#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f2a n PRO 2 N 0.00 0.68 -0.22 0.00 -0.02 -1.26 -4.93 135.00 129.25 1f2a n PRO 2 Ca 0.00 0.29 -0.09 0.00 -2.02 0.00 0.00 63.50 61.69 1f2a n PRO 2 Cb 0.00 -2.40 0.03 0.00 -0.02 0.00 0.00 33.50 31.11 1f2a n PRO 2 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1f2a h ALA 3 N -0.09 0.83 -3.02 3.55 0.00 -1.99 -3.45 119.26 115.09 1f2a h ALA 3 Ca -0.49 -0.28 -0.16 0.00 0.00 0.00 0.00 54.91 53.99 1f2a h ALA 3 Cb 1.33 -0.23 -0.25 0.00 0.00 0.00 0.00 17.79 18.64 1f2a h ALA 3 CO 0.49 0.61 -0.40 0.00 0.00 0.00 0.00 179.25 179.95 1f2a s ALA 4 N -5.15 -0.64 -0.02 0.00 0.00 -1.26 -0.43 121.76 114.26 1f2a s ALA 4 Ca -0.12 0.63 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1f2a s ALA 4 Cb 0.14 -0.34 0.02 0.00 0.00 0.00 0.00 23.12 22.94 1f2a s ALA 4 CO 0.84 -0.14 0.02 0.08 0.00 0.00 0.00 175.76 176.56 1f2a s VAL 5 N -0.12 -0.00 -0.27 0.00 1.01 -0.23 -4.99 120.40 115.80 1f2a s VAL 5 Ca -0.02 0.16 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 1f2a s VAL 5 Cb -0.03 -0.11 0.09 0.00 0.00 0.00 0.00 36.38 36.34 1f2a s VAL 5 CO 0.01 0.09 0.12 -0.62 0.00 0.00 0.00 175.10 174.69 1f2a s ASP 6 N 0.88 3.36 0.30 3.32 3.68 -1.26 -0.46 116.67 126.49 1f2a s ASP 6 Ca -0.08 -1.19 0.22 0.00 2.13 0.00 0.00 52.55 53.63 1f2a s ASP 6 Cb -0.11 -0.37 1.11 0.00 -1.45 0.00 0.00 42.92 42.10 1f2a s ASP 6 CO -0.02 -0.42 1.68 0.79 0.13 0.00 0.00 175.17 177.32 1f2a n TRP 7 N 5.23 0.76 0.18 -5.34 7.02 -0.55 -1.42 117.44 123.32 1f2a n TRP 7 Ca -0.06 0.36 0.03 0.00 -1.02 0.00 0.00 57.50 56.82 1f2a n TRP 7 Cb 0.43 -1.08 0.34 0.00 -2.42 0.00 0.00 31.31 28.59 1f2a n TRP 7 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1f2a h ARG 8 N 0.00 0.00 0.00 -0.99 3.08 -1.94 -2.47 114.38 112.06 1f2a h ARG 8 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1f2a h ARG 8 Cb 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1f2a h ARG 8 CO 0.00 0.41 -0.22 0.00 -1.07 0.00 0.00 179.97 179.08 1f2a h ALA 9 N 1.59 1.08 -0.57 0.04 0.00 -1.64 -2.72 119.26 117.04 1f2a h ALA 9 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1f2a h ALA 9 Cb 0.79 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1f2a h ALA 9 CO 0.05 0.28 0.00 0.54 0.00 0.00 0.00 179.25 180.12 1f2a n ARG 10 N -3.48 2.43 -1.91 0.00 3.00 -0.97 -4.93 116.66 110.81 1f2a n ARG 10 Ca -0.00 -2.09 -0.14 0.00 -0.01 0.00 0.00 57.85 55.61 1f2a n ARG 10 Cb 0.39 -1.48 -0.03 0.00 0.00 0.00 0.00 32.46 31.34 1f2a n ARG 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1f2a n GLY 11 N 1.36 0.50 0.63 -0.13 0.00 -1.03 -4.92 105.19 101.60 1f2a n GLY 11 Ca 0.19 -0.32 0.13 0.00 0.00 0.00 0.00 46.02 46.03 1f2a n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f2a n ALA 12 N -0.44 2.65 -3.04 4.61 0.00 -0.98 -4.88 120.51 118.43 1f2a n ALA 12 Ca -0.16 -0.54 -0.32 0.00 0.00 0.00 0.00 53.44 52.42 1f2a n ALA 12 Cb 0.56 -1.01 -0.17 0.00 0.00 0.00 0.00 19.45 18.83 1f2a n ALA 12 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1f2a s VAL 13 N -2.08 2.14 0.87 0.00 1.01 -1.26 -4.22 120.40 116.86 1f2a s VAL 13 Ca 0.32 -1.01 -0.13 0.00 0.00 0.00 0.00 61.98 61.16 1f2a s VAL 13 Cb 0.20 -1.80 0.12 0.00 0.00 0.00 0.00 36.38 34.89 1f2a s VAL 13 CO 0.36 0.56 1.18 0.42 0.00 0.00 0.00 175.10 177.62 1f2a s THR 14 N 0.16 1.99 0.73 3.92 -4.23 -1.26 -5.00 115.64 111.96 1f2a s THR 14 Ca -0.13 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 60.24 1f2a s THR 14 Cb -0.16 -2.91 0.04 0.00 1.34 0.00 0.00 72.50 70.81 1f2a s THR 14 CO 0.07 0.00 1.15 0.00 -0.54 0.00 0.00 174.62 175.30 1f2a s ALA 15 N -3.50 2.18 0.27 3.99 0.00 -1.26 -4.96 121.76 118.49 1f2a s ALA 15 Ca 0.64 0.64 -0.30 0.00 0.00 0.00 0.00 51.96 52.94 1f2a s ALA 15 Cb -0.11 -3.39 -0.10 0.00 0.00 0.00 0.00 23.12 19.52 1f2a s ALA 15 CO 0.51 -1.76 1.42 0.08 0.00 0.00 0.00 175.76 176.01 1f2a s VAL 16 N -2.33 2.61 0.26 0.00 1.01 -1.26 -5.02 120.40 115.67 1f2a s VAL 16 Ca 0.69 0.54 0.03 0.00 0.00 0.00 0.00 61.98 63.23 1f2a s VAL 16 Cb -0.24 -3.34 0.03 0.00 0.00 0.00 0.00 36.38 32.83 1f2a s VAL 16 CO 0.47 0.10 0.25 0.29 0.00 0.00 0.00 175.10 176.21 1f2a n LYS 17 N 1.91 1.02 -3.75 2.72 5.02 -1.26 -4.79 118.16 119.02 1f2a n LYS 17 Ca 0.05 -1.58 -0.27 0.00 -2.02 0.00 0.00 58.31 54.49 1f2a n LYS 17 Cb 0.40 0.09 -0.17 0.00 -0.02 0.00 0.00 35.03 35.33 1f2a n LYS 17 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1f2a s ASP 18 N -2.58 2.64 0.26 4.39 3.68 -1.26 -1.85 116.67 121.95 1f2a s ASP 18 Ca 0.19 -0.67 0.26 0.00 2.13 0.00 0.00 52.55 54.46 1f2a s ASP 18 Cb -0.02 -0.59 0.77 0.00 -1.45 0.00 0.00 42.92 41.64 1f2a s ASP 18 CO 0.12 -0.27 1.75 0.06 0.13 0.00 0.00 175.17 176.96 1f2a h GLN 19 N 8.25 0.00 0.00 4.34 3.07 -1.67 -3.47 115.11 125.63 1f2a h GLN 19 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.57 1f2a h GLN 19 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.68 1f2a h GLN 19 CO 0.33 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.66 1f2a n GLY 20 N 1.09 1.14 0.05 0.06 0.00 -1.26 -2.94 105.19 103.33 1f2a n GLY 20 Ca 0.05 -0.68 0.01 0.00 0.00 0.00 0.00 46.02 45.40 1f2a n GLY 20 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1f2a n GLN 21 N 4.16 1.07 -3.70 1.61 6.02 0.05 -4.82 117.38 121.76 1f2a n GLN 21 Ca 0.00 -0.10 -0.36 0.00 -0.01 0.00 0.00 57.00 56.52 1f2a n GLN 21 Cb 0.00 -1.05 -0.07 0.00 1.02 0.00 0.00 30.24 30.14 1f2a n GLN 21 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1f2a n GLY 23 N 2.74 3.29 1.94 0.00 0.00 -0.81 -4.51 105.19 107.84 1f2a n GLY 23 Ca -0.16 -1.32 -0.11 0.00 0.00 0.00 0.00 46.02 44.43 1f2a n GLY 23 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1f2a n SER 24 N 2.42 4.19 -0.33 1.61 3.41 -1.26 -3.38 113.62 120.28 1f2a n SER 24 Ca 0.47 -3.18 0.09 0.00 -0.26 0.00 0.00 58.87 55.99 1f2a n SER 24 Cb 0.81 -0.75 0.26 0.00 -0.26 0.00 0.00 64.21 64.27 1f2a n SER 24 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1f2a h TRP 26 N 0.78 0.76 -0.27 0.00 5.08 -1.81 -0.45 115.95 120.04 1f2a h TRP 26 Ca 0.51 0.02 -0.17 0.00 1.08 0.00 0.00 58.89 60.33 1f2a h TRP 26 Cb 0.68 -0.25 0.00 0.00 -3.00 0.00 0.00 29.16 26.59 1f2a h TRP 26 CO -0.04 0.39 -0.50 0.00 -1.28 0.00 0.00 178.44 177.02 1f2a h ALA 27 N 1.61 0.43 -0.52 0.11 0.00 -1.43 -1.62 119.26 117.83 1f2a h ALA 27 Ca 0.32 -0.49 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 1f2a h ALA 27 Cb 0.30 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1f2a h ALA 27 CO -0.11 0.61 -0.09 0.74 0.00 0.00 0.00 179.25 180.39 1f2a h PHE 28 N 0.58 1.05 0.02 0.00 -1.00 -1.03 -0.53 116.94 116.03 1f2a h PHE 28 Ca 0.01 -0.20 -0.00 0.00 2.81 0.00 0.00 57.97 60.59 1f2a h PHE 28 Cb 1.11 -0.27 0.00 0.00 3.61 0.00 0.00 35.95 40.40 1f2a h PHE 28 CO 0.08 0.98 -0.01 1.03 -1.61 0.00 0.00 178.31 178.78 1f2a h SER 29 N 0.85 -0.03 -0.02 2.17 0.87 -1.08 0.99 113.55 117.31 1f2a h SER 29 Ca 0.14 -0.18 -0.00 0.00 -1.23 0.00 0.00 61.79 60.52 1f2a h SER 29 Cb 0.63 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.60 