#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 2.34 0.02 1.61 1.04 -1.26 -5.07 113.70 112.38 1x0h s SER 2 Ca 0.00 0.24 0.02 0.00 0.48 0.00 0.00 55.95 56.69 1x0h s SER 2 Cb 0.00 -0.23 -0.04 0.00 0.10 0.00 0.00 66.02 65.85 1x0h s SER 2 CO 0.00 -3.21 0.03 -0.94 0.98 0.00 0.00 173.24 170.10 1x0h s SER 3 N -4.75 5.27 0.00 7.02 1.04 -1.26 -4.99 113.70 116.04 1x0h s SER 3 Ca 0.75 0.01 0.00 0.00 0.48 0.00 0.00 55.95 57.19 1x0h s SER 3 Cb -0.03 -1.40 0.00 0.00 0.10 0.00 0.00 66.02 64.68 1x0h s SER 3 CO 0.54 0.26 0.00 0.61 0.98 0.00 0.00 173.24 175.63 1x0h n GLY 4 N 1.17 -1.17 3.89 7.32 0.00 -1.26 -5.17 105.19 109.97 1x0h n GLY 4 Ca -0.13 0.34 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 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 0.00 5.90 -0.23 1.61 0.01 -1.26 -5.03 113.70 114.70 1x0h s SER 5 Ca 0.00 1.07 -0.18 0.00 1.31 0.00 0.00 55.95 58.15 1x0h s SER 5 Cb 0.00 -2.11 -0.17 0.00 0.21 0.00 0.00 66.02 63.95 1x0h s SER 5 CO 0.00 -0.96 0.04 -1.54 0.41 0.00 0.00 173.24 171.19 1x0h n SER 6 N -2.66 1.90 0.00 2.44 3.41 -1.26 -5.07 113.62 112.38 1x0h n SER 6 Ca 0.05 0.38 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 1x0h n SER 6 Cb 0.56 -0.91 0.00 0.00 -0.26 0.00 0.00 64.21 63.60 1x0h n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x0h n GLY 7 N 1.41 0.83 3.78 5.00 0.00 -1.26 -5.09 105.19 109.86 1x0h n GLY 7 Ca -0.39 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 44.52 1x0h n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x0h s ILE 8 N -1.86 3.45 0.12 -0.61 1.09 -1.26 -4.70 121.20 117.43 1x0h s ILE 8 Ca 0.00 0.87 0.00 0.00 -1.10 0.00 0.00 60.65 60.42 1x0h s ILE 8 Cb 0.00 -3.34 0.00 0.00 -1.06 0.00 0.00 42.46 38.06 1x0h s ILE 8 CO 0.00 -0.23 0.00 -1.20 -0.10 0.00 0.00 174.94 173.41 1x0h n SER 9 N -1.32 -8.70 -4.70 3.58 7.64 -1.26 -4.93 113.62 103.93 1x0h n SER 9 Ca 0.10 1.47 -0.39 0.00 1.01 0.00 0.00 58.87 61.06 1x0h n SER 9 Cb 0.52 -4.83 -0.06 0.00 -1.01 0.00 0.00 64.21 58.83 1x0h n SER 9 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1x0h s LEU 10 N -0.51 4.24 -0.31 -3.43 1.43 -0.84 -4.96 118.68 114.29 1x0h s LEU 10 Ca 0.00 0.91 -0.05 0.00 -1.03 0.00 0.00 54.13 53.96 1x0h s LEU 10 Cb 0.00 -2.86 0.03 0.00 0.03 0.00 0.00 46.19 43.39 1x0h s LEU 10 CO 0.00 -0.13 0.06 -0.75 0.23 0.00 0.00 176.35 175.76 1x0h s LYS 11 N 1.15 2.71 -0.01 1.70 2.47 -1.26 -2.16 119.74 124.34 1x0h s LYS 11 Ca 0.30 -1.10 0.02 0.00 -1.56 0.00 0.00 55.97 53.63 1x0h s LYS 11 Cb -0.16 -3.34 -0.00 0.00 -1.46 0.00 0.00 37.83 32.86 1x0h s LYS 11 CO 0.12 -0.58 -0.06 0.71 0.16 0.00 0.00 175.35 175.70 1x0h s TYR 12 N 1.39 0.59 0.56 4.03 2.02 -0.94 -5.00 117.35 119.99 1x0h s TYR 12 Ca -0.01 -0.11 -0.01 0.00 -0.37 0.00 0.00 57.07 56.57 1x0h s TYR 12 Cb -0.19 -0.38 0.03 0.00 -0.40 0.00 0.00 41.96 41.02 1x0h s TYR 12 CO 0.01 -0.01 0.80 0.95 -1.57 0.00 0.00 175.55 175.73 1x0h s THR 13 N -0.12 2.92 0.13 -0.71 -4.23 -1.26 0.92 115.64 113.29 1x0h s THR 13 Ca 0.02 -0.52 -0.18 0.00 -1.18 0.00 0.00 61.69 59.83 1x0h s THR 13 Cb -0.03 -3.12 -0.04 0.00 1.34 0.00 0.00 72.50 70.65 1x0h s THR 13 CO -0.00 -0.10 1.79 0.00 -0.54 0.00 0.00 174.62 175.77 1x0h h ALA 14 N 0.01 0.33 -0.57 3.99 0.00 -1.54 -2.10 119.26 119.38 1x0h h ALA 14 Ca -0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1x0h h ALA 14 Cb 1.29 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 1x0h h ALA 14 CO 0.55 -0.20 0.38 0.00 0.00 0.00 0.00 179.25 179.97 1x0h h ALA 15 N 1.10 1.58 0.54 0.00 0.00 -1.50 0.16 119.26 121.16 1x0h h ALA 15 Ca 0.10 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1x0h h ALA 15 Cb -0.03 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 17.53 1x0h h ALA 15 CO -0.03 0.38 -0.26 0.00 0.00 0.00 0.00 179.25 179.34 1x0h h ARG 16 N 