#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 0.00 0.32 1.96 -4.23 -1.26 -5.02 115.64 107.41 1l3h s THR 2 Ca 0.00 -1.86 0.09 0.00 -1.18 0.00 0.00 61.69 58.74 1l3h s THR 2 Cb 0.00 -2.46 0.31 0.00 1.34 0.00 0.00 72.50 71.69 1l3h s THR 2 CO 0.00 0.00 1.75 0.50 -0.54 0.00 0.00 174.62 176.33 1l3h h LYS 3 N 2.44 0.60 0.63 3.99 3.64 -1.98 0.13 116.57 126.02 1l3h h LYS 3 Ca -0.32 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.00 1l3h h LYS 3 Cb 1.25 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1l3h h LYS 3 CO 0.46 0.40 -0.35 0.00 -2.27 0.00 0.00 179.45 177.69 1l3h h GLN 5 N -0.90 0.07 0.80 0.00 4.20 -1.65 -0.47 115.11 117.16 1l3h h GLN 5 Ca -0.08 -0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 1l3h h GLN 5 Cb 0.71 -0.01 0.01 0.00 0.30 0.00 0.00 27.48 28.48 1l3h h GLN 5 CO 0.11 0.17 -0.39 0.93 -0.67 0.00 0.00 178.83 178.98 1l3h h GLU 6 N 0.07 -1.04 -0.46 1.46 5.08 -0.71 -0.89 114.58 118.08 1l3h h GLU 6 Ca 0.01 0.07 0.08 0.00 -1.00 0.00 0.00 59.36 58.53 1l3h h GLU 6 Cb 0.21 0.24 -0.07 0.00 0.50 0.00 0.00 28.75 29.63 1l3h h GLU 6 CO 0.01 -0.68 0.05 0.93 -1.00 0.00 0.00 179.01 178.32 1l3h h GLU 7 N -1.16 0.16 0.00 2.33 5.08 -0.40 -0.12 114.58 120.47 1l3h h GLU 7 Ca -0.11 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 1l3h h GLU 7 Cb 0.84 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.05 1l3h h GLU 7 CO 0.18 0.11 -0.12 0.28 -1.00 0.00 0.00 179.01 178.46 1l3h h VAL 8 N 0.17 0.72 -0.12 3.13 2.07 -1.14 0.13 116.25 121.21 1l3h h VAL 8 Ca 0.23 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.26 1l3h h VAL 8 Cb 0.32 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1l3h h VAL 8 CO -0.34 0.12 0.00 -1.20 0.02 0.00 0.00 177.57 176.17 1l3h n SER 9 N -3.86 1.55 0.00 0.57 7.64 -0.18 -4.52 113.62 114.82 1l3h n SER 9 Ca -0.02 -1.64 0.00 0.00 1.01 0.00 0.00 58.87 58.22 1l3h n SER 9 Cb 0.22 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.34 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 0.23 0.00 -2.63 1.43 -0.00 -0.42 -5.02 115.22 108.81 1l3h n HIS 10 Ca 0.17 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.46 1l3h n HIS 10 Cb 0.32 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.29 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 -1.45 4.51 0.84 1.59 1.01 0.33 -5.04 121.20 122.98 1l3h s ILE 11 Ca 0.00 1.76 -0.11 0.00 0.00 0.00 0.00 60.65 62.29 1l3h s ILE 11 Cb 0.00 -4.39 0.09 0.00 0.01 0.00 0.00 42.46 38.18 1l3h s ILE 11 CO 0.00 -0.44 