#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x0h s SER 2 N 0.00 0.06 0.23 1.61 0.15 -1.26 -5.05 113.70 109.45 1x0h s SER 2 Ca 0.00 -0.60 0.04 0.00 0.70 0.00 0.00 55.95 56.09 1x0h s SER 2 Cb 0.00 0.36 0.25 0.00 -1.71 0.00 0.00 66.02 64.92 1x0h s SER 2 CO 0.00 -0.75 1.56 -1.28 1.20 0.00 0.00 173.24 173.97 1x0h h SER 3 N 2.69 0.29 -0.69 5.45 0.87 -2.12 -3.45 113.55 116.59 1x0h h SER 3 Ca -0.34 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.06 1x0h h SER 3 Cb 1.21 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 1x0h h SER 3 CO 0.55 0.82 0.00 0.61 -0.53 0.00 0.00 176.83 178.28 1x0h n GLY 4 N 0.26 1.56 3.17 5.77 0.00 -1.26 -5.15 105.19 109.55 1x0h n GLY 4 Ca -0.02 -1.88 -0.11 0.00 0.00 0.00 0.00 46.02 44.01 1x0h n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x0h s SER 5 N -1.00 0.53 0.00 1.61 0.01 -1.26 -5.02 113.70 108.56 1x0h s SER 5 Ca 0.00 -1.21 0.00 0.00 1.31 0.00 0.00 55.95 56.05 1x0h s SER 5 Cb 0.00 0.25 0.00 0.00 0.21 0.00 0.00 66.02 66.48 1x0h s SER 5 CO 0.00 -0.69 0.08 -1.20 0.41 0.00 0.00 173.24 171.83 1x0h n SER 6 N -0.14 0.00 0.00 2.44 7.64 -1.26 -5.08 113.62 117.22 1x0h n SER 6 Ca -0.06 0.44 0.00 0.00 1.01 0.00 0.00 58.87 60.26 1x0h n SER 6 Cb 0.64 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 63.44 1x0h n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x0h n GLY 7 N 1.84 3.55 2.88 0.23 0.00 -1.26 -5.16 105.19 107.27 1x0h n GLY 7 Ca 0.00 -0.19 -0.16 0.00 0.00 0.00 0.00 46.02 45.68 1x0h n GLY 7 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1x0h s ILE 8 N 2.23 -0.23 -0.30 -0.61 -4.36 -1.26 -5.14 121.20 111.54 1x0h s ILE 8 Ca 0.00 0.31 -0.23 0.00 -0.26 0.00 0.00 60.65 60.47 1x0h s ILE 8 Cb 0.00 -0.30 0.18 0.00 1.25 0.00 0.00 42.46 43.59 1x0h s ILE 8 CO 0.00 0.13 1.34 -0.94 0.24 0.00 0.00 174.94 175.70 1x0h s SER 9 N 2.05 -0.13 -0.28 4.36 1.04 -1.26 -4.79 113.70 114.70 1x0h s SER 9 Ca 0.00 0.23 -0.04 0.00 0.48 0.00 0.00 55.95 56.62 1x0h s SER 9 Cb -0.12 0.43 0.02 0.00 0.10 0.00 0.00 66.02 66.45 1x0h s SER 9 CO -0.06 -0.04 0.02 -0.76 0.98 0.00 0.00 173.24 173.38 1x0h s LEU 10 N 0.31 3.59 -0.33 2.42 1.43 -1.19 -5.07 118.68 119.84 1x0h s LEU 10 Ca 0.03 -0.82 -0.08 0.00 -1.03 0.00 0.00 54.13 52.23 1x0h s LEU 10 Cb -0.04 -1.78 0.02 0.00 0.03 0.00 0.00 46.19 44.41 1x0h s LEU 10 CO -0.13 -0.17 0.13 -0.54 0.23 0.00 0.00 176.35 175.87 1x0h s LYS 11 N 1.41 2.96 -0.16 1.70 -0.14 -1.26 -3.29 119.74 120.95 1x0h s LYS 11 Ca 0.01 -0.96 -0.03 0.00 -1.36 0.00 0.00 55.97 53.63 1x0h s LYS 11 Cb -0.17 -3.52 0.05 0.00 -1.68 0.00 0.00 37.83 32.51 1x0h s LYS 11 CO -0.01 -0.56 0.04 0.71 -0.76 0.00 0.00 175.35 174.78 1x0h s TYR 12 N 1.51 0.79 0.93 3.18 2.02 -1.26 -5.08 117.35 119.45 1x0h s TYR 12 Ca 0.02 -0.61 -0.11 0.00 -0.37 0.00 0.00 57.07 56.00 1x0h s TYR 12 Cb -0.18 -0.91 0.15 0.00 -0.40 0.00 0.00 41.96 40.62 1x0h s TYR 12 CO 0.04 -0.53 1.12 0.95 -1.57 0.00 0.00 175.55 175.56 1x0h s THR 13 N 1.94 2.23 0.26 -0.71 -4.23 -1.26 -3.15 115.64 110.72 1x0h s THR 13 Ca 0.01 0.08 -0.05 0.00 -1.18 0.00 0.00 61.69 60.55 1x0h s THR 13 Cb -0.16 -2.18 0.26 0.00 1.34 0.00 0.00 72.50 71.77 1x0h s THR 13 CO -0.08 -0.10 1.93 0.00 -0.54 0.00 0.00 174.62 175.84 1x0h h ALA 14 N -1.88 1.32 -0.59 3.99 0.00 -0.62 -2.01 119.26 119.47 1x0h h ALA 14 Ca -0.46 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 1x0h h ALA 14 Cb 1.27 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 1x0h h ALA 14 CO 0.44 0.62 0.28 0.00 0.00 0.00 0.00 179.25 180.59 1x0h h ALA 15 N 1.40 1.37 0.38 0.00 0.00 -1.70 -1.05 119.26 119.66 1x0h h ALA 15 Ca 0.36 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1x0h h ALA 15 Cb -0.12 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.43 1x0h h ALA 15 CO -0.09 0.49 -0.18 0.00 0.00 0.00 0.00 179.25 