#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l3h s THR 2 N 0.00 2.69 0.28 1.47 -4.23 -1.26 -4.84 115.64 109.75 1l3h s THR 2 Ca 0.00 -0.09 0.01 0.00 -1.18 0.00 0.00 61.69 60.43 1l3h s THR 2 Cb 0.00 -3.16 0.28 0.00 1.34 0.00 0.00 72.50 70.97 1l3h s THR 2 CO 0.00 -0.18 1.84 0.50 -0.54 0.00 0.00 174.62 176.25 1l3h h LYS 3 N -0.56 0.99 0.74 3.99 3.64 -1.99 0.18 116.57 123.55 1l3h h LYS 3 Ca -0.45 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 58.84 1l3h h LYS 3 Cb 1.30 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1l3h h LYS 3 CO 0.61 0.66 -0.37 0.00 -2.27 0.00 0.00 179.45 178.08 1l3h h GLN 5 N -1.01 1.04 0.89 0.00 1.08 -1.59 0.40 115.11 115.92 1l3h h GLN 5 Ca -0.10 -0.06 -0.04 0.00 -1.45 0.00 0.00 58.65 57.00 1l3h h GLN 5 Cb 0.79 -0.23 0.00 0.00 -0.05 0.00 0.00 27.48 27.98 1l3h h GLN 5 CO 0.15 0.69 -0.49 0.93 -0.95 0.00 0.00 178.83 179.16 1l3h h GLU 6 N 1.07 -1.23 -0.84 1.46 5.08 -0.64 -1.29 114.58 118.19 1l3h h GLU 6 Ca 0.36 0.08 0.05 0.00 -1.00 0.00 0.00 59.36 58.85 1l3h h GLU 6 Cb 0.07 0.28 -0.06 0.00 0.50 0.00 0.00 28.75 29.54 1l3h h GLU 6 CO -0.11 -0.82 0.52 0.93 -1.00 0.00 0.00 179.01 178.53 1l3h h GLU 7 N -1.28 0.95 -0.19 2.33 5.08 -0.48 -0.34 114.58 120.65 1l3h h GLU 7 Ca -0.12 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.11 1l3h h GLU 7 Cb 1.01 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 1l3h h GLU 7 CO 0.16 0.63 -0.19 0.28 -1.00 0.00 0.00 179.01 178.88 1l3h h VAL 8 N 0.97 1.23 -0.00 3.13 2.07 -0.97 0.23 116.25 122.90 1l3h h VAL 8 Ca 0.35 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.84 1l3h h VAL 8 Cb 0.12 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1l3h h VAL 8 CO -0.15 0.32 -0.01 -1.20 0.02 0.00 0.00 177.57 176.55 1l3h n SER 9 N -4.19 0.24 0.00 0.57 7.64 -0.30 -4.24 113.62 113.34 1l3h n SER 9 Ca -0.00 -0.96 0.00 0.00 1.01 0.00 0.00 58.87 58.92 1l3h n SER 9 Cb 0.34 -0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 1l3h n SER 9 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1l3h n HIS 10 N -0.86 0.00 -3.26 1.43 -0.00 -0.29 -4.92 115.22 107.31 1l3h n HIS 10 Ca 0.22 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.50 1l3h n HIS 10 Cb 0.17 0.00 -0.08 0.00 -0.00 0.00 0.00 29.99 30.08 1l3h n HIS 10 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1l3h s ILE 11 N -1.69 5.02 0.89 1.59 1.01 0.75 -5.07 121.20 123.70 1l3h s ILE 11 Ca 0.00 -0.44 -0.12 0.00 0.00 0.00 0.00 60.65 60.09 1l3h s ILE 11 Cb 0.00 -4.14 0.13 0.00 0.01 0.00 0.00 42.46 38.45 1l3h s ILE 11 CO 0.00 -0.57 1.13 -2.16 0.00 0.00 0.00 174.94 