1f2a h SER 29 CO 0.04 0.17 0.01 0.00 -0.53 0.00 0.00 176.83 176.52 1f2a h ALA 30 N 0.75 0.02 -0.56 6.23 0.00 -1.22 -2.22 119.26 122.26 1f2a h ALA 30 Ca -0.00 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 1f2a h ALA 30 Cb 0.21 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1f2a h ALA 30 CO 0.01 -0.44 -0.01 0.82 0.00 0.00 0.00 179.25 179.63 1f2a h ILE 31 N -0.05 1.26 -1.00 0.00 1.08 -1.08 -1.70 117.51 116.02 1f2a h ILE 31 Ca 0.01 -1.13 0.01 0.00 -0.39 0.00 0.00 64.86 63.36 1f2a h ILE 31 Cb 0.08 0.84 -0.05 0.00 -3.07 0.00 0.00 36.82 34.61 1f2a h ILE 31 CO -0.00 0.40 0.66 1.23 -0.69 0.00 0.00 178.15 179.75 1f2a h GLY 32 N 0.99 1.41 0.96 5.37 0.00 -0.71 0.68 103.07 111.77 1f2a h GLY 32 Ca 0.16 -0.52 -0.07 0.00 0.00 0.00 0.00 47.33 46.90 1f2a h GLY 32 CO 0.03 0.50 -0.01 -0.57 0.00 0.00 0.00 176.54 176.50 1f2a h ASN 33 N 1.34 0.74 -0.60 0.19 -0.73 -1.04 -2.65 115.58 112.83 1f2a h ASN 33 Ca 0.37 -0.31 -0.03 0.00 1.87 0.00 0.00 56.30 58.19 1f2a h ASN 33 Cb -0.14 -0.20 -0.03 0.00 0.27 0.00 0.00 38.32 38.22 1f2a h ASN 33 CO -0.08 0.87 0.25 0.58 -0.37 0.00 0.00 177.43 178.67 1f2a h VAL 34 N 0.59 1.23 -0.56 2.57 2.07 -0.51 -1.01 116.25 120.63 1f2a h VAL 34 Ca 0.12 -0.70 0.07 0.00 0.82 0.00 0.00 66.70 67.00 1f2a h VAL 34 Cb 0.50 0.56 -0.06 0.00 -1.52 0.00 0.00 31.29 30.77 1f2a h VAL 34 CO 0.02 0.27 0.25 -0.33 0.02 0.00 0.00 177.57 177.81 1f2a h GLU 35 N 0.84 0.45 -0.26 1.57 5.08 -0.78 0.69 114.58 122.17 1f2a h GLU 35 Ca 0.20 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.45 1f2a h GLU 35 Cb 0.19 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1f2a h GLU 35 CO -0.02 0.30 -0.15 0.00 -1.00 0.00 0.00 179.01 178.14 1f2a h GLN 37 N 0.28 0.95 -0.26 0.00 1.08 -0.82 -1.29 115.11 115.06 1f2a h GLN 37 Ca 0.05 -0.17 -0.01 0.00 -1.45 0.00 0.00 58.65 57.07 1f2a h GLN 37 Cb 0.68 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.94 1f2a h GLN 37 CO 0.04 0.81 0.12 2.35 -0.95 0.00 0.00 178.83 181.20 1f2a h TRP 38 N 0.93 0.38 -0.56 2.96 2.91 -0.83 -1.33 115.95 120.41 1f2a h TRP 38 Ca 0.21 -0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.20 1f2a h TRP 38 Cb 0.23 -0.12 -0.03 0.00 -0.51 0.00 0.00 29.16 28.74 1f2a h TRP 38 CO 0.02 0.37 0.33 0.35 -1.03 0.00 0.00 178.44 178.48 1f2a h PHE 39 N 0.28 0.75 0.00 2.65 3.04 -1.17 -2.13 116.94 120.37 1f2a h PHE 39 Ca 0.09 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.02 1f2a h PHE 39 Cb 0.14 -0.24 -0.00 0.00 2.56 0.00 0.00 35.95 38.40 1f2a h PHE 39 CO -0.02 0.53 -0.06 -0.07 -2.02 0.00 0.00 178.31 176.67 1f2a h LEU 40 N 0.76 0.00 0.00 0.59 3.38 -0.98 -1.53 115.31 117.53 1f2a h LEU 40 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1f2a h LEU 40 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1f2a h LEU 40 CO -0.04 0.06 0.00 0.00 0.09 0.00 0.00 178.44 178.55 1f2a n ALA 41 N -2.16 2.68 0.00 1.53 0.00 -0.52 -4.86 120.51 117.17 1f2a n ALA 41 Ca -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1f2a n ALA 41 Cb 0.23 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.20 1f2a n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f2a n GLY 42 N 0.96 1.35 3.51 0.00 0.00 -0.58 -5.09 105.19 105.34 1f2a n GLY 42 Ca 0.22 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.99 1f2a n GLY 42 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1f2a s HIS 43 N -2.00 2.45 0.37 1.61 3.76 -1.17 -5.06 115.29 115.25 1f2a s HIS 43 Ca 0.00 -0.29 -0.27 0.00 -0.15 0.00 0.00 55.06 54.34 1f2a s HIS 43 Cb 0.00 -1.14 -0.10 0.00 1.11 0.00 0.00 32.58 32.46 1f2a s HIS 43 CO 0.00 0.60 1.35 -1.25 -0.85 0.00 0.00 174.74 174.59 1f2a s PRO 44 N -3.16 4.14 -0.05 8.40 0.04 -1.26 -4.19 135.00 138.92 1f2a s PRO 44 Ca 0.27 2.28 -0.33 0.00 0.04 0.00 0.00 61.00 63.26 1f2a s PRO 44 Cb -0.07 -2.92 -0.11 0.00 0.04 0.00 0.00 34.50 31.44 1f2a s PRO 44 CO 0.15 -0.40 1.93 -0.11 0.04 0.00 0.00 177.00 178.61 1f2a n LEU 45 N 0.45 3.72 -4.11 -3.56 7.94 -1.26 -4.74 117.00 115.45 1f2a n LEU 45 Ca 0.02 0.93 -0.24 0.00 -1.11 0.00 0.00 56.01 55.61 1f2a n LEU 45 Cb 0.42 -1.43 -0.16 0.00 0.53 0.00 0.00 43.42 42.78 1f2a n LEU 45 CO 0.59 0.04 -0.48 -0.89 -1.11 0.00 0.00 177.39 175.54 1f2a s THR 46 N 4.31 1.21 -0.06 1.96 2.01 -1.26 -5.11 115.64 118.70 1f2a s THR 46 Ca 0.92 -0.62 -0.30 0.00 0.31 0.00 0.00 61.69 62.00 1f2a s THR 46 Cb -0.59 -1.03 -0.02 0.00 0.01 0.00 0.00 72.50 70.87 1f2a s THR 46 CO 0.48 0.35 1.09 0.20 -0.69 0.00 0.00 174.62 176.05 1f2a s ASN 47 N -0.10 7.18 0.35 3.53 -0.87 -1.26 -4.81 114.94 118.95 1f2a s ASN 47 Ca 0.01 1.69 0.07 0.00 -1.57 0.00 0.00 52.86 53.06 1f2a s ASN 47 Cb -0.08 -2.56 -0.02 0.00 -0.02 0.00 0.00 41.25 38.56 1f2a s ASN 47 CO 0.01 -0.48 0.32 -0.76 -2.57 0.00 0.00 177.10 173.62 1f2a s LEU 48 N 1.90 3.60 -0.34 0.60 1.43 -1.26 -1.01 118.68 123.60 1f2a s LEU 48 Ca 0.52 -0.50 -0.22 0.00 -1.03 0.00 0.00 54.13 52.90 1f2a s LEU 48 Cb -0.22 -2.25 0.00 0.00 0.03 0.00 0.00 46.19 43.76 1f2a s LEU 48 CO 0.21 -0.41 0.72 -0.55 0.23 0.00 0.00 176.35 176.56 1f2a s SER 49 N -4.04 6.54 0.14 2.29 0.15 -0.07 -4.10 113.70 114.62 1f2a s SER 49 Ca 0.42 0.40 0.06 0.00 0.70 0.00 0.00 55.95 57.53 1f2a s SER 49 Cb -0.06 -2.37 -0.13 0.00 -1.71 0.00 0.00 66.02 61.75 1f2a s SER 49 CO 0.27 -0.63 1.31 -0.33 1.20 0.00 0.00 173.24 175.07 1f2a h GLU 50 N 8.33 0.05 -0.48 5.44 3.07 -1.88 -3.20 114.58 125.91 1f2a h GLU 50 Ca -0.25 -0.08 0.01 0.00 -0.50 0.00 0.00 59.36 58.55 1f2a h GLU 50 Cb 1.10 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 29.01 1f2a h GLU 50 CO 0.87 0.98 0.32 0.37 -1.40 0.00 0.00 179.01 180.14 1f2a h GLN 51 N 0.02 0.59 -0.43 2.33 5.75 -1.86 -1.27 115.11 120.24 1f2a h GLN 51 Ca -0.03 -0.04 0.07 0.00 -0.15 0.00 0.00 58.65 58.50 1f2a h GLN 51 Cb 1.69 -0.13 -0.06 0.00 1.07 0.00 0.00 27.48 30.05 1f2a h GLN 51 CO 0.13 0.39 0.10 1.98 -2.65 0.00 0.00 178.83 178.78 1f2a h MET 52 N 0.61 0.23 0.02 1.69 4.05 -1.81 0.42 114.93 120.14 1f2a h MET 52 Ca 0.18 -0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.59 1f2a h MET 52 Cb -0.01 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 30.74 1f2a h MET 52 CO -0.04 0.15 -0.01 -0.07 0.23 0.00 0.00 176.91 177.17 1f2a h LEU 53 N 0.24 -0.02 -0.72 3.39 3.38 -1.44 0.15 115.31 120.30 1f2a h LEU 53 Ca 0.21 -0.42 0.09 0.00 0.09 0.00 0.00 57.88 57.85 1f2a h LEU 53 Cb 0.25 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 1f2a h LEU 53 CO -0.26 0.41 0.37 0.58 0.09 0.00 0.00 178.44 179.63 1f2a h VAL 54 N -0.46 0.87 0.18 1.22 2.07 -1.03 -0.86 116.25 118.24 1f2a h VAL 54 Ca -0.00 -0.22 -0.30 0.00 0.82 0.00 0.00 66.70 67.00 1f2a h VAL 54 Cb 0.44 0.18 0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1f2a h VAL 54 CO 0.00 0.12 -1.43 0.28 0.02 0.00 0.00 177.57 176.56 1f2a h SER 55 N 0.63 0.58 0.07 0.57 0.02 -0.96 -3.37 113.55 111.09 1f2a h SER 55 Ca 0.35 -0.91 -0.20 0.00 -0.84 0.00 0.00 61.79 60.18 1f2a h SER 55 Cb 0.34 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 62.66 