#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 2.98 0.27 -5.08 -4.23 -1.26 -4.84 115.64 103.47 1l3h s THR 2 Ca 0.00 0.09 0.00 0.00 -1.18 0.00 0.00 61.69 60.60 1l3h s THR 2 Cb 0.00 -3.27 0.26 0.00 1.34 0.00 0.00 72.50 70.83 1l3h s THR 2 CO 0.00 -0.32 1.80 0.50 -0.54 0.00 0.00 174.62 176.06 1l3h h LYS 3 N -0.59 0.78 0.78 3.99 3.64 -1.99 0.15 116.57 123.33 1l3h h LYS 3 Ca -0.45 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 58.85 1l3h h LYS 3 Cb 1.28 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.92 1l3h h LYS 3 CO 0.63 0.52 -0.49 0.00 -2.27 0.00 0.00 179.45 177.83 1l3h h GLN 5 N -1.19 1.09 0.69 0.00 4.20 -1.57 0.80 115.11 119.12 1l3h h GLN 5 Ca -0.10 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.51 1l3h h GLN 5 Cb 0.96 -0.24 0.01 0.00 0.30 0.00 0.00 27.48 28.50 1l3h h GLN 5 CO 0.10 0.72 -0.33 0.93 -0.67 0.00 0.00 178.83 179.58 1l3h h GLU 6 N 1.12 -0.89 -0.69 1.46 5.08 -0.71 -1.11 114.58 118.83 1l3h h GLU 6 Ca 0.39 0.06 0.06 0.00 -1.00 0.00 0.00 59.36 58.87 1l3h h GLU 6 Cb 0.11 0.20 -0.06 0.00 0.50 0.00 0.00 28.75 29.51 1l3h h GLU 6 CO -0.14 -0.59 0.39 0.93 -1.00 0.00 0.00 179.01 178.60 1l3h h GLU 7 N -0.94 0.69 -0.47 2.33 5.08 -0.41 -0.52 114.58 120.35 1l3h h GLU 7 Ca -0.09 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1l3h h GLU 7 Cb 0.71 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 1l3h h GLU 7 CO 0.16 0.46 0.24 0.28 -1.00 0.00 0.00 179.01 179.14 1l3h h VAL 8 N 0.71 1.15 -0.05 3.13 2.07 -0.85 0.22 116.25 122.63 1l3h h VAL 8 Ca 0.31 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1l3h h VAL 8 Cb 0.21 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1l3h h VAL 8 CO -0.19 0.17 0.00 -1.20 0.02 0.00 0.00 177.57 176.37 1l3h n SER 9 N -4.41 0.63 0.00 0.57 7.64 -0.33 -4.24 113.62 113.48 1l3h n SER 9 Ca 0.04 -1.43 0.00 0.00 1.01 0.00 0.00 58.87 58.49 1l3h n SER 9 Cb 0.11 -0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 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 -0.41 0.00 -3.03 1.43 -0.00 -0.47 -4.97 115.22 107.77 1l3h n HIS 10 Ca 0.17 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.47 1l3h n HIS 10 Cb 0.18 0.00 -0.06 0.00 -0.00 0.00 0.00 29.99 30.11 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 -1.57 4.79 0.79 1.59 1.01 0.69 -5.08 121.20 123.42 1l3h s ILE 11 Ca 0.00 0.66 -0.11 0.00 0.00 0.00 0.00 60.65 61.20 1l3h s ILE 11 Cb 0.00 -4.17 0.06 0.00 0.01 0.00 0.00 42.46 38.36 1l3h s ILE 11 CO 0.00 -0.43 1.09 -2.16 0.00 0.00 0.00 174.94 173.44 1l3h s PRO 12 N 2.96 2.16 0.63 2.79 0.04 -1.26 -4.69 135.00 137.62 1l3h s PRO 12 Ca 0.28 0.73 0.35 0.00 0.04 0.00 0.00 61.00 62.39 1l3h s PRO 12 Cb -0.14 -1.92 1.96 0.00 0.04 0.00 0.00 34.50 34.45 1l3h s PRO 12 CO 0.17 -1.59 2.20 0.00 0.04 0.00 0.00 177.00 177.82 1l3h h ALA 13 N -1.07 1.40 -0.30 8.56 0.00 -1.98 -3.19 119.26 122.68 1l3h h ALA 13 Ca -0.47 -0.00 -0.70 0.00 0.00 0.00 0.00 54.91 53.75 1l3h h ALA 13 Cb 1.26 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.00 1l3h h ALA 13 CO 0.58 -0.14 2.79 0.28 0.00 0.00 0.00 179.25 182.76 1l3h n VAL 14 N -3.42 3.59 -1.58 0.00 0.31 -1.26 -4.76 118.33 111.21 1l3h n VAL 14 Ca -0.01 -3.36 -0.19 0.00 -0.01 0.00 0.00 64.34 60.76 1l3h n VAL 14 Cb 0.20 -2.51 0.11 0.00 -0.91 0.00 0.00 33.84 30.73 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 6.97 2.27 -1.54 3.52 1.44 -1.21 -5.07 115.22 121.60 1l3h n HIS 15 Ca 0.51 -2.17 -0.51 0.00 -2.01 0.00 0.00 57.72 53.53 1l3h n HIS 15 Cb 0.41 -0.72 -0.05 0.00 0.12 0.00 0.00 29.99 29.75 1l3h n HIS 15 CO 0.00 0.00 0.00 -2.30 -2.81 0.00 0.00 176.34 171.23 1l3h n PRO 16 N -0.95 0.73 0.00 -1.40 -0.02 -1.26 -0.85 135.00 131.24 1l3h n PRO 16 Ca 0.46 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 1l3h n PRO 16 Cb 0.97 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.74 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 1.95 2.96 3.45 -1.23 0.00 -1.26 -5.00 105.19 106.06 1l3h n GLY 17 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.73 2.32 0.22 1.61 0.15 -0.03 -5.01 113.70 109.23 1l3h s SER 18 Ca 0.00 -1.50 -0.04 0.00 0.70 0.00 0.00 55.95 55.11 1l3h s SER 18 Cb 0.00 0.20 -0.05 0.00 -1.71 0.00 0.00 66.02 64.46 1l3h s SER 18 CO 0.00 -0.76 0.46 0.12 1.20 0.00 0.00 173.24 174.26 1l3h s PHE 19 N -3.35 3.47 -0.03 3.44 5.36 -1.26 -4.08 117.98 121.53 1l3h s PHE 19 Ca 0.32 0.56 -0.01 0.00 -0.96 0.00 0.00 56.93 56.84 1l3h s PHE 19 Cb 0.06 -2.03 0.03 0.00 -0.34 0.00 0.00 43.02 40.74 1l3h s PHE 19 CO 0.15 0.31 0.05 0.50 -1.46 0.00 0.00 175.22 174.76 1l3h s ARG 20 N -3.17 -0.04 1.08 10.12 3.52 -1.26 -5.01 118.95 124.19 1l3h s ARG 20 Ca 0.42 0.30 -0.17 0.00 -0.13 0.00 0.00 55.73 56.16 1l3h s ARG 20 Cb -0.11 -0.43 0.24 0.00 -1.56 0.00 0.00 34.95 33.08 1l3h s ARG 20 CO 0.27 -0.27 1.16 -1.25 -0.81 0.00 0.00 175.30 174.40 1l3h s PRO 21 N 1.77 -0.29 -0.02 5.12 0.04 -1.26 -4.68 135.00 135.68 1l3h s PRO 21 Ca -0.00 -0.05 -0.11 0.00 0.04 0.00 0.00 