#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rwf n GLY 5 N 0.00 2.18 0.34 0.55 0.00 -1.26 -4.93 105.19 102.07 1rwf n GLY 5 Ca 0.00 -2.24 -0.03 0.00 0.00 0.00 0.00 46.02 43.75 1rwf n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwf h ALA 6 N 0.29 1.13 -0.54 4.61 0.00 -2.00 -1.03 119.26 121.72 1rwf h ALA 6 Ca -0.27 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.52 1rwf h ALA 6 Cb 1.16 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1rwf h ALA 6 CO 0.40 0.50 0.07 0.00 0.00 0.00 0.00 179.25 180.22 1rwf h ALA 7 N 1.33 0.72 -0.49 0.00 0.00 -1.99 -1.27 119.26 117.56 1rwf h ALA 7 Ca 0.33 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1rwf h ALA 7 Cb -0.11 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 1rwf h ALA 7 CO -0.08 0.48 0.03 0.93 0.00 0.00 0.00 179.25 180.60 1rwf h GLU 8 N 0.79 0.84 -0.67 0.00 3.07 -1.85 -1.21 114.58 115.55 1rwf h GLU 8 Ca 0.16 -0.25 -0.07 0.00 -0.50 0.00 0.00 59.36 58.69 1rwf h GLU 8 Cb 0.43 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.23 1rwf h GLU 8 CO 0.01 0.87 0.13 0.74 -1.40 0.00 0.00 179.01 179.36 1rwf h PHE 9 N 0.71 1.15 -0.66 4.33 -1.00 -1.09 -1.08 116.94 119.29 1rwf h PHE 9 Ca 0.14 -0.15 -0.04 0.00 2.81 0.00 0.00 57.97 60.73 1rwf h PHE 9 Cb 0.47 -0.32 -0.03 0.00 3.61 0.00 0.00 35.95 39.68 1rwf h PHE 9 CO 0.04 0.95 0.25 0.00 -1.61 0.00 0.00 178.31 177.94 1rwf h ALA 10 N 1.11 0.86 -0.68 2.45 0.00 -1.06 -0.25 119.26 121.70 1rwf h ALA 10 Ca 0.21 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1rwf h ALA 10 Cb 0.41 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1rwf h ALA 10 CO 0.01 0.49 0.13 0.00 0.00 0.00 0.00 179.25 179.87 1rwf h ALA 11 N 1.10 0.94 -0.57 0.00 0.00 -0.99 -0.97 119.26 118.78 1rwf h ALA 11 Ca 0.22 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1rwf h ALA 11 Cb 0.23 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1rwf h ALA 11 CO -0.01 0.66 0.04 -0.07 0.00 0.00 0.00 179.25 179.87 1rwf h LEU 12 N 1.04 0.95 -0.53 0.00 3.38 -0.93 -0.31 115.31 118.91 1rwf h LEU 12 Ca 0.21 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1rwf h LEU 12 Cb 0.42 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1rwf h LEU 12 CO 0.01 1.00 0.08 0.03 0.09 0.00 0.00 178.44 179.66 1rwf h ARG 13 N 0.87 0.88 -0.53 1.13 3.08 -0.87 -1.23 114.38 117.71 1rwf h ARG 13 Ca 0.17 -0.24 -0.06 0.00 0.07 0.00 0.00 59.98 59.92 1rwf h ARG 13 Cb 0.49 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 1rwf h ARG 13 CO 0.02 0.86 0.10 -0.91 -1.07 0.00 0.00 179.97 178.97 1rwf h ASN 14 N 0.76 0.78 -0.63 7.04 2.35 -0.96 -1.11 115.58 123.81 1rwf h ASN 14 Ca 0.16 -0.15 -0.08 0.00 -0.55 0.00 0.00 56.30 55.68 1rwf h ASN 14 Cb 0.41 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 1rwf h ASN 14 CO 0.01 0.78 0.10 -0.09 -1.65 0.00 0.00 177.43 176.59 1rwf h ARG 15 N 0.79 1.05 -0.39 0.81 2.43 -0.73 -0.33 114.38 118.02 1rwf h ARG 15 Ca 0.17 -0.27 -0.08 0.00 -0.81 0.00 0.00 59.98 58.99 1rwf h ARG 15 Cb 0.34 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1rwf h ARG 15 CO 0.00 0.97 -0.06 2.35 -1.51 0.00 0.00 179.97 181.72 1rwf h TRP 16 N 0.99 0.81 -0.80 2.20 2.91 -0.73 0.07 115.95 121.40 1rwf h TRP 16 Ca 0.20 -0.16 -0.02 0.00 1.13 0.00 0.00 58.89 60.03 1rwf h TRP 16 Cb 0.43 -0.20 -0.04 0.00 -0.51 0.00 0.00 29.16 28.84 1rwf h TRP 16 CO 0.03 0.85 0.42 0.28 -1.03 0.00 0.00 178.44 178.99 1rwf h VAL 17 N 0.54 1.24 -0.64 2.65 2.07 -1.11 -0.63 116.25 120.38 1rwf h VAL 17 Ca 0.10 -0.63 0.04 0.00 0.82 0.00 0.00 66.70 67.04 1rwf h VAL 17 Cb 0.57 0.19 -0.05 0.00 -1.52 0.00 0.00 31.29 30.48 1rwf h VAL 17 CO 0.03 0.28 0.37 0.44 0.02 0.00 0.00 177.57 178.71 1rwf h ASP 18 N 1.12 0.57 -0.42 0.57 3.32 -0.74 -1.08 116.42 119.77 1rwf h ASP 18 Ca 0.28 0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.24 1rwf h ASP 18 Cb 0.06 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 1rwf h ASP 18 CO -0.04 0.39 -0.17 -0.61 -1.72 0.00 0.00 179.24 177.08 1rwf h GLN 19 N 0.70 0.85 0.00 3.56 4.15 -0.08 -0.49 115.11 123.81 1rwf h GLN 19 Ca 0.27 -0.36 0.00 0.00 0.77 0.00 0.00 58.65 59.33 1rwf h GLN 19 Cb 0.11 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.77 1rwf h GLN 19 CO -0.14 1.00 -0.59 0.44 -1.93 0.00 0.00 178.83 177.61 1rwf n ILE 20 N -4.24 0.27 -0.09 2.39 -5.35 -0.33 -3.98 119.36 108.04 1rwf n ILE 20 Ca -0.01 -0.21 -0.08 0.00 -0.27 0.00 0.00 62.75 62.18 1rwf n ILE 20 Cb 0.42 -0.05 -0.14 0.00 -1.74 0.00 0.00 39.64 38.12 1rwf n ILE 20 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1rwf n THR 21 N -1.96 1.19 -1.14 7.28 -2.24 -0.43 -4.75 114.28 112.24 1rwf n THR 21 Ca 0.04 -0.76 -0.05 0.00 -2.27 0.00 0.00 64.05 61.01 1rwf n THR 21 Cb 0.41 -0.49 -0.02 0.00 -2.10 0.00 0.00 70.33 68.13 1rwf n THR 21 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rwf n GLY 22 N 1.86 0.73 0.27 3.38 0.00 -0.19 -4.45 105.19 106.79 1rwf n GLY 22 Ca -0.28 -0.49 0.12 0.00 0.00 0.00 0.00 46.02 45.36 1rwf n GLY 22 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1rwf h ARG 23 N 0.22 0.00 -0.01 1.61 0.11 -1.83 -1.42 114.38 113.06 1rwf h ARG 23 Ca -0.10 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.98 1rwf h ARG 23 Cb 0.42 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.50 1rwf h ARG 23 CO 0.14 0.04 -0.26 0.27 0.10 0.00 0.00 179.97 180.27 1rwf n ASN 24 N -4.03 0.95 -0.08 0.08 6.94 -1.26 -4.39 115.26 113.48 1rwf n ASN 24 Ca -0.03 -0.83 0.02 0.00 -0.02 0.00 0.00 54.58 53.72 1rwf n ASN 24 Cb 0.13 0.12 0.03 0.00 -2.36 0.00 0.00 39.78 37.70 1rwf n ASN 24 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 1rwf n VAL 25 N -0.72 0.77 -2.16 3.53 0.24 -0.54 -5.05 118.33 114.40 1rwf n VAL 25 Ca 0.12 -0.84 -0.42 0.00 -2.04 0.00 0.00 64.34 61.16 1rwf n VAL 25 Cb 0.34 0.50 -0.03 0.00 -1.47 0.00 0.00 33.84 33.18 1rwf n VAL 25 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1rwf s ILE 26 N -0.96 3.51 -0.25 1.34 1.01 -1.17 -4.91 121.20 119.77 1rwf s ILE 26 Ca 0.06 0.95 -0.15 0.00 0.00 0.00 0.00 60.65 61.52 1rwf s ILE 26 Cb 0.05 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 1rwf s ILE 26 CO 0.01 0.01 0.37 -1.10 0.00 0.00 0.00 174.94 174.23 1rwf s GLN 27 N 2.16 4.06 0.21 2.79 -0.21 -1.26 -5.04 119.66 122.37 1rwf s GLN 27 Ca 0.66 0.06 -0.32 0.00 0.02 0.00 0.00 55.36 55.78 1rwf s GLN 27 Cb -0.34 -3.62 -0.13 0.00 1.00 0.00 0.00 33.01 29.93 1rwf s GLN 27 CO 0.28 -0.19 1.63 0.00 -2.12 0.00 0.00 175.29 174.89 1rwf n ALA 28 N 5.04 2.13 -0.98 6.09 0.00 -1.26 -1.91 120.51 129.63 1rwf n ALA 28 Ca -0.09 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1rwf n ALA 28 Cb 0.51 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.53 1rwf n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rwf n GLY 29 N 3.35 0.28 3.69 0.00 0.00 -1.26 -4.99 105.19 106.26 1rwf n GLY 29 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1rwf n GLY 29 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rwf s ASP 30 N -2.05 7.19 0.33 1.61 -1.08 -0.80 -4.95 116.67 116.91 1rwf s ASP 30 Ca 0.00 1.46 0.10 0.00 -0.52 0.00 0.00 52.55 53.59 1rwf s ASP 30 Cb 0.00 -2.53 0.56 0.00 -1.46 0.00 0.00 42.92 39.49 1rwf s ASP 30 CO 0.00 -0.41 1.74 1.55 0.52 0.00 0.00 175.17 178.57 1rwf h PRO 31 N 7.10 0.07 -0.15 4.34 0.13 -1.94 -1.94 132.00 139.61 1rwf h PRO 31 Ca -0.32 -0.03 -0.21 0.00 -0.87 0.00 0.00 66.00 64.57 1rwf h PRO 31 Cb 1.15 -0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.29 1rwf h PRO 31 CO 0.84 0.49 -0.74 -0.44 -0.23 0.00 0.00 178.00 177.92 1rwf h ASP 32 N 0.05 0.84 -0.72 1.44 3.32 -1.97 -1.53 116.42 117.85 1rwf h ASP 32 Ca 0.00 -0.54 0.00 0.00 0.02 0.00 0.00 57.03 56.52 1rwf h ASP 32 Cb 0.80 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 40.07 1rwf h ASP 32 CO 0.06 1.32 0.45 -0.26 -1.72 0.00 0.00 179.24 179.09 1rwf h PHE 33 N 0.49 0.93 -0.87 4.55 -1.00 -1.86 -1.32 116.94 117.87 1rwf h PHE 33 Ca -0.04 0.01 -0.01 0.00 2.81 0.00 0.00 57.97 60.74 1rwf h PHE 33 Cb 1.35 -0.31 -0.04 0.00 3.61 0.00 0.00 35.95 40.56 1rwf h PHE 33 CO 0.07 0.61 0.52 0.00 -1.61 0.00 0.00 178.31 177.91 1rwf h ALA 34 N 1.24 1.28 -0.59 2.45 0.00 -1.28 -0.79 119.26 121.57 1rwf h ALA 34 Ca 0.26 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1rwf h ALA 34 Cb -0.06 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.35 1rwf h ALA 34 CO -0.05 0.62 0.06 0.87 0.00 0.00 0.00 179.25 180.74 1rwf h LYS 35 N 1.20 0.97 -0.62 0.00 1.57 -1.05 0.29 116.57 118.93 1rwf h LYS 35 Ca 0.31 -0.26 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 1rwf h LYS 35 Cb -0.05 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 1rwf h LYS 35 CO -0.06 0.92 0.07 0.00 -0.57 0.00 0.00 179.45 179.81 1rwf h ALA 36 N 1.15 0.96 -0.37 3.86 0.00 -0.71 -1.19 119.26 122.96 1rwf h ALA 36 Ca 0.18 -0.27 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 1rwf h ALA 36 Cb 0.45 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1rwf h ALA 36 CO 0.02 0.64 -0.32 0.82 0.00 0.00 0.00 179.25 180.41 1rwf h ILE 37 N 0.96 1.28 -0.90 0.00 1.08 -0.88 -1.20 117.51 117.84 1rwf h ILE 37 Ca 0.19 -1.47 0.03 0.00 -0.39 0.00 0.00 64.86 63.21 1rwf h ILE 37 Cb 0.46 1.33 -0.05 0.00 -3.07 0.00 0.00 36.82 35.49 1rwf h ILE 37 CO 0.02 0.49 0.59 0.74 -0.69 0.00 0.00 178.15 179.29 1rwf h THR 38 N 0.68 1.17 -0.39 -0.27 2.02 -0.58 0.31 112.91 115.85 1rwf h THR 38 Ca 0.07 -0.40 -0.09 0.00 0.77 0.00 0.00 66.41 66.77 1rwf h THR 38 Cb 0.86 -0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1rwf h THR 38 CO 0.08 0.21 -0.11 0.00 0.37 0.00 0.00 175.52 176.07 1rwf h ALA 39 N 1.36 0.54 -0.50 6.16 0.00 -0.94 0.67 119.26 126.55 1rwf h ALA 39 Ca 0.35 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 54.98 1rwf h ALA 39 Cb -0.04 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 1rwf h ALA 39 CO -0.11 0.42 0.26 1.25 0.00 0.00 0.00 179.25 181.07 1rwf h LEU 40 N 0.58 0.38 -0.57 0.00 5.85 -0.83 -2.07 115.31 118.65 1rwf h LEU 40 Ca 0.10 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 1rwf h LEU 40 Cb 0.63 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1rwf h LEU 40 CO 0.04 0.27 0.23 0.78 -0.34 0.00 0.00 178.44 179.42 1rwf h ASN 41 N 0.51 0.79 -0.30 1.25 2.35 0.02 -1.52 115.58 118.67 1rwf h ASN 41 Ca 0.22 -0.17 -0.10 0.00 -0.55 0.00 0.00 56.30 55.70 1rwf h ASN 41 Cb 0.11 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 1rwf h ASN 41 CO -0.14 0.74 -0.15 0.78 -1.65 0.00 0.00 177.43 177.00 1rwf h ASN 42 N 0.78 0.74 -0.40 5.81 2.35 -0.63 -0.56 115.58 123.67 1rwf h ASN 42 Ca 0.19 -0.24 -0.10 0.00 -0.55 0.00 0.00 56.30 55.61 1rwf h ASN 42 Cb 0.20 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 1rwf h ASN 42 CO -0.02 0.90 -0.12 0.50 -1.65 0.00 0.00 177.43 177.05 1rwf h LYS 43 N 0.67 0.80 -0.56 0.81 1.63 -1.26 -1.04 116.57 117.61 1rwf h LYS 43 Ca 0.11 -0.32 -0.01 0.00 -0.85 0.00 0.00 60.65 59.58 1rwf h LYS 43 Cb 0.63 -0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 32.20 1rwf h LYS 43 CO 0.04 0.93 0.31 0.00 -3.45 0.00 0.00 179.45 177.29 1rwf h ALA 44 N 0.84 0.72 -0.79 5.00 0.00 -1.04 -1.62 119.26 122.37 1rwf h ALA 44 Ca 0.10 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1rwf h ALA 44 Cb 0.66 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1rwf h ALA 44 CO 0.04 0.24 0.34 0.00 0.00 0.00 0.00 179.25 179.88 1rwf h ALA 45 N 1.14 1.11 -0.37 0.00 0.00 -1.02 -1.02 119.26 119.10 1rwf h ALA 45 Ca 0.20 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.95 1rwf h ALA 45 Cb 0.05 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1rwf h ALA 45 CO -0.03 0.65 0.19 0.22 0.00 0.00 0.00 179.25 180.28 1rwf h ASP 46 N 1.14 0.28 -0.59 0.00 1.82 -0.84 -1.04 116.42 117.19 1rwf h ASP 46 Ca 0.27 0.01 -0.01 0.00 -0.39 0.00 0.00 57.03 56.91 1rwf h ASP 46 Cb 0.17 -0.04 -0.03 0.00 0.68 0.00 0.00 39.33 40.11 1rwf h ASP 46 CO -0.03 0.21 0.32 0.28 -1.61 0.00 0.00 179.24 178.41 1rwf h SER 47 N 0.39 0.75 -0.17 2.28 0.02 -0.90 -2.94 113.55 112.98 1rwf h SER 47 Ca 0.15 -0.10 -0.08 0.00 -0.84 0.00 0.00 61.79 60.92 1rwf h SER 47 Cb 0.05 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.38 1rwf h SER 47 CO -0.10 0.64 -0.13 -0.07 -1.14 0.00 0.00 176.83 176.02 1rwf h LEU 48 N 0.80 0.54 -2.24 5.07 3.38 -0.91 -1.32 115.31 120.62 1rwf h LEU 48 Ca 0.21 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1rwf h LEU 48 Cb 0.06 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1rwf h LEU 48 CO -0.03 0.70 0.00 0.00 0.09 0.00 0.00 178.44 179.20 1rwf h ALA 49 N 1.36 1.00 -0.22 1.53 0.00 -1.02 -2.20 119.26 119.71 1rwf h ALA 49 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1rwf h ALA 49 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1rwf h ALA 49 CO 0.03 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.91 1rwf n LYS 50 N -2.94 2.08 -1.73 0.00 5.02 -0.52 -5.00 118.16 115.08 1rwf n LYS 50 Ca -0.01 -1.94 -0.42 0.00 -2.02 0.00 0.00 58.31 53.91 1rwf n LYS 50 Cb 0.14 -1.41 -0.02 0.00 -0.02 0.00 0.00 35.03 33.73 1rwf n LYS 50 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1rwf n LEU 51 N 1.17 4.02 -4.62 -0.35 4.77 -0.83 -0.40 117.00 120.76 1rwf n LEU 51 Ca 0.14 1.16 -0.43 0.00 -0.03 0.00 0.00 56.01 56.86 1rwf n LEU 51 Cb 0.52 -1.54 -0.02 0.00 -2.33 0.00 0.00 43.42 40.04 1rwf n LEU 51 CO 0.13 -0.07 1.00 -0.62 -1.33 0.00 0.00 177.39 176.50 1rwf s ASP 52 N 0.27 6.78 0.00 -1.43 3.68 0.06 -4.63 116.67 121.40 1rwf s ASP 52 Ca 0.63 0.80 0.24 0.00 2.13 0.00 0.00 52.55 56.35 1rwf s ASP 52 Cb -0.54 -2.55 0.24 0.00 -1.45 0.00 0.00 42.92 38.63 1rwf s ASP 52 CO 0.52 -1.06 1.25 0.00 0.13 0.00 0.00 175.17 176.01 1rwf n ALA 53 N 7.36 3.42 -1.76 3.66 0.00 -1.26 -4.92 120.51 127.01 1rwf n ALA 53 Ca 0.12 -0.56 -0.38 0.00 0.00 0.00 0.00 53.44 52.62 1rwf n ALA 53 Cb 0.48 -0.91 0.02 0.00 0.00 0.00 0.00 19.45 19.04 1rwf n ALA 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rwf s ALA 54 N -2.49 2.95 0.31 0.00 0.00 -1.26 -4.97 121.76 116.29 1rwf s ALA 54 Ca 0.20 1.21 -0.29 0.00 0.00 0.00 0.00 51.96 53.08 1rwf s ALA 54 Cb 0.18 -3.50 -0.11 0.00 0.00 0.00 0.00 23.12 19.69 1rwf s ALA 54 CO 0.56 -1.08 1.48 0.00 0.00 0.00 0.00 175.76 176.72 1rwf s ALA 55 N -1.37 3.63 -1.43 0.00 0.00 -1.26 -2.82 121.76 118.51 1rwf s ALA 55 Ca 0.67 1.46 -0.10 0.00 0.00 0.00 0.00 51.96 53.98 1rwf s ALA 55 Cb -0.37 -3.59 0.04 0.00 0.00 0.00 0.00 23.12 19.20 1rwf s ALA 55 CO 0.44 -0.88 1.05 0.41 0.00 0.00 0.00 175.76 176.79 1rwf n GLY 56 N 1.56 -0.53 3.71 0.00 0.00 -1.26 -4.92 105.19 103.74 1rwf n GLY 56 Ca 0.05 0.22 -0.38 0.00 0.00 0.00 0.00 46.02 45.91 1rwf n GLY 56 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1rwf n ARG 57 N -4.79 1.25 -0.01 1.61 1.85 -1.13 -4.95 116.66 110.50 1rwf n ARG 57 Ca 0.01 0.48 0.06 0.00 -1.00 0.00 0.00 57.85 57.39 1rwf n ARG 57 Cb 0.55 -2.46 0.05 0.00 -1.05 0.00 0.00 32.46 29.55 1rwf n ARG 57 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1rwf n THR 58 N -1.59 0.03 -4.18 8.89 -2.24 -1.26 -4.99 114.28 108.94 1rwf n THR 58 Ca 0.14 -0.52 -0.11 0.00 -2.27 0.00 0.00 64.05 61.29 1rwf n THR 58 Cb 0.47 1.21 -0.10 0.00 -2.10 0.00 0.00 70.33 69.81 1rwf n THR 58 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1rwf s SER 59 N -0.95 0.72 -0.15 3.42 1.04 -1.26 -4.67 113.70 111.84 1rwf s SER 59 Ca 0.14 -1.17 0.02 0.00 0.48 0.00 0.00 55.95 55.42 1rwf s SER 59 Cb 0.10 0.21 -0.23 0.00 0.10 0.00 0.00 66.02 66.19 1rwf s SER 59 CO 0.14 -0.65 0.24 0.52 0.98 0.00 0.00 173.24 174.48 1rwf n VAL 60 N -0.14 1.63 -5.03 5.02 0.31 -1.26 -4.73 118.33 114.13 1rwf n VAL 60 Ca -0.07 -0.69 -0.32 0.00 -0.01 0.00 0.00 64.34 63.25 1rwf n VAL 60 Cb 0.63 -1.35 -0.14 0.00 -0.91 0.00 0.00 33.84 32.06 1rwf n VAL 60 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1rwf s PHE 61 N -2.55 2.59 0.20 3.52 0.40 -1.26 -0.76 117.98 120.11 1rwf s PHE 61 Ca -0.20 -0.36 0.35 0.00 -0.60 0.00 0.00 56.93 56.11 1rwf s PHE 61 Cb 0.07 -1.62 1.70 0.00 0.51 0.00 0.00 43.02 43.69 1rwf s PHE 61 CO 0.75 0.03 2.05 1.79 0.70 0.00 0.00 175.22 180.54 1rwf h THR 62 N 4.60 0.00 -0.51 0.64 1.35 -0.99 -2.50 112.91 115.51 1rwf h THR 62 Ca -0.41 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.24 1rwf h THR 62 Cb 1.16 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.67 1rwf h THR 62 CO 0.50 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 174.87 1rwf n ASP 63 N -2.85 3.49 -3.82 5.36 5.75 -1.26 -4.91 116.55 118.30 1rwf n ASP 63 Ca -0.01 -2.08 -0.27 0.00 -0.01 0.00 0.00 54.79 52.42 1rwf n ASP 63 Cb 0.17 -0.37 -0.17 0.00 -1.03 0.00 0.00 41.12 39.72 1rwf n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1rwf s LEU 64 N -1.15 1.21 -0.07 -2.12 1.43 -0.94 -5.11 118.68 111.92 1rwf s LEU 64 Ca 0.36 -0.52 -0.25 0.00 -1.03 0.00 0.00 54.13 52.69 1rwf s LEU 64 Cb 0.20 -0.71 -0.03 0.00 0.03 0.00 0.00 46.19 45.68 1rwf s LEU 64 CO 0.22 -0.21 0.77 -0.55 0.23 0.00 0.00 176.35 176.81 1rwf s SER 65 N 1.78 7.05 0.07 2.29 0.15 -1.26 -4.52 113.70 119.26 1rwf s SER 65 Ca 0.02 1.27 0.14 0.00 0.70 0.00 0.00 55.95 58.08 1rwf s SER 65 Cb -0.15 -2.45 0.60 0.00 -1.71 0.00 0.00 66.02 62.32 1rwf s SER 65 CO -0.07 -0.18 1.43 0.18 1.20 0.00 0.00 173.24 175.80 1rwf n LEU 66 N 4.00 0.16 -0.20 3.45 4.77 -1.26 -2.12 117.00 125.80 1rwf n LEU 66 Ca 0.01 0.55 0.14 0.00 -0.03 0.00 0.00 56.01 56.68 1rwf n LEU 66 Cb 0.51 -0.54 0.58 0.00 -2.33 0.00 0.00 43.42 41.64 1rwf n LEU 66 CO 0.48 -0.41 0.85 0.00 -1.33 0.00 0.00 177.39 176.99 1rwf n ALA 67 N -1.57 2.78 -3.59 -1.18 0.00 -1.26 -4.71 120.51 110.98 1rwf n ALA 67 Ca 0.02 -0.32 -0.35 0.00 0.00 0.00 0.00 53.44 52.79 1rwf n ALA 67 Cb 0.14 -1.28 -0.14 0.00 0.00 0.00 0.00 19.45 18.16 1rwf n ALA 67 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1rwf s LYS 68 N -2.35 3.19 0.36 0.00 1.02 -0.90 -5.03 119.74 116.04 1rwf s LYS 68 Ca 0.32 -0.74 0.03 0.00 0.02 0.00 0.00 55.97 55.59 1rwf s LYS 68 Cb 0.20 -2.99 0.68 0.00 -0.52 0.00 0.00 37.83 35.21 1rwf s LYS 68 CO 0.45 -0.26 2.02 0.38 -0.92 0.00 0.00 175.35 177.01 1rwf h ASP 69 N 8.08 0.68 0.29 2.83 3.04 -1.84 -0.75 116.42 128.74 1rwf h ASP 69 Ca -0.39 -0.02 -0.10 0.00 -3.24 0.00 0.00 57.03 53.28 1rwf h ASP 69 Cb 1.14 -0.17 -0.01 0.00 -1.04 0.00 0.00 39.33 39.25 1rwf h ASP 69 CO 0.60 0.49 -0.40 0.00 -2.04 0.00 0.00 179.24 177.89 1rwf h ALA 70 N 1.63 1.18 0.00 4.15 0.00 -1.95 -2.06 119.26 122.21 1rwf h ALA 70 Ca 0.22 -0.40 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 1rwf h ALA 70 Cb -0.09 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1rwf h ALA 70 CO -0.05 0.56 -0.64 0.93 0.00 0.00 0.00 179.25 180.06 1rwf h GLU 71 N 0.14 0.00 -0.38 0.00 5.08 -1.44 -1.92 114.58 116.06 1rwf h GLU 71 Ca 0.01 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 1rwf h GLU 71 Cb 0.78 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 1rwf h GLU 71 CO 0.06 0.64 0.11 1.98 -1.00 0.00 0.00 179.01 180.80 1rwf h MET 72 N 0.00 0.60 -0.14 2.33 4.05 -1.02 -0.54 114.93 120.21 1rwf h MET 72 Ca -0.01 -0.13 0.01 0.00 -0.28 0.00 0.00 59.70 59.29 1rwf h MET 72 Cb 1.41 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 32.11 1rwf h MET 72 CO 0.08 0.61 0.07 0.28 0.23 0.00 0.00 176.91 178.19 1rwf h VAL 73 N 0.47 1.00 -0.19 -5.77 2.07 -1.16 -2.24 116.25 110.43 1rwf h VAL 73 Ca 0.12 -0.05 -0.04 0.00 0.82 0.00 0.00 66.70 67.55 1rwf h VAL 73 Cb 0.27 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1rwf h VAL 73 CO -0.00 0.03 -0.07 0.74 0.02 0.00 0.00 177.57 178.28 1rwf h THR 74 N 0.15 1.16 -0.33 2.57 2.02 -1.23 0.93 112.91 118.18 1rwf h THR 74 Ca 0.05 -0.69 0.06 0.00 0.77 0.00 0.00 66.41 66.60 1rwf h THR 74 Cb 0.00 1.11 -0.05 0.00 -1.74 0.00 0.00 68.15 67.46 1rwf h THR 74 CO -0.03 0.22 -0.01 0.74 0.37 0.00 0.00 175.52 176.80 1rwf h THR 75 N 0.28 0.74 -0.21 3.16 2.02 -0.70 -0.29 112.91 117.91 1rwf h THR 75 Ca 0.06 -0.03 -0.20 0.00 0.77 0.00 0.00 66.41 67.02 1rwf h THR 75 Cb 0.31 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.38 1rwf h THR 75 CO 0.01 0.01 -0.65 1.88 0.37 0.00 0.00 175.52 177.15 1rwf h TYR 76 N 0.08 0.99 -0.05 3.16 -1.99 -0.69 -2.23 116.97 116.24 1rwf h TYR 76 Ca 0.16 -0.39 -0.08 0.00 2.00 0.00 0.00 58.73 60.42 1rwf h TYR 76 Cb 0.22 -0.17 -0.01 0.00 2.00 0.00 0.00 36.73 38.77 1rwf h TYR 76 CO -0.25 1.20 -0.35 1.79 -0.00 0.00 0.00 178.16 180.56 1rwf h THR 77 N 0.55 1.26 -0.57 -2.88 1.35 -0.70 -0.42 112.91 111.52 1rwf h THR 77 Ca -0.02 -1.26 -0.10 0.00 -0.55 0.00 0.00 66.41 64.49 1rwf h THR 77 Cb 1.26 1.62 -0.02 0.00 -1.73 0.00 0.00 68.15 69.27 1rwf h THR 77 CO 0.13 0.37 -0.03 0.03 -0.25 0.00 0.00 175.52 175.77 1rwf h ARG 78 N 0.08 1.02 -0.51 4.72 3.08 -0.96 -0.98 114.38 120.83 1rwf h ARG 78 Ca 0.01 -0.34 -0.11 0.00 0.07 0.00 0.00 59.98 59.61 1rwf h ARG 78 Cb 0.65 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.60 1rwf h ARG 78 CO 0.05 1.03 -0.10 -0.07 -1.07 0.00 0.00 179.97 179.81 1rwf h LEU 79 N 0.91 0.98 -0.88 3.04 3.38 -0.99 -0.69 115.31 121.05 1rwf h LEU 79 Ca 0.16 -0.35 -0.10 0.00 0.09 0.00 0.00 57.88 57.68 1rwf h LEU 79 Cb 0.58 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1rwf h LEU 79 CO 0.03 1.10 -0.27 0.77 0.09 0.00 0.00 178.44 180.17 1rwf h SER 80 N 0.84 0.52 -0.58 -0.43 4.64 -0.97 -1.11 113.55 116.46 1rwf h SER 80 Ca 0.13 -0.18 -0.06 0.00 -0.47 0.00 0.00 61.79 61.21 1rwf h SER 80 Cb 0.66 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.58 1rwf h SER 80 CO 0.05 0.78 0.13 -0.61 -0.87 0.00 0.00 176.83 176.30 1rwf h GLN 81 N 0.45 0.94 -0.82 4.77 -0.00 -0.99 -0.03 115.11 119.43 1rwf h GLN 81 Ca 0.06 -0.23 -0.02 0.00 -0.00 0.00 0.00 58.65 58.46 1rwf h GLN 81 Cb 0.70 -0.12 -0.04 0.00 0.00 0.00 0.00 27.48 28.02 1rwf h GLN 81 CO 0.05 0.88 0.42 -0.07 0.00 0.00 0.00 178.83 180.11 1rwf h LEU 82 N 0.85 1.05 -1.01 -2.39 3.38 -0.88 -0.45 115.31 115.85 1rwf h LEU 82 Ca 0.18 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 1rwf h LEU 82 Cb 0.36 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1rwf h LEU 82 CO 0.00 0.87 -0.11 0.00 0.09 0.00 0.00 178.44 179.29 1rwf h ALA 83 N 1.22 1.18 -0.01 1.53 0.00 -0.98 -0.23 119.26 121.96 1rwf h ALA 83 Ca 0.28 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rwf h ALA 83 Cb 0.07 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1rwf h ALA 83 CO -0.04 0.53 0.01 1.15 0.00 0.00 0.00 179.25 180.89 1rwf h THR 84 N 0.53 1.00 -0.45 0.00 2.02 -0.45 -2.00 112.91 113.56 1rwf h THR 84 Ca 0.10 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.27 1rwf h THR 84 Cb 0.51 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 1rwf h THR 84 CO 0.03 0.00 0.29 0.00 0.37 0.00 0.00 175.52 176.22 1rwf h ALA 85 N 1.00 0.57 -0.12 6.16 0.00 -0.84 -2.12 119.26 123.92 1rwf h ALA 85 Ca 0.00 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1rwf h ALA 85 Cb 0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1rwf h ALA 85 CO -0.00 0.04 0.11 2.35 0.00 0.00 0.00 179.25 181.74 1rwf h TRP 86 N 0.61 0.00 -0.10 0.00 7.01 -0.87 -1.96 115.95 120.64 1rwf h TRP 86 Ca 0.16 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.16 1rwf h TRP 86 Cb -0.05 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.01 1rwf h TRP 86 CO -0.04 0.00 0.00 0.00 -2.79 0.00 0.00 178.44 175.61 1rwf n ALA 87 N -2.43 2.48 -2.72 2.65 0.00 -0.77 -1.32 120.51 118.40 1rwf n ALA 87 Ca -0.00 -0.69 -0.40 0.00 0.00 0.00 0.00 53.44 52.35 1rwf n ALA 87 Cb 0.22 -0.91 -0.11 0.00 0.00 0.00 0.00 19.45 18.65 1rwf n ALA 87 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1rwf s THR 88 N -1.89 4.82 0.29 0.00 2.01 -0.73 -4.88 115.64 115.26 1rwf s THR 88 Ca 0.32 -0.58 -0.29 0.00 0.31 0.00 0.00 61.69 61.46 1rwf s THR 88 Cb 0.21 -3.58 -0.13 0.00 0.01 0.00 0.00 72.50 69.00 1rwf s THR 88 CO 0.31 -0.11 1.18 -2.65 -0.69 0.00 0.00 174.62 172.65 1rwf n PRO 89 N 5.04 1.71 -0.18 4.92 -0.02 -1.26 -1.62 135.00 143.59 1rwf n PRO 89 Ca -0.12 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 1rwf n PRO 89 Cb 0.48 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 1rwf n PRO 89 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1rwf n THR 90 N 0.61 0.00 -1.64 3.45 -2.24 -1.26 -5.02 114.28 108.18 1rwf n THR 90 Ca 0.09 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.53 1rwf n THR 90 Cb 0.33 -0.02 0.07 0.00 -2.10 0.00 0.00 70.33 68.61 1rwf n THR 90 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rwf s ALA 91 N -2.77 2.31 0.30 6.98 0.00 -0.64 -4.90 121.76 123.04 1rwf s ALA 91 Ca 0.00 0.77 -0.00 0.00 0.00 0.00 0.00 51.96 52.73 1rwf s ALA 91 Cb 0.00 -3.41 0.50 0.00 0.00 0.00 0.00 23.12 20.21 1rwf s ALA 91 CO 0.00 -1.55 1.92 0.00 0.00 0.00 0.00 175.76 176.13 1rwf h ALA 92 N -0.01 1.48 -0.62 0.00 0.00 -1.89 -2.14 119.26 116.08 1rwf h ALA 92 Ca -0.48 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1rwf h ALA 92 Cb 1.28 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1rwf h ALA 92 CO 0.52 0.40 0.00 1.33 0.00 0.00 0.00 179.25 181.50 1rwf n VAL 93 N -4.47 1.48 -1.68 0.00 0.24 -1.26 -4.91 118.33 107.72 1rwf n VAL 93 Ca 0.13 -1.03 -0.47 0.00 -2.04 0.00 0.00 64.34 60.94 1rwf n VAL 93 Cb 0.17 0.17 -0.04 0.00 -1.47 0.00 0.00 33.84 32.67 1rwf n VAL 93 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 1rwf n PHE 94 N 1.13 2.36 -1.29 6.34 7.35 -0.81 -1.49 117.46 131.05 1rwf n PHE 94 Ca 0.23 0.05 -0.10 0.00 -0.76 0.00 0.00 57.45 56.87 1rwf n PHE 94 Cb 0.76 -2.64 -0.04 0.00 0.35 0.00 0.00 39.48 37.91 1rwf n PHE 94 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1rwf n GLY 95 N 4.05 1.02 3.62 7.13 0.00 -0.44 -4.94 105.19 115.64 1rwf n GLY 95 Ca 0.20 -0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 1rwf n GLY 95 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rwf s ASP 96 N -2.47 6.74 0.40 1.61 -1.08 -0.56 -4.91 116.67 116.40 1rwf s ASP 96 Ca 0.00 0.86 0.10 0.00 -0.52 0.00 0.00 52.55 52.99 1rwf s ASP 96 Cb 0.00 -2.54 0.83 0.00 -1.46 0.00 0.00 42.92 39.74 1rwf s ASP 96 CO 0.00 -1.09 1.94 0.00 0.52 0.00 0.00 