#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4f s SER 2 N 0.00 -0.09 0.40 1.61 0.15 -1.26 -5.19 113.70 109.32 1x4f s SER 2 Ca 0.00 0.00 0.08 0.00 0.70 0.00 0.00 55.95 56.73 1x4f s SER 2 Cb 0.00 0.10 -0.07 0.00 -1.71 0.00 0.00 66.02 64.34 1x4f s SER 2 CO 0.00 -0.16 0.02 -0.94 1.20 0.00 0.00 173.24 173.36 1x4f s SER 3 N -2.09 3.95 0.00 5.45 1.04 -1.26 -5.04 113.70 115.75 1x4f s SER 3 Ca 0.10 -1.28 0.00 0.00 0.48 0.00 0.00 55.95 55.25 1x4f s SER 3 Cb -0.01 -0.41 0.00 0.00 0.10 0.00 0.00 66.02 65.70 1x4f s SER 3 CO -0.04 -0.41 0.00 0.61 0.98 0.00 0.00 173.24 174.38 1x4f n GLY 4 N -0.98 -2.09 1.10 7.32 0.00 -1.26 -5.16 105.19 104.12 1x4f n GLY 4 Ca -0.04 0.71 0.00 0.00 0.00 0.00 0.00 46.02 46.69 1x4f n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x4f n SER 5 N 0.00 -6.06 -3.57 1.61 7.64 -1.26 -5.09 113.62 106.89 1x4f n SER 5 Ca 0.00 1.12 -0.07 0.00 1.01 0.00 0.00 58.87 60.93 1x4f n SER 5 Cb 0.00 -3.15 -0.04 0.00 -1.01 0.00 0.00 64.21 60.01 1x4f n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1x4f s SER 6 N -3.97 -0.27 -0.17 6.43 1.04 -1.26 -5.16 113.70 110.35 1x4f s SER 6 Ca 0.00 0.17 -0.01 0.00 0.48 0.00 0.00 55.95 56.59 1x4f s SER 6 Cb 0.00 0.25 -0.00 0.00 0.10 0.00 0.00 66.02 66.37 1x4f s SER 6 CO 0.00 -0.34 -0.13 -0.83 0.98 0.00 0.00 173.24 172.92 1x4f s GLY 7 N -1.67 1.50 0.01 7.32 0.00 -1.26 -5.11 107.32 108.11 1x4f s GLY 7 Ca 0.04 -1.07 0.03 0.00 0.00 0.00 0.00 44.72 43.72 1x4f s GLY 7 CO -0.04 0.10 -0.05 1.25 0.00 0.00 0.00 173.10 174.37 1x4f s LYS 8 N 0.93 2.59 -0.04 2.90 2.47 -1.26 -5.12 119.74 122.21 1x4f s LYS 8 Ca -0.03 -0.71 0.04 0.00 -1.56 0.00 0.00 55.97 53.71 1x4f s LYS 8 Cb -0.15 -2.53 -0.03 0.00 -1.46 0.00 0.00 37.83 33.66 1x4f s LYS 8 CO -0.01 0.60 -0.15 0.15 0.16 0.00 0.00 175.35 176.10 1x4f s LYS 9 N -1.49 2.47 0.00 4.03 1.02 -1.26 -5.00 119.74 119.50 1x4f s LYS 9 Ca 0.18 -0.72 0.15 0.00 0.02 0.00 0.00 55.97 55.60 1x4f s LYS 9 Cb -0.11 -2.36 0.70 0.00 -0.52 0.00 0.00 37.83 35.53 1x4f s LYS 9 CO 0.09 0.62 1.43 -0.35 -0.92 0.00 0.00 175.35 176.21 1x4f n PRO 10 N 2.24 0.13 -3.60 -1.68 -0.04 -1.26 -4.82 135.00 125.96 1x4f n PRO 10 Ca -0.17 0.19 -0.04 0.00 -0.04 0.00 0.00 63.50 63.44 1x4f n PRO 10 Cb 0.52 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.47 1x4f n PRO 10 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1x4f s GLU 11 N -2.73 0.58 0.78 0.54 2.12 -1.26 -5.07 118.70 113.66 1x4f s GLU 11 Ca 0.11 -0.26 0.00 0.00 0.36 0.00 0.00 54.97 55.18 1x4f s GLU 11 Cb 0.10 0.23 0.00 0.00 0.26 0.00 0.00 34.13 34.72 1x4f s GLU 11 CO 0.24 -0.26 0.00 0.41 -0.54 0.00 0.00 175.26 175.11 1x4f n GLY 12 N -0.28 1.29 3.41 -1.50 0.00 -1.26 -4.95 105.19 101.90 1x4f n GLY 12 Ca -0.05 -0.41 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 1x4f n GLY 12 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1x4f n LYS 13 N 0.00 -1.69 -2.05 1.61 5.02 -1.26 -4.73 118.16 115.07 1x4f n LYS 13 Ca 0.00 1.37 -0.32 0.00 -2.02 0.00 0.00 58.31 57.34 1x4f n LYS 13 Cb 0.00 -2.10 -0.04 0.00 -0.02 0.00 0.00 35.03 32.87 1x4f n LYS 13 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1x4f s PRO 14 N -2.19 2.59 -0.21 1.97 0.04 -1.26 -4.67 135.00 131.26 1x4f s PRO 14 Ca 0.31 0.14 0.19 0.00 0.04 0.00 0.00 61.00 61.68 1x4f s PRO 14 Cb -0.03 -4.74 0.43 0.00 0.04 0.00 0.00 34.50 30.19 1x4f s PRO 14 CO 0.72 -3.07 1.22 -0.25 0.04 0.00 0.00 177.00 175.66 1x4f n ASP 15 N 13.38 0.48 -3.76 6.66 8.00 -1.26 -5.04 116.55 135.01 1x4f n ASP 15 Ca 0.31 -2.06 -0.21 0.00 0.71 0.00 0.00 54.79 53.53 1x4f n ASP 15 Cb 0.49 -0.09 -0.17 0.00 -0.02 0.00 0.00 41.12 41.33 1x4f n ASP 15 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1x4f s GLN 16 