#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4f h SER 2 N 0.00 -1.51 -6.39 1.61 0.87 -2.09 -3.44 113.55 102.61 1x4f h SER 2 Ca 0.00 0.19 -0.50 0.00 -1.23 0.00 0.00 61.79 60.25 1x4f h SER 2 Cb 0.00 0.61 -0.30 0.00 -0.44 0.00 0.00 62.40 62.27 1x4f h SER 2 CO 0.00 -0.35 -0.73 -0.24 -0.53 0.00 0.00 176.83 174.98 1x4f n SER 3 N -4.91 -1.27 -0.37 6.23 2.88 -1.26 -4.74 113.62 110.18 1x4f n SER 3 Ca -0.04 -1.00 0.01 0.00 -1.33 0.00 0.00 58.87 56.51 1x4f n SER 3 Cb 0.29 -1.28 0.07 0.00 -0.75 0.00 0.00 64.21 62.54 1x4f n SER 3 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1x4f h GLY 4 N -0.74 0.25 0.03 0.46 0.00 -2.10 -2.07 103.07 98.90 1x4f h GLY 4 Ca -0.48 0.46 0.00 0.00 0.00 0.00 0.00 47.33 47.31 1x4f h GLY 4 CO 0.71 -0.25 -0.07 1.76 0.00 0.00 0.00 176.54 178.68 1x4f h SER 5 N -0.01 -0.21 -4.01 0.19 0.02 -2.01 -3.49 113.55 104.04 1x4f h SER 5 Ca 0.38 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.35 1x4f h SER 5 Cb 0.63 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.24 1x4f h SER 5 CO -0.98 -0.08 -0.41 -1.20 -1.14 0.00 0.00 176.83 173.02 1x4f n SER 6 N -2.81 -4.18 -4.58 3.07 7.64 -0.78 -4.62 113.62 107.36 1x4f n SER 6 Ca -0.01 0.63 -0.37 0.00 1.01 0.00 0.00 58.87 60.13 1x4f n SER 6 Cb 0.06 -1.60 -0.03 0.00 -1.01 0.00 0.00 64.21 61.63 1x4f n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1x4f s GLY 7 N -3.04 1.03 0.00 0.23 0.00 -1.26 -4.53 107.32 99.75 1x4f s GLY 7 Ca 0.00 -2.61 0.14 0.00 0.00 0.00 0.00 44.72 42.25 1x4f s GLY 7 CO 0.00 3.07 0.69 0.58 0.00 0.00 0.00 173.10 177.44 1x4f n LYS 8 N 8.35 2.15 -2.66 2.90 -0.00 -1.26 -4.99 118.16 122.65 1x4f n LYS 8 Ca 0.47 -0.40 -0.35 0.00 -0.00 0.00 0.00 58.31 58.03 1x4f n LYS 8 Cb 0.46 -1.18 -0.05 0.00 -0.00 0.00 0.00 35.03 34.26 1x4f n LYS 8 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 1x4f s LYS 9 N -1.99 4.20 -0.94 -1.58 0.00 -1.26 -4.94 119.74 113.23 1x4f s LYS 9 Ca 0.09 1.36 -0.24 0.00 0.00 0.00 0.00 55.97 57.17 1x4f s LYS 9 Cb 0.11 -2.42 -0.05 0.00 0.00 0.00 0.00 37.83 35.46 1x4f s LYS 9 CO 0.45 -0.09 1.95 -1.25 0.00 0.00 0.00 175.35 176.41 1x4f s PRO 10 N -2.71 2.55 0.99 1.78 0.04 -1.26 -4.95 135.00 131.44 1x4f s PRO 10 Ca 0.59 -0.40 -0.17 0.00 0.04 0.00 0.00 61.00 61.06 1x4f s PRO 10 Cb -0.17 -5.09 -0.12 0.00 0.04 0.00 0.00 34.50 29.16 1x4f s PRO 10 CO 0.22 -3.45 -0.66 -1.91 0.04 0.00 0.00 177.00 171.24 1x4f n GLU 11 N 8.78 -0.06 -3.15 4.56 2.13 -1.26 -5.00 120.64 126.63 1x4f n GLU 11 Ca 0.41 -0.01 0.04 0.00 0.66 0.00 0.00 57.16 58.25 1x4f n GLU 11 Cb 0.47 -1.14 -0.01 0.00 0.27 0.00 0.00 31.44 31.03 1x4f n GLU 11 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1x4f s GLY 12 N -1.16 -1.09 -0.79 8.31 0.00 -1.26 -5.09 107.32 106.24 1x4f s GLY 12 Ca 0.43 1.53 -0.00 0.00 0.00 0.00 0.00 44.72 46.67 1x4f s GLY 12 CO 0.79 3.48 0.63 0.54 0.00 0.00 0.00 173.10 178.55 1x4f s LYS 13 N 2.84 2.91 -0.43 2.90 3.01 -1.26 -5.05 119.74 124.67 1x4f s LYS 13 Ca 0.17 -3.13 -0.28 0.00 -1.01 0.00 0.00 55.97 51.71 1x4f s LYS 13 Cb -0.13 -3.77 -0.01 0.00 -1.01 0.00 0.00 37.83 32.90 1x4f s LYS 13 CO -0.23 -1.25 1.75 -1.25 0.51 0.00 0.00 175.35 174.88 1x4f s PRO 14 N -1.10 3.17 -0.28 -1.68 0.04 -1.26 -4.94 135.00 128.95 1x4f s PRO 14 Ca 0.24 1.11 -0.14 0.00 0.04 0.00 0.00 61.00 62.25 1x4f s PRO 14 Cb -0.10 -4.22 0.10 0.00 0.04 0.00 0.00 34.50 30.31 1x4f s PRO 14 CO -0.11 -2.06 0.67 0.16 0.04 0.00 0.00 177.00 175.70 1x4f s ASP 15 N 6.29 -1.00 -0.30 6.66 1.47 -1.26 -5.13 116.67 123.41 1x4f s ASP 15 Ca 0.73 1.52 0.03 0.00 1.18 0.00 0.00 52.55 56.01 1x4f s ASP 15 Cb -0.18 1.66 0.08 0.00 -0.34 0.00 0.00 42.92 44.14 1x4f s ASP 15 CO 0.30 -0.23 -0.03 0.00 