1.09 -2.16 0.00 0.00 0.00 174.94 173.43 1l3h s PRO 12 N 3.62 1.73 0.55 2.79 0.04 -1.26 -4.93 135.00 137.54 1l3h s PRO 12 Ca 0.46 0.95 0.24 0.00 0.04 0.00 0.00 61.00 62.69 1l3h s PRO 12 Cb -0.13 -1.85 1.55 0.00 0.04 0.00 0.00 34.50 34.11 1l3h s PRO 12 CO 0.14 -1.95 2.19 0.00 0.04 0.00 0.00 177.00 177.42 1l3h h ALA 13 N -1.34 1.67 -0.12 8.56 0.00 -2.00 -3.24 119.26 122.80 1l3h h ALA 13 Ca -0.47 -0.02 -0.67 0.00 0.00 0.00 0.00 54.91 53.75 1l3h h ALA 13 Cb 1.26 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1l3h h ALA 13 CO 0.54 0.03 2.70 0.28 0.00 0.00 0.00 179.25 182.80 1l3h n VAL 14 N -4.09 2.97 -1.51 0.00 0.31 -1.26 -4.62 118.33 110.13 1l3h n VAL 14 Ca -0.03 -2.68 -0.02 0.00 -0.01 0.00 0.00 64.34 61.60 1l3h n VAL 14 Cb 0.11 -2.48 0.20 0.00 -0.91 0.00 0.00 33.84 30.76 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 7.15 0.85 -1.78 3.52 1.44 -1.22 -5.08 115.22 120.10 1l3h n HIS 15 Ca 0.51 -1.61 -0.43 0.00 -2.01 0.00 0.00 57.72 54.18 1l3h n HIS 15 Cb 0.41 -0.44 -0.03 0.00 0.12 0.00 0.00 29.99 30.05 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 -3.26 3.54 0.00 -1.40 0.04 -1.26 -0.59 135.00 132.07 1l3h s PRO 16 Ca 0.43 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.49 1l3h s PRO 16 Cb 0.40 -4.23 0.00 0.00 0.04 0.00 0.00 34.50 30.71 1l3h s PRO 16 CO -0.02 -1.63 0.00 0.41 0.04 0.00 0.00 177.00 175.80 1l3h n GLY 17 N 5.19 2.07 3.73 0.56 0.00 -1.26 -5.10 105.19 110.39 1l3h n GLY 17 Ca 0.24 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.71 4.26 0.47 1.61 0.15 0.25 -4.98 113.70 113.74 1l3h s SER 18 Ca 0.00 -1.25 -0.04 0.00 0.70 0.00 0.00 55.95 55.36 1l3h s SER 18 Cb 0.00 -0.24 -0.03 0.00 -1.71 0.00 0.00 66.02 64.04 1l3h s SER 18 CO 0.00 -0.61 0.75 0.12 1.20 0.00 0.00 173.24 174.70 1l3h s PHE 19 N -2.68 3.53 -0.06 3.44 5.36 -1.26 -4.11 117.98 122.20 1l3h s PHE 19 Ca 0.34 0.72 -0.02 0.00 -0.96 0.00 0.00 56.93 57.01 1l3h s PHE 19 Cb 0.05 -2.26 0.04 0.00 -0.34 0.00 0.00 43.02 40.50 1l3h s PHE 19 CO 0.19 -0.25 0.11 0.50 -1.46 0.00 0.00 175.22 174.31 1l3h s ARG 20 N -4.69 -0.00 0.97 10.12 3.52 -1.25 -5.02 118.95 122.60 1l3h s ARG 20 Ca 0.47 0.42 -0.15 0.00 -0.13 0.00 0.00 55.73 56.34 1l3h s ARG 20 Cb -0.10 -0.32 0.18 0.00 -1.56 0.00 0.00 34.95 33.15 1l3h s ARG 20 CO 0.43 -0.27 1.22 -1.25 -0.81 0.00 0.00 175.30 174.62 1l3h s PRO 21 N 1.89 0.63 0.02 5.12 0.04 -1.26 -4.31 135.00 137.12 1l3h s PRO 21 Ca -0.00 -0.10 -0.00 0.00 0.04 0.00 0.00 61.00 60.93 1l3h s PRO 21 Cb -0.12 -1.82 -0.02 0.00 0.04 0.00 0.00 34.50 32.59 1l3h s PRO 21 CO -0.05 -2.47 -0.02 0.15 0.04 0.00 0.00 177.00 174.65 1l3h s LYS 22 N -5.61 0.30 0.08 4.56 3.01 -1.26 -4.81 119.74 116.01 1l3h s LYS 22 Ca 0.69 -0.57 -0.06 0.00 -1.01 0.00 0.00 55.97 55.03 1l3h s LYS 22 Cb -0.09 0.11 -0.02 0.00 -1.01 0.00 0.00 37.83 36.83 1l3h s LYS 22 CO 0.53 -0.05 0.12 0.00 0.51 0.00 0.00 175.35 176.45 1l3h s ASP 24 N -2.90 3.93 0.53 0.00 1.47 -0.23 -4.72 116.67 114.75 1l3h s ASP 24 Ca 0.08 0.10 0.20 0.00 1.18 0.00 0.00 52.55 54.11 1l3h s ASP 24 Cb 0.06 -0.40 1.35 0.00 -0.34 0.00 0.00 42.92 43.60 1l3h s ASP 24 CO -0.09 -2.18 2.12 -0.08 0.68 0.00 0.00 175.17 175.62 1l3h h GLU 25 N -1.03 0.00 -0.46 2.11 4.81 -2.03 -2.75 114.58 115.23 1l3h h GLU 25 Ca -0.42 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 1l3h h GLU 25 Cb 1.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 1l3h h GLU 25 CO 0.44 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 178.81 1l3h n ASN 26 N -4.42 1.19 0.00 1.04 4.13 -1.26 -4.87 115.26 111.07 1l3h n ASN 26 Ca 0.00 -2.07 0.00 0.00 1.68 0.00 0.00 54.58 54.19 1l3h n ASN 26 Cb 0.23 -0.27 0.00 0.00 -1.54 0.00 0.00 39.78 38.20 1l3h n ASN 26 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1l3h n GLY 27 N 0.46 0.20 3.86 7.41 0.00 -1.04 -4.99 105.19 111.10 1l3h n GLY 27 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.05 6.72 0.12 1.61 0.01 -1.26 -4.49 114.94 115.59 1l3h s ASN 28 Ca 0.00 0.95 -0.31 0.00 -0.71 0.00 0.00 52.86 52.79 1l3h s ASN 28 Cb 0.00 -2.24 -0.10 0.00 0.41 0.00 0.00 41.25 39.32 1l3h s ASN 28 CO 0.00 0.06 1.73 -0.31 -1.51 0.00 0.00 177.10 177.07 1l3h s TYR 29 N -1.56 2.42 0.47 2.20 1.51 0.41 -1.06 117.35 121.73 1l3h s TYR 29 Ca 0.40 0.21 -0.24 0.00 -1.01 0.00 0.00 57.07 56.42 1l3h s TYR 29 Cb -0.14 -4.07 -0.08 0.00 -0.11 0.00 0.00 41.96 37.56 1l3h s TYR 29 CO 0.20 -4.29 1.33 1.28 -1.11 0.00 0.00 175.55 172.95 1l3h n LEU 30 N 5.31 4.69 0.20 -1.29 4.77 -0.07 -4.37 117.00 126.23 1l3h n LEU 30 Ca 0.16 1.07 0.16 0.00 -0.03 0.00 0.00 56.01 57.38 1l3h n LEU 30 Cb 0.39 -1.55 0.65 0.00 -2.33 0.00 0.00 43.42 40.59 1l3h n LEU 30 CO 0.64 -0.53 1.14 -0.65 -1.33 0.00 0.00 177.39 176.66 1l3h h PRO 31 N 1.94 0.00 -6.09 3.23 0.11 -1.87 -3.39 132.00 125.93 1l3h h PRO 31 Ca -0.49 0.00 -0.68 0.00 0.11 0.00 0.00 66.00 64.93 1l3h h PRO 31 Cb 1.29 0.00 -0.26 0.00 0.11 0.00 0.00 31.00 32.15 1l3h h PRO 31 CO 0.59 0.00 -0.79 -1.17 -0.21 0.00 0.00 178.00 176.42 1l3h s LEU 32 N -6.31 