N -1.82 0.43 -1.12 -1.24 1.11 -1.26 -4.89 119.66 110.87 1x4f s GLN 16 Ca 0.21 0.15 -0.14 0.00 0.01 0.00 0.00 55.36 55.59 1x4f s GLN 16 Cb 0.34 -0.79 -0.03 0.00 -1.01 0.00 0.00 33.01 31.52 1x4f s GLN 16 CO -0.08 -0.27 0.84 1.63 0.01 0.00 0.00 175.29 177.41 1x4f n LYS 17 N 4.96 -1.82 -3.59 2.91 4.76 -1.26 -5.00 118.16 119.11 1x4f n LYS 17 Ca -0.10 0.61 -0.09 0.00 -2.87 0.00 0.00 58.31 55.86 1x4f n LYS 17 Cb 0.50 -4.80 -0.02 0.00 -1.84 0.00 0.00 35.03 28.87 1x4f n LYS 17 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 1x4f s PHE 18 N -3.45 -0.38 0.00 2.13 5.36 -1.26 -4.97 117.98 115.41 1x4f s PHE 18 Ca 0.44 0.09 0.00 0.00 -0.96 0.00 0.00 56.93 56.50 1x4f s PHE 18 Cb -0.12 0.61 0.00 0.00 -0.34 0.00 0.00 43.02 43.17 1x4f s PHE 18 CO 0.81 -0.95 0.00 -3.47 -1.46 0.00 0.00 175.22 170.16 1x4f n ASP 19 N -0.40 0.00 -0.41 6.13 2.03 -1.26 -4.85 116.55 117.79 1x4f n ASP 19 Ca -0.11 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.20 1x4f n ASP 19 Cb 0.62 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 41.02 1x4f n ASP 19 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 1x4f n GLN 20 N 0.00 -1.06 -0.06 -0.67 7.27 -1.26 -4.78 117.38 116.81 1x4f n GLN 20 Ca 0.00 0.83 -0.09 0.00 0.07 0.00 0.00 57.00 57.81 1x4f n GLN 20 Cb 0.00 -1.05 -0.03 0.00 2.41 0.00 0.00 30.24 31.57 1x4f n GLN 20 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1x4f n LYS 21 N -1.88 0.41 -0.29 3.69 4.76 -1.26 -4.66 118.16 118.93 1x4f n LYS 21 Ca -0.00 0.17 -0.03 0.00 -2.87 0.00 0.00 58.31 55.58 1x4f n LYS 21 Cb 0.13 -1.22 0.00 0.00 -1.84 0.00 0.00 35.03 32.10 1x4f n LYS 21 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1x4f n GLN 22 N -4.20 -0.21 -4.48 1.97 1.13 -1.26 -4.35 117.38 105.98 1x4f n GLN 22 Ca -0.15 1.12 -0.29 0.00 -1.94 0.00 0.00 57.00 55.73 1x4f n GLN 22 Cb 0.46 -1.65 -0.13 0.00 0.11 0.00 0.00 30.24 29.03 1x4f n GLN 22 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1x4f s GLU 23 N -5.60 1.44 0.09 -1.09 2.56 -1.26 -5.04 118.70 109.80 1x4f s GLU 23 Ca -0.10 -1.28 0.00 0.00 0.00 0.00 0.00 54.97 53.59 1x4f s GLU 23 Cb 0.13 -1.86 0.00 0.00 2.00 0.00 0.00 34.13 34.40 1x4f s GLU 23 CO 0.50 0.45 0.00 1.28 -0.56 0.00 0.00 175.26 176.93 1x4f n LEU 24 N 1.10 0.26 -0.04 2.70 4.77 -1.26 -4.65 117.00 119.87 1x4f n LEU 24 Ca -0.18 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1x4f n LEU 24 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 1x4f n LEU 24 CO 0.23 -0.49 0.00 0.61 -1.33 0.00 0.00 177.39 176.40 1x4f n GLY 25 N 2.46 0.83 3.21 -0.72 0.00 -1.26 -4.80 105.19 104.92 1x4f n GLY 25 Ca 0.00 -1.10 -0.39 0.00 0.00 0.00 0.00 46.02 44.53 1x4f n GLY 25 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x4f s ARG 26 N -2.28 2.42 -0.11 1.61 3.00 -1.21 -4.81 118.95 117.57 1x4f s ARG 26 Ca 0.00 -1.58 -0.02 0.00 0.00 0.00 0.00 55.73 54.13 1x4f s ARG 26 Cb 0.00 -3.71 0.04 0.00 0.00 0.00 0.00 34.95 31.28 1x4f s ARG 26 CO 0.00 -0.99 0.02 0.08 0.00 0.00 0.00 175.30 174.40 1x4f s VAL 27 N 1.33 0.38 -0.57 3.52 1.01 -1.26 -3.82 120.40 120.99 1x4f s VAL 27 Ca 0.04 -0.07 -0.25 0.00 0.00 0.00 0.00 61.98 61.70 1x4f s VAL 27 Cb -0.23 -0.66 0.04 0.00 0.00 0.00 0.00 36.38 35.53 1x4f s VAL 27 CO -0.00 0.10 1.03 -0.63 0.00 0.00 0.00 175.10 175.60 1x4f s ILE 28 N 1.96 4.26 -0.08 2.22 -1.09 0.83 -0.44 121.20 128.84 1x4f s ILE 28 Ca 0.03 0.44 -0.26 0.00 -2.23 0.00 0.00 60.65 58.63 1x4f s ILE 28 Cb -0.14 -4.61 -0.03 0.00 -1.58 0.00 0.00 42.46 36.10 1x4f s ILE 28 CO -0.06 -1.22 0.85 -2.28 -1.23 0.00 0.00 174.94 171.00 1x4f s HIS 29 N 4.31 3.55 -0.35 3.97 5.65 0.13 -0.59 115.29 131.96 1x4f s HIS 29 Ca 0.34 1.41 0.02 0.00 0.25 0.00 0.00 55.06 57.09 1x4f s HIS 29 Cb -0.11 -2.99 0.10 0.00 -1.18 0.00 0.00 32.58 28.40 1x4f s HIS 29 CO 0.21 -0.06 0.07 -0.51 -0.65 0.00 0.00 174.74 173.79 1x4f s LEU 30 N 1.37 4.75 0.13 8.88 1.43 0.52 -1.13 118.68 134.63 1x4f s LEU 30 Ca 0.43 -2.06 0.03 0.00 -1.03 0.00 0.00 54.13 51.49 1x4f s LEU 30 Cb -0.18 -1.66 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 1x4f s LEU 30 CO 0.19 -0.40 0.22 -0.44 0.23 0.00 0.00 176.35 176.16 1x4f s SER 31 N 1.10 6.09 -0.68 2.29 0.01 -0.25 -2.05 113.70 120.20 1x4f s SER 31 Ca 0.09 0.10 -0.00 0.00 1.31 0.00 0.00 55.95 57.45 1x4f s SER 31 Cb -0.20 -1.78 0.00 0.00 0.21 0.00 0.00 66.02 64.26 1x4f s SER 31 CO -0.07 0.09 0.57 -3.20 0.41 0.00 0.00 173.24 171.04 1x4f n ASN 32 N -0.26 -2.21 -4.87 2.44 5.15 -1.24 -0.98 115.26 113.28 1x4f n ASN 32 Ca -0.07 -0.34 -0.31 0.00 -0.60 0.00 0.00 54.58 53.26 1x4f n ASN 32 Cb 0.53 -3.10 -0.04 0.00 -0.53 0.00 0.00 39.78 36.65 1x4f n ASN 32 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1x4f s LEU 33 N -4.46 3.83 0.00 1.20 1.43 -1.05 -4.22 118.68 115.42 1x4f s LEU 33 Ca 0.02 1.22 0.00 0.00 -1.03 0.00 0.00 54.13 54.34 1x4f s LEU 33 Cb -0.01 -4.10 0.00 0.00 0.03 0.00 0.00 46.19 42.11 1x4f s LEU 33 CO 0.41 -0.40 0.00 -0.81 0.23 0.00 0.00 176.35 175.78 1x4f n PRO 34 N -1.22 -0.24 -2.69 1.29 -0.04 -1.26 -4.90 135.00 125.93 1x4f n PRO 34 Ca 0.03 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.43 1x4f n PRO 34 Cb 0.54 0.00 0.08 0.00 -0.04 0.00 0.00 33.50 34.08 1x4f n PRO 34 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1x4f n HIS 35 N -1.74 -1.89 -1.27 0.54 -0.00 -1.26 -4.99 115.22 104.62 1x4f n HIS 35 Ca 0.00 -1.57 -0.26 0.00 0.46 0.00 0.00 57.72 56.35 1x4f n HIS 35 Cb 0.00 1.47 0.16 0.00 -0.12 0.00 0.00 29.99 31.50 1x4f n HIS 35 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 1x4f n SER 36 N -0.18 4.62 -3.01 0.26 7.64 -1.26 -4.88 113.62 116.82 1x4f n SER 36 Ca -0.06 -3.66 -0.19 0.00 1.01 0.00 0.00 58.87 55.98 1x4f n SER 36 Cb 0.76 -0.86 0.07 0.00 -1.01 0.00 0.00 64.21 63.16 1x4f n SER 36 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x4f n GLY 37 N -1.09 -0.26 3.95 0.23 0.00 -1.26 -5.01 105.19 101.74 1x4f n GLY 37 Ca 0.60 0.07 -0.24 0.00 0.00 0.00 0.00 46.02 46.45 1x4f n GLY 37 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1x4f s TYR 38 N -3.27 2.91 -0.04 1.61 1.13 -1.26 -5.09 117.35 113.34 1x4f s TYR 38 Ca 0.40 0.24 -0.05 0.00 -1.41 0.00 0.00 57.07 56.25 1x4f s TYR 38 Cb -0.18 -2.95 -0.04 0.00 -1.10 0.00 0.00 41.96 37.69 1x4f s TYR 38 CO 0.59 -1.11 0.19 -1.12 -2.51 0.00 0.00 175.55 171.59 1x4f s SER 39 N -4.46 6.41 0.36 -0.18 0.01 -1.26 -4.97 113.70 109.62 1x4f s SER 39 Ca 0.58 0.45 0.24 0.00 1.31 0.00 0.00 55.95 58.53 1x4f s SER 39 Cb -0.11 -2.05 1.27 0.00 0.21 0.00 0.00 66.02 65.34 1x4f s SER 39 CO 0.42 0.31 1.39 -0.90 0.41 0.00 0.00 173.24 174.87 1x4f n ASP 40 N 1.37 0.24 -0.14 2.44 5.75 -1.26 0.43 116.55 125.39 1x4f n ASP 40 Ca -0.14 1.34 -0.06 0.00 -0.01 0.00 0.00 54.79 55.92 1x4f n ASP 40 Cb 0.53 -0.66 0.00 0.00 -1.03 0.00 0.00 41.12 39.97 1x4f n ASP 40 CO 0.00 0.00 0.00 -1.28 -0.11 0.00 0.00 177.20 175.81 1x4f h SER 41 N 0.00 -0.95 -1.10 -1.12 0.87 -1.98 0.16 113.55 109.43 1x4f h SER 41 Ca 0.77 0.19 0.32 0.00 -1.23 0.00 0.00 61.79 61.84 1x4f h SER 41 Cb 2.28 0.47 -0.12 0.00 -0.44 0.00 0.00 62.40 64.59 1x4f h SER 41 CO -0.54 -0.29 0.68 0.00 -0.53 0.00 0.00 176.83 176.15 1x4f h ALA 42 N 0.95 2.25 0.00 6.23 0.00 -0.42 1.21 119.26 129.49 1x4f h ALA 42 Ca 0.20 0.12 -0.10 0.00 0.00 0.00 0.00 54.91 55.12 1x4f h ALA 42 Cb 0.51 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1x4f h ALA 42 CO -0.55 -0.78 -0.48 0.28 0.00 0.00 0.00 179.25 177.72 1x4f h VAL 43 N 0.31 1.19 