0.78 -0.70 -0.09 0.00 2.47 -1.71 -1.59 114.38 113.54 1x0h h ARG 16 Ca 0.21 0.05 -0.06 0.00 -1.26 0.00 0.00 59.98 58.92 1x0h h ARG 16 Cb -0.08 0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 28.39 1x0h h ARG 16 CO -0.04 -0.41 -0.21 -0.07 0.56 0.00 0.00 179.97 179.79 1x0h h LEU 17 N -0.90 0.14 -0.18 3.04 3.38 -1.21 -2.90 115.31 116.68 1x0h h LEU 17 Ca -0.07 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1x0h h LEU 17 Cb 0.62 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1x0h h LEU 17 CO 0.12 0.36 0.08 -0.74 0.09 0.00 0.00 178.44 178.35 1x0h h HIS 18 N 0.13 0.27 -0.12 1.13 2.76 -0.54 -1.80 115.15 116.99 1x0h h HIS 18 Ca 0.02 -0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.18 1x0h h HIS 18 Cb 0.46 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.33 1x0h h HIS 18 CO 0.00 0.31 0.08 0.93 -1.30 0.00 0.00 177.93 177.96 1x0h h GLU 19 N 0.15 0.12 -0.05 5.26 4.39 -1.09 -1.48 114.58 121.89 1x0h h GLU 19 Ca 0.06 -0.01 -0.18 0.00 0.34 0.00 0.00 59.36 59.57 1x0h h GLU 19 Cb 0.15 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1x0h h GLU 19 CO -0.01 0.08 -0.76 0.87 -1.16 0.00 0.00 179.01 178.03 1x0h h LYS 20 N 0.13 0.31 0.00 2.33 1.57 -1.32 -3.48 116.57 116.11 1x0h h LYS 20 Ca 0.05 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.55 1x0h h LYS 20 Cb 0.03 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.41 1x0h h LYS 20 CO -0.01 0.94 0.00 0.41 -0.57 0.00 0.00 179.45 180.22 1x0h n GLY 21 N 0.62 2.04 0.18 3.86 0.00 -0.56 -5.01 105.19 106.32 1x0h n GLY 21 Ca -0.04 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.73 1.61 2.07 -1.72 -3.41 116.25 112.08 1x0h h VAL 22 Ca 0.00 0.00 -0.55 0.00 0.82 0.00 0.00 66.70 66.97 1x0h h VAL 22 Cb 0.00 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.76 1x0h h VAL 22 CO 0.00 0.00 0.99 -0.22 0.02 0.00 0.00 177.57 178.36 1x0h s LEU 23 N -6.43 4.31 -0.02 2.57 2.96 -1.18 -1.27 118.68 119.63 1x0h s LEU 23 Ca -0.06 2.18 -0.01 0.00 -0.22 0.00 0.00 54.13 56.02 1x0h s LEU 23 Cb 0.01 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 43.16 1x0h s LEU 23 CO 0.21 -0.85 -0.01 -0.07 -1.32 0.00 0.00 176.35 174.31 1x0h h LEU 24 N 9.50 0.00 0.00 -0.68 3.38 -1.58 -3.39 115.31 122.54 1x0h h LEU 24 Ca -0.38 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.52 1x0h h LEU 24 Cb 1.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 1x0h h LEU 24 CO 0.94 0.10 0.21 -0.62 0.09 0.00 0.00 178.44 179.16 1x0h n GLU 25 N -2.52 1.08 -3.77 1.13 1.02 -1.17 -5.05 120.64 111.37 1x0h n GLU 25 Ca -0.00 -2.35 -0.20 0.00 -0.02 0.00 0.00 57.16 54.59 1x0h n GLU 25 Cb 0.02 2.81 -0.17 0.00 -0.02 0.00 0.00 31.44 34.07 1x0h n GLU 25 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1x0h s ILE 26 N -2.21 0.09 -1.53 -3.67 1.01 -1.26 -1.52 121.20 112.10 1x0h s ILE 26 Ca 0.18 0.25 -0.10 0.00 0.00 0.00 0.00 60.65 60.98 1x0h s ILE 26 Cb -0.04 -0.27 -0.07 0.00 0.01 0.00 0.00 42.46 42.09 1x0h s ILE 26 CO 0.14 0.18 2.77 -0.62 0.00 0.00 0.00 174.94 177.41 1x0h n GLU 27 N 4.89 3.41 0.00 2.79 1.02 -1.24 -3.22 120.64 128.29 1x0h n GLU 27 Ca -0.12 -2.19 0.00 0.00 -0.02 0.00 0.00 57.16 54.83 1x0h n GLU 27 Cb 0.50 -2.85 0.00 0.00 -0.02 0.00 0.00 31.44 29.07 1x0h n GLU 27 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1x0h n ASP 28 N 4.08 0.00 -4.70 1.62 2.03 -1.26 -4.92 116.55 113.39 1x0h n ASP 28 Ca 0.72 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.75 1x0h n ASP 28 Cb 0.25 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.56 1x0h n ASP 28 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1x0h s LEU 29 N -1.18 2.83 0.46 -2.67 1.43 -1.20 -5.16 118.68 113.20 1x0h s LEU 29 Ca 0.00 -1.33 0.06 0.00 -1.03 0.00 0.00 54.13 51.83 1x0h s LEU 29 Cb 0.00 -1.05 -0.02 0.00 0.03 0.00 0.00 