0.68 0.00 0.00 175.17 175.89 1x4f s GLN 16 N 2.03 1.94 0.08 2.11 1.03 -1.26 -4.80 119.66 120.79 1x4f s GLN 16 Ca -0.09 -1.57 0.00 0.00 0.04 0.00 0.00 55.36 53.74 1x4f s GLN 16 Cb -0.07 -3.06 0.00 0.00 0.03 0.00 0.00 33.01 29.91 1x4f s GLN 16 CO -0.19 -0.74 0.00 1.17 -2.54 0.00 0.00 175.29 172.99 1x4f n LYS 17 N 4.37 0.00 -1.06 9.60 3.00 -1.26 -5.17 118.16 127.64 1x4f n LYS 17 Ca -0.06 0.00 0.13 0.00 -0.00 0.00 0.00 58.31 58.38 1x4f n LYS 17 Cb 0.42 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 35.39 1x4f n LYS 17 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1x4f n PHE 18 N -2.71 -2.81 -2.52 5.64 3.01 -1.26 -5.02 117.46 111.79 1x4f n PHE 18 Ca 0.00 1.51 -0.05 0.00 1.01 0.00 0.00 57.45 59.92 1x4f n PHE 18 Cb 0.00 -2.56 -0.04 0.00 -0.01 0.00 0.00 39.48 36.87 1x4f n PHE 18 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1x4f n ASP 19 N -3.79 -1.80 -3.74 4.37 2.03 -1.26 -5.07 116.55 107.29 1x4f n ASP 19 Ca -0.05 1.40 -0.12 0.00 0.52 0.00 0.00 54.79 56.54 1x4f n ASP 19 Cb 0.50 -5.15 -0.12 0.00 -0.72 0.00 0.00 41.12 35.63 1x4f n ASP 19 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 1x4f s GLN 20 N -0.68 0.28 -0.50 -0.67 0.74 -1.26 -5.09 119.66 112.48 1x4f s GLN 20 Ca -0.24 0.51 0.07 0.00 0.05 0.00 0.00 55.36 55.75 1x4f s GLN 20 Cb 0.02 0.00 0.24 0.00 1.10 0.00 0.00 33.01 34.37 1x4f s GLN 20 CO 0.65 -0.11 0.60 1.63 -0.55 0.00 0.00 175.29 177.51 1x4f n LYS 21 N 3.72 1.46 0.14 1.67 5.02 -1.26 -4.87 118.16 124.03 1x4f n LYS 21 Ca -0.20 -3.85 -0.24 0.00 -2.02 0.00 0.00 58.31 51.99 1x4f n LYS 21 Cb 0.55 -1.70 -0.16 0.00 -0.02 0.00 0.00 35.03 33.71 1x4f n LYS 21 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 1x4f h GLN 22 N 4.21 0.52 0.00 1.97 -0.00 -2.06 -3.44 115.11 116.31 1x4f h GLN 22 Ca 0.14 -0.88 -0.04 0.00 -0.00 0.00 0.00 58.65 57.87 1x4f h GLN 22 Cb 0.79 0.33 -0.04 0.00 0.00 0.00 0.00 27.48 28.56 1x4f h GLN 22 CO 0.62 1.42 -0.08 0.39 0.00 0.00 0.00 178.83 181.18 1x4f n GLU 23 N -3.74 0.00 0.00 1.69 1.02 -1.26 -5.15 120.64 113.19 1x4f n GLU 23 Ca -0.17 -0.29 0.00 0.00 -0.02 0.00 0.00 57.16 56.68 1x4f n GLU 23 Cb 1.08 0.40 0.00 0.00 -0.02 0.00 0.00 31.44 32.90 1x4f n GLU 23 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1x4f n LEU 24 N 0.00 0.00 -3.51 -4.62 4.77 -1.26 -4.93 117.00 107.45 1x4f n LEU 24 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1x4f n LEU 24 Cb 0.37 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.41 1x4f n LEU 24 CO -0.04 -1.32 0.48 -0.83 -1.33 0.00 0.00 177.39 174.35 1x4f s GLY 25 N -5.62 -0.39 -0.42 -0.72 0.00 -1.26 -4.88 107.32 94.03 1x4f s GLY 25 Ca 0.00 2.79 -0.08 0.00 0.00 0.00 0.00 44.72 47.43 1x4f s GLY 25 CO 0.00 3.12 0.26 0.50 0.00 0.00 0.00 173.10 176.98 1x4f s ARG 26 N 2.52 2.49 -0.17 2.90 3.00 -1.21 -4.81 118.95 123.67 1x4f s ARG 26 Ca -0.04 -1.57 -0.03 0.00 0.00 0.00 0.00 55.73 54.09 1x4f s ARG 26 Cb -0.08 -3.77 0.05 0.00 0.00 0.00 0.00 34.95 31.16 1x4f s ARG 26 CO -0.18 -1.01 0.04 0.08 0.00 0.00 0.00 175.30 174.23 1x4f s VAL 27 N 1.37 0.39 -0.42 3.52 1.01 -1.26 -3.76 120.40 121.24 1x4f s VAL 27 Ca 0.04 -0.37 -0.29 0.00 0.00 0.00 0.00 61.98 61.36 1x4f s VAL 27 Cb -0.24 -0.87 0.02 0.00 0.00 0.00 0.00 36.38 35.30 1x4f s VAL 27 CO 0.01 -0.15 1.21 -0.63 0.00 0.00 0.00 175.10 175.54 1x4f s ILE 28 N 1.93 4.17 -0.24 2.22 -1.09 0.10 -0.55 121.20 127.73 1x4f s ILE 28 Ca 0.01 1.23 -0.23 0.00 -2.23 0.00 0.00 60.65 59.43 1x4f s ILE 28 Cb -0.16 -4.45 -0.01 0.00 -1.58 0.00 0.00 42.46 36.26 1x4f s ILE 28 CO -0.08 -0.83 0.76 -2.28 -1.23 0.00 0.00 174.94 171.28 1x4f s HIS 29 N 4.56 3.32 -0.30 3.97 2.46 0.10 -1.14 115.29 128.26 1x4f s HIS 29 Ca 0.51 1.04 -0.03 0.00 0.47 0.00 0.00 55.06 57.05 1x4f s HIS 29 Cb -0.10 -2.97 0.04 0.00 -0.13 0.00 0.00 32.58 29.42 1x4f s HIS 29 CO 0.29 -0.35 0.02 -0.51 -2.47 0.00 0.00 174.74 171.72 1x4f s LEU 30 N 2.62 3.91 0.21 8.88 1.43 0.26 -0.85 118.68 135.14 1x4f s LEU 30 Ca 0.32 -1.17 0.06 0.00 -1.03 0.00 0.00 54.13 52.32 1x4f s LEU 30 Cb -0.15 -1.75 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 1x4f s LEU 30 CO 0.08 -0.26 0.15 -0.44 0.23 0.00 0.00 176.35 176.11 1x4f s SER 31 N 1.31 5.42 -0.78 2.29 0.01 0.29 -1.89 113.70 120.35 1x4f s SER 31 Ca -0.04 -0.23 -0.04 0.00 1.31 0.00 0.00 55.95 56.95 1x4f s SER 31 Cb -0.19 -1.36 -0.04 0.00 0.21 0.00 0.00 66.02 64.63 1x4f s SER 31 CO -0.00 0.02 0.70 -3.20 0.41 0.00 0.00 173.24 171.16 1x4f n ASN 32 N -0.74 -5.87 -4.92 2.44 5.15 -1.22 -0.92 115.26 109.18 1x4f n ASN 32 Ca -0.08 -0.46 -0.27 0.00 -0.60 0.00 0.00 54.58 53.16 1x4f n ASN 32 Cb 0.56 -4.28 -0.03 0.00 -0.53 0.00 0.00 39.78 35.51 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 -4.64 4.16 0.00 1.20 1.43 -1.10 -3.95 118.68 115.78 1x4f s LEU 33 Ca 0.29 0.49 0.00 0.00 -1.03 0.00 0.00 54.13 53.89 1x4f s LEU 33 Cb -0.04 -3.29 0.00 0.00 0.03 0.00 0.00 46.19 42.89 1x4f s LEU 33 CO 0.59 -0.12 0.00 -0.81 0.23 0.00 0.00 176.35 176.24 1x4f n PRO 34 N -0.87 0.23 -2.67 1.29 -0.04 -1.26 -4.92 135.00 126.76 1x4f n PRO 34 Ca -0.04 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.38 1x4f n PRO 34 Cb 0.54 0.00 0.10 0.00 -0.04 0.00 0.00 33.50 34.10 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 -1.27 -0.92 -1.46 0.54 -0.00 -1.26 -5.01 115.22 105.85 1x4f n HIS 35 Ca 0.00 -1.02 -0.01 0.00 0.46 0.00 0.00 57.72 57.15 1x4f n HIS 35 Cb 0.00 1.27 0.20 0.00 -0.12 0.00 0.00 29.99 31.35 1x4f n HIS 35 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1x4f n SER 36 N 0.30 2.34 -1.80 0.26 2.88 -1.26 -4.93 113.62 111.41 1x4f n SER 36 Ca -0.06 -3.76 -0.09 0.00 -1.33 0.00 0.00 58.87 53.63 1x4f n SER 36 Cb 0.74 -0.60 0.03 0.00 -0.75 0.00 0.00 64.21 63.63 1x4f n SER 36 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4f n GLY 37 N -1.11 0.31 3.91 0.46 0.00 -1.26 -5.03 105.19 102.46 1x4f n GLY 37 Ca 0.29 -0.29 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.13 3.53 0.39 1.61 1.13 -1.26 -5.08 117.35 114.53 1x4f s TYR 38 Ca 0.19 0.74 -0.11 0.00 -1.41 0.00 0.00 57.07 56.48 1x4f s TYR 38 Cb -0.09 -2.22 -0.07 0.00 -1.10 0.00 0.00 41.96 38.49 1x4f s TYR 38 CO 0.30 -0.11 0.75 -1.54 -2.51 0.00 0.00 175.55 172.44 1x4f s SER 39 N -3.82 6.54 0.25 -0.18 1.04 -1.26 -4.97 113.70 111.30 1x4f s SER 39 Ca 0.46 1.13 -0.02 0.00 0.48 0.00 0.00 55.95 57.99 1x4f s SER 39 Cb -0.10 -2.32 0.51 0.00 0.10 0.00 0.00 66.02 64.21 1x4f s SER 39 CO 0.39 -0.37 1.73 -2.24 0.98 0.00 0.00 173.24 173.73 1x4f h ASP 40 N 1.39 0.31 -0.72 7.02 2.03 -2.01 -1.47 116.42 122.98 1x4f h ASP 40 Ca -0.47 0.11 0.14 0.00 -0.73 0.00 0.00 57.03 56.08 1x4f h ASP 40 Cb 1.19 0.09 -0.14 0.00 -0.83 0.00 0.00 39.33 39.64 1x4f h ASP 40 CO 0.64 0.10 -0.21 0.28 -1.03 0.00 0.00 179.24 179.02 1x4f h SER 41 N 0.46 -0.76 -1.16 4.15 0.02 -1.98 0.57 113.55 114.85 1x4f h SER 41 Ca 0.44 0.22 0.33 0.00 -0.84 0.00 0.00 61.79 61.95 1x4f h SER 41 Cb 0.70 0.48 -0.09 0.00 0.14 0.00 0.00 62.40 63.62 1x4f h SER 41 CO -0.42 -0.25 0.77 0.00 -1.14 0.00 0.00 176.83 175.79 1x4f h ALA 42 N 1.63 2.59 0.00 3.77 0.00 -1.65 1.33 119.26 126.93 1x4f h ALA 42 Ca 0.34 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.22 1x4f h ALA 42 Cb 0.54 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1x4f h ALA 42 CO -0.75 -1.04 -0.36 0.28 0.00 0.00 0.00 179.25 177.39 1x4f h VAL 43 N 0.22 0.59 0.00 0.00 2.07 0.05 -3.20 116.25 