1f2a h SER 55 CO -0.25 1.66 -2.14 0.00 -1.14 0.00 0.00 176.83 174.95 1f2a s ASP 57 N -5.13 5.61 0.00 0.00 -1.08 -0.33 -4.82 116.67 110.91 1f2a s ASP 57 Ca -0.09 -0.46 0.29 0.00 -0.52 0.00 0.00 52.55 51.77 1f2a s ASP 57 Cb 0.09 -2.55 1.50 0.00 -1.46 0.00 0.00 42.92 40.50 1f2a s ASP 57 CO 0.86 -2.25 2.02 0.29 0.52 0.00 0.00 175.17 176.61 1f2a n LYS 58 N 9.06 0.48 0.00 4.34 4.01 -1.26 -2.63 118.16 132.15 1f2a n LYS 58 Ca 0.26 0.01 0.13 0.00 -0.51 0.00 0.00 58.31 58.21 1f2a n LYS 58 Cb 0.50 -1.50 0.46 0.00 -0.51 0.00 0.00 35.03 33.97 1f2a n LYS 58 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 1f2a n THR 59 N -1.25 0.00 -4.70 -0.18 -2.24 -1.26 -4.86 114.28 99.78 1f2a n THR 59 Ca 0.15 -0.09 -0.30 0.00 -2.27 0.00 0.00 64.05 61.53 1f2a n THR 59 Cb 0.21 0.19 -0.06 0.00 -2.10 0.00 0.00 70.33 68.57 1f2a n THR 59 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1f2a n ASP 60 N -0.85 3.21 -1.83 3.42 8.00 -1.08 -4.93 116.55 122.50 1f2a n ASP 60 Ca 0.12 -3.10 -0.20 0.00 0.71 0.00 0.00 54.79 52.32 1f2a n ASP 60 Cb 0.32 0.37 0.05 0.00 -0.02 0.00 0.00 41.12 41.84 1f2a n ASP 60 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1f2a n SER 61 N -1.30 4.48 0.00 -2.24 7.64 0.09 -4.98 113.62 117.31 1f2a n SER 61 Ca -0.19 -3.76 0.00 0.00 1.01 0.00 0.00 58.87 55.93 1f2a n SER 61 Cb 0.61 -0.37 0.00 0.00 -1.01 0.00 0.00 64.21 63.44 1f2a n SER 61 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1f2a n GLY 62 N -0.76 3.08 0.00 0.23 0.00 -1.23 -0.47 105.19 106.03 1f2a n GLY 62 Ca 0.40 0.25 0.10 0.00 0.00 0.00 0.00 46.02 46.77 1f2a n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f2a n SER 64 N -1.43 2.15 0.00 0.00 7.64 0.38 -1.92 113.62 120.44 1f2a n SER 64 Ca 0.06 -1.73 0.00 0.00 1.01 0.00 0.00 58.87 58.21 1f2a n SER 64 Cb 0.22 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 1f2a n SER 64 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1f2a n GLY 65 N 1.25 1.89 0.00 0.23 0.00 -1.11 -4.91 105.19 102.53 1f2a n GLY 65 Ca 0.17 -2.20 0.00 0.00 0.00 0.00 0.00 46.02 43.99 1f2a n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f2a n GLY 66 N -0.81 -0.39 3.26 -0.02 0.00 -1.26 -0.73 105.19 105.24 1f2a n GLY 66 Ca 0.00 -1.05 -0.32 0.00 0.00 0.00 0.00 46.02 44.65 1f2a n GLY 66 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1f2a s LEU 67 N 0.00 2.15 0.29 0.99 1.43 -1.26 -4.72 118.68 117.56 1f2a s LEU 67 Ca 0.00 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.60 1f2a s LEU 67 Cb 0.00 -1.41 0.52 0.00 0.03 0.00 0.00 46.19 45.33 1f2a s LEU 67 CO 0.00 0.21 1.88 0.24 0.23 0.00 0.00 176.35 178.91 1f2a h MET 68 N 6.34 1.01 -0.49 1.70 2.86 -1.99 -1.02 114.93 123.34 1f2a h MET 68 Ca -0.27 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 57.26 1f2a h MET 68 Cb 1.20 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 32.61 1f2a h MET 68 CO 0.48 0.67 0.09 -0.91 1.06 0.00 0.00 176.91 178.29 1f2a h ASN 69 N 1.04 0.71 -0.38 1.22 2.35 -1.95 -0.48 115.58 118.08 1f2a h ASN 69 Ca 0.44 -0.13 -0.08 0.00 -0.55 0.00 0.00 56.30 55.97 1f2a h ASN 69 Cb 0.31 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 1f2a h ASN 69 CO -0.19 0.72 -0.09 0.78 -1.65 0.00 0.00 177.43 177.00 1f2a h ASN 70 N 0.73 0.74 -0.39 5.81 4.21 -1.70 -2.31 115.58 122.67 1f2a h ASN 70 Ca 0.16 -0.36 0.01 0.00 1.21 0.00 0.00 56.30 57.32 1f2a h ASN 70 Cb 0.32 -0.20 -0.02 0.00 -1.12 0.00 0.00 38.32 37.29 1f2a h ASN 70 CO 0.00 0.93 0.23 0.00 -1.29 0.00 0.00 177.43 177.30 1f2a h ALA 71 N 0.84 0.49 -0.64 -0.83 0.00 -0.64 0.84 119.26 119.32 1f2a h ALA 71 Ca 0.10 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1f2a h ALA 71 Cb 0.60 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1f2a h ALA 71 CO 0.04 -0.10 0.41 0.74 0.00 0.00 0.00 179.25 180.34 1f2a h PHE 72 N 0.47 0.78 -0.44 0.00 0.04 -1.02 -2.02 116.94 114.75 1f2a h PHE 72 Ca 0.15 0.02 -0.11 0.00 2.80 0.00 0.00 57.97 60.83 1f2a h PHE 72 Cb -0.00 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 37.87 1f2a h PHE 72 CO -0.07 0.48 -0.17 0.93 -0.60 0.00 0.00 178.31 178.88 1f2a h GLU 73 N 0.83 0.84 -0.31 1.51 4.39 -0.99 -2.89 114.58 117.97 1f2a h GLU 73 Ca 0.24 -0.32 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 1f2a h GLU 73 Cb -0.06 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 1f2a h GLU 73 CO -0.07 0.95 0.17 2.35 -1.16 0.00 0.00 179.01 181.25 1f2a h TRP 74 N 0.74 0.42 -0.31 4.33 7.01 -0.45 0.19 115.95 127.88 1f2a h TRP 74 Ca 0.11 -0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.17 1f2a h TRP 74 Cb 0.69 -0.14 -0.06 0.00 -2.10 0.00 0.00 29.16 27.55 1f2a h TRP 74 CO 0.04 0.34 -0.11 0.82 -2.79 0.00 0.00 178.44 176.75 1f2a h ILE 75 N 0.38 0.63 0.17 2.65 2.04 -1.29 0.31 117.51 122.41 1f2a h ILE 75 Ca 0.11 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.96 1f2a h ILE 75 Cb 0.06 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 1f2a h ILE 75 CO -0.02 0.00 -0.08 0.58 0.00 0.00 0.00 178.15 178.63 1f2a h VAL 76 N -0.04 0.93 -0.03 1.67 2.07 -1.31 0.16 116.25 119.70 1f2a h VAL 76 Ca 0.15 -0.93 -0.19 0.00 0.82 0.00 0.00 66.70 66.56 1f2a h VAL 76 Cb 0.28 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1f2a h VAL 76 CO -0.34 0.20 -0.79 1.56 0.02 0.00 0.00 177.57 178.22 1f2a h GLN 77 N -0.72 0.27 -0.44 1.57 1.08 -0.59 -3.26 115.11 113.02 1f2a h GLN 77 Ca -0.02 -0.25 -0.24 0.00 -1.45 0.00 0.00 58.65 56.69 1f2a h GLN 77 Cb 0.50 0.06 -0.14 0.00 -0.05 0.00 0.00 27.48 27.85 1f2a h GLN 77 CO 0.04 0.93 -0.05 0.39 -0.95 0.00 0.00 178.83 179.19 1f2a n GLU 78 N -3.75 1.97 -2.14 1.46 -0.58 0.11 -5.01 120.64 112.69 1f2a n GLU 78 Ca -0.04 -3.24 0.02 0.00 -0.42 0.00 0.00 57.16 53.48 1f2a n GLU 78 Cb 0.74 -1.88 0.03 0.00 -0.57 0.00 0.00 31.44 29.77 1f2a n GLU 78 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1f2a n ASN 78 N -1.10 1.15 0.00 1.62 4.13 -1.15 -5.01 115.26 114.90 1f2a n ASN 78 Ca 0.37 -2.02 0.00 0.00 1.68 0.00 0.00 54.58 54.61 1f2a n ASN 78 Cb 1.07 -0.34 0.00 0.00 -1.54 0.00 0.00 39.78 38.96 1f2a n ASN 78 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1f2a n GLY 78 N -0.08 0.38 3.80 7.41 0.00 0.54 -4.96 105.19 112.28 1f2a n GLY 78 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1f2a n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f2a s ALA 79 N -2.00 3.38 -0.16 4.61 0.00 -1.26 -1.61 121.76 124.72 1f2a s ALA 79 Ca 0.00 0.29 -0.02 0.00 0.00 0.00 0.00 51.96 52.23 1f2a s ALA 79 Cb 0.00 -2.93 0.05 0.00 0.00 0.00 0.00 23.12 20.23 1f2a s ALA 79 CO 0.00 0.28 0.01 0.08 0.00 0.00 0.00 175.76 176.13 1f2a s VAL 80 N -1.46 0.62 0.72 0.00 1.01 0.10 -4.92 120.40 116.48 1f2a s VAL 80 Ca 0.43 -0.42 -0.13 0.00 0.00 0.00 0.00 61.98 61.86 1f2a s VAL 80 Cb -0.19 -0.98 0.03 0.00 0.00 0.00 0.00 36.38 35.25 1f2a s VAL 80 CO 0.23 -0.03 1.10 -0.31 0.00 0.00 0.00 175.10 176.09 1f2a s TYR 81 N 1.83 2.58 0.52 5.22 4.12 -1.26 -0.48 117.35 129.88 1f2a s TYR 81 Ca 0.01 1.56 -0.18 0.00 0.02 0.00 0.00 57.07 58.47 1f2a s TYR 81 Cb -0.16 -3.11 -0.07 0.00 -1.52 0.00 0.00 41.96 37.10 1f2a s TYR 81 CO -0.07 -1.77 1.03 0.95 0.02 0.00 0.00 175.55 175.71 1f2a s THR 82 N -2.63 3.96 0.33 -0.71 -4.23 -0.28 -0.89 115.64 111.19 1f2a s THR 82 Ca 0.64 1.07 0.08 0.00 -1.18 0.00 0.00 61.69 62.29 1f2a s THR 82 Cb -0.19 -3.48 0.09 0.00 1.34 0.00 0.00 72.50 70.27 1f2a s THR 82 CO 0.49 -0.41 1.80 -0.08 -0.54 0.00 0.00 174.62 175.88 1f2a h GLU 83 N 1.09 0.26 -0.43 3.99 4.81 -1.22 -2.56 114.58 120.51 1f2a h GLU 83 Ca -0.48 -0.09 -0.05 0.00 -0.13 0.00 0.00 59.36 58.61 1f2a h GLU 83 Cb 1.21 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.55 1f2a h GLU 83 CO 0.59 0.51 0.07 -0.44 -0.73 0.00 0.00 179.01 179.01 1f2a h ASP 84 N 0.23 0.61 0.99 1.04 3.32 -1.93 -1.17 116.42 119.51 1f2a h ASP 84 Ca 0.04 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1f2a h ASP 84 Cb 0.60 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1f2a h ASP 84 CO 0.04 0.64 -0.48 -1.54 -1.72 0.00 0.00 179.24 176.18 1f2a n SER 85 N -4.28 0.72 -3.08 6.45 3.41 -1.08 -4.37 113.62 111.38 1f2a n SER 85 Ca 0.03 0.21 -0.20 0.00 -0.26 0.00 0.00 58.87 58.65 1f2a n SER 85 Cb 0.23 -0.05 -0.04 0.00 -0.26 0.00 0.00 64.21 64.09 1f2a n SER 85 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1f2a n TYR 86 N -2.13 -1.16 -1.40 7.33 -0.00 -0.99 -4.56 117.16 114.26 1f2a n TYR 86 Ca 0.04 -3.09 -0.36 0.00 -0.00 0.00 0.00 57.90 54.50 1f2a n TYR 86 Cb 0.43 0.16 0.09 0.00 -0.00 0.00 0.00 39.34 40.02 1f2a n TYR 86 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.86 174.56 1f2a n PRO 87 N 1.53 0.59 -2.37 2.98 -0.02 -0.47 -4.47 135.00 132.76 1f2a n PRO 87 Ca 0.18 0.26 -0.42 0.00 -2.02 0.00 0.00 63.50 61.50 1f2a n PRO 87 Cb 0.55 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.71 1f2a n PRO 87 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1f2a s TYR 88 N -1.77 3.33 -0.02 6.00 5.04 -1.26 -4.76 117.35 123.92 1f2a s TYR 88 Ca 0.75 1.20 0.11 0.00 -2.44 0.00 0.00 57.07 56.69 1f2a s TYR 88 Cb -0.35 -3.48 0.19 0.00 0.35 0.00 0.00 41.96 38.67 1f2a s TYR 88 CO 0.49 -1.54 1.08 0.00 -1.34 0.00 0.00 175.55 174.23 1f2a n ALA 89 N 4.20 2.21 -0.32 3.97 0.00 -1.26 -4.84 120.51 124.47 1f2a n ALA 89 Ca 0.10 -1.68 0.08 0.00 0.00 0.00 0.00 53.44 51.94 1f2a n ALA 89 Cb 0.46 -0.57 0.22 0.00 0.00 0.00 0.00 19.45 19.55 1f2a n ALA 89 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1f2a n SER 89 N 0.05 3.39 0.28 0.00 7.64 -1.26 -4.64 113.62 119.07 1f2a n SER 89 Ca 0.04 -2.11 0.18 0.00 1.01 0.00 0.00 58.87 57.98 1f2a n SER 89 Cb 0.86 -0.34 0.95 0.00 -1.01 0.00 0.00 64.21 64.66 1f2a n SER 89 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1f2a h GLY 89 N 2.70 0.00 1.92 0.23 0.00 -1.85 -0.58 103.07 105.48 1f2a h GLY 89 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1f2a h GLY 89 CO 0.04 0.00 -0.06 -2.21 0.00 0.00 0.00 176.54 174.30 1f2a n GLU 89 N -3.50 0.27 0.00 4.80 4.07 -1.26 -0.77 120.64 124.25 1f2a n GLU 89 Ca -0.01 0.21 0.00 0.00 -0.06 0.00 0.00 57.16 57.30 1f2a n GLU 89 Cb 0.22 -1.80 0.00 0.00 -0.06 0.00 0.00 31.44 29.80 1f2a n GLU 89 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1f2a n GLY 90 N 1.31 0.82 3.16 8.31 0.00 -0.22 -4.82 105.19 113.74 1f2a n GLY 90 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 1f2a n GLY 90 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1f2a s ILE 91 N -2.00 1.62 -0.30 -0.61 -4.36 -1.25 -4.87 121.20 109.43 1f2a s ILE 91 Ca 0.00 -0.80 -0.16 0.00 -0.26 0.00 0.00 60.65 59.43 1f2a s ILE 91 Cb 0.00 -1.40 -0.03 0.00 1.25 0.00 0.00 42.46 42.29 1f2a s ILE 91 CO 0.00 0.46 0.40 -0.55 0.24 0.00 0.00 174.94 175.49 1f2a s SER 92 N 0.16 6.25 0.79 4.36 0.15 -1.26 -4.32 113.70 119.83 1f2a s SER 92 Ca -0.08 0.13 -0.11 0.00 0.70 0.00 0.00 55.95 56.58 1f2a s SER 92 Cb -0.14 -2.22 0.07 0.00 -1.71 0.00 0.00 66.02 62.02 1f2a s SER 92 CO 0.04 -0.27 1.10 -2.16 1.20 0.00 0.00 173.24 173.15 1f2a s PRO 93 N 2.12 2.10 0.89 5.44 0.04 -1.26 -4.97 135.00 139.36 1f2a s PRO 93 Ca 0.15 1.24 -0.13 0.00 0.04 0.00 0.00 61.00 62.31 1f2a s PRO 93 Cb -0.16 -1.87 0.05 0.00 0.04 0.00 0.00 34.50 32.56 1f2a s PRO 93 CO 0.11 -1.77 0.69 -2.30 0.04 0.00 0.00 177.00 173.76 1f2a n PRO 94 N -3.56 -0.17 -2.61 0.56 -0.02 -1.26 -4.68 135.00 123.26 1f2a n PRO 94 Ca 0.10 0.01 -0.41 0.00 -2.02 0.00 0.00 63.50 61.17 1f2a n PRO 94 Cb 0.53 -2.04 -0.04 0.00 -0.02 0.00 0.00 33.50 31.93 1f2a n PRO 94 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1f2a s THR 96 N -0.03 2.75 -2.15 0.00 -4.23 -1.26 -5.01 115.64 105.71 1f2a s THR 96 Ca 0.49 -0.72 0.17 0.00 -1.18 0.00 0.00 61.69 60.45 1f2a s THR 96 Cb -0.26 -2.20 0.40 0.00 1.34 0.00 0.00 72.50 71.78 1f2a s THR 96 CO 0.32 0.49 1.47 0.35 -0.54 0.00 0.00 174.62 176.71 1f2a n THR 97 N 4.47 0.21 -4.01 3.99 -2.24 -1.26 -4.92 114.28 110.53 1f2a n THR 97 Ca -0.19 -0.29 -0.10 0.00 -2.27 0.00 0.00 64.05 61.20 1f2a n THR 97 Cb 0.51 0.20 -0.07 0.00 -2.10 0.00 0.00 70.33 68.86 1f2a n THR 97 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1f2a s SER 98 N -1.40 0.05 0.00 3.42 1.04 -1.26 -4.90 113.70 110.65 1f2a s SER 98 Ca 0.27 -0.97 0.00 0.00 0.48 0.00 0.00 55.95 55.73 1f2a s SER 98 Cb 0.14 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.71 1f2a s SER 98 CO 0.21 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 174.13 1f2a n GLY 99 N -0.24 0.59 3.51 7.32 0.00 -1.26 -5.06 105.19 110.05 1f2a n GLY 99 Ca -0.05 -0.72 -0.24 0.00 0.00 0.00 0.00 46.02 45.01 1f2a n GLY 99 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1f2a s HIS 100 N -2.00 2.18 -0.04 1.61 4.02 -1.26 -4.85 115.29 114.95 1f2a s HIS 100 Ca 0.00 -0.80 0.04 0.00 1.02 0.00 0.00 55.06 55.32 1f2a s HIS 100 Cb 0.00 -1.44 -0.00 0.00 -1.02 0.00 0.00 32.58 30.12 1f2a s HIS 100 CO 0.00 0.23 -0.17 0.99 1.02 0.00 0.00 174.74 176.81 1f2a s THR 101 N -3.02 1.38 -0.16 1.30 2.01 -1.26 -5.06 115.64 110.82 1f2a s THR 101 Ca 0.35 -0.69 -0.29 0.00 0.31 0.00 0.00 61.69 61.36 1f2a s THR 101 Cb 0.08 -1.18 -0.01 0.00 0.01 0.00 0.00 72.50 71.40 1f2a s THR 101 CO 0.16 0.40 1.26 -0.69 -0.69 0.00 0.00 174.62 175.06 1f2a s VAL 102 N -0.00 4.29 -0.08 3.82 1.01 -1.26 -1.13 120.40 127.04 1f2a s VAL 102 Ca -0.02 1.56 0.21 0.00 0.00 0.00 0.00 61.98 63.72 1f2a s VAL 102 Cb -0.11 -4.00 -0.31 0.00 0.00 0.00 0.00 36.38 31.96 1f2a s VAL 102 CO 0.02 -0.14 0.34 0.61 0.00 0.00 0.00 175.10 175.94 1f2a n GLY 103 N 3.61 -0.99 3.59 4.51 0.00 0.36 -4.79 105.19 111.47 1f2a n GLY 103 Ca 0.14 -0.46 -0.10 0.00 0.00 0.00 0.00 46.02 45.60 1f2a n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f2a s ALA 105 N -3.18 -1.47 0.01 4.61 0.00 -0.78 -4.97 121.76 115.98 1f2a s ALA 105 Ca -0.09 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.08 1f2a s ALA 105 Cb 0.11 0.86 -0.01 0.00 0.00 0.00 0.00 23.12 24.08 1f2a s ALA 105 CO 0.88 -0.87 -0.02 0.95 0.00 0.00 0.00 175.76 176.69 1f2a s THR 106 N -3.79 0.09 0.11 0.00 -4.23 -1.26 -0.72 115.64 105.85 1f2a s THR 106 Ca 0.05 -0.59 0.06 0.00 -1.18 0.00 0.00 