173.34 1l3h s PRO 12 N 2.28 1.31 0.66 2.79 0.04 -1.26 -4.61 135.00 136.21 1l3h s PRO 12 Ca 0.13 0.35 0.38 0.00 0.04 0.00 0.00 61.00 61.90 1l3h s PRO 12 Cb -0.18 -1.85 2.10 0.00 0.04 0.00 0.00 34.50 34.60 1l3h s PRO 12 CO 0.13 -2.10 2.19 0.00 0.04 0.00 0.00 177.00 177.26 1l3h h ALA 13 N -1.43 1.17 -1.11 8.56 0.00 -1.98 -3.17 119.26 121.30 1l3h h ALA 13 Ca -0.50 -0.00 -0.73 0.00 0.00 0.00 0.00 54.91 53.68 1l3h h ALA 13 Cb 1.32 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.98 1l3h h ALA 13 CO 0.61 -0.14 1.92 0.28 0.00 0.00 0.00 179.25 181.93 1l3h n VAL 14 N -3.04 4.11 -3.27 0.00 0.31 -1.26 -4.88 118.33 110.30 1l3h n VAL 14 Ca -0.02 -4.31 -0.34 0.00 -0.01 0.00 0.00 64.34 59.66 1l3h n VAL 14 Cb 0.20 -2.43 -0.04 0.00 -0.91 0.00 0.00 33.84 30.66 1l3h n VAL 14 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1l3h n HIS 15 N 5.90 3.12 -1.91 3.52 1.44 -1.20 -5.08 115.22 121.01 1l3h n HIS 15 Ca 0.42 -3.50 -0.41 0.00 -2.01 0.00 0.00 57.72 52.21 1l3h n HIS 15 Cb 0.41 -0.89 -0.02 0.00 0.12 0.00 0.00 29.99 29.61 1l3h n HIS 15 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 1l3h s PRO 16 N -2.53 4.20 0.00 -1.40 0.04 -1.26 -2.51 135.00 131.54 1l3h s PRO 16 Ca 0.35 2.42 0.00 0.00 0.04 0.00 0.00 61.00 63.82 1l3h s PRO 16 Cb 0.09 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.56 1l3h s PRO 16 CO 0.03 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 176.96 1l3h n GLY 17 N 2.23 0.00 3.36 0.56 0.00 -1.26 -4.89 105.19 105.19 1l3h n GLY 17 Ca 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.92 1l3h n GLY 17 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1l3h s SER 18 N -1.28 1.78 0.27 1.61 1.04 -1.04 -4.92 113.70 111.16 1l3h s SER 18 Ca 0.00 -1.31 -0.08 0.00 0.48 0.00 0.00 55.95 55.04 1l3h s SER 18 Cb 0.00 0.03 -0.06 0.00 0.10 0.00 0.00 66.02 66.09 1l3h s SER 18 CO 0.00 -0.60 0.58 0.12 0.98 0.00 0.00 173.24 174.31 1l3h s PHE 19 N -3.49 3.45 -0.03 5.02 5.36 -1.26 -4.30 117.98 122.74 1l3h s PHE 19 Ca 0.33 0.81 0.00 0.00 -0.96 0.00 0.00 56.93 57.11 1l3h s PHE 19 Cb 0.07 -2.22 0.03 0.00 -0.34 0.00 0.00 43.02 40.56 1l3h s PHE 19 CO 0.12 0.19 0.01 0.50 -1.46 0.00 0.00 175.22 174.58 1l3h s ARG 20 N -3.20 0.19 1.10 10.12 3.52 -1.26 -5.01 118.95 124.40 1l3h s ARG 20 Ca 0.47 0.11 -0.17 0.00 -0.13 0.00 0.00 55.73 56.01 1l3h s ARG 20 Cb -0.11 -0.41 0.24 0.00 -1.56 0.00 0.00 34.95 33.12 1l3h s ARG 20 CO 0.26 -0.15 1.15 -1.25 -0.81 0.00 0.00 175.30 174.50 1l3h s PRO 21 N 1.05 -0.42 0.02 5.12 0.04 -1.26 -4.62 135.00 134.93 1l3h s PRO 21 Ca -0.09 -0.04 0.00 0.00 0.04 0.00 0.00 