 32 N 6.32 0.00 -3.53 2.92 0.24 -0.17 -4.76 118.33 119.35 1obf n VAL 32 Ca 0.12 -0.31 -0.17 0.00 -2.04 0.00 0.00 64.34 61.94 1obf n VAL 32 Cb 0.48 0.36 -0.06 0.00 -1.47 0.00 0.00 33.84 33.15 1obf n VAL 32 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1obf s ALA 33 N -3.00 -1.79 -0.05 2.33 0.00 -1.24 -1.68 121.76 116.33 1obf s ALA 33 Ca -0.03 1.36 0.03 0.00 0.00 0.00 0.00 51.96 53.32 1obf s ALA 33 Cb 0.11 -0.10 0.01 0.00 0.00 0.00 0.00 23.12 23.15 1obf s ALA 33 CO 0.70 -0.36 -0.11 0.42 0.00 0.00 0.00 175.76 176.40 1obf s ILE 34 N -1.15 1.03 -0.19 0.00 1.01 0.13 -1.44 121.20 120.59 1obf s ILE 34 Ca -0.10 -0.45 -0.05 0.00 0.00 0.00 0.00 60.65 60.05 1obf s ILE 34 Cb -0.00 -0.93 -0.02 0.00 0.01 0.00 0.00 42.46 41.52 1obf s ILE 34 CO 0.09 0.32 -0.01 0.21 0.00 0.00 0.00 174.94 175.55 1obf s ASN 35 N 0.44 4.76 -0.10 3.58 2.47 -0.09 -1.29 114.94 124.70 1obf s ASN 35 Ca -0.09 -0.21 -0.30 0.00 0.42 0.00 0.00 52.86 52.68 1obf s ASN 35 Cb -0.13 -1.80 0.08 0.00 -1.45 0.00 0.00 41.25 37.95 1obf s ASN 35 CO 0.02 0.08 0.76 -0.62 -3.72 0.00 0.00 177.10 173.62 1obf s ASP 36 N 0.90 -0.60 0.09 -4.21 2.15 -0.71 -1.05 116.67 113.23 1obf s ASP 36 Ca 0.01 0.74 0.25 0.00 0.43 0.00 0.00 52.55 53.97 1obf s ASP 36 Cb -0.14 0.60 0.47 0.00 -0.30 0.00 0.00 42.92 43.54 1obf s ASP 36 CO 0.02 -0.50 1.41 0.18 -0.17 0.00 0.00 175.17 176.10 1obf n LEU 37 N 1.11 0.62 -4.87 -1.34 4.32 -1.26 -4.21 117.00 111.36 1obf n LEU 37 Ca -0.16 0.22 -0.31 0.00 -0.02 0.00 0.00 56.01 55.74 1obf n LEU 37 Cb 0.57 -0.23 0.01 0.00 -1.62 0.00 0.00 43.42 42.15 1obf n LEU 37 CO 0.19 -0.02 0.70 -0.83 -1.22 0.00 0.00 177.39 176.21 1obf s GLY 38 N -3.46 1.64 -0.06 -0.72 0.00 -1.26 -5.00 107.32 98.45 1obf s GLY 38 Ca 0.08 -0.14 -0.35 0.00 0.00 0.00 0.00 44.72 44.31 1obf s GLY 38 CO 0.70 0.13 1.78 1.34 0.00 0.00 0.00 173.10 177.05 1obf n ASP 39 N -2.72 3.14 0.26 1.64 4.64 -1.26 -4.89 116.55 117.36 1obf n ASP 39 Ca 0.06 1.01 0.12 0.00 -1.38 0.00 0.00 54.79 54.60 1obf n ASP 39 Cb 0.54 -1.34 0.77 0.00 -1.04 0.00 0.00 41.12 40.06 1obf n ASP 39 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 1obf h PRO 40 N 8.11 0.00 -0.19 -0.67 0.11 -1.95 -2.17 132.00 135.24 1obf h PRO 40 Ca -0.48 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.47 1obf h PRO 40 Cb 1.28 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 1obf h PRO 40 CO 0.93 0.00 -0.57 0.87 -0.21 0.00 0.00 178.00 179.02 1obf h LYS 41 N 0.00 0.60 -0.39 1.05 1.57 -1.99 -1.72 116.57 115.69 1obf h LYS 41 Ca 0.02 -0.39 -0.05 0.00 -1.87 0.00 0.00 60.65 58.36 1obf h LYS 41 Cb 0.08 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 1obf h LYS 41 CO -0.00 1.00 0.07 1.15 -0.57 0.00 0.00 179.45 181.10 1obf h THR 42 N 0.46 1.24 -0.15 -0.16 2.02 -1.80 -2.23 112.91 112.29 1obf h THR 42 Ca 0.00 -0.85 -0.06 0.00 0.77 0.00 0.00 66.41 66.27 1obf h THR 42 Cb 1.13 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 68.57 1obf h THR 42 CO 0.11 0.29 -0.20 0.78 0.37 0.00 0.00 175.52 176.88 1obf h ASN 43 N 0.49 0.24 -0.35 4.18 2.35 -1.38 -1.56 115.58 119.55 1obf h ASN 43 Ca 0.12 -0.06 -0.13 0.00 -0.55 0.00 0.00 56.30 55.67 1obf h ASN 43 Cb 0.36 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 1obf h ASN 43 CO 0.01 0.45 -0.30 0.00 -1.65 0.00 0.00 177.43 175.94 1obf h ALA 44 N 1.57 0.51 -0.53 -0.83 0.00 -1.26 -2.16 119.26 116.57 1obf h ALA 44 Ca 0.04 -0.41 0.01 0.00 0.00 0.00 0.00 54.91 54.55 1obf h ALA 44 Cb 0.48 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1obf h ALA 44 CO 0.03 0.55 0.34 1.25 0.00 0.00 0.00 179.25 181.41 1obf h HIS 45 N 0.61 0.63 0.00 0.00 -0.00 -0.92 -2.13 115.15 113.34 1obf h HIS 45 Ca 0.06 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.45 1obf h HIS 45 Cb 0.88 -0.21 0.00 0.00 -0.00 0.00 0.00 27.41 28.08 1obf h HIS 45 CO 0.07 0.39 0.00 1.28 -0.00 0.00 0.00 177.93 179.66 1obf n LEU 46 N -4.75 0.44 0.06 0.26 4.77 -0.63 -2.19 117.00 114.97 1obf n LEU 46 Ca 0.03 0.56 -0.20 0.00 -0.03 0.00 0.00 56.01 56.38 1obf n LEU 46 Cb 0.04 -0.45 -0.10 0.00 -2.33 0.00 0.00 43.42 40.58 1obf n LEU 46 CO 0.34 -0.22 0.04 0.74 -1.33 0.00 0.00 177.39 176.96 1obf h THR 47 N 0.00 1.30 -0.13 -5.08 2.02 -0.82 -3.37 112.91 106.83 1obf h THR 47 Ca 0.00 -2.36 -0.17 0.00 0.77 0.00 0.00 66.41 64.65 1obf h THR 47 Cb 0.52 2.50 -0.01 0.00 -1.74 0.00 0.00 68.15 69.42 1obf h THR 47 CO 0.00 0.72 -0.63 0.03 0.37 0.00 0.00 175.52 176.01 1obf h ARG 48 N 0.33 0.46 -4.43 6.66 3.08 -0.91 -3.39 114.38 116.19 1obf h ARG 48 Ca -0.14 -0.33 -0.50 0.00 0.07 0.00 0.00 59.98 59.08 1obf h ARG 48 Cb 1.76 0.05 -0.34 0.00 0.08 0.00 0.00 29.97 31.52 1obf h ARG 48 CO 0.21 0.95 -0.81 0.71 -1.07 0.00 0.00 179.97 179.96 1obf s TYR 49 N -3.81 1.33 -0.00 3.04 2.02 -0.94 -1.87 117.35 117.12 1obf s TYR 49 Ca -0.06 -0.49 -0.03 0.00 -0.37 0.00 0.00 57.07 56.12 1obf s TYR 49 Cb 0.11 -1.01 -0.00 0.00 -0.40 0.00 0.00 41.96 40.65 1obf s TYR 49 CO 0.84 -0.28 0.05 0.34 -1.57 0.00 0.00 175.55 174.92 1obf s ASP 50 N 0.80 0.07 -0.01 2.29 2.15 -0.94 -4.55 116.67 116.47 1obf s ASP 50 Ca -0.12 -0.19 -0.21 0.00 0.43 0.00 0.00 52.55 52.45 1obf s ASP 50 Cb -0.15 0.14 -0.13 0.00 -0.30 0.00 0.00 42.92 42.48 1obf s ASP 50 CO 0.02 -0.21 0.91 0.74 -0.17 0.00 0.00 175.17 176.46 1obf h THR 51 N 4.71 0.19 -0.31 1.71 2.02 -1.97 -1.80 112.91 117.46 1obf h THR 51 Ca -0.29 -0.55 -0.02 0.00 0.77 0.00 0.00 66.41 66.32 1obf h THR 51 Cb 1.20 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 67.89 1obf h THR 51 CO 0.43 0.04 0.11 0.00 0.37 0.00 0.00 175.52 176.47 1obf h ALA 52 N -0.96 0.40 -0.40 6.16 0.00 -1.98 -3.26 119.26 119.23 1obf h ALA 52 Ca -0.07 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1obf h ALA 52 Cb 0.55 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1obf h ALA 52 CO 0.11 0.02 0.00 0.72 0.00 0.00 0.00 179.25 180.10 1obf n HIS 53 N -4.70 0.52 -4.70 0.00 8.25 -1.26 -4.91 115.22 108.43 1obf n HIS 53 Ca -0.02 -0.29 0.00 0.00 -0.26 0.00 0.00 57.72 57.15 1obf n HIS 53 Cb 0.16 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.26 1obf n HIS 53 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1obf n GLY 54 N 1.35 0.19 3.73 -1.41 0.00 -0.67 -4.79 105.19 103.59 1obf n GLY 54 Ca 0.18 -0.98 -0.40 0.00 0.00 0.00 0.00 46.02 44.83 1obf n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1obf s LYS 55 N 0.00 4.46 0.11 1.61 1.02 -1.26 -2.22 119.74 123.46 1obf s LYS 55 Ca 0.00 0.99 -0.32 0.00 0.02 0.00 0.00 55.97 56.67 1obf s LYS 55 Cb 0.00 -3.41 -0.11 0.00 -0.52 0.00 0.00 37.83 33.79 1obf s LYS 55 CO 0.00 0.15 1.83 0.34 -0.92 0.00 0.00 175.35 176.75 1obf n PHE 56 N 3.36 2.58 0.76 3.18 7.35 -0.78 -4.91 117.46 129.00 1obf n PHE 56 Ca -0.01 -0.12 0.09 0.00 -0.76 0.00 0.00 57.45 56.64 1obf n PHE 56 Cb 0.51 -2.72 0.42 0.00 0.35 0.00 0.00 39.48 38.04 1obf n PHE 56 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 1obf n PRO 57 N 5.61 0.16 0.00 -7.13 -0.02 -1.26 -4.83 135.00 127.53 1obf n PRO 57 Ca 0.18 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1obf n PRO 57 Cb 0.36 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.34 1obf n PRO 57 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1obf n GLY 58 N 0.27 2.80 3.42 -1.23 0.00 -1.26 -5.15 105.19 104.04 1obf n GLY 58 Ca 0.07 -1.96 -0.30 0.00 0.00 0.00 0.00 46.02 43.84 1obf n GLY 58 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1obf s THR 59 N 2.32 2.48 -0.03 2.61 -4.23 -1.26 -5.00 115.64 112.53 1obf s THR 59 Ca 0.00 -1.51 -0.01 0.00 -1.18 0.00 0.00 61.69 58.99 1obf s THR 59 Cb 0.00 -2.07 0.03 0.00 1.34 0.00 0.00 72.50 71.80 1obf s THR 59 CO 0.00 0.20 0.05 -0.69 -0.54 0.00 0.00 174.62 173.63 1obf s VAL 60 N -1.00 -0.09 0.03 2.29 1.01 -1.26 -1.59 120.40 119.80 1obf s VAL 60 Ca 0.15 0.33 0.05 0.00 0.00 0.00 0.00 61.98 62.50 1obf s VAL 60 Cb -0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 36.38 36.14 1obf s VAL 60 CO 0.06 0.14 -0.13 -0.44 0.00 0.00 0.00 175.10 174.72 1obf s SER 61 N 1.64 1.57 -0.14 3.32 0.01 -0.57 -4.97 113.70 114.55 1obf s SER 61 Ca -0.02 -0.44 -0.07 0.00 1.31 0.00 0.00 55.95 56.73 1obf s SER 61 Cb -0.12 -0.10 -0.04 0.00 0.21 0.00 0.00 66.02 65.96 1obf s SER 61 CO -0.03 0.03 0.13 -0.69 0.41 0.00 0.00 173.24 173.09 1obf s VAL 62 N -0.82 5.40 -0.37 3.43 1.01 -1.26 -0.27 120.40 127.53 1obf s VAL 62 Ca 0.01 0.17 0.05 0.00 0.00 0.00 0.00 61.98 62.22 1obf s VAL 62 Cb -0.08 -3.38 0.17 0.00 0.00 0.00 0.00 36.38 33.10 1obf s VAL 62 CO 0.01 0.57 0.50 0.21 0.00 0.00 0.00 175.10 176.39 1obf s ASN 63 N -0.67 -0.27 1.77 3.32 2.47 -0.67 -4.99 114.94 115.91 1obf s ASN 63 Ca 0.13 -0.91 0.00 0.00 0.42 0.00 0.00 52.86 52.50 1obf s ASN 63 Cb -0.12 1.33 0.00 0.00 -1.45 0.00 0.00 41.25 41.02 1obf s ASN 63 CO 0.02 -0.24 0.00 0.61 -3.72 0.00 0.00 177.10 173.77 1obf n GLY 64 N 4.60 3.39 1.71 1.21 0.00 -1.26 -2.12 105.19 112.72 1obf n GLY 64 Ca 0.09 0.07 0.07 0.00 0.00 0.00 0.00 46.02 46.25 1obf n GLY 64 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1obf n SER 65 N 9.54 5.11 -4.24 1.61 7.64 -1.26 -4.94 113.62 127.09 1obf n SER 65 Ca 0.00 -2.72 -0.24 0.00 1.01 0.00 0.00 58.87 56.92 1obf n SER 65 Cb 0.00 -0.64 -0.13 0.00 -1.01 0.00 0.00 64.21 62.43 1obf n SER 65 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1obf s TYR 66 N -2.38 1.66 -0.19 1.43 1.51 -0.90 -1.63 117.35 116.85 1obf s TYR 66 Ca 0.50 -0.39 -0.06 0.00 -1.01 0.00 0.00 57.07 56.10 1obf s TYR 66 Cb 0.36 -0.96 -0.03 0.00 -0.11 0.00 0.00 41.96 41.22 1obf s TYR 66 CO 0.17 0.12 0.03 1.41 -1.11 0.00 0.00 175.55 176.18 1obf s MET 67 N -1.47 3.80 -0.31 -0.62 1.75 -0.27 -1.67 119.30 120.50 1obf s MET 67 Ca 0.05 -0.43 -0.09 0.00 -1.25 0.00 0.00 55.69 53.97 1obf s MET 67 Cb -0.09 -3.15 -0.00 0.00 2.84 0.00 0.00 34.83 34.43 1obf s MET 67 CO 0.03 0.14 0.13 0.08 -0.65 0.00 0.00 175.02 174.75 1obf s VAL 68 N 0.69 4.39 -0.22 10.11 1.01 0.63 -1.02 120.40 136.00 1obf s VAL 68 Ca 0.02 -0.52 -0.02 0.00 0.00 0.00 0.00 61.98 61.45 1obf s VAL 68 Cb -0.14 -3.25 0.01 0.00 0.00 0.00 0.00 36.38 33.00 1obf s VAL 68 CO 0.02 0.06 -0.08 -0.69 0.00 0.00 0.00 175.10 174.41 1obf s VAL 69 N 1.57 2.95 -1.63 2.92 1.01 -0.45 -1.51 120.40 125.26 1obf s VAL 69 Ca 0.04 -0.72 -0.18 0.00 0.00 0.00 0.00 61.98 61.12 1obf s VAL 69 Cb -0.17 -2.36 0.16 0.00 0.00 0.00 0.00 36.38 34.01 1obf s VAL 69 CO 0.05 0.40 0.70 0.59 0.00 0.00 0.00 175.10 176.84 1obf n ASN 70 N 4.73 -3.05 0.00 3.32 4.13 -0.62 -1.27 115.26 122.49 1obf n ASN 70 Ca -0.18 -0.92 0.00 0.00 1.68 0.00 0.00 54.58 55.15 1obf n ASN 70 Cb 0.50 -2.53 0.00 0.00 -1.54 0.00 0.00 39.78 36.21 1obf n ASN 70 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1obf n GLY 71 N -1.27 1.89 3.69 7.41 0.00 -1.26 -5.04 105.19 110.61 1obf n GLY 71 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1obf n GLY 71 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1obf s ASP 72 N -2.52 6.91 -0.23 1.61 -0.00 -0.39 -5.04 116.67 117.01 1obf s ASP 72 Ca 0.00 1.11 -0.25 0.00 -0.00 0.00 0.00 52.55 53.41 1obf s ASP 72 Cb 0.00 -2.41 -0.01 0.00 -0.00 0.00 0.00 42.92 40.50 1obf s ASP 72 CO 0.00 -0.24 0.84 -0.54 -0.00 0.00 0.00 175.17 175.23 1obf s LYS 73 N 1.49 4.21 -0.18 8.23 1.02 -1.26 -1.34 119.74 131.90 1obf s LYS 73 Ca 0.36 0.98 -0.01 0.00 0.02 0.00 0.00 55.97 57.32 1obf s LYS 73 Cb -0.17 -3.63 0.00 0.00 -0.52 0.00 0.00 37.83 33.51 1obf s LYS 73 CO 0.15 -0.50 -0.12 0.42 -0.92 0.00 0.00 175.35 174.38 1obf s ILE 74 N 2.76 2.78 0.15 2.17 1.01 -0.19 -4.90 121.20 124.98 1obf s ILE 74 Ca 0.36 -0.71 -0.30 0.00 0.00 0.00 0.00 60.65 60.00 1obf s ILE 74 Cb -0.15 -2.21 -0.08 0.00 0.01 0.00 0.00 42.46 40.03 1obf s ILE 74 CO 0.08 0.49 1.27 -0.60 0.00 0.00 0.00 174.94 176.17 1obf s ARG 75 N 1.15 4.42 -0.22 2.79 6.06 -0.67 -1.12 118.95 131.35 1obf s ARG 75 Ca 0.01 1.94 -0.06 0.00 -2.50 0.00 0.00 55.73 55.12 1obf s ARG 75 Cb -0.14 -3.25 -0.03 0.00 0.06 0.00 0.00 34.95 31.59 1obf s ARG 75 CO -0.04 -0.24 0.03 0.08 -2.50 0.00 0.00 175.30 172.63 1obf s VAL 76 N 0.46 4.11 0.36 7.11 1.01 -0.65 -0.69 120.40 132.11 1obf s VAL 76 Ca 0.57 -0.25 0.09 0.00 0.00 0.00 0.00 61.98 62.39 1obf s VAL 76 Cb -0.34 -2.89 -0.06 0.00 0.00 0.00 0.00 36.38 33.09 1obf s VAL 76 CO 0.34 0.39 0.01 -1.81 0.00 0.00 0.00 175.10 174.03 1obf s ASP 77 N 1.28 4.06 -0.41 3.32 1.01 -0.41 -4.88 116.67 120.63 1obf s ASP 77 Ca 0.04 -1.11 0.05 0.00 0.71 0.00 0.00 52.55 52.24 1obf s ASP 77 Cb -0.15 -0.46 0.17 0.00 1.01 0.00 0.00 42.92 43.49 1obf s ASP 77 CO 0.02 -0.30 0.47 0.00 0.21 0.00 0.00 175.17 175.58 1obf s ALA 78 N -2.58 -0.80 -0.10 5.23 0.00 -1.26 -1.75 121.76 120.51 1obf s ALA 78 Ca 0.35 -0.89 -0.04 0.00 0.00 0.00 0.00 51.96 51.38 1obf s ALA 78 Cb 0.02 -2.22 0.05 0.00 0.00 0.00 0.00 23.12 20.97 1obf s ALA 78 CO 0.19 -2.16 0.20 1.21 0.00 0.00 0.00 175.76 175.20 1obf s ASN 79 N 1.22 0.32 0.53 0.00 3.84 -1.26 -4.97 114.94 114.61 1obf s ASN 79 Ca 0.21 0.42 0.29 0.00 0.21 0.00 0.00 52.86 53.99 1obf s ASN 79 Cb -0.08 0.39 1.49 0.00 -0.55 0.00 0.00 41.25 42.50 1obf s ASN 79 CO -0.06 -0.21 2.08 0.03 -2.79 0.00 0.00 177.10 176.15 1obf h ARG 80 N 7.94 0.00 -4.46 0.43 3.08 -2.00 -3.41 114.38 115.96 1obf h ARG 80 Ca -0.24 0.00 -0.72 0.00 0.07 0.00 0.00 59.98 59.09 1obf h ARG 80 Cb 1.13 0.00 -0.23 0.00 0.08 0.00 0.00 29.97 30.95 1obf h ARG 80 CO 0.23 0.11 -0.42 1.21 -1.07 0.00 0.00 179.97 180.02 1obf s ASN 81 N -6.07 5.99 0.52 7.04 2.47 -1.26 -4.97 114.94 118.66 1obf s ASN 81 Ca -0.03 -1.11 0.18 0.00 0.42 0.00 0.00 52.86 52.33 1obf s ASN 81 Cb 0.13 -2.12 1.31 0.00 -1.45 0.00 0.00 41.25 39.12 1obf s ASN 81 CO 0.57 -0.50 2.12 -0.65 -3.72 0.00 0.00 177.10 174.92 1obf h PRO 82 N 8.60 0.00 0.00 0.43 0.11 -1.86 -2.15 132.00 137.13 1obf h PRO 82 Ca -0.27 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.81 1obf h PRO 82 Cb 1.11 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1obf h PRO 82 CO 0.76 0.00 -0.15 0.00 -0.21 0.00 0.00 178.00 178.40 1obf h ALA 83 N 1.94 1.43 -0.01 -0.75 0.00 -1.90 -2.49 119.26 117.49 1obf h ALA 83 Ca 0.06 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1obf h ALA 83 Cb 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1obf h ALA 83 CO -0.00 0.18 -0.19 1.04 0.00 0.00 0.00 179.25 180.28 1obf n GLN 84 N -3.89 0.80 -2.74 0.00 6.02 -0.81 -4.02 117.38 112.74 1obf n GLN 84 Ca -0.02 -0.40 -0.36 0.00 -0.01 0.00 0.00 57.00 56.20 1obf n GLN 84 Cb 0.24 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 29.95 1obf n GLN 84 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1obf s LEU 85 N -2.47 4.26 -0.05 1.08 1.43 -0.94 -4.96 118.68 117.04 1obf s LEU 85 Ca 0.27 1.86 -0.05 0.00 -1.03 0.00 0.00 54.13 55.18 1obf s LEU 85 Cb 0.20 -4.10 -0.20 0.00 0.03 0.00 0.00 46.19 42.12 1obf s LEU 85 CO 0.50 -0.18 3.33 -0.81 0.23 0.00 0.00 176.35 179.41 1obf n PRO 86 N 0.32 1.91 0.06 1.29 -0.04 -1.26 -4.56 135.00 132.73 1obf n PRO 86 Ca 0.03 -1.01 -0.02 0.00 -0.04 0.00 0.00 63.50 62.47 1obf n PRO 86 Cb 0.50 -1.88 0.25 0.00 -0.04 0.00 0.00 33.50 32.33 1obf n PRO 86 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1obf h TRP 87 N 2.73 0.40 -0.18 0.54 -0.00 -1.87 -2.13 115.95 115.43 1obf h TRP 87 Ca 0.19 -0.08 -0.04 0.00 -0.00 0.00 0.00 58.89 58.96 1obf h TRP 87 Cb 1.37 -0.10 -0.01 0.00 -0.00 0.00 0.00 29.16 30.43 1obf h TRP 87 CO 1.55 0.59 -0.04 0.78 -0.00 0.00 0.00 178.44 181.33 1obf h GLY 88 N 1.01 0.38 1.73 1.49 0.00 -1.54 -1.81 103.07 104.34 1obf h GLY 88 Ca 0.05 -0.31 -0.06 0.00 0.00 0.00 0.00 47.33 47.01 1obf h GLY 88 CO 0.05 0.28 -0.16 0.00 0.00 0.00 0.00 176.54 176.71 1obf h ALA 89 N 0.74 1.37 -0.06 3.60 0.00 -1.83 -2.50 119.26 120.58 1obf h ALA 89 Ca 0.05 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1obf h ALA 89 Cb 0.47 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1obf h ALA 89 CO 0.02 0.43 0.00 1.28 0.00 0.00 0.00 179.25 180.98 1obf n LEU 90 N -4.22 1.23 -3.68 0.00 4.77 -0.82 -4.96 117.00 109.32 1obf n LEU 90 Ca -0.00 -0.45 -0.22 0.00 -0.03 0.00 0.00 56.01 55.30 1obf n LEU 90 Cb 0.31 -0.03 0.05 0.00 -2.33 0.00 0.00 43.42 41.41 1obf n LEU 90 CO 0.39 0.23 0.04 0.29 -1.33 0.00 0.00 177.39 177.01 1obf n LYS 91 N -0.01 -5.72 -2.49 3.23 5.02 -0.81 -4.93 118.16 112.45 1obf n LYS 91 Ca 0.18 0.68 -0.43 0.00 -2.02 0.00 0.00 58.31 56.73 1obf n LYS 91 Cb 0.29 -5.46 -0.02 0.00 -0.02 0.00 0.00 35.03 29.82 1obf n LYS 91 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1obf s VAL 92 N -3.50 4.35 -0.10 -0.18 1.01 -0.75 -4.74 120.40 116.50 1obf s VAL 92 Ca 0.20 1.66 -0.20 0.00 0.00 0.00 0.00 61.98 63.63 1obf s VAL 92 Cb -0.10 -4.07 -0.17 0.00 0.00 0.00 0.00 36.38 32.05 1obf s VAL 92 CO 0.79 -0.07 0.66 0.44 0.00 0.00 0.00 175.10 176.93 1obf h ASP 93 N 7.68 -0.05 -3.53 3.32 3.32 -1.49 -3.16 116.42 122.51 1obf h ASP 93 Ca -0.30 -0.57 -0.48 0.00 0.02 0.00 0.00 57.03 55.71 1obf h ASP 93 Cb 1.13 0.01 -0.33 0.00 0.22 0.00 0.00 39.33 40.36 1obf h ASP 93 CO 0.92 0.68 -0.80 -0.69 -1.72 0.00 0.00 179.24 177.63 1obf s VAL 94 N -2.53 0.95 -0.24 -1.35 1.01 -0.93 -1.56 120.40 115.74 1obf s VAL 94 Ca -0.13 -0.39 -0.10 0.00 0.00 0.00 0.00 61.98 61.36 1obf s VAL 94 Cb -0.01 -0.87 -0.05 0.00 0.00 0.00 0.00 36.38 35.45 1obf s VAL 94 CO 0.48 0.31 0.16 -0.69 0.00 0.00 0.00 175.10 175.35 1obf s VAL 95 N 0.60 5.33 -0.45 2.92 1.01 -0.61 -1.68 120.40 127.52 1obf s VAL 95 Ca -0.11 0.17 -0.22 0.00 0.00 0.00 0.00 61.98 61.82 1obf s VAL 95 Cb -0.14 -3.49 0.03 0.00 0.00 0.00 0.00 36.38 32.78 1obf s VAL 95 CO 0.02 0.34 0.70 -0.76 0.00 0.00 0.00 175.10 175.41 1obf s LEU 96 N 1.08 4.42 -0.51 3.92 1.43 -0.20 -1.59 118.68 127.23 1obf s LEU 96 Ca 0.07 -0.29 -0.20 0.00 -1.03 0.00 0.00 54.13 52.68 1obf s LEU 96 Cb -0.14 -2.80 0.05 0.00 0.03 0.00 0.00 46.19 43.33 1obf s LEU 96 CO 0.05 -0.85 0.70 -0.70 0.23 0.00 0.00 176.35 175.77 1obf s GLU 97 N 3.02 3.19 -0.10 1.70 2.56 -0.22 -1.64 118.70 127.21 1obf s GLU 97 Ca 0.25 -0.68 0.15 0.00 0.00 0.00 0.00 54.97 54.68 1obf s GLU 97 Cb -0.14 -4.07 0.22 0.00 2.00 0.00 0.00 34.13 32.15 1obf s GLU 97 CO 0.20 -1.25 1.11 0.00 -0.56 0.00 0.00 175.26 174.76 1obf h THR 99 N 0.70 0.00 0.00 0.00 1.35 -1.86 -3.45 112.91 109.65 1obf h THR 99 Ca 0.00 -1.00 0.00 0.00 -0.55 0.00 0.00 66.41 64.86 1obf h THR 99 Cb 0.98 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 1obf h THR 99 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1obf n GLY 100 N 1.18 1.97 0.03 5.82 0.00 -1.26 -4.89 105.19 108.03 1obf n GLY 100 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1obf n GLY 100 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1obf n PHE 101 N -2.00 0.00 -3.08 1.61 3.01 -1.26 -4.60 117.46 111.15 1obf n PHE 101 Ca 0.00 0.00 -0.24 0.00 1.01 0.00 0.00 57.45 58.22 1obf n PHE 101 Cb 0.00 -0.06 -0.04 0.00 -0.01 0.00 0.00 39.48 39.37 1obf n PHE 101 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1obf n PHE 102 N -1.42 2.61 0.59 1.38 3.01 -1.26 -4.92 117.46 117.46 1obf n PHE 102 Ca 0.05 -3.94 0.11 0.00 1.01 0.00 0.00 57.45 54.69 1obf n PHE 102 Cb 0.34 -0.47 0.25 0.00 -0.01 0.00 0.00 39.48 39.59 1obf n PHE 102 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1obf n THR 103 N 0.10 0.40 -4.19 4.37 -2.24 -1.26 -4.14 114.28 107.32 1obf n THR 103 Ca 0.29 -0.63 -0.22 0.00 -2.27 0.00 0.00 64.05 61.21 1obf n THR 103 Cb 0.48 0.84 -0.06 0.00 -2.10 0.00 0.00 70.33 69.50 1obf n THR 103 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1obf s THR 104 N -1.60 3.87 0.27 4.28 -4.23 -1.26 -0.74 115.64 116.22 1obf s THR 104 Ca 0.36 -1.66 -0.03 0.00 -1.18 0.00 0.00 61.69 59.19 1obf s THR 104 Cb 0.21 -3.11 0.17 0.00 1.34 0.00 0.00 72.50 71.11 1obf s THR 104 CO 0.30 -0.35 1.83 0.50 -0.54 0.00 0.00 174.62 176.36 1obf h LYS 105 N 1.67 0.94 -0.80 3.99 3.64 -1.89 -0.38 116.57 123.75 1obf h LYS 105 Ca -0.46 -0.17 0.01 0.00 -1.27 0.00 0.00 60.65 58.76 1obf h LYS 105 Cb 1.25 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.87 1obf h LYS 105 CO 0.61 0.79 0.53 1.49 -2.27 0.00 0.00 179.45 180.60 1obf h GLU 106 N 0.92 1.06 0.04 1.90 4.81 -1.96 0.10 114.58 121.43 1obf h GLU 106 Ca 0.21 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 59.27 1obf h GLU 106 Cb 0.23 -0.24 0.01 0.00 0.63 0.00 0.00 28.75 29.39 1obf h GLU 106 CO -0.01 0.70 -0.44 0.87 -0.73 0.00 0.00 179.01 179.40 1obf h LYS 107 N 1.08 0.23 0.00 1.92 1.57 -1.87 -3.33 116.57 116.18 1obf h LYS 107 Ca 0.29 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1obf h LYS 107 Cb -0.12 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1obf h LYS 107 CO -0.06 1.06 0.00 0.00 -0.57 0.00 0.00 179.45 179.88 1obf h ALA 108 N 0.18 1.00 0.00 3.86 0.00 -0.99 -2.75 119.26 120.56 1obf h ALA 108 Ca -0.07 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1obf h ALA 108 Cb 1.24 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 1obf h ALA 108 CO 0.08 0.00 -0.01 0.78 0.00 0.00 0.00 179.25 180.11 1obf h GLY 109 N 1.48 0.00 0.50 0.00 0.00 -1.08 -2.22 103.07 101.76 1obf h GLY 