61.00 60.89 1l3h s PRO 21 Cb -0.12 -1.70 0.01 0.00 0.04 0.00 0.00 34.50 32.73 1l3h s PRO 21 CO -0.03 -3.09 0.23 -1.59 0.04 0.00 0.00 177.00 172.56 1l3h s LYS 22 N -5.46 0.53 0.10 4.56 0.00 -1.26 -4.78 119.74 113.43 1l3h s LYS 22 Ca 0.70 -0.17 0.03 0.00 0.00 0.00 0.00 55.97 56.52 1l3h s LYS 22 Cb -0.10 0.23 -0.04 0.00 0.00 0.00 0.00 37.83 37.92 1l3h s LYS 22 CO 0.55 -0.13 -0.08 0.00 0.00 0.00 0.00 175.35 175.69 1l3h n ASP 24 N 0.15 0.77 0.22 0.00 5.75 0.41 -4.68 116.55 119.18 1l3h n ASP 24 Ca -0.13 -1.67 0.15 0.00 -0.01 0.00 0.00 54.79 53.13 1l3h n ASP 24 Cb 0.60 -0.42 0.80 0.00 -1.03 0.00 0.00 41.12 41.07 1l3h n ASP 24 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 1l3h h GLU 25 N 0.00 0.00 -0.01 0.11 9.09 -2.01 -0.23 114.58 121.53 1l3h h GLU 25 Ca -0.21 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.20 1l3h h GLU 25 Cb 0.75 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.85 1l3h h GLU 25 CO 0.22 0.00 -0.33 0.09 0.05 0.00 0.00 179.01 179.03 1l3h n ASN 26 N -2.58 1.05 0.00 3.06 3.02 -1.26 -4.95 115.26 113.61 1l3h n ASN 26 Ca -0.01 -0.87 0.00 0.00 -0.03 0.00 0.00 54.58 53.67 1l3h n ASN 26 Cb 0.08 0.21 0.00 0.00 -0.61 0.00 0.00 39.78 39.46 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 1.38 0.57 3.82 7.41 0.00 -0.10 -4.98 105.19 113.29 1l3h n GLY 27 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.34 6.49 0.05 1.61 -0.87 -1.26 -4.28 114.94 114.34 1l3h s ASN 28 Ca 0.00 1.72 -0.34 0.00 -1.57 0.00 0.00 52.86 52.67 1l3h s ASN 28 Cb 0.00 -2.53 -0.13 0.00 -0.02 0.00 0.00 41.25 38.57 1l3h s ASN 28 CO 0.00 -0.68 1.72 -1.22 -2.57 0.00 0.00 177.10 174.36 1l3h n TYR 29 N -1.30 2.31 -1.70 2.20 4.02 -1.18 -0.44 117.16 121.07 1l3h n TYR 29 Ca 0.08 0.13 -0.41 0.00 -0.01 0.00 0.00 57.90 57.69 1l3h n TYR 29 Cb 0.53 -2.61 0.01 0.00 -0.02 0.00 0.00 39.34 37.26 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 4.95 4.02 0.17 7.72 4.77 0.15 -4.61 117.00 134.18 1l3h n LEU 30 Ca 0.19 1.09 0.17 0.00 -0.03 0.00 0.00 56.01 57.44 1l3h n LEU 30 Cb 0.29 -1.49 0.64 0.00 -2.33 0.00 0.00 43.42 40.53 1l3h n LEU 30 CO 0.68 -0.72 1.15 -0.65 -1.33 0.00 0.00 177.39 176.52 1l3h h PRO 31 N 1.98 0.00 -5.96 3.23 0.11 -1.91 -3.38 132.00 126.08 1l3h h PRO 31 Ca -0.48 0.00 -0.68 0.00 0.11 0.00 0.00 66.00 64.95 1l3h h PRO 31 Cb 1.30 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 32.18 1l3h h PRO 31 CO 0.59 0.00 -0.75 -1.17 -0.21 0.00 0.00 178.00 176.47 1l3h s LEU 32 N -6.39 