46.19 45.14 1x0h s LEU 29 CO 0.00 -0.60 0.21 -1.10 0.23 0.00 0.00 176.35 175.10 1x0h s GLN 30 N -3.84 2.24 0.55 1.70 1.11 -1.26 -4.51 119.66 115.64 1x0h s GLN 30 Ca 0.31 -1.96 0.26 0.00 0.01 0.00 0.00 55.36 53.98 1x0h s GLN 30 Cb 0.06 -1.95 1.45 0.00 -1.01 0.00 0.00 33.01 31.55 1x0h s GLN 30 CO 0.17 -0.28 2.02 0.28 0.01 0.00 0.00 175.29 177.49 1x0h h VAL 31 N 1.24 0.66 0.00 1.09 2.07 -2.00 0.19 116.25 119.50 1x0h h VAL 31 Ca -0.41 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 66.99 1x0h h VAL 31 Cb 1.27 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 1x0h h VAL 31 CO 0.67 0.00 -0.55 -1.13 0.02 0.00 0.00 177.57 176.58 1x0h h ASN 32 N 0.00 0.00 0.78 0.57 -1.24 -2.03 -2.92 115.58 110.74 1x0h h ASN 32 Ca 0.20 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.21 1x0h h ASN 32 Cb 0.85 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.90 1x0h h ASN 32 CO -0.00 0.55 -0.22 0.00 -1.29 0.00 0.00 177.43 176.46 1x0h n GLN 33 N -3.61 0.00 0.32 6.67 6.02 0.62 -3.79 117.38 123.61 1x0h n GLN 33 Ca -0.00 0.00 0.19 0.00 -0.01 0.00 0.00 57.00 57.18 1x0h n GLN 33 Cb 0.61 -1.50 1.02 0.00 1.02 0.00 0.00 30.24 31.39 1x0h n GLN 33 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 1x0h h PHE 34 N 0.00 0.00 -0.67 1.08 -1.00 -1.25 -0.43 116.94 114.67 1x0h h PHE 34 Ca 0.00 0.00 -0.36 0.00 2.81 0.00 0.00 57.97 60.42 1x0h h PHE 34 Cb 0.50 0.00 -0.21 0.00 3.61 0.00 0.00 35.95 39.85 1x0h h PHE 34 CO 0.00 0.00 0.46 1.63 -1.61 0.00 0.00 178.31 178.79 1x0h n LYS 35 N -3.13 1.87 0.00 1.51 5.02 -1.25 -1.24 118.16 120.95 1x0h n LYS 35 Ca -0.02 -2.04 0.00 0.00 -2.02 0.00 0.00 58.31 54.23 1x0h n LYS 35 Cb 0.21 -1.80 0.00 0.00 -0.02 0.00 0.00 35.03 33.42 1x0h n LYS 35 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1x0h n ASN 36 N -0.56 0.83 -4.80 4.39 3.02 -0.17 -5.06 115.26 112.90 1x0h n ASN 36 Ca 0.41 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.64 1x0h n ASN 36 Cb 1.23 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 40.45 1x0h n ASN 36 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1x0h s VAL 37 N -1.79 3.83 -0.00 2.41 1.01 -1.23 -5.02 120.40 119.60 1x0h s VAL 37 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 61.98 62.61 1x0h s VAL 37 Cb 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 33.10 1x0h s VAL 37 CO 0.00 -0.74 -0.01 -0.51 0.00 0.00 0.00 175.10 173.84 1x0h s ILE 38 N -2.93 0.10 -0.29 2.22 2.07 -1.26 -3.39 121.20 117.72 1x0h s ILE 38 Ca 0.60 -0.04 -0.05 0.00 -1.41 0.00 0.00 60.65 59.75 1x0h s ILE 38 Cb -0.15 -0.11 0.03 0.00 0.13 0.00 0.00 42.46 42.36 1x0h s ILE 38 CO 0.53 0.04 0.04 -0.36 -1.91 0.00 0.00 174.94 173.27 1x0h s PHE 39 N 0.06 3.17 -0.38 3.50 0.08 0.26 -2.61 117.98 122.06 1x0h s PHE 39 Ca -0.00 -1.37 -0.13 0.00 0.12 0.00 0.00 56.93 55.55 1x0h s PHE 39 Cb -0.02 -2.19 0.02 0.00 -0.57 0.00 0.00 43.02 40.27 1x0h s PHE 39 CO -0.00 -0.69 0.24 -2.00 -0.10 0.00 0.00 175.22 172.67 1x0h s GLU 40 N 1.39 2.98 -0.24 0.44 -6.30 -1.08 -2.21 118.70 113.68 1x0h s GLU 40 Ca -0.00 -0.99 -0.08 0.00 -2.50 0.00 0.00 54.97 51.40 1x0h s GLU 40 Cb -0.18 -3.83 -0.03 0.00 0.00 0.00 0.00 34.13 30.09 1x0h s GLU 40 CO 0.00 -0.68 0.08 0.42 0.02 0.00 0.00 175.26 175.10 1x0h s ILE 41 N 1.62 4.46 -0.20 -3.70 1.01 -0.92 -1.61 121.20 121.86 1x0h s ILE 41 Ca 0.04 -0.13 -0.07 0.00 0.00 0.00 0.00 60.65 60.49 1x0h s ILE 41 Cb -0.19 -3.08 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 1x0h s ILE 41 CO 0.08 0.35 0.06 -0.44 0.00 0.00 0.00 174.94 174.99 1x0h s SER 42 N 1.44 5.47 0.33 3.58 0.01 0.11 -1.99 113.70 122.65 1x0h s SER 42 Ca 0.06 -0.00 -0.28 0.00 1.31 0.00 0.00 55.95 57.03 1x0h s SER 42 Cb -0.15 -1.95 -0.09 0.00 0.21 0.00 0.00 66.02 64.04 1x0h s SER 42 CO 0.04 0.12 1.13 -2.16 0.41 0.00 0.00 173.24 