61.00 60.91 1l3h s PRO 21 Cb -0.13 -1.69 -0.02 0.00 0.04 0.00 0.00 34.50 32.70 1l3h s PRO 21 CO -0.02 -3.18 -0.03 0.15 0.04 0.00 0.00 177.00 173.95 1l3h s LYS 22 N -5.44 0.34 0.10 4.56 3.01 -1.26 -4.80 119.74 116.24 1l3h s LYS 22 Ca 0.70 -0.64 0.02 0.00 -1.01 0.00 0.00 55.97 55.04 1l3h s LYS 22 Cb -0.10 0.08 -0.04 0.00 -1.01 0.00 0.00 37.83 36.76 1l3h s LYS 22 CO 0.55 -0.04 -0.07 0.00 0.51 0.00 0.00 175.35 176.30 1l3h n ASP 24 N 0.13 1.78 0.00 0.00 5.68 0.35 -4.62 116.55 119.86 1l3h n ASP 24 Ca -0.13 -2.35 0.01 0.00 -0.50 0.00 0.00 54.79 51.82 1l3h n ASP 24 Cb 0.60 -0.48 0.07 0.00 -1.14 0.00 0.00 41.12 40.17 1l3h n ASP 24 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1l3h n GLU 25 N -2.41 0.06 -0.13 0.11 0.00 -1.26 -0.74 120.64 116.26 1l3h n GLU 25 Ca 0.16 0.14 0.08 0.00 0.00 0.00 0.00 57.16 57.54 1l3h n GLU 25 Cb 0.57 -1.50 0.11 0.00 0.00 0.00 0.00 31.44 30.62 1l3h n GLU 25 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1l3h n ASN 26 N -1.16 1.95 0.00 -1.84 5.03 -1.26 -5.01 115.26 112.98 1l3h n ASN 26 Ca 0.02 -2.86 0.00 0.00 0.87 0.00 0.00 54.58 52.61 1l3h n ASN 26 Cb 0.02 -0.37 0.00 0.00 -1.02 0.00 0.00 39.78 38.40 1l3h n ASN 26 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1l3h n GLY 27 N -1.16 0.15 3.91 7.41 0.00 0.08 -4.98 105.19 110.59 1l3h n GLY 27 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 1l3h n GLY 27 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1l3h s ASN 28 N -2.06 5.85 0.12 1.61 0.01 -1.26 -4.23 114.94 114.99 1l3h s ASN 28 Ca 0.00 0.87 -0.31 0.00 -0.71 0.00 0.00 52.86 52.71 1l3h s ASN 28 Cb 0.00 -1.96 -0.10 0.00 0.41 0.00 0.00 41.25 39.60 1l3h s ASN 28 CO 0.00 -0.91 1.68 -0.31 -1.51 0.00 0.00 177.10 176.05 1l3h s TYR 29 N -2.95 2.57 0.20 2.20 1.51 -0.01 -0.50 117.35 120.37 1l3h s TYR 29 Ca 0.52 0.33 -0.33 0.00 -1.01 0.00 0.00 57.07 56.58 1l3h s TYR 29 Cb -0.11 -4.02 -0.14 0.00 -0.11 0.00 0.00 41.96 37.59 1l3h s TYR 29 CO 0.46 -4.01 1.50 1.28 -1.11 0.00 0.00 175.55 173.67 1l3h n LEU 30 N 5.04 3.11 0.24 -1.29 4.77 0.10 -4.43 117.00 124.55 1l3h n LEU 30 Ca 0.16 1.11 0.10 0.00 -0.03 0.00 0.00 56.01 57.34 1l3h n LEU 30 Cb 0.39 -1.43 0.51 0.00 -2.33 0.00 0.00 43.42 40.56 1l3h n LEU 30 CO 0.63 -0.38 0.94 -0.65 -1.33 0.00 0.00 177.39 176.60 1l3h h PRO 31 N 5.09 0.00 -5.44 3.23 0.11 -1.87 -3.36 132.00 129.77 1l3h h PRO 31 Ca -0.45 0.00 -0.66 0.00 0.11 0.00 0.00 66.00 65.00 1l3h h PRO 31 Cb 1.26 0.00 -0.25 0.00 0.11 0.00 0.00 31.00 32.12 1l3h h PRO 31 CO 0.82 0.00 -0.75 -1.17 -0.21 0.00 0.00 178.00 176.70 1l3h s LEU 32 N -4.81 2.82 0.09 