2.85 0.10 2.35 2.96 -1.26 -0.50 118.68 118.79 1l3h s LEU 32 Ca -0.03 -0.19 0.05 0.00 -0.22 0.00 0.00 54.13 53.74 1l3h s LEU 32 Cb 0.11 -1.61 -0.03 0.00 0.50 0.00 0.00 46.19 45.15 1l3h s LEU 32 CO 0.37 0.29 -0.14 -1.10 -1.32 0.00 0.00 176.35 174.45 1l3h s GLN 33 N -0.40 0.93 -0.07 1.98 -1.52 -0.07 -4.86 119.66 115.65 1l3h s GLN 33 Ca 0.05 -1.11 -0.03 0.00 -1.95 0.00 0.00 55.36 52.32 1l3h s GLN 33 Cb -0.12 -0.86 0.04 0.00 -0.22 0.00 0.00 33.01 31.84 1l3h s GLN 33 CO 0.02 0.18 0.15 0.00 -0.25 0.00 0.00 175.29 175.38 1l3h n TYR 35 N 4.21 3.84 -0.31 0.00 4.19 0.92 -4.36 117.16 125.66 1l3h n TYR 35 Ca -0.27 -2.95 0.14 0.00 3.31 0.00 0.00 57.90 58.14 1l3h n TYR 35 Cb 0.52 -2.38 0.32 0.00 0.49 0.00 0.00 39.34 38.28 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 10.03 1.53 1.88 2.98 0.00 -1.78 -1.23 103.07 116.49 1l3h h GLY 36 Ca 0.47 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.68 1l3h h GLY 36 CO 1.65 -0.34 0.00 -1.26 0.00 0.00 0.00 176.54 176.59 1l3h n SER 37 N -5.12 0.00 0.00 0.19 2.88 -1.26 -1.45 113.62 108.86 1l3h n SER 37 Ca 0.23 0.42 0.00 0.00 -1.33 0.00 0.00 58.87 58.19 1l3h n SER 37 Cb 0.71 -0.44 0.00 0.00 -0.75 0.00 0.00 64.21 63.73 1l3h n SER 37 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1l3h n ILE 38 N -1.44 0.03 -0.98 2.46 -5.35 -0.51 -4.72 119.36 108.84 1l3h n ILE 38 Ca 0.01 -0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.14 1l3h n ILE 38 Cb 0.05 1.30 0.00 0.00 -1.74 0.00 0.00 39.64 39.25 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 -0.01 0.53 3.71 3.28 0.00 -0.53 -5.02 105.19 107.15 1l3h n GLY 39 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.30 3.60 0.26 1.61 2.02 -1.21 -2.36 117.35 118.98 1l3h s TYR 40 Ca 0.00 1.52 0.12 0.00 -0.37 0.00 0.00 57.07 58.34 1l3h s TYR 40 Cb 0.00 -3.03 -0.05 0.00 -0.40 0.00 0.00 41.96 38.48 1l3h s TYR 40 CO 0.00 -0.03 -0.18 0.00 -1.57 0.00 0.00 175.55 173.77 1l3h s TRP 42 N -2.31 -0.01 0.41 0.00 -2.14 -0.20 -0.55 118.94 114.14 1l3h s TRP 42 Ca 0.28 -0.36 -0.10 0.00 2.66 0.00 0.00 56.10 58.58 1l3h s TRP 42 Cb -0.06 0.10 -0.06 0.00 -3.10 0.00 0.00 33.47 30.35 1l3h s TRP 42 CO 0.15 -0.63 0.77 0.00 -2.66 0.00 0.00 176.95 174.58 1l3h s VAL 44 N -2.40 0.89 0.62 0.00 -7.23 0.34 -0.22 120.40 112.42 1l3h s VAL 44 Ca 0.51 -1.54 -0.12 0.00 -1.81 0.00 0.00 61.98 59.02 1l3h s VAL 44 Cb -0.10 -1.24 -0.03 0.00 0.56 0.00 0.00 36.38 35.56 1l3h s VAL 44 CO 0.32 -0.51 1.03 -0.36 -0.31 0.00 0.00 175.10 