109 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 47.33 47.51 1obf h GLY 109 CO 0.00 0.00 0.55 0.00 0.00 0.00 0.00 176.54 177.09 1obf h ALA 110 N 1.99 2.16 -0.42 3.60 0.00 -1.69 -0.57 119.26 124.34 1obf h ALA 110 Ca -0.00 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1obf h ALA 110 Cb 0.11 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1obf h ALA 110 CO 0.00 -0.41 0.13 0.45 0.00 0.00 0.00 179.25 179.42 1obf h HIS 111 N 0.41 0.62 -0.29 0.00 3.86 -1.63 -1.89 115.15 116.22 1obf h HIS 111 Ca 0.42 -0.03 -0.15 0.00 -1.16 0.00 0.00 60.37 59.44 1obf h HIS 111 Cb 1.01 -0.19 -0.00 0.00 1.06 0.00 0.00 27.41 29.29 1obf h HIS 111 CO -0.00 0.52 -0.40 0.82 0.86 0.00 0.00 177.93 179.72 1obf h ILE 112 N 0.61 1.29 -0.02 2.45 2.04 -1.28 -2.42 117.51 120.17 1obf h ILE 112 Ca 0.14 -1.59 0.01 0.00 1.00 0.00 0.00 64.86 64.42 1obf h ILE 112 Cb 0.19 1.61 -0.00 0.00 -0.74 0.00 0.00 36.82 37.88 1obf h ILE 112 CO -0.01 0.51 0.01 0.11 0.00 0.00 0.00 178.15 178.78 1obf h LYS 113 N 0.55 0.00 0.00 2.37 1.57 -1.25 0.64 116.57 120.45 1obf h LYS 113 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1obf h LYS 113 Cb 0.99 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.30 1obf h LYS 113 CO 0.09 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.38 1obf n GLY 114 N -1.51 -1.39 0.00 3.86 0.00 -0.73 -4.92 105.19 100.50 1obf n GLY 114 Ca -0.03 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1obf n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1obf n GLY 115 N 0.33 1.00 3.83 -0.02 0.00 0.22 -2.19 105.19 108.36 1obf n GLY 115 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 1obf n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1obf s ALA 116 N -2.00 2.95 -0.01 4.61 0.00 -0.95 -3.81 121.76 122.56 1obf s ALA 116 Ca 0.00 0.20 -0.05 0.00 0.00 0.00 0.00 51.96 52.11 1obf s ALA 116 Cb 0.00 -3.15 -0.28 0.00 0.00 0.00 0.00 23.12 19.69 1obf s ALA 116 CO 0.00 -0.53 0.81 0.87 0.00 0.00 0.00 175.76 176.92 1obf h LYS 117 N 0.51 0.28 -3.58 0.00 1.57 -1.49 -3.39 116.57 110.47 1obf h LYS 117 Ca -0.46 -0.47 -0.12 0.00 -1.87 0.00 0.00 60.65 57.73 1obf h LYS 117 Cb 1.20 0.18 -0.18 0.00 0.08 0.00 0.00 32.23 33.51 1obf h LYS 117 CO 0.60 1.15 -0.42 0.15 -0.57 0.00 0.00 179.45 180.36 1obf s LYS 118 N -2.61 0.66 -0.03 3.15 -0.14 -0.60 -4.85 119.74 115.31 1obf s LYS 118 Ca -0.10 -0.62 0.02 0.00 -1.36 0.00 0.00 55.97 53.91 1obf s LYS 118 Cb 0.06 0.27 0.01 0.00 -1.68 0.00 0.00 37.83 36.49 1obf s LYS 118 CO 0.85 -0.18 -0.09 0.08 -0.76 0.00 0.00 175.35 175.25 1obf s VAL 119 N -2.43 0.78 -0.20 3.17 1.01 -0.01 -1.57 120.40 121.16 1obf s VAL 119 Ca -0.06 -0.33 -0.01 0.00 0.00 0.00 0.00 61.98 61.57 1obf s VAL 119 Cb -0.02 -0.72 0.01 0.00 0.00 0.00 0.00 36.38 35.66 1obf s VAL 119 CO -0.03 0.26 -0.13 -0.63 0.00 0.00 0.00 175.10 174.57 1obf s ILE 120 N 0.37 2.64 -0.05 2.22 1.01 -0.62 -1.73 121.20 125.04 1obf s ILE 120 Ca -0.06 -0.77 -0.25 0.00 0.00 0.00 0.00 60.65 59.56 1obf s ILE 120 Cb -0.10 -2.17 -0.03 0.00 0.01 0.00 0.00 42.46 40.16 1obf s ILE 120 CO 0.01 0.47 0.78 -0.63 0.00 0.00 0.00 174.94 175.56 1obf s ILE 121 N 1.37 4.99 -0.11 2.92 1.01 0.21 -1.05 121.20 130.54 1obf s ILE 121 Ca 0.05 1.62 -0.02 0.00 0.00 0.00 0.00 60.65 62.29 1obf s ILE 121 Cb -0.14 -4.12 -0.03 0.00 0.01 0.00 0.00 42.46 38.18 1obf s ILE 121 CO -0.08 0.22 2.58 -1.54 0.00 0.00 0.00 174.94 176.11 1obf n SER 122 N 3.89 5.66 -3.63 3.58 3.41 -0.60 -1.91 113.62 124.02 1obf n SER 122 Ca 0.01 -2.65 -0.01 0.00 -0.26 0.00 0.00 58.87 55.96 1obf n SER 122 Cb 0.51 -1.21 -0.01 0.00 -0.26 0.00 0.00 64.21 63.24 1obf n SER 122 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1obf s ALA 123 N -0.25 -2.09 0.30 7.33 0.00 -1.22 -4.98 121.76 120.85 1obf s ALA 123 Ca 0.33 0.82 -0.29 0.00 0.00 0.00 0.00 51.96 52.82 1obf s ALA 123 Cb 0.19 0.30 -0.13 0.00 0.00 0.00 0.00 23.12 23.48 1obf s ALA 123 CO -0.03 -0.93 1.36 -2.30 0.00 0.00 0.00 175.76 173.86 1obf n PRO 124 N -0.39 2.16 -3.30 0.00 -0.02 -1.16 -4.06 135.00 128.22 1obf n PRO 124 Ca -0.06 0.76 -0.19 0.00 -2.02 0.00 0.00 63.50 61.99 1obf n PRO 124 Cb 0.61 -2.39 -0.00 0.00 -0.02 0.00 0.00 33.50 31.70 1obf n PRO 124 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1obf s GLY 125 N -0.03 1.86 1.19 -1.23 0.00 -1.26 -4.96 107.32 102.89 1obf s GLY 125 Ca 0.60 -1.64 -0.17 0.00 0.00 0.00 0.00 44.72 43.52 1obf s GLY 125 CO 0.57 -1.50 1.05 -0.32 0.00 0.00 0.00 173.10 172.90 1obf s GLY 126 N -4.23 1.53 0.13 0.20 0.00 0.08 -4.91 107.32 100.12 1obf s GLY 126 Ca 0.50 -0.60 0.16 0.00 0.00 0.00 0.00 44.72 44.78 1obf s GLY 126 CO 0.31 0.21 1.51 0.00 0.00 0.00 0.00 173.10 175.13 1obf n ALA 127 N -4.84 1.48 0.60 3.20 0.00 -1.26 -2.64 120.51 117.04 1obf n ALA 127 Ca 0.08 0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.68 1obf n ALA 127 Cb 0.58 -1.26 0.26 0.00 0.00 0.00 0.00 19.45 19.02 1obf n ALA 127 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1obf n ASP 128 N -1.86 2.93 -4.79 0.00 5.75 -1.26 -4.98 116.55 112.34 1obf n ASP 128 Ca 0.02 -1.92 -0.33 0.00 -0.01 0.00 0.00 54.79 52.55 1obf n ASP 128 Cb 0.15 -0.20 0.03 0.00 -1.03 0.00 0.00 41.12 40.07 1obf n ASP 128 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 1obf s VAL 129 N -1.60 3.51 0.28 2.12 -7.23 -1.08 -4.59 120.40 111.81 1obf s VAL 129 Ca 0.36 0.70 0.09 0.00 -1.81 0.00 0.00 61.98 61.32 1obf s VAL 129 Cb 0.21 -3.23 -0.01 0.00 0.56 0.00 0.00 36.38 33.92 1obf s VAL 129 CO 0.30 -0.44 1.64 0.44 -0.31 0.00 0.00 175.10 176.73 1obf h ASP 130 N 0.16 0.07 -4.89 4.85 3.32 -1.57 -3.47 116.42 114.90 1obf h ASP 130 Ca -0.47 -0.04 0.02 0.00 0.02 0.00 0.00 57.03 56.56 1obf h ASP 130 Cb 1.23 -0.02 -0.13 0.00 0.22 0.00 0.00 39.33 40.63 1obf h ASP 130 CO 0.56 0.62 0.30 0.00 -1.72 0.00 0.00 179.24 178.99 1obf s ALA 131 N -3.77 -1.67 -0.13 3.45 0.00 -1.26 -5.05 121.76 113.34 1obf s ALA 131 Ca -0.02 0.66 0.01 0.00 0.00 0.00 0.00 51.96 52.61 1obf s ALA 131 Cb 0.13 0.73 0.02 0.00 0.00 0.00 0.00 23.12 24.00 1obf s ALA 131 CO 0.76 -0.74 -0.16 0.99 0.00 0.00 0.00 175.76 176.61 1obf s THR 132 N -3.52 1.64 -0.10 0.00 2.01 -1.26 -1.20 115.64 113.21 1obf s THR 132 Ca 0.02 -0.72 0.04 0.00 0.31 0.00 0.00 61.69 61.34 1obf s THR 132 Cb -0.01 -1.50 0.00 0.00 0.01 0.00 0.00 72.50 71.00 1obf s THR 132 CO -0.11 0.47 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.36 1obf s VAL 133 N 1.09 2.03 -0.37 3.82 1.01 -0.37 -4.69 120.40 122.92 1obf s VAL 133 Ca -0.03 -1.00 -0.09 0.00 0.00 0.00 0.00 61.98 60.86 1obf s VAL 133 Cb -0.14 -1.76 0.04 0.00 0.00 0.00 0.00 36.38 34.52 1obf s VAL 133 CO -0.04 0.55 0.19 -0.69 0.00 0.00 0.00 175.10 175.10 1obf s VAL 134 N 0.37 4.25 0.27 2.92 1.01 -1.26 -3.79 120.40 124.18 1obf s VAL 134 Ca -0.18 -1.06 -0.30 0.00 0.00 0.00 0.00 61.98 60.43 1obf s VAL 134 Cb -0.18 -3.43 -0.12 0.00 0.00 0.00 0.00 36.38 32.65 1obf s VAL 134 CO 0.08 -0.28 1.60 0.00 0.00 0.00 0.00 175.10 176.51 1obf n TYR 135 N 4.92 2.77 0.00 5.22 9.36 -1.26 -1.53 117.16 136.65 1obf n TYR 135 Ca -0.12 0.24 0.00 0.00 3.32 0.00 0.00 57.90 61.34 1obf n TYR 135 Cb 0.45 -2.60 0.00 0.00 -0.63 0.00 0.00 39.34 36.56 1obf n TYR 135 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1obf n GLY 136 N 2.45 3.12 0.21 2.98 0.00 -1.26 -4.85 105.19 107.84 1obf n GLY 136 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.85 1obf n GLY 136 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1obf n VAL 137 N -1.02 1.40 -2.05 1.61 0.31 -0.58 -4.84 118.33 113.16 1obf n VAL 137 Ca 0.00 -0.34 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 1obf n VAL 137 Cb 0.00 -1.86 0.00 0.00 -0.91 0.00 0.00 33.84 31.07 1obf n VAL 137 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1obf n ASN 138 N -4.15 0.09 0.21 4.52 6.94 -1.02 -4.87 115.26 116.99 1obf n ASN 138 Ca -0.49 -1.93 0.15 0.00 -0.02 0.00 0.00 54.58 52.29 1obf n ASN 138 Cb 0.84 -0.19 0.71 0.00 -2.36 0.00 0.00 39.78 38.78 1obf n ASN 138 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 1obf h HIS 139 N 0.10 0.00 0.00 -2.53 2.07 -1.90 -1.70 115.15 111.19 1obf h HIS 139 Ca -0.03 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.49 1obf h HIS 139 Cb 1.42 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.40 1obf h HIS 139 CO 0.08 0.00 0.00 0.41 -3.07 0.00 0.00 177.93 175.35 1obf n GLY 140 N -0.56 -1.14 0.27 6.13 0.00 -1.26 -2.37 105.19 106.26 1obf n GLY 140 Ca -0.00 0.10 0.18 0.00 0.00 0.00 0.00 46.02 46.29 1obf n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1obf h THR 141 N 0.00 0.00 -3.98 2.61 1.03 -1.71 -3.46 112.91 107.40 1obf h THR 141 Ca 0.00 -0.27 -0.51 0.00 -0.01 0.00 0.00 66.41 65.61 1obf h THR 141 Cb 0.26 1.19 0.07 0.00 -1.07 0.00 0.00 68.15 68.60 1obf h THR 141 CO 0.00 0.00 0.52 -0.76 -0.01 0.00 0.00 175.52 175.27 1obf s LEU 142 N -5.79 4.08 0.12 0.00 1.43 -1.00 -5.05 118.68 112.47 1obf s LEU 142 Ca -0.01 2.40 0.07 0.00 -1.03 0.00 0.00 54.13 55.56 1obf s LEU 142 Cb 0.10 -4.14 -0.04 0.00 0.03 0.00 0.00 46.19 42.15 1obf s LEU 142 CO 0.45 -0.89 -0.16 -0.54 0.23 0.00 0.00 176.35 175.44 1obf s LYS 143 N -2.54 1.07 0.60 1.70 1.02 -1.26 -4.56 119.74 115.77 1obf s LYS 143 Ca 0.61 -1.24 0.40 0.00 0.02 0.00 0.00 55.97 55.76 1obf s LYS 143 Cb -0.31 -1.06 2.04 0.00 -0.52 0.00 0.00 37.83 37.99 1obf s LYS 143 CO 0.39 0.22 2.20 0.66 -0.92 0.00 0.00 175.35 177.89 1obf h SER 144 N 3.60 0.00 1.66 2.83 4.64 -1.72 -2.31 113.55 122.26 1obf h SER 144 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1obf h SER 144 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1obf h SER 144 CO 0.48 0.00 -0.31 0.71 -0.87 0.00 0.00 176.83 176.84 1obf h THR 145 N 0.00 0.00 -3.31 2.95 1.35 -1.92 -3.46 112.91 108.52 1obf h THR 145 Ca 0.00 -0.97 -0.53 0.00 -0.55 0.00 0.00 66.41 64.36 1obf h THR 145 Cb 0.12 1.81 0.08 0.00 -1.73 0.00 0.00 68.15 68.43 1obf h THR 145 CO 0.00 0.00 0.89 -1.81 -0.25 0.00 0.00 175.52 174.35 1obf s ASP 146 N -5.84 6.38 0.00 5.36 1.01 -0.87 -4.95 116.67 117.76 1obf s ASP 146 Ca 0.05 2.94 0.00 0.00 0.71 0.00 0.00 52.55 56.25 1obf s ASP 146 Cb 0.07 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.36 1obf s ASP 146 CO 0.70 -0.91 0.00 0.35 0.21 0.00 0.00 175.17 175.52 1obf n THR 147 N 2.23 0.00 -3.79 -1.27 -2.24 -1.26 -4.98 114.28 102.96 1obf n THR 147 Ca 0.08 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.61 1obf n THR 147 Cb 0.37 -0.23 -0.17 0.00 -2.10 0.00 0.00 70.33 68.21 1obf n THR 147 