#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 2.73 0.30 -5.08 -4.23 -1.26 -4.84 115.64 103.26 1l3h s THR 2 Ca 0.00 -0.04 0.02 0.00 -1.18 0.00 0.00 61.69 60.50 1l3h s THR 2 Cb 0.00 -3.18 0.29 0.00 1.34 0.00 0.00 72.50 70.95 1l3h s THR 2 CO 0.00 -0.21 1.86 0.50 -0.54 0.00 0.00 174.62 176.23 1l3h h LYS 3 N -0.60 0.93 0.89 3.99 3.64 -1.95 0.20 116.57 123.67 1l3h h LYS 3 Ca -0.45 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 58.83 1l3h h LYS 3 Cb 1.30 -0.21 0.01 0.00 -0.41 0.00 0.00 32.23 32.91 1l3h h LYS 3 CO 0.62 0.62 -0.43 0.00 -2.27 0.00 0.00 179.45 177.99 1l3h h GLN 5 N -1.31 0.78 0.92 0.00 1.08 -1.60 0.32 115.11 115.30 1l3h h GLN 5 Ca -0.12 -0.05 -0.05 0.00 -1.45 0.00 0.00 58.65 56.99 1l3h h GLN 5 Cb 0.92 -0.18 0.01 0.00 -0.05 0.00 0.00 27.48 28.18 1l3h h GLN 5 CO 0.20 0.52 -0.44 0.93 -0.95 0.00 0.00 178.83 179.09 1l3h h GLU 6 N 0.81 -1.19 -0.83 1.46 4.39 -0.66 -0.83 114.58 117.73 1l3h h GLU 6 Ca 0.31 0.08 0.06 0.00 0.34 0.00 0.00 59.36 60.14 1l3h h GLU 6 Cb 0.18 0.27 -0.06 0.00 -0.10 0.00 0.00 28.75 29.05 1l3h h GLU 6 CO -0.10 -0.79 0.51 0.93 -1.16 0.00 0.00 179.01 178.40 1l3h h GLU 7 N -1.26 0.91 -0.18 2.33 5.08 -0.72 -0.09 114.58 120.65 1l3h h GLU 7 Ca -0.13 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.14 1l3h h GLU 7 Cb 0.95 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 1l3h h GLU 7 CO 0.21 0.60 -0.08 0.28 -1.00 0.00 0.00 179.01 179.02 1l3h h VAL 8 N 0.94 1.16 -0.20 3.13 2.07 -0.98 0.16 116.25 122.53 1l3h h VAL 8 Ca 0.36 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 67.19 1l3h h VAL 8 Cb 0.15 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1l3h h VAL 8 CO -0.17 0.22 0.00 -1.20 0.02 0.00 0.00 177.57 176.44 1l3h n SER 9 N -4.31 1.23 0.00 0.57 7.64 -0.19 -4.25 113.62 114.32 1l3h n SER 9 Ca -0.00 -1.86 0.00 0.00 1.01 0.00 0.00 58.87 58.02 1l3h n SER 9 Cb 0.24 -0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 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 0.12 0.00 -2.94 1.43 -0.00 -0.38 -4.93 115.22 108.51 1l3h n HIS 10 Ca 0.11 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.40 1l3h n HIS 10 Cb 0.22 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.16 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 -1.75 4.59 0.77 1.59 1.01 0.47 -5.06 121.20 122.81 1l3h s ILE 11 Ca 0.00 0.27 -0.11 0.00 0.00 0.00 0.00 60.65 60.81 1l3h s ILE 11 Cb 0.00 -4.39 0.05 0.00 0.01 0.00 0.00 42.46 38.13 1l3h s ILE 11 CO 0.00 -0.86 1.09 -2.16 0.00 0.00 0.00 174.94 