175.27 1l3h s PHE 45 N -2.22 3.43 -1.16 2.82 0.08 0.45 -4.45 117.98 116.92 1l3h s PHE 45 Ca 0.03 1.37 0.07 0.00 0.12 0.00 0.00 56.93 58.51 1l3h s PHE 45 Cb -0.04 -2.79 0.31 0.00 -0.57 0.00 0.00 43.02 39.93 1l3h s PHE 45 CO 0.00 -0.81 1.16 -0.35 -0.10 0.00 0.00 175.22 175.13 1l3h n PRO 46 N -2.62 0.04 0.03 0.24 -0.04 -1.26 -0.46 135.00 130.94 1l3h n PRO 46 Ca 0.07 0.32 0.13 0.00 -0.04 0.00 0.00 63.50 63.98 1l3h n PRO 46 Cb 0.54 -1.50 0.35 0.00 -0.04 0.00 0.00 33.50 32.85 1l3h n PRO 46 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1l3h n ASN 47 N -1.42 0.47 0.00 3.54 6.94 -1.26 -3.13 115.26 120.41 1l3h n ASN 47 Ca 0.02 0.19 0.00 0.00 -0.02 0.00 0.00 54.58 54.77 1l3h n ASN 47 Cb 0.07 -0.15 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 1.42 0.46 3.73 4.83 0.00 0.40 -4.92 105.19 111.10 1l3h n GLY 48 Ca 0.05 0.00 -0.41 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 3.92 0.64 2.61 2.01 -1.25 -4.79 115.64 116.78 1l3h s THR 49 Ca 0.00 1.52 -0.15 0.00 0.31 0.00 0.00 61.69 63.37 1l3h s THR 49 Cb 0.00 -3.97 -0.01 0.00 0.01 0.00 0.00 72.50 68.53 1l3h s THR 49 CO 0.00 0.20 1.09 -1.83 -0.69 0.00 0.00 174.62 173.39 1l3h s GLU 50 N 0.25 2.95 -0.43 4.92 -1.05 -1.26 -0.41 118.70 123.67 1l3h s GLU 50 Ca 0.54 1.31 -0.26 0.00 -0.15 0.00 0.00 54.97 56.41 1l3h s GLU 50 Cb -0.30 -1.98 0.02 0.00 -0.44 0.00 0.00 34.13 31.44 1l3h s GLU 50 CO 0.33 -1.12 0.93 0.08 0.95 0.00 0.00 175.26 176.43 1l3h s VAL 51 N -2.41 4.51 0.59 1.83 1.01 0.70 -4.78 120.40 121.84 1l3h s VAL 51 Ca 0.65 0.90 -0.18 0.00 0.00 0.00 0.00 61.98 63.35 1l3h s VAL 51 Cb -0.19 -4.40 -0.07 0.00 0.00 0.00 0.00 36.38 31.72 1l3h s VAL 51 CO 0.41 -0.73 0.61 -2.65 0.00 0.00 0.00 175.10 172.74 1l3h n PRO 52 N 7.04 0.57 -0.61 2.72 -0.02 -1.26 -2.61 135.00 140.81 1l3h n PRO 52 Ca 0.06 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1l3h n PRO 52 Cb 0.48 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 1l3h n PRO 52 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1l3h n ASN 53 N 0.16 -0.86 0.14 2.55 3.02 -1.26 -4.80 115.26 114.21 1l3h n ASN 53 Ca 0.12 0.00 -0.00 0.00 -0.03 0.00 0.00 54.58 54.67 1l3h n ASN 53 Cb 0.48 -2.41 0.16 0.00 -0.61 0.00 0.00 39.78 37.39 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 1.29 -0.33 3.41 1.35 -1.88 -3.46 112.91 113.30 1l3h h THR 54 Ca 0.00 -2.18 -0.57 0.00 -0.55 0.00 0.00 66.41 63.11 1l3h h THR 54 Cb 0.14 2.23 -0.06 0.00 -1.73 0.00 0.00 68.15 68.72 1l3h h THR 54 CO 