115.98 1x4f h VAL 43 Ca 0.65 -1.83 0.00 0.00 0.82 0.00 0.00 66.70 66.34 1x4f h VAL 43 Cb 1.98 2.29 0.00 0.00 -1.52 0.00 0.00 31.29 34.03 1x4f h VAL 43 CO -0.25 0.33 -0.85 0.18 0.02 0.00 0.00 177.57 177.00 1x4f n LEU 44 N -3.18 0.67 0.17 2.57 4.77 0.41 -3.99 117.00 118.43 1x4f n LEU 44 Ca 0.03 0.15 0.15 0.00 -0.03 0.00 0.00 56.01 56.30 1x4f n LEU 44 Cb 0.67 -0.13 0.74 0.00 -2.33 0.00 0.00 43.42 42.37 1x4f n LEU 44 CO 0.39 -0.04 1.13 0.11 -1.33 0.00 0.00 177.39 177.65 1x4f h LYS 45 N 0.00 0.00 -0.00 3.23 6.56 -0.05 0.52 116.57 126.82 1x4f h LYS 45 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1x4f h LYS 45 Cb 0.78 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.44 1x4f h LYS 45 CO 0.00 0.00 -0.00 1.47 -2.06 0.00 0.00 179.45 178.86 1x4f n LEU 46 N -4.19 0.25 0.00 2.94 -0.00 -1.26 -3.47 117.00 111.27 1x4f n LEU 46 Ca 0.02 -0.07 0.00 0.00 -0.00 0.00 0.00 56.01 55.96 1x4f n LEU 46 Cb 0.31 -0.01 0.00 0.00 -0.00 0.00 0.00 43.42 43.72 1x4f n LEU 46 CO 0.32 0.04 -0.34 0.00 -0.00 0.00 0.00 177.39 177.41 1x4f n ALA 47 N -0.82 1.51 0.12 1.47 0.00 0.13 -4.73 120.51 118.19 1x4f n ALA 47 Ca 0.23 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.52 1x4f n ALA 47 Cb 0.16 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.52 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 0.00 -0.69 0.00 0.00 4.39 -0.25 0.12 114.58 118.15 1x4f h GLU 48 Ca 0.00 0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1x4f h GLU 48 Cb 0.00 0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1x4f h GLU 48 CO 0.00 -0.46 0.00 -0.35 -1.16 0.00 0.00 179.01 177.04 1x4f n PRO 49 N -5.18 0.48 -0.11 2.33 -0.04 -1.26 -2.58 135.00 128.64 1x4f n PRO 49 Ca -0.08 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.24 1x4f n PRO 49 Cb 0.38 -1.36 -0.11 0.00 -0.04 0.00 0.00 33.50 32.37 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 -0.86 0.00 -3.58 0.54 4.02 -0.01 -5.09 117.16 112.18 1x4f n TYR 50 Ca 0.08 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 58.00 1x4f n TYR 50 Cb 0.04 -0.89 -0.00 0.00 -0.02 0.00 0.00 39.34 38.47 1x4f n TYR 50 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1x4f s GLY 51 N -6.01 -0.45 -0.05 2.72 0.00 0.22 -4.47 107.32 99.29 1x4f s GLY 51 Ca -0.26 0.92 -0.30 0.00 0.00 0.00 0.00 44.72 45.08 1x4f s GLY 51 CO 0.58 0.18 1.57 0.54 0.00 0.00 0.00 173.10 175.97 1x4f s LYS 52 N -2.19 4.20 -0.71 2.90 -0.14 -1.26 -4.34 119.74 118.20 1x4f s LYS 52 Ca 0.14 2.11 -0.26 0.00 -1.36 0.00 0.00 55.97 56.60 1x4f s LYS 52 Cb 0.06 -3.86 -0.01 0.00 -1.68 0.00 0.00 37.83 32.34 1x4f s LYS 52 CO -0.05 -0.78 1.75 0.42 -0.76 0.00 0.00 175.35 175.93 1x4f s ILE 53 N 3.58 3.46 -0.23 2.17 1.01 -1.26 -0.37 121.20 129.55 1x4f s ILE 53 Ca 0.70 0.09 0.18 0.00 0.00 0.00 0.00 60.65 61.62 1x4f s ILE 53 Cb -0.32 -4.18 0.10 0.00 0.01 0.00 0.00 42.46 38.07 1x4f s ILE 53 CO 0.28 -1.14 1.36 0.50 0.00 0.00 0.00 174.94 175.94 1x4f h LYS 54 N 13.20 0.00 -1.46 2.79 1.63 -1.74 -3.48 116.57 127.51 1x4f h LYS 54 Ca -0.18 0.00 0.16 0.00 -0.85 0.00 0.00 60.65 59.78 1x4f h LYS 54 Cb 1.11 0.00 -0.23 0.00 -0.60 0.00 0.00 32.23 32.51 1x4f h LYS 54 CO 1.24 0.30 0.71 1.21 -3.45 0.00 0.00 179.45 179.45 1x4f s ASN 55 N -6.20 -0.23 0.04 4.20 2.47 -1.16 -5.03 114.94 109.03 1x4f s ASN 55 Ca 0.03 0.19 -0.16 0.00 0.42 0.00 0.00 52.86 53.34 1x4f s ASN 55 Cb 0.07 0.20 0.03 0.00 -1.45 0.00 0.00 41.25 40.11 1x4f s ASN 55 CO 0.74 -0.26 0.37 -0.72 -3.72 0.00 0.00 177.10 173.51 1x4f s TYR 56 N -1.49 -0.21 -0.08 0.43 -0.85 -1.26 0.22 117.35 114.11 1x4f s TYR 56 Ca 0.04 0.14 -0.00 0.00 -0.52 0.00 0.00 57.07 56.72 1x4f s TYR 56 Cb -0.01 0.17 0.03 0.00 0.38 0.00 0.00 41.96 