61.69 60.04 1f2a s THR 106 Cb -0.03 -0.19 -0.04 0.00 1.34 0.00 0.00 72.50 73.59 1f2a s THR 106 CO -0.05 -0.31 -0.15 0.27 -0.54 0.00 0.00 174.62 173.83 1f2a s ILE 107 N -0.92 1.38 -0.21 2.99 -4.36 -0.63 -4.71 121.20 114.74 1f2a s ILE 107 Ca -0.10 -1.63 0.16 0.00 -0.26 0.00 0.00 60.65 58.82 1f2a s ILE 107 Cb -0.06 -1.47 -0.23 0.00 1.25 0.00 0.00 42.46 41.94 1f2a s ILE 107 CO -0.01 -0.33 0.43 0.35 0.24 0.00 0.00 174.94 175.63 1f2a n THR 108 N 0.72 0.00 -2.63 8.37 -2.24 0.06 -4.57 114.28 114.00 1f2a n THR 108 Ca -0.17 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 1f2a n THR 108 Cb 0.56 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 69.16 1f2a n THR 108 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f2a n GLY 109 N 1.53 -0.58 3.40 3.38 0.00 -1.16 -5.00 105.19 106.76 1f2a n GLY 109 Ca -0.01 -0.63 -0.14 0.00 0.00 0.00 0.00 46.02 45.24 1f2a n GLY 109 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1f2a s HIS 110 N -3.18 -0.44 0.06 1.61 -0.00 -1.26 -0.82 115.29 111.27 1f2a s HIS 110 Ca 0.00 0.45 0.09 0.00 -0.00 0.00 0.00 55.06 55.61 1f2a s HIS 110 Cb 0.00 0.37 -0.03 0.00 -0.00 0.00 0.00 32.58 32.92 1f2a s HIS 110 CO 0.00 -0.67 -0.25 0.14 -0.00 0.00 0.00 174.74 173.95 1f2a s VAL 111 N -2.64 2.05 -0.24 -5.38 -7.23 -0.20 -4.93 120.40 101.84 1f2a s VAL 111 Ca -0.04 -1.43 -0.07 0.00 -1.81 0.00 0.00 61.98 58.63 1f2a s VAL 111 Cb -0.00 -1.78 -0.03 0.00 0.56 0.00 0.00 36.38 35.13 1f2a s VAL 111 CO -0.03 0.26 0.06 -1.61 -0.31 0.00 0.00 175.10 173.47 1f2a s GLU 112 N -1.41 3.66 0.53 4.82 2.02 -1.26 -1.70 118.70 125.36 1f2a s GLU 112 Ca 0.11 -0.48 -0.14 0.00 0.02 0.00 0.00 54.97 54.48 1f2a s GLU 112 Cb -0.10 -3.28 -0.07 0.00 0.10 0.00 0.00 34.13 30.79 1f2a s GLU 112 CO 0.03 -0.13 0.97 -0.51 0.02 0.00 0.00 175.26 175.64 1f2a s LEU 113 N 1.44 3.54 0.65 1.80 1.43 -0.17 -4.99 118.68 122.39 1f2a s LEU 113 Ca 0.05 1.46 -0.18 0.00 -1.03 0.00 0.00 54.13 54.44 1f2a s LEU 113 Cb -0.15 -4.43 -0.01 0.00 0.03 0.00 0.00 46.19 41.64 1f2a s LEU 113 CO 0.03 -0.64 1.27 -2.84 0.23 0.00 0.00 176.35 174.40 1f2a s PRO 114 N -4.36 2.54 -1.41 1.29 0.02 -1.26 -4.59 135.00 127.23 1f2a s PRO 114 Ca 0.57 1.98 -0.11 0.00 0.02 0.00 0.00 61.00 63.46 1f2a s PRO 114 Cb -0.10 -1.85 0.07 0.00 0.02 0.00 0.00 34.50 32.64 1f2a s PRO 114 CO 0.38 -1.58 2.24 1.04 -0.33 0.00 0.00 177.00 178.74 1f2a n GLN 115 N -2.00 3.45 -3.66 5.54 6.02 -1.26 -4.67 117.38 120.81 1f2a n GLN 115 Ca 0.15 -2.96 -0.08 0.00 -0.01 0.00 0.00 57.00 54.10 1f2a n GLN 115 Cb 0.49 -3.01 -0.09 0.00 1.02 0.00 0.00 30.24 28.64 1f2a n GLN 115 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1f2a s ASP 116 N 1.90 -0.31 0.28 1.08 -1.08 -1.26 -4.92 116.67 112.35 1f2a s ASP 116 Ca 0.49 1.02 -0.03 0.00 -0.52 0.00 0.00 52.55 53.50 1f2a s ASP 116 Cb 0.14 1.36 0.38 0.00 -1.46 0.00 0.00 42.92 43.34 1f2a s ASP 116 CO -0.05 -0.23 1.94 -0.33 0.52 0.00 0.00 175.17 177.02 1f2a h GLU 117 N 8.09 1.17 -0.64 4.34 5.08 -1.91 0.21 114.58 130.93 1f2a h GLU 117 Ca -0.17 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.03 1f2a h GLU 117 Cb 1.11 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 30.07 1f2a h GLU 117 CO 0.13 0.78 0.06 0.00 -1.00 0.00 0.00 179.01 178.97 1f2a h ALA 118 N 1.44 0.86 -0.21 3.43 0.00 -1.97 -0.34 119.26 122.48 1f2a h ALA 118 Ca 0.35 -0.29 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 1f2a h ALA 118 Cb -0.07 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1f2a h ALA 118 CO -0.09 0.66 -0.54 1.96 0.00 0.00 0.00 179.25 181.24 1f2a h GLN 119 N 1.01 0.61 -0.50 0.00 4.20 -1.83 -1.75 115.11 116.85 1f2a h GLN 119 Ca 0.19 -0.38 -0.08 0.00 0.06 0.00 0.00 58.65 58.43 1f2a h GLN 119 Cb 0.50 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.30 1f2a h GLN 119 CO 0.02 0.99 -0.02 0.82 -0.67 0.00 0.00 178.83 179.98 1f2a h ILE 120 N 0.47 1.26 -0.69 2.54 2.04 -0.78 -2.30 117.51 120.06 1f2a h ILE 120 Ca 0.01 -1.11 -0.02 0.00 1.00 0.00 0.00 64.86 64.74 1f2a h ILE 120 Cb 1.09 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 38.12 1f2a h ILE 120 CO 0.10 0.39 0.35 0.00 0.00 0.00 0.00 178.15 179.00 1f2a h ALA 121 N 0.93 0.89 -0.70 1.87 0.00 -0.93 -0.55 119.26 120.77 1f2a h ALA 121 Ca 0.14 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1f2a h ALA 121 Cb 0.54 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1f2a h ALA 121 CO 0.03 0.44 0.39 0.00 0.00 0.00 0.00 179.25 180.10 1f2a h ALA 122 N 1.17 0.89 -0.24 0.00 0.00 -1.12 -0.75 119.26 119.21 1f2a h ALA 122 Ca 0.24 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1f2a h ALA 122 Cb 0.08 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1f2a h ALA 122 CO -0.03 0.40 -0.11 2.35 0.00 0.00 0.00 179.25 181.86 1f2a h TRP 123 N 0.96 0.58 -0.67 0.00 7.01 -1.08 -3.11 115.95 119.63 1f2a h TRP 123 Ca 0.25 -0.14 -0.01 0.00 2.11 0.00 0.00 58.89 61.09 1f2a h TRP 123 Cb 0.03 -0.13 -0.03 0.00 -2.10 0.00 0.00 29.16 26.92 1f2a h TRP 123 CO -0.01 0.76 0.36 1.25 -2.79 0.00 0.00 178.44 178.01 1f2a h LEU 124 N 0.23 0.82 -1.60 0.65 6.46 -0.90 0.16 115.31 121.13 1f2a h LEU 124 Ca 0.06 -0.06 0.01 0.00 -0.12 0.00 0.00 57.88 57.76 1f2a h LEU 124 Cb 0.60 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 40.30 1f2a h LEU 124 CO 0.03 0.67 0.28 0.00 -0.62 0.00 0.00 178.44 178.80 1f2a h ALA 125 N 1.47 1.72 0.00 1.25 0.00 -1.07 -1.07 119.26 121.55 1f2a h ALA 125 Ca 0.24 -0.03 -0.40 0.00 0.00 0.00 0.00 54.91 54.72 1f2a h ALA 125 Cb 0.03 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 17.59 1f2a h ALA 125 CO -0.04 0.26 -2.42 0.28 0.00 0.00 0.00 179.25 177.33 1f2a n VAL 126 N -4.47 1.41 0.91 0.00 0.31 -1.05 -4.71 118.33 110.73 1f2a n VAL 126 Ca 0.03 -0.46 0.11 0.00 -0.01 0.00 0.00 64.34 64.02 1f2a n VAL 126 Cb 0.07 -1.58 0.08 0.00 -0.91 0.00 0.00 33.84 31.50 1f2a n VAL 126 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1f2a n ASN 127 N -3.64 0.68 0.00 4.52 4.13 0.52 -5.09 115.26 116.38 1f2a n ASN 127 Ca -0.47 -0.48 0.00 0.00 1.68 0.00 0.00 54.58 55.31 1f2a n ASN 127 Cb 0.92 0.61 0.00 0.00 -1.54 0.00 0.00 39.78 39.76 1f2a n ASN 127 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1f2a n GLY 128 N 1.47 -2.91 3.54 7.41 0.00 -0.41 -4.91 105.19 109.39 1f2a n GLY 128 Ca 0.04 -2.15 -0.45 0.00 0.00 0.00 0.00 46.02 43.47 1f2a n GLY 128 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1f2a n PRO 129 N -0.14 1.03 -5.14 1.61 -0.02 -1.26 -4.35 135.00 126.73 1f2a n PRO 129 Ca 0.00 0.36 -0.29 0.00 -2.02 0.00 0.00 63.50 61.55 1f2a n PRO 129 Cb 0.00 -1.66 -0.16 0.00 -0.02 0.00 0.00 33.50 31.66 1f2a n PRO 129 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1f2a s VAL 130 N -1.08 1.88 0.01 -1.45 1.01 -0.89 -4.88 120.40 115.00 1f2a s VAL 130 Ca 0.60 -1.05 -0.28 0.00 0.00 0.00 0.00 61.98 61.25 1f2a s VAL 130 Cb -0.74 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 1f2a s VAL 130 CO 0.59 0.50 0.89 0.00 0.00 0.00 0.00 175.10 177.08 1f2a s ALA 131 N -0.59 3.24 0.06 5.51 0.00 0.45 -0.76 