172.77 1x0h s PRO 43 N 0.71 4.43 0.11 12.44 0.04 -1.26 -2.25 135.00 149.23 1x0h s PRO 43 Ca 0.03 1.81 0.03 0.00 0.04 0.00 0.00 61.00 62.92 1x0h s PRO 43 Cb -0.13 -2.99 -0.04 0.00 0.04 0.00 0.00 34.50 31.38 1x0h s PRO 43 CO 0.02 0.02 0.14 0.95 0.04 0.00 0.00 177.00 178.17 1x0h s THR 44 N -1.28 4.74 0.19 1.26 -4.23 -1.26 -4.95 115.64 110.11 1x0h s THR 44 Ca 0.49 -0.81 -0.10 0.00 -1.18 0.00 0.00 61.69 60.09 1x0h s THR 44 Cb -0.31 -3.35 0.12 0.00 1.34 0.00 0.00 72.50 70.30 1x0h s THR 44 CO 0.40 0.02 1.80 1.05 -0.54 0.00 0.00 174.62 177.35 1x0h h GLU 45 N 2.81 0.99 -6.61 3.99 4.11 -1.90 -3.42 114.58 114.55 1x0h h GLU 45 Ca -0.47 -0.13 -0.52 0.00 0.07 0.00 0.00 59.36 58.31 1x0h h GLU 45 Cb 1.18 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 30.25 1x0h h GLU 45 CO 0.67 0.76 0.51 -2.00 0.07 0.00 0.00 179.01 179.02 1x0h s GLU 46 N -5.78 4.53 0.07 1.06 2.56 -1.26 -4.99 118.70 114.89 1x0h s GLU 46 Ca -0.13 1.75 -0.31 0.00 0.00 0.00 0.00 54.97 56.29 1x0h s GLU 46 Cb 0.14 -3.29 -0.06 0.00 2.00 0.00 0.00 34.13 32.92 1x0h s GLU 46 CO 0.80 -0.04 1.22 0.54 -0.56 0.00 0.00 175.26 177.22 1x0h s VAL 47 N 0.13 3.94 0.00 3.70 0.11 -1.26 -3.26 120.40 123.76 1x0h s VAL 47 Ca 0.52 1.40 0.00 0.00 -2.93 0.00 0.00 61.98 60.97 1x0h s VAL 47 Cb -0.30 -3.90 0.00 0.00 -1.53 0.00 0.00 36.38 30.66 1x0h s VAL 47 CO 0.34 0.11 0.00 0.61 -3.33 0.00 0.00 175.10 172.83 1x0h n GLY 48 N 3.21 2.16 3.89 6.54 0.00 -1.26 -5.07 105.19 114.66 1x0h n GLY 48 Ca 0.09 -0.34 -0.29 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.01 6.48 0.31 1.61 2.15 -1.20 -3.26 116.67 122.75 1x0h s ASP 49 Ca 0.00 0.88 -0.02 0.00 0.43 0.00 0.00 52.55 53.84 1x0h s ASP 49 Cb 0.00 -2.22 -0.01 0.00 -0.30 0.00 0.00 42.92 40.39 1x0h s ASP 49 CO 0.00 -0.28 0.40 -0.36 -0.17 0.00 0.00 175.17 174.76 1x0h s PHE 50 N -2.20 1.08 -0.28 -5.34 0.08 -0.74 -4.26 117.98 106.33 1x0h s PHE 50 Ca 0.47 -1.28 -0.04 0.00 0.12 0.00 0.00 56.93 56.20 1x0h s PHE 50 Cb -0.11 -0.20 0.10 0.00 -0.57 0.00 0.00 43.02 42.24 1x0h s PHE 50 CO 0.30 -1.01 0.14 -2.00 -0.10 0.00 0.00 175.22 172.55 1x0h s GLU 51 N -3.40 0.18 0.34 0.44 2.12 -0.96 -2.39 118.70 115.03 1x0h s GLU 51 Ca 0.32 -0.44 -0.02 0.00 0.36 0.00 0.00 54.97 55.18 1x0h s GLU 51 Cb 0.01 -1.20 -0.04 0.00 0.26 0.00 0.00 34.13 33.16 1x0h s GLU 51 CO 0.19 -0.98 0.58 0.08 -0.54 0.00 0.00 175.26 174.59 1x0h s VAL 52 N 2.13 5.05 -0.03 3.70 1.01 -0.89 0.08 120.40 131.45 1x0h s VAL 52 Ca 0.08 -0.16 -0.12 0.00 0.00 0.00 0.00 61.98 61.78 1x0h s VAL 52 Cb -0.16 -3.81 0.02 0.00 0.00 0.00 0.00 36.38 32.43 1x0h s VAL 52 CO -0.33 -0.49 0.26 -0.75 0.00 0.00 0.00 175.10 173.79 1x0h s LYS 53 N -4.03 0.55 -0.08 2.72 2.20 -0.64 -2.00 119.74 118.48 1x0h s LYS 53 Ca 0.42 -0.12 -0.03 0.00 -0.36 0.00 0.00 55.97 55.89 1x0h s LYS 53 Cb -0.10 0.24 0.04 0.00 -1.51 0.00 0.00 37.83 36.50 1x0h s LYS 53 CO 0.34 -0.14 0.06 0.00 -0.36 0.00 0.00 175.35 175.25 1x0h s ALA 54 N -1.04 0.37 0.74 3.13 0.00 -1.26 -2.64 121.76 121.07 1x0h s ALA 54 Ca -0.11 0.01 -0.13 0.00 0.00 0.00 0.00 51.96 51.73 1x0h s ALA 54 Cb -0.05 -0.74 0.04 0.00 0.00 0.00 0.00 23.12 22.36 1x0h s ALA 54 CO 0.03 -0.65 1.12 0.21 0.00 0.00 0.00 175.76 176.46 1x0h s LYS 55 N 2.12 2.35 -1.24 0.00 2.47 -1.07 -3.61 119.74 120.76 1x0h s LYS 55 Ca 0.04 1.35 -0.08 0.00 -1.56 0.00 0.00 55.97 55.72 1x0h s LYS 55 Cb -0.13 -1.90 0.01 0.00 -1.46 0.00 0.00 37.83 34.35 1x0h s LYS 55 CO -0.05 -1.60 1.01 1.19 0.16 0.00 0.00 175.35 176.06 1x0h n PHE 56 N -3.07 -2.50 -2.21 4.03 3.72 -1.26 -4.79 117.46 111.37 1x0h n PHE 56 Ca 0.10 0.86 -0.01 0.00 -0.05 0.00 0.00 57.45 58.36 1x0h n PHE 56 Cb 0.52 -4.57 0.02 0.00 -0.94 0.00 0.00 39.48 34.51 1x0h n PHE 56 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 176.76 176.59 1x0h n MET 57 N -4.45 