0.00 0.00 2.07 -0.78 -2.76 116.25 116.29 1x4f h VAL 43 Ca 0.70 -1.72 0.00 0.00 0.82 0.00 0.00 66.70 66.50 1x4f h VAL 43 Cb 1.81 1.96 0.00 0.00 -1.52 0.00 0.00 31.29 33.54 1x4f h VAL 43 CO -0.43 0.47 -0.50 0.18 0.02 0.00 0.00 177.57 177.31 1x4f n LEU 44 N -3.76 0.50 -0.12 2.57 4.77 0.39 -3.94 117.00 117.40 1x4f n LEU 44 Ca -0.01 0.09 -0.01 0.00 -0.03 0.00 0.00 56.01 56.05 1x4f n LEU 44 Cb 0.53 -0.25 0.25 0.00 -2.33 0.00 0.00 43.42 41.62 1x4f n LEU 44 CO 0.39 0.08 1.07 0.11 -1.33 0.00 0.00 177.39 177.71 1x4f h LYS 45 N 0.00 0.80 0.00 3.23 1.57 -0.35 0.84 116.57 122.66 1x4f h LYS 45 Ca 0.00 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1x4f h LYS 45 Cb 0.55 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1x4f h LYS 45 CO 0.00 0.65 0.00 1.47 -0.57 0.00 0.00 179.45 181.00 1x4f n LEU 46 N -4.34 0.65 -0.13 2.94 -0.00 -1.25 -2.63 117.00 112.23 1x4f n LEU 46 Ca 0.05 0.63 0.02 0.00 -0.00 0.00 0.00 56.01 56.71 1x4f n LEU 46 Cb 0.15 -0.51 0.01 0.00 -0.00 0.00 0.00 43.42 43.07 1x4f n LEU 46 CO 0.38 -0.44 0.24 0.00 -0.00 0.00 0.00 177.39 177.57 1x4f n ALA 47 N -1.75 2.50 0.42 1.47 0.00 -0.38 -4.68 120.51 118.08 1x4f n ALA 47 Ca 0.03 -0.43 -0.16 0.00 0.00 0.00 0.00 53.44 52.88 1x4f n ALA 47 Cb 0.28 -0.15 -0.08 0.00 0.00 0.00 0.00 19.45 19.50 1x4f n ALA 47 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1x4f h GLU 48 N 0.65 -1.03 0.00 0.00 5.08 0.89 -2.49 114.58 117.67 1x4f h GLU 48 Ca 0.00 0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1x4f h GLU 48 Cb 0.16 0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1x4f h GLU 48 CO 0.00 -0.69 0.00 -0.35 -1.00 0.00 0.00 179.01 176.97 1x4f n PRO 49 N -5.20 0.49 -0.07 2.33 -0.04 -1.26 -2.49 135.00 128.75 1x4f n PRO 49 Ca -0.13 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.17 1x4f n PRO 49 Cb 0.42 -1.37 -0.14 0.00 -0.04 0.00 0.00 33.50 32.38 1x4f n PRO 49 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1x4f n TYR 50 N -0.87 0.45 0.00 0.54 4.02 -1.05 -5.07 117.16 115.18 1x4f n TYR 50 Ca 0.09 0.12 0.00 0.00 -0.01 0.00 0.00 57.90 58.09 1x4f n TYR 50 Cb 0.04 -1.07 0.00 0.00 -0.02 0.00 0.00 39.34 38.29 1x4f n TYR 50 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1x4f n GLY 51 N 1.96 0.49 3.64 2.72 0.00 -0.96 -4.45 105.19 108.59 1x4f n GLY 51 Ca -0.35 -0.85 -0.43 0.00 0.00 0.00 0.00 46.02 44.39 1x4f n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x4f s LYS 52 N -2.00 3.94 -0.82 1.61 -0.14 -1.26 -4.51 119.74 116.55 1x4f s LYS 52 Ca 0.00 1.89 -0.25 0.00 -1.36 0.00 0.00 55.97 56.25 1x4f s LYS 52 Cb 0.00 -4.02 -0.03 0.00 -1.68 0.00 0.00 37.83 32.10 1x4f s LYS 52 CO 0.00 -1.13 1.86 0.42 -0.76 0.00 0.00 175.35 175.75 1x4f s ILE 53 N 4.81 3.46 0.23 2.17 1.01 -1.26 -0.82 121.20 130.80 1x4f s ILE 53 Ca 0.73 -0.21 0.05 0.00 0.00 0.00 0.00 60.65 61.22 1x4f s ILE 53 Cb -0.28 -4.09 -0.06 0.00 0.01 0.00 0.00 42.46 38.04 1x4f s ILE 53 CO 0.29 -1.04 1.54 0.11 0.00 0.00 0.00 174.94 175.84 1x4f h LYS 54 N 12.19 0.19 -1.90 2.79 6.56 -1.81 -3.46 116.57 131.13 1x4f h LYS 54 Ca -0.01 -0.14 -0.02 0.00 -1.06 0.00 0.00 60.65 59.41 1x4f h LYS 54 Cb 1.05 0.03 -0.21 0.00 -0.57 0.00 0.00 32.23 32.53 1x4f h LYS 54 CO 1.23 0.77 0.26 1.21 -2.06 0.00 0.00 179.45 180.86 1x4f s ASN 55 N -6.89 -0.61 0.09 0.86 2.47 -1.22 -5.04 114.94 104.60 1x4f s ASN 55 Ca -0.03 0.80 -0.08 0.00 0.42 0.00 0.00 52.86 53.97 1x4f s ASN 55 Cb 0.12 0.69 -0.01 0.00 -1.45 0.00 0.00 41.25 40.60 1x4f s ASN 55 CO 0.80 -0.47 0.18 -0.72 -3.72 0.00 0.00 177.10 173.17 1x4f s TYR 56 N -0.80 0.21 -0.02 0.43 1.13 -1.26 0.25 117.35 117.28 1x4f s TYR 56 Ca -0.06 -0.64 -0.00 0.00 -1.41 0.00 0.00 57.07 54.95 1x4f s TYR 56 Cb -0.01 -0.09 0.03 