2.35 2.96 -1.26 -0.59 118.68 120.23 1l3h s LEU 32 Ca -0.02 -0.27 0.10 0.00 -0.22 0.00 0.00 54.13 53.71 1l3h s LEU 32 Cb 0.05 -1.64 -0.03 0.00 0.50 0.00 0.00 46.19 45.07 1l3h s LEU 32 CO 0.17 0.19 -0.25 -1.10 -1.32 0.00 0.00 176.35 174.04 1l3h s GLN 33 N 0.21 1.48 -0.04 1.98 -1.52 0.16 -4.83 119.66 117.10 1l3h s GLN 33 Ca -0.07 -1.20 -0.01 0.00 -1.95 0.00 0.00 55.36 52.13 1l3h s GLN 33 Cb -0.15 -1.80 0.03 0.00 -0.22 0.00 0.00 33.01 30.87 1l3h s GLN 33 CO 0.05 0.44 0.03 0.00 -0.25 0.00 0.00 175.29 175.56 1l3h n TYR 35 N 4.95 3.28 -0.23 0.00 4.19 0.75 -4.49 117.16 125.60 1l3h n TYR 35 Ca -0.11 -2.90 0.17 0.00 3.31 0.00 0.00 57.90 58.37 1l3h n TYR 35 Cb 0.50 -2.31 0.48 0.00 0.49 0.00 0.00 39.34 38.50 1l3h n TYR 35 CO 0.00 0.00 0.00 0.78 0.91 0.00 0.00 176.86 178.55 1l3h h GLY 36 N 9.09 0.92 2.00 2.98 0.00 -1.84 -1.59 103.07 114.63 1l3h h GLY 36 Ca 0.50 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.63 1l3h h GLY 36 CO 1.78 0.02 0.00 1.44 0.00 0.00 0.00 176.54 179.79 1l3h n SER 37 N -4.52 0.24 0.00 0.19 7.64 -1.26 -0.90 113.62 115.00 1l3h n SER 37 Ca 0.18 0.59 0.00 0.00 1.01 0.00 0.00 58.87 60.65 1l3h n SER 37 Cb 0.62 -0.63 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 1l3h n SER 37 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1l3h n ILE 38 N -1.80 0.00 -2.18 0.44 -5.35 -0.65 -4.59 119.36 105.23 1l3h n ILE 38 Ca 0.00 -0.46 -0.05 0.00 -0.27 0.00 0.00 62.75 61.97 1l3h n ILE 38 Cb 0.06 1.04 0.00 0.00 -1.74 0.00 0.00 39.64 39.00 1l3h n ILE 38 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1l3h n GLY 39 N 0.41 0.20 3.59 3.28 0.00 -0.08 -5.07 105.19 107.52 1l3h n GLY 39 Ca 0.00 -0.64 -0.28 0.00 0.00 0.00 0.00 46.02 45.09 1l3h n GLY 39 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1l3h s TYR 40 N -2.35 2.72 0.17 1.61 1.51 -1.11 -3.70 117.35 116.19 1l3h s TYR 40 Ca 0.02 -0.18 0.01 0.00 -1.01 0.00 0.00 57.07 55.91 1l3h s TYR 40 Cb -0.01 -1.38 -0.05 0.00 -0.11 0.00 0.00 41.96 40.42 1l3h s TYR 40 CO 0.02 0.47 0.02 0.00 -1.11 0.00 0.00 175.55 174.95 1l3h s TRP 42 N -3.75 0.23 0.32 0.00 -2.14 -0.15 -0.46 118.94 112.99 1l3h s TRP 42 Ca 0.25 -0.60 -0.12 0.00 2.66 0.00 0.00 56.10 58.29 1l3h s TRP 42 Cb 0.07 0.02 -0.08 0.00 -3.10 0.00 0.00 33.47 30.38 1l3h s TRP 42 CO 0.04 -0.70 0.70 0.00 -2.66 0.00 0.00 176.95 174.33 1l3h s VAL 44 N -2.05 0.97 0.66 0.00 -7.23 0.24 -0.36 120.40 112.64 1l3h s VAL 44 Ca 0.52 -1.83 -0.11 0.00 -1.81 0.00 0.00 61.98 58.75 1l3h s VAL 44 Cb -0.10 -1.57 -0.01 0.00 0.56 0.00 0.00 36.38 35.25 1l3h s VAL 44 CO 0.22 -0.67 1.05 -0.36 -0.31 0.00 