179.47 1x0h h ARG 16 N 0.84 -0.50 -0.26 0.00 2.47 -1.68 -0.02 114.38 115.23 1x0h h ARG 16 Ca 0.21 0.03 -0.05 0.00 -1.26 0.00 0.00 59.98 58.91 1x0h h ARG 16 Cb 0.10 0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 28.52 1x0h h ARG 16 CO -0.03 -0.32 -0.04 -0.07 0.56 0.00 0.00 179.97 180.07 1x0h h LEU 17 N -0.53 0.38 -0.35 3.04 3.38 -1.35 -1.81 115.31 118.07 1x0h h LEU 17 Ca -0.05 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 1x0h h LEU 17 Cb 0.40 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1x0h h LEU 17 CO 0.09 0.48 0.02 -0.74 0.09 0.00 0.00 178.44 178.37 1x0h h HIS 18 N 0.39 0.65 -0.53 1.13 2.76 -0.87 -0.59 115.15 118.08 1x0h h HIS 18 Ca 0.08 -0.10 -0.10 0.00 -2.20 0.00 0.00 60.37 58.05 1x0h h HIS 18 Cb 0.33 -0.17 -0.02 0.00 1.55 0.00 0.00 27.41 29.10 1x0h h HIS 18 CO 0.01 0.69 -0.05 0.93 -1.30 0.00 0.00 177.93 178.21 1x0h h GLU 19 N 0.42 0.94 -0.08 5.26 4.39 -0.71 -2.77 114.58 122.04 1x0h h GLU 19 Ca 0.10 -0.31 -0.10 0.00 0.34 0.00 0.00 59.36 59.40 1x0h h GLU 19 Cb 0.42 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 1x0h h GLU 19 CO 0.01 0.96 -0.40 0.87 -1.16 0.00 0.00 179.01 179.30 1x0h h LYS 20 N 0.86 0.16 0.00 2.33 1.57 -1.21 -3.47 116.57 116.81 1x0h h LYS 20 Ca 0.15 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1x0h h LYS 20 Cb 0.57 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1x0h h LYS 20 CO 0.03 0.54 0.00 0.41 -0.57 0.00 0.00 179.45 179.86 1x0h n GLY 21 N -0.27 2.17 0.17 3.86 0.00 -0.40 -5.01 105.19 105.71 1x0h n GLY 21 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 1x0h n GLY 21 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1x0h h VAL 22 N 0.00 0.00 -3.82 1.61 2.07 -1.42 -3.42 116.25 111.27 1x0h h VAL 22 Ca 0.00 0.00 -0.51 0.00 0.82 0.00 0.00 66.70 67.01 1x0h h VAL 22 Cb 0.00 0.00 0.03 0.00 -1.52 0.00 0.00 31.29 29.80 1x0h h VAL 22 CO 0.00 0.00 0.53 -0.22 0.02 0.00 0.00 177.57 177.90 1x0h s LEU 23 N -6.38 4.51 -0.03 2.57 2.96 -0.79 -0.50 118.68 121.03 1x0h s LEU 23 Ca -0.06 2.40 -0.03 0.00 -0.22 0.00 0.00 54.13 56.22 1x0h s LEU 23 Cb 0.01 -3.63 -0.01 0.00 0.50 0.00 0.00 46.19 43.06 1x0h s LEU 23 CO 0.20 -0.27 -0.05 0.18 -1.32 0.00 0.00 176.35 175.09 1x0h n LEU 24 N 1.12 0.30 -3.81 -0.68 4.77 -0.47 -4.24 117.00 113.99 1x0h n LEU 24 Ca -0.01 0.05 -0.09 0.00 -0.03 0.00 0.00 56.01 55.94 1x0h n LEU 24 Cb 0.44 -0.53 0.02 0.00 -2.33 0.00 0.00 43.42 41.02 1x0h n LEU 24 CO 0.56 -0.47 0.53 -1.61 -1.33 0.00 0.00 177.39 175.07 1x0h s GLU 25 N -1.30 2.21 0.03 3.23 2.02 -1.10 -5.02 118.70 118.78 1x0h s GLU 25 Ca -0.04 -1.41 0.05 0.00 0.02 0.00 0.00 54.97 53.58 1x0h s GLU 25 Cb 0.01 0.62 -0.02 0.00 0.10 0.00 0.00 34.13 34.84 1x0h s GLU 25 CO 0.07 -1.03 -0.14 0.42 0.02 0.00 0.00 175.26 174.59 1x0h s ILE 26 N -2.38 1.08 -0.56 -1.63 1.01 -1.26 -0.47 121.20 116.99 1x0h s ILE 26 Ca 0.15 -0.96 -0.03 0.00 0.00 0.00 0.00 60.65 59.82 1x0h s ILE 26 Cb -0.05 -0.98 0.18 0.00 0.01 0.00 0.00 42.46 41.62 1x0h s ILE 26 CO 0.11 0.02 2.46 -0.62 0.00 0.00 0.00 174.94 176.91 1x0h n GLU 27 N 1.97 2.45 0.00 2.79 -0.58 -1.07 -4.23 120.64 121.98 1x0h n GLU 27 Ca -0.18 -2.63 0.00 0.00 -0.42 0.00 0.00 57.16 53.93 1x0h n GLU 27 Cb 0.55 -2.13 0.00 0.00 -0.57 0.00 0.00 31.44 29.29 1x0h n GLU 27 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 1x0h n ASP 28 N 0.34 0.00 -4.88 1.62 5.75 -1.26 -4.97 116.55 113.15 1x0h n ASP 28 Ca 0.49 0.00 -0.34 0.00 -0.01 0.00 0.00 54.79 54.93 1x0h n ASP 28 Cb 0.48 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.52 1x0h n ASP 28 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1x0h s LEU 29 N 0.00 4.36 0.62 -2.12 2.01 -1.26 -5.10 118.68 117.19 1x0h s LEU 29 Ca 0.00 0.62 -0.07 0.00 0.01 0.00 0.00 54.13 54.70 1x0h s LEU 29 Cb 0.00 -2.79 0.02 0.00 0.01 0.00 0.00 46.19 