0.00 0.59 1.62 -1.14 -0.25 0.00 0.00 175.52 176.34 1l3h n ARG 55 N -3.60 0.25 -4.15 4.72 3.00 -1.25 -4.65 116.66 110.97 1l3h n ARG 55 Ca -0.00 0.03 -0.10 0.00 -0.00 0.00 0.00 57.85 57.78 1l3h n ARG 55 Cb 0.65 -1.86 -0.10 0.00 0.00 0.00 0.00 32.46 31.15 1l3h n ARG 55 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1l3h s SER 56 N 8.67 0.69 0.00 6.15 0.01 0.29 -4.98 113.70 124.53 1l3h s SER 56 Ca 1.25 -1.10 0.00 0.00 1.31 0.00 0.00 55.95 57.41 1l3h s SER 56 Cb -1.12 0.19 0.00 0.00 0.21 0.00 0.00 66.02 65.30 1l3h s SER 56 CO 0.49 -0.61 0.37 0.54 0.41 0.00 0.00 173.24 174.44 1l3h n ARG 57 N -0.05 0.45 -3.71 12.44 5.12 -1.26 -0.58 116.66 129.07 1l3h n ARG 57 Ca -0.10 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.82 1l3h n ARG 57 Cb 0.62 -1.08 0.00 0.00 -1.16 0.00 0.00 32.46 30.84 1l3h n ARG 57 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1l3h n GLY 58 N 0.07 -1.32 3.65 -0.13 0.00 -0.99 -4.73 105.19 101.74 1l3h n GLY 58 Ca 0.00 -1.10 -0.36 0.00 0.00 0.00 0.00 46.02 44.56 1l3h n GLY 58 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1l3h n HIS 59 N 6.42 1.04 -3.71 1.61 -0.00 -1.26 -4.27 115.22 115.06 1l3h n HIS 59 Ca 0.00 0.41 -0.12 0.00 0.46 0.00 0.00 57.72 58.47 1l3h n HIS 59 Cb 0.00 -2.13 -0.07 0.00 -0.12 0.00 0.00 29.99 27.67 1l3h n HIS 59 CO 0.00 0.00 0.00 -3.38 0.46 0.00 0.00 176.34 173.42 1l3h s HIS 60 N -1.72 -0.16 -1.18 1.57 -3.43 -1.26 -5.08 115.29 104.02 1l3h s HIS 60 Ca 0.76 0.01 -0.07 0.00 -0.80 0.00 0.00 55.06 54.96 1l3h s HIS 60 Cb -0.35 0.15 0.23 0.00 -1.43 0.00 0.00 32.58 31.18 1l3h s HIS 60 CO 0.48 -0.56 1.67 0.09 -2.00 0.00 0.00 174.74 174.42 1l3h n ASN 61 N 0.39 5.71 -4.53 7.38 4.13 -1.26 -4.94 115.26 122.14 1l3h n ASN 61 Ca -0.18 -3.24 -0.48 0.00 1.68 0.00 0.00 54.58 52.36 1l3h n ASN 61 Cb 0.60 -1.39 -0.06 0.00 -1.54 0.00 0.00 39.78 37.40 1l3h n ASN 61 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1l3h n SER 63 N 9.81 2.69 -1.86 0.00 3.41 -1.26 -4.22 113.62 122.19 1l3h n SER 63 Ca 0.35 -2.70 -0.16 0.00 -0.26 0.00 0.00 58.87 56.11 1l3h n SER 63 Cb 0.30 -1.21 -0.04 0.00 -0.26 0.00 0.00 64.21 63.00 1l3h n SER 63 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1l3h n GLU 64 N 7.05 -1.62 0.00 4.33 1.02 -1.26 -5.16 120.64 125.00 1l3h n GLU 64 Ca 0.49 0.85 0.00 0.00 -0.02 0.00 0.00 57.16 58.48 1l3h n GLU 64 Cb 0.41 -5.28 0.00 0.00 -0.02 0.00 0.00 31.44 26.55 1l3h n GLU 64 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74