0.00 -1.10 0.00 0.00 41.96 40.79 1x4f s TYR 56 CO 0.06 -0.55 0.03 0.42 -2.51 0.00 0.00 175.55 173.01 1x4f s ILE 57 N -3.88 -0.06 -0.41 -3.49 -1.09 0.14 -4.95 121.20 107.47 1x4f s ILE 57 Ca 0.06 0.25 -0.00 0.00 -2.23 0.00 0.00 60.65 58.73 1x4f s ILE 57 Cb 0.05 -0.10 0.11 0.00 -1.58 0.00 0.00 42.46 40.94 1x4f s ILE 57 CO -0.10 0.11 0.17 -0.22 -1.23 0.00 0.00 174.94 173.67 1x4f s LEU 58 N 1.25 5.03 -0.25 2.97 1.98 -1.26 -1.03 118.68 127.37 1x4f s LEU 58 Ca -0.07 -2.19 -0.13 0.00 -2.89 0.00 0.00 54.13 48.85 1x4f s LEU 58 Cb -0.13 -1.75 -0.04 0.00 0.66 0.00 0.00 46.19 44.93 1x4f s LEU 58 CO -0.03 -0.46 0.27 -0.04 -1.89 0.00 0.00 176.35 174.20 1x4f s MET 59 N 0.89 4.05 0.21 1.98 -1.94 0.24 -4.95 119.30 119.78 1x4f s MET 59 Ca 0.10 -0.10 0.24 0.00 -1.71 0.00 0.00 55.69 54.22 1x4f s MET 59 Cb -0.21 -3.59 0.42 0.00 2.01 0.00 0.00 34.83 33.45 1x4f s MET 59 CO -0.05 -0.09 1.45 0.00 -0.01 0.00 0.00 175.02 176.31 1x4f h ARG 60 N 7.83 0.00 0.00 2.03 -0.00 -1.96 -1.98 114.38 120.29 1x4f h ARG 60 Ca -0.35 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.13 1x4f h ARG 60 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.14 1x4f h ARG 60 CO 0.64 0.00 0.00 -1.33 0.00 0.00 0.00 179.97 179.28 1x4f n MET 61 N -2.39 0.00 -1.26 0.04 2.81 -1.26 -3.18 117.12 111.87 1x4f n MET 61 Ca 0.04 0.29 -0.25 0.00 -1.81 0.00 0.00 57.70 55.96 1x4f n MET 61 Cb 0.47 -0.89 0.14 0.00 -0.71 0.00 0.00 33.22 32.23 1x4f n MET 61 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1x4f n LYS 62 N -0.68 2.43 -3.94 0.03 5.02 -1.26 -4.91 118.16 114.85 1x4f n LYS 62 Ca 0.00 -3.21 -0.26 0.00 -2.02 0.00 0.00 58.31 52.82 1x4f n LYS 62 Cb 0.00 -2.18 -0.02 0.00 -0.02 0.00 0.00 35.03 32.82 1x4f n LYS 62 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1x4f n SER 63 N -1.04 -0.64 -4.47 4.39 7.64 -1.19 -4.64 113.62 113.66 1x4f n SER 63 Ca 0.56 -1.02 -0.25 0.00 1.01 0.00 0.00 58.87 59.18 1x4f n SER 63 Cb 1.19 -3.04 -0.10 0.00 -1.01 0.00 0.00 64.21 61.25 1x4f n SER 63 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1x4f s GLN 64 N -6.54 1.69 0.09 1.43 -0.21 -0.75 -2.52 119.66 112.85 1x4f s GLN 64 Ca 0.04 -1.61 -0.14 0.00 0.02 0.00 0.00 55.36 53.67 1x4f s GLN 64 Cb -0.01 -1.86 0.02 0.00 1.00 0.00 0.00 33.01 32.16 1x4f s GLN 64 CO 0.89 0.37 0.32 0.00 -2.12 0.00 0.00 175.29 174.75 1x4f s ALA 65 N -2.10 -0.69 -0.11 6.09 0.00 -0.87 -0.59 121.76 123.48 1x4f s ALA 65 Ca 0.26 -0.14 -0.03 0.00 0.00 0.00 0.00 51.96 52.05 1x4f s ALA 65 Cb -0.07 0.51 0.04 0.00 0.00 0.00 0.00 23.12 23.60 1x4f s ALA 65 CO 0.13 -0.53 0.04 -0.06 0.00 0.00 0.00 175.76 175.34 1x4f s PHE 66 N -3.35 0.54 -0.32 0.00 0.40 -0.20 -0.36 117.98 114.70 1x4f s PHE 66 Ca 0.01 -0.28 -0.05 0.00 -0.60 0.00 0.00 56.93 56.01 1x4f s PHE 66 Cb 0.02 -0.77 0.04 0.00 0.51 0.00 0.00 43.02 42.81 1x4f s PHE 66 CO -0.08 -0.40 0.06 0.42 0.70 0.00 0.00 175.22 175.91 1x4f s ILE 67 N 2.02 3.53 -0.62 0.64 1.01 0.24 0.25 121.20 128.27 1x4f s ILE 67 Ca 0.03 -1.12 -0.25 0.00 0.00 0.00 0.00 60.65 59.30 1x4f s ILE 67 Cb -0.14 -2.96 0.04 0.00 0.01 0.00 0.00 42.46 39.41 1x4f s ILE 67 CO -0.06 -0.09 1.08 -0.70 0.00 0.00 0.00 174.94 175.17 1x4f s GLU 68 N 1.37 3.31 0.69 2.79 2.12 0.14 -0.12 118.70 129.00 1x4f s GLU 68 Ca -0.02 -0.22 -0.15 0.00 0.36 0.00 0.00 54.97 54.93 1x4f s GLU 68 Cb -0.19 -4.10 0.02 0.00 0.26 0.00 0.00 34.13 30.12 1x4f s GLU 68 CO 0.01 -1.73 1.18 -1.64 -0.54 0.00 0.00 175.26 172.54 1x4f s MET 69 N 4.60 2.42 0.38 4.30 -1.94 -1.25 -2.80 119.30 125.01 1x4f s MET 69 Ca 0.33 1.66 0.09 0.00 -1.71 0.00 0.00 55.69 56.05 1x4f s MET 69 Cb -0.11 -1.88 0.84 0.00 2.01 0.00 0.00 34.83 35.69 1x4f s MET 69 CO 0.18 -1.60 1.96 1.49 -0.01 0.00 0.00 175.02 