173.00 1l3h s PRO 12 N 3.44 2.32 0.57 2.79 0.04 -1.26 -4.67 135.00 138.23 1l3h s PRO 12 Ca 0.28 1.14 0.27 0.00 0.04 0.00 0.00 61.00 62.73 1l3h s PRO 12 Cb -0.13 -1.91 1.60 0.00 0.04 0.00 0.00 34.50 34.10 1l3h s PRO 12 CO 0.20 -1.59 2.11 0.00 0.04 0.00 0.00 177.00 177.76 1l3h h ALA 13 N -1.09 1.88 0.00 8.56 0.00 -1.97 -3.00 119.26 123.64 1l3h h ALA 13 Ca -0.44 -0.01 -0.66 0.00 0.00 0.00 0.00 54.91 53.81 1l3h h ALA 13 Cb 1.23 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 1l3h h ALA 13 CO 0.52 -0.27 3.02 0.28 0.00 0.00 0.00 179.25 182.80 1l3h n VAL 14 N -3.97 3.12 0.34 0.00 0.31 -1.26 -4.66 118.33 112.22 1l3h n VAL 14 Ca 0.02 -2.44 0.12 0.00 -0.01 0.00 0.00 64.34 62.02 1l3h n VAL 14 Cb 0.30 -2.50 0.23 0.00 -0.91 0.00 0.00 33.84 30.97 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 5.77 0.51 -1.41 3.52 -0.00 -1.14 -5.03 115.22 117.44 1l3h n HIS 15 Ca 0.56 -0.25 -0.60 0.00 -0.00 0.00 0.00 57.72 57.42 1l3h n HIS 15 Cb 0.34 0.00 -0.11 0.00 -0.00 0.00 0.00 29.99 30.22 1l3h n HIS 15 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 1l3h n PRO 16 N 1.43 0.21 0.00 -1.40 -0.02 -1.26 -0.41 135.00 133.55 1l3h n PRO 16 Ca 0.19 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 1l3h n PRO 16 Cb 0.59 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.41 1l3h n PRO 16 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1l3h n GLY 17 N 6.45 2.65 3.53 -1.23 0.00 -1.26 -5.09 105.19 110.24 1l3h n GLY 17 Ca 0.47 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.24 1l3h n GLY 17 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1l3h s SER 18 N -1.55 3.92 0.70 1.61 0.15 0.46 -5.01 113.70 113.99 1l3h s SER 18 Ca 0.00 -0.87 -0.13 0.00 0.70 0.00 0.00 55.95 55.66 1l3h s SER 18 Cb 0.00 -0.50 0.02 0.00 -1.71 0.00 0.00 66.02 63.83 1l3h s SER 18 CO 0.00 0.04 1.09 0.12 1.20 0.00 0.00 173.24 175.68 1l3h s PHE 19 N -2.33 2.75 -0.13 3.44 5.36 -1.26 -4.65 117.98 121.16 1l3h s PHE 19 Ca 0.29 1.52 -0.07 0.00 -0.96 0.00 0.00 56.93 57.72 1l3h s PHE 19 Cb -0.06 -3.04 0.05 0.00 -0.34 0.00 0.00 43.02 39.63 1l3h s PHE 19 CO 0.16 -1.57 0.31 0.50 -1.46 0.00 0.00 175.22 173.17 1l3h s ARG 20 N -4.59 0.28 0.99 10.12 3.52 -1.26 -5.01 118.95 123.00 1l3h s ARG 20 Ca 0.62 0.63 -0.13 0.00 -0.13 0.00 0.00 55.73 56.72 1l3h s ARG 20 Cb -0.17 -0.08 0.19 0.00 -1.56 0.00 0.00 34.95 33.32 1l3h s ARG 20 CO 0.49 -0.16 1.12 -1.25 -0.81 0.00 0.00 175.30 174.69 1l3h s PRO 21 N 1.30 0.46 0.01 5.12 0.04 -1.26 -4.67 135.00 136.00 1l3h s PRO 21 Ca -0.09 0.33 -0.06 0.00 0.04 0.00 0.00 61.00 61.22 1l3h s PRO 21 Cb -0.09 -1.76 -0.00 0.00 0.04 0.00 0.00 34.50 32.69 1l3h s PRO 21 CO -0.10 -2.67 0.12 0.15 0.04 0.00 0.00 177.00 174.53 1l3h s LYS 22 N -5.15 0.48 0.12 4.56 3.01 -1.26 -4.80 119.74 116.70 1l3h s LYS 22 Ca 0.66 -0.46 0.04 0.00 -1.01 0.00 0.00 55.97 55.19 1l3h s LYS 22 Cb -0.16 0.20 -0.04 0.00 -1.01 0.00 0.00 37.83 36.82 1l3h s LYS 22 CO 0.56 -0.11 -0.09 0.00 0.51 0.00 0.00 175.35 176.21 1l3h s ASP 24 N -2.89 3.87 0.45 0.00 1.47 0.32 -4.65 116.67 115.23 1l3h s ASP 24 Ca 0.12 -0.34 0.30 0.00 1.18 0.00 0.00 52.55 53.81 1l3h s ASP 24 Cb 0.01 0.14 1.61 0.00 -0.34 0.00 0.00 42.92 44.34 1l3h s ASP 24 CO -0.01 -2.20 1.93 1.05 0.68 0.00 0.00 175.17 176.61 1l3h h GLU 25 N -0.88 0.00 -0.00 2.11 9.09 -2.01 0.81 114.58 123.69 1l3h h GLU 25 Ca -0.37 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.04 1l3h h GLU 25 Cb 1.25 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.35 1l3h h GLU 25 CO 0.36 0.00 -0.08 0.09 0.05 0.00 0.00 179.01 179.43 1l3h n ASN 26 N -2.58 0.54 0.00 3.06 3.02 -1.26 -4.93 115.26 113.12 1l3h n ASN 26 Ca -0.02 -0.78 0.00 0.00 -0.03 0.00 0.00 54.58 53.76 1l3h n ASN 26 Cb 0.07 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.19 1l3h n ASN 26 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1l3h n GLY 27 N 1.22 0.41 3.81 7.41 0.00 0.28 -5.01 105.19 113.30 1l3h n GLY 27 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 1l3h n GLY 27 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1l3h s ASN 28 N -2.08 7.07 0.03 1.61 2.47 -1.26 -4.19 114.94 118.60 1l3h s ASN 28 Ca 0.00 1.72 -0.36 0.00 0.42 0.00 0.00 52.86 54.64 1l3h s ASN 28 Cb 0.00 -2.54 -0.15 0.00 -1.45 0.00 0.00 41.25 37.11 1l3h s ASN 28 CO 0.00 -0.25 1.58 -1.22 -3.72 0.00 0.00 177.10 173.49 1l3h n TYR 29 N -0.19 2.01 -1.70 0.43 4.02 -1.26 -0.52 117.16 119.94 1l3h n TYR 29 Ca 0.05 0.38 -0.43 0.00 -0.01 0.00 0.00 57.90 57.88 1l3h n TYR 29 Cb 0.53 -2.48 -0.03 0.00 -0.02 0.00 0.00 39.34 37.33 1l3h n TYR 29 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1l3h n LEU 30 N 3.94 3.70 -0.18 7.72 4.77 0.12 -4.68 117.00 132.39 1l3h n LEU 30 Ca 0.20 1.09 0.28 0.00 -0.03 0.00 0.00 56.01 57.56 1l3h n LEU 30 Cb 0.24 -1.52 0.72 0.00 -2.33 0.00 0.00 43.42 40.53 1l3h n LEU 30 CO 0.67 -0.04 1.26 -0.65 -1.33 0.00 0.00 177.39 177.30 1l3h h PRO 31 N 5.80 0.00 -5.67 3.23 0.11 -1.85 -3.38 132.00 130.25 1l3h h PRO 31 Ca -0.45 -0.00 -0.67 0.00 0.11 0.00 0.00 66.00 64.99 1l3h h PRO 31 Cb 