121.76 129.67 1f2a s ALA 131 Ca 0.09 0.43 0.01 0.00 0.00 0.00 0.00 51.96 52.49 1f2a s ALA 131 Cb -0.09 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 1f2a s ALA 131 CO -0.01 -0.13 -0.06 0.14 0.00 0.00 0.00 175.76 175.71 1f2a s VAL 132 N 0.63 0.43 -0.01 0.00 -7.23 -0.83 -0.59 120.40 112.80 1f2a s VAL 132 Ca 0.46 -1.44 -0.00 0.00 -1.81 0.00 0.00 61.98 59.19 1f2a s VAL 132 Cb -0.21 -1.03 -0.04 0.00 0.56 0.00 0.00 36.38 35.67 1f2a s VAL 132 CO 0.26 -0.67 0.07 0.00 -0.31 0.00 0.00 175.10 174.45 1f2a s ALA 133 N -2.54 3.55 0.20 1.32 0.00 -1.09 -0.99 121.76 122.21 1f2a s ALA 133 Ca -0.02 -0.87 -0.05 0.00 0.00 0.00 0.00 51.96 51.02 1f2a s ALA 133 Cb -0.02 -1.57 -0.03 0.00 0.00 0.00 0.00 23.12 21.51 1f2a s ALA 133 CO -0.03 0.68 0.23 0.14 0.00 0.00 0.00 175.76 176.78 1f2a s VAL 134 N -1.17 0.02 -0.37 0.00 -7.23 -0.06 -4.28 120.40 107.31 1f2a s VAL 134 Ca 0.22 -1.76 -0.18 0.00 -1.81 0.00 0.00 61.98 58.45 1f2a s VAL 134 Cb -0.12 -2.30 0.00 0.00 0.56 0.00 0.00 36.38 34.53 1f2a s VAL 134 CO 0.13 -0.08 0.49 -0.62 -0.31 0.00 0.00 175.10 174.71 1f2a s ASP 135 N -3.09 6.28 -0.35 4.85 3.68 0.44 -1.57 116.67 126.91 1f2a s ASP 135 Ca 0.30 -0.18 0.09 0.00 2.13 0.00 0.00 52.55 54.89 1f2a s ASP 135 Cb 0.05 -2.26 0.72 0.00 -1.45 0.00 0.00 42.92 39.98 1f2a s ASP 135 CO 0.09 -0.51 1.82 0.00 0.13 0.00 0.00 175.17 176.70 1f2a n ALA 136 N 5.72 4.77 -0.18 3.66 0.00 -1.26 -4.60 120.51 128.62 1f2a n ALA 136 Ca -0.05 -2.50 -0.07 0.00 0.00 0.00 0.00 53.44 50.82 1f2a n ALA 136 Cb 0.49 -1.26 0.02 0.00 0.00 0.00 0.00 19.45 18.70 1f2a n ALA 136 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1f2a h SER 139 N 2.26 0.61 0.48 0.00 0.02 -1.91 -2.62 113.55 112.40 1f2a h SER 139 Ca 0.34 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.26 1f2a h SER 139 Cb 2.42 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 64.81 1f2a h SER 139 CO 0.80 0.46 -0.03 -1.20 -1.14 0.00 0.00 176.83 175.71 1f2a n SER 140 N -4.71 0.13 0.18 3.07 7.64 -1.26 -4.16 113.62 114.51 1f2a n SER 140 Ca 0.03 -0.31 0.13 0.00 1.01 0.00 0.00 58.87 59.74 1f2a n SER 140 Cb 0.03 -0.21 0.41 0.00 -1.01 0.00 0.00 64.21 63.43 1f2a n SER 140 CO 0.00 0.00 0.00 -0.50 -3.01 0.00 0.00 175.04 171.53 1f2a h TRP 141 N 0.15 0.00 0.00 1.43 4.06 -1.78 -3.31 115.95 116.50 1f2a h TRP 141 Ca 0.00 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.88 1f2a h TRP 141 Cb 0.29 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.44 1f2a h TRP 141 CO 0.00 0.00 -0.34 1.98 -3.56 0.00 0.00 178.44 176.52 1f2a h MET 142 N 0.00 0.00 -0.51 0.49 4.05 -1.74 -2.81 114.93 114.40 1f2a h MET 142 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1f2a h MET 142 Cb 0.70 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.50 1f2a h MET 142 CO 0.00 0.34 0.00 0.25 0.23 0.00 0.00 176.91 177.73 1f2a n THR 143 N -3.84 0.67 -2.21 -0.77 -2.24 -1.24 -4.96 114.28 99.69 1f2a n THR 143 Ca -0.01 -0.81 -0.42 0.00 -2.27 0.00 0.00 64.05 60.53 1f2a n THR 143 Cb 0.41 0.75 -0.03 0.00 -2.10 0.00 0.00 70.33 69.37 1f2a n THR 143 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1f2a s TYR 144 N -1.33 2.86 -0.06 4.78 6.14 -1.06 -4.89 117.35 123.79 1f2a s TYR 144 Ca 0.42 0.81 0.03 0.00 0.64 0.00 0.00 57.07 58.97 1f2a s TYR 144 Cb 0.23 -3.67 -0.05 0.00 0.42 0.00 0.00 41.96 38.89 1f2a s TYR 144 CO 0.32 -2.49 0.09 0.25 0.64 0.00 0.00 175.55 174.36 1f2a n THR 145 N 4.62 0.00 0.00 4.34 -2.24 -1.26 -3.95 114.28 115.79 1f2a n THR 145 Ca 0.13 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1f2a n THR 145 Cb 0.43 0.63 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 1f2a n THR 145 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f2a n GLY 146 N 1.88 0.36 0.19 3.38 0.00 -1.26 -4.56 105.19 105.18 1f2a n GLY 146 Ca -0.00 -1.51 0.03 0.00 0.00 0.00 0.00 46.02 44.53 1f2a n GLY 146 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f2a n GLY 147 N -1.37 -1.59 3.64 -0.02 0.00 -1.26 -4.78 105.19 99.80 1f2a n GLY 147 Ca 0.00 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.13 1f2a n GLY 147 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f2a s VAL 148 N -1.51 4.77 -0.41 1.61 1.01 -1.26 -4.29 120.40 120.31 1f2a s VAL 148 Ca 0.00 1.56 -0.29 0.00 0.00 0.00 0.00 61.98 63.25 1f2a s VAL 148 Cb 0.00 -4.19 0.01 0.00 0.00 0.00 0.00 36.38 32.21 1f2a s VAL 148 CO 0.00 -0.18 1.33 -0.32 0.00 0.00 0.00 175.10 175.93 1f2a s MET 149 N 3.01 3.66 0.01 2.72 0.00 -0.26 -4.87 119.30 123.57 1f2a s MET 149 Ca 0.37 0.89 0.24 0.00 0.00 0.00 0.00 55.69 57.19 1f2a s MET 149 Cb -0.15 -3.97 0.35 0.00 0.00 0.00 0.00 34.83 31.06 1f2a s MET 149 CO 0.09 -1.46 1.30 0.25 0.00 0.00 0.00 175.02 175.20 1f2a n THR 151 N 6.90 0.04 -3.66 10.11 -2.24 -1.26 -1.08 114.28 123.09 1f2a n THR 151 Ca 0.15 -0.04 -0.18 0.00 -2.27 0.00 0.00 64.05 61.70 1f2a n THR 151 Cb 0.48 0.32 -0.16 0.00 -2.10 0.00 0.00 70.33 68.87 1f2a n THR 151 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1f2a s SER 152 N -3.18 0.98 -0.03 3.42 0.15 -1.26 -4.89 113.70 108.90 1f2a s SER 152 Ca 0.10 0.18 0.03 0.00 0.70 0.00 0.00 55.95 56.95 1f2a s SER 152 Cb 0.17 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.60 1f2a s SER 152 CO 0.73 -0.25 -0.09 0.00 1.20 0.00 0.00 173.24 174.82 1f2a s VAL 154 N 0.19 3.34 -0.66 0.00 1.01 -1.26 -4.25 120.40 118.77 1f2a s VAL 154 Ca -0.03 0.40 0.05 0.00 0.00 0.00 0.00 61.98 62.40 1f2a s VAL 154 Cb -0.09 -3.27 0.20 0.00 0.00 0.00 0.00 36.38 33.22 1f2a s VAL 154 CO 0.01 -0.05 0.57 -1.20 0.00 0.00 0.00 175.10 174.43 1f2a n SER 155 N 7.54 2.97 -0.02 3.32 7.64 -1.26 -4.42 113.62 129.39 1f2a n SER 155 Ca 0.19 -3.22 -0.06 0.00 1.01 0.00 0.00 58.87 56.79 1f2a n SER 155 Cb 0.42 -0.71 -0.02 0.00 -1.01 0.00 0.00 64.21 62.89 1f2a n SER 155 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1f2a n GLU 156 N 1.62 0.14 -3.97 1.43 1.02 -1.26 -4.86 120.64 114.76 1f2a n GLU 156 Ca 0.24 0.06 -0.17 0.00 -0.02 0.00 0.00 57.16 57.27 1f2a n GLU 156 Cb 0.38 -0.74 -0.16 0.00 -0.02 0.00 0.00 31.44 30.90 1f2a n GLU 156 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1f2a s GLN 156 N -2.17 0.37 0.13 3.49 2.00 -1.26 -5.11 119.66 117.11 1f2a s GLN 156 Ca -0.09 0.03 -0.31 0.00 -2.00 0.00 0.00 55.36 53.00 1f2a s GLN 156 Cb 0.03 -0.51 -0.08 0.00 0.80 0.00 0.00 33.01 33.25 1f2a s GLN 156 CO 0.12 -0.11 1.33 -0.51 -0.50 0.00 0.00 175.29 175.62 1f2a s LEU 157 N 0.90 4.38 0.00 3.68 1.43 -1.26 -4.23 118.68 123.58 1f2a s LEU 157 Ca -0.09 2.29 0.00 0.00 -1.03 0.00 0.00 54.13 55.30 1f2a s LEU 157 Cb -0.13 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.50 1f2a s LEU 157 CO -0.01 -0.59 0.20 -0.90 0.23 0.00 0.00 176.35 175.28 1f2a n ASP 158 N 3.60 0.00 -3.84 2.29 3.85 -0.61 -4.94 116.55 116.90 1f2a n ASP 158 Ca 0.10 -1.00 -0.12 0.00 -0.71 0.00 0.00 54.79 53.06 1f2a n ASP 158 Cb 0.43 0.00 -0.11 0.00 -1.35 0.00 0.00 41.12 40.09 1f2a n ASP 158 CO 0.00 0.00 0.00 -2.28 -1.01 0.00 0.00 177.20 173.91 1f2a s HIS 159 N 0.00 -0.06 -0.12 2.11 