177.05 1x4f h GLU 70 N -0.07 0.62 -4.55 2.03 4.81 -1.26 -3.44 114.58 112.71 1x4f h GLU 70 Ca -0.48 -0.04 -0.23 0.00 -0.13 0.00 0.00 59.36 58.48 1x4f h GLU 70 Cb 1.28 -0.14 -0.15 0.00 0.63 0.00 0.00 28.75 30.37 1x4f h GLU 70 CO 0.51 0.41 -0.60 0.95 -0.73 0.00 0.00 179.01 179.56 1x4f s THR 71 N -5.58 0.00 0.08 0.32 -4.23 -1.26 -5.01 115.64 99.96 1x4f s THR 71 Ca -0.09 -1.98 -0.16 0.00 -1.18 0.00 0.00 61.69 58.28 1x4f s THR 71 Cb 0.20 -2.49 -0.11 0.00 1.34 0.00 0.00 72.50 71.44 1x4f s THR 71 CO 0.76 0.00 1.39 -0.09 -0.54 0.00 0.00 174.62 176.14 1x4f h ARG 72 N 2.60 0.62 -0.76 3.99 2.43 -1.98 -3.05 114.38 118.24 1x4f h ARG 72 Ca -0.36 -0.34 0.17 0.00 -0.81 0.00 0.00 59.98 58.65 1x4f h ARG 72 Cb 1.25 0.02 -0.12 0.00 -0.42 0.00 0.00 29.97 30.70 1x4f h ARG 72 CO 0.52 0.94 0.12 0.93 -1.51 0.00 0.00 179.97 180.98 1x4f h GLU 73 N 0.33 0.19 0.74 0.20 3.07 -1.97 0.19 114.58 117.32 1x4f h GLU 73 Ca 0.03 -0.01 -0.04 0.00 -0.50 0.00 0.00 59.36 58.85 1x4f h GLU 73 Cb 0.85 -0.04 0.01 0.00 -0.84 0.00 0.00 28.75 28.72 1x4f h GLU 73 CO 0.07 0.13 -0.36 -0.44 -1.40 0.00 0.00 179.01 177.01 1x4f h ASP 74 N 0.20 -0.84 -0.33 1.42 3.32 -1.77 -2.04 116.42 116.38 1x4f h ASP 74 Ca 0.43 0.03 0.06 0.00 0.02 0.00 0.00 57.03 57.57 1x4f h ASP 74 Cb 0.77 0.22 -0.08 0.00 0.22 0.00 0.00 39.33 40.45 1x4f h ASP 74 CO -0.58 -0.55 -0.41 0.00 -1.72 0.00 0.00 179.24 175.98 1x4f h ALA 75 N -1.44 -0.44 -0.93 3.45 0.00 -1.31 0.20 119.26 118.79 1x4f h ALA 75 Ca -0.10 0.05 0.24 0.00 0.00 0.00 0.00 54.91 55.09 1x4f h ALA 75 Cb 0.76 0.84 -0.06 0.00 0.00 0.00 0.00 17.79 19.33 1x4f h ALA 75 CO 0.17 -0.86 0.63 0.52 0.00 0.00 0.00 179.25 179.71 1x4f h MET 76 N -0.36 0.26 -0.37 0.00 2.86 -0.68 0.31 114.93 116.96 1x4f h MET 76 Ca 0.13 -0.02 -0.07 0.00 -2.06 0.00 0.00 59.70 57.68 1x4f h MET 76 Cb 0.59 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.17 1x4f h MET 76 CO -0.52 0.17 -0.05 0.00 1.06 0.00 0.00 176.91 177.57 1x4f h ALA 77 N 1.59 1.23 0.17 6.32 0.00 0.16 -2.21 119.26 126.51 1x4f h ALA 77 Ca 0.48 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1x4f h ALA 77 Cb 1.42 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1x4f h ALA 77 CO -0.14 0.51 -0.08 1.98 0.00 0.00 0.00 179.25 181.52 1x4f h MET 78 N 0.56 -0.21 -1.00 0.00 4.05 0.11 -0.53 114.93 117.90 1x4f h MET 78 Ca 0.11 0.01 0.31 0.00 -0.28 0.00 0.00 59.70 59.86 1x4f h MET 78 Cb 0.44 0.05 -0.15 0.00 -0.80 0.00 0.00 31.60 31.14 1x4f h MET 78 CO 0.02 -0.14 0.57 -0.39 0.23 0.00 0.00 176.91 177.20 1x4f h VAL 79 N -0.33 0.32 -0.01 -5.77 -1.51 -1.56 0.12 116.25 107.51 1x4f h VAL 79 Ca -0.02 -0.12 -0.00 0.00 -1.23 0.00 0.00 66.70 65.32 1x4f h VAL 79 Cb 0.17 -0.06 -0.00 0.00 -2.13 0.00 0.00 31.29 29.27 1x4f h VAL 79 CO 0.04 0.06 -0.00 -0.78 -1.23 0.00 0.00 177.57 175.66 1x4f h ASP 80 N 0.35 0.02 -1.06 4.19 3.58 -1.43 -2.96 116.42 119.11 1x4f h ASP 80 Ca 0.73 -0.39 0.29 0.00 0.42 0.00 0.00 57.03 58.07 1x4f h ASP 80 Cb 1.63 -0.01 -0.07 0.00 1.72 0.00 0.00 39.33 42.61 1x4f h ASP 80 CO -0.59 0.40 0.72 -0.74 -2.88 0.00 0.00 179.24 176.15 1x4f h HIS 81 N -0.36 0.33 -0.04 0.28 2.76 0.92 0.70 115.15 119.73 1x4f h HIS 81 Ca 0.00 0.01 -0.14 0.00 -2.20 0.00 0.00 60.37 58.05 1x4f h HIS 81 Cb 0.40 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.25 1x4f h HIS 81 CO 0.06 0.03 -0.60 0.00 -1.30 0.00 0.00 177.93 176.12 1x4f h LEU 83 N 0.09 -0.05 -0.12 0.00 3.38 0.49 -3.32 115.31 115.78 1x4f h LEU 83 Ca -0.01 -0.44 -0.08 0.00 0.09 0.00 0.00 57.88 57.44 1x4f h LEU 83 Cb 1.09 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1x4f h LEU 83 CO 0.09 0.43 -0.22 0.11 0.09 0.00 0.00 178.44 178.94 1x4f h LYS 84 N -0.55 0.36 -5.91 1.13 6.56 -1.42 -3.45 116.57 113.29 1x4f h LYS 84 Ca -0.01 -0.23 -0.57 0.00 -1.06 0.00 0.00 60.65 58.79 1x4f h LYS 84 Cb 0.49 0.03 -0.28 0.00 -0.57 0.00 0.00 32.23 31.90 1x4f h LYS 84 CO 0.01 0.82 -0.84 0.21 -2.06 0.00 0.00 179.45 177.59 1x4f s LYS 85 N -4.03 1.45 -0.09 3.15 2.47 0.27 -5.11 119.74 117.85 1x4f s LYS 85 Ca -0.14 -0.79 -0.30 0.00 -1.56 0.00 0.00 55.97 53.19 1x4f s LYS 85 Cb 0.05 -1.47 -0.04 0.00 -1.46 0.00 0.00 37.83 34.91 1x4f s LYS 85 CO 0.76 0.39 1.41 0.00 0.16 0.00 0.00 175.35 178.07 1x4f s ALA 86 N -0.60 3.62 -0.10 3.13 0.00 -1.26 -3.42 121.76 123.13 1x4f s ALA 86 Ca 0.07 0.69 -0.24 0.00 0.00 0.00 0.00 51.96 52.49 1x4f s ALA 86 Cb -0.08 -3.65 -0.03 0.00 0.00 0.00 0.00 23.12 19.36 1x4f s ALA 86 CO 0.00 -1.17 0.74 -1.17 0.00 0.00 0.00 175.76 174.16 1x4f s LEU 87 N 3.39 4.27 -0.26 0.00 0.20 -1.26 -5.03 118.68 119.98 1x4f s LEU 87 Ca 0.62 1.18 0.02 0.00 0.69 0.00 0.00 54.13 56.64 1x4f s LEU 87 Cb -0.27 -3.13 0.06 0.00 -0.43 0.00 0.00 46.19 42.42 1x4f s LEU 87 CO 0.22 -0.21 -0.08 0.26 -0.29 0.00 0.00 176.35 176.25 1x4f s TRP 88 N 1.26 3.08 -0.34 5.38 0.52 -1.26 -3.49 118.94 124.08 1x4f s TRP 88 Ca 0.38 -2.24 -0.11 0.00 0.02 0.00 0.00 56.10 54.14 1x4f s TRP 88 Cb -0.17 -1.94 0.00 0.00 -1.15 0.00 0.00 33.47 30.21 1x4f s TRP 88 CO 0.16 -0.86 0.20 0.12 0.02 0.00 0.00 176.95 176.60 1x4f s PHE 89 N 1.16 3.21 -1.21 -1.98 5.36 0.47 -4.43 117.98 120.57 1x4f s PHE 89 Ca -0.06 -0.56 -0.08 0.00 -0.96 0.00 0.00 56.93 55.27 1x4f s PHE 89 Cb -0.20 -2.43 0.01 0.00 -0.34 0.00 0.00 43.02 40.06 1x4f s PHE 89 CO -0.06 -0.49 1.06 1.04 -1.46 0.00 0.00 175.22 175.31 1x4f n GLN 90 N 5.04 -7.10 -2.23 10.12 6.02 -1.26 -2.13 117.38 125.84 1x4f n GLN 90 Ca -0.13 0.74 -0.13 0.00 -0.01 0.00 0.00 57.00 57.47 1x4f n GLN 90 Cb 0.48 -5.53 -0.01 0.00 1.02 0.00 0.00 30.24 26.21 1x4f n GLN 90 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1x4f n GLY 91 N -1.83 -0.14 3.04 1.08 0.00 -1.26 -5.01 105.19 101.07 1x4f n GLY 91 Ca -0.00 -0.34 -0.14 0.00 0.00 0.00 0.00 46.02 45.54 1x4f n GLY 91 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x4f s ARG 92 N -4.62 0.51 -0.97 1.61 0.52 -0.91 -5.09 118.95 110.00 1x4f s ARG 92 Ca 0.00 -0.60 -0.19 0.00 -0.52 0.00 0.00 55.73 54.42 1x4f s ARG 92 Cb 0.00 -0.34 0.11 0.00 0.52 0.00 0.00 34.95 35.24 1x4f s ARG 92 CO 0.00 0.07 1.22 0.00 0.02 0.00 0.00 175.30 176.61 1x4f s VAL 94 N 3.14 4.85 -0.23 0.00 0.11 -1.23 -4.90 120.40 122.14 1x4f s VAL 94 Ca 0.36 1.03 -0.15 0.00 -2.93 0.00 0.00 61.98 60.29 1x4f s VAL 94 Cb -0.03 -3.81 -0.04 0.00 -1.53 0.00 0.00 36.38 30.96 1x4f s VAL 94 CO -0.09 0.50 0.38 -0.75 -3.33 0.00 0.00 175.10 171.81 1x4f s LYS 95 N -1.27 4.11 -0.24 1.54 2.36 -0.16 -4.72 119.74 121.36 1x4f s LYS 95 Ca 0.29 0.13 -0.04 0.00 -2.55 0.00 0.00 55.97 53.80 1x4f s LYS 95 Cb -0.18 -3.58 0.00 0.00 -1.05 0.00 0.00 37.83 33.02 1x4f s LYS 95 CO 0.17 -0.13 -0.03 0.54 1.55 0.00 0.00 175.35 177.46 1x4f s VAL 96 N 1.60 3.32 -0.00 4.02 0.11 -1.26 -1.09 120.40 127.10 1x4f s VAL 96 Ca 0.17 -0.67 -0.01 0.00 -2.93 0.00 0.00 61.98 58.54 1x4f s VAL 96 Cb -0.15 -2.58 -0.00 0.00 -1.53 0.00 0.00 36.38 32.11 1x4f s VAL 96 CO 0.08 0.31 0.02 1.51 -3.33 0.00 0.00 175.10 173.70 1x4f s ASP 97 N 1.44 0.06 -0.10 3.54 -4.77 -0.28 -4.39 116.67 112.17 1x4f s ASP 97 Ca 0.04 -0.13 -0.30 0.00 -3.30 0.00 0.00 52.55 48.86 1x4f s ASP 97 Cb -0.15 0.09 -0.02 0.00 -1.09 0.00 0.00 42.92 41.74 1x4f s ASP 97 CO -0.03 -0.13 1.17 -0.22 0.70 0.00 0.00 175.17 176.66 1x4f s LEU 98 N -0.55 4.24 -0.17 2.11 2.96 -1.26 0.21 118.68 126.22 1x4f s LEU 98 Ca -0.06 1.71 -0.21 0.00 -0.22 0.00 0.00 54.13 55.35 1x4f s LEU 98 Cb -0.04 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 43.07 