0.00 175.10 175.03 1l3h s PHE 45 N -2.93 3.39 0.64 2.82 0.08 0.41 -4.45 117.98 117.95 1l3h s PHE 45 Ca 0.10 1.30 0.30 0.00 0.12 0.00 0.00 56.93 58.76 1l3h s PHE 45 Cb 0.00 -2.83 1.65 0.00 -0.57 0.00 0.00 43.02 41.28 1l3h s PHE 45 CO -0.01 -0.97 1.97 -1.35 -0.10 0.00 0.00 175.22 174.76 1l3h h PRO 46 N -0.52 0.00 0.00 0.24 0.11 -1.90 0.13 132.00 130.05 1l3h h PRO 46 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1l3h h PRO 46 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1l3h h PRO 46 CO 0.60 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.66 1l3h n ASN 47 N -3.21 0.00 0.00 -2.05 6.94 -1.26 -0.83 115.26 114.85 1l3h n ASN 47 Ca 0.01 0.49 0.00 0.00 -0.02 0.00 0.00 54.58 55.05 1l3h n ASN 47 Cb 0.42 -0.50 0.00 0.00 -2.36 0.00 0.00 39.78 37.34 1l3h n ASN 47 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1l3h n GLY 48 N 1.36 0.47 3.67 4.83 0.00 0.44 -4.89 105.19 111.07 1l3h n GLY 48 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1l3h n GLY 48 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l3h s THR 49 N -2.00 4.05 0.32 2.61 2.01 -1.25 -4.77 115.64 116.61 1l3h s THR 49 Ca 0.00 1.34 -0.29 0.00 0.31 0.00 0.00 61.69 63.05 1l3h s THR 49 Cb 0.00 -3.86 -0.12 0.00 0.01 0.00 0.00 72.50 68.53 1l3h s THR 49 CO 0.00 -0.06 1.49 1.21 -0.69 0.00 0.00 174.62 176.57 1l3h n GLU 50 N 6.02 2.50 -2.77 4.92 2.13 -1.26 -0.44 120.64 131.73 1l3h n GLU 50 Ca 0.13 0.88 -0.43 0.00 0.66 0.00 0.00 57.16 58.41 1l3h n GLU 50 Cb 0.45 -2.60 -0.04 0.00 0.27 0.00 0.00 31.44 29.52 1l3h n GLU 50 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1l3h s VAL 51 N -0.51 4.40 0.84 6.31 1.01 0.51 -4.85 120.40 128.11 1l3h s VAL 51 Ca 0.60 0.80 -0.12 0.00 0.00 0.00 0.00 61.98 63.26 1l3h s VAL 51 Cb -0.53 -4.49 0.10 0.00 0.00 0.00 0.00 36.38 31.47 1l3h s VAL 51 CO 0.55 -0.91 1.16 -2.16 0.00 0.00 0.00 175.10 173.74 1l3h s PRO 52 N 3.94 1.52 0.00 2.72 0.04 -1.26 -3.00 135.00 138.96 1l3h s PRO 52 Ca 0.39 1.57 0.00 0.00 0.04 0.00 0.00 61.00 62.99 1l3h s PRO 52 Cb -0.10 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 32.66 1l3h s PRO 52 CO 0.27 -2.26 0.00 0.09 0.04 0.00 0.00 177.00 175.13 1l3h n ASN 53 N -3.68 0.00 0.19 6.66 3.02 -1.26 -4.83 115.26 115.35 1l3h n ASN 53 Ca 0.12 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.79 1l3h n ASN 53 Cb 0.52 -1.79 0.19 0.00 -0.61 0.00 0.00 39.78 38.08 1l3h n ASN 53 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 1l3h h THR 54 N 0.00 0.00 -1.20 3.41 1.35 -1.91 -3.45 112.91 111.11 1l3h h THR 54 Ca 0.00 -0.91 -0.42 0.00 -0.55 0.00 0.00 66.41 