1.23 -0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.27 1l3h h PRO 31 CO 0.88 0.00 -0.49 -1.17 -0.21 0.00 0.00 178.00 177.01 1l3h s LEU 32 N -8.54 4.34 0.06 2.35 2.96 -1.26 -0.69 118.68 117.91 1l3h s LEU 32 Ca -0.05 0.44 0.05 0.00 -0.22 0.00 0.00 54.13 54.35 1l3h s LEU 32 Cb 0.21 -2.09 -0.03 0.00 0.50 0.00 0.00 46.19 44.79 1l3h s LEU 32 CO 0.77 0.40 -0.13 -1.10 -1.32 0.00 0.00 176.35 174.97 1l3h s GLN 33 N -1.08 0.76 -0.05 1.98 -1.52 0.16 -4.87 119.66 115.05 1l3h s GLN 33 Ca 0.16 -0.91 -0.02 0.00 -1.95 0.00 0.00 55.36 52.64 1l3h s GLN 33 Cb -0.12 -0.72 0.03 0.00 -0.22 0.00 0.00 33.01 31.97 1l3h s GLN 33 CO 0.05 0.16 0.10 0.00 -0.25 0.00 0.00 175.29 175.35 1l3h n TYR 35 N 3.93 3.39 -0.34 0.00 4.19 0.54 -4.46 117.16 124.41 1l3h n TYR 35 Ca -0.24 -2.90 0.20 0.00 3.31 0.00 0.00 57.90 58.27 1l3h n TYR 35 Cb 0.53 -2.09 0.43 0.00 0.49 0.00 0.00 39.34 38.70 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 8.59 1.77 2.00 2.98 0.00 -1.84 -0.74 103.07 115.83 1l3h h GLY 36 Ca 0.41 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1l3h h GLY 36 CO 1.59 -0.26 0.00 1.76 0.00 0.00 0.00 176.54 179.64 1l3h h SER 37 N 0.50 0.00 -0.00 0.19 0.02 -1.90 -1.13 113.55 111.23 1l3h h SER 37 Ca 0.65 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.60 1l3h h SER 37 Cb 1.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.92 1l3h h SER 37 CO -0.45 0.00 0.00 2.30 -1.14 0.00 0.00 176.83 177.54 1l3h n ILE 38 N -2.47 0.19 -0.60 3.27 -5.35 -0.32 -4.88 119.36 109.20 1l3h n ILE 38 Ca -0.02 -0.59 0.00 0.00 -0.27 0.00 0.00 62.75 61.87 1l3h n ILE 38 Cb 0.06 0.91 0.00 0.00 -1.74 0.00 0.00 39.64 38.87 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 -0.07 1.78 3.79 3.28 0.00 -0.43 -5.02 105.19 108.52 1l3h n GLY 39 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.59 3.73 0.22 1.61 1.51 -1.22 -3.06 117.35 116.55 1l3h s TYR 40 Ca 0.00 1.59 0.04 0.00 -1.01 0.00 0.00 57.07 57.68 1l3h s TYR 40 Cb 0.00 -2.76 -0.05 0.00 -0.11 0.00 0.00 41.96 39.04 1l3h s TYR 40 CO 0.00 0.34 -0.02 0.00 -1.11 0.00 0.00 175.55 174.76 1l3h s TRP 42 N -3.41 0.07 0.33 0.00 -2.14 -0.27 -0.82 118.94 112.70 1l3h s TRP 42 Ca 0.27 -0.42 -0.08 0.00 2.66 0.00 0.00 56.10 58.53 1l3h s TRP 42 Cb 0.05 0.26 -0.06 0.00 -3.10 0.00 0.00 33.47 30.62 1l3h s TRP 42 CO 0.08 -0.88 0.64 0.00 -2.66 0.00 0.00 176.95 174.13 1l3h s VAL 44 N -2.17 1.36 0.55 0.00 -7.23 0.14 -0.44 120.40 112.61 1l3h s VAL 44 Ca 0.47 -2.11 -0.02 0.00 -1.81 0.00 0.00 61.98 58.51 1l3h s VAL 44 Cb -0.11 -1.94 0.02 0.00 0.56 0.00 0.00 36.38 34.91 1l3h s VAL 44 CO 0.29 -0.67 0.81 -0.36 -0.31 0.00 0.00 175.10 174.86 1l3h s PHE 45 N -3.21 3.06 -1.67 2.82 0.08 0.07 -4.21 117.98 114.91 1l3h s PHE 45 Ca 0.19 0.27 0.00 0.00 0.12 0.00 0.00 56.93 57.52 1l3h s PHE 45 Cb 0.02 -2.69 0.00 0.00 -0.57 0.00 0.00 43.02 39.77 1l3h s PHE 45 CO 0.03 -0.80 0.58 -2.30 -0.10 0.00 0.00 175.22 172.63 1l3h n PRO 46 N -2.41 0.00 -0.04 0.24 -0.02 -1.26 -0.50 135.00 131.02 1l3h n PRO 46 Ca 0.05 0.10 0.05 0.00 -2.02 0.00 0.00 63.50 61.69 1l3h n PRO 46 Cb 0.59 -1.51 0.07 0.00 -0.02 0.00 0.00 33.50 32.63 1l3h n PRO 46 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1l3h n ASN 47 N -1.08 2.10 0.00 2.55 6.94 -1.26 -4.49 115.26 120.02 1l3h n ASN 47 Ca 0.00 -1.57 0.00 0.00 -0.02 0.00 0.00 54.58 52.99 1l3h n ASN 47 Cb 0.01 -0.05 0.00 0.00 -2.36 0.00 0.00 39.78 37.38 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 0.56 0.67 3.61 4.83 0.00 0.35 -4.94 105.19 110.27 1l3h n GLY 48 Ca 0.07 0.00 -0.43 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 -2.33 3.46 0.32 2.61 2.01 -1.24 -4.72 115.64 115.74 1l3h s THR 49 Ca 0.00 0.48 -0.29 0.00 0.31 0.00 0.00 61.69 62.19 1l3h s THR 49 Cb 0.00 -3.56 -0.12 0.00 0.01 0.00 0.00 72.50 68.83 1l3h s THR 49 CO 0.00 -0.31 1.36 1.21 -0.69 0.00 0.00 174.62 176.18 1l3h n GLU 50 N 8.24 2.19 -2.73 4.92 2.13 -1.26 -0.75 120.64 133.38 1l3h n GLU 50 Ca 0.23 0.77 -0.42 0.00 0.66 0.00 0.00 57.16 58.40 1l3h n GLU 50 Cb 0.46 -2.40 -0.03 0.00 0.27 0.00 0.00 31.44 29.73 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 -0.76 4.07 -1.07 6.31 1.01 0.42 -4.90 120.40 125.48 1l3h s VAL 51 Ca 0.59 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.54 1l3h s VAL 51 Cb -0.57 -4.78 0.00 0.00 0.00 0.00 0.00 36.38 31.02 1l3h s VAL 51 CO 0.58 -1.62 0.33 -0.81 0.00 0.00 0.00 175.10 173.58 1l3h n PRO 52 N 8.40 0.61 0.00 2.72 -0.04 -1.26 -1.15 135.00 144.28 1l3h n PRO 52 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1l3h n PRO 52 Cb 0.47 -1.28 0.00 0.00 -0.04 0.00 0.00 33.50 32.65 1l3h n PRO 52 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1l3h n ASN 53 N 0.15 0.71 0.02 3.54 4.13 -1.26 -4.67 115.26 117.87 1l3h n ASN 53 Ca 0.00 -0.92 0.11 0.00 1.68 0.00 0.00 54.58 55.45 1l3h n ASN 53 Cb 0.14 0.10 -0.05 0.00 -1.54 0.00 0.00 39.78 38.44 1l3h n ASN 53 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1l3h n THR 54 N -0.10 0.12 -1.53 3.41 -2.24 -0.30 -4.98 114.28 108.66 1l3h n THR 54 Ca 0.00 -0.26 -0.48 