5.04 -0.85 -4.90 115.29 116.51 1f2a s HIS 159 Ca 0.00 0.12 0.01 0.00 -1.54 0.00 0.00 55.06 53.65 1f2a s HIS 159 Cb 0.00 0.00 -0.01 0.00 0.04 0.00 0.00 32.58 32.61 1f2a s HIS 159 CO 0.00 -0.21 -0.15 0.20 -2.34 0.00 0.00 174.74 172.24 1f2a s GLY 160 N -0.78 1.51 0.09 1.59 0.00 -1.26 -0.88 107.32 107.59 1f2a s GLY 160 Ca -0.09 -0.91 0.02 0.00 0.00 0.00 0.00 44.72 43.75 1f2a s GLY 160 CO 0.01 -0.24 0.07 3.33 0.00 0.00 0.00 173.10 176.28 1f2a n VAL 161 N 3.47 0.00 -4.48 1.40 0.24 -0.16 -4.45 118.33 114.35 1f2a n VAL 161 Ca -0.18 -0.65 -0.26 0.00 -2.04 0.00 0.00 64.34 61.20 1f2a n VAL 161 Cb 0.53 0.32 -0.17 0.00 -1.47 0.00 0.00 33.84 33.05 1f2a n VAL 161 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1f2a s LEU 162 N 0.00 1.61 -0.29 1.34 2.96 -1.05 -1.98 118.68 121.26 1f2a s LEU 162 Ca 0.11 -0.33 -0.23 0.00 -0.22 0.00 0.00 54.13 53.45 1f2a s LEU 162 Cb 0.01 -0.90 -0.00 0.00 0.50 0.00 0.00 46.19 45.79 1f2a s LEU 162 CO 0.07 0.01 0.75 -0.76 -1.32 0.00 0.00 176.35 175.10 1f2a s LEU 163 N 0.88 4.09 0.00 -0.68 1.43 0.06 -0.51 118.68 123.95 1f2a s LEU 163 Ca -0.10 0.67 0.12 0.00 -1.03 0.00 0.00 54.13 53.80 1f2a s LEU 163 Cb -0.15 -3.02 -0.01 0.00 0.03 0.00 0.00 46.19 43.04 1f2a s LEU 163 CO 0.01 -0.55 0.72 1.33 0.23 0.00 0.00 176.35 178.08 1f2a n VAL 164 N 5.44 0.00 -1.14 -1.59 0.24 -0.35 -2.10 118.33 118.84 1f2a n VAL 164 Ca 0.03 -0.37 0.00 0.00 -2.04 0.00 0.00 64.34 61.96 1f2a n VAL 164 Cb 0.48 1.14 0.00 0.00 -1.47 0.00 0.00 33.84 34.00 1f2a n VAL 164 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1f2a n GLY 165 N 1.00 -1.61 3.63 7.63 0.00 -1.18 -1.48 105.19 113.17 1f2a n GLY 165 Ca 0.05 -1.07 -0.09 0.00 0.00 0.00 0.00 46.02 44.91 1f2a n GLY 165 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1f2a s TYR 166 N -2.34 -0.36 -0.23 1.61 -0.85 0.39 -0.88 117.35 114.69 1f2a s TYR 166 Ca 0.00 0.04 -0.03 0.00 -0.52 0.00 0.00 57.07 56.56 1f2a s TYR 166 Cb 0.00 0.63 0.10 0.00 0.38 0.00 0.00 41.96 43.07 1f2a s TYR 166 CO 0.00 -0.99 0.22 1.21 -1.52 0.00 0.00 175.55 174.47 1f2a s ASN 167 N -2.82 1.69 0.00 -0.18 3.84 -0.54 -1.06 114.94 115.87 1f2a s ASN 167 Ca 0.06 -0.46 0.25 0.00 0.21 0.00 0.00 52.86 52.93 1f2a s ASN 167 Cb -0.03 0.31 0.54 0.00 -0.55 0.00 0.00 41.25 41.52 1f2a s ASN 167 CO -0.04 -0.35 1.44 0.47 -2.79 0.00 0.00 177.10 175.83 1f2a n ASP 167 N 5.31 0.51 -2.96 -4.21 10.43 0.43 -1.99 116.55 124.07 1f2a n ASP 167 Ca -0.05 -0.26 -0.33 0.00 2.57 0.00 0.00 54.79 56.72 1f2a n ASP 167 Cb 0.48 0.22 -0.03 0.00 1.84 0.00 0.00 41.12 43.63 1f2a n ASP 167 CO 0.00 0.00 0.00 -1.54 -1.07 0.00 0.00 177.20 174.59 1f2a n SER 167 N -1.45 7.20 -0.04 -2.24 3.41 -1.25 -4.70 113.62 114.53 1f2a n SER 167 Ca 0.06 -3.21 -0.08 0.00 -0.26 0.00 0.00 58.87 55.38 1f2a n SER 167 Cb 0.34 -1.28 -0.07 0.00 -0.26 0.00 0.00 64.21 62.93 1f2a n SER 167 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1f2a h ALA 167 N 3.72 -0.04 -3.63 7.33 0.00 -2.06 -3.49 119.26 121.09 1f2a h ALA 167 Ca 0.53 -0.26 -0.67 0.00 0.00 0.00 0.00 54.91 54.51 1f2a h ALA 167 Cb 0.52 0.01 -0.35 0.00 0.00 0.00 0.00 17.79 17.97 1f2a h ALA 167 CO 1.15 -0.05 -0.77 0.08 0.00 0.00 0.00 179.25 179.67 1f2a s VAL 168 N -2.15 2.50 0.42 0.00 1.01 -1.26 -5.09 120.40 115.83 1f2a s VAL 168 Ca -0.11 -1.44 -0.25 0.00 0.00 0.00 0.00 61.98 60.19 1f2a s VAL 168 Cb -0.01 -2.41 -0.10 0.00 0.00 0.00 0.00 36.38 33.85 1f2a s VAL 168 CO 0.39 0.01 1.09 -0.81 0.00 0.00 0.00 175.10 175.78 1f2a n PRO 169 N 4.53 1.52 -4.02 2.72 -0.04 -1.26 -4.87 135.00 133.58 1f2a n PRO 169 Ca -0.14 0.54 -0.09 0.00 -0.04 0.00 0.00 63.50 63.77 1f2a n PRO 169 Cb 0.44 -2.15 -0.08 0.00 -0.04 0.00 0.00 33.50 31.67 1f2a n PRO 169 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1f2a s TYR 170 N -1.25 0.52 0.03 0.54 -0.85 -0.84 -0.64 117.35 114.86 1f2a s TYR 170 Ca 0.63 -0.92 -0.00 0.00 -0.52 0.00 0.00 57.07 56.25 1f2a s TYR 170 Cb -0.54 -0.23 -0.04 0.00 0.38 0.00 0.00 41.96 41.53 1f2a s TYR 170 CO 0.57 -0.59 0.15 -1.58 -1.52 0.00 0.00 175.55 172.57 1f2a s TRP 171 N -3.97 3.41 -0.23 -3.49 0.52 0.53 -1.46 118.94 114.24 1f2a s TRP 171 Ca 0.17 0.24 -0.06 0.00 0.02 0.00 0.00 56.10 56.47 1f2a s TRP 171 Cb 0.05 -1.75 -0.02 0.00 -1.15 0.00 0.00 33.47 30.60 1f2a s TRP 171 CO -0.02 0.59 0.02 0.42 0.02 0.00 0.00 176.95 177.97 1f2a s ILE 172 N -1.35 3.86 -0.09 2.03 1.01 -0.06 -2.40 121.20 124.20 1f2a s ILE 172 Ca 0.28 -0.33 0.04 0.00 0.00 0.00 0.00 60.65 60.64 1f2a s ILE 172 Cb -0.12 -2.78 0.00 0.00 0.01 0.00 0.00 42.46 39.57 1f2a s ILE 172 CO 0.20 0.38 -0.21 -0.63 0.00 0.00 0.00 174.94 174.69 1f2a s ILE 173 N 1.54 1.78 -0.18 2.92 1.01 -0.01 -1.21 121.20 127.04 1f2a s ILE 173 Ca 0.06 -0.86 -0.21 0.00 0.00 0.00 0.00 60.65 59.64 1f2a s ILE 173 Cb -0.15 -1.56 -0.03 0.00 0.01 0.00 0.00 42.46 40.74 1f2a s ILE 173 CO 0.00 0.50 0.63 -0.75 0.00 0.00 0.00 174.94 175.32 1f2a s LYS 174 N 0.42 4.24 0.48 2.79 2.20 0.33 -1.41 119.74 128.79 1f2a s LYS 174 Ca -0.17 0.63 0.08 0.00 -0.36 0.00 0.00 55.97 56.14 1f2a s LYS 174 Cb -0.17 -3.56 0.02 0.00 -1.51 0.00 0.00 37.83 32.61 1f2a s LYS 174 CO 0.07 -0.19 0.48 1.21 -0.36 0.00 0.00 175.35 176.56 1f2a s ASN 175 N 1.13 5.01 -0.31 1.43 2.47 -0.85 -2.54 114.94 121.28 1f2a s ASN 175 Ca 0.29 -0.87 0.09 0.00 0.42 0.00 0.00 52.86 52.80 1f2a s ASN 175 Cb -0.16 -0.15 0.46 0.00 -1.45 0.00 0.00 41.25 39.96 1f2a s ASN 175 CO 0.11 -0.92 1.16 -1.54 -3.72 0.00 0.00 177.10 172.19 1f2a n SER 176 N -1.77 4.29 -1.80 -4.21 3.41 -1.26 -4.49 113.62 107.79 1f2a n SER 176 Ca 0.05 -3.46 -0.19 0.00 -0.26 0.00 0.00 58.87 55.01 1f2a n SER 176 Cb 0.62 -0.38 0.06 0.00 -0.26 0.00 0.00 64.21 64.24 1f2a n SER 176 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1f2a n TRP 177 N -0.64 2.31 -0.63 7.33 8.01 -1.24 -1.68 117.44 130.91 1f2a n TRP 177 Ca 0.37 -2.13 0.08 0.00 -1.31 0.00 0.00 57.50 54.50 1f2a n TRP 177 Cb 0.89 -0.39 -0.03 0.00 -2.01 0.00 0.00 31.31 29.78 1f2a n TRP 177 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.69 176.93 1f2a n THR 178 N -0.79 -0.11 1.25 -0.99 -2.24 -0.77 -4.12 114.28 106.50 1f2a n THR 178 Ca 0.41 0.27 0.13 0.00 -2.27 0.00 0.00 64.05 62.59 1f2a n THR 178 Cb 0.92 -0.48 0.67 0.00 -2.10 0.00 0.00 70.33 69.34 1f2a n THR 178 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1f2a n THR 179 N -3.22 0.12 0.21 4.28 -2.24 -1.26 -3.16 114.28 109.01 1f2a n THR 179 Ca -0.02 0.03 0.10 0.00 -2.27 0.00 0.00 64.05 61.89 1f2a n THR 179 Cb 0.30 -0.58 0.26 0.00 -2.10 0.00 0.00 70.33 68.21 1f2a n THR 179 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1f2a h GLN 180 N 0.00 0.00 -6.17 -0.78 4.20 -1.90 -3.18 115.11 107.28 1f2a h GLN 180 Ca 0.00 0.00 -0.58 0.00 0.06 0.00 0.00 58.65 58.13 1f2a h GLN 180 Cb 0.28 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.01 1f2a h GLN 180 CO 0.00 0.17 -0.15 -0.46 -0.67 0.00 0.00 178.83 177.72 1f2a s TRP 181 N -3.29 3.67 0.00 2.96 -0.00 -1.19 -4.90 118.94 116.18 1f2a s TRP 181 Ca 0.04 1.01 0.00 0.00 -0.00 0.00 0.00 