0.26 -4.01 -1.08 1.56 -1.24 -5.16 117.12 103.00 1x0h n MET 57 Ca -0.00 -0.34 -0.21 0.00 -0.27 0.00 0.00 57.70 56.87 1x0h n MET 57 Cb 0.56 0.27 -0.03 0.00 2.15 0.00 0.00 33.22 36.17 1x0h n MET 57 CO 0.00 0.00 0.00 0.20 -0.73 0.00 0.00 175.97 175.44 1x0h s GLY 58 N -0.33 1.28 -0.08 -5.12 0.00 -1.26 -4.93 107.32 96.88 1x0h s GLY 58 Ca 0.02 -1.30 0.06 0.00 0.00 0.00 0.00 44.72 43.50 1x0h s GLY 58 CO -0.02 -1.32 0.00 1.55 0.00 0.00 0.00 173.10 173.31 1x0h n VAL 59 N -1.34 0.56 -2.54 1.40 3.14 -1.26 -4.89 118.33 113.41 1x0h n VAL 59 Ca -0.08 -0.32 -0.01 0.00 -2.96 0.00 0.00 64.34 60.97 1x0h n VAL 59 Cb 0.57 -0.80 0.05 0.00 -1.06 0.00 0.00 33.84 32.61 1x0h n VAL 59 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1x0h n GLN 60 N -2.40 0.59 -2.51 1.45 1.13 -1.26 -4.97 117.38 109.40 1x0h n GLN 60 Ca -0.14 -0.54 -0.18 0.00 -1.94 0.00 0.00 57.00 54.20 1x0h n GLN 60 Cb 0.75 0.21 0.00 0.00 0.11 0.00 0.00 30.24 31.31 1x0h n GLN 60 CO 0.00 0.00 0.00 -0.12 -1.44 0.00 0.00 177.06 175.50 1x0h n MET 61 N -0.67 -2.26 -3.48 -1.09 0.00 -1.26 -4.97 117.12 103.39 1x0h n MET 61 Ca -0.08 0.82 -0.43 0.00 0.00 0.00 0.00 57.70 58.02 1x0h n MET 61 Cb 0.66 -5.32 -0.09 0.00 0.00 0.00 0.00 33.22 28.47 1x0h n MET 61 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 175.97 173.97 1x0h s GLU 62 N -5.07 2.80 0.56 2.12 -6.30 -1.26 -5.07 118.70 106.48 1x0h s GLU 62 Ca 0.08 -1.43 -0.21 0.00 -2.50 0.00 0.00 54.97 50.91 1x0h s GLU 62 Cb -0.04 -3.98 -0.04 0.00 0.00 0.00 0.00 34.13 30.07 1x0h s GLU 62 CO 0.10 -1.01 1.36 2.41 0.02 0.00 0.00 175.26 178.14 1x0h n THR 63 N 5.07 4.02 -2.97 -1.70 -1.04 -1.26 -4.85 114.28 111.54 1x0h n THR 63 Ca -0.11 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.05 60.98 1x0h n THR 63 Cb 0.43 -1.66 -0.05 0.00 -1.82 0.00 0.00 70.33 67.23 1x0h n THR 63 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1x0h s PHE 64 N -1.30 3.15 0.36 -1.42 5.36 -0.84 -4.97 117.98 118.32 1x0h s PHE 64 Ca 0.73 0.63 -0.27 0.00 -0.96 0.00 0.00 56.93 57.06 1x0h s PHE 64 Cb -0.41 -3.30 -0.09 0.00 -0.34 0.00 0.00 43.02 38.88 1x0h s PHE 64 CO 0.48 -0.65 1.18 1.41 -1.46 0.00 0.00 175.22 176.18 1x0h s MET 65 N 2.99 4.23 -0.07 10.12 -2.45 -1.26 -2.10 119.30 130.77 1x0h s MET 65 Ca 0.31 1.91 0.02 0.00 -1.25 0.00 0.00 55.69 56.68 1x0h s MET 65 Cb -0.14 -2.86 0.01 0.00 1.25 0.00 0.00 34.83 33.10 1x0h s MET 65 CO 0.15 -0.19 -0.13 -1.17 1.05 0.00 0.00 175.02 174.73 1x0h s LEU 66 N -2.15 1.66 0.17 4.11 2.96 -1.01 -4.90 118.68 119.52 1x0h s LEU 66 Ca 0.53 -0.32 0.04 0.00 -0.22 0.00 0.00 54.13 54.16 1x0h s LEU 66 Cb -0.33 -0.88 -0.04 0.00 0.50 0.00 0.00 46.19 45.45 1x0h s LEU 66 CO 0.42 0.03 0.22 -2.28 -1.32 0.00 0.00 176.35 173.42 1x0h s HIS 67 N 0.70 3.31 0.08 5.38 2.46 -1.26 -1.80 115.29 124.16 1x0h s HIS 67 Ca -0.14 0.04 0.06 0.00 0.47 0.00 0.00 55.06 55.49 1x0h s HIS 67 Cb -0.16 -1.58 -0.23 0.00 -0.13 0.00 0.00 32.58 30.49 1x0h s HIS 67 CO 0.03 0.51 1.13 -0.92 -2.47 0.00 0.00 174.74 173.02 1x0h h TYR 68 N 2.18 0.10 -0.87 3.88 5.03 -1.95 -3.25 116.97 122.09 1x0h h TYR 68 Ca -0.48 -0.07 -0.00 0.00 2.58 0.00 0.00 58.73 60.75 1x0h h TYR 68 Cb 1.20 -0.00 -0.04 0.00 1.55 0.00 0.00 36.73 39.43 1x0h h TYR 68 CO 0.55 1.07 0.53 0.37 -1.32 0.00 0.00 178.16 179.36 1x0h h GLN 69 N 0.02 1.18 -0.20 1.82 -0.00 -1.96 -1.29 115.11 114.68 1x0h h GLN 69 Ca -0.09 -0.10 -0.11 0.00 -0.00 0.00 0.00 58.65 58.35 1x0h h GLN 69 Cb 1.86 -0.25 -0.01 0.00 0.00 0.00 0.00 27.48 29.07 1x0h h GLN 69 CO 0.13 0.82 -0.33 0.22 0.00 0.00 0.00 178.83 179.68 1x0h h ASP 70 N 1.20 0.43 -0.44 -0.69 3.58 -1.99 -0.12 116.42 118.38 1x0h h ASP 70 Ca 0.31 -0.16 -0.13 0.00 0.42 0.00 0.00 57.03 57.47 1x0h h ASP 70 Cb -0.06 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 40.86 1x0h h ASP 70 CO -0.06 0.74 -0.24 -0.07 -2.88 0.00 0.00 179.24 176.73 1x0h h LEU 71 N 0.36 0.98 -0.32 2.28 3.38 -1.44 -2.99 115.31 117.56 1x0h h LEU 71 Ca 0.04 -0.41 -0.18 0.00 0.09 0.00 0.00 57.88 57.42 1x0h h LEU 71 Cb 0.76 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1x0h h LEU 71 CO 0.06 1.18 -0.85 -0.07 0.09 0.00 0.00 178.44 178.85 1x0h h LEU 72 N 0.79 0.12 -1.75 1.67 3.38 -1.12 -3.17 115.31 115.23 1x0h h LEU 72 Ca 0.10 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1x0h h LEU 72 Cb 0.82 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1x0h h LEU 72 CO 0.07 0.91 0.05 -0.61 0.09 0.00 0.00 178.44 178.95 1x0h h GLN 73 N 0.05 0.21 -0.15 1.13 -0.00 -0.92 -2.36 115.11 113.07 1x0h h GLN 73 Ca -0.03 -0.02 -0.08 0.00 -0.00 0.00 0.00 58.65 58.52 1x0h h GLN 73 Cb 1.48 -0.04 -0.00 0.00 0.00 0.00 0.00 27.48 28.91 1x0h h GLN 73 CO 0.12 0.19 -0.23 -0.07 0.00 0.00 0.00 178.83 178.84 1x0h h LEU 74 N 0.21 0.46 -1.84 -2.39 3.38 -1.50 -2.36 115.31 111.27 1x0h h LEU 74 Ca 0.05 -0.53 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1x0h h LEU 74 Cb 0.07 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1x0h h LEU 74 CO -0.00 0.89 0.10 -0.61 0.09 0.00 0.00 178.44 178.91 1x0h h GLN 75 N 0.04 0.21 -0.09 1.13 4.15 -1.50 0.57 115.11 119.62 1x0h h GLN 75 Ca 0.01 -0.01 -0.16 0.00 0.77 0.00 0.00 58.65 59.27 1x0h h GLN 75 Cb 0.80 -0.05 0.01 0.00 0.21 0.00 0.00 27.48 28.45 1x0h h GLN 75 CO 0.05 0.14 -0.55 -0.92 -1.93 0.00 0.00 178.83 175.62 1x0h h TYR 76 N 0.21 0.72 -0.09 3.99 3.20 -1.36 -3.29 116.97 120.36 1x0h h TYR 76 Ca 0.06 -0.33 -0.21 0.00 3.14 0.00 0.00 58.73 61.38 1x0h h TYR 76 Cb -0.02 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.14 1x0h h TYR 76 CO 0.00 1.12 -0.80 0.93 -1.64 0.00 0.00 178.16 177.77 1x0h h GLU 77 N 0.12 0.59 0.00 1.82 5.08 -0.87 -3.48 114.58 117.83 1x0h h GLU 77 Ca -0.04 -0.51 0.00 0.00 -1.00 0.00 0.00 59.36 57.81 1x0h h GLU 77 Cb 1.21 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.57 1x0h h GLU 77 CO 0.11 1.13 0.00 0.41 -1.00 0.00 0.00 179.01 179.66 1x0h n GLY 78 N 0.70 2.00 3.25 -3.84 0.00 0.18 -5.08 105.19 102.40 1x0h n GLY 78 Ca -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 1x0h n GLY 78 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x0h s VAL 79 N -2.00 5.14 0.36 1.61 1.01 0.07 -4.88 120.40 121.71 1x0h s VAL 79 Ca 0.00 -3.09 0.05 0.00 0.00 0.00 0.00 61.98 58.94 1x0h s VAL 79 Cb 0.00 -4.17 0.20 0.00 0.00 0.00 0.00 36.38 32.41 1x0h s VAL 79 CO 0.00 -1.06 1.94 0.00 0.00 0.00 0.00 175.10 175.98 1x0h h ALA 80 N 6.99 1.49 -2.56 5.51 0.00 -1.96 -3.41 119.26 125.31 1x0h h ALA 80 Ca 0.12 -0.14 -0.53 0.00 0.00 0.00 0.00 54.91 54.36 1x0h h ALA 80 Cb 0.94 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1x0h h ALA 80 CO 0.83 0.39 0.04 0.08 0.00 0.00 0.00 179.25 180.60 1x0h s VAL 81 N -5.19 4.66 -0.12 0.00 1.01 -1.26 0.30 120.40 119.80 1x0h s VAL 81 Ca -0.08 1.15 0.02 0.00 0.00 0.00 0.00 61.98 63.07 1x0h s VAL 81 Cb 0.16 -3.83 0.02 0.00 0.00 0.00 0.00 36.38 32.73 1x0h s VAL 81 CO 0.75 0.25 -0.16 -0.32 0.00 0.00 0.00 175.10 175.62 1x0h s MET 82 N -1.90 2.38 -0.76 2.72 1.75 -0.40 -4.86 119.30 118.23 1x0h s MET 82 Ca 0.40 -0.61 -0.26 0.00 -1.25 0.00 0.00 55.69 53.97 1x0h s MET 82 Cb -0.16 -2.03 0.02 0.00 2.84 0.00 0.00 34.83 35.49 1x0h s MET 82 CO 0.20 -0.10 1.45 0.21 -0.65 0.00 0.00 175.02 176.14 1x0h s LYS 83 N 1.07 3.10 -0.17 4.11 2.47 -1.26 -2.83 119.74 126.23 1x0h s LYS 83 Ca -0.04 -0.18 -0.06 0.00 -1.56 0.00 0.00 55.97 54.13 1x0h s LYS 83 Cb -0.14 -4.41 -0.04 0.00 -1.46 0.00 0.00 37.83 31.78 1x0h s LYS 83 CO -0.04 -2.33 0.03 -0.51 0.16 0.00 0.00 175.35 172.66 1x0h s LEU 84 N 6.51 3.62 -2.04 5.43 1.43 -0.39 -4.40 118.68 128.84 1x0h s LEU 84 Ca 0.45 0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.57 