175.17 176.54 1rwf h ALA 97 N 8.90 1.55 -0.32 3.66 0.00 -1.92 -0.12 119.26 131.02 1rwf h ALA 97 Ca -0.23 -0.18 -0.17 0.00 0.00 0.00 0.00 54.91 54.33 1rwf h ALA 97 Cb 1.07 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 1rwf h ALA 97 CO 1.07 0.32 -0.47 0.00 0.00 0.00 0.00 179.25 180.17 1rwf h ALA 98 N 1.68 0.49 -0.38 0.00 0.00 -1.98 -0.36 119.26 118.70 1rwf h ALA 98 Ca 0.05 -0.49 -0.06 0.00 0.00 0.00 0.00 54.91 54.41 1rwf h ALA 98 Cb 0.33 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1rwf h ALA 98 CO 0.02 0.66 0.02 0.28 0.00 0.00 0.00 179.25 180.22 1rwf h VAL 99 N 0.68 1.25 -0.33 0.00 2.07 -1.85 -1.96 116.25 116.12 1rwf h VAL 99 Ca 0.03 -0.95 0.07 0.00 0.82 0.00 0.00 66.70 66.67 1rwf h VAL 99 Cb 1.07 1.13 -0.07 0.00 -1.52 0.00 0.00 31.29 31.91 1rwf h VAL 99 CO 0.11 0.32 -0.11 0.25 0.02 0.00 0.00 177.57 178.16 1rwf h LEU 100 N 0.49 -0.37 -1.24 2.57 5.85 -0.92 -0.43 115.31 121.25 1rwf h LEU 100 Ca 0.11 0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.95 1rwf h LEU 100 Cb 0.44 0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.66 1rwf h LEU 100 CO 0.02 -0.14 0.52 0.00 -0.34 0.00 0.00 178.44 178.50 1rwf h ALA 101 N 1.27 1.46 -0.57 1.25 0.00 -0.85 -1.12 119.26 120.70 1rwf h ALA 101 Ca 0.16 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 1rwf h ALA 101 Cb 0.28 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1rwf h ALA 101 CO -0.36 0.50 -0.00 0.00 0.00 0.00 0.00 179.25 179.39 1rwf h ALA 102 N 1.52 0.92 -0.13 0.00 0.00 -0.79 -0.91 119.26 119.86 1rwf h ALA 102 Ca 0.29 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1rwf h ALA 102 Cb -0.10 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1rwf h ALA 102 CO -0.07 0.64 0.06 0.82 0.00 0.00 0.00 179.25 180.71 1rwf h ILE 103 N 0.90 1.12 -0.86 0.00 2.04 -0.41 -1.34 117.51 118.97 1rwf h ILE 103 Ca 0.16 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.68 1rwf h ILE 103 Cb 0.53 1.12 -0.04 0.00 -0.74 0.00 0.00 36.82 37.69 1rwf h ILE 103 CO 0.03 0.11 0.55 0.11 0.00 0.00 0.00 178.15 178.95 1rwf h LYS 104 N 0.08 1.14 -0.20 2.37 1.57 -1.10 0.10 116.57 120.54 1rwf h LYS 104 Ca 0.04 -0.08 -0.11 0.00 -1.87 0.00 0.00 60.65 58.63 1rwf h LYS 104 Cb 0.12 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 1rwf h LYS 104 CO -0.01 0.78 -0.36 0.00 -0.57 0.00 0.00 179.45 179.28 1rwf h ALA 105 N 1.30 1.00 -0.39 3.86 0.00 -1.09 -0.61 119.26 123.33 1rwf h ALA 105 Ca 0.31 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1rwf h ALA 105 Cb -0.10 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1rwf h ALA 105 CO -0.06 0.61 0.12 0.78 0.00 0.00 0.00 179.25 180.69 1rwf h GLY 106 N 1.10 0.65 1.07 0.00 0.00 -0.55 -0.14 103.07 105.19 1rwf h GLY 106 Ca 0.04 -0.38 -0.08 0.00 0.00 0.00 0.00 47.33 46.90 1rwf h GLY 106 CO 0.07 0.36 0.10 1.41 0.00 0.00 0.00 176.54 178.47 1rwf h LEU 107 N 0.48 1.07 -0.18 3.11 3.38 -0.82 0.22 115.31 122.58 1rwf h LEU 107 Ca 0.13 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1rwf h LEU 107 Cb 0.26 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1rwf h LEU 107 CO -0.00 1.06 0.05 0.00 0.09 0.00 0.00 178.44 179.64 1rwf h ALA 108 N 1.04 0.23 -0.07 1.53 0.00 -0.92 -2.13 119.26 118.94 1rwf h ALA 108 Ca 0.20 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.78 1rwf h ALA 108 Cb 0.46 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1rwf h ALA 108 CO 0.02 -0.14 -0.76 -0.44 0.00 0.00 0.00 179.25 177.93 1rwf h ASP 109 N 0.10 0.50 -0.23 0.00 3.32 -0.98 -0.99 116.42 118.14 1rwf h ASP 109 Ca 0.06 -0.34 -0.04 0.00 0.02 0.00 0.00 57.03 56.72 1rwf h ASP 109 Cb 0.25 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 1rwf h ASP 109 CO -0.00 1.09 0.02 0.00 -1.72 0.00 0.00 179.24 178.63 1rwf h ALA 110 N 0.90 1.42 0.24 3.45 0.00 -0.92 0.51 119.26 124.85 1rwf h ALA 110 Ca -0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1rwf h ALA 110 Cb 1.35 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1rwf h ALA 110 CO 0.13 0.41 -0.12 -0.97 0.00 0.00 0.00 179.25 178.71 1rwf h ASN 111 N 0.49 -0.27 -0.51 0.00 -0.00 -1.12 -0.48 115.58 113.69 1rwf h ASN 111 Ca 0.11 -0.19 0.06 0.00 -0.00 0.00 0.00 56.30 56.28 1rwf h ASN 111 Cb 0.29 0.07 -0.05 0.00 -0.00 0.00 0.00 38.32 38.63 1rwf h ASN 111 CO 0.01 0.05 0.22 0.74 -0.00 0.00 0.00 177.43 178.44 1rwf h THR 112 N -0.62 0.88 0.00 -3.57 2.02 -1.01 -3.21 112.91 107.40 1rwf h THR 112 Ca -0.03 -0.15 -0.13 0.00 0.77 0.00 0.00 66.41 66.87 1rwf h THR 112 Cb 0.44 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 1rwf h THR 112 CO 0.05 0.08 -0.62 -0.07 0.37 0.00 0.00 175.52 175.33 1rwf h LEU 113 N 0.42 0.00 0.00 2.58 3.38 -0.95 -3.46 115.31 117.29 1rwf h LEU 113 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1rwf h LEU 113 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1rwf h LEU 113 CO -0.21 0.62 0.00 0.00 0.09 0.00 0.00 178.44 178.94 1rwf s TYR 115 N -1.11 3.63 0.26 0.00 5.04 -0.25 -4.74 117.35 120.18 1rwf s TYR 115 Ca 0.00 -1.88 -0.01 0.00 -2.44 0.00 0.00 57.07 52.73 1rwf s TYR 115 Cb 0.00 -3.93 -0.02 0.00 0.35 0.00 0.00 41.96 38.35 1rwf s TYR 115 CO 0.00 -1.11 0.28 0.54 -1.34 0.00 0.00 175.55 173.92 1rwf s ASN 116 N 2.47 0.57 0.00 4.32 2.20 -1.25 -4.32 114.94 118.94 1rwf s ASN 116 Ca 0.22 -1.41 0.17 0.00 -0.94 0.00 0.00 52.86 50.90 1rwf s ASN 116 Cb -0.09 0.50 1.03 0.00 -2.00 0.00 0.00 41.25 40.69 1rwf s ASN 116 CO -0.09 -1.02 1.50 -0.90 -2.94 0.00 0.00 177.10 173.65 1rwf n ASP 117 N -0.76 0.00 -0.61 3.54 5.75 -1.26 -2.34 116.55 120.87 1rwf n ASP 117 Ca 0.02 -0.95 0.07 0.00 -0.01 0.00 0.00 54.79 53.93 1rwf n ASP 117 Cb 0.64 0.00 0.07 0.00 -1.03 0.00 0.00 41.12 40.80 1rwf n ASP 117 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1rwf n ARG 118 N -0.86 1.17 -3.32 0.11 1.74 -1.26 -4.96 116.66 109.28 1rwf n ARG 118 Ca 0.13 -1.44 -0.38 0.00 -0.77 0.00 0.00 57.85 55.40 1rwf n ARG 118 Cb 0.06 -1.29 -0.06 0.00 -1.02 0.00 0.00 32.46 30.15 1rwf n ARG 118 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1rwf s LYS 119 N -1.23 4.34 0.26 5.56 2.47 -0.99 -5.06 119.74 125.10 1rwf s LYS 119 Ca 0.18 0.45 -0.29 0.00 -1.56 0.00 0.00 55.97 54.74 1rwf s LYS 119 Cb 0.13 -3.43 -0.09 0.00 -1.46 0.00 0.00 37.83 32.97 1rwf s LYS 119 CO 0.19 0.16 1.00 -2.00 0.16 0.00 0.00 175.35 174.86 1rwf s GLU 120 N 0.61 4.74 0.40 4.03 2.12 -1.26 -4.94 118.70 124.40 1rwf s GLU 120 Ca 0.26 1.60 -0.27 0.00 0.36 0.00 0.00 54.97 56.91 1rwf s GLU 120 Cb -0.15 -3.19 -0.10 0.00 0.26 0.00 0.00 34.13 30.94 1rwf s GLU 120 CO 0.10 0.37 1.48 -1.21 -0.54 0.00 0.00 175.26 175.47 1rwf s GLU 121 N -1.37 3.99 -0.06 4.30 2.02 -1.26 -5.02 118.70 121.29 1rwf s GLU 121 Ca 0.43 2.56 0.02 0.00 0.02 0.00 0.00 54.97 58.00 1rwf s GLU 121 Cb -0.28 -2.88 0.02 0.00 0.10 0.00 0.00 34.13 31.09 1rwf s GLU 121 CO 0.35 -0.63 -0.10 0.08 0.02 0.00 0.00 175.26 174.98 1rwf s VAL 122 N -1.14 0.96 0.00 2.63 1.01 -1.26 -5.08 120.40 117.51 1rwf s VAL 122 Ca 0.55 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 62.17 1rwf s VAL 122 Cb -0.46 -0.91 0.00 0.00 0.00 0.00 0.00 36.38 35.01 1rwf s VAL 122 CO 0.62 0.32 0.00 0.61 0.00 0.00 0.00 175.10 176.65 1rwf n GLY 123 N 4.01 -0.14 3.65 4.51 0.00 -1.26 -4.71 105.19 111.26 1rwf n GLY 123 Ca -0.22 -1.23 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 1rwf n GLY 123 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1rwf s ASN 124 N -4.00 6.57 0.42 1.61 3.84 -1.26 -4.88 114.94 117.24 1rwf s ASN 124 Ca 0.00 2.05 0.17 0.00 0.21 0.00 0.00 52.86 55.29 1rwf s ASN 124 Cb 0.00 -2.53 1.08 0.00 -0.55 0.00 0.00 41.25 39.25 1rwf s ASN 124 CO 0.00 -1.03 1.86 4.11 -2.79 0.00 0.00 177.10 179.25 1rwf h TRP 125 N 9.95 0.53 -0.73 0.43 5.08 -2.00 -1.96 115.95 127.25 1rwf h TRP 125 Ca -0.37 0.02 -0.02 0.00 1.08 0.00 0.00 58.89 59.59 1rwf h TRP 125 Cb 1.17 -0.16 -0.03 0.00 -3.00 0.00 0.00 29.16 27.13 1rwf h TRP 125 CO 0.89 0.15 0.38 2.35 -1.28 0.00 0.00 178.44 180.92 1rwf h TRP 126 N 0.41 1.01 -0.72 0.12 7.01 -1.98 -1.89 115.95 119.90 1rwf h TRP 126 Ca 0.46 -0.03 0.07 0.00 2.11 0.00 0.00 58.89 61.50 1rwf h TRP 126 Cb 1.14 -0.32 -0.06 0.00 -2.10 0.00 0.00 29.16 27.82 1rwf h TRP 126 CO -0.00 0.71 0.41 0.77 -2.79 0.00 0.00 178.44 177.54 1rwf h SER 127 N 1.02 0.61 0.75 2.65 0.02 -1.70 0.10 113.55 117.00 1rwf h SER 127 Ca 0.26 0.03 -0.23 0.00 -0.84 0.00 0.00 61.79 61.00 1rwf h SER 127 Cb 0.06 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 1rwf h SER 127 CO -0.04 0.39 -1.08 -0.50 -1.14 0.00 0.00 176.83 174.46 1rwf h TRP 128 N 0.74 0.28 0.00 3.45 4.06 -1.49 -1.50 115.95 121.50 1rwf h TRP 128 Ca 0.33 -0.19 -0.21 0.00 2.06 0.00 0.00 58.89 60.88 1rwf h TRP 128 Cb 0.22 -0.02 -0.04 0.00 -1.00 0.00 0.00 29.16 28.32 1rwf h TRP 128 CO -0.07 1.12 -2.07 0.39 -3.56 0.00 0.00 178.44 174.25 1rwf n GLU 129 N -3.50 0.98 0.00 0.49 1.02 -0.78 -4.46 120.64 114.39 1rwf n GLU 129 Ca -0.04 -0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.03 1rwf n GLU 129 Cb 0.95 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.93 1rwf n GLU 129 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1rwf n ILE 130 N -2.47 0.00 0.09 -3.67 5.41 0.03 -4.60 119.36 114.16 1rwf n ILE 130 Ca -0.20 0.00 -0.13 0.00 1.00 0.00 0.00 62.75 63.42 1rwf n ILE 130 Cb 0.86 -1.29 -0.08 0.00 -0.71 0.00 0.00 39.64 38.42 1rwf n ILE 130 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1rwf h GLY 131 N 0.00 -0.20 0.38 7.39 0.00 -0.89 -2.75 103.07 106.99 1rwf h GLY 131 Ca 0.00 0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.40 1rwf h GLY 131 CO 0.00 -0.07 -0.00 -2.08 0.00 0.00 0.00 176.54 174.38 1rwf h VAL 132 N -0.38 1.46 -0.76 4.60 2.07 -1.52 -3.27 116.25 118.45 1rwf h VAL 132 Ca -0.02 -1.45 0.10 0.00 0.82 0.00 0.00 66.70 66.16 1rwf h VAL 132 Cb 0.30 2.43 -0.08 0.00 -1.52 0.00 0.00 31.29 32.43 1rwf h VAL 132 CO 0.03 0.37 0.39 -0.65 0.02 0.00 0.00 177.57 177.74 1rwf h PRO 133 N -0.64 0.63 -0.85 1.57 0.11 -1.78 0.14 132.00 131.19 1rwf h PRO 133 Ca -0.00 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.05 1rwf h PRO 133 Cb 0.62 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 31.55 1rwf h PRO 133 CO 0.00 0.42 0.44 0.00 -0.21 0.00 0.00 178.00 178.65 1rwf h ARG 134 N 0.65 1.20 -0.01 1.05 3.08 -1.61 0.24 114.38 118.97 1rwf h ARG 134 Ca 0.38 -0.16 -0.21 0.00 0.07 0.00 0.00 59.98 60.06 1rwf h ARG 134 Cb 0.41 -0.23 0.02 0.00 0.08 0.00 0.00 29.97 30.25 1rwf h ARG 134 CO -0.28 0.90 -0.83 0.00 -1.07 0.00 0.00 179.97 178.69 1rwf h ALA 135 N 1.23 0.11 -0.41 0.04 0.00 -1.37 -2.11 119.26 116.74 1rwf h ALA 135 Ca 0.29 -0.64 -0.12 0.00 0.00 0.00 0.00 54.91 54.45 1rwf h ALA 135 Cb 0.07 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1rwf h ALA 135 CO -0.04 0.53 -0.22 1.25 0.00 0.00 0.00 179.25 180.76 1rwf h LEU 136 N 0.18 0.85 -0.53 0.00 5.85 -0.71 -0.80 115.31 120.14 1rwf h LEU 136 Ca -0.10 -0.31 -0.04 0.00 0.84 0.00 0.00 57.88 58.27 1rwf h LEU 136 Cb 1.51 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.29 1rwf h LEU 136 CO 0.16 1.04 0.19 0.00 -0.34 0.00 0.00 178.44 179.49 1rwf h ALA 137 N 1.02 0.69 -0.46 1.25 0.00 -0.97 -0.21 119.26 120.58 1rwf h ALA 137 Ca 0.10 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1rwf h ALA 137 Cb 0.75 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1rwf h ALA 137 CO 0.06 0.32 0.27 -0.44 0.00 0.00 0.00 179.25 179.47 1rwf h ASP 138 N 0.72 0.45 -0.73 0.00 3.32 -1.20 -1.53 116.42 117.44 1rwf h ASP 138 Ca 0.17 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.18 1rwf h ASP 138 Cb 0.23 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 1rwf h ASP 138 CO -0.01 0.32 0.27 0.00 -1.72 0.00 0.00 179.24 178.10 1rwf h ALA 139 N 1.20 1.07 -0.45 3.45 0.00 -0.83 0.56 119.26 124.27 1rwf h ALA 139 Ca 0.18 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1rwf h ALA 139 Cb 0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1rwf h ALA 139 CO -0.08 0.64 0.25 0.52 0.00 0.00 0.00 179.25 180.59 1rwf h MET 140 N 1.09 0.63 -0.23 0.00 2.86 -0.67 -0.55 114.93 118.06 1rwf h MET 140 Ca 0.25 -0.07 -0.04 0.00 -2.06 0.00 0.00 59.70 57.78 1rwf h MET 140 Cb 0.24 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 1rwf h MET 140 CO -0.02 0.49 -0.00 0.28 1.06 0.00 0.00 176.91 178.72 1rwf h VAL 141 N 0.60 1.26 -0.78 -2.22 2.07 -0.89 -1.10 116.25 115.18 1rwf h VAL 141 Ca 0.16 -0.89 0.08 0.00 0.82 0.00 0.00 66.70 66.87 1rwf h VAL 141 Cb 0.04 1.39 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 1rwf h VAL 141 CO -0.03 0.28 0.51 -0.07 0.02 0.00 0.00 177.57 178.28 1rwf h LEU 142 N 0.17 0.69 -3.53 2.57 3.38 -0.73 -2.67 115.31 115.19 1rwf h LEU 142 Ca 0.06 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1rwf h LEU 142 Cb 0.41 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1rwf h LEU 142 CO 0.01 0.43 0.03 0.18 0.09 0.00 0.00 178.44 179.18 1rwf n LEU 143 N -4.49 5.42 -0.28 1.67 4.77 -0.23 -4.71 117.00 119.15 1rwf n LEU 143 Ca 0.12 -3.00 0.07 0.00 -0.03 0.00 0.00 56.01 53.17 1rwf n LEU 143 Cb 0.27 -0.67 0.29 0.00 -2.33 0.00 0.00 43.42 40.99 1rwf n LEU 143 CO 0.33 0.67 1.23 -0.74 -1.33 0.00 0.00 177.39 177.55 1rwf h HIS 144 N 3.39 0.95 0.00 -1.77 2.76 -0.84 0.06 115.15 119.70 1rwf h HIS 144 Ca 0.03 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 1rwf h HIS 144 Cb 1.92 -0.31 0.00 0.00 1.55 0.00 0.00 27.41 30.57 1rwf h HIS 144 CO 1.00 0.45 0.00 0.00 -1.30 0.00 0.00 177.93 178.09 1rwf n ALA 145 N -2.41 1.93 -0.03 5.26 0.00 -1.26 -3.86 120.51 120.14 1rwf n ALA 145 Ca 0.14 -0.07 -0.03 0.00 0.00 0.00 0.00 53.44 53.48 1rwf n ALA 145 Cb 0.28 -1.32 -0.04 0.00 0.00 0.00 0.00 19.45 18.37 1rwf n ALA 145 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1rwf n GLU 146 N -1.45 2.86 -2.57 0.00 -0.58 -0.10 -5.02 120.64 113.77 1rwf n GLU 146 Ca 0.06 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.44 1rwf n GLU 146 Cb 0.21 -1.13 -0.04 0.00 -0.57 0.00 0.00 31.44 29.91 1rwf n GLU 146 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1rwf s LEU 147 N -4.48 4.09 0.77 -4.62 1.43 -0.57 -5.07 118.68 110.24 1rwf s LEU 147 Ca -0.03 1.99 -0.11 0.00 -1.03 0.00 0.00 54.13 54.95 1rwf s LEU 147 Cb 0.02 -4.25 0.07 0.00 0.03 0.00 0.00 46.19 42.05 1rwf s LEU 147 CO 0.20 -0.50 1.13 -0.94 0.23 0.00 0.00 176.35 176.46 1rwf s SER 148 N -1.66 4.72 0.25 2.29 1.04 -1.26 -4.93 113.70 114.14 1rwf s SER 148 Ca 0.59 0.76 -0.05 0.00 0.48 0.00 0.00 55.95 57.73 1rwf s SER 148 Cb -0.20 -1.34 0.27 0.00 0.10 0.00 0.00 66.02 64.85 1rwf s SER 148 CO 0.25 -1.75 1.85 0.00 0.98 0.00 0.00 173.24 174.57 1rwf h ALA 149 N -0.89 1.18 -0.51 5.32 0.00 -1.97 -1.69 119.26 120.69 1rwf h ALA 149 Ca -0.46 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.22 1rwf h ALA 149 Cb 1.32 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1rwf h ALA 149 CO 0.65 0.63 -0.03 0.00 0.00 0.00 0.00 179.25 180.49 1rwf h ALA 150 N 1.29 0.98 -0.35 0.00 0.00 -1.99 -0.45 119.26 118.75 1rwf h ALA 150 Ca 0.28 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1rwf h ALA 150 Cb 0.10 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1rwf h ALA 150 CO -0.04 0.62 0.14 0.93 0.00 0.00 0.00 179.25 180.90 1rwf h GLU 151 N 0.82 0.52 -0.70 0.00 5.08 -1.85 -1.66 114.58 116.79 1rwf h GLU 151 Ca 0.15 -0.10 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 1rwf h GLU 151 Cb 0.53 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.64 1rwf h GLU 151 CO 0.03 0.52 0.42 0.00 -1.00 0.00 0.00 179.01 178.98 1rwf h ARG 152 N 0.41 0.77 -0.58 2.33 3.08 -1.04 -1.23 114.38 118.12 1rwf h ARG 152 Ca 0.12 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 1rwf h ARG 152 Cb 0.19 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 1rwf h ARG 152 CO -0.01 0.51 0.32 1.15 -1.07 0.00 0.00 179.97 180.88 1rwf h THR 153 N 0.80 1.19 -0.44 2.04 2.02 -0.75 0.11 112.91 117.87 1rwf h THR 153 Ca 0.30 -0.47 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 1rwf h THR 153 Cb 0.11 0.44 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 1rwf h THR 153 CO -0.15 0.20 0.19 0.00 0.37 0.00 0.00 175.52 176.14 1rwf h ALA 154 N 1.15 0.57 0.04 6.16 0.00 -0.88 -1.16 119.26 125.14 1rwf h ALA 154 Ca 0.21 -0.13 -0.27 0.00 0.00 0.00 0.00 54.91 54.71 1rwf h ALA 154 Cb 0.04 -0.17 0.02 0.00 0.00 0.00 0.00 17.79 17.68 1rwf h ALA 154 CO -0.03 0.16 -1.10 1.88 0.00 0.00 0.00 179.25 180.15 1rwf h TYR 155 N 0.57 0.97 -0.92 0.00 0.05 -0.98 -1.73 116.97 114.94 1rwf h TYR 155 Ca 0.15 -0.56 0.05 0.00 0.05 0.00 0.00 58.73 58.42 1rwf h TYR 155 Cb 0.16 -0.10 -0.06 0.00 1.01 0.00 0.00 36.73 37.75 1rwf h TYR 155 CO -0.00 1.40 0.60 0.00 -1.05 0.00 0.00 178.16 179.10 1rwf h ALA 157 N 1.48 0.91 0.06 0.00 0.00 -0.96 -0.81 119.26 119.94 1rwf h ALA 157 Ca 0.38 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1rwf h ALA 157 Cb 0.09 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1rwf h ALA 157 CO -0.13 0.62 -0.03 0.00 0.00 0.00 0.00 179.25 179.72 1rwf h ALA 158 N 1.11 -0.08 -0.31 0.00 0.00 -0.99 -1.18 119.26 117.81 1rwf h ALA 158 Ca 0.10 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1rwf h ALA 158 Cb 0.70 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 1rwf h ALA 158 CO 0.05 -0.47 0.11 0.82 0.00 0.00 0.00 179.25 179.77 1rwf h ILE 159 N -0.23 0.92 0.00 0.00 2.04 -1.15 -2.36 117.51 116.72 1rwf h ILE 159 Ca -0.01 -0.09 -0.05 0.00 1.00 0.00 0.00 64.86 65.71 1rwf h ILE 159 Cb 0.20 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 1rwf h ILE 159 CO 0.01 0.05 -0.25 0.44 0.00 0.00 0.00 178.15 178.40 1rwf h ASP 160 N 0.25 0.00 -0.47 1.72 3.32 -1.08 0.47 116.42 120.63 1rwf h ASP 160 Ca 0.14 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 1rwf h ASP 160 Cb 0.11 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 1rwf h ASP 160 CO -0.14 0.25 0.23 -0.74 -1.72 0.00 0.00 179.24 177.12 1rwf h HIS 161 N 0.00 0.66 0.03 4.55 -0.00 -0.70 -2.37 115.15 117.32 1rwf h HIS 161 Ca -0.00 -0.03 -0.23 0.00 -0.00 0.00 0.00 60.37 60.11 1rwf h HIS 161 Cb 0.48 -0.21 -0.03 0.00 -0.00 0.00 0.00 27.41 27.65 1rwf h HIS 161 CO 0.00 0.52 -1.14 0.74 -0.00 0.00 0.00 177.93 178.06 1rwf h PHE 162 N 0.61 0.10 -2.37 5.26 -1.00 -1.09 -3.39 116.94 115.06 1rwf h PHE 162 Ca 0.16 -0.07 -0.59 0.00 2.81 0.00 0.00 57.97 60.28 1rwf h PHE 162 Cb 0.10 -0.00 -0.40 0.00 3.61 0.00 0.00 35.95 39.25 1rwf h PHE 162 CO -0.01 1.06 -0.84 0.28 -1.61 0.00 0.00 178.31 177.19 1rwf n VAL 163 N -3.35 0.40 0.25 -0.55 0.31 0.11 -4.84 118.33 110.66 1rwf n VAL 163 Ca -0.04 -4.33 0.14 0.00 -0.01 0.00 0.00 64.34 60.10 1rwf n VAL 163 Cb 0.97 -1.96 0.57 0.00 -0.91 0.00 0.00 33.84 32.51 1rwf n VAL 163 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1rwf h PRO 164 N 4.76 0.00 -2.01 5.55 0.13 -1.64 -3.41 132.00 135.38 1rwf h PRO 164 Ca 0.17 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.11 1rwf h PRO 164 Cb 0.81 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.63 1rwf h PRO 164 CO 0.58 0.09 -0.52 0.34 -0.23 0.00 0.00 178.00 178.26 1rwf s ASP 165 N -5.93 0.55 0.00 1.44 -1.08 -1.26 -5.04 116.67 105.35 1rwf s ASP 165 Ca 0.01 0.04 0.16 0.00 -0.52 0.00 0.00 52.55 52.24 1rwf s ASP 165 Cb 0.09 0.94 0.84 0.00 -1.46 0.00 0.00 42.92 43.34 1rwf s ASP 165 CO 0.59 -0.31 1.42 -0.81 0.52 0.00 0.00 175.17 176.57 1rwf n PRO 166 N 5.35 0.31 0.00 4.34 -0.04 -1.26 -1.38 135.00 142.32 1rwf n PRO 166 Ca -0.04 0.09 0.12 0.00 -0.04 0.00 0.00 63.50 63.64 1rwf n PRO 166 Cb 0.50 -1.50 0.59 0.00 -0.04 0.00 0.00 33.50 33.05 1rwf n PRO 166 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1rwf n TRP 167 N -1.19 0.00 -4.43 0.54 7.02 -1.26 -4.58 117.44 113.54 1rwf n TRP 167 Ca 0.09 0.00 -0.21 0.00 -1.02 0.00 0.00 57.50 56.36 1rwf n TRP 167 Cb 0.10 -0.38 -0.10 0.00 -2.42 0.00 0.00 31.31 28.51 1rwf n TRP 167 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1rwf s LEU 168 N -2.76 2.46 0.12 -0.99 1.43 -0.48 -1.08 118.68 117.39 1rwf s LEU 168 Ca 0.19 -1.21 -0.09 0.00 -1.03 0.00 0.00 54.13 51.99 1rwf s LEU 168 Cb 0.17 -0.61 -0.00 0.00 0.03 0.00 0.00 46.19 45.77 1rwf s LEU 168 CO 0.41 -0.37 0.24 0.00 0.23 0.00 0.00 176.35 176.87 1rwf s GLN 169 N -3.74 0.99 0.00 1.70 -2.07 -0.31 -4.66 119.66 111.58 1rwf s GLN 169 Ca 0.30 -1.04 0.00 0.00 -1.82 0.00 0.00 55.36 52.80 1rwf s GLN 169 Cb 0.04 0.36 0.00 0.00 -1.09 0.00 0.00 33.01 32.33 1rwf s GLN 169 CO 0.12 -0.34 0.00 1.19 -1.32 0.00 0.00 175.29 174.94 1rwf n PHE 170 N -0.14 0.00 -1.82 9.60 0.99 -1.26 -1.69 117.46 123.14 1rwf n PHE 170 Ca -0.12 0.00 -0.32 0.00 -0.00 0.00 0.00 57.45 57.01 1rwf n PHE 170 Cb 0.63 -0.12 0.03 0.00 -1.00 0.00 0.00 39.48 39.03 1rwf n PHE 170 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 1rwf s PRO 171 N -4.14 3.01 0.38 -1.08 0.04 -1.26 -4.71 135.00 127.23 1rwf s PRO 171 Ca 0.00 1.23 0.12 0.00 0.04 0.00 0.00 61.00 62.38 1rwf s PRO 171 Cb 0.00 -1.99 0.90 0.00 0.04 0.00 0.00 34.50 33.45 1rwf s PRO 171 CO 0.00 -1.06 1.87 -1.35 0.04 0.00 0.00 177.00 176.49 1rwf h PRO 172 N 0.01 0.58 -0.00 0.56 0.11 -1.96 -1.42 132.00 129.88 1rwf h PRO 172 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1rwf h PRO 172 Cb 1.23 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1rwf h PRO 172 CO 0.56 0.38 0.01 -0.22 -0.21 0.00 0.00 178.00 178.52 1rwf h LYS 173 N 0.60 0.00 0.00 1.05 3.64 -2.02 -2.35 116.57 117.49 1rwf h LYS 173 Ca 0.45 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.66 1rwf h LYS 173 Cb 0.85 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.64 1rwf h LYS 173 CO -0.20 0.00 -1.53 -2.13 -2.27 0.00 0.00 179.45 173.32 1rwf n ARG 174 N -3.27 0.63 -0.11 1.90 0.63 -0.54 -5.07 116.66 110.82 1rwf n ARG 174 Ca -0.03 0.17 0.00 0.00 -0.92 0.00 0.00 57.85 57.07 1rwf n ARG 174 Cb 0.08 -1.76 0.00 0.00 0.45 0.00 0.00 32.46 31.23 1rwf n ARG 174 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1rwf n GLY 175 N 1.41 -0.23 3.80 5.14 0.00 -0.89 -5.04 105.19 109.39 1rwf n GLY 175 Ca -0.11 -1.12 -0.39 0.00 0.00 0.00 0.00 46.02 44.40 1rwf n GLY 175 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rwf s LYS 176 N -3.55 4.23 0.36 1.61 1.02 -1.26 -4.83 119.74 117.31 1rwf s LYS 176 Ca 0.00 0.74 0.09 0.00 0.02 0.00 0.00 55.97 56.81 1rwf s LYS 176 Cb 0.00 -3.26 -0.06 0.00 -0.52 0.00 0.00 37.83 33.99 1rwf s LYS 176 CO 0.00 0.58 -0.02 0.96 -0.92 0.00 0.00 175.35 175.95 1rwf s ILE 177 N -0.91 2.35 0.21 2.17 -4.36 -0.68 -4.91 121.20 115.07 1rwf s ILE 177 Ca 0.29 -2.05 -0.32 0.00 -0.26 0.00 0.00 60.65 58.31 1rwf s ILE 177 Cb -0.19 -2.78 -0.12 0.00 1.25 0.00 0.00 42.46 40.62 1rwf s ILE 177 CO 0.19 -0.15 1.69 -0.89 0.24 0.00 0.00 174.94 176.01 1rwf s THR 178 N -2.59 2.11 0.25 8.37 2.01 -1.26 -1.16 115.64 123.37 1rwf s THR 178 Ca 0.34 0.08 -0.26 0.00 0.31 0.00 0.00 61.69 62.16 1rwf s THR 178 Cb 0.03 -3.05 -0.09 0.00 0.01 0.00 0.00 72.50 69.40 1rwf s THR 178 CO 0.18 0.01 0.87 -0.94 -0.69 0.00 0.00 174.62 174.05 1rwf s SER 179 N 1.10 7.39 0.12 3.53 1.04 -0.24 -4.79 113.70 121.84 1rwf s SER 179 Ca 0.73 1.76 0.05 0.00 0.48 0.00 0.00 55.95 58.97 1rwf s SER 179 Cb -0.49 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 63.05 1rwf s SER 179 CO 0.34 0.06 -0.11 0.68 0.98 0.00 0.00 173.24 175.19 1rwf s VAL 180 N -1.39 1.12 0.00 5.02 -7.23 -1.26 -4.51 120.40 112.15 1rwf s VAL 180 Ca 0.44 -1.76 0.00 0.00 -1.81 0.00 0.00 61.98 58.84 1rwf s VAL 180 Cb -0.21 -1.53 0.00 0.00 0.56 0.00 0.00 36.38 35.20 1rwf s VAL 180 CO 0.26 -0.56 0.00 0.61 -0.31 0.00 0.00 175.10 175.10 1rwf n GLY 181 N 0.37 3.24 0.36 2.32 0.00 -1.26 -1.67 105.19 108.54 1rwf n GLY 181 Ca -0.14 -0.20 0.08 0.00 0.00 0.00 0.00 46.02 45.76 1rwf n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwf h ALA 182 N -0.90 1.76 -0.43 4.61 0.00 -1.95 -2.38 119.26 119.97 1rwf h ALA 182 Ca 0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1rwf h ALA 182 Cb 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1rwf h ALA 182 CO 0.00 0.10 -0.03 -0.91 0.00 0.00 0.00 179.25 178.40 1rwf h ASN 183 N 0.71 0.77 -0.53 0.00 2.35 -1.71 -0.84 115.58 116.33 1rwf h ASN 183 Ca 0.33 -0.33 0.03 0.00 -0.55 0.00 0.00 56.30 55.79 1rwf h ASN 183 Cb 0.38 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.50 1rwf h ASN 183 CO -0.12 0.91 0.30 -0.09 -1.65 0.00 0.00 177.43 176.79 1rwf h ARG 184 N 0.61 0.58 -0.11 0.81 9.65 -1.18 -0.79 114.38 123.96 1rwf h ARG 184 Ca 0.12 -0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.96 1rwf h ARG 184 Cb 0.54 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.98 1rwf h ARG 184 CO 0.03 0.38 0.07 0.28 2.80 0.00 0.00 179.97 183.53 1rwf h VAL 185 N 0.60 1.06 -0.42 0.20 2.07 -1.25 -1.11 116.25 117.40 1rwf h VAL 185 Ca 0.22 -0.15 -0.07 0.00 0.82 0.00 0.00 66.70 67.52 1rwf h VAL 185 Cb 0.06 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1rwf h VAL 185 CO -0.12 0.05 -0.03 0.44 0.02 0.00 0.00 177.57 177.94 1rwf h ASP 186 N 0.12 0.67 -0.29 0.57 3.32 -0.94 0.50 116.42 120.36 1rwf h ASP 186 Ca 0.04 -0.16 -0.10 0.00 0.02 0.00 0.00 57.03 56.83 1rwf h ASP 186 Cb 0.03 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 1rwf h ASP 186 CO -0.01 0.76 -0.20 -0.07 -1.72 0.00 0.00 179.24 178.00 1rwf h LEU 187 N 0.65 0.68 -0.98 1.55 3.38 -0.99 -2.21 115.31 117.39 1rwf h LEU 187 Ca 0.13 -0.44 -0.05 0.00 0.09 0.00 0.00 57.88 57.61 1rwf h LEU 187 Cb 0.45 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 1rwf h LEU 187 CO 0.02 0.97 0.18 0.00 0.09 0.00 0.00 178.44 179.70 1rwf h GLN 189 N 0.89 -0.10 -0.81 0.00 4.15 -0.75 0.55 115.11 119.04 1rwf h GLN 189 Ca 0.20 0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.65 1rwf h GLN 189 Cb 0.27 0.02 -0.05 0.00 0.21 0.00 0.00 27.48 27.94 1rwf h GLN 189 CO -0.01 -0.05 0.52 0.78 -1.93 0.00 0.00 178.83 178.14 1rwf h GLY 190 N -0.13 1.16 1.33 2.39 0.00 -1.21 -1.47 103.07 105.15 1rwf h GLY 190 Ca -0.01 -0.40 -0.14 0.00 0.00 0.00 0.00 47.33 46.78 1rwf h GLY 190 CO 0.02 0.36 -0.34 -2.22 0.00 0.00 0.00 176.54 174.35 1rwf