43.42 1x0h s LEU 29 CO 0.00 0.22 0.94 -1.10 1.01 0.00 0.00 176.35 177.42 1x0h s GLN 30 N -1.85 2.81 0.31 1.70 -0.21 -1.26 -4.35 119.66 116.82 1x0h s GLN 30 Ca 0.30 0.01 -0.00 0.00 0.02 0.00 0.00 55.36 55.69 1x0h s GLN 30 Cb -0.13 -2.23 0.52 0.00 1.00 0.00 0.00 33.01 32.17 1x0h s GLN 30 CO 0.17 -0.81 1.97 0.28 -2.12 0.00 0.00 175.29 174.78 1x0h h VAL 31 N -0.29 1.16 0.00 1.09 2.07 -1.99 -1.18 116.25 117.12 1x0h h VAL 31 Ca -0.45 -0.35 -0.07 0.00 0.82 0.00 0.00 66.70 66.64 1x0h h VAL 31 Cb 1.26 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1x0h h VAL 31 CO 0.61 0.19 -0.34 -0.55 0.02 0.00 0.00 177.57 177.49 1x0h h ASN 32 N 1.02 0.00 1.45 0.57 -1.07 -2.05 -2.73 115.58 112.78 1x0h h ASN 32 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.67 1x0h h ASN 32 Cb -0.04 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.21 1x0h h ASN 32 CO -0.08 0.34 0.00 1.56 0.07 0.00 0.00 177.43 179.32 1x0h h GLN 33 N 0.00 0.00 -0.90 4.14 4.20 -1.59 -3.23 115.11 117.73 1x0h h GLN 33 Ca -0.00 0.00 0.26 0.00 0.06 0.00 0.00 58.65 58.97 1x0h h GLN 33 Cb 0.81 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.55 1x0h h GLN 33 CO 0.04 0.00 0.73 0.74 -0.67 0.00 0.00 178.83 179.67 1x0h h PHE 34 N 0.00 0.00 -0.41 2.96 -1.00 -1.21 0.12 116.94 117.41 1x0h h PHE 34 Ca 0.00 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.78 1x0h h PHE 34 Cb 0.72 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.26 1x0h h PHE 34 CO 0.00 0.00 0.24 -0.22 -1.61 0.00 0.00 178.31 176.72 1x0h h LYS 35 N 0.00 0.56 0.00 1.51 3.64 -1.78 -2.64 116.57 117.86 1x0h h LYS 35 Ca 0.43 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 59.59 1x0h h LYS 35 Cb 1.88 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 33.56 1x0h h LYS 35 CO -0.00 0.42 -0.76 -2.95 -2.27 0.00 0.00 179.45 173.88 1x0h h ASN 36 N 0.54 0.00 -3.56 4.20 7.08 -1.06 -3.45 115.58 119.33 1x0h h ASN 36 Ca 0.15 0.00 -0.52 0.00 -3.08 0.00 0.00 56.30 52.85 1x0h h ASN 36 Cb 0.01 0.00 0.01 0.00 -2.08 0.00 0.00 38.32 36.26 1x0h h ASN 36 CO -0.03 0.76 0.52 -0.69 -2.08 0.00 0.00 177.43 175.91 1x0h s VAL 37 N -3.00 3.65 -0.01 6.14 1.01 -0.65 -4.98 120.40 122.56 1x0h s VAL 37 Ca 0.01 1.44 -0.12 0.00 0.00 0.00 0.00 61.98 63.31 1x0h s VAL 37 Cb 0.10 -3.92 0.01 0.00 0.00 0.00 0.00 36.38 32.58 1x0h s VAL 37 CO 0.78 0.25 0.24 -0.51 0.00 0.00 0.00 175.10 175.86 1x0h s ILE 38 N -0.27 0.07 -0.23 2.22 2.07 -1.26 -0.35 121.20 123.45 1x0h s ILE 38 Ca 0.50 -0.55 0.02 0.00 -1.41 0.00 0.00 60.65 59.21 1x0h s ILE 38 Cb -0.31 -0.53 0.05 0.00 0.13 0.00 0.00 42.46 41.79 1x0h s ILE 38 CO 0.37 -0.30 -0.11 -0.36 -1.91 0.00 0.00 174.94 172.63 1x0h s PHE 39 N -1.30 2.80 -0.23 3.50 0.08 -1.19 -3.42 117.98 118.22 1x0h s PHE 39 Ca -0.14 -1.92 -0.21 0.00 0.12 0.00 0.00 56.93 54.78 1x0h s PHE 39 Cb -0.06 -1.78 -0.02 0.00 -0.57 0.00 0.00 43.02 40.59 1x0h s PHE 39 CO 0.03 -0.81 0.67 -2.00 -0.10 0.00 0.00 175.22 173.01 1x0h s GLU 40 N 1.27 4.16 -0.10 0.44 -6.30 -0.40 -4.00 118.70 113.77 1x0h s GLU 40 Ca -0.04 0.65 0.01 0.00 -2.50 0.00 0.00 54.97 53.09 1x0h s GLU 40 Cb -0.18 -3.62 -0.02 0.00 0.00 0.00 0.00 34.13 30.32 1x0h s GLU 40 CO -0.07 -0.36 -0.15 0.42 0.02 0.00 0.00 175.26 175.12 1x0h s ILE 41 N 2.33 2.94 -0.28 -3.70 1.01 -1.21 -1.42 121.20 120.88 1x0h s ILE 41 Ca 0.29 -0.72 -0.03 0.00 0.00 0.00 0.00 60.65 60.19 1x0h s ILE 41 Cb -0.16 -2.20 0.03 0.00 0.01 0.00 0.00 42.46 40.14 1x0h s ILE 41 CO 0.09 0.55 -0.01 -0.44 0.00 0.00 0.00 174.94 175.13 1x0h s SER 42 N 0.06 4.70 1.14 3.58 0.01 -0.02 -3.18 113.70 119.98 1x0h s SER 42 Ca -0.06 -0.98 -0.14 0.00 1.31 0.00 0.00 55.95 56.09 1x0h s SER 42 Cb -0.15 -1.73 0.23 0.00 0.21 0.00 0.00 66.02 64.58 1x0h s SER 42 CO 0.05 -0.19 0.76 -2.65 0.41 0.00 0.00 173.24 171.62 1x0h n PRO 43 N 4.70 -2.03 -4.50 12.44 -0.02 -1.26 -3.19 135.00 141.15 1x0h n PRO 43 Ca -0.15 -0.56 -0.24 0.00 -2.02 0.00 0.00 63.50 60.53 1x0h n PRO 43 Cb 0.46 -2.06 -0.10 0.00 -0.02 0.00 0.00 33.50 31.77 1x0h n PRO 43 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1x0h s THR 44 N -2.38 2.10 0.14 3.45 -4.23 -1.26 -4.84 115.64 108.61 1x0h s THR 44 Ca 0.65 -2.21 -0.15 0.00 -1.18 0.00 0.00 61.69 58.80 1x0h s THR 44 Cb -0.22 -2.53 0.01 0.00 1.34 0.00 0.00 72.50 71.10 1x0h s THR 44 CO 0.65 -0.27 1.65 -0.08 -0.54 0.00 0.00 174.62 176.03 1x0h h GLU 45 N 2.14 0.69 -7.57 3.99 4.81 -1.96 -3.44 114.58 113.24 1x0h h GLU 45 Ca -0.41 -0.16 -0.45 0.00 -0.13 0.00 0.00 59.36 58.21 1x0h h GLU 45 Cb 1.25 -0.10 0.13 0.00 0.63 0.00 0.00 28.75 30.66 1x0h h GLU 45 CO 0.68 0.68 0.31 -2.00 -0.73 0.00 0.00 179.01 177.96 1x0h s GLU 46 N -5.36 1.10 -0.07 1.92 2.12 -1.26 -5.09 118.70 112.06 1x0h s GLU 46 Ca -0.13 -0.60 0.01 0.00 0.36 0.00 0.00 54.97 54.61 1x0h s GLU 46 Cb 0.11 -2.02 -0.03 0.00 0.26 0.00 0.00 34.13 32.45 1x0h s GLU 46 CO 0.77 -2.02 -0.07 0.54 -0.54 0.00 0.00 175.26 173.94 1x0h s VAL 47 N -3.61 3.66 0.00 3.70 0.11 -1.26 -4.65 120.40 118.35 1x0h s VAL 47 Ca 0.70 -0.49 0.00 0.00 -2.93 0.00 0.00 61.98 59.26 1x0h s VAL 47 Cb -0.05 -2.50 0.00 0.00 -1.53 0.00 0.00 36.38 32.30 1x0h s VAL 47 CO 0.50 0.59 0.00 0.61 -3.33 0.00 0.00 175.10 173.47 1x0h n GLY 48 N 2.36 3.29 3.85 6.54 0.00 -1.26 -5.07 105.19 114.89 1x0h n GLY 48 Ca -0.18 -0.98 -0.32 0.00 0.00 0.00 0.00 46.02 44.54 1x0h n GLY 48 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1x0h s ASP 49 N 0.00 6.72 -0.05 1.61 2.15 -1.26 -3.63 116.67 122.21 1x0h s ASP 49 Ca 0.00 1.34 -0.04 0.00 0.43 0.00 0.00 52.55 54.29 1x0h s ASP 49 Cb 0.00 -2.40 0.02 0.00 -0.30 0.00 0.00 42.92 40.24 1x0h s ASP 49 CO 0.00 -0.32 0.13 -0.36 -0.17 0.00 0.00 175.17 174.45 1x0h s PHE 50 N -2.18 -0.15 -0.43 -5.34 0.08 -0.72 -4.55 117.98 104.70 1x0h s PHE 50 Ca 0.55 0.40 -0.13 0.00 0.12 0.00 0.00 56.93 57.87 1x0h s PHE 50 Cb -0.10 -0.01 0.05 0.00 -0.57 0.00 0.00 43.02 42.39 1x0h s PHE 50 CO 0.21 -0.11 0.31 -2.00 -0.10 0.00 0.00 175.22 173.53 1x0h s GLU 51 N 0.56 2.87 0.03 0.44 2.12 -1.19 -0.17 118.70 123.35 1x0h s GLU 51 Ca -0.04 -1.24 -0.00 0.00 0.36 0.00 0.00 54.97 54.05 1x0h s GLU 51 Cb -0.06 -3.95 -0.04 0.00 0.26 0.00 0.00 34.13 30.35 1x0h s GLU 51 CO -0.03 -0.88 0.14 0.08 -0.54 0.00 0.00 175.26 174.03 1x0h s VAL 52 N 1.59 5.02 -0.11 3.70 1.01 -0.86 -0.84 120.40 129.91 1x0h s VAL 52 Ca 0.04 -0.41 -0.14 0.00 0.00 0.00 0.00 61.98 61.47 1x0h s VAL 52 Cb -0.22 -3.37 0.03 0.00 0.00 0.00 0.00 36.38 32.83 1x0h s VAL 52 CO 0.07 0.25 0.36 -0.75 0.00 0.00 0.00 175.10 175.03 1x0h s LYS 53 N -2.10 0.49 -0.42 2.72 2.20 -0.51 -2.82 119.74 119.31 1x0h s LYS 53 Ca 0.28 0.37 -0.13 0.00 -0.36 0.00 0.00 55.97 56.13 1x0h s LYS 53 Cb -0.12 0.23 0.05 0.00 -1.51 0.00 0.00 37.83 36.47 1x0h s LYS 53 CO 0.20 -0.08 0.29 0.00 -0.36 0.00 0.00 175.35 175.39 1x0h s ALA 54 N -0.13 3.40 -0.65 3.13 0.00 -1.26 -1.27 121.76 124.97 1x0h s ALA 54 Ca -0.03 -1.89 -0.28 0.00 0.00 0.00 0.00 51.96 49.77 1x0h s ALA 54 Cb -0.03 -2.80 0.03 0.00 0.00 0.00 0.00 23.12 20.32 1x0h s ALA 54 CO 0.01 -1.54 1.29 0.15 0.00 0.00 0.00 175.76 175.68 1x0h s LYS 55 N 1.59 3.30 0.02 0.00 -0.14 -1.22 -4.19 119.74 119.09 1x0h s LYS 55 Ca 0.03 0.06 0.00 0.00 -1.36 0.00 0.00 55.97 54.70 1x0h s LYS 55 Cb -0.21 -4.12 0.00 0.00 -1.68 0.00 0.00 37.83 31.82 1x0h s LYS 55 CO 0.07 -1.97 0.00 0.34 -0.76 0.00 0.00 175.35 173.02 1x0h n PHE 56 N 9.19 -0.91 -3.34 3.18 -0.00 -1.26 -4.55 117.46 119.77 1x0h n PHE 56 Ca 0.07 0.06 -0.20 0.00 -0.00 0.00 0.00 57.45 57.38 1x0h n PHE 56 Cb 0.49 0.29 -0.08 0.00 -0.00 0.00 0.00 39.48 40.18 1x0h n PHE 56 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.76 175.12 1x0h s MET 57 N -2.00 0.71 -0.26 -4.13 -1.94 -1.26 -5.12 119.30 105.30 1x0h s MET 57 Ca 0.00 -1.20 -0.24 0.00 -1.71 0.00 0.00 55.69 52.54 1x0h s MET 57 Cb 0.00 -0.91 -0.00 0.00 2.01 0.00 0.00 34.83 35.93 1x0h s MET 57 CO 0.00 -1.25 0.83 0.20 -0.01 0.00 0.00 175.02 174.79 1x0h s GLY 58 N 1.06 1.74 -0.15 -0.03 0.00 -1.26 -4.89 107.32 103.79 1x0h s GLY 58 Ca 0.21 -0.20 -0.01 0.00 0.00 0.00 0.00 44.72 44.72 1x0h s GLY 58 CO -0.05 1.81 -0.15 -0.62 0.00 0.00 0.00 173.10 174.09 1x0h n VAL 59 N 5.34 0.84 -2.16 1.40 0.31 -1.26 -5.04 118.33 117.75 1x0h n VAL 59 Ca 0.05 -0.29 -0.20 0.00 -0.01 0.00 0.00 64.34 63.89 1x0h n VAL 59 Cb 0.48 -1.21 0.12 0.00 -0.91 0.00 0.00 33.84 32.31 1x0h n VAL 59 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1x0h n GLN 60 N -3.15 -0.42 -0.09 5.55 6.02 -1.26 -5.06 117.38 118.97 1x0h n GLN 60 Ca -0.27 -1.88 -0.18 0.00 -0.01 0.00 0.00 57.00 54.66 1x0h n GLN 60 Cb 0.76 -0.76 -0.07 0.00 1.02 0.00 0.00 30.24 31.19 1x0h n GLN 60 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 1x0h n MET 61 N -2.77 0.38 -2.41 -1.09 2.81 -1.26 -5.01 117.12 107.77 1x0h n MET 61 Ca 0.13 0.16 -0.36 0.00 -1.81 0.00 0.00 57.70 55.82 1x0h n MET 61 Cb 0.45 -1.16 -0.02 0.00 -0.71 0.00 0.00 33.22 31.78 1x0h n MET 61 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1x0h s GLU 62 N -2.33 3.84 0.62 0.03 -6.30 -1.26 -5.04 118.70 108.27 1x0h s GLU 62 Ca -0.25 1.58 -0.07 0.00 -2.50 0.00 0.00 54.97 53.74 1x0h s GLU 62 Cb 0.09 -2.33 0.02 0.00 0.00 0.00 0.00 34.13 31.91 1x0h s GLU 62 CO 0.32 -0.43 0.94 0.99 0.02 0.00 0.00 175.26 177.10 1x0h s THR 63 N -1.71 3.39 0.16 -1.70 2.01 -1.26 -5.05 115.64 111.48 1x0h s THR 63 Ca 0.64 0.00 -0.28 0.00 0.31 0.00 0.00 61.69 62.36 1x0h s THR 63 Cb -0.23 -3.37 -0.08 0.00 0.01 0.00 0.00 72.50 68.83 1x0h s THR 63 CO 0.28 -0.40 0.86 0.12 -0.69 0.00 0.00 174.62 174.80 1x0h s PHE 64 N -3.07 3.89 -0.09 4.92 5.36 -1.13 -5.00 117.98 122.86 1x0h s PHE 64 Ca 0.55 1.74 -0.07 0.00 -0.96 0.00 0.00 56.93 58.20 1x0h s PHE 64 Cb -0.11 -2.90 -0.04 0.00 -0.34 0.00 0.00 43.02 39.64 1x0h s PHE 64 CO 0.46 0.41 0.16 -1.64 -1.46 0.00 0.00 175.22 173.14 1x0h s MET 65 N -0.79 3.46 -0.27 10.12 -1.94 -1.26 -2.04 119.30 126.57 1x0h s MET 65 Ca 0.40 -0.14 0.01 0.00 -1.71 0.00 0.00 55.69 54.25 1x0h s MET 65 Cb -0.24 -3.17 0.08 0.00 2.01 0.00 0.00 34.83 33.51 1x0h s MET 65 CO 0.28 0.76 0.01 -1.17 -0.01 0.00 0.00 175.02 174.89 1x0h s LEU 66 N -1.20 2.90 0.50 -0.03 2.96 0.76 -4.92 118.68 119.64 1x0h s LEU 66 Ca 0.18 -1.47 -0.16 0.00 -0.22 0.00 0.00 54.13 52.45 1x0h s LEU 66 Cb -0.12 -1.18 -0.08 0.00 0.50 0.00 0.00 46.19 45.31 1x0h s LEU 66 CO 0.07 -0.31 0.96 -2.28 -1.32 0.00 0.00 176.35 173.47 1x0h s HIS 67 N 1.36 3.45 0.11 5.38 2.46 -1.26 -1.75 115.29 125.05 1x0h s HIS 67 Ca 0.01 1.41 0.05 0.00 0.47 0.00 0.00 55.06 57.00 1x0h s HIS 67 Cb -0.18 -2.74 -0.21 0.00 -0.13 0.00 0.00 32.58 29.31 1x0h s HIS 67 CO -0.11 -0.33 1.26 -0.92 -2.47 0.00 0.00 174.74 172.17 1x0h h TYR 68 N 0.97 0.09 -0.43 3.88 3.20 -1.97 -3.27 116.97 119.44 1x0h h TYR 68 Ca -0.47 -0.07 -0.06 0.00 3.14 0.00 0.00 58.73 61.28 1x0h h TYR 68 Cb 1.18 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.43 1x0h h TYR 68 CO 0.63 1.05 0.05 0.37 -1.64 0.00 0.00 178.16 178.62 1x0h h GLN 69 N 0.01 0.73 -0.36 1.82 5.75 -1.94 -2.45 115.11 118.68 1x0h h GLN 69 Ca -0.03 -0.21 0.00 0.00 -0.15 0.00 0.00 58.65 58.27 1x0h h GLN 69 Cb 1.80 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 30.25 1x0h h GLN 69 CO 0.14 0.77 0.24 -0.44 -2.65 0.00 0.00 178.83 176.89 1x0h h ASP 70 N 0.58 0.41 0.03 -0.69 5.19 -1.98 0.11 116.42 120.07 1x0h h ASP 70 Ca 0.13 -0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.53 1x0h h ASP 70 Cb 0.41 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.81 1x0h h ASP 70 CO 0.01 0.30 -0.01 -0.07 -3.12 0.00 0.00 179.24 176.35 1x0h h LEU 71 N 0.48 -0.03 -1.44 1.55 3.38 -1.54 -3.12 115.31 114.60 1x0h h LEU 71 Ca 0.13 -0.42 -0.06 0.00 0.09 0.00 0.00 57.88 57.62 1x0h h LEU 71 Cb -0.05 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1x0h h LEU 71 CO -0.03 0.41 -0.27 -0.07 0.09 0.00 0.00 178.44 178.57 1x0h h LEU 72 N -0.48 0.00 -1.71 1.67 3.38 -1.12 -2.69 115.31 114.35 1x0h h LEU 72 Ca -0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 1x0h h LEU 72 Cb 0.45 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1x0h h LEU 72 CO 0.01 0.27 0.28 -0.61 0.09 0.00 0.00 178.44 178.48 1x0h h GLN 73 N 0.00 0.35 -0.03 1.13 5.75 -0.73 -1.27 115.11 120.31 1x0h h GLN 73 Ca -0.00 -0.02 -0.22 0.00 -0.15 0.00 0.00 58.65 58.26 1x0h h GLN 73 Cb 0.57 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.05 1x0h h GLN 73 CO 0.04 0.23 -0.89 -0.07 -2.65 0.00 0.00 178.83 175.48 1x0h h LEU 74 N 0.36 0.58 -0.91 -2.39 3.38 -1.49 -2.00 115.31 112.84 1x0h h LEU 74 Ca 0.18 -0.44 -0.08 0.00 0.09 0.00 0.00 57.88 57.63 1x0h h LEU 74 Cb 0.27 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1x0h h LEU 74 CO -0.04 1.23 -0.07 1.56 0.09 0.00 0.00 178.44 181.20 1x0h h GLN 75 N 0.28 0.72 0.04 1.13 1.08 -1.30 0.22 115.11 117.28 1x0h h GLN 75 Ca -0.07 -0.22 -0.26 0.00 -1.45 0.00 0.00 58.65 56.65 1x0h h GLN 75 Cb 1.52 -0.07 0.02 0.00 -0.05 0.00 0.00 27.48 28.90 1x0h h GLN 75 CO 0.16 0.79 -1.05 -0.92 -0.95 0.00 0.00 178.83 176.85 1x0h h TYR 76 N 0.67 0.99 -0.04 2.96 3.20 -1.33 -3.26 116.97 120.15 1x0h h TYR 76 Ca 0.12 -0.56 -0.12 0.00 3.14 0.00 0.00 58.73 61.30 1x0h h TYR 76 Cb 0.52 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 1x0h h TYR 76 CO 0.02 1.40 -0.55 0.93 -1.64 0.00 0.00 178.16 178.33 1x0h h GLU 77 N 0.29 0.11 0.00 1.82 5.08 -1.24 -3.47 114.58 117.17 1x0h h GLU 77 Ca -0.14 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 1x0h h GLU 77 Cb 1.72 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.98 1x0h h GLU 77 CO 0.21 0.63 0.00 0.41 -1.00 0.00 0.00 179.01 179.26 1x0h n GLY 78 N 0.10 1.48 3.56 -3.84 0.00 0.65 -5.06 105.19 102.08 1x0h n GLY 78 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 1x0h n GLY 78 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1x0h n VAL 79 N -0.09 0.24 0.01 1.61 0.31 -0.46 -4.81 118.33 115.14 1x0h n VAL 79 Ca 0.00 -0.48 -0.10 0.00 -0.01 0.00 0.00 64.34 63.74 1x0h n VAL 79 Cb 0.00 -2.43 -0.14 0.00 -0.91 0.00 0.00 33.84 30.36 1x0h n VAL 79 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1x0h h ALA 80 N 15.37 0.59 -2.69 3.52 0.00 -1.97 -3.37 119.26 130.71 1x0h h ALA 80 Ca -0.35 -1.30 -0.58 0.00 0.00 0.00 0.00 54.91 52.68 1x0h h ALA 80 Cb 1.26 0.34 -0.05 0.00 0.00 0.00 0.00 17.79 19.35 1x0h h ALA 80 CO 1.01 1.43 -0.08 0.08 0.00 0.00 0.00 179.25 181.69 1x0h s VAL 81 N -2.62 4.82 0.08 0.00 1.01 -1.26 -0.72 120.40 121.70 1x0h s VAL 81 Ca -0.06 1.12 0.08 0.00 0.00 0.00 0.00 61.98 63.12 1x0h s VAL 81 Cb 0.08 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 1x0h s VAL 81 CO 0.82 0.56 -0.17 -0.32 0.00 0.00 0.00 175.10 176.00 1x0h s MET 82 N -1.08 1.99 -0.52 2.72 1.75 -0.22 -4.90 119.30 119.03 1x0h s MET 82 Ca 0.28 -1.05 -0.08 0.00 -1.25 0.00 0.00 55.69 53.59 1x0h s MET 82 Cb -0.19 -2.19 0.13 0.00 2.84 0.00 0.00 34.83 35.43 1x0h s MET 82 CO 0.17 0.52 0.38 0.21 -0.65 0.00 0.00 175.02 175.65 1x0h s LYS 83 N -1.81 2.53 -0.18 4.11 2.20 -1.26 -2.90 119.74 122.42 1x0h s LYS 83 Ca 0.17 -1.97 -0.15 0.00 -0.36 0.00 0.00 55.97 53.66 1x0h s LYS 83 Cb -0.11 -3.90 -0.04 0.00 -1.51 0.00 0.00 37.83 32.28 1x0h s LYS 83 CO 0.08 -1.19 0.35 -0.51 -0.36 0.00 0.00 175.35 173.73 1x0h s LEU 84 N 0.98 4.19 -1.96 5.43 1.43 -0.76 -4.13 118.68 123.86 1x0h s LEU 84 Ca 0.09 0.51 0.00 0.00 -1.03 0.00 0.00 54.13 53.70 1x0h s