1x0h s LEU 84 Cb -0.08 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.25 1x0h s LEU 84 CO 0.12 0.19 0.00 0.49 0.23 0.00 0.00 176.35 177.38 1x0h n PHE 85 N 3.42 -0.28 -2.64 0.29 3.72 -1.26 -1.53 117.46 119.18 1x0h n PHE 85 Ca -0.17 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.06 1x0h n PHE 85 Cb 0.52 -3.51 -0.00 0.00 -0.94 0.00 0.00 39.48 35.56 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 -1.45 -4.60 0.00 4.37 9.92 -1.26 -4.57 116.55 118.96 1x0h n ASP 86 Ca -0.21 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.05 1x0h n ASP 86 Cb 0.67 -3.84 0.00 0.00 -0.64 0.00 0.00 41.12 37.30 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 -3.14 0.00 -1.71 -1.24 1.74 -0.71 -5.04 116.66 106.56 1x0h n ARG 87 Ca -0.14 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.51 1x0h n ARG 87 Cb 0.62 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 32.03 1x0h n ARG 87 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1x0h n ALA 88 N -2.10 2.52 -2.94 7.54 0.00 -0.58 -3.61 120.51 121.33 1x0h n ALA 88 Ca 0.00 0.41 -0.33 0.00 0.00 0.00 0.00 53.44 53.52 1x0h n ALA 88 Cb 0.00 -2.49 -0.13 0.00 0.00 0.00 0.00 19.45 16.83 1x0h n ALA 88 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1x0h s LYS 89 N 1.13 3.44 0.06 0.00 1.02 -0.58 -1.26 119.74 123.56 1x0h s LYS 89 Ca 0.76 -0.59 0.06 0.00 0.02 0.00 0.00 55.97 56.23 1x0h s LYS 89 Cb -0.54 -2.76 -0.03 0.00 -0.52 0.00 0.00 37.83 33.98 1x0h s LYS 89 CO 0.33 0.29 -0.17 0.08 -0.92 0.00 0.00 175.35 174.96 1x0h s VAL 90 N 0.19 1.38 -0.20 3.17 1.01 -1.13 -1.80 120.40 123.02 1x0h s VAL 90 Ca -0.04 -1.21 -0.29 0.00 0.00 0.00 0.00 61.98 60.43 1x0h s VAL 90 Cb -0.14 -1.24 0.00 0.00 0.00 0.00 0.00 36.38 34.99 1x0h s VAL 90 CO 0.04 0.01 1.10 0.21 0.00 0.00 0.00 175.10 176.45 1x0h s ASN 91 N -1.40 7.07 0.31 3.32 2.47 -0.40 -1.28 114.94 125.03 1x0h s ASN 91 Ca 0.03 1.48 0.11 0.00 0.42 0.00 0.00 52.86 54.90 1x0h s ASN 91 Cb -0.09 -2.54 0.51 0.00 -1.45 0.00 0.00 41.25 37.68 1x0h s ASN 91 CO 0.02 -0.68 1.70 0.58 -3.72 0.00 0.00 177.10 175.00 1x0h h VAL 92 N 5.43 1.36 -0.04 -5.21 2.07 -0.44 0.88 116.25 120.30 1x0h h VAL 92 Ca -0.22 -1.73 -0.07 0.00 0.82 0.00 0.00 66.70 65.50 1x0h h VAL 92 Cb 1.08 1.92 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 1x0h h VAL 92 CO 0.97 0.50 -0.32 -1.13 0.02 0.00 0.00 177.57 177.61 1x0h h ASN 93 N 0.02 0.07 0.00 0.57 -0.00 -1.92 -2.85 115.58 111.48 1x0h h ASN 93 Ca -0.00 -0.02 -0.30 0.00 -0.00 0.00 0.00 56.30 55.98 1x0h h ASN 93 Cb 0.90 -0.02 -0.06 0.00 -0.00 0.00 0.00 38.32 39.14 1x0h h ASN 93 CO 0.07 0.39 -2.17 0.18 -0.00 0.00 0.00 177.43 175.89 1x0h n LEU 94 N -4.14 0.00 -0.18 0.34 4.77 -1.09 -3.92 117.00 112.78 1x0h n LEU 94 Ca -0.02 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.91 1x0h n LEU 94 Cb 0.38 0.41 0.05 0.00 -2.33 0.00 0.00 43.42 41.92 1x0h n LEU 94 CO 0.39 0.41 1.07 0.25 -1.33 0.00 0.00 177.39 178.17 1x0h h LEU 95 N 0.00 0.51 -0.24 2.23 5.85 0.79 -1.82 115.31 122.63 1x0h h LEU 95 Ca -0.45 0.01 -0.20 0.00 0.84 0.00 0.00 57.88 58.08 1x0h h LEU 95 Cb 2.01 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.93 1x0h h LEU 95 CO 0.02 0.35 -0.91 0.40 -0.34 0.00 0.00 178.44 177.97 1x0h h ILE 96 N 0.63 1.51 -0.37 4.05 2.04 -1.73 -3.22 117.51 120.40 1x0h h ILE 96 Ca 0.22 -2.69 0.02 0.00 1.00 0.00 0.00 64.86 63.42 1x0h h ILE 96 Cb 0.05 2.51 -0.03 0.00 -0.74 0.00 0.00 36.82 38.61 1x0h h ILE 96 CO -0.11 0.78 0.20 0.15 0.00 0.00 0.00 178.15 179.17 1x0h h PHE 97 N 0.10 0.37 0.39 1.37 3.57 -1.57 0.12 116.94 121.29 1x0h h PHE 97 Ca -0.05 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.45 1x0h h PHE 97 Cb 1.55 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 40.17 1x0h h PHE 97 CO 0.03 0.20 -0.22 1.25 -2.23 0.00 0.00 178.31 177.34 1x0h h LEU 98 N 0.41 -0.54 -1.89 0.59 5.85 -1.41 -2.43 115.31 115.89 1x0h h LEU 98 Ca 0.15 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 1x0h h LEU 98 Cb 0.04 0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.22 1x0h h LEU 98 CO -0.10 -0.36 -0.01 -0.07 -0.34 0.00 0.00 178.44 177.56 1x0h h LEU 99 N -0.58 0.05 -2.32 2.25 3.38 -1.54 0.17 115.31 116.72 1x0h h LEU 99 Ca -0.05 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.95 1x0h h LEU 99 Cb 0.46 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1x0h h LEU 99 CO 0.06 0.07 0.12 -1.13 0.09 0.00 0.00 178.44 177.65 1x0h h ASN 100 N 0.05 0.00 0.00 -0.43 -0.73 -0.25 0.17 115.58 114.39 1x0h h ASN 100 Ca 0.01 0.00 -0.05 0.00 1.87 0.00 0.00 56.30 58.14 1x0h h ASN 100 Cb 0.06 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.64 1x0h h ASN 100 CO 0.00 0.00 -1.40 1.17 -0.37 0.00 0.00 177.43 176.83 1x0h n LYS 101 N -3.81 1.15 0.00 6.67 4.81 -0.56 -4.30 118.16 122.12 1x0h n LYS 101 Ca -0.00 -0.05 0.00 0.00 -0.87 0.00 0.00 58.31 57.39 1x0h n LYS 101 Cb 0.23 -1.18 0.00 0.00 0.02 0.00 0.00 35.03 34.09 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 -1.94 0.00 -0.01 1.64 4.76 0.48 -4.64 118.16 118.45 1x0h n LYS 102 Ca -0.05 0.17 -0.17 0.00 -2.87 0.00 0.00 58.31 55.39 1x0h n LYS 102 Cb 0.39 -0.66 -0.10 0.00 -1.84 0.00 0.00 35.03 32.81 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 0.56 -1.72 2.13 -1.00 -1.62 -3.44 116.94 111.85 1x0h h PHE 103 Ca 0.00 -0.28 -0.63 0.00 2.81 0.00 0.00 57.97 59.87 1x0h h PHE 103 Cb 0.00 -0.07 0.00 0.00 3.61 0.00 0.00 35.95 39.49 1x0h h PHE 103 CO 0.00 1.08 1.31 0.98 -1.61 0.00 0.00 178.31 180.07 1x0h n TYR 104 N -4.29 2.00 0.00 -0.55 4.19 0.54 -4.32 117.16 114.73 1x0h n TYR 104 Ca -0.10 0.04 0.00 0.00 3.31 0.00 0.00 57.90 61.16 1x0h n TYR 104 Cb 0.61 -2.64 0.00 0.00 0.49 0.00 0.00 39.34 37.80 1x0h n TYR 104 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1x0h n GLY 105 N 5.46 -0.27 2.57 2.98 0.00 -1.26 -4.49 105.19 110.17 1x0h n GLY 105 Ca 0.30 0.03 -0.05 0.00 0.00 0.00 0.00 46.02 46.31 1x0h n GLY 105 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1x0h n LYS 106 N -2.18 -4.66 0.11 1.61 4.81 -1.26 -5.03 118.16 111.56 1x0h n LYS 106 Ca 0.00 3.48 0.00 0.00 -0.87 0.00 0.00 58.31 60.92 1x0h n LYS 106 Cb 0.00 -4.92 0.00 0.00 0.02 0.00 0.00 35.03 30.13 1x0h n LYS 106 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1x0h n SER 107 N 1.78 -1.69 -2.72 3.14 2.88 -1.26 -5.08 113.62 110.67 1x0h n SER 107 Ca -0.35 0.41 -0.04 0.00 -1.33 0.00 0.00 58.87 57.55 1x0h n SER 107 Cb 0.55 1.79 0.03 0.00 -0.75 0.00 0.00 64.21 65.83 1x0h n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x0h n GLY 108 N -0.86 -1.06 0.33 0.46 0.00 -1.26 -5.17 105.19 97.62 1x0h n GLY 108 Ca 0.00 0.81 -0.03 0.00 0.00 0.00 0.00 46.02 46.80 1x0h n GLY 108 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x0h n PRO 109 N 2.56 -1.20 -4.32 1.61 -0.04 -1.26 -5.10 135.00 127.24 1x0h n PRO 109 Ca 0.13 -0.16 -0.19 0.00 -0.04 0.00 0.00 63.50 63.24 1x0h n PRO 109 Cb 0.61 -0.15 -0.09 0.00 -0.04 0.00 0.00 33.50 33.83 1x0h n PRO 109 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x0h s SER 110 N -1.78 1.50 -0.13 3.54 0.15 -1.26 -5.09 113.70 110.63 1x0h s SER 110 Ca 0.07 -1.59 -0.20 0.00 0.70 0.00 0.00 55.95 54.92 1x0h s SER 110 Cb -0.01 0.43 -0.18 0.00 -1.71 0.00 0.00 66.02 64.56 1x0h s SER 110 CO 0.05 -0.93 0.52 0.28 1.20 0.00 0.00 173.24 174.36 1x0h h SER 111 N 2.21 0.00 0.00 5.45 0.02 -1.99 -3.41 113.55 115.83 1x0h h SER 111 Ca -0.32 -0.68 0.00 0.00 -0.84 0.00 0.00 61.79 59.95 1x0h h SER 111 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 1x0h h SER 111 CO 0.49 0.86 0.00 0.61 -1.14 0.00 0.00 176.83 177.65