h ILE 191 N 1.03 1.28 -0.20 2.60 1.08 -1.11 -1.52 117.51 120.67 1rwf h ILE 191 Ca 0.31 -1.50 -0.00 0.00 -0.39 0.00 0.00 64.86 63.28 1rwf h ILE 191 Cb -0.03 1.40 -0.01 0.00 -3.07 0.00 0.00 36.82 35.10 1rwf h ILE 191 CO -0.10 0.49 0.12 0.40 -0.69 0.00 0.00 178.15 178.38 1rwf h ILE 192 N 0.62 1.08 -0.32 -0.67 2.04 -0.50 0.14 117.51 119.89 1rwf h ILE 192 Ca 0.06 -0.18 -0.15 0.00 1.00 0.00 0.00 64.86 65.59 1rwf h ILE 192 Cb 0.88 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 1rwf h ILE 192 CO 0.08 0.07 -0.41 0.40 0.00 0.00 0.00 178.15 178.29 1rwf h ILE 193 N 0.25 1.28 -0.20 -0.67 1.08 -1.26 -1.82 117.51 116.18 1rwf h ILE 193 Ca 0.07 -1.59 0.00 0.00 -0.39 0.00 0.00 64.86 62.95 1rwf h ILE 193 Cb 0.01 1.48 -0.01 0.00 -3.07 0.00 0.00 36.82 35.23 1rwf h ILE 193 CO -0.01 0.52 0.13 -0.09 -0.69 0.00 0.00 178.15 178.00 1rwf h ARG 194 N 0.64 0.26 0.00 2.37 1.12 -1.11 -1.93 114.38 115.73 1rwf h ARG 194 Ca 0.05 -0.02 -0.08 0.00 -1.11 0.00 0.00 59.98 58.82 1rwf h ARG 194 Cb 0.98 -0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 30.87 1rwf h ARG 194 CO 0.09 0.18 -0.39 0.77 -3.11 0.00 0.00 179.97 177.51 1rwf h SER 195 N 0.27 0.00 -0.25 -3.80 0.02 0.06 -1.66 113.55 108.18 1rwf h SER 195 Ca 0.07 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.88 1rwf h SER 195 Cb -0.02 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.52 1rwf h SER 195 CO -0.01 0.39 -0.39 -0.07 -1.14 0.00 0.00 176.83 175.60 1rwf h LEU 196 N 0.00 0.78 -0.48 5.07 3.38 -0.61 0.44 115.31 123.88 1rwf h LEU 196 Ca -0.00 -0.52 -0.04 0.00 0.09 0.00 0.00 57.88 57.41 1rwf h LEU 196 Cb 1.04 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 1rwf h LEU 196 CO 0.05 1.15 0.16 0.00 0.09 0.00 0.00 178.44 179.89 1rwf h ALA 197 N 0.65 0.63 -0.02 1.53 0.00 -1.21 -3.19 119.26 117.65 1rwf h ALA 197 Ca 0.02 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1rwf h ALA 197 Cb 0.99 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1rwf h ALA 197 CO 0.09 0.27 -0.07 0.41 0.00 0.00 0.00 179.25 179.96 1rwf n GLY 198 N -0.71 0.12 3.44 0.00 0.00 -0.65 -4.99 105.19 102.39 1rwf n GLY 198 Ca 0.01 -0.50 -0.22 0.00 0.00 0.00 0.00 46.02 45.32 1rwf n GLY 198 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rwf n GLU 199 N 0.28 -1.73 -3.95 1.61 1.02 0.03 -4.98 120.64 112.91 1rwf n GLU 199 Ca 0.16 0.72 -0.30 0.00 -0.02 0.00 0.00 57.16 57.73 1rwf n GLU 199 Cb 0.41 -5.03 -0.14 0.00 -0.02 0.00 0.00 31.44 26.67 1rwf n GLU 199 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1rwf s ASP 200 N -3.39 4.32 0.42 1.62 -1.08 -0.50 -4.96 116.67 113.09 1rwf s ASP 200 Ca 0.43 -2.97 0.13 0.00 -0.52 0.00 0.00 52.55 49.62 1rwf s ASP 200 Cb -0.10 -1.63 0.91 0.00 -1.46 0.00 0.00 42.92 40.64 1rwf s ASP 200 CO 0.80 -0.24 1.95 1.55 0.52 0.00 0.00 175.17 179.75 1rwf h PRO 201 N 6.55 0.05 0.06 4.34 0.13 -1.92 -1.97 132.00 139.24 1rwf h PRO 201 Ca -0.08 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1rwf h PRO 201 Cb 0.90 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1rwf h PRO 201 CO 0.68 0.25 -0.03 1.15 -0.23 0.00 0.00 178.00 179.82 1rwf h THR 202 N 0.05 1.09 -0.73 1.56 2.02 -1.99 0.20 112.91 115.11 1rwf h THR 202 Ca 0.01 -0.51 -0.05 0.00 0.77 0.00 0.00 66.41 66.62 1rwf h THR 202 Cb 0.39 1.43 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 1rwf h THR 202 CO 0.03 0.13 0.24 0.11 0.37 0.00 0.00 175.52 176.40 1rwf h LYS 203 N -0.31 1.12 0.06 6.66 1.57 -1.96 -2.30 116.57 121.41 1rwf h LYS 203 Ca -0.01 -0.23 -0.00 0.00 -1.87 0.00 0.00 60.65 58.54 1rwf h LYS 203 Cb 0.27 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1rwf h LYS 203 CO 0.01 0.95 -0.03 1.25 -0.57 0.00 0.00 179.45 181.07 1rwf h LEU 204 N 1.07 -0.07 -0.76 2.94 6.46 -1.25 -1.61 115.31 122.09 1rwf h LEU 204 Ca 0.24 -0.01 0.05 0.00 -0.12 0.00 0.00 57.88 58.04 1rwf h LEU 204 Cb 0.28 0.02 -0.06 0.00 -0.73 0.00 0.00 40.66 40.18 1rwf h LEU 204 CO -0.01 -0.04 0.46 0.78 -0.62 0.00 0.00 178.44 179.01 1rwf h ASN 205 N -0.09 0.72 -0.53 1.25 2.35 -0.88 -1.05 115.58 117.36 1rwf h ASN 205 Ca -0.01 0.02 -0.07 0.00 -0.55 0.00 0.00 56.30 55.69 1rwf h ASN 205 Cb 0.07 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 1rwf h ASN 205 CO 0.01 0.47 0.06 -0.74 -1.65 0.00 0.00 177.43 175.59 1rwf h HIS 206 N 0.86 0.96 -0.73 1.19 2.76 -1.26 -1.76 115.15 117.17 1rwf h HIS 206 Ca 0.33 -0.14 -0.03 0.00 -2.20 0.00 0.00 60.37 58.32 1rwf h HIS 206 Cb 0.14 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 28.80 1rwf h HIS 206 CO -0.05 0.87 0.33 0.00 -1.30 0.00 0.00 177.93 177.78 1rwf h ALA 207 N 0.97 0.94 -0.65 5.26 0.00 -0.84 -1.67 119.26 123.27 1rwf h ALA 207 Ca 0.16 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rwf h ALA 207 Cb 0.44 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1rwf h ALA 207 CO 0.02 0.52 0.42 0.28 0.00 0.00 0.00 179.25 180.49 1rwf h VAL 208 N 1.02 1.17 -0.11 0.00 2.07 -1.04 -2.22 116.25 117.14 1rwf h VAL 208 Ca 0.25 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 1rwf h VAL 208 Cb 0.15 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 1rwf h VAL 208 CO -0.03 0.17 -0.08 0.00 0.02 0.00 0.00 177.57 177.65 1rwf h ALA 209 N 1.23 1.66 0.00 1.67 0.00 -1.05 -1.82 119.26 120.95 1rwf h ALA 209 Ca 0.24 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1rwf h ALA 209 Cb -0.08 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1rwf h ALA 209 CO -0.05 0.26 -0.09 0.78 0.00 0.00 0.00 179.25 180.14 1rwf h GLY 210 N 0.55 0.00 2.00 0.00 0.00 -0.66 -2.59 103.07 102.37 1rwf h GLY 210 Ca 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.35 1rwf h GLY 210 CO 0.01 0.00 -0.09 1.41 0.00 0.00 0.00 176.54 177.87 1rwf h LEU 211 N 0.00 0.00 -1.60 3.11 3.38 -1.25 -3.27 115.31 115.67 1rwf h LEU 211 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1rwf h LEU 211 Cb 0.31 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1rwf h LEU 211 CO 0.01 0.09 0.13 0.28 0.09 0.00 0.00 178.44 179.04 1rwf h SER 212 N 0.00 0.35 0.20 -0.43 0.02 -1.61 -2.11 113.55 109.96 1rwf h SER 212 Ca -0.00 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1rwf h SER 212 Cb 0.16 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.61 1rwf h SER 212 CO 0.01 0.31 -0.11 -0.61 -1.14 0.00 0.00 176.83 175.29 1rwf h GLN 213 N 0.40 0.00 0.00 3.45 5.75 -1.78 -3.18 115.11 119.74 1rwf h GLN 213 Ca 0.10 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.60 1rwf h GLN 213 Cb 0.06 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.61 1rwf h GLN 213 CO -0.01 0.11 0.00 -0.39 -2.65 0.00 0.00 178.83 175.88 1rwf h VAL 214 N 0.00 0.00 -0.27 2.39 -1.51 -1.61 -2.78 116.25 112.48 1rwf h VAL 214 Ca -0.00 -0.71 0.00 0.00 -1.23 0.00 0.00 66.70 64.76 1rwf h VAL 214 Cb 0.23 1.70 0.00 0.00 -2.13 0.00 0.00 31.29 31.09 1rwf h VAL 214 CO 0.01 0.00 0.00 -2.67 -1.23 0.00 0.00 177.57 173.68 1rwf n TRP 215 N -2.99 0.84 -2.71 5.19 2.14 -1.20 -4.60 117.44 114.12 1rwf n TRP 215 Ca 0.03 -0.81 -0.40 0.00 2.07 0.00 0.00 57.50 58.38 1rwf n TRP 215 Cb 0.41 -0.26 -0.06 0.00 -0.81 0.00 0.00 31.31 30.59 1rwf n TRP 215 CO 0.00 0.00 0.00 -0.65 2.07 0.00 0.00 177.69 179.11 1rwf s GLN 216 N -2.51 4.82 0.39 -2.67 -1.52 -1.05 -4.57 119.66 112.55 1rwf s GLN 216 Ca 0.39 1.54 -0.27 0.00 -1.95 0.00 0.00 55.36 55.06 1rwf s GLN 216 Cb 0.30 -3.27 -0.10 0.00 -0.22 0.00 0.00 33.01 29.72 1rwf s GLN 216 CO 0.10 0.46 1.40 0.71 -0.25 0.00 0.00 175.29 177.71 1rwf s TYR 217 N -1.12 2.69 0.27 0.91 4.12 -1.26 -4.48 117.35 118.48 1rwf s TYR 217 Ca 0.42 1.28 0.12 0.00 0.02 0.00 0.00 57.07 58.91 1rwf s TYR 217 Cb -0.27 -3.87 -0.05 0.00 -1.52 0.00 0.00 41.96 36.25 1rwf s TYR 217 CO 0.33 -2.59 -0.20 0.14 0.02 0.00 0.00 175.55 173.25 1rwf s VAL 218 N -1.17 2.40 -0.79 0.71 -7.23 -0.24 -5.01 120.40 109.08 1rwf s VAL 218 Ca 0.55 -2.38 0.07 0.00 -1.81 0.00 0.00 61.98 58.41 1rwf s VAL 218 Cb -0.43 -2.27 0.04 0.00 0.56 0.00 0.00 36.38 34.28 1rwf s VAL 218 CO 0.57 -0.41 0.65 0.35 -0.31 0.00 0.00 175.10 175.95 1rwf n THR 219 N -0.56 0.00 -3.85 5.32 -2.24 -1.26 -4.34 114.28 107.35 1rwf n THR 219 Ca -0.06 -0.48 -0.07 0.00 -2.27 0.00 0.00 64.05 61.17 1rwf n THR 219 Cb 0.60 1.12 -0.01 0.00 -2.10 0.00 0.00 70.33 69.94 1rwf n THR 219 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1rwf s SER 220 N -0.75 -0.19 0.36 3.42 1.04 -1.26 -5.14 113.70 111.18 1rwf s SER 220 Ca 0.07 -0.75 0.00 0.00 0.48 0.00 0.00 55.95 55.75 1rwf s SER 220 Cb 0.06 0.76 0.00 0.00 0.10 0.00 0.00 66.02 66.94 1rwf s SER 220 CO 0.12 -1.44 0.00 0.61 0.98 0.00 0.00 173.24 173.50 1rwf n GLY 221 N -0.48 -0.20 3.85 7.32 0.00 -1.26 -4.81 105.19 109.61 1rwf n GLY 221 Ca -0.05 -1.02 -0.37 0.00 0.00 0.00 0.00 46.02 44.57 1rwf n GLY 221 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1rwf s ASP 222 N -4.00 6.58 0.00 1.61 1.01 -1.26 -4.75 116.67 115.86 1rwf s ASP 222 Ca 0.00 0.70 0.00 0.00 0.71 0.00 0.00 52.55 53.96 1rwf s ASP 222 Cb 0.00 -2.16 0.00 0.00 1.01 0.00 0.00 42.92 41.77 1rwf s ASP 222 CO 0.00 0.35 0.00 0.61 0.21 0.00 0.00 175.17 176.34 1rwf n GLY 223 N 2.02 0.97 3.71 0.21 0.00 -0.24 -4.88 105.19 106.98 1rwf n GLY 223 Ca -0.17 -1.91 -0.39 0.00 0.00 0.00 0.00 46.02 43.55 1rwf n GLY 223 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rwf s ILE 224 N -2.35 5.09 0.31 -0.61 1.01 -1.26 -1.87 121.20 121.52 1rwf s ILE 224 Ca 0.00 1.24 0.02 0.00 0.00 0.00 0.00 60.65 61.91 1rwf s ILE 224 Cb 0.00 -3.95 -0.03 0.00 0.01 0.00 0.00 42.46 38.49 1rwf s ILE 224 CO 0.00 0.25 0.48 -0.36 0.00 0.00 0.00 174.94 175.31 1rwf s PHE 225 N 0.95 3.47 0.43 3.97 0.40 -0.27 -1.08 117.98 125.84 1rwf s PHE 225 Ca 0.32 0.19 0.33 0.00 -0.60 0.00 0.00 56.93 57.17 1rwf s PHE 225 Cb -0.16 -1.78 1.69 0.00 0.51 0.00 0.00 43.02 43.28 1rwf s PHE 225 CO 0.14 0.24 2.14 0.00 0.70 0.00 0.00 175.22 178.44 1rwf h ARG 226 N 0.91 0.00 -0.02 0.44 3.08 -1.89 -0.06 114.38 116.84 1rwf h ARG 226 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.55 1rwf h ARG 226 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.27 1rwf h ARG 226 CO 0.61 0.06 0.00 -0.40 -1.07 0.00 0.00 179.97 179.17 1rwf n ASP 227 N -3.43 0.25 0.00 7.04 5.68 -1.26 -4.88 116.55 119.95 1rwf n ASP 227 Ca -0.02 -1.38 0.00 0.00 -0.50 0.00 0.00 54.79 52.89 1rwf n ASP 227 Cb 0.20 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.17 1rwf n ASP 227 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1rwf n GLY 228 N 0.88 1.04 3.69 6.12 0.00 -0.03 -4.82 105.19 112.07 1rwf n GLY 228 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 1rwf n GLY 228 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rwf n SER 229 N 0.00 1.39 -3.83 1.61 7.64 -1.26 -4.39 113.62 114.78 1rwf n SER 229 Ca 0.00 0.72 -0.22 0.00 1.01 0.00 0.00 58.87 60.38 1rwf n SER 229 Cb 0.00 -1.51 -0.17 0.00 -1.01 0.00 0.00 64.21 61.52 1rwf n SER 229 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1rwf s PHE 230 N -1.71 0.74 -0.05 1.43 5.36 -1.26 -1.12 117.98 121.37 1rwf s PHE 230 Ca 0.78 -0.22 0.06 0.00 -0.96 0.00 0.00 56.93 56.59 1rwf s PHE 230 Cb -0.35 -0.76 -0.01 0.00 -0.34 0.00 0.00 43.02 41.56 1rwf s PHE 230 CO 0.46 -0.27 -0.24 0.42 -1.46 0.00 0.00 175.22 174.13 1rwf s ILE 231 N 1.46 2.18 0.07 3.12 1.01 -0.78 -0.72 121.20 127.54 1rwf s ILE 231 Ca -0.03 -1.03 0.06 0.00 0.00 0.00 0.00 60.65 59.66 1rwf s ILE 231 Cb -0.13 -1.79 -0.03 0.00 0.01 0.00 0.00 42.46 40.52 1rwf s ILE 231 CO -0.03 0.57 -0.17 -1.58 0.00 0.00 0.00 174.94 173.73 1rwf s GLN 232 N -0.28 0.99 -1.22 2.79 2.00 -1.18 -1.08 119.66 121.68 1rwf s GLN 232 Ca 0.00 -0.97 0.00 0.00 -2.00 0.00 0.00 55.36 52.39 1rwf s GLN 232 Cb -0.13 -1.08 0.00 0.00 0.80 0.00 0.00 33.01 32.60 1rwf s GLN 232 CO 0.03 0.25 0.00 0.72 -0.50 0.00 0.00 175.29 175.79 1rwf n HIS 233 N 1.42 -0.55 0.00 1.67 8.25 -1.26 -3.70 115.22 121.05 1rwf n HIS 233 Ca -0.20 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.26 1rwf n HIS 233 Cb 0.54 -2.88 0.00 0.00 1.12 0.00 0.00 29.99 28.77 1rwf n HIS 233 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1rwf n SER 234 N -0.56 0.00 -0.06 0.41 7.64 -1.26 -4.27 113.62 115.52 1rwf n SER 234 Ca -0.16 0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.73 1rwf n SER 234 Cb 0.60 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.81 1rwf n SER 234 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1rwf n THR 235 N 0.00 0.45 -4.44 0.44 -2.24 -1.26 -4.69 114.28 102.54 1rwf n THR 235 Ca 0.00 -0.48 -0.29 0.00 -2.27 0.00 0.00 64.05 61.01 1rwf n THR 235 Cb 0.00 0.70 -0.17 0.00 -2.10 0.00 0.00 70.33 68.76 1rwf n THR 235 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1rwf s THR 236 N -0.52 1.57 0.10 4.28 2.01 -1.24 -0.97 115.64 120.86 1rwf s THR 236 Ca 0.02 -0.68 -0.33 0.00 0.31 0.00 0.00 61.69 61.02 1rwf s THR 236 Cb 0.02 -1.43 -0.12 0.00 0.01 0.00 0.00 72.50 70.98 1rwf s THR 236 CO 0.00 0.45 1.74 -2.65 -0.69 0.00 0.00 174.62 173.48 1rwf n PRO 237 N 4.24 2.43 -0.48 4.92 -0.02 -1.26 -3.13 135.00 141.70 1rwf n PRO 237 Ca -0.19 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1rwf n PRO 237 Cb 0.51 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.27 1rwf n PRO 237 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1rwf n TYR 238 N 4.92 0.00 -0.35 6.00 0.53 0.10 -4.15 117.16 124.22 1rwf n TYR 238 Ca 0.18 0.00 0.11 0.00 -1.02 0.00 0.00 57.90 57.18 1rwf n TYR 238 Cb 0.32 -0.01 0.30 0.00 -1.03 0.00 0.00 39.34 38.93 1rwf n TYR 238 CO 0.00 0.00 0.00 1.15 -1.02 0.00 0.00 176.86 176.99 1rwf h THR 239 N 6.57 0.79 0.00 -0.72 2.02 -1.55 -1.28 112.91 118.75 1rwf h THR 239 Ca 0.00 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.89 1rwf h THR 239 Cb 1.33 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 1rwf h THR 239 CO 0.00 0.15 0.00 1.23 0.37 0.00 0.00 175.52 177.27 1rwf h GLY 240 N 0.83 0.00 0.00 2.16 0.00 -1.21 -2.74 103.07 102.11 1rwf h GLY 240 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1rwf h GLY 240 CO -0.32 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.08 1rwf n SER 241 N -2.37 0.00 -0.22 0.19 3.41 -1.06 -4.57 113.62 109.00 1rwf n SER 241 Ca 0.05 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.69 1rwf n SER 241 Cb 0.42 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.66 1rwf n SER 241 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 1rwf h TYR 242 N 0.00 0.90 -0.77 7.33 -1.99 -1.78 -0.78 116.97 119.88 1rwf h TYR 242 Ca 0.00 0.02 -0.03 0.00 2.00 0.00 0.00 58.73 60.72 1rwf h TYR 242 Cb 0.00 -0.30 -0.04 0.00 2.00 0.00 0.00 36.73 38.39 1rwf h TYR 242 CO 0.00 0.52 0.35 0.78 -0.00 0.00 0.00 178.16 179.81 1rwf h GLY 243 N 0.93 1.19 1.47 3.88 0.00 -1.18 -2.00 103.07 107.37 1rwf h GLY 243 Ca 0.31 -0.60 -0.11 0.00 0.00 0.00 0.00 47.33 46.94 1rwf h GLY 243 CO -0.10 0.57 -0.26 -2.08 0.00 0.00 0.00 176.54 174.67 1rwf h VAL 244 N 1.10 1.27 -0.61 4.60 2.07 -0.93 -1.04 116.25 122.71 1rwf h VAL 244 Ca 0.26 -1.34 0.04 0.00 0.82 0.00 0.00 66.70 66.48 1rwf h VAL 244 Cb 0.14 1.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 1rwf h VAL 244 CO -0.03 0.43 0.36 0.58 0.02 0.00 0.00 177.57 178.93 1rwf h VAL 245 N 0.53 1.02 -0.16 2.57 2.07 -0.78 0.21 116.25 121.70 1rwf h VAL 245 Ca 0.07 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 1rwf h VAL 245 Cb 0.73 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1rwf h VAL 245 CO 0.06 0.13 0.07 0.25 0.02 0.00 0.00 177.57 178.09 1rwf h LEU 246 N 0.69 0.22 -0.36 2.57 6.46 -1.11 -1.45 115.31 122.33 1rwf h LEU 246 Ca 0.26 -0.14 -0.00 0.00 -0.12 0.00 0.00 57.88 57.88 1rwf h LEU 246 Cb 0.09 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 39.95 1rwf h LEU 246 CO -0.13 0.29 0.21 0.25 -0.62 0.00 0.00 178.44 178.44 1rwf h LEU 247 N 0.12 0.43 0.19 2.25 5.85 -0.83 -1.39 115.31 121.93 1rwf h LEU 247 Ca 0.05 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1rwf h LEU 247 Cb 0.14 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1rwf h LEU 247 CO -0.01 0.36 -0.09 0.74 -0.34 0.00 0.00 178.44 179.10 1rwf h THR 248 N 0.47 0.82 -0.64 1.05 2.02 -0.53 -1.50 112.91 114.60 1rwf h THR 248 Ca 0.13 -0.01 -0.08 0.00 0.77 0.00 0.00 66.41 67.22 1rwf h THR 248 Cb 0.01 0.82 -0.03 0.00 -1.74 0.00 0.00 68.15 67.21 1rwf h THR 248 CO -0.02 0.00 0.09 1.23 0.37 0.00 0.00 175.52 177.19 1rwf h GLY 249 N -0.26 1.15 1.15 2.16 0.00 -1.13 -2.02 103.07 104.12 1rwf h GLY 249 Ca -0.03 -0.76 -0.09 0.00 0.00 0.00 0.00 47.33 46.45 1rwf h GLY 249 CO 0.04 0.71 -0.00 1.41 0.00 0.00 0.00 176.54 178.70 1rwf h LEU 250 N 0.99 0.99 -0.70 3.11 3.38 -1.24 -1.20 115.31 120.65 1rwf h LEU 250 Ca 0.20 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.92 1rwf h LEU 250 Cb 0.45 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.88 1rwf h LEU 250 CO 0.01 1.05 0.43 0.77 0.09 0.00 0.00 178.44 180.79 1rwf h SER 251 N 0.93 0.70 -0.26 -0.43 4.64 -0.95 0.60 113.55 118.77 1rwf h SER 251 Ca 0.17 0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.35 1rwf h SER 251 Cb 0.55 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.49 1rwf h SER 251 CO 0.03 0.47 -0.41 0.11 -0.87 0.00 0.00 176.83 176.17 1rwf h LYS 252 N 0.83 0.74 -0.24 4.77 1.57 -1.13 -2.47 116.57 120.64 1rwf h LYS 252 Ca 0.29 -0.44 -0.13 0.00 -1.87 0.00 0.00 60.65 58.50 1rwf h LYS 252 Cb 0.05 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 1rwf h LYS 252 CO -0.12 1.07 -0.35 -0.07 -0.57 0.00 0.00 179.45 179.41 1rwf h LEU 253 N 0.47 0.73 -0.37 2.94 3.38 -1.06 -1.16 115.31 120.24 1rwf h LEU 253 Ca 0.02 -0.51 0.05 0.00 0.09 0.00 0.00 57.88 57.53 1rwf h LEU 253 Cb 1.00 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.50 1rwf h LEU 253 CO 0.09 1.09 0.10 -0.26 0.09 0.00 0.00 178.44 179.55 1rwf h PHE 254 N 0.38 0.17 -0.32 1.13 0.05 -0.94 -1.75 116.94 115.65 1rwf h PHE 254 Ca 0.03 0.02 -0.03 0.00 3.82 0.00 0.00 57.97 61.80 1rwf h PHE 254 Cb 0.93 -0.02 -0.01 0.00 2.00 0.00 0.00 35.95 38.85 1rwf h PHE 254 CO 0.08 0.05 0.07 1.03 -0.18 0.00 0.00 178.31 179.36 1rwf h SER 255 N 0.23 0.49 -0.39 2.17 0.87 -1.41 -1.83 113.55 113.67 1rwf h SER 255 Ca 0.17 -0.24 0.07 0.00 -1.23 0.00 0.00 61.79 60.57 1rwf h SER 255 Cb 0.18 -0.13 -0.06 0.00 -0.44 0.00 0.00 62.40 61.95 1rwf h SER 255 CO -0.21 0.60 0.02 0.25 -0.53 0.00 0.00 176.83 176.96 1rwf h LEU 256 N 0.35 -0.12 0.00 2.23 5.85 -1.02 -3.16 115.31 119.45 1rwf h LEU 256 Ca 0.10 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.90 1rwf h LEU 256 Cb 0.30 0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.48 1rwf h LEU 256 CO 0.00 -0.02 -0.76 0.18 -0.34 0.00 0.00 178.44 177.50 1rwf n LEU 257 N -5.17 0.63 -4.70 2.25 4.77 -0.67 -4.91 117.00 109.20 1rwf n LEU 257 Ca 0.03 0.08 -0.44 0.00 -0.03 0.00 0.00 56.01 55.64 1rwf n LEU 257 Cb 0.20 -0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 41.10 1rwf n LEU 257 CO 0.20 0.02 1.24 0.61 -1.33 0.00 0.00 177.39 178.14 1rwf n GLY 258 N 1.39 1.26 2.49 -0.72 0.00 -0.70 -1.79 105.19 107.12 1rwf n GLY 258 Ca 0.03 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.65 1rwf n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rwf n GLY 259 N 3.28 0.83 3.89 -0.02 0.00 -1.26 -4.98 105.19 106.92 1rwf n GLY 259 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 1rwf n GLY 259 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rwf s THR 260 N -3.26 1.88 0.08 2.61 -4.23 -0.74 -5.00 115.64 106.98 1rwf s THR 260 Ca 0.00 -1.47 0.30 0.00 -1.18 0.00 0.00 61.69 59.34 1rwf s THR 260 Cb 0.00 -2.35 0.30 0.00 1.34 0.00 0.00 72.50 71.79 1rwf s THR 260 CO 0.00 0.00 1.92 0.00 -0.54 0.00 0.00 174.62 176.00 1rwf h ALA 261 N 0.84 1.00 -0.29 3.99 0.00 -1.95 -2.67 119.26 120.17 1rwf h ALA 261 Ca -0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1rwf h ALA 261 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1rwf h ALA 261 CO 0.58 0.00 0.00 1.19 0.00 0.00 0.00 179.25 181.02 1rwf n PHE 262 N -2.57 0.76 -1.69 0.00 3.01 -1.26 -5.04 117.46 110.66 1rwf n PHE 262 Ca -0.02 -0.73 -0.41 0.00 1.01 0.00 0.00 57.45 57.30 1rwf n PHE 262 Cb 0.08 -0.20 0.01 0.00 -0.01 0.00 0.00 39.48 39.35 1rwf n PHE 262 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 1rwf n GLU 263 N -0.11 1.90 -2.16 -1.08 2.13 -1.01 -4.90 120.64 115.41 1rwf n GLU 263 Ca 0.17 0.67 -0.43 0.00 0.66 0.00 0.00 57.16 58.24 1rwf n GLU 263 Cb 0.71 -2.33 -0.02 0.00 0.27 0.00 0.00 31.44 30.06 1rwf n GLU 263 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1rwf s VAL 264 N -1.19 3.80 -0.39 6.31 1.01 -1.26 -4.87 120.40 123.81 1rwf s VAL 264 Ca 0.60 0.94 0.03 0.00 0.00 0.00 0.00 61.98 63.55 1rwf s VAL 264 Cb -0.53 -3.70 0.02 0.00 0.00 0.00 0.00 36.38 32.18 1rwf s VAL 264 CO 0.59 -0.19 0.59 -1.54 0.00 0.00 0.00 175.10 174.55 1rwf n SER 265 N 7.57 1.25 -4.67 3.32 3.41 -1.26 -5.01 113.62 118.22 1rwf n SER 265 Ca 0.17 -1.12 -0.42 0.00 -0.26 0.00 0.00 58.87 57.23 1rwf n SER 265 Cb 0.44 0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.38 1rwf n SER 265 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1rwf s ASP 266 N -0.28 6.62 0.52 4.04 -1.08 -1.26 -4.88 116.67 120.35 1rwf s ASP 266 Ca 0.04 2.40 0.32 0.00 -0.52 0.00 0.00 52.55 54.78 1rwf s ASP 266 Cb 0.03 -2.55 1.24 0.00 -1.46 0.00 0.00 42.92 40.18 1rwf s ASP 266 CO 0.04 -0.91 1.93 1.55 0.52 0.00 0.00 175.17 178.30 1rwf h PRO 267 N 9.02 0.00 0.00 4.34 0.13 -2.04 -2.46 132.00 140.99 1rwf h PRO 267 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1rwf h PRO 267 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1rwf h PRO 267 CO 0.94 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.96 1rwf n THR 268 N -3.02 0.59 0.20 1.56 -2.24 -1.26 -2.57 114.28 107.53 1rwf n THR 268 Ca 0.01 0.15 0.08 0.00 -2.27 0.00 0.00 64.05 62.02 1rwf n THR 268 Cb 0.32 -0.92 0.40 0.00 -2.10 0.00 0.00 70.33 68.03 1rwf n THR 268 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1rwf n ARG 269 N -1.26 0.10 -0.16 -0.78 1.85 -0.93 -1.15 116.66 114.33 1rwf n ARG 269 Ca 0.07 0.53 0.20 0.00 -1.00 0.00 0.00 57.85 57.64 1rwf n ARG 269 Cb 0.10 -1.79 0.58 0.00 -1.05 0.00 0.00 32.46 30.30 1rwf n ARG 269 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1rwf h SER 270 N 0.00 0.25 -0.80 2.89 4.64 -1.76 -1.14 113.55 117.63 1rwf h SER 270 Ca 0.00 0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1rwf h SER 270 Cb 0.09 -0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 62.12 1rwf h SER 270 CO 0.00 0.12 0.50 0.40 -0.87 0.00 0.00 176.83 176.98 1rwf h ILE 271 N 0.26 1.22 -0.22 0.95 2.04 -1.42 0.94 117.51 121.27 1rwf h ILE 271 Ca 0.38 -0.45 -0.02 0.00 1.00 0.00 0.00 64.86 65.77 1rwf h ILE 271 Cb 1.11 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1rwf h ILE 271 CO -0.09 0.22 0.07 0.15 0.00 0.00 0.00 178.15 178.50 1rwf h PHE 272 N 1.09 0.36 -1.00 1.37 3.57 -1.42 -2.06 116.94 118.85 1rwf h PHE 272 Ca 0.29 -0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.78 1rwf h PHE 272 Cb -0.07 -0.10 -0.05 0.00 2.79 0.00 0.00 35.95 38.51 1rwf h PHE 272 CO -0.01 0.43 0.66 0.74 -2.23 0.00 0.00 178.31 177.90 1rwf h PHE 273 N 0.19 1.24 0.00 0.41 0.04 -1.07 -0.91 116.94 116.84 1rwf h PHE 273 Ca 0.07 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.87 1rwf h PHE 273 Cb 0.24 -0.42 -0.00 0.00 2.20 0.00 0.00 35.95 37.97 1rwf h PHE 273 CO 0.00 0.74 -0.03 -0.44 -0.60 0.00 0.00 178.31 177.98 1rwf h ASP 274 N 1.30 0.00 1.15 2.17 3.32 -0.55 -2.22 116.42 121.59 1rwf h ASP 274 Ca 0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 1rwf h ASP 274 Cb -0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1rwf h ASP 274 CO -0.11 0.03 0.00 0.00 -1.72 0.00 0.00 179.24 177.45 1rwf h ALA 275 N 1.97 1.00 -0.22 3.45 0.00 -0.44 -0.70 119.26 124.32 1rwf h ALA 275 Ca -0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1rwf h ALA 275 Cb 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1rwf h ALA 275 CO 0.00 0.00 0.12 0.28 0.00 0.00 0.00 179.25 179.65 1rwf h VAL 276 N 0.00 1.01 0.00 0.00 2.07 -1.41 0.82 116.25 118.74 1rwf h VAL 276 Ca 0.00 -0.09 -0.22 0.00 0.82 0.00 0.00 66.70 67.21 1rwf h VAL 276 Cb 0.58 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 1rwf h VAL 276 CO 0.00 0.05 -1.57 -0.62 0.02 0.00 0.00 177.57 175.45 1rwf n GLU 277 N -4.98 0.63 0.10 1.57 1.02 -1.20 -0.72 120.64 117.06 1rwf n GLU 277 Ca -0.03 0.25 -0.03 0.00 -0.02 0.00 0.00 57.16 57.34 1rwf n GLU 277 Cb 0.05 -1.79 -0.02 0.00 -0.02 0.00 0.00 31.44 29.66 1rwf n GLU 277 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1rwf h GLY 278 N 3.63 0.00 0.00 0.62 0.00 -1.08 -3.39 103.07 102.86 1rwf h GLY 278 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1rwf h GLY 278 CO 0.06 0.00 -0.90 1.44 0.00 0.00 0.00 176.54 177.14 1rwf n SER 279 N -3.37 0.13 -0.05 0.19 7.64 0.16 -4.50 113.62 113.83 1rwf n SER 279 Ca 0.00 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.70 1rwf n SER 279 Cb 0.82 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.89 1rwf n SER 279 CO 0.00 0.00 0.00 -0.26 -3.01 0.00 0.00 175.04 171.77 1rwf h PHE 280 N 0.00 0.17 -0.98 1.43 -1.00 -1.18 -3.39 116.94 112.00 1rwf h PHE 280 Ca 0.00 -0.13 0.05 0.00 2.81 0.00 0.00 57.97 60.70 1rwf h PHE 280 Cb 0.90 -0.01 -0.06 0.00 3.61 0.00 0.00 35.95 40.39 1rwf h PHE 280 CO 0.00 1.32 0.63 0.00 -1.61 0.00 0.00 178.31 178.65 1rwf h ALA 281 N -0.15 1.32 0.00 2.45 0.00 -1.12 -2.48 119.26 119.29 1rwf h ALA 281 Ca -0.20 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1rwf h ALA 281 Cb 1.36 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1rwf h ALA 281 CO -0.03 0.48 0.00 -1.35 0.00 0.00 0.00 179.25 178.35 1rwf h PRO 282 N 1.19 0.00 -0.56 0.00 0.11 -1.76 -2.35 132.00 128.63 1rwf h PRO 282 Ca 0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.51 1rwf h PRO 282 Cb 0.