64.53 1l3h h THR 54 Cb 0.00 1.85 -0.01 0.00 -1.73 0.00 0.00 68.15 68.26 1l3h h THR 54 CO 0.00 0.00 1.51 -1.14 -0.25 0.00 0.00 175.52 175.64 1l3h n ARG 55 N -2.91 0.81 -4.20 4.72 0.00 -1.26 -4.44 116.66 109.39 1l3h n ARG 55 Ca 0.04 -0.09 -0.13 0.00 -0.00 0.00 0.00 57.85 57.67 1l3h n ARG 55 Cb 0.52 -3.12 -0.10 0.00 0.00 0.00 0.00 32.46 29.76 1l3h n ARG 55 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1l3h s SER 56 N 11.39 0.29 0.00 6.15 0.15 0.39 -4.98 113.70 127.09 1l3h s SER 56 Ca 1.04 -1.40 0.05 0.00 0.70 0.00 0.00 55.95 56.34 1l3h s SER 56 Cb -0.35 0.41 0.29 0.00 -1.71 0.00 0.00 66.02 64.66 1l3h s SER 56 CO 0.29 -0.88 0.83 -1.14 1.20 0.00 0.00 173.24 173.53 1l3h n ARG 57 N -0.31 0.14 -3.13 5.44 3.00 -1.26 -1.06 116.66 119.48 1l3h n ARG 57 Ca 0.02 0.06 0.00 0.00 -0.00 0.00 0.00 57.85 57.93 1l3h n ARG 57 Cb 0.65 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.61 1l3h n ARG 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1l3h n GLY 58 N -0.73 -1.29 3.55 5.14 0.00 -1.24 -4.64 105.19 105.98 1l3h n GLY 58 Ca 0.03 -0.95 -0.33 0.00 0.00 0.00 0.00 46.02 44.77 1l3h n GLY 58 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1l3h n HIS 59 N 0.54 -0.07 -3.93 1.61 8.25 -1.26 -4.13 115.22 116.22 1l3h n HIS 59 Ca 0.00 0.34 -0.09 0.00 -0.26 0.00 0.00 57.72 57.71 1l3h n HIS 59 Cb 0.00 -1.95 -0.03 0.00 1.12 0.00 0.00 29.99 29.13 1l3h n HIS 59 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 1l3h s HIS 60 N -2.24 0.20 -0.94 4.41 -3.43 -1.26 -5.06 115.29 106.98 1l3h s HIS 60 Ca 0.66 -0.63 -0.06 0.00 -0.80 0.00 0.00 55.06 54.23 1l3h s HIS 60 Cb -0.27 0.43 0.23 0.00 -1.43 0.00 0.00 32.58 31.54 1l3h s HIS 60 CO 0.59 -1.16 0.86 -0.80 -2.00 0.00 0.00 174.74 172.22 1l3h s ASN 61 N -3.01 6.46 1.10 7.38 -0.87 -1.26 -4.93 114.94 119.81 1l3h s ASN 61 Ca 0.18 -3.48 -0.06 0.00 -1.57 0.00 0.00 52.86 47.93 1l3h s ASN 61 Cb -0.03 -2.04 0.09 0.00 -0.02 0.00 0.00 41.25 39.25 1l3h s ASN 61 CO 0.10 -0.28 0.27 0.00 -2.57 0.00 0.00 177.10 174.61 1l3h n SER 63 N -3.62 1.37 -1.22 0.00 7.64 -1.26 -4.76 113.62 111.77 1l3h n SER 63 Ca 0.04 -1.80 0.00 0.00 1.01 0.00 0.00 58.87 58.12 1l3h n SER 63 Cb 0.16 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 1l3h n SER 63 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1l3h n GLU 64 N 3.17 0.48 0.00 1.43 1.02 -1.26 -4.80 120.64 120.68 1l3h n GLU 64 Ca 0.11 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.28 1l3h n GLU 64 Cb 0.19 -1.26 0.14 0.00 -0.02 0.00 0.00 31.44 30.49 1l3h n GLU 64 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18