LEU 84 Cb -0.23 -2.46 0.00 0.00 0.03 0.00 0.00 46.19 43.53 1x0h s LEU 84 CO -0.02 -0.00 0.00 0.49 0.23 0.00 0.00 176.35 177.04 1x0h n PHE 85 N 4.09 -0.33 -2.55 0.29 3.72 -1.26 -1.60 117.46 119.82 1x0h n PHE 85 Ca -0.10 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.14 1x0h n PHE 85 Cb 0.51 -3.44 -0.00 0.00 -0.94 0.00 0.00 39.48 35.61 1x0h n PHE 85 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1x0h n ASP 86 N -1.42 -4.63 0.00 4.37 9.92 -1.26 -4.69 116.55 118.84 1x0h n ASP 86 Ca -0.20 0.05 0.00 0.00 -0.53 0.00 0.00 54.79 54.11 1x0h n ASP 86 Cb 0.65 -3.88 0.00 0.00 -0.64 0.00 0.00 41.12 37.25 1x0h n ASP 86 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1x0h n ARG 87 N -3.03 0.00 -1.53 -1.24 5.12 -0.63 -5.00 116.66 110.35 1x0h n ARG 87 Ca -0.16 0.00 -0.36 0.00 -1.93 0.00 0.00 57.85 55.40 1x0h n ARG 87 Cb 0.63 0.00 0.09 0.00 -1.16 0.00 0.00 32.46 32.02 1x0h n ARG 87 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1x0h s ALA 88 N -1.71 2.19 -0.12 7.54 0.00 -0.88 -2.58 121.76 126.20 1x0h s ALA 88 Ca 0.00 1.06 -0.00 0.00 0.00 0.00 0.00 51.96 53.02 1x0h s ALA 88 Cb 0.00 -3.52 0.03 0.00 0.00 0.00 0.00 23.12 19.62 1x0h s ALA 88 CO 0.00 -1.83 -0.08 0.15 0.00 0.00 0.00 175.76 174.01 1x0h s LYS 89 N -3.66 1.55 0.17 0.00 1.02 0.38 -1.82 119.74 117.38 1x0h s LYS 89 Ca 0.79 -0.29 0.11 0.00 0.02 0.00 0.00 55.97 56.59 1x0h s LYS 89 Cb -0.34 -1.66 -0.04 0.00 -0.52 0.00 0.00 37.83 35.27 1x0h s LYS 89 CO 0.43 -0.28 -0.25 0.08 -0.92 0.00 0.00 175.35 174.41 1x0h s VAL 90 N 1.69 2.30 -0.21 3.17 1.01 -1.14 -1.37 120.40 125.84 1x0h s VAL 90 Ca 0.05 -1.95 -0.24 0.00 0.00 0.00 0.00 61.98 59.83 1x0h s VAL 90 Cb -0.13 -2.07 -0.01 0.00 0.00 0.00 0.00 36.38 34.17 1x0h s VAL 90 CO -0.08 -0.07 0.81 0.21 0.00 0.00 0.00 175.10 175.97 1x0h s ASN 91 N -2.50 6.86 0.28 3.32 2.47 0.35 -1.06 114.94 124.66 1x0h s ASN 91 Ca 0.19 1.07 0.08 0.00 0.42 0.00 0.00 52.86 54.61 1x0h s ASN 91 Cb -0.08 -2.44 0.38 0.00 -1.45 0.00 0.00 41.25 37.66 1x0h s ASN 91 CO 0.09 -0.45 1.64 0.58 -3.72 0.00 0.00 177.10 175.23 1x0h h VAL 92 N 5.32 1.37 -0.12 -5.21 2.07 -1.24 0.32 116.25 118.77 1x0h h VAL 92 Ca -0.26 -1.84 0.03 0.00 0.82 0.00 0.00 66.70 65.45 1x0h h VAL 92 Cb 1.11 1.94 -0.00 0.00 -1.52 0.00 0.00 31.29 32.82 1x0h h VAL 92 CO 0.85 0.54 0.09 0.78 0.02 0.00 0.00 177.57 179.85 1x0h h ASN 93 N 0.10 0.00 0.00 0.57 2.35 -1.92 -2.59 115.58 114.10 1x0h h ASN 93 Ca -0.00 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.52 1x0h h ASN 93 Cb 0.99 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.31 1x0h h ASN 93 CO 0.08 0.00 -1.89 0.18 -1.65 0.00 0.00 177.43 174.14 1x0h n LEU 94 N -4.44 0.00 -0.14 1.61 4.77 -1.11 -4.18 117.00 113.50 1x0h n LEU 94 Ca -0.00 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.08 1x0h n LEU 94 Cb 0.21 0.31 0.43 0.00 -2.33 0.00 0.00 43.42 42.04 1x0h n LEU 94 CO 0.34 0.31 1.20 0.25 -1.33 0.00 0.00 177.39 178.16 1x0h h LEU 95 N 0.00 0.51 0.00 2.23 5.85 -0.14 0.13 115.31 123.89 1x0h h LEU 95 Ca -0.34 0.01 -0.22 0.00 0.84 0.00 0.00 57.88 58.18 1x0h h LEU 95 Cb 1.75 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.65 1x0h h LEU 95 CO 0.02 0.31 -1.12 0.40 -0.34 0.00 0.00 178.44 177.70 1x0h h ILE 96 N 0.56 1.38 -0.18 4.05 2.04 -1.69 -3.26 117.51 120.41 1x0h h ILE 96 Ca 0.31 -3.08 -0.20 0.00 1.00 0.00 0.00 64.86 62.89 1x0h h ILE 96 Cb 0.47 2.67 0.01 0.00 -0.74 0.00 0.00 36.82 39.24 1x0h h ILE 96 CO -0.10 0.79 -0.65 0.15 0.00 0.00 0.00 178.15 178.33 1x0h h PHE 97 N 0.00 1.01 0.49 1.37 3.04 -1.37 -2.36 116.94 119.12 1x0h h PHE 97 Ca -0.08 -0.42 -0.02 0.00 3.98 0.00 0.00 57.97 61.43 1x0h h PHE 97 Cb 1.78 -0.17 -0.00 0.00 2.56 0.00 0.00 35.95 40.12 1x0h h PHE 97 CO 0.00 1.24 -0.27 1.25 -2.02 0.00 0.00 178.31 178.51 1x0h h LEU 98 N 0.49 -0.67 -1.93 