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1obf s VAL 148 N -1.70 0.58 0.25 2.28 1.01 -1.26 -0.83 120.40 120.73 1obf s VAL 148 Ca 0.00 -0.19 0.05 0.00 0.00 0.00 0.00 61.98 61.85 1obf s VAL 148 Cb 0.00 -0.81 -0.05 0.00 0.00 0.00 0.00 36.38 35.52 1obf s VAL 148 CO 0.00 0.14 -0.04 0.27 0.00 0.00 0.00 175.10 175.47 1obf s ILE 149 N 1.87 1.38 -0.07 2.22 -4.36 -0.71 -1.29 121.20 120.25 1obf s ILE 149 Ca 0.03 -2.09 -0.00 0.00 -0.26 0.00 0.00 60.65 58.33 1obf s ILE 149 Cb -0.14 -2.38 -0.03 0.00 1.25 0.00 0.00 42.46 41.16 1obf s ILE 149 CO -0.07 -0.33 -0.03 -0.55 0.24 0.00 0.00 174.94 174.20 1obf s SER 150 N -3.38 4.93 -0.10 4.36 0.15 -0.34 -0.62 113.70 118.71 1obf s SER 150 Ca 0.28 0.04 0.08 0.00 0.70 0.00 0.00 55.95 57.05 1obf s SER 150 Cb 0.04 -1.30 0.39 0.00 -1.71 0.00 0.00 66.02 63.44 1obf s SER 150 CO 0.10 0.36 1.15 -3.20 1.20 0.00 0.00 173.24 172.85 1obf n ASN 151 N 2.09 3.10 0.00 5.45 4.05 -0.80 -1.24 115.26 127.90 1obf n ASN 151 Ca -0.18 -2.38 0.00 0.00 0.45 0.00 0.00 54.58 52.48 1obf n ASN 151 Cb 0.53 -0.53 0.00 0.00 1.23 0.00 0.00 39.78 41.01 1obf n ASN 151 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1obf n ALA 152 N 0.36 0.00 -2.84 5.20 0.00 -1.25 -4.72 120.51 117.27 1obf n ALA 152 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1obf n ALA 152 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 1obf n ALA 152 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1obf n SER 153 N -2.66 0.00 0.00 0.00 3.41 -1.26 -3.00 113.62 110.10 1obf n SER 153 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1obf n SER 153 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1obf n SER 153 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1obf n THR 155 N 0.00 0.00 -0.24 6.66 -1.04 -1.26 -1.78 114.28 116.62 1obf n THR 155 Ca 0.00 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.99 1obf n THR 155 Cb 0.00 0.00 0.17 0.00 -1.82 0.00 0.00 70.33 68.68 1obf n THR 155 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1obf h THR 156 N 0.00 1.23 0.00 12.58 2.02 -1.97 -0.82 112.91 125.95 1obf h THR 156 Ca 0.00 -0.61 -0.03 0.00 0.77 0.00 0.00 66.41 66.54 1obf h THR 156 Cb 0.00 0.25 -0.00 0.00 -1.74 0.00 0.00 68.15 66.66 1obf h THR 156 CO 0.00 0.27 -0.12 0.78 0.37 0.00 0.00 175.52 176.81 1obf h ASN 157 N 1.05 0.00 0.11 4.18 4.21 -1.70 -1.08 115.58 122.35 1obf h ASN 157 Ca 0.26 0.00 -0.17 0.00 1.21 0.00 0.00 56.30 57.60 1obf h ASN 157 Cb 0.07 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.28 1obf h ASN 157 CO -0.04 0.12 -0.79 0.00 -1.29 0.00 0.00 177.43 175.43 1obf h LEU 159 N -0.48 0.55 -0.78 0.00 5.85 -1.08 -3.32 115.31 116.05 1obf h LEU 159 Ca -0.15 -0.46 -0.05 0.00 0.84 0.00 0.00 57.88 58.06 1obf h LEU 159 Cb 1.55 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.39 1obf h LEU 159 CO 0.10 0.89 0.30 0.00 -0.34 0.00 0.00 178.44 179.40 1obf h ALA 160 N 0.67 1.02 0.00 1.25 0.00 -1.41 -1.93 119.26 118.86 1obf h ALA 160 Ca 0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1obf h ALA 160 Cb 0.72 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1obf h ALA 160 CO 0.05 0.65 -0.05 -1.35 0.00 0.00 0.00 179.25 178.55 1obf h PRO 161 N 1.14 0.00 -0.01 0.00 0.11 -1.76 -2.15 132.00 129.34 1obf h PRO 161 Ca 0.26 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.36 1obf h PRO 161 Cb 0.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.34 1obf h PRO 161 CO -0.02 0.05 -0.05 -0.07 -0.21 0.00 0.00 178.00 177.70 1obf h LEU 162 N 0.00 0.05 -0.70 2.35 3.38 -1.47 -3.38 115.31 115.55 1obf h LEU 162 Ca -0.00 -0.72 -0.09 0.00 0.09 0.00 0.00 57.88 57.16 1obf h LEU 162 Cb 0.18 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1obf h LEU 162 CO 0.01 0.76 -0.44 -0.37 0.09 0.00 0.00 178.44 178.50 1obf h VAL 163 N -0.65 0.93 0.90 1.22 -1.51 -1.28 -3.16 116.25 112.70 1obf h VAL 163 Ca -0.00 -1.77 -0.04 0.00 -1.23 0.00 0.00 66.70 63.66 1obf h VAL 163 Cb 0.77 2.08 0.01 0.00 -2.13 0.00 0.00 31.29 32.01 1obf h VAL 163 CO 0.01 0.43 -0.43 0.50 -1.23 0.00 0.00 177.57 176.84 1obf h LYS 164 N 0.00 -1.17 -0.41 5.19 3.64 -1.56 -0.17 116.57 122.10 1obf h LYS 164 Ca -0.00 0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.42 1obf h LYS 164 Cb 1.04 0.27 -0.02 0.00 -0.41 0.00 0.00 32.23 33.11 1obf h LYS 164 CO 0.06 -0.78 0.10 -1.00 -2.27 0.00 0.00 179.45 175.56 1obf h PRO 165 N -1.22 0.60 -0.56 1.90 0.13 -1.76 -1.25 132.00 129.84 1obf h PRO 165 Ca -0.12 -0.10 -0.09 0.00 -0.87 0.00 0.00 66.00 64.81 1obf h PRO 165 Cb 0.93 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 31.94 1obf h PRO 165 CO 0.20 0.55 -0.01 -0.07 -0.23 0.00 0.00 178.00 178.44 1obf h LEU 166 N 0.59 0.98 -0.40 1.56 3.38 -1.49 -1.56 115.31 118.37 1obf h LEU 166 Ca 0.14 -0.31 -0.13 0.00 0.09 0.00 0.00 57.88 57.66 1obf h LEU 166 Cb 0.22 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1obf h LEU 166 CO -0.00 1.05 -0.27 -1.13 0.09 0.00 0.00 178.44 178.18 1obf h ASN 167 N 0.88 0.92 -0.65 -0.43 -0.00 -0.85 -0.72 115.58 114.74 1obf h ASN 167 Ca 0.16 -0.43 -0.05 0.00 -0.00 0.00 0.00 56.30 55.97 1obf h ASN 167 Cb 0.56 -0.26 -0.03 0.00 -0.00 0.00 0.00 38.32 38.59 1obf h ASN 167 CO 0.03 1.15 0.20 0.44 -0.00 0.00 0.00 177.43 179.25 1obf h ASP 168 N 0.69 0.95 -0.02 1.15 3.32 -1.11 -2.72 116.42 118.69 1obf h ASP 168 Ca 0.08 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.92 1obf h ASP 168 Cb 0.84 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.14 1obf h ASP 168 CO 0.07 0.91 -0.22 0.29 -1.72 0.00 0.00 179.24 178.57 1obf n LYS 169 N -4.35 1.57 0.05 3.56 4.76 -0.60 -4.75 118.16 118.41 1obf n LYS 169 Ca 0.04 -1.06 0.00 0.00 -2.87 0.00 0.00 58.31 54.42 1obf n LYS 169 Cb 0.22 -1.30 0.00 0.00 -1.84 0.00 0.00 35.03 32.11 1obf n LYS 169 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1obf n LEU 170 N 0.26 -0.39 0.00 -0.35 7.94 -0.93 -5.06 117.00 118.47 1obf n LEU 170 Ca 0.08 0.19 0.00 0.00 -1.11 0.00 0.00 56.01 55.16 1obf n LEU 170 Cb 0.37 0.51 0.00 0.00 0.53 0.00 0.00 43.42 44.83 1obf n LEU 170 CO 0.17 -0.50 0.00 0.61 -1.11 0.00 0.00 177.39 176.56 1obf n GLY 171 N 0.71 2.22 3.26 -3.96 0.00 -0.32 -4.26 105.19 102.84 1obf n GLY 171 Ca 0.00 -1.40 -0.35 0.00 0.00 0.00 0.00 46.02 44.27 1obf n GLY 171 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1obf s LEU 172 N 0.00 3.10 -0.10 0.99 0.20 -1.26 -1.11 118.68 120.49 1obf s LEU 172 Ca 0.00 -0.63 -0.21 0.00 0.69 0.00 0.00 54.13 53.98 1obf s LEU 172 Cb 0.00 -1.72 -0.18 0.00 -0.43 0.00 0.00 46.19 43.86 1obf s LEU 172 CO 0.00 -0.08 0.68 -0.61 -0.29 0.00 0.00 176.35 176.04 1obf h GLN 173 N 8.08 -0.05 -2.92 1.98 5.75 -1.45 -3.48 115.11 123.03 1obf h GLN 173 Ca -0.37 0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.04 1obf h GLN 173 Cb 1.13 0.01 -0.19 0.00 1.07 0.00 0.00 27.48 29.51 1obf h GLN 173 CO 0.59 0.59 -0.17 -0.51 -2.65 0.00 0.00 178.83 176.69 1obf s ASP 174 N -5.88 -0.27 -0.02 -0.69 1.01 -1.25 -4.92 116.67 104.65 1obf s ASP 174 Ca -0.14 0.12 -0.15 0.00 0.71 0.00 0.00 52.55 53.10 1obf s ASP 174 Cb -0.01 0.37 0.02 0.00 1.01 0.00 0.00 42.92 44.31 1obf s ASP 174 CO 0.50 -0.54 0.31 -0.83 0.21 0.00 0.00 175.17 174.82 1obf s GLY 175 N -1.56 -0.15 -0.06 0.21 0.00 -0.47 -1.27 107.32 104.01 1obf s GLY 175 Ca -0.10 0.35 0.01 0.00 0.00 0.00 0.00 44.72 44.98 1obf s GLY 175 CO 0.03 0.15 -0.06 1.08 0.00 0.00 0.00 173.10 174.30 1obf s LEU 176 N -1.25 1.28 -0.08 0.66 1.43 0.17 -2.51 118.68 118.39 1obf s LEU 176 Ca -0.13 -0.17 -0.01 0.00 -1.03 0.00 0.00 54.13 52.80 1obf s LEU 176 Cb -0.05 -0.55 -0.03 0.00 0.03 0.00 0.00 46.19 45.59 1obf s LEU 176 CO 0.04 -0.06 -0.03 -0.32 0.23 0.00 0.00 176.35 176.21 1obf s MET 177 N 1.06 2.91 -0.18 1.70 -2.45 -0.53 -1.16 119.30 120.64 1obf s MET 177 Ca -0.08 -0.48 -0.02 0.00 -1.25 0.00 0.00 55.69 53.86 1obf s MET 177 Cb -0.14 -2.71 -0.01 0.00 1.25 0.00 0.00 34.83 33.23 1obf s MET 177 CO -0.01 0.66 -0.10 0.99 1.05 0.00 0.00 175.02 177.62 1obf s THR 178 N -0.78 3.04 -0.27 10.11 2.01 -0.37 -1.97 115.64 127.41 1obf s THR 178 Ca 0.12 -0.62 -0.11 0.00 0.31 0.00 0.00 61.69 61.38 1obf s THR 178 Cb -0.11 -2.34 -0.05 0.00 0.01 0.00 0.00 72.50 70.01 1obf s THR 178 CO 0.02 0.48 0.21 0.28 -0.69 0.00 0.00 174.62 174.92 1obf s THR 179 N 1.06 5.30 -0.35 -0.82 -1.32 -0.73 -1.20 115.64 117.58 1obf s THR 179 Ca -0.00 0.23 -0.20 0.00 -1.21 0.00 0.00 61.69 60.52 1obf s THR 179 Cb -0.15 -3.55 0.00 0.00 -1.51 0.00 0.00 72.50 67.30 1obf s THR 179 CO -0.02 0.26 0.60 -0.69 -2.21 0.00 0.00 174.62 172.56 1obf s VAL 180 N 1.63 4.92 -0.01 5.08 1.01 -0.49 -0.71 120.40 131.84 1obf s VAL 180 Ca 0.08 0.52 0.04 0.00 0.00 0.00 0.00 61.98 62.62 1obf s VAL 180 Cb -0.15 -4.05 -0.01 0.00 0.00 0.00 0.00 36.38 32.17 1obf s VAL 180 CO 0.09 -0.29 -0.13 -2.28 0.00 0.00 0.00 175.10 172.49 1obf s HIS 181 N 2.62 1.21 0.64 5.22 5.04 -0.42 -1.27 115.29 128.34 1obf s HIS 181 Ca 0.23 -0.24 -0.18 0.00 -1.54 0.00 0.00 55.06 53.33 1obf s HIS 181 Cb -0.15 -0.79 -0.01 0.00 0.04 0.00 0.00 32.58 31.67 1obf s HIS 181 CO 0.14 -0.03 1.25 0.00 -2.34 0.00 0.00 174.74 173.77 1obf n ALA 182 N 2.77 1.04 -1.22 1.58 0.00 -1.25 -1.62 120.51 121.82 1obf n ALA 182 Ca -0.14 -0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.98 1obf n ALA 182 Cb 0.55 -2.30 0.10 0.00 0.00 0.00 0.00 19.45 17.80 1obf n ALA 182 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1obf s TYR 183 N -1.40 2.44 0.34 0.00 -0.85 -0.50 -4.77 117.35 112.61 1obf s TYR 183 Ca 0.82 1.59 0.03 0.00 -0.52 0.00 0.00 57.07 58.99 1obf s TYR 183 Cb -0.38 -3.11 -0.04 0.00 0.38 0.00 0.00 41.96 38.80 1obf s TYR 183 CO 0.41 -1.94 0.10 0.95 -1.52 0.00 0.00 175.55 173.55 1obf s THR 184 N -2.77 0.77 -1.15 -3.49 -4.23 -1.26 -4.76 115.64 98.75 1obf s THR 184 Ca 0.63 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 59.30 1obf s THR 184 Cb -0.19 -2.58 0.19 0.00 1.34 0.00 0.00 72.50 71.26 1obf s THR 184 CO 0.54 0.00 1.51 0.59 -0.54 0.00 0.00 174.62 176.72 1obf n ASN 185 N -0.89 0.00 0.28 3.99 3.02 -1.26 -1.77 115.26 118.63 1obf n ASN 185 Ca -0.03 0.35 0.15 0.00 -0.03 0.00 0.00 54.58 55.02 1obf n ASN 185 Cb 0.66 -0.43 0.77 0.00 -0.61 0.00 0.00 39.78 40.17 1obf n ASN 185 CO 0.00 0.00 0.00 -1.13 -2.62 0.00 0.00 177.26 173.51 1obf h ASN 186 N 0.00 0.00 -3.68 6.41 -0.73 -2.01 -3.45 115.58 112.13 1obf h ASN 186 Ca 0.00 0.00 -0.24 0.00 1.87 0.00 0.00 56.30 57.93 1obf h ASN 186 Cb 0.24 0.00 0.07 0.00 0.27 0.00 0.00 38.32 38.90 1obf h ASN 186 CO 0.00 0.08 0.15 0.00 -0.37 0.00 0.00 177.43 177.29 1obf n GLN 187 N -3.37 -0.27 -4.32 6.67 6.02 -0.73 -5.02 117.38 116.37 1obf n GLN 187 Ca -0.01 -1.27 -0.19 0.00 -0.01 0.00 0.00 57.00 55.52 1obf n GLN 187 Cb 0.25 -0.56 -0.10 0.00 1.02 0.00 0.00 30.24 30.85 1obf n GLN 187 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1obf s VAL 188 N -2.09 1.64 -0.07 5.09 -7.23 -1.26 -5.03 120.40 111.45 1obf s VAL 188 Ca 0.38 -2.05 -0.15 0.00 -1.81 0.00 0.00 61.98 58.35 1obf s VAL 188 Cb -0.01 -1.90 -0.30 0.00 0.56 0.00 0.00 36.38 34.73 1obf s VAL 188 CO 0.26 -0.52 0.67 -0.07 -0.31 0.00 0.00 175.10 175.13 1obf h LEU 189 N 2.89 0.51 -8.05 1.32 3.38 -1.95 -0.91 115.31 112.50 1obf h LEU 189 Ca -0.39 -0.90 -0.15 0.00 0.09 0.00 0.00 57.88 56.53 1obf h LEU 189 Cb 1.21 -0.17 -0.19 0.00 0.09 0.00 0.00 40.66 41.61 1obf h LEU 189 CO 0.58 1.66 -0.67 0.28 0.09 0.00 0.00 178.44 180.38 1obf s THR 190 N -2.51 0.15 0.32 0.22 -1.32 -1.26 -4.45 115.64 106.78 1obf s THR 190 Ca -0.17 -1.21 -0.29 0.00 -1.21 0.00 0.00 61.69 58.81 1obf s THR 190 Cb 0.04 -0.73 -0.12 0.00 -1.51 0.00 0.00 72.50 70.19 1obf s THR 190 CO 0.82 -0.67 1.54 0.47 -2.21 0.00 0.00 174.62 174.57 1obf n ASP 191 N 1.04 3.73 -3.52 8.08 9.92 -1.26 -4.72 116.55 129.81 1obf n ASP 191 Ca -0.20 1.18 -0.09 0.00 -0.53 0.00 0.00 54.79 55.14 1obf n ASP 191 Cb 0.57 -1.59 -0.02 0.00 -0.64 0.00 0.00 41.12 39.44 1obf n ASP 191 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1obf s VAL 192 N -0.41 0.00 0.20 2.53 0.11 -0.81 -5.01 120.40 117.01 1obf s VAL 192 Ca 0.60 -0.15 -0.32 0.00 -2.93 0.00 0.00 61.98 59.18 1obf s VAL 192 Cb -0.50 -1.18 -0.15 0.00 -1.53 0.00 0.00 36.38 33.02 1obf s VAL 192 CO 0.54 0.00 1.25 0.00 -3.33 0.00 0.00 175.10 173.56 1obf n TYR 193 N -0.34 1.61 -3.71 1.54 9.36 -1.26 -4.55 117.16 119.80 1obf n TYR 193 Ca -0.12 0.59 -0.14 0.00 3.32 0.00 0.00 57.90 61.55 1obf n TYR 193 Cb 0.63 -2.34 -0.08 0.00 -0.63 0.00 0.00 39.34 36.91 1obf n TYR 193 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 1obf s HIS 194 N -0.14 -0.28 0.48 2.98 2.46 -1.26 -4.96 115.29 114.58 1obf s HIS 194 Ca 0.71 0.42 0.14 0.00 0.47 0.00 0.00 55.06 56.81 1obf s HIS 194 Cb -0.78 0.16 1.12 0.00 -0.13 0.00 0.00 32.58 32.96 1obf s HIS 194 CO 0.51 -0.45 2.08 1.05 -2.47 0.00 0.00 174.74 175.47 1obf h GLU 195 N 3.63 0.08 -4.82 2.88 4.11 -1.98 -3.40 114.58 115.08 1obf h GLU 195 Ca -0.29 -0.01 -0.66 0.00 0.07 0.00 0.00 59.36 58.46 1obf h GLU 195 Cb 1.17 -0.02 -0.21 0.00 0.50 0.00 0.00 28.75 30.19 1obf h GLU 195 CO 0.40 0.11 -0.55 0.34 0.07 0.00 0.00 179.01 179.38 1obf s ASP 196 N -7.00 5.63 0.42 3.06 -1.08 -1.26 -5.00 116.67 111.44 1obf s ASP 196 Ca -0.05 -0.37 0.29 0.00 -0.52 0.00 0.00 52.55 51.90 1obf s ASP 196 Cb 0.17 -2.03 1.20 0.00 -1.46 0.00 0.00 42.92 40.80 1obf s ASP 196 CO 0.69 -0.15 1.86 -0.07 0.52 0.00 0.00 175.17 178.02 1obf h LEU 197 N 8.35 0.00 0.20 -1.34 3.38 -2.00 -1.75 115.31 122.15 1obf h LEU 197 Ca -0.34 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.29 1obf h LEU 197 Cb 1.16 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.93 1obf h LEU 197 CO 0.60 0.00 -1.65 0.03 0.09 0.00 0.00 178.44 177.51 1obf h ARG 198 N 0.00 0.42 0.00 1.13 3.08 -1.94 -3.31 114.38 113.75 1obf h ARG 198 Ca 0.00 -0.71 0.00 0.00 0.07 0.00 0.00 59.98 59.34 1obf h ARG 198 Cb 0.44 0.27 0.00 0.00 0.08 0.00 0.00 29.97 30.76 1obf h ARG 198 CO 0.00 1.34 0.00 0.54 -1.07 0.00 0.00 179.97 180.78 1obf n ARG 199 N -3.66 0.15 0.00 0.04 1.74 -0.95 -2.08 116.66 111.90 1obf n ARG 199 Ca -0.23 0.35 0.05 0.00 -0.77 0.00 0.00 57.85 57.24 1obf n ARG 199 Cb 1.06 -1.76 0.23 0.00 -1.02 0.00 0.00 32.46 30.97 1obf n ARG 199 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1obf n ALA 200 N -1.70 1.54 -2.80 7.54 0.00 -0.70 -4.13 120.51 120.26 1obf n ALA 200 Ca 0.03 -0.04 -0.33 0.00 0.00 0.00 0.00 53.44 53.10 1obf n ALA 200 Cb 0.24 -1.16 -0.07 0.00 0.00 0.00 0.00 19.45 18.46 1obf n ALA 200 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1obf s ARG 201 N -2.80 3.10 -0.30 0.00 1.81 -0.88 -1.92 118.95 117.95 1obf s ARG 201 Ca 0.07 -0.49 -0.42 0.00 -1.72 0.00 0.00 55.73 53.17 1obf s ARG 201 Cb 0.07 -2.88 -0.18 0.00 -0.45 0.00 0.00 34.95 31.52 1obf s ARG 201 CO 0.17 0.64 1.61 0.45 -0.68 0.00 0.00 175.30 177.49 1obf n SER 202 N 1.05 1.73 0.27 0.23 2.88 -1.26 -4.60 113.62 113.93 1obf n SER 202 Ca -0.12 1.12 0.16 0.00 -1.33 0.00 0.00 58.87 58.70 1obf n SER 202 Cb 0.52 -1.04 0.69 0.00 -0.75 0.00 0.00 64.21 63.64 1obf n SER 202 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1obf h ALA 203 N 5.89 1.03 0.00 -1.46 0.00 -1.38 -3.26 119.26 120.09 1obf h ALA 203 Ca -0.46 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1obf h ALA 203 Cb 1.35 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1obf h ALA 203 CO 0.93 0.07 -0.68 0.25 0.00 0.00 0.00 179.25 179.81 1obf n THR 204 N -3.20 0.15 0.19 0.00 -2.24 -1.26 -4.00 114.28 103.91 1obf n THR 204 Ca -0.00 -0.14 0.02 0.00 -2.27 0.00 0.00 64.05 61.66 1obf n THR 204 Cb 0.30 0.15 -0.02 0.00 -2.10 0.00 0.00 70.33 68.66 1obf n THR 204 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1obf n MET 205 N -1.80 5.39 -4.13 -0.78 2.00 -1.23 -4.79 117.12 111.78 1obf n MET 205 Ca 0.04 -0.00 -0.11 0.00 0.00 0.00 0.00 57.70 57.63 1obf n MET 205 Cb 0.39 -0.71 -0.10 0.00 0.00 0.00 0.00 33.22 32.79 1obf n MET 205 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 1obf s SER 206 N -1.44 0.97 -0.07 7.83 0.01 -1.24 -5.07 113.70 114.69 1obf s SER 206 Ca 0.01 -0.86 -0.28 0.00 1.31 0.00 0.00 55.95 56.13 1obf s SER 206 Cb 0.03 0.09 -0.02 0.00 0.21 0.00 0.00 66.02 66.33 1obf s SER 206 CO 0.17 -0.40 0.91 -0.04 0.41 0.00 0.00 173.24 174.29 1obf s MET 207 N -3.14 4.46 -0.30 12.44 -1.94 -1.26 -4.32 119.30 125.23 1obf s MET 207 Ca 0.04 1.24 0.00 0.00 -1.71 0.00 0.00 55.69 55.27 1obf s MET 207 Cb 0.01 -3.50 0.09 0.00 2.01 0.00 0.00 34.83 33.45 1obf s MET 207 CO -0.04 -0.14 0.07 0.42 -0.01 0.00 0.00 175.02 175.33 1obf s ILE 208 N 1.40 1.17 0.33 2.53 1.01 -0.12 -4.96 121.20 122.57 1obf s ILE 208 Ca 0.46 -1.52 -0.29 0.00 0.00 0.00 0.00 60.65 59.30 1obf s ILE 208 Cb -0.19 -1.84 -0.11 0.00 0.01 0.00 0.00 42.46 40.33 1obf s ILE 208 CO 0.21 -0.60 1.54 -2.84 0.00 0.00 0.00 174.94 173.25 1obf s PRO 209 N 1.48 4.12 0.05 2.79 0.02 -1.26 -1.28 135.00 140.91 1obf s PRO 209 Ca 0.08 2.57 -0.15 0.00 0.02 0.00 0.00 61.00 63.52 1obf s PRO 209 Cb -0.18 -3.00 0.02 0.00 0.02 0.00 0.00 34.50 31.37 1obf s PRO 209 CO -0.20 -0.58 0.34 -0.08 -0.33 0.00 0.00 177.00 176.15 1obf s THR 210 N -0.56 0.07 0.49 0.99 -1.32 -0.35 -4.81 115.64 110.16 1obf s THR 210 Ca 0.58 -0.61 -0.20 0.00 -1.21 0.00 0.00 61.69 60.24 1obf s THR 210 Cb -0.47 -0.95 -0.08 0.00 -1.51 0.00 0.00 72.50 69.49 1obf s THR 210 CO 0.55 -0.34 1.06 -0.54 -2.21 0.00 0.00 174.62 173.15 1obf s LYS 211 N -2.56 3.73 -0.02 7.08 1.02 -1.26 -1.52 119.74 126.22 1obf s LYS 211 Ca -0.05 1.43 -0.07 0.00 0.02 0.00 0.00 55.97 57.31 1obf s LYS 211 Cb -0.01 -2.11 0.01 0.00 -0.52 0.00 0.00 37.83 35.20 1obf s LYS 211 CO -0.03 -0.50 0.15 -0.08 -0.92 0.00 0.00 175.35 173.96 1obf s THR 212 N -1.91 0.05 -2.15 2.17 -1.32 -1.26 -4.77 115.64 106.45 1obf s THR 212 Ca 0.68 -0.44 0.20 0.00 -1.21 0.00 0.00 61.69 60.91 1obf s THR 212 Cb -0.18 -0.36 0.49 0.00 -1.51 0.00 0.00 72.50 70.94 1obf s THR 212 CO 0.22 -0.24 1.44 0.61 -2.21 0.00 0.00 174.62 174.44 1obf n GLY 213 N 2.01 1.57 0.28 6.08 0.00 -1.26 -4.60 105.19 109.27 1obf n GLY 213 Ca -0.19 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1obf n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1obf h ALA 214 N 4.19 1.43 -0.07 4.61 0.00 -1.96 -1.32 119.26 126.14 1obf h ALA 214 Ca 0.00 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1obf h ALA 214 Cb 0.80 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1obf h ALA 214 CO 0.00 0.41 -0.17 0.00 0.00 0.00 0.00 179.25 179.50 1obf h ALA 215 N 1.54 0.11 -0.47 0.00 0.00 -1.90 -3.13 119.26 115.40 1obf h ALA 215 Ca 0.12 -0.36 0.02 0.00 0.00 0.00 0.00 54.91 54.69 1obf h ALA 215 Cb 0.25 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1obf h ALA 215 CO 0.00 0.04 0.31 0.00 0.00 0.00 0.00 179.25 179.60 1obf h ALA 216 N 0.47 1.73 0.00 0.00 0.00 -1.62 -2.53 119.26 117.31 1obf h ALA 216 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1obf h ALA 216 Cb 0.77 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1obf h ALA 216 CO 0.04 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.51 1obf h ALA 217 N 1.72 1.00 -0.46 0.00 0.00 -1.19 -2.34 119.26 117.99 1obf h ALA 217 Ca 0.18 0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.17 1obf h ALA 217 Cb 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1obf h ALA 217 CO -0.04 0.00 0.31 0.28 0.00 0.00 0.00 179.25 179.80 1obf h VAL 218 N 0.00 0.92 -0.56 0.00 2.07 -1.42 -1.46 116.25 115.80 1obf h VAL 218 Ca 0.00 -0.10 0.16 0.00 0.82 0.00 0.00 66.70 67.58 1obf h VAL 218 Cb 0.37 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1obf h VAL 218 CO 0.00 0.05 0.44 1.23 0.02 0.00 0.00 177.57 179.32 1obf h GLY 219 N 0.30 0.00 2.00 2.17 0.00 -1.60 0.25 103.07 106.18 1obf h GLY 219 Ca 0.21 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.41 1obf h GLY 219 CO -0.04 0.00 -0.61 -0.55 0.00 0.00 0.00 176.54 175.34 1obf h ASP 220 N 0.00 0.00 0.12 0.19 3.32 -1.47 -3.12 116.42 115.47 1obf h ASP 220 Ca 0.27 -0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.95 1obf h ASP 220 Cb 1.15 -0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.65 1obf h ASP 220 CO -0.00 0.61 -2.16 0.52 -1.72 0.00 0.00 179.24 176.49 1obf n VAL 221 N -3.82 1.63 -3.73 -1.35 0.31 -0.50 -4.68 118.33 106.18 1obf n VAL 221 Ca -0.01 -0.67 -0.28 0.00 -0.01 0.00 0.00 64.34 63.37 1obf n VAL 221 Cb 0.61 -1.41 -0.12 0.00 -0.91 0.00 0.00 33.84 32.01 1obf n VAL 221 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1obf s LEU 222 N -6.59 3.41 0.53 7.52 1.43 0.75 -4.76 118.68 120.98 1obf s LEU 222 Ca -0.23 -3.28 0.28 0.00 -1.03 0.00 0.00 54.13 49.87 1obf s LEU 222 Cb 0.07 -1.19 1.43 0.00 0.03 0.00 0.00 46.19 46.53 1obf s LEU 222 CO 0.73 -0.16 1.95 -0.65 0.23 0.00 0.00 176.35 178.44 1obf h PRO 223 N 5.89 0.01 -0.02 1.29 0.11 -1.77 -0.88 132.00 136.63 1obf h PRO 223 Ca 0.12 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.23 1obf h PRO 223 Cb 0.85 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.96 1obf h PRO 223 CO 0.57 0.00 0.07 1.05 -0.21 0.00 0.00 178.00 179.49 