42.53 1x4f s TYR 56 CO -0.03 -0.54 -0.03 0.42 -1.52 0.00 0.00 175.55 173.84 1x4f s ILE 57 N -2.48 0.61 -0.47 -3.49 -1.09 0.13 -4.94 121.20 109.47 1x4f s ILE 57 Ca -0.05 -0.06 -0.06 0.00 -2.23 0.00 0.00 60.65 58.25 1x4f s ILE 57 Cb -0.01 -0.70 0.12 0.00 -1.58 0.00 0.00 42.46 40.30 1x4f s ILE 57 CO -0.03 0.29 0.31 -0.76 -1.23 0.00 0.00 174.94 173.52 1x4f s LEU 58 N 1.64 5.50 -0.21 2.97 2.01 -1.26 -0.91 118.68 128.42 1x4f s LEU 58 Ca 0.01 -2.09 -0.12 0.00 0.01 0.00 0.00 54.13 51.94 1x4f s LEU 58 Cb -0.13 -1.92 -0.05 0.00 0.01 0.00 0.00 46.19 44.10 1x4f s LEU 58 CO -0.05 -0.59 0.24 -0.04 1.01 0.00 0.00 176.35 176.92 1x4f s MET 59 N 1.08 4.15 0.04 1.70 -1.94 0.25 -4.96 119.30 119.63 1x4f s MET 59 Ca 0.08 -0.07 0.23 0.00 -1.71 0.00 0.00 55.69 54.23 1x4f s MET 59 Cb -0.24 -3.50 0.16 0.00 2.01 0.00 0.00 34.83 33.26 1x4f s MET 59 CO -0.03 0.10 1.14 2.89 -0.01 0.00 0.00 175.02 179.11 1x4f n ARG 60 N 4.09 0.19 0.00 2.03 1.85 -1.26 -2.13 116.66 121.43 1x4f n ARG 60 Ca -0.13 0.01 0.00 0.00 -1.00 0.00 0.00 57.85 56.73 1x4f n ARG 60 Cb 0.52 -1.57 0.00 0.00 -1.05 0.00 0.00 32.46 30.36 1x4f n ARG 60 CO 0.00 0.00 0.00 -1.33 -0.01 0.00 0.00 177.63 176.29 1x4f n MET 61 N -1.82 0.00 -1.02 2.89 2.81 -1.26 -3.55 117.12 115.16 1x4f n MET 61 Ca 0.03 0.11 -0.20 0.00 -1.81 0.00 0.00 57.70 55.82 1x4f n MET 61 Cb 0.40 -0.95 0.14 0.00 -0.71 0.00 0.00 33.22 32.11 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 -0.55 2.05 -3.99 0.03 5.02 -1.26 -4.90 118.16 114.56 1x4f n LYS 62 Ca 0.00 -2.50 -0.31 0.00 -2.02 0.00 0.00 58.31 53.49 1x4f n LYS 62 Cb 0.00 -1.98 -0.02 0.00 -0.02 0.00 0.00 35.03 33.01 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 -0.84 -1.60 -4.40 4.39 7.64 -1.23 -4.72 113.62 112.86 1x4f n SER 63 Ca 0.50 -1.11 -0.21 0.00 1.01 0.00 0.00 58.87 59.06 1x4f n SER 63 Cb 1.42 -2.64 -0.10 0.00 -1.01 0.00 0.00 64.21 61.88 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 -6.73 1.47 -0.02 1.43 -0.21 -0.91 -2.69 119.66 112.00 1x4f s GLN 64 Ca 0.17 -1.65 -0.19 0.00 0.02 0.00 0.00 55.36 53.70 1x4f s GLN 64 Cb -0.07 -1.41 0.04 0.00 1.00 0.00 0.00 33.01 32.56 1x4f s GLN 64 CO 0.92 0.25 0.41 0.00 -2.12 0.00 0.00 175.29 174.75 1x4f s ALA 65 N -2.70 -1.05 -0.22 6.09 0.00 -0.79 -0.58 121.76 122.51 1x4f s ALA 65 Ca 0.25 0.60 -0.01 0.00 0.00 0.00 0.00 51.96 52.81 1x4f s ALA 65 Cb -0.03 0.05 0.06 0.00 0.00 0.00 0.00 23.12 23.20 1x4f s ALA 65 CO 0.10 -0.29 -0.02 -0.06 0.00 0.00 0.00 175.76 175.49 1x4f s PHE 66 N -1.28 1.92 -0.39 0.00 0.08 -0.09 -0.58 117.98 117.64 1x4f s PHE 66 Ca -0.13 -1.45 -0.11 0.00 0.12 0.00 0.00 56.93 55.36 1x4f s PHE 66 Cb -0.04 -1.39 0.03 0.00 -0.57 0.00 0.00 43.02 41.05 1x4f s PHE 66 CO 0.06 -0.72 0.23 0.42 -0.10 0.00 0.00 175.22 175.11 1x4f s ILE 67 N 1.56 4.63 -0.56 0.64 1.01 -0.29 0.19 121.20 128.37 1x4f s ILE 67 Ca -0.04 -0.91 -0.25 0.00 0.00 0.00 0.00 60.65 59.45 1x4f s ILE 67 Cb -0.18 -3.62 0.04 0.00 0.01 0.00 0.00 42.46 38.71 1x4f s ILE 67 CO -0.07 -0.29 1.00 -0.70 0.00 0.00 0.00 174.94 174.88 1x4f s GLU 68 N 1.55 3.37 1.03 2.79 2.12 0.13 -0.72 118.70 128.97 1x4f s GLU 68 Ca 0.02 -0.15 -0.12 0.00 0.36 0.00 0.00 54.97 55.08 1x4f s GLU 68 Cb -0.20 -4.05 0.21 0.00 0.26 0.00 0.00 34.13 30.35 1x4f s GLU 68 CO 0.07 -1.54 1.07 -1.64 -0.54 0.00 0.00 175.26 172.68 1x4f s MET 69 N 4.20 0.16 0.30 4.30 -1.94 -1.25 -2.52 119.30 122.55 1x4f s MET 69 Ca 0.33 0.75 0.10 0.00 -1.71 0.00 0.00 55.69 55.17 1x4f s MET 69 Cb -0.11 -1.69 0.47 0.00 2.01 0.00 0.00 34.83 35.51 1x4f s MET 69 CO 0.20 -2.98 1.68 1.49 -0.01 0.00 0.00 175.02 175.41 1x4f h GLU 70 N -2.08 0.03 0.00 2.03 4.81 -1.00 -3.42 114.58 114.96 1x4f h GLU 70 Ca -0.55 -0.02 -0.27 0.00 -0.13 0.00 0.00 59.36 58.39 1x4f h GLU 70 Cb 1.32 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 30.63 1x4f h GLU 70 CO 0.53 0.55 -0.22 0.25 -0.73 0.00 0.00 179.01 179.40 1x4f n THR 71 N -3.92 0.00 0.04 0.32 -2.24 -1.26 -5.00 114.28 102.23 1x4f n THR 71 Ca -0.01 -1.48 -0.15 0.00 -2.27 0.00 0.00 64.05 60.13 1x4f n THR 71 Cb 0.54 0.81 -0.14 0.00 -2.10 0.00 0.00 70.33 69.44 1x4f n THR 71 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1x4f h ARG 72 N 0.00 0.20 -0.88 -0.78 2.43 -1.98 -3.21 114.38 110.16 1x4f h ARG 72 Ca -0.18 -0.34 0.15 0.00 -0.81 0.00 0.00 59.98 58.81 1x4f h ARG 72 Cb 0.84 0.12 -0.07 0.00 -0.42 0.00 0.00 29.97 30.45 1x4f h ARG 72 CO 0.25 1.02 0.57 0.93 -1.51 0.00 0.00 179.97 181.23 1x4f h GLU 73 N 0.05 0.61 0.09 0.20 5.08 -1.97 0.29 114.58 118.94 1x4f h GLU 73 Ca -0.25 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1x4f h GLU 73 Cb 2.00 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 31.11 1x4f h GLU 73 CO 0.14 0.41 -0.04 -0.44 -1.00 0.00 0.00 179.01 178.07 1x4f h ASP 74 N 0.63 -0.10 -1.04 1.42 3.32 -1.78 -2.63 116.42 116.24 1x4f h ASP 74 Ca 0.44 0.00 0.36 0.00 0.02 0.00 0.00 57.03 57.85 1x4f h ASP 74 Cb 0.78 0.03 -0.15 0.00 0.22 0.00 0.00 39.33 40.20 1x4f h ASP 74 CO -0.20 0.16 0.60 0.00 -1.72 0.00 0.00 179.24 178.09 1x4f h ALA 75 N -1.48 2.10 -0.12 3.45 0.00 -1.53 1.16 119.26 122.84 1x4f h ALA 75 Ca -0.01 0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 1x4f h ALA 75 Cb 0.09 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1x4f h ALA 75 CO 0.02 -0.75 -0.57 0.52 0.00 0.00 0.00 179.25 178.46 1x4f h MET 76 N 0.23 0.38 -0.01 0.00 2.86 -1.05 -2.72 114.93 114.62 1x4f h MET 76 Ca 0.77 -0.25 -0.11 0.00 -2.06 0.00 0.00 59.70 58.05 1x4f h MET 76 Cb 1.90 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 33.58 1x4f h MET 76 CO -0.61 0.85 -0.51 0.00 1.06 0.00 0.00 176.91 177.69 1x4f h ALA 77 N 1.10 1.13 0.20 6.32 0.00 0.17 -2.12 119.26 126.06 1x4f h ALA 77 Ca -0.00 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1x4f h ALA 77 Cb 1.09 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1x4f h ALA 77 CO 0.10 0.64 -0.10 1.98 0.00 0.00 0.00 179.25 181.88 1x4f h MET 78 N 0.02 -0.26 -0.84 0.00 4.05 -0.89 -1.74 114.93 115.27 1x4f h MET 78 Ca -0.00 0.02 0.04 0.00 -0.28 0.00 0.00 59.70 59.48 1x4f h MET 78 Cb 0.91 0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 31.72 1x4f h MET 78 CO 0.07 0.14 0.55 -0.39 0.23 0.00 0.00 176.91 177.51 1x4f h VAL 79 N -0.86 1.12 -0.26 -5.77 -1.51 -1.53 -2.40 116.25 105.04 1x4f h VAL 79 Ca -0.03 -0.35 -0.06 0.00 -1.23 0.00 0.00 66.70 65.04 1x4f h VAL 79 Cb 0.51 0.01 -0.01 0.00 -2.13 0.00 0.00 31.29 29.68 1x4f h VAL 79 CO 0.04 0.19 -0.05 -0.78 -1.23 0.00 0.00 177.57 175.74 1x4f h ASP 80 N 1.02 0.50 0.00 4.19 3.58 -1.43 -2.52 116.42 121.75 1x4f h ASP 80 Ca 0.34 -0.36 0.00 0.00 0.42 0.00 0.00 57.03 57.44 1x4f h ASP 80 Cb 0.08 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 40.99 1x4f h ASP 80 CO -0.11 0.74 0.12 -0.74 -2.88 0.00 0.00 179.24 176.37 1x4f h HIS 81 N 0.25 0.00 0.00 0.28 2.76 -0.80 0.23 115.15 117.87 1x4f h HIS 81 Ca 0.07 0.00 -0.21 0.00 -2.20 0.00 0.00 60.37 58.03 1x4f h HIS 81 Cb 0.51 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.44 1x4f h HIS 81 CO 0.05 0.00 -1.26 0.00 -1.30 0.00 0.00 177.93 175.42 1x4f h LEU 83 N 0.00 0.14 -0.05 0.00 3.38 -0.52 -3.33 115.31 114.94 1x4f h LEU 83 Ca -0.14 -0.52 -0.10 0.00 0.09 0.00 0.00 57.88 57.20 1x4f h LEU 83 Cb 1.73 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 42.45 1x4f h LEU 83 CO 0.08 0.64 -0.37 0.11 0.09 0.00 0.00 178.44 178.99 1x4f h LYS 84 N -0.35 