1x4f s LEU 98 CO -0.00 -0.60 0.64 -0.55 -1.32 0.00 0.00 176.35 174.51 1x4f s SER 99 N 1.50 6.74 -0.07 3.68 0.15 0.41 -4.91 113.70 121.21 1x4f s SER 99 Ca 0.54 0.90 -0.11 0.00 0.70 0.00 0.00 55.95 57.98 1x4f s SER 99 Cb -0.22 -2.36 -0.30 0.00 -1.71 0.00 0.00 66.02 61.43 1x4f s SER 99 CO 0.19 -0.24 0.61 -0.08 1.20 0.00 0.00 173.24 174.92 1x4f h GLU 100 N 7.30 0.36 -0.01 5.44 4.81 -1.88 -3.37 114.58 127.23 1x4f h GLU 100 Ca -0.33 -0.61 0.00 0.00 -0.13 0.00 0.00 59.36 58.28 1x4f h GLU 100 Cb 1.15 0.23 -0.00 0.00 0.63 0.00 0.00 28.75 30.76 1x4f h GLU 100 CO 0.77 1.29 -0.01 -0.22 -0.73 0.00 0.00 179.01 180.12 1x4f h LYS 101 N 0.04 -0.01 -6.51 1.92 3.11 -1.92 -3.39 116.57 109.81 1x4f h LYS 101 Ca -0.35 0.00 -0.53 0.00 -2.81 0.00 0.00 60.65 56.96 1x4f h LYS 101 Cb 2.04 0.00 0.01 0.00 -1.00 0.00 0.00 32.23 33.29 1x4f h LYS 101 CO 0.15 -0.00 0.64 0.71 -2.81 0.00 0.00 179.45 178.13 1x4f s TYR 102 N -3.04 3.35 -0.13 1.91 2.02 -1.26 -4.94 117.35 115.26 1x4f s TYR 102 Ca -0.00 1.13 -0.08 0.00 -0.37 0.00 0.00 57.07 57.76 1x4f s TYR 102 Cb 0.00 -3.55 -0.25 0.00 -0.40 0.00 0.00 41.96 37.76 1x4f s TYR 102 CO 0.01 -1.81 0.33 1.63 -1.57 0.00 0.00 175.55 174.15 1x4f n LYS 103 N 3.93 0.74 -3.64 -0.62 5.02 -1.26 -4.62 118.16 117.72 1x4f n LYS 103 Ca 0.10 0.28 -0.15 0.00 -2.02 0.00 0.00 58.31 56.52 1x4f n LYS 103 Cb 0.44 -1.71 -0.07 0.00 -0.02 0.00 0.00 35.03 33.68 1x4f n LYS 103 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1x4f s LYS 104 N -2.54 0.88 -1.04 1.97 -2.85 -1.26 -3.33 119.74 111.56 1x4f s LYS 104 Ca -0.23 -0.01 -0.22 0.00 -1.00 0.00 0.00 55.97 54.50 1x4f s LYS 104 Cb 0.07 0.40 0.06 0.00 -2.06 0.00 0.00 37.83 36.30 1x4f s LYS 104 CO 0.75 -0.27 1.44 -0.51 0.10 0.00 0.00 175.35 176.87 1x4f s LEU 105 N -1.36 3.74 0.03 2.77 1.43 -1.26 -4.73 118.68 119.31 1x4f s LEU 105 Ca -0.11 -1.65 0.18 0.00 -1.03 0.00 0.00 54.13 51.52 1x4f s LEU 105 Cb -0.02 -2.55 -0.16 0.00 0.03 0.00 0.00 46.19 43.49 1x4f s LEU 105 CO 0.06 -1.41 0.71 1.33 0.23 0.00 0.00 176.35 177.27 1x4f n VAL 106 N 6.64 0.97 0.09 -1.59 0.24 -1.26 -4.91 118.33 118.51 1x4f n VAL 106 Ca 0.34 -0.67 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 1x4f n VAL 106 Cb 0.50 -0.55 0.00 0.00 -1.47 0.00 0.00 33.84 32.32 1x4f n VAL 106 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1x4f n SER 107 N -2.75 -1.58 0.00 -1.34 3.41 -1.26 -5.18 113.62 104.92 1x4f n SER 107 Ca -0.11 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 58.89 1x4f n SER 107 Cb 0.80 1.72 0.00 0.00 -0.26 0.00 0.00 64.21 66.48 1x4f n SER 107 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x4f n GLY 108 N -1.39 3.27 3.71 5.00 0.00 -1.26 -5.05 105.19 109.47 1x4f n GLY 108 Ca 0.00 -1.64 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 1x4f n GLY 108 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4f s PRO 109 N -4.52 4.32 0.29 1.61 0.04 -1.26 -4.91 135.00 130.56 1x4f s PRO 109 Ca 0.00 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.08 1x4f s PRO 109 Cb 0.00 -3.31 0.68 0.00 0.04 0.00 0.00 34.50 31.91 1x4f s PRO 109 CO 0.00 -0.44 1.62 1.03 0.04 0.00 0.00 177.00 179.25 1x4f h SER 110 N 6.97 -0.20 -3.58 6.66 0.87 -2.08 -3.47 113.55 118.71 1x4f h SER 110 Ca -0.42 0.22 0.36 0.00 -1.23 0.00 0.00 61.79 60.73 1x4f h SER 110 Cb 1.21 0.34 -0.19 0.00 -0.44 0.00 0.00 62.40 63.32 1x4f h SER 110 CO 0.87 -0.22 -1.26 -1.20 -0.53 0.00 0.00 176.83 174.49 1x4f n SER 111 N -5.33 -8.17 0.00 6.23 7.64 -1.26 -5.18 113.62 107.55 1x4f n SER 111 Ca 0.20 1.43 0.00 0.00 1.01 0.00 0.00 58.87 61.52 1x4f n SER 111 Cb 0.67 -5.06 0.00 0.00 -1.01 0.00 0.00 64.21 58.81 1x4f n SER 111 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64