1obf h GLU 224 N 0.01 0.00 -0.49 1.05 9.09 -1.95 -2.32 114.58 119.98 1obf h GLU 224 Ca 0.33 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.74 1obf h GLU 224 Cb 1.32 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.42 1obf h GLU 224 CO -0.01 0.00 0.00 1.28 0.05 0.00 0.00 179.01 180.33 1obf n LEU 225 N -3.24 3.37 -4.69 3.06 4.77 -0.33 -4.98 117.00 114.95 1obf n LEU 225 Ca -0.02 -1.85 -0.44 0.00 -0.03 0.00 0.00 56.01 53.67 1obf n LEU 225 Cb 0.14 -0.32 -0.04 0.00 -2.33 0.00 0.00 43.42 40.88 1obf n LEU 225 CO 0.21 0.81 1.42 -0.67 -1.33 0.00 0.00 177.39 177.83 1obf n ASP 226 N 1.14 3.77 0.00 -1.43 2.03 -0.87 -1.29 116.55 119.89 1obf n ASP 226 Ca 0.18 1.01 0.00 0.00 0.52 0.00 0.00 54.79 56.49 1obf n ASP 226 Cb 0.53 -1.50 0.00 0.00 -0.72 0.00 0.00 41.12 39.43 1obf n ASP 226 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1obf n GLY 227 N 4.09 1.56 0.82 0.27 0.00 -1.26 -4.90 105.19 105.77 1obf n GLY 227 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.33 1obf n GLY 227 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1obf n LYS 228 N -2.00 2.11 -4.27 1.61 5.02 -0.41 -4.93 118.16 115.28 1obf n LYS 228 Ca 0.00 -1.65 -0.17 0.00 -2.02 0.00 0.00 58.31 54.47 1obf n LYS 228 Cb 0.00 -1.47 -0.14 0.00 -0.02 0.00 0.00 35.03 33.40 1obf n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1obf s LEU 229 N -2.03 2.06 0.30 -0.35 1.43 -1.26 -1.37 118.68 117.46 1obf s LEU 229 Ca 0.30 -0.22 -0.09 0.00 -1.03 0.00 0.00 54.13 53.09 1obf s LEU 229 Cb 0.20 -0.39 0.00 0.00 0.03 0.00 0.00 46.19 46.04 1obf s LEU 229 CO 0.32 0.05 0.51 0.21 0.23 0.00 0.00 176.35 177.67 1obf s ASN 230 N -0.44 0.35 0.00 2.29 2.47 -1.04 -3.79 114.94 114.78 1obf s ASN 230 Ca 0.01 -1.20 0.00 0.00 0.42 0.00 0.00 52.86 52.09 1obf s ASN 230 Cb -0.04 0.65 0.00 0.00 -1.45 0.00 0.00 41.25 40.40 1obf s ASN 230 CO -0.00 -1.27 0.00 0.61 -3.72 0.00 0.00 177.10 172.72 1obf n GLY 231 N -0.47 -1.59 3.52 1.21 0.00 -1.26 -1.46 105.19 105.13 1obf n GLY 231 Ca -0.01 -1.08 -0.11 0.00 0.00 0.00 0.00 46.02 44.82 1obf n GLY 231 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1obf s TYR 232 N -2.19 0.67 0.09 1.61 -0.85 -0.83 -4.54 117.35 111.32 1obf s TYR 232 Ca 0.00 -0.99 0.07 0.00 -0.52 0.00 0.00 57.07 55.63 1obf s TYR 232 Cb 0.00 0.03 -0.04 0.00 0.38 0.00 0.00 41.96 42.33 1obf s TYR 232 CO 0.00 -1.01 -0.13 0.00 -1.52 0.00 0.00 175.55 172.89 1obf s ALA 233 N -3.68 2.84 -0.23 9.51 0.00 -0.57 -1.77 121.76 127.85 1obf s ALA 233 Ca 0.27 -1.24 0.02 0.00 0.00 0.00 0.00 51.96 51.01 1obf s ALA 233 Cb 0.00 -0.83 0.05 0.00 0.00 0.00 0.00 23.12 22.34 1obf s ALA 233 CO 0.13 0.62 -0.13 0.42 0.00 0.00 0.00 175.76 176.79 1obf s ILE 234 N -1.14 2.10 0.02 0.00 1.01 0.11 -1.21 121.20 122.10 1obf s ILE 234 Ca 0.19 -1.40 -0.30 0.00 0.00 0.00 0.00 60.65 59.14 1obf s ILE 234 Cb -0.11 -2.12 -0.04 0.00 0.01 0.00 0.00 42.46 40.20 1obf s ILE 234 CO 0.11 0.14 0.96 -0.13 0.00 0.00 0.00 174.94 176.01 1obf s ARG 235 N 1.17 4.58 0.24 2.79 1.81 -0.40 -1.30 118.95 127.84 1obf s ARG 235 Ca -0.05 1.39 0.05 0.00 -1.72 0.00 0.00 55.73 55.40 1obf s ARG 235 Cb -0.18 -3.44 -0.05 0.00 -0.45 0.00 0.00 34.95 30.83 1obf s ARG 235 CO -0.07 0.02 -0.04 0.14 -0.68 0.00 0.00 175.30 174.66 1obf s VAL 236 N 0.77 1.32 -1.06 3.52 -7.23 -0.64 -0.94 120.40 116.14 1obf s VAL 236 Ca 0.50 -2.08 -0.14 0.00 -1.81 0.00 0.00 61.98 58.45 1obf s VAL 236 Cb -0.21 -2.35 -0.08 0.00 0.56 0.00 0.00 36.38 34.30 1obf s VAL 236 CO 0.28 -0.35 2.18 -2.65 -0.31 0.00 0.00 175.10 174.25 1obf n PRO 237 N -0.47 2.24 -4.21 4.82 -0.02 -1.26 -3.32 135.00 132.79 1obf n PRO 237 Ca -0.06 -1.91 -0.17 0.00 -2.02 0.00 0.00 63.50 59.34 1obf n PRO 237 Cb 0.63 -2.83 -0.11 0.00 -0.02 0.00 0.00 33.50 31.18 1obf n PRO 237 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1obf s THR 238 N 3.77 1.18 -0.05 3.45 -4.23 -1.26 -5.02 115.64 113.48 1obf s THR 238 Ca 0.51 -1.61 0.12 0.00 -1.18 0.00 0.00 61.69 59.54 1obf s THR 238 Cb 0.13 -1.39 -0.09 0.00 1.34 0.00 0.00 72.50 72.50 1obf s THR 238 CO 0.01 -0.41 1.23 -0.29 -0.54 0.00 0.00 174.62 174.61 1obf h ILE 239 N 3.69 1.11 -2.06 2.99 2.10 -1.88 -1.33 117.51 122.13 1obf h ILE 239 Ca -0.39 -2.65 0.07 0.00 1.08 0.00 0.00 64.86 62.96 1obf h ILE 239 Cb 1.19 2.52 -0.18 0.00 -1.09 0.00 0.00 36.82 39.26 1obf h ILE 239 CO 0.49 0.63 0.45 0.21 -1.08 0.00 0.00 178.15 178.85 1obf s ASN 240 N -6.42 -0.42 0.00 2.19 2.47 -1.26 -4.71 114.94 106.79 1obf s ASN 240 Ca 0.01 0.24 0.00 0.00 0.42 0.00 0.00 52.86 53.53 1obf s ASN 240 Cb 0.09 0.40 0.00 0.00 -1.45 0.00 0.00 41.25 40.28 1obf s ASN 240 CO 0.79 -0.55 0.00 0.52 -3.72 0.00 0.00 177.10 174.13 1obf n VAL 241 N 0.24 -0.70 -4.27 -5.21 0.31 -1.26 -4.89 118.33 102.55 1obf n VAL 241 Ca -0.11 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.06 1obf n VAL 241 Cb 0.60 -0.31 -0.10 0.00 -0.91 0.00 0.00 33.84 33.12 1obf n VAL 241 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1obf s SER 242 N -1.08 0.88 -0.02 4.52 0.01 -0.03 -3.74 113.70 114.24 1obf s SER 242 Ca 0.00 -1.48 0.00 0.00 1.31 0.00 0.00 55.95 55.78 1obf s SER 242 Cb 0.00 0.37 0.02 0.00 0.21 0.00 0.00 66.02 66.62 1obf s SER 242 CO 0.00 -0.86 0.00 -0.51 0.41 0.00 0.00 173.24 172.28 1obf s ILE 243 N -3.86 0.08 -0.16 1.44 2.07 -0.40 -1.37 121.20 119.01 1obf s ILE 243 Ca 0.38 0.08 -0.20 0.00 -1.41 0.00 0.00 60.65 59.50 1obf s ILE 243 Cb 0.06 -0.16 -0.03 0.00 0.13 0.00 0.00 42.46 42.46 1obf s ILE 243 CO 0.16 0.09 0.57 -0.69 -1.91 0.00 0.00 174.94 173.16 1obf s VAL 244 N 0.70 5.08 -0.36 4.00 1.01 -0.09 -1.39 120.40 129.36 1obf s VAL 244 Ca -0.06 1.10 -0.03 0.00 0.00 0.00 0.00 61.98 62.99 1obf s VAL 244 Cb -0.09 -3.90 0.08 0.00 0.00 0.00 0.00 36.38 32.46 1obf s VAL 244 CO -0.02 0.19 0.11 -0.62 0.00 0.00 0.00 175.10 174.77 1obf s ASP 245 N 1.01 5.12 -0.24 3.32 -1.08 -0.34 -1.10 116.67 123.37 1obf s ASP 245 Ca 0.28 -1.61 -0.07 0.00 -0.52 0.00 0.00 52.55 50.63 1obf s ASP 245 Cb -0.16 -1.79 -0.03 0.00 -1.46 0.00 0.00 42.92 39.48 1obf s ASP 245 CO 0.11 -0.40 0.07 -0.22 0.52 0.00 0.00 175.17 175.25 1obf s LEU 246 N 1.22 3.50 -0.20 -1.34 2.96 -0.45 -1.24 118.68 123.13 1obf s LEU 246 Ca 0.02 -0.16 -0.05 0.00 -0.22 0.00 0.00 54.13 53.71 1obf s LEU 246 Cb -0.21 -1.93 -0.03 0.00 0.50 0.00 0.00 46.19 44.52 1obf s LEU 246 CO -0.02 -0.00 0.00 -0.44 -1.32 0.00 0.00 176.35 174.57 1obf s SER 247 N 1.43 4.90 0.05 3.68 0.01 -0.31 -1.86 113.70 121.60 1obf s SER 247 Ca 0.05 -0.17 -0.03 0.00 1.31 0.00 0.00 55.95 57.11 1obf s SER 247 Cb -0.15 -1.84 -0.02 0.00 0.21 0.00 0.00 66.02 64.22 1obf s SER 247 CO 0.04 0.08 0.04 0.72 0.41 0.00 0.00 173.24 174.52 1obf s PHE 248 N 0.92 0.34 -0.30 2.43 -0.12 0.07 -0.65 117.98 120.66 1obf s PHE 248 Ca 0.01 -0.76 -0.15 0.00 -0.05 0.00 0.00 56.93 55.98 1obf s PHE 248 Cb -0.14 -0.25 -0.03 0.00 -0.63 0.00 0.00 43.02 41.97 1obf s PHE 248 CO 0.02 -0.37 0.35 0.08 -0.05 0.00 0.00 175.22 175.25 1obf s VAL 249 N -3.19 5.18 0.54 -2.49 1.01 -0.40 -0.73 120.40 120.31 1obf s VAL 249 Ca 0.00 0.29 -0.17 0.00 0.00 0.00 0.00 61.98 62.10 1obf s VAL 249 Cb 0.02 -3.74 -0.06 0.00 0.00 0.00 0.00 36.38 32.60 1obf s VAL 249 CO -0.07 0.05 1.02 0.00 0.00 0.00 0.00 175.10 176.10 1obf s ALA 250 N 2.02 2.91 -1.30 5.51 0.00 -0.24 -1.19 121.76 129.46 1obf s ALA 250 Ca 0.13 0.34 0.29 0.00 0.00 0.00 0.00 51.96 52.72 1obf s ALA 250 Cb -0.16 -3.19 1.41 0.00 0.00 0.00 0.00 23.12 21.19 1obf s ALA 250 CO 0.11 -0.45 2.00 1.63 0.00 0.00 0.00 175.76 179.05 1obf n LYS 251 N -1.60 0.29 -3.99 0.00 5.02 -0.27 -4.76 118.16 112.85 1obf n LYS 251 Ca 0.08 0.01 -0.10 0.00 -2.02 0.00 0.00 58.31 56.28 1obf n LYS 251 Cb 0.53 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 34.00 1obf n LYS 251 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1obf s ARG 252 N -2.70 1.67 0.48 1.97 1.70 -1.26 -5.06 118.95 115.74 1obf s ARG 252 Ca 0.24 -1.34 -0.24 0.00 -0.47 0.00 0.00 55.73 53.92 1obf s ARG 252 Cb 0.20 0.48 -0.07 0.00 -0.57 0.00 0.00 34.95 34.99 1obf s ARG 252 CO 0.47 -0.70 1.35 -0.80 -1.08 0.00 0.00 175.30 174.54 1obf s ASN 253 N -3.05 5.73 0.26 -2.89 0.01 -1.26 -4.88 114.94 108.86 1obf s ASN 253 Ca 0.23 2.76 -0.07 0.00 -0.71 0.00 0.00 52.86 55.07 1obf s ASN 253 Cb -0.01 -2.64 0.03 0.00 0.41 0.00 0.00 41.25 39.04 1obf s ASN 253 CO 0.11 -1.26 0.47 1.07 -1.51 0.00 0.00 177.10 175.98 1obf n THR 254 N -0.50 0.00 -4.13 1.60 5.66 -1.26 -5.13 114.28 110.51 1obf n THR 254 Ca 0.07 -0.92 -0.09 0.00 -3.05 0.00 0.00 64.05 60.06 1obf n THR 254 Cb 0.44 0.72 -0.10 0.00 -1.55 0.00 0.00 70.33 69.84 1obf n THR 254 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1obf s THR 255 N -2.51 0.30 0.24 1.09 -4.23 -1.26 -4.99 115.64 104.28 1obf s THR 255 Ca 0.15 -1.87 -0.04 0.00 -1.18 0.00 0.00 61.69 58.74 1obf s THR 255 Cb -0.02 -1.75 0.21 0.00 1.34 0.00 0.00 72.50 72.27 1obf s THR 255 CO 0.11 -0.78 1.77 0.58 -0.54 0.00 0.00 174.62 175.76 1obf h VAL 256 N 3.00 0.78 -0.73 2.29 2.07 -1.92 -1.54 116.25 120.19 1obf h VAL 256 Ca -0.35 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 66.91 1obf h VAL 256 Cb 1.17 0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1obf h VAL 256 CO 0.63 0.11 0.26 -0.33 0.02 0.00 0.00 177.57 178.26 1obf h GLU 257 N 0.61 1.10 -0.14 1.57 3.07 -1.98 -1.72 114.58 117.10 1obf h GLU 257 Ca 0.40 -0.21 -0.13 0.00 -0.50 0.00 0.00 59.36 58.92 1obf h GLU 257 Cb 0.51 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.25 1obf h GLU 257 CO -0.32 0.92 -0.42 1.49 -1.40 0.00 0.00 179.01 179.28 1obf h GLU 258 N 1.07 0.53 -0.19 2.33 4.81 -1.79 -1.63 114.58 119.71 1obf h GLU 258 Ca 0.24 -0.38 0.02 0.00 -0.13 0.00 0.00 59.36 59.11 1obf h GLU 258 Cb 0.25 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 1obf h GLU 258 CO -0.01 1.00 0.04 0.28 -0.73 0.00 0.00 179.01 179.59 1obf h VAL 259 N 0.15 0.92 -0.40 0.32 2.07 -1.22 -1.43 116.25 116.66 1obf h VAL 259 Ca -0.01 -0.04 -0.06 0.00 0.82 0.00 0.00 66.70 67.40 1obf h VAL 259 Cb 1.04 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.57 1obf h VAL 259 CO 0.09 0.02 -0.02 0.78 0.02 0.00 0.00 177.57 178.46 1obf h ASN 260 N 0.12 0.61 -0.67 0.57 -0.26 -1.35 -2.76 115.58 111.85 1obf h ASN 260 Ca 0.09 -0.14 -0.07 0.00 -0.56 0.00 0.00 56.30 55.62 1obf h ASN 260 Cb 0.08 -0.16 -0.03 0.00 -1.06 0.00 0.00 38.32 37.15 1obf h ASN 260 CO -0.11 0.70 0.13 1.23 -1.06 0.00 0.00 177.43 178.32 1obf h GLY 261 N 0.92 1.18 0.99 2.83 0.00 -0.86 0.08 103.07 108.21 1obf h GLY 261 Ca 0.12 -0.77 0.00 0.00 0.00 0.00 0.00 47.33 46.69 1obf h GLY 261 CO 0.02 0.71 0.29 -2.22 0.00 0.00 0.00 176.54 175.34 1obf h ILE 262 N 1.02 1.13 -0.48 2.60 2.04 -1.11 -2.06 117.51 120.65 1obf h ILE 262 Ca 0.21 -0.28 -0.12 0.00 1.00 0.00 0.00 64.86 65.66 1obf h ILE 262 Cb 0.41 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1obf h ILE 262 CO 0.01 0.13 -0.18 -0.07 0.00 0.00 0.00 178.15 178.04 1obf h LEU 263 N 0.61 1.00 -0.40 1.44 3.38 -1.20 -2.25 115.31 117.89 1obf h LEU 263 Ca 0.17 -0.38 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 1obf h LEU 263 Cb -0.03 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 1obf h LEU 263 CO -0.03 1.16 0.11 0.50 0.09 0.00 0.00 178.44 180.27 1obf h LYS 264 N 0.83 0.64 -0.82 1.13 3.64 -0.92 -1.43 116.57 119.64 1obf h LYS 264 Ca 0.11 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1obf h LYS 264 Cb 0.75 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.45 1obf h LYS 264 CO 0.06 0.64 0.53 0.00 -2.27 0.00 0.00 179.45 178.41 1obf h ALA 265 N 0.96 1.05 -0.65 5.00 0.00 -1.33 -2.43 119.26 121.86 1obf h ALA 265 Ca 0.13 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1obf h ALA 265 Cb 0.28 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1obf h ALA 265 CO -0.00 0.48 0.06 0.00 0.00 0.00 0.00 179.25 179.79 1obf h ALA 266 N 1.29 0.86 0.00 0.00 0.00 -1.17 -1.80 119.26 118.44 1obf h ALA 266 Ca 0.30 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1obf h ALA 266 Cb -0.09 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 1obf h ALA 266 CO -0.06 0.67 -0.07 0.66 0.00 0.00 0.00 179.25 180.45 1obf h SER 267 N 1.01 0.00 0.15 0.00 4.64 -0.88 -2.32 113.55 116.15 1obf h SER 267 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1obf h SER 267 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1obf h SER 267 CO 0.02 0.07 -0.69 -0.62 -0.87 0.00 0.00 176.83 174.74 1obf n GLU 268 N -4.05 0.33 0.00 4.77 1.02 -0.95 -3.66 120.64 118.09 1obf n GLU 268 Ca -0.03 -0.25 0.00 0.00 -0.02 0.00 0.00 57.16 56.87 1obf n GLU 268 Cb 0.15 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 1obf n GLU 268 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1obf n GLY 269 N 1.47 1.36 0.34 0.62 0.00 -0.71 -4.80 105.19 103.47 1obf n GLY 269 Ca 0.06 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.23 1obf n GLY 269 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1obf h GLU 270 N 0.00 0.11 -0.45 1.61 9.09 -1.83 -2.19 114.58 120.92 1obf h GLU 270 Ca 0.00 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.40 1obf h GLU 270 Cb 0.00 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 27.07 1obf h GLU 270 CO 0.00 0.08 0.00 1.28 0.05 0.00 0.00 179.01 180.42 1obf n LEU 271 N -4.45 4.78 -4.70 3.06 4.77 -0.92 -5.00 117.00 114.55 1obf n LEU 271 Ca 0.06 -2.86 -0.44 0.00 -0.03 0.00 0.00 56.01 52.74 1obf n LEU 271 Cb 0.39 -0.60 -0.03 0.00 -2.33 0.00 0.00 43.42 40.85 1obf n LEU 271 CO 0.35 0.68 1.25 1.17 -1.33 0.00 0.00 177.39 179.50 1obf n LYS 272 N 0.24 2.46 -0.57 3.23 4.81 -0.83 -1.24 118.16 126.26 1obf n LYS 272 Ca 0.24 0.88 0.00 0.00 -0.87 0.00 0.00 58.31 58.57 1obf n LYS 272 Cb 1.01 -2.67 0.00 0.00 0.02 0.00 0.00 35.03 33.39 1obf n LYS 272 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1obf n GLY 273 N 3.24 1.10 1.24 3.14 0.00 -1.26 -4.81 105.19 107.84 1obf n GLY 273 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1obf n GLY 273 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1obf n ILE 274 N -2.00 0.53 -3.59 -0.61 5.41 -0.38 -4.71 119.36 114.01 1obf n ILE 274 Ca 0.00 0.18 -0.38 0.00 1.00 0.00 0.00 62.75 63.54 1obf n ILE 274 Cb 0.00 -1.32 -0.11 0.00 -0.71 0.00 0.00 39.64 37.49 1obf n ILE 274 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 1obf s LEU 275 N -6.45 4.05 0.42 1.39 2.96 -0.52 -1.44 118.68 119.10 1obf s LEU 275 Ca 0.00 -0.08 0.08 0.00 -0.22 0.00 0.00 54.13 53.90 1obf s LEU 275 Cb 0.00 -2.11 -0.01 0.00 0.50 0.00 0.00 46.19 44.57 1obf s LEU 275 CO 0.00 -0.08 0.42 -1.81 -1.32 0.00 0.00 176.35 173.57 1obf s ASP 276 N 1.74 5.15 -0.06 3.68 1.11 0.12 -4.38 116.67 124.03 1obf s ASP 276 Ca 0.07 -0.70 -0.03 0.00 0.18 0.00 0.00 52.55 52.07 1obf s ASP 276 Cb -0.16 -0.54 0.04 0.00 1.07 0.00 0.00 42.92 43.33 1obf s ASP 276 CO 0.10 -0.70 0.12 -0.47 1.18 0.00 0.00 175.17 175.40 1obf s TYR 277 N -2.46 -0.09 -0.02 4.23 5.04 -1.26 -1.42 117.35 121.36 1obf s TYR 277 Ca 0.49 0.45 0.04 0.00 -2.44 0.00 0.00 57.07 55.61 1obf s TYR 277 Cb -0.04 -0.29 -0.01 0.00 0.35 0.00 0.00 41.96 41.97 1obf s TYR 277 CO 0.29 -0.21 -0.14 1.21 -1.34 0.00 0.00 175.55 175.35 1obf s ASN 278 N 1.96 1.76 0.00 4.32 3.84 -0.34 -4.96 114.94 121.52 1obf s ASN 278 Ca 0.00 -0.28 0.00 0.00 0.21 0.00 0.00 52.86 52.80 1obf s ASN 278 Cb -0.12 -0.32 0.00 0.00 -0.55 0.00 0.00 41.25 40.26 1obf s ASN 278 CO -0.05 0.16 0.96 0.35 -2.79 0.00 0.00 177.10 175.73 1obf n THR 279 N 2.92 0.93 -3.17 -5.21 -2.24 -1.26 -1.22 114.28 105.03 1obf n THR 279 Ca -0.16 -0.95 -0.27 0.00 -2.27 0.00 0.00 64.05 60.40 1obf n THR 279 Cb 0.54 0.54 -0.02 0.00 -2.10 0.00 0.00 70.33 69.29 1obf n THR 279 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1obf s GLU 280 N -0.93 3.59 -1.37 -0.78 2.02 -1.26 -4.87 118.70 115.10 1obf s GLU 280 Ca 0.00 -0.01 -0.13 0.00 0.02 0.00 0.00 54.97 54.86 1obf s GLU 280 Cb 0.00 -2.57 0.09 0.00 0.10 0.00 0.00 34.13 31.75 1obf s GLU 280 CO 0.00 0.09 2.02 -0.35 0.02 0.00 0.00 175.26 177.04 1obf n PRO 281 N -1.46 3.18 -3.08 0.39 -0.04 -1.26 -4.97 135.00 127.76 1obf n PRO 281 Ca -0.02 -3.05 -0.18 0.00 -0.04 0.00 0.00 63.50 60.21 1obf n PRO 281 Cb 0.55 -3.16 0.02 0.00 -0.04 0.00 0.00 33.50 30.86 1obf n PRO 281 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1obf s LEU 282 N 1.50 3.47 0.37 1.53 1.43 -1.26 -5.15 118.68 120.58 1obf s LEU 282 Ca 0.45 -0.58 0.04 0.00 -1.03 0.00 0.00 54.13 53.01 1obf s LEU 282 Cb 0.11 -2.31 -0.03 0.00 0.03 0.00 0.00 46.19 43.98 1obf s LEU 282 CO -0.04 -0.91 0.12 0.68 0.23 0.00 0.00 176.35 176.44 1obf s VAL 283 N -2.45 0.64 0.30 -1.59 -7.23 -1.26 -5.07 120.40 103.75 1obf s VAL 283 Ca 0.56 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.72 1obf s VAL 283 Cb -0.08 -2.47 0.27 0.00 0.56 0.00 0.00 36.38 34.66 1obf s VAL 283 CO 0.34 0.00 1.94 0.77 -0.31 0.00 0.00 175.10 177.84 1obf h SER 284 N 1.95 0.92 -0.06 4.85 4.64 -1.98 -2.15 113.55 121.73 1obf h SER 284 Ca -0.36 -0.01 0.02 0.00 -0.47 0.00 0.00 61.79 60.97 1obf h SER 284 Cb 1.26 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1obf h SER 284 CO 0.58 0.63 0.04 1.62 -0.87 0.00 0.00 176.83 178.83 1obf h VAL 285 N 1.07 0.96 0.00 0.95 3.04 -1.98 -0.76 116.25 119.53 1obf h VAL 285 Ca 0.35 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 66.03 1obf h VAL 285 Cb 0.05 0.97 -0.00 0.00 -2.01 0.00 0.00 31.29 30.30 1obf h VAL 285 CO -0.11 0.00 -0.03 0.44 -1.01 0.00 0.00 177.57 176.87 1obf h ASP 286 N 0.00 0.00 0.02 3.17 3.45 -1.80 -2.31 116.42 118.95 1obf h ASP 286 Ca 0.03 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.49 1obf h ASP 286 Cb 0.11 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.88 1obf h ASP 286 CO -0.00 0.03 -0.10 -1.22 -1.57 0.00 0.00 179.24 176.38 1obf n TYR 287 N -3.28 0.00 -1.92 4.55 4.01 -0.29 -4.87 117.16 115.35 1obf n TYR 287 Ca -0.02 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.30 1obf n TYR 287 Cb 0.16 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.14 1obf n TYR 287 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1obf s ASN 288 N -2.14 6.55 -1.14 7.72 2.47 -0.87 -2.17 114.94 125.37 1obf s ASN 288 Ca 0.30 2.71 0.00 0.00 0.42 0.00 0.00 52.86 56.29 1obf s ASN 288 Cb 0.20 -2.61 0.00 0.00 -1.45 0.00 0.00 41.25 37.39 1obf s ASN 288 CO 0.38 -0.81 0.00 1.57 -3.72 0.00 0.00 177.10 174.52 1obf n HIS 289 N 3.17 0.00 -3.12 0.43 -0.00 -1.26 -5.01 115.22 109.43 1obf n HIS 289 Ca 0.11 0.00 -0.40 0.00 0.46 0.00 0.00 57.72 57.89 1obf n HIS 289 Cb 0.39 -2.15 -0.06 0.00 -0.12 0.00 0.00 29.99 28.05 1obf n HIS 289 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 1obf s ASP 290 N -2.73 6.62 0.00 0.26 -1.08 -0.92 -4.99 116.67 113.83 1obf s ASP 290 Ca 0.00 0.76 0.29 0.00 -0.52 0.00 0.00 52.55 53.08 1obf s ASP 290 Cb 0.00 -2.34 1.73 0.00 -1.46 0.00 0.00 42.92 40.86 1obf s ASP 290 CO 0.00 -0.31 2.11 -0.81 0.52 0.00 0.00 175.17 176.67 1obf n PRO 291 N 5.35 0.98 -1.98 4.34 -0.04 -1.26 -4.10 135.00 138.30 1obf n PRO 291 Ca -0.01 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.08 1obf n PRO 291 Cb 0.49 -1.46 0.04 0.00 -0.04 0.00 0.00 33.50 32.53 1obf n PRO 291 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1obf s ALA 292 N -2.00 2.56 0.23 0.55 0.00 -1.26 -4.41 121.76 117.43 1obf s ALA 292 Ca 0.44 1.06 0.12 0.00 0.00 0.00 0.00 51.96 53.58 1obf s ALA 292 Cb 0.20 -3.47 0.39 0.00 0.00 0.00 0.00 23.12 20.24 1obf s ALA 292 CO 0.34 -1.21 1.62 0.77 0.00 0.00 0.00 175.76 177.28 1obf h SER 293 N 0.94 0.00 -2.36 0.00 0.02 -1.53 -3.39 113.55 107.24 1obf h SER 293 Ca -0.51 0.00 0.08 0.00 -0.84 0.00 0.00 61.79 60.52 1obf h SER 293 Cb 1.30 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 63.62 1obf h SER 293 CO 0.55 0.58 0.07 -0.55 -1.14 0.00 0.00 176.83 176.35 1obf s SER 294 N -6.73 -0.87 -0.25 3.07 0.15 -1.10 -3.70 113.70 104.27 1obf s SER 294 Ca -0.01 1.30 0.02 0.00 0.70 0.00 0.00 55.95 57.97 1obf s SER 294 Cb 0.12 1.65 0.06 0.00 -1.71 0.00 0.00 66.02 66.14 1obf s SER 294 CO 0.75 -0.20 -0.09 -0.89 1.20 0.00 0.00 173.24 174.02 1obf s THR 295 N 2.05 1.90 0.15 6.45 2.01 -0.29 -0.70 115.64 127.22 1obf s THR 295 Ca -0.08 -1.47 -0.31 0.00 0.31 0.00 0.00 61.69 60.14 1obf s THR 295 Cb -0.07 -2.08 -0.10 0.00 0.01 0.00 0.00 72.50 70.26 1obf s THR 295 CO -0.18 -0.06 1.58 -0.69 -0.69 0.00 0.00 174.62 174.57 1obf s VAL 296 N 1.22 2.69 -0.71 3.82 1.01 -0.51 -0.95 120.40 126.97 1obf s VAL 296 Ca -0.08 0.46 -0.18 0.00 0.00 0.00 0.00 61.98 62.18 1obf s VAL 296 Cb -0.20 -3.29 0.13 0.00 0.00 0.00 0.00 36.38 33.02 1obf s VAL 296 CO -0.06 0.03 0.81 -0.62 0.00 0.00 0.00 175.10 175.26 1obf s ASP 297 N 1.32 6.39 0.47 3.32 -1.08 -0.60 -1.20 116.67 125.29 1obf s ASP 297 Ca 0.71 -1.81 0.13 0.00 -0.52 0.00 0.00 52.55 51.05 1obf s ASP 297 Cb -0.43 -2.30 1.09 0.00 -1.46 0.00 0.00 42.92 39.82 1obf s ASP 297 CO 0.31 -1.00 2.10 0.00 0.52 0.00 0.00 175.17 177.11 1obf h ALA 298 N 8.83 1.86 0.00 3.66 0.00 -1.47 -2.13 119.26 130.02 1obf h ALA 298 Ca -0.12 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1obf