56.10 57.15 1f2a s TRP 181 Cb 0.07 -2.32 0.00 0.00 -0.00 0.00 0.00 33.47 31.23 1f2a s TRP 181 CO 0.66 0.54 0.00 0.41 -0.00 0.00 0.00 176.95 178.56 1f2a n GLY 182 N 1.26 2.15 3.43 5.86 0.00 -1.25 -0.14 105.19 116.50 1f2a n GLY 182 Ca -0.09 -0.44 -0.44 0.00 0.00 0.00 0.00 46.02 45.05 1f2a n GLY 182 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1f2a s GLU 183 N 0.00 4.04 -1.42 1.61 2.02 0.18 -4.43 118.70 120.71 1f2a s GLU 183 Ca 0.00 -2.61 -0.11 0.00 0.02 0.00 0.00 54.97 52.27 1f2a s GLU 183 Cb 0.00 -4.93 0.04 0.00 0.10 0.00 0.00 34.13 29.34 1f2a s GLU 183 CO 0.00 -1.65 1.12 0.39 0.02 0.00 0.00 175.26 175.14 1f2a n GLU 184 N 5.12 -7.17 -0.12 1.61 1.02 -1.25 -1.76 120.64 118.10 1f2a n GLU 184 Ca 0.32 0.75 0.00 0.00 -0.02 0.00 0.00 57.16 58.21 1f2a n GLU 184 Cb 0.43 -5.76 0.00 0.00 -0.02 0.00 0.00 31.44 26.09 1f2a n GLU 184 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1f2a n GLY 185 N -1.91 0.80 3.81 0.62 0.00 0.80 -4.62 105.19 104.69 1f2a n GLY 185 Ca 0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 1f2a n GLY 185 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1f2a s TYR 186 N -2.42 2.89 -0.03 1.61 2.02 -0.72 -2.01 117.35 118.67 1f2a s TYR 186 Ca 0.00 -0.28 -0.03 0.00 -0.37 0.00 0.00 57.07 56.39 1f2a s TYR 186 Cb 0.00 -1.64 0.01 0.00 -0.40 0.00 0.00 41.96 39.93 1f2a s TYR 186 CO 0.00 0.32 0.09 -1.50 -1.57 0.00 0.00 175.55 172.89 1f2a s ILE 187 N -2.30 0.01 -0.15 2.71 2.07 -0.50 -0.65 121.20 122.39 1f2a s ILE 187 Ca 0.38 -0.04 0.00 0.00 -1.41 0.00 0.00 60.65 59.58 1f2a s ILE 187 Cb -0.05 -0.15 -0.01 0.00 0.13 0.00 0.00 42.46 42.38 1f2a s ILE 187 CO 0.25 -0.02 -0.15 -0.13 -1.91 0.00 0.00 174.94 172.98 1f2a s ARG 188 N -0.03 3.25 0.11 3.50 0.52 -1.26 -0.83 118.95 124.22 1f2a s ARG 188 Ca -0.01 -0.74 0.10 0.00 -0.52 0.00 0.00 55.73 54.56 1f2a s ARG 188 Cb -0.01 -2.62 -0.04 0.00 0.52 0.00 0.00 34.95 32.81 1f2a s ARG 188 CO 0.00 0.07 -0.24 0.96 0.02 0.00 0.00 175.30 176.11 1f2a s ILE 189 N 0.68 2.01 0.40 1.52 -4.36 -1.01 -1.10 121.20 119.33 1f2a s ILE 189 Ca -0.07 -1.63 -0.27 0.00 -0.26 0.00 0.00 60.65 58.42 1f2a s ILE 189 Cb -0.16 -1.79 -0.10 0.00 1.25 0.00 0.00 42.46 41.66 1f2a s ILE 189 CO 0.02 0.04 1.36 0.00 0.24 0.00 0.00 174.94 176.61 1f2a n ALA 190 N 1.06 1.73 -2.67 2.27 0.00 -0.24 -0.35 120.51 122.30 1f2a n ALA 190 Ca -0.19 0.30 -0.34 0.00 0.00 0.00 0.00 53.44 53.21 1f2a n ALA 190 Cb 0.53 -2.33 -0.10 0.00 0.00 0.00 0.00 19.45 17.55 1f2a n ALA 190 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1f2a s LYS 191 N -2.16 2.98 0.00 0.00 2.20 0.19 -4.44 119.74 118.50 1f2a s LYS 191 Ca 0.58 -0.47 0.00 0.00 -0.36 0.00 0.00 55.97 55.72 1f2a s LYS 191 Cb -0.50 -2.74 0.00 0.00 -1.51 0.00 0.00 37.83 33.08 1f2a s LYS 191 CO 0.60 0.64 0.00 0.41 -0.36 0.00 0.00 175.35 176.64 1f2a n GLY 192 N 2.32 1.32 0.50 5.54 0.00 -1.26 -4.71 105.19 108.90 1f2a n GLY 192 Ca -0.18 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.90 1f2a n GLY 192 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1f2a n SER 193 N 0.00 1.49 -3.81 1.61 3.41 -1.26 -5.00 113.62 110.06 1f2a n SER 193 Ca 0.00 -2.91 -0.25 0.00 -0.26 0.00 0.00 58.87 55.45 1f2a n SER 193 Cb 0.00 -0.39 0.02 0.00 -0.26 0.00 0.00 64.21 63.59 1f2a n SER 193 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1f2a n ASN 198 N -0.78 -2.22 -4.72 4.04 5.15 -1.26 -4.90 115.26 110.58 1f2a n ASN 198 Ca 0.12 -0.83 -0.42 0.00 -0.60 0.00 0.00 54.58 52.85 1f2a n ASN 198 Cb 0.74 -3.87 -0.03 0.00 -0.53 0.00 0.00 39.78 36.09 1f2a n ASN 198 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1f2a s GLN 199 N -6.26 4.20 -1.82 1.20 -1.52 -1.26 -1.85 119.66 112.35 1f2a s GLN 199 Ca 0.22 2.40 0.00 0.00 -1.95 0.00 0.00 55.36 56.03 1f2a s GLN 199 Cb -0.11 -3.16 0.00 0.00 -0.22 0.00 0.00 33.01 29.52 1f2a s GLN 199 CO 0.83 -0.64 0.00 0.00 -0.25 0.00 0.00 175.29 175.23 1f2a n LEU 201 N -1.95 -1.89 0.20 0.00 4.77 -0.77 -0.42 117.00 116.94 1f2a n LEU 201 Ca -0.17 -0.02 0.18 0.00 -0.03 0.00 0.00 56.01 55.97 1f2a n LEU 201 Cb 0.59 -2.78 0.82 0.00 -2.33 0.00 0.00 43.42 39.73 1f2a n LEU 201 CO 0.26 -0.20 1.16 1.62 -1.33 0.00 0.00 177.39 178.90 1f2a h VAL 202 N -0.01 0.33 -0.01 4.08 3.04 -1.64 -2.14 116.25 119.91 1f2a h VAL 202 Ca -0.46 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.23 1f2a h VAL 202 Cb 1.34 0.76 0.00 0.00 -2.01 0.00 0.00 31.29 31.38 1f2a h VAL 202 CO 0.55 0.00 -0.36 2.29 -1.01 0.00 0.00 177.57 179.04 1f2a n LYS 203 N -3.58 0.77 -0.10 4.17 2.85 -1.26 -4.51 118.16 116.50 1f2a n LYS 203 Ca 0.03 -0.50 -0.08 0.00 -1.05 0.00 0.00 58.31 56.70 1f2a n LYS 203 Cb 0.41 -1.49 0.08 0.00 -0.65 0.00 0.00 35.03 33.38 1f2a n LYS 203 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1f2a h GLU 204 N 1.22 0.81 -2.02 -1.58 4.39 -1.67 -3.37 114.58 112.37 1f2a h GLU 204 Ca 0.00 -0.32 -0.56 0.00 0.34 0.00 0.00 59.36 58.82 1f2a h GLU 204 Cb 0.55 -0.04 -0.38 0.00 -0.10 0.00 0.00 28.75 28.77 1f2a h GLU 204 CO 0.00 0.94 -1.08 -1.91 -1.16 0.00 0.00 179.01 175.80 1f2a n GLU 205 N -4.12 0.64 -3.91 2.33 4.07 -1.26 -4.88 120.64 113.51 1f2a n GLU 205 Ca 0.00 -3.19 -0.36 0.00 -0.06 0.00 0.00 57.16 53.55 1f2a n GLU 205 Cb 0.42 -1.27 -0.07 0.00 -0.06 0.00 0.00 31.44 30.46 1f2a n GLU 205 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1f2a s ALA 206 N -0.99 3.75 0.26 4.31 0.00 -1.26 -2.69 121.76 125.14 1f2a s ALA 206 Ca 0.35 -0.67 -0.20 0.00 0.00 0.00 0.00 51.96 51.43 1f2a s ALA 206 Cb 0.15 -1.95 0.02 0.00 0.00 0.00 0.00 23.12 21.35 1f2a s ALA 206 CO -0.12 0.50 0.67 -1.54 0.00 0.00 0.00 175.76 175.27 1f2a s SER 207 N -0.66 -0.28 -0.08 0.00 1.04 0.24 -0.99 113.70 112.96 1f2a s SER 207 Ca 0.13 -0.55 -0.21 0.00 0.48 0.00 0.00 55.95 55.79 1f2a s SER 207 Cb -0.12 0.69 0.05 0.00 0.10 0.00 0.00 66.02 66.74 1f2a s SER 207 CO 0.02 -1.27 0.49 -0.55 0.98 0.00 0.00 173.24 172.91 1f2a s SER 208 N -2.90 -0.44 0.62 7.02 0.15 -0.69 -0.41 113.70 117.04 1f2a s SER 208 Ca 0.11 0.58 -0.14 0.00 0.70 0.00 0.00 55.95 57.19 1f2a s SER 208 Cb -0.05 0.61 -0.03 0.00 -1.71 0.00 0.00 66.02 64.85 1f2a s SER 208 CO 0.04 -0.42 1.05 0.00 1.20 0.00 0.00 173.24 175.12 1f2a s ALA 209 N -0.79 2.75 -0.14 5.45 0.00 -1.26 -1.03 121.76 126.73 1f2a s ALA 209 Ca -0.09 0.28 0.02 0.00 0.00 0.00 0.00 51.96 52.17 1f2a s ALA 209 Cb -0.03 -3.21 0.02 0.00 0.00 0.00 0.00 23.12 19.90 1f2a s ALA 209 CO 0.05 -0.90 -0.19 0.08 0.00 0.00 0.00 175.76 174.81 1f2a s VAL 210 N -2.65 1.85 -0.57 0.00 1.01 -0.00 -4.82 120.40 115.21 1f2a s VAL 210 Ca 0.62 -0.83 -0.07 0.00 0.00 0.00 0.00 61.98 61.69 1f2a s VAL 210 Cb -0.15 -1.67 0.15 0.00 0.00 0.00 0.00 36.38 34.71 1f2a s VAL 210 CO 0.42 0.51 0.43 0.54 0.00 0.00 0.00 175.10 177.00 1f2a s VAL 211 N 1.08 4.16 -1.14 2.92 0.11 -1.26 -0.76 120.40 125.50 1f2a s VAL 211 Ca -0.02 -2.32 0.00 0.00 -2.93 0.00 0.00 61.98 56.70 1f2a s VAL 211 Cb -0.14 -3.71 0.00 0.00 -1.53 0.00 0.00 36.38 31.00 1f2a s VAL 211 CO -0.06 -0.84 0.29 0.61 -3.33 0.00 0.00 175.10 171.77