0.33 -6.37 1.13 6.56 -1.68 -3.45 116.57 112.74 1x4f h LYS 84 Ca 0.01 -0.30 -0.64 0.00 -1.06 0.00 0.00 60.65 58.66 1x4f h LYS 84 Cb 0.61 0.07 -0.27 0.00 -0.57 0.00 0.00 32.23 32.06 1x4f h LYS 84 CO 0.02 0.96 -0.86 0.21 -2.06 0.00 0.00 179.45 177.71 1x4f s LYS 85 N -3.48 1.66 -0.38 3.15 2.20 -0.96 -5.09 119.74 116.84 1x4f s LYS 85 Ca -0.14 -0.97 -0.29 0.00 -0.36 0.00 0.00 55.97 54.21 1x4f s LYS 85 Cb 0.03 -1.75 0.01 0.00 -1.51 0.00 0.00 37.83 34.61 1x4f s LYS 85 CO 0.78 0.46 1.40 0.00 -0.36 0.00 0.00 175.35 177.63 1x4f s ALA 86 N -0.73 3.13 -0.45 3.13 0.00 -1.26 -3.58 121.76 121.99 1x4f s ALA 86 Ca 0.09 -0.07 -0.28 0.00 0.00 0.00 0.00 51.96 51.70 1x4f s ALA 86 Cb -0.09 -3.90 0.00 0.00 0.00 0.00 0.00 23.12 19.13 1x4f s ALA 86 CO 0.01 -2.24 1.55 -1.17 0.00 0.00 0.00 175.76 173.91 1x4f s LEU 87 N 5.19 3.49 -0.14 0.00 0.20 -1.26 -4.99 118.68 121.17 1x4f s LEU 87 Ca 0.61 0.75 -0.07 0.00 0.69 0.00 0.00 54.13 56.11 1x4f s LEU 87 Cb -0.15 -3.31 -0.04 0.00 -0.43 0.00 0.00 46.19 42.26 1x4f s LEU 87 CO 0.30 -1.66 0.10 0.26 -0.29 0.00 0.00 176.35 175.06 1x4f s TRP 88 N 6.30 3.43 -0.15 5.38 0.52 -1.26 -3.69 118.94 129.47 1x4f s TRP 88 Ca 0.64 0.35 0.01 0.00 0.02 0.00 0.00 56.10 57.13 1x4f s TRP 88 Cb -0.15 -1.99 0.02 0.00 -1.15 0.00 0.00 33.47 30.20 1x4f s TRP 88 CO 0.30 0.50 -0.18 0.12 0.02 0.00 0.00 176.95 177.71 1x4f s PHE 89 N -0.46 2.42 -0.47 -1.98 5.36 0.79 -4.71 117.98 118.94 1x4f s PHE 89 Ca 0.11 -1.31 0.00 0.00 -0.96 0.00 0.00 56.93 54.77 1x4f s PHE 89 Cb -0.12 -1.70 0.00 0.00 -0.34 0.00 0.00 43.02 40.86 1x4f s PHE 89 CO 0.02 -0.65 0.00 0.00 -1.46 0.00 0.00 175.22 173.13 1x4f n GLN 90 N 4.43 -1.44 -0.52 10.12 10.64 -1.26 0.11 117.38 139.46 1x4f n GLN 90 Ca -0.19 0.26 0.00 0.00 -1.83 0.00 0.00 57.00 55.24 1x4f n GLN 90 Cb 0.51 -4.44 0.00 0.00 -0.86 0.00 0.00 30.24 25.45 1x4f n GLN 90 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1x4f n GLY 91 N -0.20 1.45 3.00 2.61 0.00 -1.26 -5.10 105.19 105.68 1x4f n GLY 91 Ca -0.05 -0.20 -0.19 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.59 0.79 -0.18 1.61 1.81 0.31 -5.04 118.95 116.66 1x4f s ARG 92 Ca 0.00 -0.28 -0.06 0.00 -1.72 0.00 0.00 55.73 53.67 1x4f s ARG 92 Cb 0.00 -0.75 -0.22 0.00 -0.45 0.00 0.00 34.95 33.52 1x4f s ARG 92 CO 0.00 0.13 3.49 0.00 -0.68 0.00 0.00 175.30 178.24 1x4f n VAL 94 N 2.44 0.47 -3.16 0.00 3.14 -1.24 -4.95 118.33 115.03 1x4f n VAL 94 Ca 0.47 -0.12 -0.39 0.00 -2.96 0.00 0.00 64.34 61.34 1x4f n VAL 94 Cb 0.83 -1.78 -0.05 0.00 -1.06 0.00 0.00 33.84 31.77 1x4f n VAL 94 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 1x4f s LYS 95 N 0.34 4.38 -0.22 1.45 2.36 -0.09 -4.68 119.74 123.27 1x4f s LYS 95 Ca 0.71 0.69 0.01 0.00 -2.55 0.00 0.00 55.97 54.83 1x4f s LYS 95 Cb -0.57 -3.46 0.03 0.00 -1.05 0.00 0.00 37.83 32.79 1x4f s LYS 95 CO 0.41 0.07 -0.13 0.54 1.55 0.00 0.00 175.35 177.80 1x4f s VAL 96 N 0.84 2.38 -0.02 4.02 0.11 -1.26 -0.54 120.40 125.92 1x4f s VAL 96 Ca 0.32 -1.14 -0.03 0.00 -2.93 0.00 0.00 61.98 58.20 1x4f s VAL 96 Cb -0.17 -2.18 0.00 0.00 -1.53 0.00 0.00 36.38 32.51 1x4f s VAL 96 CO 0.14 0.28 0.08 -1.81 -3.33 0.00 0.00 175.10 170.46 1x4f s ASP 97 N 1.26 -0.03 -0.00 3.54 1.11 -0.03 -4.55 116.67 117.96 1x4f s ASP 97 Ca -0.00 0.04 -0.30 0.00 0.18 0.00 0.00 52.55 52.47 1x4f s ASP 97 Cb -0.16 0.17 -0.06 0.00 1.07 0.00 0.00 42.92 43.93 1x4f s ASP 97 CO -0.08 -0.11 1.57 -0.22 1.18 0.00 0.00 175.17 177.51 1x4f s LEU 98 N -0.32 4.33 0.14 1.23 2.96 -1.26 0.00 118.68 125.75 1x4f s LEU 98 Ca -0.04 2.26 -0.31 0.00 -0.22 0.00 0.00 54.13 55.83 1x4f s LEU 98 Cb -0.03 -3.55 -0.08 0.00 0.50 0.00 0.00 46.19 43.03 1x4f s LEU 98 CO 0.00 -0.85 1.32 -0.55 -1.32 0.00 0.00 176.35 174.96 1x4f s SER 99 N 2.56 6.90 -0.12 3.68 0.15 0.28 -4.86 113.70 122.30 1x4f s SER 99 Ca 0.70 2.29 0.18 0.00 0.70 0.00 0.00 55.95 59.82 1x4f s SER 99 Cb -0.34 -2.59 0.69 0.00 -1.71 0.00 0.00 66.02 62.06 1x4f s SER 99 CO 0.29 -0.57 1.60 -1.84 1.20 0.00 0.00 173.24 173.93 1x4f n GLU 100 N 3.46 3.70 0.00 5.44 0.28 -1.26 -4.61 120.64 127.64 1x4f n GLU 100 Ca 0.09 -2.86 0.00 0.00 -0.16 0.00 0.00 57.16 54.23 1x4f n GLU 100 Cb 0.43 -1.87 0.00 0.00 1.43 0.00 0.00 31.44 31.43 1x4f n GLU 100 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1x4f n LYS 101 N 0.96 0.00 -2.64 3.44 3.00 -1.26 -5.02 118.16 116.64 1x4f n LYS 101 Ca 0.25 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 58.14 1x4f n LYS 101 Cb 0.88 -0.16 -0.04 0.00 0.00 0.00 0.00 35.03 35.72 1x4f n LYS 101 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1x4f s TYR 102 N -1.00 3.66 -0.15 5.64 2.02 -1.26 -4.94 117.35 121.32 1x4f s TYR 102 Ca 0.00 1.65 0.18 0.00 -0.37 0.00 0.00 57.07 58.53 1x4f s TYR 102 Cb 0.00 -3.17 -0.26 0.00 -0.40 0.00 0.00 41.96 38.13 1x4f s TYR 102 CO 0.00 -0.25 0.17 0.36 -1.57 0.00 0.00 175.55 174.26 1x4f n LYS 103 N 3.36 0.79 -4.13 -0.62 2.85 -1.26 -4.50 118.16 114.64 1x4f n LYS 103 Ca 0.05 -0.06 -0.09 0.00 -1.05 0.00 0.00 58.31 57.16 1x4f n LYS 103 Cb 0.49 -1.50 -0.10 0.00 -0.65 0.00 0.00 35.03 33.27 1x4f n LYS 103 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1x4f s LYS 104 N -2.72 0.84 -0.72 -1.58 1.02 -1.26 -3.36 119.74 111.96 1x4f s LYS 104 Ca -0.09 -1.38 -0.03 0.00 0.02 0.00 0.00 55.97 54.49 1x4f s LYS 104 Cb 0.08 0.23 0.18 0.00 -0.52 0.00 0.00 37.83 37.80 1x4f s LYS 104 CO 0.81 -0.22 0.56 -0.51 -0.92 0.00 0.00 175.35 175.07 1x4f s LEU 105 N -3.01 5.37 0.06 3.17 1.43 -1.26 -4.80 118.68 119.64 1x4f s LEU 105 Ca 0.19 -3.16 0.00 0.00 -1.03 0.00 0.00 54.13 50.14 1x4f s LEU 105 Cb 0.08 -1.88 0.00 0.00 0.03 0.00 0.00 46.19 44.42 1x4f s LEU 105 CO -0.01 -0.31 0.00 0.52 0.23 0.00 0.00 176.35 176.78 1x4f n VAL 106 N 3.09 0.46 0.00 -1.59 0.31 -1.26 -4.98 118.33 114.35 1x4f n VAL 106 Ca 0.13 0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.61 1x4f n VAL 106 Cb 0.38 -1.37 0.00 0.00 -0.91 0.00 0.00 33.84 31.94 1x4f n VAL 106 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1x4f n SER 107 N -3.18 0.00 -3.87 4.52 2.88 -1.26 -4.79 113.62 107.93 1x4f n SER 107 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 1x4f n SER 107 Cb 0.23 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.58 1x4f n SER 107 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x4f s GLY 108 N 0.00 0.01 0.25 0.46 0.00 -1.26 -5.05 107.32 101.73 1x4f s GLY 108 Ca 0.00 0.03 0.02 0.00 0.00 0.00 0.00 44.72 44.77 1x4f s GLY 108 CO 0.00 -0.06 1.62 -0.56 0.00 0.00 0.00 173.10 174.10 1x4f h PRO 109 N 5.08 0.41 -3.39 2.90 0.13 -2.04 -3.49 132.00 131.59 1x4f h PRO 109 Ca -0.28 -0.22 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1x4f h PRO 109 Cb 1.20 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1x4f h PRO 109 CO 0.42 0.78 -0.82 0.45 -0.23 0.00 0.00 178.00 178.59 1x4f n SER 110 N -4.00 -8.02 0.00 1.44 2.88 -1.26 -5.05 113.62 99.61 1x4f n SER 110 Ca -0.02 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.65 1x4f n SER 110 Cb 0.52 -4.23 0.00 0.00 -0.75 0.00 0.00 64.21 59.76 1x4f n SER 110 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1x4f n SER 111 N -0.56 0.00 0.00 -3.46 2.88 -1.26 -5.30 113.62 105.92 1x4f n SER 111 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1x4f n SER 111 Cb 0.00 0.15 0.00 0.00 -0.75 0.00 0.00 64.21 63.61 1x4f n SER 111 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42