0.59 5.85 -0.91 -2.40 115.31 116.32 1x0h h LEU 98 Ca -0.03 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1x0h h LEU 98 Cb 1.28 0.19 -0.00 0.00 0.37 0.00 0.00 40.66 42.50 1x0h h LEU 98 CO 0.14 -0.45 -0.09 -0.07 -0.34 0.00 0.00 178.44 177.63 1x0h h LEU 99 N -0.72 0.00 -1.99 2.25 3.38 -1.65 0.45 115.31 117.04 1x0h h LEU 99 Ca -0.06 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.98 1x0h h LEU 99 Cb 0.57 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1x0h h LEU 99 CO 0.08 0.09 0.18 -1.13 0.09 0.00 0.00 178.44 177.76 1x0h h ASN 100 N 0.00 0.01 0.00 -0.43 -0.73 -0.89 0.35 115.58 113.89 1x0h h ASN 100 Ca -0.00 0.00 -0.16 0.00 1.87 0.00 0.00 56.30 58.01 1x0h h ASN 100 Cb 0.18 -0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.74 1x0h h ASN 100 CO 0.01 0.01 -1.61 1.17 -0.37 0.00 0.00 177.43 176.64 1x0h n LYS 101 N -4.46 2.30 0.00 6.67 4.81 -0.73 -4.20 118.16 122.55 1x0h n LYS 101 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.47 1x0h n LYS 101 Cb 0.33 -1.23 0.00 0.00 0.02 0.00 0.00 35.03 34.15 1x0h n LYS 101 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1x0h n LYS 102 N -2.38 0.00 -0.02 1.64 4.76 0.15 -4.48 118.16 117.82 1x0h n LYS 102 Ca -0.15 0.20 -0.13 0.00 -2.87 0.00 0.00 58.31 55.36 1x0h n LYS 102 Cb 0.78 -0.91 -0.10 0.00 -1.84 0.00 0.00 35.03 32.96 1x0h n LYS 102 CO 0.00 0.00 0.00 0.74 -1.37 0.00 0.00 177.40 176.77 1x0h h PHE 103 N 0.00 0.01 -1.38 2.13 -1.00 -1.58 -3.41 116.94 111.71 1x0h h PHE 103 Ca 0.00 -0.00 -0.38 0.00 2.81 0.00 0.00 57.97 60.40 1x0h h PHE 103 Cb 0.00 -0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.57 1x0h h PHE 103 CO 0.04 0.55 1.35 0.66 -1.61 0.00 0.00 178.31 179.30 1x0h n TYR 104 N -4.82 1.38 -2.72 -0.55 4.01 0.12 -4.70 117.16 109.89 1x0h n TYR 104 Ca -0.09 0.09 0.01 0.00 -0.16 0.00 0.00 57.90 57.76 1x0h n TYR 104 Cb 0.28 -2.64 0.04 0.00 -0.31 0.00 0.00 39.34 36.71 1x0h n TYR 104 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1x0h n GLY 105 N 6.16 1.55 0.20 2.72 0.00 -1.26 -4.32 105.19 110.23 1x0h n GLY 105 Ca 0.39 -0.93 -0.14 0.00 0.00 0.00 0.00 46.02 45.34 1x0h n GLY 105 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x0h h LYS 106 N 2.02 0.61 -5.83 1.61 1.57 -1.91 -3.41 116.57 111.23 1x0h h LYS 106 Ca -0.19 -0.51 -0.61 0.00 -1.87 0.00 0.00 60.65 57.47 1x0h h LYS 106 Cb 1.45 0.11 -0.11 0.00 0.08 0.00 0.00 32.23 33.76 1x0h h LYS 106 CO 0.13 1.13 0.41 -1.12 -0.57 0.00 0.00 179.45 179.43 1x0h s SER 107 N -7.06 6.58 0.00 0.86 0.01 -1.26 -4.54 113.70 108.29 1x0h s SER 107 Ca -0.08 0.41 0.00 0.00 1.31 0.00 0.00 55.95 57.59 1x0h s SER 107 Cb 0.09 -2.41 0.00 0.00 0.21 0.00 0.00 66.02 63.92 1x0h s SER 107 CO 0.88 -0.74 0.00 0.61 0.41 0.00 0.00 173.24 174.39 1x0h n GLY 108 N 4.48 1.59 3.67 3.44 0.00 -1.26 -5.07 105.19 112.04 1x0h n GLY 108 Ca 0.04 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 1x0h n GLY 108 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x0h s PRO 109 N 0.00 4.22 0.25 1.61 0.04 -1.26 -4.91 135.00 134.95 1x0h s PRO 109 Ca 0.00 2.00 0.07 0.00 0.04 0.00 0.00 61.00 63.11 1x0h s PRO 109 Cb 0.00 -3.81 0.29 0.00 0.04 0.00 0.00 34.50 31.02 1x0h s PRO 109 CO 0.00 -0.74 1.58 0.66 0.04 0.00 0.00 177.00 178.54 1x0h h SER 110 N 8.71 0.15 -3.51 6.66 4.64 -1.94 -3.41 113.55 124.85 1x0h h SER 110 Ca -0.36 -0.09 -0.60 0.00 -0.47 0.00 0.00 61.79 60.28 1x0h h SER 110 Cb 1.16 -0.04 -0.38 0.00 -0.31 0.00 0.00 62.40 62.83 1x0h h SER 110 CO 0.94 0.73 -0.79 -0.44 -0.87 0.00 0.00 176.83 176.40 1x0h s SER 111 N -6.88 3.51 0.00 4.97 0.01 -1.26 -5.20 113.70 108.85 1x0h s SER 111 Ca -0.03 -0.99 0.00 0.00 1.31 0.00 0.00 55.95 56.24 1x0h s SER 111 Cb 0.12 -1.12 0.00 0.00 0.21 0.00 0.00 66.02 65.24 1x0h s SER 111 CO 0.78 -0.21 0.00 0.61 0.41 0.00 0.00 173.24 174.84