h ALA 298 Cb 1.06 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1obf h ALA 298 CO 1.03 0.12 0.00 0.77 0.00 0.00 0.00 179.25 181.17 1obf h SER 299 N 0.20 0.00 0.43 0.00 0.02 -1.90 -3.06 113.55 109.25 1obf h SER 299 Ca 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1obf h SER 299 Cb 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.55 1obf h SER 299 CO -0.01 0.00 -0.70 0.18 -1.14 0.00 0.00 176.83 175.16 1obf n LEU 300 N -3.08 0.62 -4.72 5.07 4.77 -0.80 -4.96 117.00 113.90 1obf n LEU 300 Ca -0.01 -0.07 -0.42 0.00 -0.03 0.00 0.00 56.01 55.48 1obf n LEU 300 Cb 0.19 -0.17 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 1obf n LEU 300 CO 0.24 0.12 1.34 -0.89 -1.33 0.00 0.00 177.39 176.86 1obf s THR 301 N -3.05 2.14 0.05 -5.08 2.01 -1.16 -4.83 115.64 105.72 1obf s THR 301 Ca 0.09 0.10 0.06 0.00 0.31 0.00 0.00 61.69 62.25 1obf s THR 301 Cb 0.16 -3.07 -0.03 0.00 0.01 0.00 0.00 72.50 69.58 1obf s THR 301 CO 0.75 0.01 -0.16 -0.54 -0.69 0.00 0.00 174.62 173.99 1obf s LYS 302 N 1.05 1.00 -0.05 4.92 -0.14 -0.65 -4.98 119.74 120.89 1obf s LYS 302 Ca 0.73 -0.88 0.01 0.00 -1.36 0.00 0.00 55.97 54.47 1obf s LYS 302 Cb -0.48 -1.06 0.02 0.00 -1.68 0.00 0.00 37.83 34.63 1obf s LYS 302 CO 0.33 0.26 -0.04 0.08 -0.76 0.00 0.00 175.35 175.21 1obf s VAL 303 N -0.97 0.55 -0.26 3.17 1.01 -1.26 -1.20 120.40 121.43 1obf s VAL 303 Ca 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 61.98 61.89 1obf s VAL 303 Cb -0.09 -0.59 0.08 0.00 0.00 0.00 0.00 36.38 35.78 1obf s VAL 303 CO 0.02 0.24 0.04 -0.55 0.00 0.00 0.00 175.10 174.84 1obf s SER 304 N 1.08 3.71 1.97 3.32 0.15 -0.31 -4.96 113.70 118.67 1obf s SER 304 Ca -0.08 -1.32 0.00 0.00 0.70 0.00 0.00 55.95 55.25 1obf s SER 304 Cb -0.14 -0.92 0.00 0.00 -1.71 0.00 0.00 66.02 63.25 1obf s SER 304 CO -0.01 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 174.71 1obf n GLY 305 N 4.82 3.88 0.88 9.45 0.00 -1.26 -1.47 105.19 121.49 1obf n GLY 305 Ca -0.06 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.07 1obf n GLY 305 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1obf n ARG 306 N 13.94 2.17 -3.04 1.61 1.74 -1.26 -4.62 116.66 127.20 1obf n ARG 306 Ca 0.00 -1.75 -0.41 0.00 -0.77 0.00 0.00 57.85 54.93 1obf n ARG 306 Cb 0.00 -1.46 -0.05 0.00 -1.02 0.00 0.00 32.46 29.93 1obf n ARG 306 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1obf s LEU 307 N -1.60 4.15 -0.05 0.55 2.96 -0.54 -1.08 118.68 123.08 1obf s LEU 307 Ca 0.35 0.95 0.06 0.00 -0.22 0.00 0.00 54.13 55.27 1obf s LEU 307 Cb 0.20 -3.01 -0.01 0.00 0.50 0.00 0.00 46.19 43.88 1obf s LEU 307 CO 0.30 -0.32 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.10 1obf s VAL 308 N 1.99 1.79 -0.13 1.68 1.01 0.09 -1.16 120.40 125.67 1obf s VAL 308 Ca 0.32 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.38 1obf s VAL 308 Cb -0.16 -1.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.70 1obf s VAL 308 CO 0.11 0.50 -0.17 -0.75 0.00 0.00 0.00 175.10 174.80 1obf s LYS 309 N -0.14 3.23 -0.00 2.72 2.20 -0.34 -0.75 119.74 126.65 1obf s LYS 309 Ca -0.02 -0.76 0.05 0.00 -0.36 0.00 0.00 55.97 54.88 1obf s LYS 309 Cb -0.12 -2.55 -0.01 0.00 -1.51 0.00 0.00 37.83 33.64 1obf s LYS 309 CO 0.02 0.13 -0.16 0.08 -0.36 0.00 0.00 175.35 175.07 1obf s VAL 310 N 0.53 1.23 -0.02 4.02 1.01 -0.78 -1.64 120.40 124.74 1obf s VAL 310 Ca -0.11 -0.73 0.05 0.00 0.00 0.00 0.00 61.98 61.19 1obf s VAL 310 Cb -0.16 -1.04 -0.01 0.00 0.00 0.00 0.00 36.38 35.17 1obf s VAL 310 CO 0.04 0.29 -0.17 -0.44 0.00 0.00 0.00 175.10 174.82 1obf s SER 311 N -0.51 2.02 -0.03 3.32 0.01 -1.26 -1.34 113.70 115.91 1obf s SER 311 Ca 0.05 -0.32 0.00 0.00 1.31 0.00 0.00 55.95 57.00 1obf s SER 311 Cb -0.06 -0.35 0.03 0.00 0.21 0.00 0.00 66.02 65.84 1obf s SER 311 CO -0.00 0.19 0.01 -0.55 0.41 0.00 0.00 173.24 173.30 1obf s SER 312 N -0.23 0.27 0.23 2.44 0.15 -0.26 -1.55 113.70 114.74 1obf s SER 312 Ca 0.03 0.01 -0.24 0.00 0.70 0.00 0.00 55.95 56.44 1obf s SER 312 Cb -0.08 -0.15 -0.09 0.00 -1.71 0.00 0.00 66.02 63.99 1obf s SER 312 CO 0.00 -0.12 0.81 0.26 1.20 0.00 0.00 173.24 175.39 1obf s TRP 313 N 1.06 3.78 -0.10 3.44 0.52 -0.12 -0.91 118.94 126.59 1obf s TRP 313 Ca -0.09 1.60 -0.05 0.00 0.02 0.00 0.00 56.10 57.58 1obf s TRP 313 Cb -0.13 -2.76 0.05 0.00 -1.15 0.00 0.00 33.47 29.47 1obf s TRP 313 CO -0.02 0.38 0.24 1.52 0.02 0.00 0.00 176.95 179.09 1obf s TYR 314 N -1.39 -0.32 -0.47 -1.98 -0.00 -0.47 -1.13 117.35 111.59 1obf s TYR 314 Ca 0.42 0.77 -0.28 0.00 -0.00 0.00 0.00 57.07 57.99 1obf s TYR 314 Cb -0.20 0.04 -0.01 0.00 -0.00 0.00 0.00 41.96 41.79 1obf s TYR 314 CO 0.24 -0.23 1.71 0.34 -0.00 0.00 0.00 175.55 177.61 1obf s ASP 315 N 1.27 5.77 0.21 -0.18 3.68 -1.26 -0.85 116.67 125.31 1obf s ASP 315 Ca -0.09 0.76 0.20 0.00 2.13 0.00 0.00 52.55 55.55 1obf s ASP 315 Cb -0.10 -2.53 0.89 0.00 -1.45 0.00 0.00 42.92 39.72 1obf s ASP 315 CO -0.08 -1.90 1.60 -0.46 0.13 0.00 0.00 175.17 174.45 1obf n ASN 316 N 10.84 0.48 -0.14 -0.34 6.94 -1.26 -2.01 115.26 129.77 1obf n ASN 316 Ca 0.20 0.65 -0.29 0.00 -0.02 0.00 0.00 54.58 55.11 1obf n ASN 316 Cb 0.49 -0.74 -0.10 0.00 -2.36 0.00 0.00 39.78 37.08 1obf n ASN 316 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1obf n GLU 317 N -2.06 0.58 0.12 -3.83 1.02 -1.26 -4.64 120.64 110.56 1obf n GLU 317 Ca 0.01 0.25 -0.19 0.00 -0.02 0.00 0.00 57.16 57.21 1obf n GLU 317 Cb 0.16 -1.47 -0.14 0.00 -0.02 0.00 0.00 31.44 29.97 1obf n GLU 317 CO 0.00 0.00 0.00 2.35 1.18 0.00 0.00 177.13 180.66 1obf h TRP 318 N -0.98 0.70 0.23 -0.32 2.91 -1.85 -2.61 115.95 114.03 1obf h TRP 318 Ca -0.68 -0.50 -0.01 0.00 1.13 0.00 0.00 58.89 58.83 1obf h TRP 318 Cb 1.60 -0.03 -0.00 0.00 -0.51 0.00 0.00 29.16 30.22 1obf h TRP 318 CO -0.09 1.38 -0.12 0.78 -1.03 0.00 0.00 178.44 179.36 1obf h GLY 319 N 1.02 -0.33 0.79 2.65 0.00 -1.55 -2.50 103.07 103.14 1obf h GLY 319 Ca -0.18 0.13 0.05 0.00 0.00 0.00 0.00 47.33 47.33 1obf h GLY 319 CO 0.23 -0.13 0.49 -2.75 0.00 0.00 0.00 176.54 174.39 1obf h PHE 320 N -0.32 0.92 -0.33 5.60 3.57 -1.75 -1.24 116.94 123.38 1obf h PHE 320 Ca -0.03 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.53 1obf h PHE 320 Cb 0.26 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 38.66 1obf h PHE 320 CO -0.07 0.49 0.13 0.77 -2.23 0.00 0.00 178.31 177.39 1obf h SER 321 N 0.93 0.15 -0.46 0.41 0.02 -1.38 -1.44 113.55 111.78 1obf h SER 321 Ca 0.33 0.03 -0.10 0.00 -0.84 0.00 0.00 61.79 61.22 1obf h SER 321 Cb 0.10 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.63 1obf h SER 321 CO -0.15 0.12 -0.08 0.78 -1.14 0.00 0.00 176.83 176.37 1obf h ASN 322 N 0.27 0.91 0.04 3.07 2.35 -1.09 -3.02 115.58 118.11 1obf h ASN 322 Ca 0.15 -0.28 -0.05 0.00 -0.55 0.00 0.00 56.30 55.57 1obf h ASN 322 Cb 0.11 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 1obf h ASN 322 CO -0.14 1.01 -0.14 0.03 -1.65 0.00 0.00 177.43 176.54 1obf h ARG 323 N 0.83 0.22 -0.72 0.81 2.47 -0.73 -2.48 114.38 114.78 1obf h ARG 323 Ca 0.14 -0.05 0.03 0.00 -1.26 0.00 0.00 59.98 58.84 1obf h ARG 323 Cb 0.60 -0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 28.85 1obf h ARG 323 CO 0.04 0.37 0.48 0.52 0.56 0.00 0.00 179.97 181.93 1obf h MET 324 N 0.21 0.87 -0.26 0.04 2.86 -1.14 0.05 114.93 117.55 1obf h MET 324 Ca 0.04 -0.05 -0.14 0.00 -2.06 0.00 0.00 59.70 57.49 1obf h MET 324 Cb 0.38 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 31.84 1obf h MET 324 CO 0.02 0.57 -0.36 -0.07 1.06 0.00 0.00 176.91 178.13 1obf h LEU 325 N 0.89 0.78 -0.58 1.22 3.38 -1.51 -2.43 115.31 117.06 1obf h LEU 325 Ca 0.28 -0.51 0.01 0.00 0.09 0.00 0.00 57.88 57.76 1obf h LEU 325 Cb 0.03 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 1obf h LEU 325 CO -0.08 1.13 0.37 0.44 0.09 0.00 0.00 178.44 180.39 1obf h ASP 326 N 0.44 0.63 0.25 -0.43 3.32 -1.17 -2.83 116.42 116.63 1obf h ASP 326 Ca 0.03 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.95 1obf h ASP 326 Cb 0.95 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.34 1obf h ASP 326 CO 0.09 0.45 -0.47 0.74 -1.72 0.00 0.00 179.24 178.33 1obf h THR 327 N 0.75 1.33 -0.10 0.35 2.02 -1.01 -2.10 112.91 114.16 1obf h THR 327 Ca 0.22 -1.66 0.03 0.00 0.77 0.00 0.00 66.41 65.76 1obf h THR 327 Cb -0.04 1.77 -0.03 0.00 -1.74 0.00 0.00 68.15 68.11 1obf h THR 327 CO -0.07 0.50 -0.06 0.74 0.37 0.00 0.00 175.52 177.00 1obf h THR 328 N 0.22 0.82 -0.38 3.16 2.02 -1.27 -1.09 112.91 116.40 1obf h THR 328 Ca 0.01 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 1obf h THR 328 Cb 0.91 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 68.12 1obf h THR 328 CO 0.07 0.00 0.16 0.58 0.37 0.00 0.00 175.52 176.70 1obf h VAL 329 N -0.06 1.19 -0.94 3.16 2.07 -1.29 -2.65 116.25 117.73 1obf h VAL 329 Ca 0.06 -0.56 0.04 0.00 0.82 0.00 0.00 66.70 67.06 1obf h VAL 329 Cb 0.15 0.86 -0.06 0.00 -1.52 0.00 0.00 31.29 30.71 1obf h VAL 329 CO -0.13 0.20 0.61 0.00 0.02 0.00 0.00 177.57 178.26 1obf h ALA 330 N 1.01 1.25 -0.41 1.67 0.00 -1.22 -1.65 119.26 119.91 1obf h ALA 330 Ca 0.13 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1obf h ALA 330 Cb 0.17 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1obf h ALA 330 CO -0.01 0.45 0.08 1.25 0.00 0.00 0.00 179.25 181.02 1obf h LEU 331 N 1.16 0.64 -0.38 0.00 5.85 -1.01 -2.34 115.31 119.23 1obf h LEU 331 Ca 0.38 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1obf h LEU 331 Cb 0.04 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 40.90 1obf h LEU 331 CO -0.13 0.73 0.00 0.24 -0.34 0.00 0.00 178.44 178.94 1obf h MET 332 N 0.53 0.00 -0.00 1.25 2.86 -1.27 -3.11 114.93 115.18 1obf h MET 332 Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 1obf h MET 332 Cb 0.35 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.01 1obf h MET 332 CO 0.01 0.00 -0.63 0.43 1.06 0.00 0.00 176.91 177.78 1obf n SER 333 N -2.46 1.04 -4.77 1.22 7.64 -0.64 -5.00 113.62 110.66 1obf n SER 333 Ca 0.04 -0.85 -0.39 0.00 1.01 0.00 0.00 58.87 58.67 1obf n SER 333 Cb 0.37 0.53 -0.01 0.00 -1.01 0.00 0.00 64.21 64.09 1obf n SER 333 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1obf s ALA 334 N -2.82 3.24 -2.04 -0.43 0.00 -0.90 -5.05 121.76 113.77 1obf s ALA 334 Ca 0.14 1.13 0.32 0.00 0.00 0.00 0.00 51.96 53.54 1obf s ALA 334 Cb 0.17 -3.44 1.84 0.00 0.00 0.00 0.00 23.12 21.70 1obf s ALA 334 CO 0.70 -0.68 2.19 0.00 0.00 0.00 0.00 175.76 177.97