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.18 1rwf h PRO 282 CO -0.14 0.00 0.00 1.33 -0.21 0.00 0.00 178.00 178.98 1rwf n VAL 283 N -2.94 0.86 -3.32 3.15 0.24 -0.95 -4.87 118.33 110.50 1rwf n VAL 283 Ca 0.00 -0.93 -0.38 0.00 -2.04 0.00 0.00 64.34 60.99 1rwf n VAL 283 Cb 0.25 0.63 -0.06 0.00 -1.47 0.00 0.00 33.84 33.18 1rwf n VAL 283 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1rwf s MET 284 N -1.10 4.29 -0.30 7.34 -1.94 -0.89 -0.83 119.30 125.88 1rwf s MET 284 Ca 0.40 0.40 -0.00 0.00 -1.71 0.00 0.00 55.69 54.77 1rwf s MET 284 Cb 0.22 -3.47 0.09 0.00 2.01 0.00 0.00 34.83 33.68 1rwf s MET 284 CO 0.29 0.07 0.08 0.42 -0.01 0.00 0.00 175.02 175.87 1rwf s ILE 285 N 0.91 1.04 -1.44 2.53 1.01 0.34 -4.82 121.20 120.78 1rwf s ILE 285 Ca 0.24 -1.42 -0.11 0.00 0.00 0.00 0.00 60.65 59.37 1rwf s ILE 285 Cb -0.15 -1.73 0.07 0.00 0.01 0.00 0.00 42.46 40.66 1rwf s ILE 285 CO 0.09 -0.59 0.69 0.59 0.00 0.00 0.00 174.94 175.72 1rwf n ASN 286 N 4.79 -4.42 0.00 3.58 3.02 -1.26 -1.49 115.26 119.49 1rwf n ASN 286 Ca -0.03 -0.54 0.00 0.00 -0.03 0.00 0.00 54.58 53.98 1rwf n ASN 286 Cb 0.43 -3.59 0.00 0.00 -0.61 0.00 0.00 39.78 36.01 1rwf n ASN 286 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rwf n GLY 287 N -1.41 0.47 3.55 7.41 0.00 -1.24 -4.32 105.19 109.65 1rwf n GLY 287 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 1rwf n GLY 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwf s ALA 288 N -2.19 2.87 0.17 4.61 0.00 -0.55 -3.93 121.76 122.74 1rwf s ALA 288 Ca 0.00 -0.94 -0.30 0.00 0.00 0.00 0.00 51.96 50.72 1rwf s ALA 288 Cb 0.00 -1.12 -0.08 0.00 0.00 0.00 0.00 23.12 21.92 1rwf s ALA 288 CO 0.00 0.57 1.24 -1.64 0.00 0.00 0.00 175.76 175.93 1rwf s MET 289 N -0.85 4.44 0.29 0.00 -1.94 -0.18 -0.50 119.30 120.56 1rwf s MET 289 Ca 0.13 1.92 -0.30 0.00 -1.71 0.00 0.00 55.69 55.73 1rwf s MET 289 Cb -0.11 -3.24 -0.13 0.00 2.01 0.00 0.00 34.83 33.36 1rwf s MET 289 CO 0.02 -0.18 1.34 0.00 -0.01 0.00 0.00 175.02 176.18 1rwf n ALA 290 N 2.84 1.14 -0.01 3.03 0.00 -0.01 -4.58 120.51 122.93 1rwf n ALA 290 Ca 0.06 0.39 0.04 0.00 0.00 0.00 0.00 53.44 53.93 1rwf n ALA 290 Cb 0.44 -2.25 0.42 0.00 0.00 0.00 0.00 19.45 18.06 1rwf n ALA 290 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1rwf h ASP 291 N 3.38 0.49 0.39 0.00 3.32 -1.93 -2.01 116.42 120.06 1rwf h ASP 291 Ca -0.45 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1rwf h ASP 291 Cb 1.28 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.71 1rwf h ASP 291 CO 0.69 0.35 0.00 0.00 -1.72 0.00 0.00 179.24 178.56 1rwf n ALA 292 N -2.47 1.39 -1.12 3.45 0.00 -1.26 -1.95 120.51 118.54 1rwf n ALA 292 Ca 0.03 0.10 0.08 0.00 0.00 0.00 0.00 53.44 53.66 1rwf n ALA 292 Cb 0.06 -1.31 0.19 0.00 0.00 0.00 0.00 19.45 18.39 1rwf n ALA 292 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1rwf n VAL 293 N -2.10 2.10 -0.78 0.00 0.24 -0.76 -4.63 118.33 112.40 1rwf n VAL 293 Ca 0.01 -2.26 0.05 0.00 -2.04 0.00 0.00 64.34 60.10 1rwf n VAL 293 Cb 0.13 -0.25 0.07 0.00 -1.47 0.00 0.00 33.84 32.32 1rwf n VAL 293 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 1rwf n ARG 294 N -1.08 1.68 0.00 7.34 1.85 -0.82 -0.65 116.66 124.97 1rwf n ARG 294 Ca 0.19 -1.93 0.00 0.00 -1.00 0.00 0.00 57.85 55.12 1rwf n ARG 294 Cb 0.76 -1.17 0.00 0.00 -1.05 0.00 0.00 32.46 31.00 1rwf n ARG 294 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1rwf n GLY 295 N -0.89 2.96 0.01 2.89 0.00 -1.26 -2.03 105.19 106.88 1rwf n GLY 295 Ca 0.08 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.20 1rwf n GLY 295 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1rwf n ARG 296 N 14.00 0.01 0.12 1.61 1.85 -1.26 -3.12 116.66 129.88 1rwf n ARG 296 Ca 0.00 0.13 0.11 0.00 -1.00 0.00 0.00 57.85 57.09 1rwf n ARG 296 Cb 0.00 -1.52 0.48 0.00 -1.05 0.00 0.00 32.46 30.38 1rwf n ARG 296 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1rwf n SER 297 N -1.54 0.56 -0.00 2.89 3.41 -0.86 -2.17 113.62 115.91 1rwf n SER 297 Ca 0.05 0.67 0.19 0.00 -0.26 0.00 0.00 58.87 59.53 1rwf n SER 297 Cb 0.26 -0.78 0.67 0.00 -0.26 0.00 0.00 64.21 64.11 1rwf n SER 297 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 175.04 175.04 1rwf h ILE 298 N 0.00 0.75 0.00 -1.33 3.07 -1.72 -1.39 117.51 116.90 1rwf h ILE 298 Ca 0.00 -0.01 0.00 0.00 1.55 0.00 0.00 64.86 66.40 1rwf h ILE 298 Cb 0.24 0.71 0.00 0.00 -0.27 0.00 0.00 36.82 37.51 1rwf h ILE 298 CO 0.00 0.01 0.00 -1.54 -1.05 0.00 0.00 178.15 175.57 1rwf n SER 299 N -4.39 0.00 -4.46 2.16 3.41 -0.92 -4.80 113.62 104.61 1rwf n SER 299 Ca 0.10 -1.02 -0.40 0.00 -0.26 0.00 0.00 58.87 57.29 1rwf n SER 299 Cb 0.58 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.42 1rwf n SER 299 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1rwf s ARG 300 N -2.00 3.33 0.50 4.33 0.52 -0.52 -4.47 118.95 120.63 1rwf s ARG 300 Ca 0.29 -0.74 0.15 0.00 -0.52 0.00 0.00 55.73 54.90 1rwf s ARG 300 Cb 0.13 -3.68 1.20 0.00 0.52 0.00 0.00 34.95 33.12 1rwf s ARG 300 CO 0.22 -0.47 2.12 1.05 0.02 0.00 0.00 175.30 178.25 1rwf h GLU 301 N 8.42 0.11 -0.05 3.54 4.11 -1.88 -2.95 114.58 125.87 1rwf h GLU 301 Ca -0.31 -0.01 -0.06 0.00 0.07 0.00 0.00 59.36 59.06 1rwf h GLU 301 Cb 1.14 -0.02 -0.08 0.00 0.50 0.00 0.00 28.75 30.29 1rwf h GLU 301 CO 0.63 0.07 -0.59 0.00 0.07 0.00 0.00 179.01 179.19 1rwf n ALA 302 N -2.53 3.59 -3.17 1.06 0.00 -1.26 -4.69 120.51 113.51 1rwf n ALA 302 Ca -0.01 -3.22 -0.21 0.00 0.00 0.00 0.00 53.44 49.99 1rwf n ALA 302 Cb 0.11 -0.40 -0.06 0.00 0.00 0.00 0.00 19.45 19.10 1rwf n ALA 302 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1rwf n ASN 303 N -0.90 -0.70 -4.82 0.00 4.05 -1.12 -5.03 115.26 106.75 1rwf n ASN 303 Ca 0.19 -2.68 -0.22 0.00 0.45 0.00 0.00 54.58 52.32 1rwf n ASN 303 Cb 0.76 -0.12 0.09 0.00 1.23 0.00 0.00 39.78 41.73 1rwf n ASN 303 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 1rwf s THR 304 N -0.40 2.19 0.40 -0.44 -4.23 -1.26 -4.63 115.64 107.27 1rwf s THR 304 Ca 0.34 -0.75 0.08 0.00 -1.18 0.00 0.00 61.69 60.17 1rwf s THR 304 Cb 0.12 -2.44 0.29 0.00 1.34 0.00 0.00 72.50 71.81 1rwf s THR 304 CO -0.15 0.00 2.02 1.23 -0.54 0.00 0.00 174.62 177.18 1rwf h GLY 305 N -0.22 0.68 1.58 3.99 0.00 -1.93 -1.48 103.07 105.69 1rwf h GLY 305 Ca -0.34 -0.23 -0.24 0.00 0.00 0.00 0.00 47.33 46.51 1rwf h GLY 305 CO 0.41 0.20 -1.02 -0.97 0.00 0.00 0.00 176.54 175.16 1rwf h TYR 306 N 0.59 0.57 -0.59 5.60 -1.99 -1.87 0.61 116.97 119.89 1rwf h TYR 306 Ca 0.22 -0.34 -0.00 0.00 2.00 0.00 0.00 58.73 60.61 1rwf h TYR 306 Cb 0.14 -0.05 -0.03 0.00 2.00 0.00 0.00 36.73 38.78 1rwf h TYR 306 CO -0.00 1.18 0.36 -0.44 -0.00 0.00 0.00 178.16 179.26 1rwf h ASP 307 N 0.18 0.70 -0.12 3.88 3.32 -1.78 0.29 116.42 122.90 1rwf h ASP 307 Ca -0.09 -0.05 -0.22 0.00 0.02 0.00 0.00 57.03 56.68 1rwf h ASP 307 Cb 1.68 -0.18 0.01 0.00 0.22 0.00 0.00 39.33 41.07 1rwf h ASP 307 CO 0.17 0.55 -0.80 -0.07 -1.72 0.00 0.00 179.24 177.37 1rwf h LEU 308 N 0.80 0.92 -1.05 1.55 3.38 -1.27 -2.00 115.31 117.64 1rwf h LEU 308 Ca 0.21 -0.65 -0.03 0.00 0.09 0.00 0.00 57.88 57.50 1rwf h LEU 308 Cb -0.03 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 1rwf h LEU 308 CO -0.04 1.42 0.27 1.23 0.09 0.00 0.00 178.44 181.42 1rwf h GLY 309 N 0.48 1.02 1.31 0.83 0.00 -0.86 -1.00 103.07 104.85 1rwf h GLY 309 Ca -0.07 -0.52 -0.10 0.00 0.00 0.00 0.00 47.33 46.65 1rwf h GLY 309 CO 0.16 0.49 -0.11 0.00 0.00 0.00 0.00 176.54 177.09 1rwf h ALA 310 N 1.36 0.97 -0.68 3.60 0.00 -0.78 -0.55 119.26 123.18 1rwf h ALA 310 Ca 0.22 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1rwf h ALA 310 Cb 0.16 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1rwf h ALA 310 CO -0.02 0.61 0.14 0.77 0.00 0.00 0.00 179.25 180.75 1rwf h SER 311 N 0.73 1.05 -0.60 0.00 0.02 -1.07 -1.08 113.55 112.60 1rwf h SER 311 Ca 0.12 -0.25 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 1rwf h SER 311 Cb 0.60 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.83 1rwf h SER 311 CO 0.04 1.03 0.23 0.00 -1.14 0.00 0.00 176.83 176.99 1rwf h ALA 312 N 1.06 1.21 -0.15 3.77 0.00 -0.66 -1.80 119.26 122.70 1rwf h ALA 312 Ca 0.21 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1rwf h ALA 312 Cb 0.40 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1rwf h ALA 312 CO 0.01 0.57 0.01 0.82 0.00 0.00 0.00 179.25 180.65 1rwf h ILE 313 N 0.92 1.24 -0.80 0.00 2.04 -0.78 -0.05 117.51 120.08 1rwf h ILE 313 Ca 0.21 -0.79 0.09 0.00 1.00 0.00 0.00 64.86 65.37 1rwf h ILE 313 Cb 0.21 1.47 -0.07 0.00 -0.74 0.00 0.00 36.82 37.69 1rwf h ILE 313 CO -0.02 0.24 0.45 -0.08 0.00 0.00 0.00 178.15 178.74 1rwf h GLU 314 N 0.02 0.73 -0.37 2.37 4.81 -1.02 -0.47 114.58 120.66 1rwf h GLU 314 Ca 0.04 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 1rwf h GLU 314 Cb 0.35 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1rwf h GLU 314 CO 0.01 0.49 -0.18 0.00 -0.73 0.00 0.00 179.01 178.60 1rwf h ALA 315 N 1.44 0.52 -0.66 2.92 0.00 -0.99 -1.36 119.26 121.12 1rwf h ALA 315 Ca 0.38 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1rwf h ALA 315 Cb 0.35 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1rwf h ALA 315 CO -0.25 0.45 0.22 0.82 0.00 0.00 0.00 179.25 180.49 1rwf h ILE 316 N 0.56 1.25 -0.73 0.00 2.04 -0.71 -0.72 117.51 119.21 1rwf h ILE 316 Ca 0.08 -0.84 -0.03 0.00 1.00 0.00 0.00 64.86 65.07 1rwf h ILE 316 Cb 0.72 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 1rwf h ILE 316 CO 0.05 0.33 0.33 -0.07 0.00 0.00 0.00 178.15 178.79 1rwf h LEU 317 N 0.95 0.97 -0.41 1.44 3.38 -0.95 -0.18 115.31 120.52 1rwf h LEU 317 Ca 0.21 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1rwf h LEU 317 Cb 0.28 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1rwf h LEU 317 CO -0.01 0.84 0.06 0.25 0.09 0.00 0.00 178.44 179.67 1rwf h LEU 318 N 1.03 0.65 -1.10 1.67 5.85 -0.88 -2.92 115.31 119.61 1rwf h LEU 318 Ca 0.25 -0.27 -0.08 0.00 0.84 0.00 0.00 57.88 58.63 1rwf h LEU 318 Cb 0.15 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1rwf h LEU 318 CO -0.03 0.75 -0.18 -0.07 -0.34 0.00 0.00 178.44 178.58 1rwf h LEU 319 N 0.53 0.42 -2.14 2.25 3.38 -0.97 -2.96 115.31 115.81 1rwf h LEU 319 Ca 0.12 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1rwf h LEU 319 Cb 0.38 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1rwf h LEU 319 CO 0.01 0.61 -0.03 0.00 0.09 0.00 0.00 178.44 179.12 1rwf h ALA 320 N 1.43 1.74 -0.21 1.53 0.00 -0.82 -2.40 119.26 120.53 1rwf h ALA 320 Ca 0.07 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.01 1rwf h ALA 320 Cb 0.54 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1rwf h ALA 320 CO 0.03 0.04 0.16 0.00 0.00 0.00 0.00 179.25 179.48 1rwf h ARG 321 N 0.00 0.00 -0.02 0.00 3.08 -1.55 -2.42 114.38 113.47 1rwf h ARG 321 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1rwf h ARG 321 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1rwf h ARG 321 CO 0.00 0.00 -0.35 0.00 -1.07 0.00 0.00 179.97 178.55 1rwf n ALA 322 N -2.53 3.29 -2.13 0.04 0.00 -0.90 -5.01 120.51 113.27 1rwf n ALA 322 Ca 0.02 -0.59 -0.26 0.00 0.00 0.00 0.00 53.44 52.61 1rwf n ALA 322 Cb 0.30 -0.89 0.03 0.00 0.00 0.00 0.00 19.45 18.89 1rwf n ALA 322 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1rwf s MET 323 N -2.41 2.95 0.80 0.00 -1.94 -0.91 -5.06 119.30 112.73 1rwf s MET 323 Ca 0.22 -0.12 -0.14 0.00 -1.71 0.00 0.00 55.69 53.94 1rwf s MET 323 Cb 0.19 -2.34 0.04 0.00 2.01 0.00 0.00 34.83 34.73 1rwf s MET 323 CO 0.52 -0.60 0.91 -0.40 -0.01 0.00 0.00 175.02 175.44 1rwf n ASP 324 N -2.47 0.01 -0.14 3.03 5.68 -1.26 -4.65 116.55 116.75 1rwf n ASP 324 Ca 0.04 0.56 -0.03 0.00 -0.50 0.00 0.00 54.79 54.86 1rwf n ASP 324 Cb 0.58 -1.39 0.05 0.00 -1.14 0.00 0.00 41.12 39.22 1rwf n ASP 324 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 1rwf h PRO 325 N -0.80 0.15 -0.54 0.11 0.11 -1.97 -0.07 132.00 129.00 1rwf h PRO 325 Ca -0.46 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 1rwf h PRO 325 Cb 1.31 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 1rwf h PRO 325 CO 0.44 0.10 0.25 0.00 -0.21 0.00 0.00 178.00 178.57 1rwf h ALA 326 N 1.38 0.69 -0.28 -0.75 0.00 -1.99 -1.05 119.26 117.25 1rwf h ALA 326 Ca 0.22 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 1rwf h ALA 326 Cb 0.32 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1rwf h ALA 326 CO -0.34 0.27 -0.24 1.15 0.00 0.00 0.00 179.25 180.09 1rwf h THR 327 N 0.72 1.30 -0.24 0.00 2.02 -1.82 -1.57 112.91 113.32 1rwf h THR 327 Ca 0.18 -1.39 0.05 0.00 0.77 0.00 0.00 66.41 66.03 1rwf h THR 327 Cb 0.14 1.58 -0.05 0.00 -1.74 0.00 0.00 68.15 68.07 1rwf h THR 327 CO -0.02 0.44 -0.09 0.00 0.37 0.00 0.00 175.52 176.22 1rwf h ALA 328 N 0.71 0.12 -0.45 6.16 0.00 -0.94 -0.38 119.26 124.48 1rwf h ALA 328 Ca 0.05 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1rwf h ALA 328 Cb 0.79 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1rwf h ALA 328 CO 0.06 -0.50 -0.01 0.00 0.00 0.00 0.00 179.25 178.80 1rwf h ALA 329 N 1.17 1.15 -0.17 0.00 0.00 -1.12 -0.65 119.26 119.63 1rwf h ALA 329 Ca 0.12 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1rwf h ALA 329 Cb 0.23 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1rwf h ALA 329 CO -0.27 0.55 0.09 -0.09 0.00 0.00 0.00 179.25 179.52 1rwf h ARG 330 N 0.69 0.24 -0.67 0.00 9.65 -0.88 0.20 114.38 123.61 1rwf h ARG 330 Ca 0.14 -0.03 -0.08 0.00 -1.10 0.00 0.00 59.98 58.91 1rwf h ARG 330 Cb 0.44 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 28.95 1rwf h ARG 330 CO 0.02 0.25 0.10 -1.49 2.80 0.00 0.00 179.97 181.65 1rwf h TRP 331 N 0.16 1.20 -0.74 2.20 6.55 -0.95 -0.85 115.95 123.52 1rwf h TRP 331 Ca 0.06 -0.17 -0.06 0.00 0.95 0.00 0.00 58.89 59.67 1rwf h TRP 331 Cb 0.09 -0.33 -0.03 0.00 -0.86 0.00 0.00 29.16 28.03 1rwf h TRP 331 CO -0.04 1.00 0.25 0.00 -1.05 0.00 0.00 178.44 178.60 1rwf h ARG 332 N 1.05 1.14 -0.68 0.49 3.08 -1.00 -1.52 114.38 116.93 1rwf h ARG 332 Ca 0.20 -0.23 -0.06 0.00 0.07 0.00 0.00 59.98 59.96 1rwf h ARG 332 Cb 0.46 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 1rwf h ARG 332 CO 0.01 0.96 0.20 0.78 -1.07 0.00 0.00 179.97 180.85 1rwf h GLY 333 N 1.12 1.14 0.82 0.04 0.00 -0.44 0.18 103.07 105.94 1rwf h GLY 333 Ca 0.24 -0.68 0.03 0.00 0.00 0.00 0.00 47.33 46.91 1rwf h GLY 333 CO -0.01 0.64 0.18 1.41 0.00 0.00 0.00 176.54 178.76 1rwf h LEU 334 N 0.99 0.26 -0.38 3.11 3.38 -0.92 -1.03 115.31 120.71 1rwf h LEU 334 Ca 0.22 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 1rwf h LEU 334 Cb 0.32 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1rwf h LEU 334 CO -0.00 0.19 0.07 0.00 0.09 0.00 0.00 178.44 178.78 1rwf h ALA 336 N 0.92 1.87 -0.19 0.00 0.00 -0.44 -0.29 119.26 121.14 1rwf h ALA 336 Ca 0.12 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1rwf h ALA 336 Cb 0.36 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1rwf h ALA 336 CO 0.01 0.05 -0.22 0.78 0.00 0.00 0.00 179.25 179.86 1rwf h GLY 337 N 0.46 0.53 2.00 0.00 0.00 -0.90 0.32 103.07 105.48 1rwf h GLY 337 Ca 0.21 -0.56 -0.05 0.00 0.00 0.00 0.00 47.33 46.93 1rwf h GLY 337 CO -0.06 0.51 -0.22 1.49 0.00 0.00 0.00 176.54 178.26 1rwf h TRP 338 N 0.14 0.00 0.00 5.60 6.55 -0.93 -1.94 115.95 125.38 1rwf h TRP 338 Ca 0.03 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.86 1rwf h TRP 338 Cb 0.78 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.08 1rwf h TRP 338 CO 0.08 0.22 -0.03 0.82 -1.05 0.00 0.00 178.44 178.48 1rwf h ILE 339 N 0.00 1.63 -0.34 1.49 2.04 -0.98 -3.29 117.51 118.06 1rwf h ILE 339 Ca -0.00 -1.89 -0.08 0.00 1.00 0.00 0.00 64.86 63.89 1rwf h ILE 339 Cb 0.42 2.90 -0.02 0.00 -0.74 0.00 0.00 36.82 39.38 1rwf h ILE 339 CO 0.03 0.49 -0.12 0.00 0.00 0.00 0.00 178.15 178.56 1rwf h ALA 340 N 0.21 1.17 0.00 1.87 0.00 -0.72 -2.57 119.26 119.22 1rwf h ALA 340 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1rwf h ALA 340 Cb 0.82 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1rwf h ALA 340 CO 0.01 0.53 0.00 0.00 0.00 0.00 0.00 179.25 179.78 1rwf h ARG 341 N 0.53 0.00 -4.54 0.00 3.08 -1.53 -3.40 114.38 108.52 1rwf h ARG 341 Ca 0.10 0.00 -0.73 0.00 0.07 0.00 0.00 59.98 59.42 1rwf h ARG 341 Cb 0.52 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 30.36 1rwf h ARG 341 CO 0.03 0.00 0.56 0.34 -1.07 0.00 0.00 179.97 179.83 1rwf s ASP 342 N -5.07 6.70 0.00 7.04 2.15 -0.97 -4.78 116.67 121.74 1rwf s ASP 342 Ca 0.07 -2.33 0.26 0.00 0.43 0.00 0.00 52.55 50.98 1rwf s ASP 342 Cb 0.09 -2.32 0.94 0.00 -0.30 0.00 0.00 42.92 41.33 1rwf s ASP 342 CO 0.56 -0.86 1.68 0.35 -0.17 0.00 0.00 175.17 176.74 1rwf n THR 343 N 4.85 0.05 -0.07 1.71 -2.24 -1.26 -3.97 114.28 113.35 1rwf n THR 343 Ca 0.20 -0.29 -0.22 0.00 -2.27 0.00 0.00 64.05 61.47 1rwf n THR 343 Cb 0.48 0.53 -0.12 0.00 -2.10 0.00 0.00 70.33 69.12 1rwf n THR 343 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rwf n TYR 344 N 0.28 0.92 -3.40 4.78 9.36 -1.26 -4.56 117.16 123.28 1rwf n TYR 344 Ca 0.18 0.29 -0.26 0.00 3.32 0.00 0.00 57.90 61.43 1rwf n TYR 344 Cb 0.37 -1.11 -0.09 0.00 -0.63 0.00 0.00 39.34 37.88 1rwf n TYR 344 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1rwf n ARG 345 N -3.93 1.37 -1.63 2.98 5.12 -1.26 -5.08 116.66 114.22 1rwf n ARG 345 Ca -0.36 -3.87 -0.45 0.00 -1.93 0.00 0.00 57.85 51.25 1rwf n ARG 345 Cb 0.88 -1.78 -0.02 0.00 -1.16 0.00 0.00 32.46 30.37 1rwf n ARG 345 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 1rwf n PRO 346 N 1.56 1.63 0.25 5.56 -0.02 -1.25 -4.83 135.00 137.89 1rwf n PRO 346 Ca 0.25 0.57 0.08 0.00 -2.02 0.00 0.00 63.50 62.38 1rwf n PRO 346 Cb 0.46 -2.08 0.61 0.00 -0.02 0.00 0.00 33.50 32.47 1rwf n PRO 346 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1rwf h ILE 347 N 2.47 0.99 0.00 4.25 2.10 -1.89 -1.81 117.51 123.62 1rwf h ILE 347 Ca -0.43 -0.26 0.00 0.00 1.08 0.00 0.00 64.86 65.26 1rwf h ILE 347 Cb 1.31 1.14 0.00 0.00 -1.09 0.00 0.00 36.82 38.18 1rwf h ILE 347 CO 0.66 0.07 0.00 0.18 -1.08 0.00 0.00 178.15 177.98 1rwf n LEU 348 N -4.37 0.82 -4.67 2.19 4.77 -1.26 -4.18 117.00 110.31 1rwf n LEU 348 Ca -0.03 0.59 -0.42 0.00 -0.03 0.00 0.00 56.01 56.12 1rwf n LEU 348 Cb 0.15 -0.35 -0.03 0.00 -2.33 0.00 0.00 43.42 40.86 1rwf n LEU 348 CO 0.34 -0.24 1.32 0.20 -1.33 0.00 0.00 177.39 177.68 1rwf s ASN 349 N -4.53 6.69 -0.20 -1.43 -0.87 -0.68 -2.56 114.94 111.35 1rwf s ASN 349 Ca 0.10 2.24 0.00 0.00 -1.57 0.00 0.00 52.86 53.63 1rwf s ASN 349 Cb 0.12 -2.54 0.00 0.00 -0.02 0.00 0.00 41.25 38.81 1rwf s ASN 349 CO 0.57 -0.89 0.00 -1.20 -2.57 0.00 0.00 177.10 173.01 1rwf n SER 350 N 6.65 -5.33 -4.76 -1.22 7.64 -1.26 -4.99 113.62 110.34 1rwf n SER 350 Ca 0.16 0.05 -0.39 0.00 1.01 0.00 0.00 58.87 59.70 1rwf n SER 350 Cb 0.43 -2.99 0.01 0.00 -1.01 0.00 0.00 64.21 60.64 1rwf n SER 350 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rwf s ALA 351 N -1.37 3.17 1.08 -0.43 0.00 -1.06 -5.03 121.76 118.12 1rwf s ALA 351 Ca 0.00 1.31 -0.13 0.00 0.00 0.00 0.00 51.96 53.15 1rwf s ALA 351 Cb 0.00 -3.53 0.24 0.00 0.00 0.00 0.00 23.12 19.83 1rwf s ALA 351 CO 0.00 -1.03 1.06 -1.54 0.00 0.00 0.00 175.76 174.26 1rwf s SER 352 N -0.72 1.81 0.08 0.00 1.04 -1.26 -4.55 113.70 110.10 1rwf s SER 352 Ca 0.61 1.34 -0.23 0.00 0.48 0.00 0.00 55.95 58.15 1rwf s SER 352 Cb -0.40 -2.07 -0.14 0.00 0.10 0.00 0.00 66.02 63.51 1rwf s SER 352 CO 0.50 -3.66 1.70 0.58 0.98 0.00 0.00 173.24 173.34 1rwf h VAL 353 N -2.25 1.04 -0.81 5.02 2.07 -1.85 -0.81 116.25 118.65 1rwf h VAL 353 Ca -0.58 -0.12 0.07 0.00 0.82 0.00 0.00 66.70 66.89 1rwf h VAL 353 Cb 1.33 1.08 -0.06 0.00 -1.52 0.00 0.00 31.29 32.12 1rwf h VAL 353 CO 0.54 0.03 0.49 -0.65 0.02 0.00 0.00 177.57 178.00 1rwf h PRO 354 N -0.01 0.84 -0.53 1.57 0.11 -1.84 -1.12 132.00 131.02 1rwf h PRO 354 Ca 0.01 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 1rwf h PRO 354 Cb 0.04 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 30.94 1rwf h PRO 354 CO -0.00 0.56 0.20 -0.09 -0.21 0.00 0.00 178.00 178.46 1rwf h ARG 355 N 0.87 0.81 -0.53 1.05 2.43 -1.90 -1.95 114.38 115.16 1rwf h ARG 355 Ca 0.37 -0.16 0.04 0.00 -0.81 0.00 0.00 59.98 59.42 1rwf h ARG 355 Cb 0.23 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.61 1rwf h ARG 355 CO -0.19 0.72 0.29 1.15 -1.51 0.00 0.00 179.97 180.43 1rwf h THR 356 N 0.73 1.00 -0.59 0.20 2.02 -0.79 -1.37 112.91 114.10 1rwf h THR 356 Ca 0.18 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 67.15 1rwf h THR 356 Cb 0.22 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 66.98 1rwf h THR 356 CO -0.01 0.10 0.33 0.00 0.37 0.00 0.00 175.52 176.31 1rwf h ALA 357 N 1.27 0.76 -0.66 6.16 0.00 -0.97 0.89 119.26 126.70 1rwf h ALA 357 Ca 0.23 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1rwf h ALA 357 Cb 0.09 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1rwf h ALA 357 CO -0.13 0.27 0.17 -0.07 0.00 0.00 0.00 179.25 179.48 1rwf h LEU 358 N 0.80 0.98 -0.40 0.00 3.38 -1.00 0.64 115.31 119.71 1rwf h LEU 358 Ca 0.21 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 1rwf h LEU 358 Cb 0.03 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 1rwf h LEU 358 CO -0.03 0.94 -0.10 0.58 0.09 0.00 0.00 178.44 179.92 1rwf h VAL 359 N 0.99 1.27 -0.56 1.22 2.07 -0.93 -1.47 116.25 118.86 1rwf h VAL 359 Ca 0.21 -1.18 -0.03 0.00 0.82 0.00 0.00 66.70 66.52 1rwf h VAL 359 Cb 0.33 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1rwf h VAL 359 CO -0.00 0.40 0.22 0.11 0.02 0.00 0.00 177.57 178.32 1rwf h LYS 360 N 0.58 0.83 -0.65 1.57 1.79 -0.65 -1.35 116.57 118.69 1rwf h LYS 360 Ca 0.10 -0.15 0.05 0.00 -2.18 0.00 0.00 60.65 58.47 1rwf h LYS 360 Cb 0.62 -0.14 -0.05 0.00 -1.58 0.00 0.00 32.23 31.08 1rwf h LYS 360 CO 0.04 0.72 0.37 0.37 -1.08 0.00 0.00 179.45 179.87 1rwf h GLN 361 N 0.76 0.68 -0.16 3.15 4.15 -0.74 -1.54 115.11 121.41 1rwf h GLN 361 Ca 0.19 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.56 1rwf h GLN 361 Cb 0.20 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.73 1rwf h GLN 361 CO -0.02 0.45 0.09 1.25 -1.93 0.00 0.00 178.83 178.67 1rwf h LEU 362 N 0.70 0.20 -1.30 -2.39 5.85 -0.98 -2.12 115.31 115.26 1rwf h LEU 362 Ca 0.28 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.95 1rwf h LEU 362 Cb 0.14 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 1rwf h LEU 362 CO -0.16 0.23 0.49 -0.08 -0.34 0.00 0.00 178.44 178.58 1rwf h GLU 363 N 0.15 0.88 0.00 1.25 4.81 -1.00 -2.67 114.58 118.00 1rwf h GLU 363 Ca 0.06 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 1rwf h GLU 363 Cb 0.07 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1rwf h GLU 363 CO -0.01 0.58 -0.26 0.00 -0.73 0.00 0.00 179.01 178.59 1rwf h ALA 364 N 1.56 1.20 0.00 2.92 0.00 -0.65 -2.66 119.26 121.63 1rwf h ALA 364 Ca 0.30 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1rwf h ALA 364 Cb 0.06 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1rwf h ALA 364 CO -0.09 0.32 -0.03 1.79 0.00 0.00 0.00 179.25 181.25 1rwf h THR 365 N 0.00 0.21 0.00 0.00 1.35 -1.06 -3.47 112.91 109.95 1rwf h THR 365 Ca -0.00 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 1rwf h THR 365 Cb 0.62 1.20 0.00 0.00 -1.73 0.00 0.00 68.15 68.24 1rwf h THR 365 CO 0.03 0.03 0.00 0.61 -0.25 0.00 0.00 175.52 175.95 1rwf n GLY 366 N -0.77 0.18 3.72 5.82 0.00 -1.01 -4.98 105.19 108.15 1rwf n GLY 366 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1rwf n GLY 366 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rwf s VAL 367 N -1.41 2.22 0.49 1.61 1.01 -1.26 -4.96 120.40 118.09 1rwf s VAL 367 Ca 0.00 0.16 -0.20 0.00 0.00 0.00 0.00 61.98 61.93 1rwf s VAL 367 Cb 0.00 -3.10 -0.08 0.00 0.00 0.00 0.00 36.38 33.19 1rwf s VAL 367 CO 0.00 0.01 1.03 0.00 0.00 0.00 0.00 175.10 176.15 1rwf s ALA 368 N 1.09 2.88 0.25 5.51 0.00 -1.26 -4.86 121.76 125.37 1rwf s ALA 368 Ca 0.73 0.59 -0.30 0.00 0.00 0.00 0.00 51.96 52.98 1rwf s ALA 368 Cb -0.48 -3.25 -0.09 0.00 0.00 0.00 0.00 23.12 19.30 1rwf s ALA 368 CO 0.33 -0.30 1.28 -1.25 0.00 0.00 0.00 175.76 175.82 1rwf s PRO 369 N -3.25 4.41 -0.20 0.00 0.04 -1.26 -4.40 135.00 130.35 1rwf s PRO 369 Ca 0.67 2.07 -0.10 0.00 0.04 0.00 0.00 61.00 63.69 1rwf s PRO 369 Cb -0.16 -3.16 -0.05 0.00 0.04 0.00 0.00 34.50 31.18 1rwf s PRO 369 CO 0.20 -0.18 0.12 0.08 0.04 0.00 0.00 177.00 177.26 1rwf s VAL 370 N -0.43 5.33 0.64 -0.36 1.01 -0.47 -4.82 120.40 121.31 1rwf s VAL 370 Ca 0.53 0.16 -0.15 0.00 0.00 0.00 0.00 61.98 62.52 1rwf s VAL 370 Cb -0.37 -3.43 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 1rwf s VAL 370 CO 0.43 0.44 1.09 0.00 0.00 0.00 0.00 175.10 177.07 1rwf s ALA 371 N 0.35 2.56 -0.01 5.51 0.00 -1.26 -4.37 121.76 124.54 1rwf s ALA 371 Ca 0.07 0.48 -0.30 0.00 0.00 0.00 0.00 51.96 52.22 1rwf s ALA 371 Cb -0.11 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.68 1rwf s ALA 371 CO -0.02 -1.13 1.13 -1.21 0.00 0.00 0.00 175.76 174.53 1rwf s GLU 372 N -4.12 4.44 0.27 0.00 2.02 -1.26 -4.99 118.70 115.06 1rwf s GLU 372 Ca 0.66 1.62 -0.29 0.00 0.02 0.00 0.00 54.97 56.97 1rwf s GLU 372 Cb -0.19 -3.46 -0.10 0.00 0.10 0.00 0.00 34.13 30.49 1rwf s GLU 372 CO 0.40 -0.27 1.35 0.00 0.02 0.00 0.00 175.26 176.77 1rwf s ALA 373 N 1.49 3.55 0.75 5.21 0.00 -1.26 -5.01 121.76 126.49 1rwf s ALA 373 Ca 0.55 1.24 -0.14 0.00 0.00 0.00 0.00 51.96 53.62 1rwf s ALA 373 Cb -0.25 -3.50 0.05 0.00 0.00 0.00 0.00 23.12 19.42 1rwf s ALA 373 CO 0.26 -0.64 1.16 0.95 0.00 0.00 0.00 175.76 177.49 1rwf s THR 374 N -0.45 2.58 0.00 0.00 -4.23 -1.26 -4.71 115.64 107.57 1rwf s THR 374 Ca 0.54 0.25 0.00 0.00 -1.18 0.00 0.00 61.69 61.30 1rwf s THR 374 Cb -0.40 -2.70 0.00 0.00 1.34 0.00 0.00 72.50 70.74 1rwf s THR 374 CO 0.46 -0.19 0.00 0.61 -0.54 0.00 0.00 174.62 174.96 1rwf n GLY 375 N -0.02 -0.01 3.31 3.99 0.00 -0.47 -4.89 105.19 107.10 1rwf n GLY 375 Ca 0.12 -2.24 -0.32 0.00 0.00 0.00 0.00 46.02 43.59 1rwf n GLY 375 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1rwf s HIS 376 N 0.00 2.49 -0.16 1.61 0.09 -1.26 -0.64 115.29 117.42 1rwf s HIS 376 Ca 0.00 -0.59 -0.01 0.00 -0.00 0.00 0.00 55.06 54.46 1rwf s HIS 376 Cb 0.00 -1.61 0.04 0.00 -0.00 0.00 0.00 32.58 31.02 1rwf s HIS 376 CO 0.00 -0.13 -0.05 0.15 -0.00 0.00 0.00 174.74 174.71 1rwf s LYS 377 N -0.28 1.36 -0.11 1.40 -0.14 -0.07 -5.02 119.74 116.88 1rwf s LYS 377 Ca 0.00 -0.47 -0.03 0.00 -1.36 0.00 0.00 55.97 54.11 1rwf s LYS 377 Cb -0.13 -1.95 -0.03 0.00 -1.68 0.00 0.00 37.83 34.04 1rwf s LYS 377 CO 0.03 -0.43 0.03 -0.51 -0.76 0.00 0.00 175.35 173.71 1rwf s LEU 378 N 1.66 3.73 -0.58 3.17 1.43 -1.26 -0.65 118.68 126.18 1rwf s LEU 378 Ca 0.01 0.18 0.06 0.00 -1.03 0.00 0.00 54.13 53.35 1rwf s LEU 378 Cb -0.15 -1.88 0.23 0.00 0.03 0.00 0.00 46.19 44.42 1rwf s LEU 378 CO -0.08 0.35 0.61 0.49 0.23 0.00 0.00 176.35 177.95 1rwf n PHE 379 N 2.35 2.32 0.25 0.29 3.01 0.22 -4.97 117.46 120.93 1rwf n PHE 379 Ca -0.19 -3.99 0.11 0.00 1.01 0.00 0.00 57.45 54.39 1rwf n PHE 379 Cb 0.54 -0.46 0.70 0.00 -0.01 0.00 0.00 39.48 40.25 1rwf n PHE 379 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1rwf h PRO 380 N 4.52 0.00 0.00 -1.08 0.11 -1.88 -1.88 132.00 131.80 1rwf h PRO 380 Ca 0.17 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.25 1rwf h PRO 380 Cb 0.75 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.85 1rwf h PRO 380 CO 0.69 0.00 -0.11 0.00 -0.21 0.00 0.00 178.00 178.37 1rwf h ALA 381 N 1.97 1.40 0.00 -0.75 0.00 -1.94 -2.90 119.26 117.05 1rwf h ALA 381 Ca 0.02 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1rwf h ALA 381 Cb 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1rwf h ALA 381 CO -0.00 0.14 -0.01 0.00 0.00 0.00 0.00 179.25 179.38 1rwf n MET 382 N -3.80 1.36 -3.79 0.00 0.00 -0.76 -4.96 117.12 105.17 1rwf n MET 382 Ca -0.02 -2.48 -0.25 0.00 0.00 0.00 0.00 57.70 54.95 1rwf n MET 382 Cb 0.21 -1.45 0.03 0.00 0.00 0.00 0.00 33.22 32.01 1rwf n MET 382 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1rwf n ASP 383 N -1.35 -2.84 -4.07 3.17 8.00 -0.90 -4.70 116.55 113.85 1rwf n ASP 383 Ca 0.15 -0.79 -0.17 0.00 0.71 0.00 0.00 54.79 54.68 1rwf n ASP 383 Cb 0.62 -4.01 -0.13 0.00 -0.02 0.00 0.00 41.12 37.57 1rwf n ASP 383 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1rwf s ARG 384 N -6.26 0.68 0.03 -1.24 1.81 -1.09 -3.10 118.95 109.78 1rwf s ARG 384 Ca 0.30 -0.61 0.01 0.00 -1.72 0.00 0.00 55.73 53.71 1rwf s ARG 384 Cb -0.15 -0.60 -0.02 0.00 -0.45 0.00 0.00 34.95 33.73 1rwf s ARG 384 CO 0.82 0.15 -0.05 0.95 -0.68 0.00 0.00 175.30 176.48 1rwf s THR 385 N -0.82 0.32 0.02 0.02 -4.23 -1.24 -0.61 115.64 109.10 1rwf s THR 385 Ca -0.02 -1.03 0.07 0.00 -1.18 0.00 0.00 61.69 59.54 1rwf s THR 385 Cb -0.07 -0.48 -0.02 0.00 1.34 0.00 0.00 72.50 73.27 1rwf s THR 385 CO 0.01 -0.47 -0.22 -0.04 -0.54 0.00 0.00 174.62 173.36 1rwf s MET 386 N -1.62 1.59 -0.07 3.99 -1.94 0.18 -2.19 119.30 119.24 1rwf s MET 386 Ca -0.12 -0.91 -0.04 0.00 -1.71 0.00 0.00 55.69 52.91 1rwf s MET 386 Cb -0.09 -1.65 0.03 0.00 2.01 0.00 0.00 34.83 35.13 1rwf s MET 386 CO -0.01 0.43 0.17 -1.01 -0.01 0.00 0.00 175.02 174.60 1rwf s HIS 387 N -0.69 -0.20 0.04 -0.03 3.76 -0.23 -0.89 115.29 117.03 1rwf s HIS 387 Ca 0.08 0.53 0.05 0.00 -0.15 0.00 0.00 55.06 55.57 1rwf s HIS 387 Cb -0.09 -0.00 -0.02 0.00 1.11 0.00 0.00 32.58 33.58 1rwf s HIS 387 CO 0.01 -0.15 -0.13 1.03 -0.85 0.00 0.00 174.74 174.65 1rwf s ARG 388 N 0.76 0.90 0.34 1.40 0.52 0.19 0.07 118.95 123.13 1rwf s ARG 388 Ca -0.06 -0.72 0.03 0.00 -0.52 0.00 0.00 55.73 54.46 1rwf s ARG 388 Cb -0.07 -0.89 -0.01 0.00 0.52 0.00 0.00 34.95 34.50 1rwf s ARG 388 CO -0.04 0.22 0.38 0.20 0.02 0.00 0.00 175.30 176.08 1rwf s GLY 389 N -1.08 1.97 -0.14 -3.53 0.00 -0.87 -1.36 107.32 102.30 1rwf s GLY 389 Ca 0.01 -1.83 -0.31 0.00 0.00 0.00 0.00 44.72 42.60 1rwf s GLY 389 CO 0.01 -1.25 2.09 -1.05 0.00 0.00 0.00 173.10 172.91 1rwf n PRO 390 N -0.61 2.15 -0.63 2.90 -0.02 -1.26 -1.64 135.00 135.89 1rwf n PRO 390 Ca 0.04 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1rwf n PRO 390 Cb 0.62 -2.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.12 1rwf n PRO 390 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rwf n GLY 391 N 5.28 0.77 3.34 -1.23 0.00 -1.26 -4.95 105.19 107.13 1rwf n GLY 391 Ca 0.27 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.17 1rwf n GLY 391 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1rwf s TRP 392 N -2.80 -0.28 -0.03 1.61 1.48 -0.65 -4.05 118.94 114.21 1rwf s TRP 392 Ca 0.00 0.17 -0.00 0.00 -1.06 0.00 0.00 56.10 55.21 1rwf s TRP 392 Cb 0.00 0.26 0.03 0.00 -1.16 0.00 0.00 33.47 32.60 1rwf s TRP 392 CO 0.00 -0.63 0.03 0.00 -4.06 0.00 0.00 176.95 172.29 1rwf s ALA 393 N -2.88 0.22 -0.20 2.67 0.00 -0.29 -2.04 121.76 119.24 1rwf s ALA 393 Ca -0.03 0.21 -0.12 0.00 0.00 0.00 0.00 51.96 52.02 1rwf s ALA 393 Cb -0.00 -0.39 -0.05 0.00 0.00 0.00 0.00 23.12 22.68 1rwf s ALA 393 CO -0.05 -0.21 0.22 -1.17 0.00 0.00 0.00 175.76 174.55 1rwf s LEU 394 N 1.38 4.18 -0.18 0.00 2.96 0.11 -0.46 118.68 126.67 1rwf s LEU 394 Ca -0.05 0.31 -0.01 0.00 -0.22 0.00 0.00 54.13 54.16 1rwf s LEU 394 Cb -0.13 -2.23 0.00 0.00 0.50 0.00 0.00 46.19 44.33 1rwf s LEU 394 CO -0.03 0.08 -0.13 -0.55 -1.32 0.00 0.00 176.35 174.40 1rwf s SER 395 N 0.72 3.73 -0.08 3.68 0.15 -0.45 -1.07 113.70 120.38 1rwf s SER 395 Ca 0.12 -0.49 -0.10 0.00 0.70 0.00 0.00 55.95 56.18 1rwf s SER 395 Cb -0.13 -1.60 -0.05 0.00 -1.71 0.00 0.00 66.02 62.54 1rwf s SER 395 CO 0.03 0.04 0.25 -0.76 1.20 0.00 0.00 173.24 173.99 1rwf s LEU 396 N 1.11 4.41 -0.24 3.45 1.43 -0.93 -1.21 118.68 126.70 1rwf s LEU 396 Ca 0.00 0.66 0.02 0.00 -1.03 0.00 0.00 54.13 53.78 1rwf s LEU 396 Cb -0.14 -2.28 0.06 0.00 0.03 0.00 0.00 46.19 43.85 1rwf s LEU 396 CO -0.04 0.36 -0.09 0.00 0.23 0.00 0.00 176.35 176.81 1rwf s ALA 397 N -0.97 2.22 0.49 4.21 0.00 -0.73 -3.63 121.76 123.35 1rwf s ALA 397 Ca 0.18 -1.49 0.04 0.00 0.00 0.00 0.00 51.96 50.70 1rwf s ALA 397 Cb -0.14 -1.46 0.04 0.00 0.00 0.00 0.00 23.12 21.56 1rwf s ALA 397 CO 0.07 -1.11 0.37 1.28 0.00 0.00 0.00 175.76 176.37 1rwf n LEU 398 N 4.58 0.00 -3.83 0.00 4.77 -1.18 -1.53 117.00 119.81 1rwf n LEU 398 Ca -0.13 -2.54 -0.10 0.00 -0.03 0.00 0.00 56.01 53.21 1rwf n LEU 398 Cb 0.44 -0.04 -0.05 0.00 -2.33 0.00 0.00 43.42 41.43 1rwf n LEU 398 CO 0.20 -0.55 0.14 -0.94 -1.33 0.00 0.00 177.39 174.90 1rwf s SER 399 N -3.88 -0.12 0.06 -1.43 1.04 -1.09 -4.75 113.70 103.52 1rwf s SER 399 Ca 0.28 -0.64 -0.06 0.00 0.48 0.00 0.00 55.95 56.01 1rwf s SER 399 Cb -0.02 0.51 0.02 0.00 0.10 0.00 0.00 66.02 66.63 1rwf s SER 399 CO 0.18 -0.98 0.29 -1.54 0.98 0.00 0.00 173.24 172.18 1rwf n SER 400 N -0.28 -0.53 0.00 7.02 3.41 -0.52 -4.72 113.62 118.00 1rwf n SER 400 Ca -0.09 -1.29 0.05 0.00 -0.26 0.00 0.00 58.87 57.28 1rwf n SER 400 Cb 0.63 0.86 0.27 0.00 -0.26 0.00 0.00 64.21 65.70 1rwf n SER 400 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1rwf n ASN 401 N -0.83 0.00 -0.02 4.04 0.23 -0.83 -1.90 115.26 115.95 1rwf n ASN 401 Ca -0.01 0.10 0.05 0.00 -0.53 0.00 0.00 54.58 54.19 1rwf n ASN 401 Cb 0.17 -0.27 -0.12 0.00 -2.08 0.00 0.00 39.78 37.49 1rwf n ASN 401 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1rwf n ARG 402 N -1.27 0.72 -4.13 -3.83 1.74 -1.26 -4.94 116.66 103.69 1rwf n ARG 402 Ca 0.05 -0.11 -0.24 0.00 -0.77 0.00 0.00 57.85 56.78 1rwf n ARG 402 Cb 0.08 -1.36 -0.17 0.00 -1.02 0.00 0.00 32.46 30.00 1rwf n ARG 402 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1rwf s ILE 403 N -2.89 0.87 0.68 0.55 -1.09 -0.80 -4.70 121.20 113.82 1rwf s ILE 403 Ca -0.06 -0.25 -0.17 0.00 -2.23 0.00 0.00 60.65 57.94 1rwf s ILE 403 Cb 0.08 -0.87 0.01 0.00 -1.58 0.00 0.00 42.46 40.10 1rwf s ILE 403 CO 0.61 0.32 1.25 0.00 -1.23 0.00 0.00 174.94 175.89 1rwf s ALA 404 N 1.28 2.27 0.26 9.38 0.00 -0.15 -1.44 121.76 133.37 1rwf s ALA 404 Ca -0.04 1.05 -0.01 0.00 0.00 0.00 0.00 51.96 52.96 1rwf s ALA 404 Cb -0.14 -3.51 0.54 0.00 0.00 0.00 0.00 23.12 20.01 1rwf s ALA 404 CO -0.03 -1.69 1.74 -1.49 0.00 0.00 0.00 175.76 174.30 1rwf h TRP 405 N 0.20 0.68 -1.77 0.00 6.55 -1.91 -3.45 115.95 116.24 1rwf h TRP 405 Ca -0.49 0.04 0.20 0.00 0.95 0.00 0.00 58.89 59.58 1rwf h TRP 405 Cb 1.31 -0.17 -0.18 0.00 -0.86 0.00 0.00 29.16 29.27 1rwf h TRP 405 CO 0.44 0.12 0.69 1.52 -1.05 0.00 0.00 178.44 180.16 1rwf s TYR 406 N -5.97 -0.21 -0.20 0.49 -0.00 -1.26 -2.43 117.35 107.76 1rwf s TYR 406 Ca -0.12 0.13 -0.06 0.00 -0.00 0.00 0.00 57.07 57.01 1rwf s TYR 406 Cb 0.22 0.52 -0.03 0.00 -0.00 0.00 0.00 41.96 42.67 1rwf s TYR 406 CO 0.77 -0.33 0.04 -2.00 -0.00 0.00 0.00 175.55 174.03 1rwf s GLU 407 N -2.67 3.77 0.27 -3.49 2.12 -1.26 -3.89 118.70 113.54 1rwf s GLU 407 Ca 0.08 -0.44 0.12 0.00 0.36 0.00 0.00 54.97 55.08 1rwf s GLU 407 Cb -0.01 -3.18 -0.05 0.00 0.26 0.00 0.00 34.13 31.15 1rwf s GLU 407 CO -0.06 0.09 -0.20 0.00 -0.54 0.00 0.00 175.26 174.55 1rwf n GLY 409 N -0.52 1.74 2.48 0.00 0.00 -0.84 -0.53 105.19 107.52 1rwf n GLY 409 Ca -0.06 -0.49 -0.15 0.00 0.00 0.00 0.00 46.02 45.33 1rwf n GLY 409 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1rwf n ASN 410 N 0.00 -4.36 0.00 1.61 3.02 -1.26 -0.86 115.26 113.42 1rwf n ASN 410 Ca 0.00 0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.67 1rwf n ASN 410 Cb 0.00 -3.67 0.00 0.00 -0.61 0.00 0.00 39.78 35.50 1rwf n ASN 410 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rwf n GLY 411 N -0.88 0.47 3.28 7.41 0.00 -1.26 -4.77 105.19 109.44 1rwf n GLY 411 Ca -0.16 -0.51 -0.32 0.00 0.00 0.00 0.00 46.02 45.03 1rwf n GLY 411 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rwf s GLU 412 N -0.95 2.97 -1.28 1.61 2.02 -0.04 -1.26 118.70 121.78 1rwf s GLU 412 Ca 0.00 -0.83 0.00 0.00 0.02 0.00 0.00 54.97 54.16 1rwf s GLU 412 Cb 0.00 -2.34 0.00 0.00 0.10 0.00 0.00 34.13 31.89 1rwf s GLU 412 CO 0.00 0.26 0.00 -1.71 0.02 0.00 0.00 175.26 173.83 1rwf n ASN 413 N 3.31 -4.40 0.32 -0.19 5.15 -1.07 -2.00 115.26 116.39 1rwf n ASN 413 Ca -0.18 0.09 0.20 0.00 -0.60 0.00 0.00 54.58 54.09 1rwf n ASN 413 Cb 0.53 -3.44 1.12 0.00 -0.53 0.00 0.00 39.78 37.45 1rwf n ASN 413 CO 0.00 0.00 0.00 0.78 1.40 0.00 0.00 177.26 179.44 1rwf h ASN 414 N 0.00 0.00 -0.01 1.20 2.35 -1.85 -1.47 115.58 115.80 1rwf h ASN 414 Ca -0.32 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.43 1rwf h ASN 414 Cb 1.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.52 1rwf h ASN 414 CO 0.40 0.00 -0.03 -1.14 -1.65 0.00 0.00 177.43 175.01 1rwf n ARG 415 N -3.31 1.86 0.00 0.81 0.63 -1.26 -1.04 116.66 114.35 1rwf n ARG 415 Ca -0.03 -1.31 0.00 0.00 -0.92 0.00 0.00 57.85 55.59 1rwf n ARG 415 Cb 0.09 -1.47 0.00 0.00 0.45 0.00 0.00 32.46 31.53 1rwf n ARG 415 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1rwf n GLY 416 N 1.26 1.55 0.28 5.14 0.00 -0.55 -4.51 105.19 108.36 1rwf n GLY 416 Ca 0.16 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.37 1rwf n GLY 416 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1rwf h TYR 417 N 0.02 0.00 -0.37 1.61 -0.00 -1.83 -1.94 116.97 114.46 1rwf h TYR 417 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1rwf h TYR 417 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.30 1rwf h TYR 417 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 178.16 178.88 1rwf n HIS 418 N -2.95 0.48 0.49 0.10 8.25 -1.26 -4.54 115.22 115.79 1rwf n HIS 418 Ca -0.01 -0.24 0.12 0.00 -0.26 0.00 0.00 57.72 57.33 1rwf n HIS 418 Cb 0.20 0.00 0.46 0.00 1.12 0.00 0.00 29.99 31.77 1rwf n HIS 418 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1rwf n THR 419 N 1.26 0.76 -0.71 1.59 -2.24 -0.73 -1.91 114.28 112.30 1rwf n THR 419 Ca 0.19 0.11 0.08 0.00 -2.27 0.00 0.00 64.05 62.16 1rwf n THR 419 Cb 0.55 -0.98 0.31 0.00 -2.10 0.00 0.00 70.33 68.10 1rwf n THR 419 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rwf n GLY 420 N 0.36 3.16 2.09 3.38 0.00 -1.02 -4.52 105.19 108.63 1rwf n GLY 420 Ca 0.03 -0.85 -0.23 0.00 0.00 0.00 0.00 46.02 44.98 1rwf n GLY 420 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rwf n SER 421 N 0.50 4.49 -0.27 1.61 7.64 -0.80 -2.69 113.62 124.10 1rwf n SER 421 Ca 0.23 -3.43 0.00 0.00 1.01 0.00 0.00 58.87 56.68 1rwf n SER 421 Cb 0.88 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 1rwf n SER 421 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rwf n GLY 422 N -0.84 0.95 3.77 0.23 0.00 -0.58 -3.22 105.19 105.49 1rwf n GLY 422 Ca 0.52 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 1rwf n GLY 422 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rwf s MET 423 N -2.47 4.21 -0.44 1.61 -1.94 -0.88 -3.45 119.30 115.93 1rwf s MET 423 Ca 0.00 2.07 -0.02 0.00 -1.71 0.00 0.00 55.69 56.03 1rwf s MET 423 Cb 0.00 -2.91 0.12 0.00 2.01 0.00 0.00 34.83 34.05 1rwf s MET 423 CO 0.00 -0.26 0.23 0.95 -0.01 0.00 0.00 175.02 175.93 1rwf s THR 424 N -1.24 3.28 -0.33 2.05 -4.23 -0.23 -1.77 115.64 113.17 1rwf s THR 424 Ca 0.52 -2.23 -0.22 0.00 -1.18 0.00 0.00 61.69 58.59 1rwf s THR 424 Cb -0.36 -3.24 0.00 0.00 1.34 0.00 0.00 72.50 70.24 1rwf s THR 424 CO 0.47 -0.72 0.71 -0.31 -0.54 0.00 0.00 174.62 174.23 1rwf s TYR 425 N 0.93 3.17 -0.52 3.99 1.51 -0.35 -4.63 117.35 121.44 1rwf s TYR 425 Ca 0.10 0.57 -0.15 0.00 -1.01 0.00 0.00 57.07 56.58 1rwf s TYR 425 Cb -0.22 -3.18 0.12 0.00 -0.11 0.00 0.00 41.96 38.57 1rwf s TYR 425 CO -0.04 -0.60 0.47 -0.06 -1.11 0.00 0.00 175.55 174.21 1rwf s PHE 426 N 2.84 3.27 0.26 2.71 0.40 -1.26 -1.34 117.98 124.86 1rwf s PHE 426 Ca 0.28 -1.34 -0.27 0.00 -0.60 0.00 0.00 56.93 55.00 1rwf s PHE 426 Cb -0.14 -3.70 -0.09 0.00 0.51 0.00 0.00 43.02 39.60 1rwf s PHE 426 CO 0.14 -1.00 0.90 0.71 0.70 0.00 0.00 175.22 176.68 1rwf s TYR 427 N 1.57 3.84 0.00 0.36 1.51 0.39 -4.92 117.35 120.10 1rwf s TYR 427 Ca 0.03 1.79 0.00 0.00 -1.01 0.00 0.00 57.07 57.88 1rwf s TYR 427 Cb -0.29 -2.90 0.00 0.00 -0.11 0.00 0.00 41.96 38.66 1rwf s TYR 427 CO 0.03 0.36 0.00 0.25 -1.11 0.00 0.00 175.55 175.08 1rwf n THR 428 N 1.08 0.00 0.34 -0.71 -2.24 -1.26 -1.13 114.28 110.35 1rwf n THR 428 Ca -0.01 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.85 1rwf n THR 428 Cb 0.49 0.00 0.38 0.00 -2.10 0.00 0.00 70.33 69.09 1rwf n THR 428 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1rwf n SER 429 N -1.21 0.34 -4.58 3.42 3.41 -1.26 -3.79 113.62 109.95 1rwf n SER 429 Ca 0.00 0.60 -0.36 0.00 -0.26 0.00 0.00 58.87 58.85 1rwf n SER 429 Cb 0.00 -0.67 -0.03 0.00 -0.26 0.00 0.00 64.21 63.25 1rwf n SER 429 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1rwf s ASP 430 N -3.62 6.03 0.40 4.04 2.15 -1.26 -4.79 116.67 119.60 1rwf s ASP 430 Ca 0.03 -1.95 0.14 0.00 0.43 0.00 0.00 52.55 51.21 1rwf s ASP 430 Cb 0.08 -2.58 0.82 0.00 -0.30 0.00 0.00 42.92 40.94 1rwf s ASP 430 CO 0.26 -2.01 1.87 -0.07 -0.17 0.00 0.00 175.17 175.05 1rwf h LEU 431 N 14.85 0.00 -0.72 -1.34 3.38 -2.00 -1.86 115.31 127.63 1rwf h LEU 431 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 1rwf h LEU 431 Cb 0.92 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.67 1rwf h LEU 431 CO 1.35 0.32 0.00 0.61 0.09 0.00 0.00 178.44 180.81 1rwf n GLY 432 N -0.57 -0.11 0.35 0.83 0.00 -1.26 -4.59 105.19 99.83 1rwf n GLY 432 Ca -0.02 -0.24 -0.07 0.00 0.00 0.00 0.00 46.02 45.69 1rwf n GLY 432 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1rwf h GLN 433 N 1.21 -0.21 -0.02 1.61 5.75 -1.70 -0.19 115.11 121.56 1rwf h GLN 433 Ca 0.00 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 1rwf h GLN 433 Cb 0.27 0.05 0.00 0.00 1.07 0.00 0.00 27.48 28.87 1rwf h GLN 433 CO 0.00 -0.14 -0.10 0.66 -2.65 0.00 0.00 178.83 176.60 1rwf n TYR 434 N -5.42 0.00 0.02 3.99 4.02 -1.26 -4.35 117.16 114.15 1rwf n TYR 434 Ca 0.02 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 57.99 1rwf n TYR 434 Cb 0.35 -0.01 -0.11 0.00 -0.02 0.00 0.00 39.34 39.55 1rwf n TYR 434 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1rwf n ASP 435 N 0.74 1.58 -4.14 7.72 -0.08 -0.73 -4.41 116.55 117.24 1rwf n ASP 435 Ca 0.14 -0.03 -0.43 0.00 -1.51 0.00 0.00 54.79 52.95 1rwf n ASP 435 Cb 0.51 1.65 0.00 0.00 2.34 0.00 0.00 41.12 45.62 1rwf n ASP 435 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1rwf n ASP 436 N -1.99 5.23 -1.74 1.67 2.03 -0.16 -4.34 116.55 117.25 1rwf n ASP 436 Ca -0.02 -3.07 -0.19 0.00 0.52 0.00 0.00 54.79 52.03 1rwf n ASP 436 Cb 0.38 -1.50 -0.07 0.00 -0.72 0.00 0.00 41.12 39.21 1rwf n ASP 436 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rwf n ALA 437 N 4.43 -0.37 -0.05 -1.67 0.00 -1.26 -4.89 120.51 116.70 1rwf n ALA 437 Ca 0.37 0.27 -0.09 0.00 0.00 0.00 0.00 53.44 54.00 1rwf n ALA 437 Cb 0.39 -1.93 -0.02 0.00 0.00 0.00 0.00 19.45 17.89 1rwf n ALA 437 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1rwf h PHE 438 N 0.00 0.16 0.00 0.00 3.57 -1.77 -1.90 116.94 117.00 1rwf h PHE 438 Ca -0.40 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.11 1rwf h PHE 438 Cb 1.26 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.96 1rwf h PHE 438 CO 0.55 0.09 0.00 0.91 -2.23 0.00 0.00 178.31 177.62 1rwf n TRP 439 N -5.02 0.20 0.07 0.41 7.02 -1.26 -0.74 117.44 118.12 1rwf n TRP 439 Ca -0.02 0.07 0.01 0.00 -1.02 0.00 0.00 57.50 56.53 1rwf n TRP 439 Cb 0.07 -0.61 -0.05 0.00 -2.42 0.00 0.00 31.31 28.31 1rwf n TRP 439 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1rwf h ALA 440 N 2.76 0.64 0.00 6.99 0.00 -1.78 -3.42 119.26 124.45 1rwf h ALA 440 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1rwf h ALA 440 Cb 0.47 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1rwf h ALA 440 CO 0.00 0.83 -0.93 0.25 0.00 0.00 0.00 179.25 179.40 1rwf n THR 441 N -3.03 0.00 -1.52 0.00 -2.24 -0.76 -4.11 114.28 102.63 1rwf n THR 441 Ca -0.05 -0.13 -0.34 0.00 -2.27 0.00 0.00 64.05 61.26 1rwf n THR 441 Cb 0.81 0.55 0.08 0.00 -2.10 0.00 0.00 70.33 69.67 1rwf n THR 441 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rwf s ALA 442 N -1.99 2.19 -0.59 6.98 0.00 0.08 -4.62 121.76 123.80 1rwf s ALA 442 Ca -0.01 0.89 -0.28 0.00 0.00 0.00 0.00 51.96 52.57 1rwf s ALA 442 Cb 0.02 -3.46 0.02 0.00 0.00 0.00 0.00 23.12 19.69 1rwf s ALA 442 CO 0.10 -1.77 1.30 1.21 0.00 0.00 0.00 175.76 176.60 1rwf s ASN 443 N -1.99 6.27 0.00 0.00 3.84 -1.26 -4.88 114.94 116.92 1rwf s ASN 443 Ca 0.75 0.11 0.07 0.00 0.21 0.00 0.00 52.86 54.00 1rwf s ASN 443 Cb -0.29 -2.55 0.31 0.00 -0.55 0.00 0.00 41.25 38.17 1rwf s ASN 443 CO 0.44 -1.63 1.22 -1.22 -2.79 0.00 0.00 177.10 173.12 1rwf n TYR 444 N 9.05 0.00 0.40 0.43 4.02 -1.26 -0.84 117.16 128.96 1rwf n TYR 444 Ca 0.09 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 58.10 1rwf n TYR 444 Cb 0.49 -0.49 0.19 0.00 -0.02 0.00 0.00 39.34 39.52 1rwf n TYR 444 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1rwf n ASN 445 N -1.49 3.38 -2.75 7.72 3.02 -1.26 -4.53 115.26 119.36 1rwf n ASN 445 Ca 0.02 -1.99 -0.04 0.00 -0.03 0.00 0.00 54.58 52.54 1rwf n ASN 445 Cb 0.08 -0.21 0.05 0.00 -0.61 0.00 0.00 39.78 39.09 1rwf n ASN 445 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1rwf n ARG 446 N 1.45 1.46 -2.07 3.52 1.74 -0.02 -4.92 116.66 117.83 1rwf n ARG 446 Ca 0.18 -3.18 -0.36 0.00 -0.77 0.00 0.00 57.85 53.72 1rwf n ARG 446 Cb 0.60 -1.26 0.02 0.00 -1.02 0.00 0.00 32.46 30.81 1rwf n ARG 446 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1rwf s LEU 447 N -3.54 3.74 0.27 0.55 1.43 -1.15 -4.57 118.68 115.41 1rwf s LEU 447 Ca 0.26 2.38 -0.31 0.00 -1.03 0.00 0.00 54.13 55.43 1rwf s LEU 447 Cb 0.39 -4.52 -0.12 0.00 0.03 0.00 0.00 46.19 41.96 1rwf s LEU 447 CO -0.02 -1.45 1.63 -0.81 0.23 0.00 0.00 176.35 175.94 1rwf n PRO 448 N -1.36 2.73 0.00 1.29 -0.04 -1.26 -2.65 135.00 133.71 1rwf n PRO 448 Ca 0.12 0.98 0.00 0.00 -0.04 0.00 0.00 63.50 64.56 1rwf n PRO 448 Cb 0.49 -2.78 0.00 0.00 -0.04 0.00 0.00 33.50 31.17 1rwf n PRO 448 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1rwf n GLY 449 N 2.63 3.28 3.79 0.55 0.00 0.36 -1.07 105.19 114.73 1rwf n GLY 449 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 1rwf n GLY 449 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1rwf s ILE 450 N -2.19 3.66 -0.09 -0.61 -4.36 -1.08 -4.57 121.20 111.95 1rwf s ILE 450 Ca 0.00 0.65 -0.05 0.00 -0.26 0.00 0.00 60.65 60.99 1rwf s ILE 450 Cb 0.00 -3.23 -0.04 0.00 1.25 0.00 0.00 42.46 40.44 1rwf s ILE 450 CO 0.00 -0.59 0.14 -0.89 0.24 0.00 0.00 174.94 173.83 1rwf s THR 451 N -2.71 5.35 -0.14 8.37 2.01 -1.20 -1.14 115.64 126.18 1rwf s THR 451 Ca 0.62 0.05 -0.08 0.00 0.31 0.00 0.00 61.69 62.60 1rwf s THR 451 Cb -0.17 -3.37 0.05 0.00 0.01 0.00 0.00 72.50 69.03 1rwf s THR 451 CO 0.47 0.54 0.34 0.54 -0.69 0.00 0.00 174.62 175.82 1rwf s VAL 452 N -1.09 -0.05 -0.04 3.82 0.11 -0.01 -4.95 120.40 118.18 1rwf s VAL 452 Ca 0.18 0.12 -0.30 0.00 -2.93 0.00 0.00 61.98 59.05 1rwf s VAL 452 Cb -0.12 -0.52 -0.03 0.00 -1.53 0.00 0.00 36.38 34.18 1rwf s VAL 452 CO 0.08 0.05 1.08 -0.62 -3.33 0.00 0.00 175.10 172.36 1rwf s ASP 453 N 1.38 7.20 0.00 3.54 -1.08 -1.26 -0.76 116.67 125.69 1rwf s ASP 453 Ca -0.09 1.72 0.18 0.00 -0.52 0.00 0.00 52.55 53.84 1rwf s ASP 453 Cb -0.09 -2.56 1.07 0.00 -1.46 0.00 0.00 42.92 39.87 1rwf s ASP 453 CO -0.11 -0.44 1.53 0.35 0.52 0.00 0.00 175.17 177.01 1rwf n THR 454 N 4.30 0.00 -1.67 1.71 -2.24 -0.53 -4.79 114.28 111.07 1rwf n THR 454 Ca 0.09 0.00 -0.49 0.00 -2.27 0.00 0.00 64.05 61.37 1rwf n THR 454 Cb 0.48 -0.51 -0.05 0.00 -2.10 0.00 0.00 70.33 68.15 1rwf n THR 454 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1rwf n THR 455 N -0.88 0.26 -1.98 4.28 -1.04 -1.26 -4.92 114.28 108.73 1rwf n THR 455 Ca 0.13 -0.05 -0.41 0.00 -2.04 0.00 0.00 64.05 61.69 1rwf n THR 455 Cb 0.06 -1.51 -0.02 0.00 -1.82 0.00 0.00 70.33 67.04 1rwf n THR 455 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1rwf s PRO 456 N 2.38 4.25 0.05 -2.82 0.02 -1.26 -5.02 135.00 132.59 1rwf s PRO 456 Ca 0.88 2.35 0.04 0.00 0.02 0.00 0.00 61.00 64.29 1rwf s PRO 456 Cb -0.78 -3.08 -0.04 0.00 0.02 0.00 0.00 34.50 30.62 1rwf s PRO 456 CO 0.48 -0.43 -0.05 -0.51 -0.33 0.00 0.00 177.00 176.17 1rwf s LEU 457 N -0.68 3.27 0.55 -5.54 1.43 -1.26 -5.12 118.68 111.33 1rwf s LEU 457 Ca 0.58 -0.19 -0.18 0.00 -1.03 0.00 0.00 54.13 53.32 1rwf s LEU 457 Cb -0.43 -1.96 -0.06 0.00 0.03 0.00 0.00 46.19 43.78 1rwf s LEU 457 CO 0.46 0.23 1.06 -2.16 0.23 0.00 0.00 176.35 176.18 1rwf s PRO 458 N -1.86 3.48 0.34 1.29 0.04 -1.26 -4.98 135.00 132.06 1rwf s PRO 458 Ca 0.21 1.32 -0.27 0.00 0.04 0.00 0.00 61.00 62.30 1rwf s PRO 458 Cb -0.11 -2.05 -0.12 0.00 0.04 0.00 0.00 34.50 32.25 1rwf s PRO 458 CO 0.12 -0.69 1.14 -0.25 0.04 0.00 0.00 177.00 177.36 1rwf n ASP 459 N -1.55 1.96 -0.66 6.66 10.43 -1.26 -1.61 116.55 130.52 1rwf n ASP 459 Ca 0.09 1.16 -0.09 0.00 2.57 0.00 0.00 54.79 58.53 1rwf n ASP 459 Cb 0.52 -1.39 -0.04 0.00 1.84 0.00 0.00 41.12 42.05 1rwf n ASP 459 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1rwf n LYS 460 N 0.51 -0.90 -1.62 -1.24 5.02 -0.21 -4.99 118.16 114.72 1rwf n LYS 460 Ca 0.07 0.74 -0.41 0.00 -2.02 0.00 0.00 58.31 56.70 1rwf n LYS 460 Cb 0.35 -4.70 0.02 0.00 -0.02 0.00 0.00 35.03 30.68 1rwf n LYS 460 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 1rwf n VAL 461 N -2.60 2.59 -0.62 -0.18 3.14 -0.64 -1.11 118.33 118.91 1rwf n VAL 461 Ca -0.09 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.79 1rwf n VAL 461 Cb 0.36 -1.22 0.00 0.00 -1.06 0.00 0.00 33.84 31.92 1rwf n VAL 461 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1rwf n GLU 462 N 0.00 0.00 0.00 1.45 -0.58 -1.26 -4.86 120.64 115.39 1rwf n GLU 462 Ca 0.09 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 1rwf n GLU 462 Cb 0.40 -3.51 0.00 0.00 -0.57 0.00 0.00 31.44 27.77 1rwf n GLU 462 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1rwf n GLY 463 N -2.00 1.05 3.91 0.62 0.00 -0.27 -3.91 105.19 104.59 1rwf n GLY 463 Ca 0.00 -1.85 -0.28 0.00 0.00 0.00 0.00 46.02 43.90 1rwf n GLY 463 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rwf s GLN 464 N -2.62 2.74 -1.74 1.61 -0.21 -1.26 -4.43 119.66 113.75 1rwf s GLN 464 Ca 0.00 0.14 -0.01 0.00 0.02 0.00 0.00 55.36 55.51 1rwf s GLN 464 Cb 0.00 -2.15 0.00 0.00 1.00 0.00 0.00 33.01 31.86 1rwf s GLN 464 CO 0.00 -0.95 0.09 0.91 -2.12 0.00 0.00 175.29 173.22 1rwf n TRP 465 N -2.83 -1.17 -2.34 0.91 7.02 0.31 -2.65 117.44 116.69 1rwf n TRP 465 Ca 0.06 0.08 -0.19 0.00 -1.02 0.00 0.00 57.50 56.43 1rwf n TRP 465 Cb 0.58 -4.03 -0.01 0.00 -2.42 0.00 0.00 31.31 25.43 1rwf n TRP 465 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1rwf n GLY 466 N -1.09 -0.36 0.22 6.99 0.00 -1.25 -4.87 105.19 104.83 1rwf n GLY 466 Ca -0.22 -0.08 0.08 0.00 0.00 0.00 0.00 46.02 45.79 1rwf n GLY 466 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwf h ALA 467 N 0.88 1.16 -3.87 4.61 0.00 -1.76 -3.44 119.26 116.85 1rwf h ALA 467 Ca -0.45 -0.24 -0.68 0.00 0.00 0.00 0.00 54.91 53.53 1rwf h ALA 467 Cb 1.33 -0.04 -0.21 0.00 0.00 0.00 0.00 17.79 18.87 1rwf h ALA 467 CO 0.54 0.34 -0.79 0.00 0.00 0.00 0.00 179.25 179.33 1rwf s ALA 468 N -3.91 2.67 0.10 0.00 0.00 -1.25 -5.12 121.76 114.25 1rwf s ALA 468 Ca -0.01 -1.21 0.06 0.00 0.00 0.00 0.00 51.96 50.80 1rwf s ALA 468 Cb 0.12 -0.77 -0.03 0.00 0.00 0.00 0.00 23.12 22.44 1rwf s ALA 468 CO 0.65 0.58 -0.16 0.14 0.00 0.00 0.00 175.76 176.97 1rwf s VAL 469 N -0.99 1.38 0.17 0.00 -7.23 -1.26 -4.22 120.40 108.25 1rwf s VAL 469 Ca 0.16 -1.51 -0.31 0.00 -1.81 0.00 0.00 61.98 58.51 1rwf s VAL 469 Cb -0.11 -1.37 -0.09 0.00 0.56 0.00 0.00 36.38 35.38 1rwf s VAL 469 CO 0.07 -0.23 1.43 -2.16 -0.31 0.00 0.00 175.10 173.90 1rwf s PRO 470 N -2.07 4.30 -1.40 4.82 0.04 -1.24 -4.90 135.00 134.53 1rwf s PRO 470 Ca 0.04 2.19 -0.13 0.00 0.04 0.00 0.00 61.00 63.14 1rwf s PRO 470 Cb -0.09 -3.18 0.08 0.00 0.04 0.00 0.00 34.50 31.35 1rwf s PRO 470 CO 0.03 -0.44 2.11 0.00 0.04 0.00 0.00 177.00 178.74 1rwf n ALA 471 N 3.32 5.39 -2.02 8.56 0.00 -1.26 -1.96 120.51 132.53 1rwf n