0.00 -2.27 0.00 0.00 64.05 61.04 1l3h n THR 54 Cb 0.04 0.29 -0.06 0.00 -2.10 0.00 0.00 70.33 68.51 1l3h n THR 54 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1l3h n ARG 55 N -1.97 1.49 -4.00 -0.78 0.00 -1.26 -4.55 116.66 105.61 1l3h n ARG 55 Ca 0.01 0.43 -0.10 0.00 -0.00 0.00 0.00 57.85 58.19 1l3h n ARG 55 Cb 0.45 -2.72 -0.07 0.00 0.00 0.00 0.00 32.46 30.12 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 7.17 0.00 0.00 6.15 0.15 0.00 -5.01 113.70 122.16 1l3h s SER 56 Ca 1.05 -0.94 0.00 0.00 0.70 0.00 0.00 55.95 56.75 1l3h s SER 56 Cb -0.68 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.12 1l3h s SER 56 CO 0.45 -0.97 0.77 0.54 1.20 0.00 0.00 173.24 175.23 1l3h n ARG 57 N -0.28 0.86 -3.88 5.44 3.00 -1.26 -0.60 116.66 119.93 1l3h n ARG 57 Ca -0.04 0.00 0.02 0.00 -0.01 0.00 0.00 57.85 57.82 1l3h n ARG 57 Cb 0.63 -1.09 0.01 0.00 0.00 0.00 0.00 32.46 32.01 1l3h n ARG 57 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1l3h s GLY 58 N -0.93 -0.18 0.87 -0.13 0.00 -1.17 -4.56 107.32 101.21 1l3h s GLY 58 Ca 0.00 0.18 -0.12 0.00 0.00 0.00 0.00 44.72 44.77 1l3h s GLY 58 CO 0.00 3.90 0.96 1.42 0.00 0.00 0.00 173.10 179.38 1l3h n HIS 59 N -0.78 0.38 -3.88 1.90 8.25 -1.26 -4.19 115.22 115.65 1l3h n HIS 59 Ca -0.00 0.36 -0.09 0.00 -0.26 0.00 0.00 57.72 57.73 1l3h n HIS 59 Cb 0.60 -1.99 -0.04 0.00 1.12 0.00 0.00 29.99 29.68 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 -2.34 0.06 -1.35 4.41 -3.43 -1.26 -5.06 115.29 106.32 1l3h s HIS 60 Ca 0.67 -0.44 -0.09 0.00 -0.80 0.00 0.00 55.06 54.40 1l3h s HIS 60 Cb -0.26 0.39 0.11 0.00 -1.43 0.00 0.00 32.58 31.39 1l3h s HIS 60 CO 0.57 -1.03 2.19 0.09 -2.00 0.00 0.00 174.74 174.57 1l3h n ASN 61 N -0.38 6.31 -4.72 7.38 3.02 -1.26 -4.87 115.26 120.73 1l3h n ASN 61 Ca -0.05 -3.04 -0.31 0.00 -0.03 0.00 0.00 54.58 51.15 1l3h n ASN 61 Cb 0.61 -1.47 0.13 0.00 -0.61 0.00 0.00 39.78 38.44 1l3h n ASN 61 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1l3h n SER 63 N -3.84 0.00 -0.76 0.00 7.64 -1.26 -4.83 113.62 110.56 1l3h n SER 63 Ca 0.09 -1.10 0.00 0.00 1.01 0.00 0.00 58.87 58.87 1l3h n SER 63 Cb 0.53 -0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.71 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 0.00 0.88 0.00 1.43 4.71 -1.26 -5.03 120.64 121.36 1l3h n GLU 64 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1l3h n GLU 64 Cb 0.52 -1.24 0.00 0.00 -1.01 0.00 0.00 31.44 29.71 1l3h n GLU 64 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65