ALA 471 Ca 0.10 -4.00 -0.18 0.00 0.00 0.00 0.00 53.44 49.36 1rwf n ALA 471 Cb 0.41 -3.39 0.03 0.00 0.00 0.00 0.00 19.45 16.50 1rwf n ALA 471 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1rwf s ASP 472 N 2.64 5.45 -0.06 0.00 -4.77 -1.26 -4.99 116.67 113.67 1rwf s ASP 472 Ca 0.45 -0.56 -0.27 0.00 -3.30 0.00 0.00 52.55 48.88 1rwf s ASP 472 Cb 0.12 -0.33 -0.22 0.00 -1.09 0.00 0.00 42.92 41.40 1rwf s ASP 472 CO -0.06 -0.98 1.09 -0.33 0.70 0.00 0.00 175.17 175.59 1rwf h GLU 473 N 0.46 0.02 -1.70 2.11 5.08 -1.92 -3.42 114.58 115.21 1rwf h GLU 473 Ca -0.37 -0.02 0.18 0.00 -1.00 0.00 0.00 59.36 58.15 1rwf h GLU 473 Cb 1.28 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 30.34 1rwf h GLU 473 CO 0.44 0.70 0.68 1.67 -1.00 0.00 0.00 179.01 181.49 1rwf s TRP 474 N -3.50 -0.23 0.02 4.33 1.48 -1.26 -4.80 118.94 114.98 1rwf s TRP 474 Ca -0.17 0.22 0.03 0.00 -1.06 0.00 0.00 56.10 55.12 1rwf s TRP 474 Cb 0.00 0.51 -0.01 0.00 -1.16 0.00 0.00 33.47 32.80 1rwf s TRP 474 CO 0.69 -0.32 -0.09 -1.12 -4.06 0.00 0.00 176.95 172.05 1rwf s SER 475 N -1.98 1.04 0.00 -2.66 0.01 -1.26 -1.43 113.70 107.42 1rwf s SER 475 Ca 0.06 -0.33 0.00 0.00 1.31 0.00 0.00 55.95 56.99 1rwf s SER 475 Cb -0.01 -0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.16 1rwf s SER 475 CO -0.05 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.20 1rwf n GLY 476 N 2.23 -1.41 3.49 3.44 0.00 -0.53 -4.80 105.19 107.62 1rwf n GLY 476 Ca -0.17 -0.99 -0.09 0.00 0.00 0.00 0.00 46.02 44.76 1rwf n GLY 476 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwf s ALA 477 N -1.38 -1.72 0.23 4.61 0.00 -1.26 -0.93 121.76 121.30 1rwf s ALA 477 Ca 0.00 0.75 -0.08 0.00 0.00 0.00 0.00 51.96 52.63 1rwf s ALA 477 Cb 0.00 0.61 -0.02 0.00 0.00 0.00 0.00 23.12 23.71 1rwf s ALA 477 CO 0.00 -0.74 0.34 -0.08 0.00 0.00 0.00 175.76 175.28 1rwf s THR 478 N -3.37 0.00 -0.13 0.00 -1.32 -0.09 -4.69 115.64 106.03 1rwf s THR 478 Ca 0.04 -1.65 -0.21 0.00 -1.21 0.00 0.00 61.69 58.66 1rwf s THR 478 Cb -0.01 -2.32 0.05 0.00 -1.51 0.00 0.00 72.50 68.71 1rwf s THR 478 CO -0.10 0.00 0.54 0.00 -2.21 0.00 0.00 174.62 172.85 1rwf s ALA 479 N -4.07 -1.35 -0.11 11.08 0.00 -1.26 -1.08 121.76 124.97 1rwf s ALA 479 Ca 0.29 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.52 1rwf s ALA 479 Cb 0.02 -0.50 0.02 0.00 0.00 0.00 0.00 23.12 22.66 1rwf s ALA 479 CO 0.10 -0.29 -0.10 -1.17 0.00 0.00 0.00 175.76 174.31 1rwf s LEU 480 N -0.37 1.37 0.00 0.00 2.96 -0.14 -4.78 118.68 117.72 1rwf s LEU 480 Ca -0.05 -0.33 0.00 0.00 -0.22 0.00 0.00 54.13 53.52 1rwf s LEU 480 Cb -0.03 -0.90 0.00 0.00 0.50 0.00 0.00 46.19 45.76 1rwf s LEU 480 CO 0.04 -0.08 0.00 0.61 -1.32 0.00 0.00 176.35 175.60 1rwf n GLY 481 N 4.67 3.32 0.19 7.98 0.00 -1.26 -1.88 105.19 118.21 1rwf n GLY 481 Ca -0.15 0.12 0.15 0.00 0.00 0.00 0.00 46.02 46.14 1rwf n GLY 481 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rwf n GLU 482 N 14.00 1.16 -5.19 1.61 1.02 -1.26 -4.74 120.64 127.25 1rwf n GLU 482 Ca 0.00 -0.38 -0.31 0.00 -0.02 0.00 0.00 57.16 56.45 1rwf n GLU 482 Cb 0.00 -1.49 -0.17 0.00 -0.02 0.00 0.00 31.44 29.76 1rwf n GLU 482 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1rwf s VAL 483 N -2.10 2.00 0.14 2.62 1.01 -0.79 -3.14 120.40 120.15 1rwf s VAL 483 Ca 0.41 -0.99 0.07 0.00 0.00 0.00 0.00 61.98 61.46 1rwf s VAL 483 Cb 0.21 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 1rwf s VAL 483 CO 0.38 0.55 -0.05 0.00 0.00 0.00 0.00 175.10 175.98 1rwf s ALA 484 N 0.29 3.10 -0.14 5.51 0.00 -0.19 -0.96 121.76 129.37 1rwf s ALA 484 Ca -0.17 -1.30 0.02 0.00 0.00 0.00 0.00 51.96 50.52 1rwf s ALA 484 Cb -0.17 -0.96 0.01 0.00 0.00 0.00 0.00 23.12 22.00 1rwf s ALA 484 CO 0.08 0.57 -0.21 0.00 0.00 0.00 0.00 175.76 176.20 1rwf s ALA 485 N -1.49 2.20 -0.04 0.00 0.00 -0.24 -1.15 121.76 121.05 1rwf s ALA 485 Ca 0.25 -1.07 0.03 0.00 0.00 0.00 0.00 51.96 51.17 1rwf s ALA 485 Cb -0.10 -0.99 0.00 0.00 0.00 0.00 0.00 23.12 22.03 1rwf s ALA 485 CO 0.16 -0.05 -0.11 0.08 0.00 0.00 0.00 175.76 175.85 1rwf s VAL 486 N 0.85 0.97 0.07 0.00 1.01 -0.02 -0.91 120.40 122.37 1rwf s VAL 486 Ca -0.07 -0.45 0.05 0.00 0.00 0.00 0.00 61.98 61.51 1rwf s VAL 486 Cb -0.15 -0.86 -0.03 0.00 0.00 0.00 0.00 36.38 35.34 1rwf s VAL 486 CO -0.02 0.30 -0.14 -0.83 0.00 0.00 0.00 175.10 174.41 1rwf s GLY 487 N 0.24 0.85 -0.08 4.51 0.00 -0.10 -0.68 107.32 112.05 1rwf s GLY 487 Ca -0.05 -1.00 -0.03 0.00 0.00 0.00 0.00 44.72 43.64 1rwf s GLY 487 CO 0.01 -1.03 0.16 1.62 0.00 0.00 0.00 173.10 173.86 1rwf s GLN 488 N -1.78 0.04 -0.60 2.90 0.74 0.39 -1.45 119.66 119.90 1rwf s GLN 488 Ca -0.02 0.54 -0.27 0.00 0.05 0.00 0.00 55.36 55.66 1rwf s GLN 488 Cb -0.10 -0.26 0.03 0.00 1.10 0.00 0.00 33.01 33.79 1rwf s GLN 488 CO 0.02 -0.29 1.14 -1.58 -0.55 0.00 0.00 175.29 174.04 1rwf s HIS 489 N 2.13 2.59 -0.05 1.67 5.65 -0.51 -1.24 115.29 125.53 1rwf s HIS 489 Ca 0.01 0.20 -0.28 0.00 0.25 0.00 0.00 55.06 55.24 1rwf s HIS 489 Cb -0.12 -4.43 -0.03 0.00 -1.18 0.00 0.00 32.58 26.82 1rwf s HIS 489 CO -0.06 -1.62 0.93 -1.17 -0.65 0.00 0.00 174.74 172.17 1rwf s LEU 490 N 4.84 4.32 -0.17 8.88 2.96 0.18 -4.68 118.68 135.00 1rwf s LEU 490 Ca 0.38 1.52 -0.01 0.00 -0.22 0.00 0.00 54.13 55.80 1rwf s LEU 490 Cb -0.09 -3.46 -0.01 0.00 0.50 0.00 0.00 46.19 43.13 1rwf s LEU 490 CO 0.22 -0.29 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.14 1rwf s VAL 491 N 1.30 2.92 0.54 1.68 1.01 -1.26 -1.88 120.40 124.70 1rwf s VAL 491 Ca 0.48 -0.68 -0.19 0.00 0.00 0.00 0.00 61.98 61.59 1rwf s VAL 491 Cb -0.19 -2.26 -0.06 0.00 0.00 0.00 0.00 36.38 33.86 1rwf s VAL 491 CO 0.23 0.49 1.07 -0.83 0.00 0.00 0.00 175.10 176.06 1rwf s GLY 492 N 0.91 2.42 0.72 4.51 0.00 -0.44 -4.88 107.32 110.57 1rwf s GLY 492 Ca -0.03 0.60 -0.11 0.00 0.00 0.00 0.00 44.72 45.19 1rwf s GLY 492 CO -0.01 0.93 1.07 2.56 0.00 0.00 0.00 173.10 177.65 1rwf s PRO 493 N -3.50 2.69 0.00 2.90 0.04 -1.26 -4.12 135.00 131.75 1rwf s PRO 493 Ca 0.68 0.97 0.00 0.00 0.04 0.00 0.00 61.00 62.69 1rwf s PRO 493 Cb -0.18 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.40 1rwf s PRO 493 CO 0.27 -1.28 0.00 0.41 0.04 0.00 0.00 177.00 176.44 1rwf n GLY 494 N -1.82 0.46 2.44 0.56 0.00 -1.26 -4.19 105.19 101.37 1rwf n GLY 494 Ca 0.08 -0.62 -0.21 0.00 0.00 0.00 0.00 46.02 45.27 1rwf n GLY 494 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rwf n ARG 495 N -2.95 -1.65 0.25 1.61 5.12 -1.26 -4.88 116.66 112.90 1rwf n ARG 495 Ca 0.00 1.05 0.13 0.00 -1.93 0.00 0.00 57.85 57.10 1rwf n ARG 495 Cb 0.00 -5.67 0.59 0.00 -1.16 0.00 0.00 32.46 26.22 1rwf n ARG 495 CO 0.00 0.00 0.00 1.79 -1.93 0.00 0.00 177.63 177.49 1rwf h THR 496 N 0.00 0.40 0.00 0.55 1.35 -1.81 -3.47 112.91 109.93 1rwf h THR 496 Ca -0.48 -0.82 0.00 0.00 -0.55 0.00 0.00 66.41 64.56 1rwf h THR 496 Cb 1.37 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.38 1rwf h THR 496 CO 0.59 0.14 0.00 0.61 -0.25 0.00 0.00 175.52 176.61 1rwf n GLY 497 N -0.09 0.61 3.74 5.82 0.00 -1.26 -1.78 105.19 112.23 1rwf n GLY 497 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1rwf n GLY 497 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1rwf s LEU 498 N 0.00 4.36 0.00 0.99 2.96 -1.26 -3.87 118.68 121.86 1rwf s LEU 498 Ca 0.00 2.88 0.02 0.00 -0.22 0.00 0.00 54.13 56.81 1rwf s LEU 498 Cb 0.00 -3.62 -0.01 0.00 0.50 0.00 0.00 46.19 43.06 1rwf s LEU 498 CO 0.00 -0.91 -0.06 0.28 -1.32 0.00 0.00 176.35 174.34 1rwf s THR 499 N 0.41 0.45 -0.08 3.68 -1.32 -0.39 -1.33 115.64 117.06 1rwf s THR 499 Ca 0.67 -0.32 -0.23 0.00 -1.21 0.00 0.00 61.69 60.60 1rwf s THR 499 Cb -0.48 -0.40 0.05 0.00 -1.51 0.00 0.00 72.50 70.17 1rwf s THR 499 CO 0.42 0.08 0.52 0.00 -2.21 0.00 0.00 174.62 173.43 1rwf s ALA 500 N -0.25 -1.34 -0.38 11.08 0.00 -0.79 -2.25 121.76 127.84 1rwf s ALA 500 Ca 0.01 1.04 -0.06 0.00 0.00 0.00 0.00 51.96 52.95 1rwf s ALA 500 Cb -0.03 -0.20 0.07 0.00 0.00 0.00 0.00 23.12 22.96 1rwf s ALA 500 CO -0.00 -0.31 0.17 1.03 0.00 0.00 0.00 175.76 176.65 1rwf s ARG 501 N -0.86 2.50 -0.15 0.00 0.52 -0.27 -0.65 118.95 120.04 1rwf s ARG 501 Ca -0.09 -1.40 -0.02 0.00 -0.52 0.00 0.00 55.73 53.69 1rwf s ARG 501 Cb -0.03 -3.58 -0.02 0.00 0.52 0.00 0.00 34.95 31.84 1rwf s ARG 501 CO 0.06 -0.84 -0.07 0.15 0.02 0.00 0.00 175.30 174.61 1rwf s LYS 502 N 1.35 3.55 0.12 3.54 1.02 -0.38 -1.14 119.74 127.80 1rwf s LYS 502 Ca 0.01 -0.59 0.05 0.00 0.02 0.00 0.00 55.97 55.47 1rwf s LYS 502 Cb -0.21 -2.80 -0.04 0.00 -0.52 0.00 0.00 37.83 34.26 1rwf s LYS 502 CO 0.01 0.22 -0.13 -1.12 -0.92 0.00 0.00 175.35 173.41 1rwf s SER 503 N 0.37 1.86 -0.05 2.83 0.01 0.07 -0.46 113.70 118.33 1rwf s SER 503 Ca -0.07 -0.82 0.01 0.00 1.31 0.00 0.00 55.95 56.39 1rwf s SER 503 Cb -0.15 -0.05 0.02 0.00 0.21 0.00 0.00 66.02 66.05 1rwf s SER 503 CO 0.04 -0.18 -0.07 0.26 0.41 0.00 0.00 173.24 173.71 1rwf s TRP 504 N -2.25 0.92 -0.20 2.43 0.51 0.14 -1.36 118.94 119.13 1rwf s TRP 504 Ca 0.08 -0.28 0.01 0.00 -2.12 0.00 0.00 56.10 53.79 1rwf s TRP 504 Cb -0.04 -0.75 0.04 0.00 -0.81 0.00 0.00 33.47 31.91 1rwf s TRP 504 CO 0.02 -0.20 -0.11 -0.06 -0.51 0.00 0.00 176.95 176.09 1rwf s PHE 505 N 0.80 2.53 -0.19 -1.98 0.40 0.05 -0.84 117.98 118.75 1rwf s PHE 505 Ca -0.12 -1.68 0.01 0.00 -0.60 0.00 0.00 56.93 54.54 1rwf s PHE 505 Cb -0.15 -1.69 0.03 0.00 0.51 0.00 0.00 43.02 41.72 1rwf s PHE 505 CO 0.01 -0.76 -0.19 0.08 0.70 0.00 0.00 175.22 175.06 1rwf s VAL 506 N 1.36 2.08 0.00 -0.44 1.01 -0.30 -0.65 120.40 123.45 1rwf s VAL 506 Ca -0.02 -1.05 0.00 0.00 0.00 0.00 0.00 61.98 60.91 1rwf s VAL 506 Cb -0.16 -1.93 0.00 0.00 0.00 0.00 0.00 36.38 34.29 1rwf s VAL 506 CO -0.08 0.45 0.00 -1.54 0.00 0.00 0.00 175.10 173.93 1rwf n SER 507 N 4.59 0.00 0.08 3.32 3.41 -0.34 -1.02 113.62 123.66 1rwf n SER 507 Ca -0.20 -0.66 0.09 0.00 -0.26 0.00 0.00 58.87 57.85 1rwf n SER 507 Cb 0.49 0.00 0.41 0.00 -0.26 0.00 0.00 64.21 64.84 1rwf n SER 507 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rwf n GLY 508 N 5.00 -1.12 0.01 5.00 0.00 -1.19 -4.36 105.19 108.54 1rwf n GLY 508 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1rwf n GLY 508 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rwf n ASP 509 N -1.93 1.37 -4.41 1.61 5.68 -1.26 -4.45 116.55 113.16 1rwf n ASP 509 Ca 0.02 0.00 -0.28 0.00 -0.50 0.00 0.00 54.79 54.03 1rwf n ASP 509 Cb 0.19 0.00 -0.12 0.00 -1.14 0.00 0.00 41.12 40.04 1rwf n ASP 509 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1rwf s VAL 510 N -1.35 2.32 -0.20 2.12 1.01 -1.26 -4.37 120.40 118.66 1rwf s VAL 510 Ca 0.00 -1.90 -0.00 0.00 0.00 0.00 0.00 61.98 60.07 1rwf s VAL 510 Cb 0.00 -2.08 0.02 0.00 0.00 0.00 0.00 36.38 34.32 1rwf s VAL 510 CO 0.00 -0.02 -0.14 -0.89 0.00 0.00 0.00 175.10 174.05 1rwf s THR 511 N -1.40 2.45 -0.20 3.92 2.01 -0.50 -1.20 115.64 120.73 1rwf s THR 511 Ca 0.18 -0.92 -0.14 0.00 0.31 0.00 0.00 61.69 61.12 1rwf s THR 511 Cb -0.09 -2.12 -0.04 0.00 0.01 0.00 0.00 72.50 70.26 1rwf s THR 511 CO 0.08 0.42 0.30 -0.69 -0.69 0.00 0.00 174.62 174.04 1rwf s VAL 512 N 1.32 5.28 -0.24 3.82 1.01 0.18 -0.95 120.40 130.81 1rwf s VAL 512 Ca 0.03 0.52 0.00 0.00 0.00 0.00 0.00 61.98 62.54 1rwf s VAL 512 Cb -0.14 -3.64 0.04 0.00 0.00 0.00 0.00 36.38 32.64 1rwf s VAL 512 CO -0.09 0.32 -0.10 0.00 0.00 0.00 0.00 175.10 175.23 1rwf s LEU 514 N 1.25 2.70 -0.00 0.00 1.02 -0.46 -1.48 118.68 121.70 1rwf s LEU 514 Ca -0.02 -0.21 0.02 0.00 0.02 0.00 0.00 54.13 53.94 1rwf s LEU 514 Cb -0.17 -1.54 -0.01 0.00 0.02 0.00 0.00 46.19 44.49 1rwf s LEU 514 CO -0.06 0.35 -0.06 -0.83 0.02 0.00 0.00 176.35 175.76 1rwf s GLY 515 N -0.73 0.31 0.15 -3.19 0.00 -0.12 -0.75 107.32 102.99 1rwf s GLY 515 Ca 0.11 -0.30 -0.12 0.00 0.00 0.00 0.00 44.72 44.42 1rwf s GLY 515 CO 0.00 -0.26 0.33 0.00 0.00 0.00 0.00 173.10 173.18 1rwf s ALA 516 N -0.22 -0.37 -1.37 3.20 0.00 -0.30 -1.34 121.76 121.37 1rwf s ALA 516 Ca 0.02 -0.58 -0.08 0.00 0.00 0.00 0.00 51.96 51.32 1rwf s ALA 516 Cb -0.03 0.76 0.01 0.00 0.00 0.00 0.00 23.12 23.86 1rwf s ALA 516 CO -0.00 -0.65 1.04 -3.47 0.00 0.00 0.00 175.76 172.68 1rwf n ASP 517 N -0.21 -6.25 -4.68 0.00 2.03 -0.78 -1.11 116.55 105.54 1rwf n ASP 517 Ca -0.11 -0.47 -0.40 0.00 0.52 0.00 0.00 54.79 54.33 1rwf n ASP 517 Cb 0.63 -4.92 -0.05 0.00 -0.72 0.00 0.00 41.12 36.06 1rwf n ASP 517 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1rwf s ILE 518 N -3.28 5.02 0.27 5.18 1.01 -0.40 -4.39 121.20 124.61 1rwf s ILE 518 Ca 0.52 1.29 -0.15 0.00 0.00 0.00 0.00 60.65 62.30 1rwf s ILE 518 Cb -0.23 -3.98 0.01 0.00 0.01 0.00 0.00 42.46 38.27 1rwf s ILE 518 CO 0.64 0.14 0.59 -0.94 0.00 0.00 0.00 174.94 175.37 1rwf s SER 519 N 1.06 -0.09 0.24 3.58 1.04 -0.95 -1.24 113.70 117.34 1rwf s SER 519 Ca 0.32 -0.87 -0.12 0.00 0.48 0.00 0.00 55.95 55.77 1rwf s SER 519 Cb -0.16 0.66 -0.01 0.00 0.10 0.00 0.00 66.02 66.61 1rwf s SER 519 CO 0.12 -1.26 0.44 0.28 0.98 0.00 0.00 173.24 173.80 1rwf s THR 520 N -3.80 0.00 -1.60 2.02 -1.32 -1.26 -1.27 115.64 108.41 1rwf s THR 520 Ca 0.18 -1.47 0.14 0.00 -1.21 0.00 0.00 61.69 59.33 1rwf s THR 520 Cb -0.03 -2.23 0.07 0.00 -1.51 0.00 0.00 72.50 68.81 1rwf s THR 520 CO 0.09 -0.00 0.89 0.00 -2.21 0.00 0.00 174.62 173.39 1rwf n ALA 521 N -0.37 2.66 0.20 11.08 0.00 -0.73 -4.69 120.51 128.66 1rwf n ALA 521 Ca -0.01 -0.57 0.09 0.00 0.00 0.00 0.00 53.44 52.95 1rwf n ALA 521 Cb 0.62 -0.48 0.17 0.00 0.00 0.00 0.00 19.45 19.76 1rwf n ALA 521 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1rwf h SER 522 N 2.37 0.00 0.00 0.00 4.64 -1.81 -3.48 113.55 115.27 1rwf h SER 522 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rwf h SER 522 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1rwf h SER 522 CO 0.00 0.16 0.00 0.61 -0.87 0.00 0.00 176.83 176.73 1rwf n GLY 523 N 1.04 1.19 3.95 -0.77 0.00 -1.26 -5.05 105.19 104.29 1rwf n GLY 523 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 1rwf n GLY 523 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwf s ALA 524 N -3.28 3.81 0.64 4.61 0.00 -1.26 -4.70 121.76 121.57 1rwf s ALA 524 Ca 0.00 -1.05 -0.17 0.00 0.00 0.00 0.00 51.96 50.73 1rwf s ALA 524 Cb 0.00 -1.99 -0.01 0.00 0.00 0.00 0.00 23.12 21.12 1rwf s ALA 524 CO 0.00 -0.02 1.21 0.15 0.00 0.00 0.00 175.76 177.10 1rwf s LYS 525 N -4.27 2.72 -0.04 0.00 1.02 -1.26 -4.44 119.74 113.47 1rwf s LYS 525 Ca 0.40 1.79 0.06 0.00 0.02 0.00 0.00 55.97 58.25 1rwf s LYS 525 Cb -0.09 -1.90 -0.02 0.00 -0.52 0.00 0.00 37.83 35.30 1rwf s LYS 525 CO 0.34 -1.40 -0.23 0.08 -0.92 0.00 0.00 175.35 173.23 1rwf s VAL 526 N -1.74 2.30 0.21 3.17 1.01 -1.08 -1.45 120.40 122.82 1rwf s VAL 526 Ca 0.76 -1.00 0.11 0.00 0.00 0.00 0.00 61.98 61.85 1rwf s VAL 526 Cb -0.30 -1.84 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 1rwf s VAL 526 CO 0.37 0.58 -0.22 -1.61 0.00 0.00 0.00 175.10 174.22 1rwf s GLU 527 N -0.49 1.51 -0.06 2.72 2.02 0.06 -0.43 118.70 124.03 1rwf s GLU 527 Ca 0.06 -1.56 0.04 0.00 0.02 0.00 0.00 54.97 53.53 1rwf s GLU 527 Cb -0.11 -1.74 0.00 0.00 0.10 0.00 0.00 34.13 32.38 1rwf s GLU 527 CO 0.01 0.36 -0.17 0.99 0.02 0.00 0.00 175.26 176.47 1rwf s THR 528 N -1.91 1.45 -0.46 3.63 2.01 -0.67 -0.83 115.64 118.84 1rwf s THR 528 Ca 0.22 -0.71 -0.16 0.00 0.31 0.00 0.00 61.69 61.36 1rwf s THR 528 Cb -0.07 -1.26 0.06 0.00 0.01 0.00 0.00 72.50 71.24 1rwf s THR 528 CO 0.10 0.42 0.40 -0.63 -0.69 0.00 0.00 174.62 174.22 1rwf s ILE 529 N 0.22 5.21 0.14 1.82 -1.09 -0.29 -0.51 121.20 126.70 1rwf s ILE 529 Ca -0.08 -0.95 -0.15 0.00 -2.23 0.00 0.00 60.65 57.24 1rwf s ILE 529 Cb -0.13 -4.11 0.02 0.00 -1.58 0.00 0.00 42.46 36.66 1rwf s ILE 529 CO 0.03 -0.55 1.69 0.58 -1.23 0.00 0.00 174.94 175.47 1rwf h VAL 530 N 5.74 1.20 -2.91 2.92 2.07 -1.19 0.10 116.25 124.19 1rwf h VAL 530 Ca -0.28 -0.63 0.01 0.00 0.82 0.00 0.00 66.70 66.62 1rwf h VAL 530 Cb 1.11 0.77 -0.11 0.00 -1.52 0.00 0.00 31.29 31.54 1rwf h VAL 530 CO 0.86 0.24 0.25 -0.62 0.02 0.00 0.00 177.57 178.31 1rwf s ASP 531 N -5.92 -0.48 -0.27 0.57 -1.08 -0.90 -4.39 116.67 104.19 1rwf s ASP 531 Ca -0.13 -0.12 -0.02 0.00 -0.52 0.00 0.00 52.55 51.76 1rwf s ASP 531 Cb 0.11 0.60 0.11 0.00 -1.46 0.00 0.00 42.92 42.28 1rwf s ASP 531 CO 0.76 -1.00 0.23 -2.28 0.52 0.00 0.00 175.17 173.40 1rwf s HIS 532 N -3.71 -0.18 -0.10 -5.34 5.65 -1.25 -0.85 115.29 109.50 1rwf s HIS 532 Ca 0.03 -0.29 0.00 0.00 0.25 0.00 0.00 55.06 55.06 1rwf s HIS 532 Cb -0.02 -0.57 0.02 0.00 -1.18 0.00 0.00 32.58 30.83 1rwf s HIS 532 CO -0.09 -0.81 -0.09 0.50 -0.65 0.00 0.00 174.74 173.60 1rwf s ARG 533 N 2.27 1.63 -0.04 2.88 3.52 -0.03 -4.54 118.95 124.64 1rwf s ARG 533 Ca 0.08 -0.32 -0.30 0.00 -0.13 0.00 0.00 55.73 55.07 1rwf s ARG 533 Cb -0.15 -1.57 -0.06 0.00 -1.56 0.00 0.00 34.95 31.61 1rwf s ARG 533 CO -0.29 -0.18 1.68 1.21 -0.81 0.00 0.00 175.30 176.91 1rwf s ASN 534 N 1.40 6.65 0.00 -2.12 2.47 -1.26 -1.44 114.94 120.64 1rwf s ASN 534 Ca -0.00 2.29 0.24 0.00 0.42 0.00 0.00 52.86 55.80 1rwf s ASN 534 Cb -0.13 -2.53 0.37 0.00 -1.45 0.00 0.00 41.25 37.50 1rwf s ASN 534 CO -0.05 -0.93 1.36 0.18 -3.72 0.00 0.00 177.10 173.94 1rwf n LEU 535 N 7.08 3.18 0.00 3.21 4.77 0.17 -4.95 117.00 130.46 1rwf n LEU 535 Ca 0.17 -1.25 0.00 0.00 -0.03 0.00 0.00 56.01 54.90 1rwf n LEU 535 Cb 0.42 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 1rwf n LEU 535 CO 0.63 0.63 0.00 1.41 -1.33 0.00 0.00 177.39 178.73 1rwf n HIS 536 N 1.37 0.00 -0.61 -1.77 8.25 -1.21 -0.62 115.22 120.62 1rwf n HIS 536 Ca 0.17 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.71 1rwf n HIS 536 Cb 0.59 0.00 0.28 0.00 1.12 0.00 0.00 29.99 31.98 1rwf n HIS 536 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1rwf n GLN 537 N 13.58 3.33 -1.79 -0.41 1.13 -1.26 -1.13 117.38 130.82 1rwf n GLN 537 Ca 0.00 -2.67 -0.31 0.00 -1.94 0.00 0.00 57.00 52.09 1rwf n GLN 537 Cb 0.00 -1.73 0.04 0.00 0.11 0.00 0.00 30.24 28.66 1rwf n GLN 537 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1rwf s GLY 538 N -1.21 1.65 -0.36 1.08 0.00 0.21 -5.00 107.32 103.69 1rwf s GLY 538 Ca 0.42 -0.15 0.05 0.00 0.00 0.00 0.00 44.72 45.04 1rwf s GLY 538 CO 0.18 0.17 1.33 -1.14 0.00 0.00 0.00 173.10 173.64 1rwf n SER 539 N -2.96 5.40 -4.62 1.64 3.41 -1.26 -4.88 113.62 110.35 1rwf n SER 539 Ca 0.07 -3.76 -0.50 0.00 -0.26 0.00 0.00 58.87 54.42 1rwf n SER 539 Cb 0.55 -0.46 -0.05 0.00 -0.26 0.00 0.00 64.21 63.99 1rwf n SER 539 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1rwf n ASN 540 N -0.73 2.11 -4.73 4.04 4.13 -1.26 -4.89 115.26 113.93 1rwf n ASN 540 Ca 0.47 1.10 -0.41 0.00 1.68 0.00 0.00 54.58 57.42 1rwf n ASN 540 Cb 0.90 -1.26 -0.04 0.00 -1.54 0.00 0.00 39.78 37.85 1rwf n ASN 540 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1rwf s THR 541 N 0.78 3.82 -0.48 3.41 2.01 -1.26 -4.74 115.64 119.18 1rwf s THR 541 Ca 0.84 1.50 -0.15 0.00 0.31 0.00 0.00 61.69 64.18 1rwf s THR 541 Cb -0.88 -3.96 0.08 0.00 0.01 0.00 0.00 72.50 67.76 1rwf s THR 541 CO 0.45 0.23 0.41 -0.76 -0.69 0.00 0.00 174.62 174.26 1rwf s LEU 542 N -0.07 5.71 0.08 4.42 1.43 -1.26 -0.57 118.68 128.41 1rwf s LEU 542 Ca 0.52 -1.41 -0.19 0.00 -1.03 0.00 0.00 54.13 52.03 1rwf s LEU 542 Cb -0.30 -2.18 -0.07 0.00 0.03 0.00 0.00 46.19 43.67 1rwf s LEU 542 CO 0.34 -0.68 0.56 -0.89 0.23 0.00 0.00 176.35 175.91 1rwf s THR 543 N 1.63 4.76 0.30 5.49 2.01 0.27 -1.27 115.64 128.83 1rwf s THR 543 Ca 0.04 1.17 0.02 0.00 0.31 0.00 0.00 61.69 63.23 1rwf s THR 543 Cb -0.25 -3.88 -0.05 0.00 0.01 0.00 0.00 72.50 68.33 1rwf s THR 543 CO 0.06 0.53 0.09 0.42 -0.69 0.00 0.00 174.62 175.04 1rwf s THR 544 N -1.14 0.74 0.32 -0.82 -4.23 -0.41 -0.70 115.64 109.40 1rwf s THR 544 Ca 0.29 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.91 1rwf s THR 544 Cb -0.19 -2.65 0.32 0.00 1.34 0.00 0.00 72.50 71.32 1rwf s THR 544 CO 0.19 0.00 1.68 0.00 -0.54 0.00 0.00 174.62 175.95 1rwf h ALA 545 N 2.23 1.75 0.00 3.99 0.00 -1.94 -2.47 119.26 122.82 1rwf h ALA 545 Ca -0.38 0.18 -0.20 0.00 0.00 0.00 0.00 54.91 54.50 1rwf h ALA 545 Cb 1.25 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.15 1rwf h ALA 545 CO 0.62 -0.45 -1.25 0.00 0.00 0.00 0.00 179.25 178.17 1rwf h ALA 546 N 1.79 0.63 0.00 0.00 0.00 -1.96 -3.50 119.26 116.22 1rwf h ALA 546 Ca 0.67 -0.96 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1rwf h ALA 546 Cb 1.41 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1rwf h ALA 546 CO -0.57 1.12 0.00 0.41 0.00 0.00 0.00 179.25 180.21 1rwf n GLY 547 N 1.40 -1.35 3.17 0.00 0.00 -0.93 -5.14 105.19 102.34 1rwf n GLY 547 Ca -0.08 0.59 -0.10 0.00 0.00 0.00 0.00 46.02 46.43 1rwf n GLY 547 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rwf s THR 548 N 0.00 0.41 0.11 2.61 -4.23 -1.26 -1.29 115.64 111.99 1rwf s THR 548 Ca 0.00 -1.92 0.03 0.00 -1.18 0.00 0.00 61.69 58.62 1rwf s THR 548 Cb 0.00 -1.89 -0.04 0.00 1.34 0.00 0.00 72.50 71.90 1rwf s THR 548 CO 0.00 -0.65 -0.08 -0.51 -0.54 0.00 0.00 174.62 172.84 1rwf s ILE 549 N -3.83 0.84 -1.33 2.99 2.07 -0.40 -4.82 121.20 116.72 1rwf s ILE 549 Ca 0.18 -1.92 -0.02 0.00 -1.41 0.00 0.00 60.65 57.49 1rwf s ILE 549 Cb 0.07 -1.67 0.01 0.00 0.13 0.00 0.00 42.46 41.00 1rwf s ILE 549 CO -0.01 -0.80 0.75 0.00 -1.91 0.00 0.00 174.94 172.96 1rwf n ALA 550 N 0.01 -1.93 0.23 1.50 0.00 -1.26 -4.41 120.51 114.65 1rwf n ALA 550 Ca -0.12 -0.12 0.13 0.00 0.00 0.00 0.00 53.44 53.33 1rwf n ALA 550 Cb 0.60 -2.26 0.32 0.00 0.00 0.00 0.00 19.45 18.12 1rwf n ALA 550 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1rwf h GLY 551 N -1.90 0.00 -7.36 0.00 0.00 -1.91 -3.40 103.07 88.50 1rwf h GLY 551 Ca -0.61 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.06 1rwf h GLY 551 CO 0.57 0.00 -0.62 -1.59 0.00 0.00 0.00 176.54 174.90 1rwf s THR 552 N -3.35 4.17 0.18 4.70 2.01 -1.26 -5.07 115.64 117.03 1rwf s THR 552 Ca 0.05 -0.43 -0.33 0.00 0.31 0.00 0.00 61.69 61.28 1rwf s THR 552 Cb 0.06 -3.06 -0.14 0.00 0.01 0.00 0.00 72.50 69.38 1rwf s THR 552 CO 0.64 0.20 1.54 0.00 -0.69 0.00 0.00 174.62 176.31 1rwf n ALA 553 N 4.91 1.34 -0.03 7.40 0.00 -1.26 -2.37 120.51 130.49 1rwf n ALA 553 Ca -0.15 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1rwf n ALA 553 Cb 0.50 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.61 1rwf n ALA 553 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rwf n GLY 554 N 3.13 0.99 3.17 0.00 0.00 0.45 -4.99 105.19 107.94 1rwf n GLY 554 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1rwf n GLY 554 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rwf s THR 555 N -2.37 3.44 0.26 2.61 2.01 -1.00 -5.04 115.64 115.56 1rwf s THR 555 Ca 0.00 -1.75 -0.29 0.00 0.31 0.00 0.00 61.69 59.96 1rwf s THR 555 Cb 0.00 -3.21 -0.09 0.00 0.01 0.00 0.00 72.50 69.20 1rwf s THR 555 CO 0.00 -0.52 1.27 0.54 -0.69 0.00 0.00 174.62 175.22 1rwf s VAL 556 N 1.23 3.08 0.13 3.82 0.11 -1.26 -4.71 120.40 122.79 1rwf s VAL 556 Ca 0.04 0.99 0.08 0.00 -2.93 0.00 0.00 61.98 60.16 1rwf s VAL 556 Cb -0.22 -3.63 -0.04 0.00 -1.53 0.00 0.00 36.38 30.96 1rwf s VAL 556 CO -0.02 0.20 -0.19 -1.61 -3.33 0.00 0.00 175.10 170.15 1rwf s GLU 557 N -1.01 1.17 -0.16 1.54 2.02 -0.27 -4.97 118.70 117.03 1rwf s GLU 557 Ca 0.51 -1.27 -0.07 0.00 0.02 0.00 0.00 54.97 54.16 1rwf s GLU 557 Cb -0.37 -1.31 -0.04 0.00 0.10 0.00 0.00 34.13 32.51 1rwf s GLU 557 CO 0.44 0.28 0.09 0.08 0.02 0.00 0.00 175.26 176.17 1rwf s VAL 558 N -1.64 5.03 0.26 2.63 1.01 -1.26 -0.27 120.40 126.16 1rwf s VAL 558 Ca 0.10 0.04 -0.30 0.00 0.00 0.00 0.00 61.98 61.82 1rwf s VAL 558 Cb -0.08 -3.24 -0.11 0.00 0.00 0.00 0.00 36.38 32.95 1rwf s VAL 558 CO 0.05 0.51 1.60 -0.22 0.00 0.00 0.00 175.10 177.04 1rwf s LEU 559 N -0.06 4.35 0.00 3.92 2.96 -0.23 -5.00 118.68 124.62 1rwf s LEU 559 Ca 0.08 2.89 0.00 0.00 -0.22 0.00 0.00 54.13 56.87 1rwf s LEU 559 Cb -0.12 -3.62 0.00 0.00 0.50 0.00 0.00 46.19 42.95 1rwf s LEU 559 CO 0.01 -0.90 0.00 0.61 -1.32 0.00 0.00 176.35 174.75 1rwf n GLY 560 N 2.60 -3.38 0.01 7.98 0.00 -1.26 -4.74 105.19 106.39 1rwf n GLY 560 Ca 0.10 -0.77 0.10 0.00 0.00 0.00 0.00 46.02 45.45 1rwf n GLY 560 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1rwf n ASP 561 N 0.00 0.25 0.19 1.61 8.00 -1.26 -4.42 116.55 120.91 1rwf n ASP 561 Ca 0.00 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.64 1rwf n ASP 561 Cb 0.00 1.95 0.66 0.00 -0.02 0.00 0.00 41.12 43.71 1rwf n ASP 561 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1rwf h GLY 562 N 3.80 0.00 0.00 0.44 0.00 -1.98 -3.47 103.07 101.87 1rwf h GLY 562 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1rwf h GLY 562 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.08 1rwf n ARG 563 N -2.44 -0.44 -4.26 4.80 1.74 -1.26 -4.97 116.66 109.83 1rwf n ARG 563 Ca -0.01 0.11 -0.21 0.00 -0.77 0.00 0.00 57.85 56.97 1rwf n ARG 563 Cb 0.11 -3.89 -0.12 0.00 -1.02 0.00 0.00 32.46 27.55 1rwf n ARG 563 CO 0.00 0.00 0.00 1.67 -1.52 0.00 0.00 177.63 177.78 1rwf s TRP 564 N -1.90 1.59 -0.04 -1.55 1.48 -1.26 -0.41 118.94 116.85 1rwf s TRP 564 Ca 0.00 -0.46 -0.02 0.00 -1.06 0.00 0.00 56.10 54.56 1rwf s TRP 564 Cb 0.00 -0.85 0.02 0.00 -1.16 0.00 0.00 33.47 31.48 1rwf s TRP 564 CO 0.00 0.18 0.08 0.54 -4.06 0.00 0.00 176.95 173.69 1rwf s VAL 565 N -1.53 -0.03 -0.11 -0.66 0.11 -0.49 -4.32 120.40 113.37 1rwf s VAL 565 Ca 0.07 0.10 0.01 0.00 -2.93 0.00 0.00 61.98 59.22 1rwf s VAL 565 Cb -0.08 -0.14 -0.02 0.00 -1.53 0.00 0.00 36.38 34.61 1rwf s VAL 565 CO 0.04 0.04 -0.14 -2.28 -3.33 0.00 0.00 175.10 169.43 1rwf s HIS 566 N 0.58 2.77 -0.27 1.54 5.04 0.12 -1.27 115.29 123.81 1rwf s HIS 566 Ca -0.04 -0.53 -0.09 0.00 -1.54 0.00 0.00 55.06 52.85 1rwf s HIS 566 Cb -0.06 -1.78 -0.03 0.00 0.04 0.00 0.00 32.58 30.74 1rwf s HIS 566 CO -0.02 -0.12 0.13 -1.17 -2.34 0.00 0.00 174.74 171.22 1rwf s LEU 567 N 0.07 3.74 0.16 8.88 2.96 0.17 -0.57 118.68 134.10 1rwf s LEU 567 Ca -0.06 -0.17 -0.34 0.00 -0.22 0.00 0.00 54.13 53.35 1rwf s LEU 567 Cb -0.15 -2.01 -0.15 0.00 0.50 0.00 0.00 46.19 44.39 1rwf s LEU 567 CO 0.04 -0.06 1.44 1.21 -1.32 0.00 0.00 176.35 177.67 1rwf n GLU 568 N 4.98 1.77 -0.39 1.98 2.13 0.26 -1.40 120.64 129.98 1rwf n GLU 568 Ca -0.15 0.64 0.00 0.00 0.66 0.00 0.00 57.16 58.31 1rwf n GLU 568 Cb 0.51 -2.33 0.00 0.00 0.27 0.00 0.00 31.44 29.90 1rwf n GLU 568 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1rwf n GLY 569 N 2.81 1.34 1.21 8.31 0.00 -1.26 -4.70 105.19 112.90 1rwf n GLY 569 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1rwf n GLY 569 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1rwf n PHE 570 N -2.00 -0.28 -0.53 1.61 7.35 -0.50 -4.90 117.46 118.21 1rwf n PHE 570 Ca 0.00 0.05 0.00 0.00 -0.76 0.00 0.00 57.45 56.74 1rwf n PHE 570 Cb 0.00 0.11 0.00 0.00 0.35 0.00 0.00 39.48 39.94 1rwf n PHE 570 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1rwf n GLY 571 N 3.12 0.43 3.50 7.13 0.00 -0.90 -0.20 105.19 118.28 1rwf n GLY 571 Ca 0.00 -1.48 -0.27 0.00 0.00 0.00 0.00 46.02 44.27 1rwf n GLY 571 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rwf s GLY 572 N 0.00 1.71 0.01 -0.02 0.00 -0.68 -0.65 107.32 107.69 1rwf s GLY 572 Ca 0.00 -1.50 0.04 0.00 0.00 0.00 0.00 44.72 43.26 1rwf s GLY 572 CO 0.00 -1.51 -0.11 -0.19 0.00 0.00 0.00 173.10 171.29 1rwf s TYR 573 N -1.54 0.97 -0.07 1.90 1.51 -0.39 -0.53 117.35 119.19 1rwf s TYR 573 Ca 0.22 -0.27 -0.08 0.00 -1.01 0.00 0.00 57.07 55.93 1rwf s TYR 573 Cb -0.09 -0.60 0.02 0.00 -0.11 0.00 0.00 41.96 41.18 1rwf s TYR 573 CO 0.12 -0.00 0.21 0.00 -1.11 0.00 0.00 175.55 174.76 1rwf s ALA 574 N -0.57 -0.51 0.05 3.71 0.00 -0.56 -1.40 121.76 122.49 1rwf s ALA 574 Ca 0.02 0.50 -0.28 0.00 0.00 0.00 0.00 51.96 52.20 1rwf s ALA 574 Cb -0.06 -0.28 -0.05 0.00 0.00 0.00 0.00 23.12 22.73 1rwf s ALA 574 CO 0.00 -0.12 0.88 -1.64 0.00 0.00 0.00 175.76 174.88 1rwf s MET 575 N -0.11 4.59 -0.04 0.00 -1.94 0.45 -0.62 119.30 121.63 1rwf s MET 575 Ca -0.02 1.27 0.18 0.00 -1.71 0.00 0.00 55.69 55.41 1rwf s MET 575 Cb -0.02 -3.39 0.57 0.00 2.01 0.00 0.00 34.83 33.99 1rwf s MET 575 CO 0.01 0.18 1.48 1.28 -0.01 0.00 0.00 175.02 177.95 1rwf n LEU 576 N 3.07 3.88 0.00 -0.03 4.77 0.15 -4.94 117.00 123.90 1rwf n LEU 576 Ca 0.01 -2.18 -0.06 0.00 -0.03 0.00 0.00 56.01 53.76 1rwf n LEU 576 Cb 0.50 -0.45 -0.02 0.00 -2.33 0.00 0.00 43.42 41.13 1rwf n LEU 576 CO 0.50 0.86 0.03 -0.90 -1.33 0.00 0.00 177.39 176.54 1rwf n ASP 577 N 1.07 -0.40 -1.78 -1.43 5.68 -1.23 -4.90 116.55 113.56 1rwf n ASP 577 Ca 0.21 -1.70 0.07 0.00 -0.50 0.00 0.00 54.79 52.86 1rwf n ASP 577 Cb 0.65 0.79 0.37 0.00 -1.14 0.00 0.00 41.12 41.79 1rwf n ASP 577 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1rwf n ASP 578 N -2.17 5.35 -4.77 -1.12 5.75 -1.26 -4.97 116.55 113.36 1rwf n ASP 578 Ca 0.01 -2.83 -0.38 0.00 -0.01 0.00 0.00 54.79 51.57 1rwf n ASP 578 Cb 0.21 -0.67 -0.02 0.00 -1.03 0.00 0.00 41.12 39.61 1rwf n ASP 578 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1rwf s SER 579 N -0.73 6.55 0.25 -1.12 0.01 -1.26 -4.99 113.70 112.41 1rwf s SER 579 Ca 0.50 2.34 -0.30 0.00 1.31 0.00 0.00 55.95 59.81 1rwf s SER 579 Cb 0.38 -2.61 -0.10 0.00 0.21 0.00 0.00 66.02 63.90 1rwf s SER 579 CO 0.15 -0.66 1.47 -2.84 0.41 0.00 0.00 173.24 171.77 1rwf s PRO 580 N -2.28 4.24 -0.28 12.44 0.02 -1.26 -5.01 135.00 142.87 1rwf s PRO 580 Ca 0.57 2.34 -0.09 0.00 0.02 0.00 0.00 61.00 63.83 1rwf s PRO 580 Cb -0.31 -3.10 -0.03 0.00 0.02 0.00 0.00 34.50 31.08 1rwf s PRO 580 CO 0.38 -0.46 0.14 -1.17 -0.33 0.00 0.00 177.00 175.56 1rwf s LEU 581 N -0.27 3.87 -0.06 -5.54 2.96 -1.26 -4.50 118.68 113.88 1rwf s LEU 581 Ca 0.61 -0.26 -0.21 0.00 -0.22 0.00 0.00 54.13 54.04 1rwf s LEU 581 Cb -0.43 -2.02 -0.04 0.00 0.50 0.00 0.00 46.19 44.20 1rwf s LEU 581 CO 0.43 -0.10 0.62 -1.00 -1.32 0.00 0.00 176.35 174.98 1rwf s HIS 582 N 1.66 3.59 -0.11 5.38 3.76 -0.06 -1.07 115.29 128.45 1rwf s HIS 582 Ca 0.06 1.15 0.02 0.00 -0.15 0.00 0.00 55.06 56.14 1rwf s HIS 582 Cb -0.16 -2.69 0.01 0.00 1.11 0.00 0.00 32.58 30.86 1rwf s HIS 582 CO 0.07 0.19 -0.16 0.08 -0.85 0.00 0.00 174.74 174.07 1rwf s VAL 583 N 0.46 1.55 -0.10 -0.90 1.01 0.63 -0.97 120.40 122.07 1rwf s VAL 583 Ca 0.33 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.63 1rwf s VAL 583 Cb -0.17 -1.40 0.02 0.00 0.00 0.00 0.00 36.38 34.83 1rwf s VAL 583 CO 0.16 0.45 -0.09 -0.22 0.00 0.00 0.00 175.10 175.40 1rwf s LEU 584 N 0.91 1.35 -0.16 3.92 2.96 0.13 -1.11 118.68 126.67 1rwf s LEU 584 Ca -0.08 -0.32 -0.18 0.00 -0.22 0.00 0.00 54.13 53.33 1rwf s LEU 584 Cb -0.15 -0.87 -0.04 0.00 0.50 0.00 0.00 46.19 45.63 1rwf s LEU 584 CO -0.01 -0.07 0.47 -0.60 -1.32 0.00 0.00 176.35 174.82 1rwf s ARG 585 N 1.42 4.25 0.03 1.98 3.52 -1.26 -0.62 118.95 128.28 1rwf s ARG 585 Ca 0.00 0.39 -0.02 0.00 -0.13 0.00 0.00 55.73 55.96 1rwf s ARG 585 Cb -0.13 -3.50 -0.02 0.00 -1.56 0.00 0.00 34.95 29.74 1rwf s ARG 585 CO -0.06 0.01 0.02 -1.83 -0.81 0.00 0.00 175.30 172.64 1rwf s GLU 586 N 1.11 0.50 -0.18 5.12 -1.05 -0.30 -0.41 118.70 123.48 1rwf s GLU 586 Ca 0.24 -0.82 -0.04 0.00 -0.15 0.00 0.00 54.97 54.19 1rwf s GLU 586 Cb -0.15 0.18 -0.02 0.00 -0.44 0.00 0.00 34.13 33.70 1rwf s GLU 586 CO 0.09 -0.10 -0.03 0.99 0.95 0.00 0.00 175.26 177.16 1rwf s THR 587 N -2.55 3.79 0.11 1.83 2.01 -1.26 -0.35 115.64 119.22 1rwf s THR 587 Ca -0.06 -0.38 0.10 0.00 0.31 0.00 0.00 61.69 61.67 1rwf s THR 587 Cb -0.02 -2.69 -0.04 0.00 0.01 0.00 0.00 72.50 69.77 1rwf s THR 587 CO -0.05 0.46 -0.26 -0.13 -0.69 0.00 0.00 174.62 173.95 1rwf s ARG 588 N 0.79 1.43 0.09 4.92 0.52 0.33 -4.97 118.95 122.05 1rwf s ARG 588 Ca -0.01 -1.29 0.06 0.00 -0.52 0.00 0.00 55.73 53.97 1rwf s ARG 588 Cb -0.14 -1.86 -0.03 0.00 0.52 0.00 0.00 34.95 33.44 1rwf s ARG 588 CO 0.02 0.45 -0.15 -1.12 0.02 0.00 0.00 175.30 174.51 1rwf s SER 589 N -1.92 1.88 -0.16 0.23 0.01 -1.26 -0.76 113.70 111.73 1rwf s SER 589 Ca 0.13 -0.67 -0.35 0.00 1.31 0.00 0.00 55.95 56.38 1rwf s SER 589 Cb -0.10 -0.07 0.14 0.00 0.21 0.00 0.00 66.02 66.21 1rwf s SER 589 CO 0.05 -0.07 1.35 -0.83 0.41 0.00 0.00 173.24 174.15 1rwf s GLY 590 N -1.91 -0.35 0.21 3.44 0.00 -0.20 -4.85 107.32 103.66 1rwf s GLY 590 Ca 0.02 1.34 0.08 0.00 0.00 0.00 0.00 44.72 46.15 1rwf s GLY 590 CO 0.03 0.38 0.05 -1.35 0.00 0.00 0.00 173.10 172.21 1rwf s SER 591 N -2.53 4.93 0.51 1.64 1.04 -1.26 -0.38 113.70 117.65 1rwf s SER 591 Ca 0.13 -0.40 0.24 0.00 0.48 0.00 0.00 55.95 56.39 1rwf s SER 591 Cb 0.03 -1.09 1.35 0.00 0.10 0.00 0.00 66.02 66.41 1rwf s SER 591 CO -0.04 0.04 2.06 -0.50 0.98 0.00 0.00 173.24 175.78 1rwf h TRP 592 N 2.25 0.00 0.00 5.02 4.06 -1.71 -1.04 115.95 124.53 1rwf h TRP 592 Ca -0.47 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.48 1rwf h TRP 592 Cb 1.22 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.38 1rwf h TRP 592 CO 0.62 0.13 -0.01 0.66 -3.56 0.00 0.00 178.44 176.29 1rwf h SER 593 N 0.00 0.00 1.21 -3.49 4.64 -1.13 -1.30 113.55 113.48 1rwf h SER 593 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rwf h SER 593 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1rwf h SER 593 CO 0.02 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 1rwf n GLY 594 N -0.97 -1.56 0.00 -0.77 0.00 -0.40 -3.71 105.19 97.78 1rwf n GLY 594 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1rwf n GLY 594 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1rwf n VAL 595 N -2.15 0.00 -3.68 1.61 0.24 -0.58 -4.97 118.33 108.79 1rwf n VAL 595 Ca 0.05 -0.48 -0.09 0.00 -2.04 0.00 0.00 64.34 61.77 1rwf n VAL 595 Cb 0.36 1.03 -0.10 0.00 -1.47 0.00 0.00 33.84 33.66 1rwf n VAL 595 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1rwf s ASN 596 N -0.26 -0.62 0.60 -1.34 3.84 -0.66 -2.59 114.94 113.91 1rwf s ASN 596 Ca 0.00 1.06 0.30 0.00 0.21 0.00 0.00 52.86 54.43 1rwf s ASN 596 Cb 0.00 0.97 1.67 0.00 -0.55 0.00 0.00 41.25 43.34 1rwf s ASN 596 CO 0.00 -0.21 2.07 -0.29 -2.79 0.00 0.00 177.10 175.89 1rwf h ILE 597 N 5.46 0.40 -0.02 -5.21 6.09 -1.41 -0.48 117.51 122.33 1rwf h ILE 597 Ca -0.34 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.15 1rwf h ILE 597 Cb 1.19 0.80 0.00 0.00 0.47 0.00 0.00 36.82 39.28 1rwf h ILE 597 CO 0.25 0.00 -0.14 0.59 -3.07 0.00 0.00 178.15 175.79 1rwf n ASN 598 N -3.68 2.13 -4.78 2.19 3.02 -1.26 -4.99 115.26 107.88 1rwf n ASN 598 Ca 0.02 -1.61 -0.34 0.00 -0.03 0.00 0.00 54.58 52.62 1rwf n ASN 598 Cb 0.36 0.12 0.01 0.00 -0.61 0.00 0.00 39.78 39.66 1rwf n ASN 598 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1rwf s GLY 599 N -2.17 2.40 0.74 7.41 0.00 -0.19 -4.96 107.32 110.55 1rwf s GLY 599 Ca 0.28 0.65 -0.13 0.00 0.00 0.00 0.00 44.72 45.52 1rwf s GLY 599 CO 0.40 0.99 1.14 -1.35 0.00 0.00 0.00 173.10 174.28 1rwf s SER 600 N -2.20 4.39 0.11 1.64 1.04 -1.26 -3.65 113.70 113.77 1rwf s SER 600 Ca 0.69 2.08 0.26 0.00 0.48 0.00 0.00 55.95 59.47 1rwf s SER 600 Cb -0.21 -2.56 0.75 0.00 0.10 0.00 0.00 66.02 64.10 1rwf s SER 600 CO 0.32 -2.12 1.65 0.00 0.98 0.00 0.00 173.24 174.07 1rwf n ALA 601 N -3.03 2.62 -1.61 5.32 0.00 -1.26 -0.99 120.51 121.56 1rwf n ALA 601 Ca 0.11 -0.14 -0.50 0.00 0.00 0.00 0.00 53.44 52.91 1rwf n ALA 601 Cb 0.52 -1.35 -0.05 0.00 0.00 0.00 0.00 19.45 18.57 1rwf n ALA 601 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1rwf n THR 602 N -1.96 0.29 -3.12 0.00 -1.04 -1.26 -4.82 114.28 102.37 1rwf n THR 602 Ca 0.05 -0.07 -0.40 0.00 -2.04 0.00 0.00 64.05 61.59 1rwf n THR 602 Cb 0.40 -1.01 -0.06 0.00 -1.82 0.00 0.00 70.33 67.84 1rwf n THR 602 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1rwf s VAL 603 N 0.36 5.03 -0.09 12.58 1.01 -1.26 -4.22 120.40 133.81 1rwf s VAL 603 Ca 0.79 1.20 -0.05 0.00 0.00 0.00 0.00 61.98 63.92 1rwf s VAL 603 Cb -0.85 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 31.54 1rwf s VAL 603 CO 0.47 0.14 0.11 -1.10 0.00 0.00 0.00 175.10 174.72 1rwf s GLN 604 N 1.69 3.32 -0.08 2.72 -1.52 0.49 -4.93 119.66 121.36 1rwf s GLN 604 Ca 0.30 -0.23 0.03 0.00 -1.95 0.00 0.00 55.36 53.50 1rwf s GLN 604 Cb -0.16 -3.08 0.01 0.00 -0.22 0.00 0.00 33.01 29.56 1rwf s GLN 604 CO 0.11 0.74 -0.17 -1.14 -0.25 0.00 0.00 175.29 174.59 1rwf s GLN 605 N -1.15 2.18 0.01 2.91 0.74 -1.26 -1.04 119.66 122.06 1rwf s GLN 605 Ca 0.17 -0.59 -0.01 0.00 0.05 0.00 0.00 55.36 54.98 1rwf s GLN 605 Cb -0.12 -1.73 -0.01 0.00 1.10 0.00 0.00 33.01 32.25 1rwf s GLN 605 CO 0.06 0.09 -0.01 1.03 -0.55 0.00 0.00 175.29 175.91 1rwf s ARG 606 N 0.52 0.26 0.09 1.67 1.81 0.06 -4.93 118.95 118.43 1rwf s ARG 606 Ca -0.16 -0.46 -0.16 0.00 -1.72 0.00 0.00 55.73 53.24 1rwf s ARG 606 Cb -0.16 0.09 -0.07 0.00 -0.45 0.00 0.00 34.95 34.36 1rwf s ARG 606 CO 0.06 -0.04 0.53 -0.80 -0.68 0.00 0.00 175.30 174.36 1rwf s ASN 607 N -1.13 6.91 0.08 0.23 0.01 -0.29 -0.51 114.94 120.25 1rwf s ASN 607 Ca -0.12 1.13 0.05 0.00 -0.71 0.00 0.00 52.86 53.20 1rwf s ASN 607 Cb -0.08 -2.31 -0.03 0.00 0.41 0.00 0.00 41.25 39.25 1rwf s ASN 607 CO -0.01 0.21 -0.13 -0.36 -1.51 0.00 0.00 177.10 175.31 1rwf s PHE 608 N -1.26 1.15 -0.18 2.20 0.40 0.52 0.45 117.98 121.27 1rwf s PHE 608 Ca 0.32 -0.51 -0.06 0.00 -0.60 0.00 0.00 56.93 56.08 1rwf s PHE 608 Cb -0.17 -0.64 -0.03 0.00 0.51 0.00 0.00 43.02 42.68 1rwf s PHE 608 CO 0.18 0.04 0.02 0.00 0.70 0.00 0.00 175.22 176.16 1rwf s ALA 609 N -1.58 3.19 -0.16 5.36 0.00 -0.52 -1.16 121.76 126.89 1rwf s ALA 609 Ca -0.00 -0.84 -0.00 0.00 0.00 0.00 0.00 51.96 51.11 1rwf s ALA 609 Cb -0.08 -1.79 0.03 0.00 0.00 0.00 0.00 23.12 21.28 1rwf s ALA 609 CO 0.02 0.08 -0.09 0.99 0.00 0.00 0.00 175.76 176.76 1rwf s THR 610 N 0.58 1.31 -0.11 0.00 2.01 0.20 -0.85 115.64 118.78 1rwf s THR 610 Ca 0.01 -0.64 0.03 0.00 0.31 0.00 0.00 61.69 61.40 1rwf s THR 610 Cb -0.14 -1.37 0.00 0.00 0.01 0.00 0.00 72.50 71.01 1rwf s THR 610 CO 0.02 0.27 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.23 1rwf s LEU 611 N 1.57 2.06 0.10 4.42 1.02 -0.03 -0.69 118.68 127.11 1rwf s LEU 611 Ca 0.02 -0.56 -0.16 0.00 0.02 0.00 0.00 54.13 53.46 1rwf s LEU 611 Cb -0.14 -1.38 0.03 0.00 0.02 0.00 0.00 46.19 44.72 1rwf s LEU 611 CO -0.09 0.12 0.38 -0.72 0.02 0.00 0.00 176.35 176.07 1rwf s TYR 612 N 0.52 -0.18 -0.04 0.29 -0.85 -0.14 -0.60 117.35 116.35 1rwf s TYR 612 Ca -0.15 -0.06 -0.01 0.00 -0.52 0.00 0.00 57.07 56.33 1rwf s TYR 612 Cb -0.17 0.21 -0.04 0.00 0.38 0.00 0.00 41.96 42.34 1rwf s TYR 612 CO 0.05 -0.64 0.04 0.14 -1.52 0.00 0.00 175.55 173.62 1rwf s VAL 613 N -3.38 4.55 -0.28 -3.49 -7.23 0.33 -0.88 120.40 110.02 1rwf s VAL 613 Ca 0.00 -0.33 -0.07 0.00 -1.81 0.00 0.00 61.98 59.77 1rwf s VAL 613 Cb 0.01 -3.01 -0.00 0.00 0.56 0.00 0.00 36.38 33.94 1rwf s VAL 613 CO -0.09 0.47 0.07 0.21 -0.31 0.00 0.00 175.10 175.45 1rwf s ASN 614 N -1.35 5.09 0.00 4.85 3.84 -1.26 -1.68 114.94 124.43 1rwf s ASN 614 Ca 0.18 -0.54 0.28 0.00 0.21 0.00 0.00 52.86 52.99 1rwf s ASN 614 Cb -0.12 -1.89 1.13 0.00 -0.55 0.00 0.00 41.25 39.83 1rwf s ASN 614 CO 0.08 -0.14 1.81 1.41 -2.79 0.00 0.00 177.10 177.48 1rwf n HIS 615 N 4.88 0.00 -2.44 0.43 8.25 0.42 -5.01 115.22 121.76 1rwf n HIS 615 Ca -0.15 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.32 1rwf n HIS 615 Cb 0.49 -0.24 -0.00 0.00 1.12 0.00 0.00 29.99 31.35 1rwf n HIS 615 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1rwf n GLY 616 N 1.34 -2.04 3.78 -1.41 0.00 -1.24 -4.39 105.19 101.23 1rwf n GLY 616 Ca 0.12 -1.41 -0.38 0.00 0.00 0.00 0.00 46.02 44.35 1rwf n GLY 616 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rwf s VAL 617 N -0.53 4.29 -1.37 1.61 1.01 -1.26 -2.63 120.40 121.51 1rwf s VAL 617 Ca 0.00 1.73 -0.05 0.00 0.00 0.00 0.00 61.98 63.66 1rwf s VAL 617 Cb 0.00 -4.06 0.03 0.00 0.00 0.00 0.00 36.38 32.35 1rwf s VAL 617 CO 0.00 0.30 0.87 0.61 0.00 0.00 0.00 175.10 176.88 1rwf n GLY 618 N 0.97 -0.39 3.77 4.51 0.00 -1.26 -4.93 105.19 107.85 1rwf n GLY 618 Ca -0.01 0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 1rwf n GLY 618 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1rwf s PRO 619 N -6.15 3.67 -0.25 1.61 0.04 -1.26 -4.98 135.00 127.68 1rwf s PRO 619 Ca 0.27 2.43 0.01 0.00 0.04 0.00 0.00 61.00 63.74 1rwf s PRO 619 Cb -0.13 -2.65 0.04 0.00 0.04 0.00 0.00 34.50 31.80 1rwf s PRO 619 CO 0.80 -0.84 -0.10 0.08 0.04 0.00 0.00 177.00 176.98 1rwf s VAL 620 N -1.20 2.45 -1.41 -0.36 1.01 -1.26 -4.49 120.40 115.13 1rwf s VAL 620 Ca 0.61 -1.29 -0.00 0.00 0.00 0.00 0.00 61.98 61.30 1rwf s VAL 620 Cb -0.44 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 33.64 1rwf s VAL 620 CO 0.56 0.14 0.39 0.00 0.00 0.00 0.00 175.10 176.19 1rwf n ALA 621 N 4.56 -2.02 -0.89 5.51 0.00 -1.18 -4.93 120.51 121.56 1rwf n ALA 621 Ca -0.16 -0.28 -0.32 0.00 0.00 0.00 0.00 53.44 52.67 1rwf n ALA 621 Cb 0.45 -1.44 0.14 0.00 0.00 0.00 0.00 19.45 18.61 1rwf n ALA 621 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rwf n GLY 622 N -2.02 -0.44 3.43 0.00 0.00 -0.38 -4.33 105.19 101.45 1rwf n GLY 622 Ca -0.31 -0.61 -0.10 0.00 0.00 0.00 0.00 46.02 45.00 1rwf n GLY 622 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1rwf s SER 623 N -2.31 -0.16 0.15 1.61 1.04 -1.26 -1.27 113.70 111.49 1rwf s SER 623 Ca 0.69 -0.57 -0.11 0.00 0.48 0.00 0.00 55.95 56.44 1rwf s SER 623 Cb -0.26 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.38 1rwf s SER 623 CO 0.56 -0.97 0.32 -0.72 0.98 0.00 0.00 173.24 173.40 1rwf s TYR 624 N -3.89 0.18 -0.26 5.02 -0.85 -0.45 -4.95 117.35 112.16 1rwf s TYR 624 Ca 0.10 -0.55 -0.07 0.00 -0.52 0.00 0.00 57.07 56.03 1rwf s TYR 624 Cb 0.01 0.05 0.13 0.00 0.38 0.00 0.00 41.96 42.53 1rwf s TYR 624 CO -0.04 -0.71 0.54 0.00 -1.52 0.00 0.00 175.55 173.82 1rwf s ALA 625 N -3.91 -1.70 0.29 9.51 0.00 -1.26 -0.95 121.76 123.74 1rwf s ALA 625 Ca 0.11 1.83 -0.13 0.00 0.00 0.00 0.00 51.96 53.77 1rwf s ALA 625 Cb 0.03 -1.70 0.01 0.00 0.00 0.00 0.00 23.12 21.46 1rwf s ALA 625 CO -0.04 -0.99 0.56 1.52 0.00 0.00 0.00 175.76 176.81 1rwf s TYR 626 N 2.76 0.33 0.04 0.00 -0.85 -0.55 -0.68 117.35 118.41 1rwf s TYR 626 Ca 0.02 -0.74 -0.00 0.00 -0.52 0.00 0.00 57.07 55.83 1rwf s TYR 626 Cb -0.13 0.33 -0.03 0.00 0.38 0.00 0.00 41.96 42.51 1rwf s TYR 626 CO -0.17 -1.14 -0.03 0.00 -1.52 0.00 0.00 175.55 172.69 1rwf s MET 627 N -3.63 0.54 -0.06 -3.49 0.23 0.21 -0.22 119.30 112.89 1rwf s MET 627 Ca 0.21 -1.05 0.04 0.00 -1.03 0.00 0.00 55.69 53.85 1rwf s MET 627 Cb -0.02 0.14 0.00 0.00 -1.53 0.00 0.00 34.83 33.42 1rwf s MET 627 CO 0.11 -0.08 -0.17 0.08 -2.03 0.00 0.00 175.02 172.92 1rwf s VAL 628 N -3.17 1.47 -0.59 5.16 1.01 -0.12 -1.49 120.40 122.67 1rwf s VAL 628 Ca 0.01 -0.71 0.04 0.00 0.00 0.00 0.00 61.98 61.32 1rwf s VAL 628 Cb 0.02 -1.28 0.17 0.00 0.00 0.00 0.00 36.38 35.29 1rwf s VAL 628 CO -0.07 0.43 0.42 0.00 0.00 0.00 0.00 175.10 175.88 1rwf s ALA 629 N 0.25 2.91 0.32 5.51 0.00 0.31 -1.41 121.76 129.65 1rwf s ALA 629 Ca -0.09 -3.30 -0.29 0.00 0.00 0.00 0.00 51.96 48.28 1rwf s ALA 629 Cb -0.14 -1.96 -0.11 0.00 0.00 0.00 0.00 23.12 20.91 1rwf s ALA 629 CO 0.04 -2.05 1.56 -1.25 0.00 0.00 0.00 175.76 174.05 1rwf s PRO 630 N -0.83 4.12 0.00 0.00 0.04 -1.26 -1.69 135.00 135.38 1rwf s PRO 630 Ca 0.27 2.57 0.00 0.00 0.04 0.00 0.00 61.00 63.88 1rwf s PRO 630 Cb -0.03 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.50 1rwf s PRO 630 CO -0.16 -0.60 0.00 0.41 0.04 0.00 0.00 177.00 176.69 1rwf n GLY 631 N 1.66 1.97 3.76 0.56 0.00 0.73 -4.92 105.19 108.94 1rwf n GLY 631 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1rwf n GLY 631 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwf s ALA 632 N -3.45 3.48 0.96 4.61 0.00 -0.85 -4.88 121.76 121.63 1rwf s ALA 632 Ca 0.00 1.14 -0.12 0.00 0.00 0.00 0.00 51.96 52.98 1rwf s ALA 632 Cb 0.00 -3.44 0.17 0.00 0.00 0.00 0.00 23.12 19.85 1rwf s ALA 632 CO 0.00 -0.49 1.09 -1.54 0.00 0.00 0.00 175.76 174.81 1rwf s SER 633 N -0.42 2.86 0.24 0.00 1.04 -1.26 -4.17 113.70 111.99 1rwf s SER 633 Ca 0.49 1.41 -0.05 0.00 0.48 0.00 0.00 55.95 58.29 1rwf s SER 633 Cb -0.37 -2.09 0.41 0.00 0.10 0.00 0.00 66.02 64.07 1rwf s SER 633 CO 0.47 -3.01 1.74 0.58 0.98 0.00 0.00 173.24 174.00 1rwf h VAL 634 N -1.81 0.72 -0.45 5.02 2.07 -1.96 -0.39 116.25 119.45 1rwf h VAL 634 Ca -0.52 -0.17 -0.06 0.00 0.82 0.00 0.00 66.70 66.77 1rwf h VAL 634 Cb 1.30 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1rwf h VAL 634 CO 0.55 0.09 0.07 -0.78 0.02 0.00 0.00 177.57 177.51 1rwf h ASP 635 N 0.48 0.73 -0.33 0.57 3.58 -1.99 -0.97 116.42 118.49 1rwf h ASP 635 Ca 0.39 -0.27 -0.12 0.00 0.42 0.00 0.00 57.03 57.45 1rwf h ASP 635 Cb 0.54 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.38 1rwf h ASP 635 CO -0.36 0.81 -0.25 0.25 -2.88 0.00 0.00 179.24 176.81 1rwf h LEU 636 N 0.62 0.86 -0.27 2.28 5.85 -1.88 -2.65 115.31 120.11 1rwf h LEU 636 Ca 0.14 -0.33 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 1rwf h LEU 636 Cb 0.40 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1rwf h LEU 636 CO 0.01 1.06 0.12 0.74 -0.34 0.00 0.00 178.44 180.03 1rwf h THR 637 N 0.72 1.16 -0.66 1.05 2.02 -0.74 -2.15 112.91 114.31 1rwf h THR 637 Ca 0.09 -0.49 0.16 0.00 0.77 0.00 0.00 66.41 66.94 1rwf h THR 637 Cb 0.78 0.99 -0.04 0.00 -1.74 0.00 0.00 68.15 68.15 1rwf h THR 637 CO 0.06 0.17 0.45 -0.09 0.37 0.00 0.00 175.52 176.49 1rwf h ARG 638 N 0.29 0.18 -0.00 6.66 2.43 -1.04 -2.35 114.38 120.55 1rwf h ARG 638 Ca 0.09 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1rwf h ARG 638 Cb 0.16 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1rwf h ARG 638 CO -0.01 0.12 -0.33 1.63 -1.51 0.00 0.00 179.97 179.87 1rwf n LYS 639 N -4.42 0.50 -0.32 0.20 5.02 -0.85 -4.54 118.16 113.76 1rwf n LYS 639 Ca 0.12 -0.28 0.08 0.00 -2.02 0.00 0.00 58.31 56.21 1rwf n LYS 639 Cb 0.60 -1.49 0.28 0.00 -0.02 0.00 0.00 35.03 34.39 1rwf n LYS 639 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1rwf h LEU 640 N 0.69 0.85 -1.31 -0.35 3.38 -0.96 -1.91 115.31 115.70 1rwf h LEU 640 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1rwf h LEU 640 Cb 0.49 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1rwf h LEU 640 CO 0.00 0.47 0.00 0.18 0.09 0.00 0.00 178.44 179.18 1rwf n LEU 641 N -4.57 1.94 -4.88 1.67 4.77 -1.26 -4.58 117.00 110.08 1rwf n LEU 641 Ca 0.17 -0.88 -0.35 0.00 -0.03 0.00 0.00 56.01 54.92 1rwf n LEU 641 Cb 0.34 -0.17 -0.05 0.00 -2.33 0.00 0.00 43.42 41.20 1rwf n LEU 641 CO 0.29 0.44 -0.08 -1.61 -1.33 0.00 0.00 177.39 175.10 1rwf s GLU 642 N -1.65 3.56 -0.26 3.23 0.41 -0.72 -4.51 118.70 118.76 1rwf s GLU 642 Ca 0.30 -0.07 0.00 0.00 -0.41 0.00 0.00 54.97 54.79 1rwf s GLU 642 Cb 0.16 -3.12 0.00 0.00 -1.78 0.00 0.00 34.13 29.39 1rwf s GLU 642 CO 0.23 0.68 0.00 0.41 -0.49 0.00 0.00 175.26 176.10 1rwf n GLY 643 N 1.35 0.58 3.95 -1.39 0.00 -1.26 -3.68 105.19 104.74 1rwf n GLY 643 Ca -0.13 -0.57 -0.28 0.00 0.00 0.00 0.00 46.02 45.03 1rwf n GLY 643 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1rwf n ASN 644 N 0.81 -2.27 0.00 1.61 5.15 -1.26 -4.87 115.26 114.43 1rwf n ASN 644 Ca -0.02 -0.91 -0.03 0.00 -0.60 0.00 0.00 54.58 53.01 1rwf n ASN 644 Cb 0.11 -3.40 0.21 0.00 -0.53 0.00 0.00 39.78 36.18 1rwf n ASN 644 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1rwf h LYS 645 N -1.84 0.52 -3.45 1.20 1.57 -1.81 -3.37 116.57 109.39 1rwf h LYS 645 Ca -0.61 -0.18 -0.63 0.00 -1.87 0.00 0.00 60.65 57.37 1rwf h LYS 645 Cb 1.37 -0.04 -0.40 0.00 0.08 0.00 0.00 32.23 33.24 1rwf h LYS 645 CO 0.66 0.69 -0.69 0.71 -0.57 0.00 0.00 179.45 180.25 1rwf s TYR 646 N -4.61 2.74 -0.51 -1.35 1.51 -1.26 -1.05 117.35 112.82 1rwf s TYR 646 Ca -0.07 -2.78 -0.17 0.00 -1.01 0.00 0.00 57.07 53.04 1rwf s TYR 646 Cb 0.14 -2.43 0.09 0.00 -0.11 0.00 0.00 41.96 39.65 1rwf s TYR 646 CO 0.79 -0.80 0.52 0.45 -1.11 0.00 0.00 175.55 175.40 1rwf s SER 647 N 0.25 6.18 0.16 2.29 0.15 -0.31 -4.94 113.70 117.48 1rwf s SER 647 Ca 0.16 -1.36 -0.31 0.00 0.70 0.00 0.00 55.95 55.14 1rwf s SER 647 Cb -0.24 -2.23 -0.09 0.00 -1.71 0.00 0.00 66.02 61.76 1rwf s SER 647 CO -0.03 -0.82 1.37 -0.69 1.20 0.00 0.00 173.24 174.27 1rwf s VAL 648 N 2.01 3.17 -0.27 4.45 1.01 -1.26 -0.72 120.40 128.78 1rwf s VAL 648 Ca 0.07 0.90 -0.12 0.00 0.00 0.00 0.00 61.98 62.83 1rwf s VAL 648 Cb -0.25 -3.57 -0.13 0.00 0.00 0.00 0.00 36.38 32.43 1rwf s VAL 648 CO 0.07 0.10 -0.32 -0.38 0.00 0.00 0.00 175.10 174.57 1rwf n ILE 649 N 3.28 1.53 -3.65 2.22 5.41 -0.18 -4.94 119.36 123.03 1rwf n ILE 649 Ca 0.09 -0.40 -0.15 0.00 1.00 0.00 0.00 62.75 63.29 1rwf n ILE 649 Cb 0.42 -1.83 -0.08 0.00 -0.71 0.00 0.00 39.64 37.45 1rwf n ILE 649 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 1rwf s ARG 650 N -2.51 0.77 -0.42 0.38 3.52 -1.19 -4.72 118.95 114.78 1rwf s ARG 650 Ca -0.38 0.48 0.05 0.00 -0.13 0.00 0.00 55.73 55.75 1rwf s ARG 650 Cb 0.14 0.37 0.17 0.00 -1.56 0.00 0.00 34.95 34.06 1rwf s ARG 650 CO 0.51 -0.16 0.46 1.21 -0.81 0.00 0.00 175.30 176.51 1rwf s ASN 651 N -0.38 0.47 0.00 -2.12 2.47 -1.24 -1.00 114.94 113.15 1rwf s ASN 651 Ca -0.05 -2.01 0.00 0.00 0.42 0.00 0.00 52.86 51.22 1rwf s ASN 651 Cb -0.03 0.67 0.00 0.00 -1.45 0.00 0.00 41.25 40.44 1rwf s ASN 651 CO 0.04 -0.18 0.00 -0.90 -3.72 0.00 0.00 177.10 172.34 1rwf n ASP 652 N 3.54 0.00 0.14 -4.21 5.68 -0.76 -4.87 116.55 116.06 1rwf n ASP 652 Ca 0.18 -0.52 0.12 0.00 -0.50 0.00 0.00 54.79 54.07 1rwf n ASP 652 Cb 0.49 0.00 0.50 0.00 -1.14 0.00 0.00 41.12 40.97 1rwf n ASP 652 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1rwf n ALA 653 N -3.00 1.66 -0.06 2.12 0.00 -1.26 -2.90 120.51 117.07 1rwf n ALA 653 Ca 0.00 0.09 -0.20 0.00 0.00 0.00 0.00 53.44 53.33 1rwf n ALA 653 Cb 0.00 -1.40 -0.13 0.00 0.00 0.00 0.00 19.45 17.93 1rwf n ALA 653 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1rwf h THR 654 N 0.00 1.13 -2.70 0.00 2.02 -1.96 -3.40 112.91 108.01 1rwf h THR 654 Ca 0.00 -2.29 -0.02 0.00 0.77 0.00 0.00 66.41 64.87 1rwf h THR 654 Cb 0.37 2.63 -0.14 0.00 -1.74 0.00 0.00 68.15 69.27 1rwf h THR 654 CO 0.00 0.51 0.23 0.00 0.37 0.00 0.00 175.52 176.63 1rwf s ALA 655 N -2.37 -1.66 -0.04 6.16 0.00 -1.14 -0.89 121.76 121.82 1rwf s ALA 655 Ca -0.24 0.74 0.02 0.00 0.00 0.00 0.00 51.96 52.47 1rwf s ALA 655 Cb 0.04 0.62 0.02 0.00 0.00 0.00 0.00 23.12 23.80 1rwf s ALA 655 CO 0.67 -0.66 -0.06 -0.65 0.00 0.00 0.00 175.76 175.06 1rwf s GLN 656 N -3.05 0.96 -0.12 0.00 -0.21 -0.41 -1.83 119.66 115.00 1rwf s GLN 656 Ca -0.02 -0.19 -0.23 0.00 0.02 0.00 0.00 55.36 54.94 1rwf s GLN 656 Cb -0.01 -0.91 0.06 0.00 1.00 0.00 0.00 33.01 33.15 1rwf s GLN 656 CO -0.07 -0.02 0.57 0.45 -2.12 0.00 0.00 175.29 174.10 1rwf s SER 657 N 0.70 -0.55 0.01 5.90 0.15 -0.17 -0.61 113.70 119.14 1rwf s SER 657 Ca -0.10 0.81 0.00 0.00 0.70 0.00 0.00 55.95 57.36 1rwf s SER 657 Cb -0.13 0.80 -0.01 0.00 -1.71 0.00 0.00 66.02 64.97 1rwf s SER 657 CO 0.01 -0.40 -0.02 0.68 1.20 0.00 0.00 173.24 174.71 1rwf s VAL 658 N -0.54 0.10 -0.17 4.45 -7.23 -0.73 -1.01 120.40 115.28 1rwf s VAL 658 Ca -0.07 -0.43 -0.06 0.00 -1.81 0.00 0.00 61.98 59.61 1rwf s VAL 658 Cb -0.03 -0.17 -0.04 0.00 0.56 0.00 0.00 36.38 36.71 1rwf s VAL 658 CO 0.05 -0.21 0.04 -0.70 -0.31 0.00 0.00 175.10 173.97 1rwf s GLU 659 N -0.67 3.85 -0.45 4.82 2.12 0.10 -1.09 118.70 127.38 1rwf s GLU 659 Ca -0.07 -0.37 -0.22 0.00 0.36 0.00 0.00 54.97 54.67 1rwf s GLU 659 Cb -0.05 -3.13 0.03 0.00 0.26 0.00 0.00 34.13 31.24 1rwf s GLU 659 CO -0.00 0.31 0.72 -0.06 -0.54 0.00 0.00 175.26 175.69 1rwf s PHE 660 N 0.25 3.02 0.05 5.30 0.40 0.23 -1.16 117.98 126.06 1rwf s PHE 660 Ca 0.03 0.04 -0.25 0.00 -0.60 0.00 0.00 56.93 56.15 1rwf s PHE 660 Cb -0.13 -3.53 -0.17 0.00 0.51 0.00 0.00 43.02 39.70 1rwf s PHE 660 CO 0.01 -0.95 1.55 -0.22 0.70 0.00 0.00 175.22 176.31 1rwf h LYS 661 N 8.94 -0.09 -0.31 0.44 3.64 -1.33 -1.90 116.57 125.95 1rwf h LYS 661 Ca -0.25 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.13 1rwf h LYS 661 Cb 1.09 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 1rwf h LYS 661 CO 0.93 0.10 0.17 1.15 -2.27 0.00 0.00 179.45 179.53 1rwf h THR 662 N -0.27 1.14 0.00 1.00 2.02 -1.93 -2.24 112.91 112.63 1rwf h THR 662 Ca -0.01 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.81 1rwf h THR 662 Cb 0.23 0.81 0.00 0.00 -1.74 0.00 0.00 68.15 67.45 1rwf h THR 662 CO 0.02 0.14 0.00 0.00 0.37 0.00 0.00 175.52 176.04 1rwf n ALA 663 N -2.23 2.31 -4.25 6.16 0.00 -1.18 -4.91 120.51 116.42 1rwf n ALA 663 Ca -0.01 -0.13 -0.31 0.00 0.00 0.00 0.00 53.44 52.98 1rwf n ALA 663 Cb 0.08 -1.38 -0.07 0.00 0.00 0.00 0.00 19.45 18.07 1rwf n ALA 663 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1rwf n LYS 664 N -1.11 -1.66 -3.91 0.00 5.02 -0.74 -4.95 118.16 110.80 1rwf n LYS 664 Ca 0.15 0.19 -0.13 0.00 -2.02 0.00 0.00 58.31 56.51 1rwf n LYS 664 Cb 0.12 -4.05 -0.14 0.00 -0.02 0.00 0.00 35.03 30.93 1rwf n LYS 664 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1rwf s THR 665 N -4.08 0.07 -0.01 -0.18 2.01 -1.05 -4.27 115.64 108.13 1rwf s THR 665 Ca 0.14 -0.01 0.06 0.00 0.31 0.00 0.00 61.69 62.20 1rwf s THR 665 Cb -0.08 -0.09 -0.03 0.00 0.01 0.00 0.00 72.50 72.31 1rwf s THR 665 CO 0.97 0.04 -0.18 -0.89 -0.69 0.00 0.00 174.62 173.86 1rwf s THR 666 N 0.16 2.72 0.07 -0.82 2.01 -0.49 -0.61 115.64 118.69 1rwf s THR 666 Ca -0.01 -0.98 0.06 0.00 0.31 0.00 0.00 61.69 61.07 1rwf s THR 666 Cb -0.03 -2.07 -0.03 0.00 0.01 0.00 0.00 72.50 70.39 1rwf s THR 666 CO -0.00 0.50 -0.16 0.00 -0.69 0.00 0.00 174.62 174.26 1rwf s ALA 667 N -0.77 1.39 -0.03 7.40 0.00 -0.25 -0.87 121.76 128.62 1rwf s ALA 667 Ca 0.12 -1.02 -0.21 0.00 0.00 0.00 0.00 51.96 50.85 1rwf s ALA 667 Cb -0.10 -0.18 0.04 0.00 0.00 0.00 0.00 23.12 22.88 1rwf s ALA 667 CO 0.02 0.25 0.46 0.00 0.00 0.00 0.00 175.76 176.49 1rwf s ALA 668 N -1.08 -1.17 0.00 0.00 0.00 0.33 -1.77 121.76 118.07 1rwf s ALA 668 Ca 0.02 0.73 0.08 0.00 0.00 0.00 0.00 51.96 52.79 1rwf s ALA 668 Cb -0.09 0.03 -0.02 0.00 0.00 0.00 0.00 23.12 23.04 1rwf s ALA 668 CO 0.02 -0.30 -0.23 0.95 0.00 0.00 0.00 175.76 176.20 1rwf s THR 669 N -1.24 1.86 -0.12 0.00 -4.23 0.22 -0.95 115.64 111.19 1rwf s THR 669 Ca -0.12 -1.10 0.03 0.00 -1.18 0.00 0.00 61.69 59.32 1rwf s THR 669 Cb -0.03 -1.56 0.01 0.00 1.34 0.00 0.00 72.50 72.25 1rwf s THR 669 CO 0.06 0.44 -0.22 -0.36 -0.54 0.00 0.00 174.62 174.00 1rwf s PHE 670 N -0.63 2.54 -0.19 3.99 0.40 -0.05 -1.29 117.98 122.75 1rwf s PHE 670 Ca 0.09 -1.15 0.16 0.00 -0.60 0.00 0.00 56.93 55.43 1rwf s PHE 670 Cb -0.09 -1.72 -0.24 0.00 0.51 0.00 0.00 43.02 41.48 1rwf s PHE 670 CO 0.00 -0.50 0.08 0.91 0.70 0.00 0.00 175.22 176.41 1rwf n TRP 671 N 3.79 0.08 -4.18 0.36 7.02 -0.06 -2.62 117.44 121.83 1rwf n TRP 671 Ca -0.20 0.03 -0.11 0.00 -1.02 0.00 0.00 57.50 56.20 1rwf n TRP 671 Cb 0.52 -1.01 -0.10 0.00 -2.42 0.00 0.00 31.31 28.30 1rwf n TRP 671 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 1rwf s LYS 672 N -2.50 0.86 0.35 -0.99 1.02 -1.06 -4.60 119.74 112.81 1rwf s LYS 672 Ca -0.12 -1.36 -0.29 0.00 0.02 0.00 0.00 55.97 54.22 1rwf s LYS 672 Cb 0.06 -0.21 -0.11 0.00 -0.52 0.00 0.00 37.83 37.05 1rwf s LYS 672 CO 0.80 -0.03 1.54 -2.14 -0.92 0.00 0.00 175.35 174.60 1rwf s PRO 673 N -3.84 4.10 0.00 -1.68 0.02 -1.26 -4.69 135.00 127.65 1rwf s PRO 673 Ca 0.13 2.59 0.00 0.00 0.02 0.00 0.00 61.00 63.74 1rwf s PRO 673 Cb 0.05 -2.98 0.00 0.00 0.02 0.00 0.00 34.50 31.59 1rwf s PRO 673 CO -0.04 -0.59 0.00 0.41 -0.33 0.00 0.00 177.00 176.46 1rwf n GLY 674 N 1.11 -2.25 3.41 0.52 0.00 -0.69 -5.00 105.19 102.28 1rwf n GLY 674 Ca 0.04 -1.25 -0.33 0.00 0.00 0.00 0.00 46.02 44.48 1rwf n GLY 674 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rwf s MET 675 N -1.92 2.70 -0.34 1.61 -1.94 -1.26 -1.66 119.30 116.48 1rwf s MET 675 Ca 0.00 -0.73 0.01 0.00 -1.71 0.00 0.00 55.69 53.26 1rwf s MET 675 Cb 0.00 -2.39 0.09 0.00 2.01 0.00 0.00 34.83 34.54 1rwf s MET 675 CO 0.00 0.49 0.06 0.00 -0.01 0.00 0.00 175.02 175.56 1rwf s ALA 676 N -0.39 2.90 0.00 3.03 0.00 0.10 -4.93 121.76 122.48 1rwf s ALA 676 Ca 0.04 -2.29 0.00 0.00 0.00 0.00 0.00 51.96 49.71 1rwf s ALA 676 Cb -0.12 -2.02 0.00 0.00 0.00 0.00 0.00 23.12 20.97 1rwf s ALA 676 CO 0.02 -1.58 0.00 0.41 0.00 0.00 0.00 175.76 174.61 1rwf n GLY 677 N 4.43 3.59 1.49 0.00 0.00 -1.26 -2.23 105.19 111.22 1rwf n GLY 677 Ca -0.03 -0.07 0.11 0.00 0.00 0.00 0.00 46.02 46.03 1rwf n GLY 677 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rwf n ASP 678 N 6.88 4.38 -4.71 1.61 5.75 -1.26 -4.87 116.55 124.33 1rwf n ASP 678 Ca 0.00 -2.20 -0.35 0.00 -0.01 0.00 0.00 54.79 52.23 1rwf n ASP 678 Cb 0.00 -0.54 -0.09 0.00 -1.03 0.00 0.00 41.12 39.46 1rwf n ASP 678 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1rwf s LEU 679 N -1.38 3.96 0.18 -2.12 2.96 -0.95 -3.25 118.68 118.09 1rwf s LEU 679 Ca 0.51 0.19 0.09 0.00 -0.22 0.00 0.00 54.13 54.70 1rwf s LEU 679 Cb 0.29 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.96 1rwf s LEU 679 CO 0.30 0.25 -0.18 -0.83 -1.32 0.00 0.00 176.35 174.57 1rwf s GLY 680 N -0.11 1.47 0.04 7.98 0.00 -0.19 0.03 107.32 116.55 1rwf s GLY 680 Ca 0.08 -1.57 0.01 0.00 0.00 0.00 0.00 44.72 43.24 1rwf s GLY 680 CO 0.01 -1.63 -0.06 0.00 0.00 0.00 0.00 173.10 171.42 1rwf s ALA 681 N -2.20 0.49 -1.59 3.20 0.00 -0.67 -0.93 121.76 120.06 1rwf s ALA 681 Ca 0.19 -0.80 0.28 0.00 0.00 0.00 0.00 51.96 51.62 1rwf s ALA 681 Cb -0.05 0.10 1.02 0.00 0.00 0.00 0.00 23.12 24.18 1rwf s ALA 681 CO 0.08 -0.10 1.73 -1.13 0.00 0.00 0.00 175.76 176.34 1rwf n SER 682 N 1.27 0.62 -2.69 0.00 3.41 -0.32 -1.71 113.62 114.20 1rwf n SER 682 Ca -0.22 -0.58 0.01 0.00 -0.26 0.00 0.00 58.87 57.83 1rwf n SER 682 Cb 0.56 -0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.51 1rwf n SER 682 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rwf n GLY 683 N 1.33 0.43 3.58 5.00 0.00 -1.26 -4.44 105.19 109.83 1rwf n GLY 683 Ca 0.12 -0.97 -0.49 0.00 0.00 0.00 0.00 46.02 44.68 1rwf n GLY 683 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1rwf n PRO 684 N -0.55 1.18 -3.50 1.61 -0.02 -1.26 -4.75 135.00 127.71 1rwf n PRO 684 Ca 0.02 0.42 -0.17 0.00 -2.02 0.00 0.00 63.50 61.76 1rwf n PRO 684 Cb 0.35 -1.94 -0.05 0.00 -0.02 0.00 0.00 33.50 31.84 1rwf n PRO 684 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1rwf s ALA 685 N -0.11 -1.74 -0.11 3.55 0.00 -1.08 -4.45 121.76 117.83 1rwf s ALA 685 Ca 0.74 1.18 0.02 0.00 0.00 0.00 0.00 51.96 53.90 1rwf s ALA 685 Cb -0.86 0.15 -0.01 0.00 0.00 0.00 0.00 23.12 22.40 1rwf s ALA 685 CO 0.51 -0.44 -0.16 0.00 0.00 0.00 0.00 175.76 175.68 1rwf s VAL 687 N 0.12 0.39 -0.03 0.00 1.01 -0.12 -1.35 120.40 120.42 1rwf s VAL 687 Ca -0.08 -0.16 0.04 0.00 0.00 0.00 0.00 61.98 61.78 1rwf s VAL 687 Cb -0.15 -0.37 -0.00 0.00 0.00 0.00 0.00 36.38 35.86 1rwf s VAL 687 CO 0.05 0.13 -0.15 -0.69 0.00 0.00 0.00 175.10 174.45 1rwf s VAL 688 N 0.18 1.24 0.03 2.92 1.01 -0.34 -0.51 120.40 124.94 1rwf s VAL 688 Ca -0.02 -0.62 -0.02 0.00 0.00 0.00 0.00 61.98 61.32 1rwf s VAL 688 Cb -0.05 -1.07 -0.02 0.00 0.00 0.00 0.00 36.38 35.24 1rwf s VAL 688 CO -0.00 0.36 -0.00 0.72 0.00 0.00 0.00 175.10 176.17 1rwf s PHE 689 N -0.00 0.33 -0.16 5.22 -0.12 -0.05 -0.92 117.98 122.29 1rwf s PHE 689 Ca -0.02 -0.70 -0.11 0.00 -0.05 0.00 0.00 56.93 56.05 1rwf s PHE 689 Cb -0.10 -0.25 0.05 0.00 -0.63 0.00 0.00 43.02 42.10 1rwf s PHE 689 CO 0.01 -0.29 0.39 0.45 -0.05 0.00 0.00 175.22 175.73 1rwf s SER 690 N -2.08 -0.45 -0.08 1.98 0.15 -0.29 -1.39 113.70 111.54 1rwf s SER 690 Ca -0.06 0.82 -0.14 0.00 0.70 0.00 0.00 55.95 57.27 1rwf s SER 690 Cb -0.02 0.75 -0.05 0.00 -1.71 0.00 0.00 66.02 64.99 1rwf s SER 690 CO -0.05 -0.17 0.36 -0.60 1.20 0.00 0.00 173.24 173.98 1rwf s ARG 691 N 0.93 4.03 -0.31 5.44 3.52 -1.26 -1.01 118.95 130.28 1rwf s ARG 691 Ca -0.06 0.27 0.01 0.00 -0.13 0.00 0.00 55.73 55.83 1rwf s ARG 691 Cb -0.06 -3.31 0.09 0.00 -1.56 0.00 0.00 34.95 30.11 1rwf s ARG 691 CO -0.07 0.49 0.06 -1.01 -0.81 0.00 0.00 175.30 173.96 1rwf s HIS 692 N -0.38 2.55 0.00 5.12 3.76 0.42 -5.00 115.29 121.76 1rwf s HIS 692 Ca 0.21 -2.20 0.00 0.00 -0.15 0.00 0.00 55.06 52.93 1rwf s HIS 692 Cb -0.15 -2.14 0.00 0.00 1.11 0.00 0.00 32.58 31.40 1rwf s HIS 692 CO 0.09 -0.89 0.00 0.41 -0.85 0.00 0.00 174.74 173.51 1rwf n GLY 693 N 4.61 3.36 1.71 -2.22 0.00 -1.26 -1.68 105.19 109.71 1rwf n GLY 693 Ca -0.01 0.24 0.03 0.00 0.00 0.00 0.00 46.02 46.28 1rwf n GLY 693 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1rwf n ASN 694 N 10.01 4.81 -3.97 1.61 6.94 -1.26 -4.89 115.26 128.52 1rwf n ASN 694 Ca 0.00 -2.84 -0.22 0.00 -0.02 0.00 0.00 54.58 51.50 1rwf n ASN 694 Cb 0.00 -0.67 -0.16 0.00 -2.36 0.00 0.00 39.78 36.59 1rwf n ASN 694 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1rwf s GLU 695 N -2.50 1.25 -0.20 -3.83 2.02 -0.67 -1.64 118.70 113.14 1rwf s GLU 695 Ca 0.46 -0.28 -0.05 0.00 0.02 0.00 0.00 54.97 55.12 1rwf s GLU 695 Cb 0.35 -1.11 -0.02 0.00 0.10 0.00 0.00 34.13 33.45 1rwf s GLU 695 CO 0.13 0.01 -0.02 -1.17 0.02 0.00 0.00 175.26 174.23 1rwf s LEU 696 N 0.66 3.18 -0.12 1.80 2.96 0.00 -0.43 118.68 126.73 1rwf s LEU 696 Ca -0.12 -0.22 -0.05 0.00 -0.22 0.00 0.00 54.13 53.52 1rwf s LEU 696 Cb -0.14 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.71 1rwf s LEU 696 CO 0.02 0.07 0.08 -0.44 -1.32 0.00 0.00 176.35 174.76 1rwf s SER 697 N 0.97 5.89 0.01 3.68 0.01 -0.18 -0.59 113.70 123.48 1rwf s SER 697 Ca 0.01 0.31 0.01 0.00 1.31 0.00 0.00 55.95 57.59 1rwf s SER 697 Cb -0.14 -1.84 -0.01 0.00 0.21 0.00 0.00 66.02 64.24 1rwf s SER 697 CO 0.01 0.37 -0.04 -0.76 0.41 0.00 0.00 173.24 173.23 1rwf s LEU 698 N -0.80 2.07 -0.04 2.44 1.02 -0.34 -1.13 118.68 121.89 1rwf s LEU 698 Ca 0.13 -0.19 0.06 0.00 0.02 0.00 0.00 54.13 54.15 1rwf s LEU 698 Cb -0.12 -0.15 -0.02 0.00 0.02 0.00 0.00 46.19 45.92 1rwf s LEU 698 CO 0.03 -0.03 -0.21 0.00 0.02 0.00 0.00 176.35 176.16 1rwf s ALA 699 N -0.44 2.37 -0.01 4.21 0.00 -0.09 -1.55 121.76 126.25 1rwf s ALA 699 Ca -0.02 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 50.90 1rwf s ALA 699 Cb -0.04 -0.76 0.02 0.00 0.00 0.00 0.00 23.12 22.34 1rwf s ALA 699 CO -0.00 0.50 0.02 0.08 0.00 0.00 0.00 175.76 176.36 1rwf s VAL 700 N -0.51 -0.03 0.16 0.00 1.01 -0.46 -1.19 120.40 119.38 1rwf s VAL 700 Ca 0.07 0.11 0.08 0.00 0.00 0.00 0.00 61.98 62.24 1rwf s VAL 700 Cb -0.11 -0.05 -0.04 0.00 0.00 0.00 0.00 36.38 36.18 1rwf s VAL 700 CO 0.01 0.05 -0.17 -0.94 0.00 0.00 0.00 175.10 174.05 1rwf s SER 701 N 0.55 2.51 -0.56 3.32 1.04 -0.46 -0.78 113.70 119.31 1rwf s SER 701 Ca -0.05 -0.88 -0.07 0.00 0.48 0.00 0.00 55.95 55.44 1rwf s SER 701 Cb -0.07 -0.13 0.15 0.00 0.10 0.00 0.00 66.02 66.07 1rwf s SER 701 CO -0.02 -0.09 0.41 -0.70 0.98 0.00 0.00 173.24 173.83 1rwf s GLU 702 N -2.95 2.58 0.00 4.02 -6.30 -1.26 -1.99 118.70 112.80 1rwf s GLU 702 Ca 0.16 -2.14 0.28 0.00 -2.50 0.00 0.00 54.97 50.77 1rwf s GLU 702 Cb -0.04 -3.87 1.21 0.00 0.00 0.00 0.00 34.13 31.43 1rwf s GLU 702 CO 0.06 -1.18 1.90 -0.35 0.02 0.00 0.00 175.26 175.71 1rwf n PRO 703 N 4.23 0.03 0.19 4.30 -0.04 -1.26 -2.66 135.00 139.79 1rwf n PRO 703 Ca 0.01 0.02 0.07 0.00 -0.04 0.00 0.00 63.50 63.56 1rwf n PRO 703 Cb 0.41 -1.50 0.27 0.00 -0.04 0.00 0.00 33.50 32.63 1rwf n PRO 703 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1rwf h THR 704 N 0.00 0.70 -0.17 0.52 1.35 -1.87 -3.40 112.91 110.04 1rwf h THR 704 Ca 0.00 -1.59 -0.07 0.00 -0.55 0.00 0.00 66.41 64.20 1rwf h THR 704 Cb 0.47 2.04 -0.03 0.00 -1.73 0.00 0.00 68.15 68.90 1rwf h THR 704 CO 0.00 0.34 -0.07 0.00 -0.25 0.00 0.00 175.52 175.54 1rwf n GLN 705 N -3.35 -0.78 0.00 4.72 6.02 -1.09 -4.84 117.38 118.07 1rwf n GLN 705 Ca 0.01 0.46 0.00 0.00 -0.01 0.00 0.00 57.00 57.46 1rwf n GLN 705 Cb 0.56 -4.20 0.00 0.00 1.02 0.00 0.00 30.24 27.62 1rwf n GLN 705 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1rwf n LYS 706 N -1.85 2.25 -3.29 -1.09 5.02 -1.26 -4.69 118.16 113.25 1rwf n LYS 706 Ca -0.04 -0.08 -0.39 0.00 -2.02 0.00 0.00 58.31 55.78 1rwf n LYS 706 Cb 0.25 -0.42 -0.06 0.00 -0.02 0.00 0.00 35.03 34.78 1rwf n LYS 706 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rwf s ALA 707 N -0.35 3.59 -0.29 7.82 0.00 -1.26 -4.98 121.76 126.29 1rwf s ALA 707 Ca 0.00 0.01 0.20 0.00 0.00 0.00 0.00 51.96 52.17 1rwf s ALA 707 Cb 0.00 -2.62 0.15 0.00 0.00 0.00 0.00 23.12 20.65 1rwf s ALA 707 CO 0.00 0.39 1.38 0.00 0.00 0.00 0.00 175.76 177.52 1rwf h ALA 708 N 4.66 0.78 -2.60 0.00 0.00 -1.97 -3.34 119.26 116.79 1rwf h ALA 708 Ca -0.49 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.09 1rwf h ALA 708 Cb 1.21 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.88 1rwf h ALA 708 CO 0.64 0.27 -0.38 0.20 0.00 0.00 0.00 179.25 179.97 1rwf s GLY 709 N -4.37 0.55 -0.19 0.00 0.00 -1.26 -0.62 107.32 101.44 1rwf s GLY 709 Ca 0.04 -0.98 -0.14 0.00 0.00 0.00 0.00 44.72 43.64 1rwf s GLY 709 CO 0.73 -0.93 0.47 -2.27 0.00 0.00 0.00 173.10 171.10 1rwf s LEU 710 N -2.98 -0.03 -0.15 0.66 2.96 -0.98 -4.87 118.68 113.30 1rwf s LEU 710 Ca 0.18 0.99 0.02 0.00 -0.22 0.00 0.00 54.13 55.10 1rwf s LEU 710 Cb 0.04 1.61 0.01 0.00 0.50 0.00 0.00 46.19 48.35 1rwf s LEU 710 CO -0.00 -0.18 -0.21 -0.89 -1.32 0.00 0.00 176.35 173.75 1rwf s THR 711 N 0.79 2.14 -0.03 3.68 2.01 -1.26 -0.49 115.64 122.48 1rwf s THR 711 Ca -0.04 -0.95 -0.13 0.00 0.31 0.00 0.00 61.69 60.88 1rwf s THR 711 Cb -0.05 -1.86 -0.05 0.00 0.01 0.00 0.00 72.50 70.54 1rwf s THR 711 CO -0.06 0.54 0.35 -0.76 -0.69 0.00 0.00 174.62 174.00 1rwf s LEU 712 N 0.87 4.45 -0.33 4.42 1.43 0.01 -1.18 118.68 128.36 1rwf s LEU 712 Ca -0.06 0.85 -0.15 0.00 -1.03 0.00 0.00 54.13 53.74 1rwf s LEU 712 Cb -0.15 -2.47 -0.02 0.00 0.03 0.00 0.00 46.19 43.58 1rwf s LEU 712 CO -0.03 0.34 0.37 -0.89 0.23 0.00 0.00 176.35 176.37 1rwf s THR 713 N -1.03 5.16 0.23 5.49 2.01 -0.11 -1.02 115.64 126.37 1rwf s THR 713 Ca 0.22 0.18 -0.30 0.00 0.31 0.00 0.00 61.69 62.10 1rwf s THR 713 Cb -0.16 -3.80 -0.09 0.00 0.01 0.00 0.00 72.50 68.47 1rwf s THR 713 CO 0.11 -0.04 0.99 -0.76 -0.69 0.00 0.00 174.62 174.23 1rwf s LEU 714 N 2.05 4.60 0.79 4.42 1.43 -0.04 -1.02 118.68 130.92 1rwf s LEU 714 Ca 0.13 2.01 -0.10 0.00 -1.03 0.00 0.00 54.13 55.13 1rwf s LEU 714 Cb -0.16 -3.61 0.09 0.00 0.03 0.00 0.00 46.19 42.54 1rwf s LEU 714 CO 0.11 0.04 1.14 -2.16 0.23 0.00 0.00 176.35 175.71 1rwf s PRO 715 N -1.02 1.85 -0.85 1.29 0.04 -1.20 -4.60 135.00 130.51 1rwf s PRO 715 Ca 0.43 -0.11 -0.01 0.00 0.04 0.00 0.00 61.00 61.35 1rwf s PRO 715 Cb -0.27 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.25 1rwf s PRO 715 CO 0.34 -1.59 0.17 0.39 0.04 0.00 0.00 177.00 176.35 1rwf n GLU 716 N -3.24 -1.75 0.00 4.56 -0.58 -1.26 -4.77 120.64 113.60 1rwf n GLU 716 Ca 0.09 0.49 0.00 0.00 -0.42 0.00 0.00 57.16 57.32 1rwf n GLU 716 Cb 0.61 -4.49 0.00 0.00 -0.57 0.00 0.00 31.44 26.98 1rwf n GLU 716 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1rwf n GLY 717 N -1.08 -1.33 3.86 0.62 0.00 -1.26 -4.98 105.19 101.02 1rwf n GLY 717 Ca -0.09 -1.69 -0.24 0.00 0.00 0.00 0.00 46.02 43.99 1rwf n GLY 717 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rwf s THR 718 N 0.00 4.78 -0.03 2.61 -4.23 -1.26 -4.50 115.64 113.01 1rwf s THR 718 Ca 0.00 -1.06 -0.01 0.00 -1.18 0.00 0.00 61.69 59.44 1rwf s THR 718 Cb 0.00 -3.51 0.03 0.00 1.34 0.00 0.00 72.50 70.37 1rwf s THR 718 CO 0.00 -0.20 0.05 0.26 -0.54 0.00 0.00 174.62 174.19 1rwf s TRP 719 N -1.88 0.01 -0.09 3.99 0.52 -1.26 -4.70 118.94 115.53 1rwf s TRP 719 Ca 0.33 0.20 0.02 0.00 0.02 0.00 0.00 56.10 56.67 1rwf s TRP 719 Cb -0.10 -0.26 -0.02 0.00 -1.15 0.00 0.00 33.47 31.95 1rwf s TRP 719 CO 0.26 -0.12 0.08 -1.13 0.02 0.00 0.00 176.95 176.06 1rwf n SER 720 N 4.37 0.23 -3.82 2.95 3.41 -0.89 -4.92 113.62 114.95 1rwf n SER 720 Ca -0.24 -0.53 -0.09 0.00 -0.26 0.00 0.00 58.87 57.75 1rwf n SER 720 Cb 0.50 1.00 -0.06 0.00 -0.26 0.00 0.00 64.21 65.39 1rwf n SER 720 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1rwf s SER 721 N -1.21 -0.02 -0.30 4.04 1.04 -1.08 -5.02 113.70 111.15 1rwf s SER 721 Ca 0.01 -0.62 -0.09 0.00 0.48 0.00 0.00 55.95 55.72 1rwf s SER 721 Cb 0.01 0.42 -0.01 0.00 0.10 0.00 0.00 66.02 66.54 1rwf s SER 721 CO 0.08 -0.83 0.15 -0.69 0.98 0.00 0.00 173.24 172.92 1rwf s VAL 722 N -3.88 4.60 -0.07 5.02 1.01 -1.26 -0.09 120.40 125.73 1rwf s VAL 722 Ca 0.08 -0.38 -0.18 0.00 0.00 0.00 0.00 61.98 61.50 1rwf s VAL 722 Cb 0.03 -3.33 -0.29 0.00 0.00 0.00 0.00 36.38 32.79 1rwf s VAL 722 CO -0.07 0.09 0.72 -0.07 0.00 0.00 0.00 175.10 175.77 1rwf h LEU 723 N 8.34 0.45 -8.06 3.92 3.38 -0.62 -3.48 115.31 119.25 1rwf h LEU 723 Ca -0.33 -0.90 -0.35 0.00 0.09 0.00 0.00 57.88 56.40 1rwf h LEU 723 Cb 1.15 -0.15 -0.26 0.00 0.09 0.00 0.00 40.66 41.49 1rwf h LEU 723 CO 0.61 1.54 -0.76 -1.61 0.09 0.00 0.00 178.44 178.31 1rwf s GLU 724 N -2.47 0.60 0.89 1.13 2.02 -0.97 -4.96 118.70 114.95 1rwf s GLU 724 Ca -0.17 -0.44 0.00 0.00 0.02 0.00 0.00 54.97 54.39 1rwf s GLU 724 Cb 0.03 -0.54 0.00 0.00 0.10 0.00 0.00 34.13 33.72 1rwf s GLU 724 CO 0.80 0.14 0.00 0.41 0.02 0.00 0.00 175.26 176.63 1rwf n GLY 725 N 2.43 -1.89 3.37 -1.39 0.00 -1.26 -1.01 105.19 105.45 1rwf n GLY 725 Ca -0.16 -1.59 -0.28 0.00 0.00 0.00 0.00 46.02 43.99 1rwf n GLY 725 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rwf s ALA 726 N -1.29 2.27 0.00 4.61 0.00 -1.26 -4.98 121.76 121.10 1rwf s ALA 726 Ca 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 51.96 50.53 1rwf s ALA 726 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 23.12 22.77 1rwf s ALA 726 CO 0.00 0.50 0.00 0.41 0.00 0.00 0.00 175.76 176.67 1rwf n GLY 727 N 0.91 3.85 3.29 0.00 0.00 -1.26 -4.95 105.19 107.04 1rwf n GLY 727 Ca -0.18 -1.22 -0.35 0.00 0.00 0.00 0.00 46.02 44.27 1rwf n GLY 727 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rwf s THR 728 N -2.00 3.21 0.38 2.61 2.01 -0.54 -4.92 115.64 116.39 1rwf s THR 728 Ca 0.00 -0.55 -0.24 0.00 0.31 0.00 0.00 61.69 61.21 1rwf s THR 728 Cb 0.00 -2.45 -0.09 0.00 0.01 0.00 0.00 72.50 69.97 1rwf s THR 728 CO 0.00 0.44 1.01 -0.76 -0.69 0.00 0.00 174.62 174.63 1rwf s LEU 729 N 1.37 4.18 0.00 4.42 1.43 -1.26 -1.20 118.68 127.62 1rwf s LEU 729 Ca 0.05 1.96 -0.04 0.00 -1.03 0.00 0.00 54.13 55.06 1rwf s LEU 729 Cb -0.14 -4.17 0.02 0.00 0.03 0.00 0.00 46.19 41.93 1rwf s LEU 729 CO -0.04 -0.37 0.38 0.61 0.23 0.00 0.00 176.35 177.16 1rwf n GLY 730 N 0.31 2.04 2.84 -3.19 0.00 -0.32 -4.96 105.19 101.91 1rwf n GLY 730 Ca 0.04 -1.38 -0.13 0.00 0.00 0.00 0.00 46.02 44.55 1rwf n GLY 730 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rwf s THR 731 N -2.58 0.01 0.00 2.61 2.01 -1.26 -0.53 115.64 115.89 1rwf s THR 731 Ca 0.15 0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.20 1rwf s THR 731 Cb -0.02 -0.06 0.00 0.00 0.01 0.00 0.00 72.50 72.44 1rwf s THR 731 CO 0.11 0.04 0.00 -0.90 -0.69 0.00 0.00 174.62 173.17 1rwf n ASP 732 N 3.43 0.00 0.15 3.53 5.68 0.31 -4.90 116.55 124.75 1rwf n ASP 732 Ca -0.17 -0.42 0.02 0.00 -0.50 0.00 0.00 54.79 53.72 1rwf n ASP 732 Cb 0.57 0.00 0.19 0.00 -1.14 0.00 0.00 41.12 40.73 1rwf n ASP 732 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1rwf h ALA 733 N -0.96 0.85 -0.64 2.12 0.00 -2.02 -3.18 119.26 115.42 1rwf h ALA 733 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1rwf h ALA 733 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1rwf h ALA 733 CO 0.00 0.66 0.00 -0.25 0.00 0.00 0.00 179.25 179.66 1rwf n ASP 734 N -3.50 4.19 -0.06 0.00 8.00 -1.26 -4.93 116.55 119.00 1rwf n ASP 734 Ca 0.00 -2.26 -0.01 0.00 0.71 0.00 0.00 54.79 53.24 1rwf n ASP 734 Cb 0.63 -0.52 -0.00 0.00 -0.02 0.00 0.00 41.12 41.20 1rwf n ASP 734 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rwf n GLY 735 N 1.29 0.47 3.83 0.44 0.00 -1.20 -5.06 105.19 104.96 1rwf n GLY 735 Ca 0.24 -0.23 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1rwf n GLY 735 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rwf s ARG 736 N -0.76 4.12 0.29 1.61 0.52 -1.26 -4.79 118.95 118.68 1rwf s ARG 736 Ca 0.00 0.70 -0.29 0.00 -0.52 0.00 0.00 55.73 55.62 1rwf s ARG 736 Cb 0.00 -2.82 -0.10 0.00 0.52 0.00 0.00 34.95 32.55 1rwf s ARG 736 CO 0.00 0.38 1.15 -1.12 0.02 0.00 0.00 175.30 175.74 1rwf s SER 737 N -1.79 7.14 0.22 0.23 0.01 -1.26 -0.53 113.70 117.72 1rwf s SER 737 Ca 0.43 2.38 0.11 0.00 1.31 0.00 0.00 55.95 60.17 1rwf s SER 737 Cb -0.15 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.40 1rwf s SER 737 CO 0.20 -0.25 -0.15 0.42 0.41 0.00 0.00 173.24 173.87 1rwf s THR 738 N -1.13 2.79 -0.10 1.44 -4.23 0.30 -0.86 115.64 113.86 1rwf s THR 738 Ca 0.46 -2.01 -0.00 0.00 -1.18 0.00 0.00 61.69 58.96 1rwf s THR 738 Cb -0.34 -2.41 0.02 0.00 1.34 0.00 0.00 72.50 71.11 1rwf s THR 738 CO 0.44 -0.23 -0.06 -0.22 -0.54 0.00 0.00 174.62 174.01 1rwf s LEU 739 N -3.09 1.10 -0.18 4.79 2.96 -0.19 -1.18 118.68 122.89 1rwf s LEU 739 Ca 0.26 -0.26 -0.03 0.00 -0.22 0.00 0.00 54.13 53.88 1rwf s LEU 739 Cb -0.07 -0.76 -0.02 0.00 0.50 0.00 0.00 46.19 45.84 1rwf s LEU 739 CO 0.14 -0.12 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.11 1rwf s THR 740 N 1.70 3.56 -0.00 3.68 2.01 -0.34 -0.80 115.64 125.44 1rwf s THR 740 Ca 0.04 -0.45 0.05 0.00 0.31 0.00 0.00 61.69 61.63 1rwf s THR 740 Cb -0.13 -2.58 -0.03 0.00 0.01 0.00 0.00 72.50 69.77 1rwf s THR 740 CO -0.07 0.46 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.43 1rwf s LEU 741 N 0.87 2.83 -0.41 4.42 1.43 0.36 -1.46 118.68 126.72 1rwf s LEU 741 Ca -0.01 -0.26 -0.21 0.00 -1.03 0.00 0.00 54.13 52.62 1rwf s LEU 741 Cb -0.15 -1.63 0.02 0.00 0.03 0.00 0.00 46.19 44.46 1rwf s LEU 741 CO 0.01 0.29 0.66 -0.62 0.23 0.00 0.00 176.35 176.93 1rwf s ASP 742 N -1.20 6.38 -0.03 2.29 -1.08 -1.26 -2.32 116.67 119.45 1rwf s ASP 742 Ca 0.14 -0.11 0.13 0.00 -0.52 0.00 0.00 52.55 52.19 1rwf s ASP 742 Cb -0.11 -2.33 0.39 0.00 -1.46 0.00 0.00 42.92 39.41 1rwf s ASP 742 CO 0.04 -0.72 1.32 0.35 0.52 0.00 0.00 175.17 176.68 1rwf n THR 743 N 5.79 1.19 -1.68 1.71 -2.24 0.21 -4.99 114.28 114.27 1rwf n THR 743 Ca -0.01 -1.11 -0.50 0.00 -2.27 0.00 0.00 64.05 60.16 1rwf n THR 743 Cb 0.48 0.40 -0.05 0.00 -2.10 0.00 0.00 70.33 69.05 1rwf n THR 743 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1rwf n THR 744 N 0.55 0.43 -1.38 4.28 -1.04 -1.10 -2.34 114.28 113.69 1rwf n THR 744 Ca 0.15 -0.08 -0.13 0.00 -2.04 0.00 0.00 64.05 61.95 1rwf n THR 744 Cb 0.52 -1.64 -0.06 0.00 -1.82 0.00 0.00 70.33 67.33 1rwf n THR 744 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1rwf n GLY 745 N 4.17 1.38 0.01 3.41 0.00 -1.26 -4.90 105.19 107.99 1rwf n GLY 745 Ca 0.23 -0.41 0.13 0.00 0.00 0.00 0.00 46.02 45.97 1rwf n GLY 745 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rwf n LEU 746 N -1.48 0.04 -3.93 0.99 4.77 -0.99 -4.92 117.00 111.50 1rwf n LEU 746 Ca -0.13 0.51 -0.30 0.00 -0.03 0.00 0.00 56.01 56.05 1rwf n LEU 746 Cb 0.43 -0.49 0.02 0.00 -2.33 0.00 0.00 43.42 41.05 1rwf n LEU 746 CO 0.20 -0.05 0.10 -1.20 -1.33 0.00 0.00 177.39 175.10 1rwf n SER 747 N -1.54 -4.66 0.00 -1.43 7.64 -1.26 -1.40 113.62 110.97 1rwf n SER 747 Ca 0.06 -0.79 0.00 0.00 1.01 0.00 0.00 58.87 59.15 1rwf n SER 747 Cb 0.32 -3.83 0.00 0.00 -1.01 0.00 0.00 64.21 59.68 1rwf n SER 747 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rwf n GLY 748 N -1.68 0.48 3.82 0.23 0.00 -1.26 -4.56 105.19 102.22 1rwf n GLY 748 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1rwf n GLY 748 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rwf s LYS 749 N -0.50 3.08 0.08 1.61 1.02 -0.49 -4.73 119.74 119.80 1rwf s LYS 749 Ca 0.00 0.97 -0.18 0.00 0.02 0.00 0.00 55.97 56.78 1rwf s LYS 749 Cb 0.00 -2.01 -0.07 0.00 -0.52 0.00 0.00 37.83 35.24 1rwf s LYS 749 CO 0.00 -0.99 0.55 0.99 -0.92 0.00 0.00 175.35 174.98 1rwf s THR 750 N -2.97 4.79 -0.16 2.17 2.01 -1.26 -4.51 115.64 115.71 1rwf s THR 750 Ca 0.58 1.11 -0.04 0.00 0.31 0.00 0.00 61.69 63.66 1rwf s THR 750 Cb -0.14 -3.85 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 1rwf s THR 750 CO 0.52 0.50 -0.03 -0.54 -0.69 0.00 0.00 174.62 174.38 1rwf s LYS 751 N -1.27 3.70 -0.16 4.92 -0.14 0.04 -4.95 119.74 121.88 1rwf s LYS 751 Ca 0.30 -0.50 -0.08 0.00 -1.36 0.00 0.00 55.97 54.33 1rwf s LYS 751 Cb -0.18 -2.95 -0.04 0.00 -1.68 0.00 0.00 37.83 32.98 1rwf s LYS 751 CO 0.18 0.24 0.11 -0.51 -0.76 0.00 0.00 175.35 174.61 1rwf s LEU 752 N 0.37 4.12 0.01 3.17 1.43 -1.26 -1.35 118.68 125.16 1rwf s LEU 752 Ca -0.03 0.26 0.03 0.00 -1.03 0.00 0.00 54.13 53.36 1rwf s LEU 752 Cb -0.14 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.04 1rwf s LEU 752 CO 0.03 0.26 -0.09 -0.63 0.23 0.00 0.00 176.35 176.15 1rwf s ILE 753 N -0.16 0.73 -0.05 -0.59 1.09 -0.60 -4.32 121.20 117.30 1rwf s ILE 753 Ca 0.09 -0.61 0.02 0.00 -1.10 0.00 0.00 60.65 59.05 1rwf s ILE 753 Cb -0.12 -0.65 0.02 0.00 -1.06 0.00 0.00 42.46 40.65 1rwf s ILE 753 CO 0.01 0.05 -0.08 -0.75 -0.10 0.00 0.00 174.94 174.07 1rwf s LYS 754 N -0.62 1.24 0.18 2.79 2.20 -0.18 -1.20 119.74 124.14 1rwf s LYS 754 Ca 0.01 -0.25 0.09 0.00 -0.36 0.00 0.00 55.97 55.45 1rwf s LYS 754 Cb -0.05 -1.10 -0.04 0.00 -1.51 0.00 0.00 37.83 35.13 1rwf s LYS 754 CO 0.00 -0.02 -0.11 -0.51 -0.36 0.00 0.00 175.35 174.34 1rwf s LEU 755 N 0.77 2.90 0.02 5.43 1.43 0.24 0.13 118.68 129.61 1rwf s LEU 755 Ca -0.13 -0.61 0.08 0.00 -1.03 0.00 0.00 54.13 52.44 1rwf s LEU 755 Cb -0.15 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.44 1rwf s LEU 755 CO 0.02 0.11 -0.22 -0.75 0.23 0.00 0.00 176.35 175.73 1rwf s LYS 756 N -2.78 2.03 0.00 1.70 2.20 0.87 -0.82 119.74 122.94 1rwf s LYS 756 Ca 0.24 -0.98 0.00 0.00 -0.36 0.00 0.00 55.97 54.87 1rwf s LYS 756 Cb -0.09 -2.10 0.00 0.00 -1.51 0.00 0.00 37.83 34.13 1rwf s LYS 756 CO 0.14 0.54 0.44 -2.13 -0.36 0.00 0.00 175.35 173.99