2.60 0.05 2.35 2.96 -1.26 -0.44 118.68 118.63 1l3h s LEU 32 Ca -0.03 -0.28 0.05 0.00 -0.22 0.00 0.00 54.13 53.64 1l3h s LEU 32 Cb 0.10 -1.53 -0.02 0.00 0.50 0.00 0.00 46.19 45.24 1l3h s LEU 32 CO 0.35 0.29 -0.14 -1.10 -1.32 0.00 0.00 176.35 174.44 1l3h s GLN 33 N -0.42 0.86 -0.06 1.98 -1.52 -0.09 -4.74 119.66 115.67 1l3h s GLN 33 Ca 0.05 -0.81 -0.01 0.00 -1.95 0.00 0.00 55.36 52.64 1l3h s GLN 33 Cb -0.12 -0.86 0.03 0.00 -0.22 0.00 0.00 33.01 31.83 1l3h s GLN 33 CO 0.02 0.20 -0.00 0.00 -0.25 0.00 0.00 175.29 175.26 1l3h n TYR 35 N 4.89 3.29 -0.23 0.00 4.19 0.87 -3.81 117.16 126.35 1l3h n TYR 35 Ca -0.12 -2.89 0.23 0.00 3.31 0.00 0.00 57.90 58.44 1l3h n TYR 35 Cb 0.50 -2.23 0.59 0.00 0.49 0.00 0.00 39.34 38.69 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 8.95 0.60 1.23 2.98 0.00 -1.81 -1.16 103.07 113.86 1l3h h GLY 36 Ca 0.47 -0.12 0.07 0.00 0.00 0.00 0.00 47.33 47.75 1l3h h GLY 36 CO 1.73 -0.02 0.32 1.76 0.00 0.00 0.00 176.54 180.32 1l3h h SER 37 N 0.26 0.00 -0.03 0.19 0.02 -1.89 -0.60 113.55 111.50 1l3h h SER 37 Ca 0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.42 1l3h h SER 37 Cb 1.40 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.94 1l3h h SER 37 CO -0.13 0.00 0.00 2.30 -1.14 0.00 0.00 176.83 177.86 1l3h n ILE 38 N -3.60 0.65 -0.96 3.27 -5.35 -0.46 -4.72 119.36 108.19 1l3h n ILE 38 Ca 0.03 -0.82 0.00 0.00 -0.27 0.00 0.00 62.75 61.69 1l3h n ILE 38 Cb 0.45 0.69 0.00 0.00 -1.74 0.00 0.00 39.64 39.04 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 -0.19 0.36 3.87 3.28 0.00 -0.23 -5.01 105.19 107.27 1l3h n GLY 39 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.84 3.42 0.12 1.61 1.51 -1.14 -3.60 117.35 117.43 1l3h s TYR 40 Ca 0.00 0.88 0.03 0.00 -1.01 0.00 0.00 57.07 56.97 1l3h s TYR 40 Cb 0.00 -2.27 -0.04 0.00 -0.11 0.00 0.00 41.96 39.54 1l3h s TYR 40 CO 0.00 0.25 -0.07 0.00 -1.11 0.00 0.00 175.55 174.63 1l3h s TRP 42 N -3.54 0.47 0.36 0.00 -2.14 -0.11 -0.80 118.94 113.17 1l3h s TRP 42 Ca 0.15 -0.88 -0.14 0.00 2.66 0.00 0.00 56.10 57.89 1l3h s TRP 42 Cb 0.05 -0.21 -0.08 0.00 -3.10 0.00 0.00 33.47 30.12 1l3h s TRP 42 CO -0.02 -0.58 0.75 0.00 -2.66 0.00 0.00 176.95 174.44 1l3h s VAL 44 N -2.13 1.03 0.65 0.00 -7.23 0.41 -0.33 120.40 112.80 1l3h s VAL 44 Ca 0.53 -1.68 -0.11 0.00 -1.81 0.00 0.00 61.98 58.92 1l3h s VAL 44 Cb -0.10 -1.42 -0.02 0.00 0.56 0.00 0.00 36.38 35.40 1l3h s VAL 44 CO 0.22 -0.54 1.04 -0.36 -0.31 0.00 0.00 175.10 175.16 1l3h s PHE 45 N -2.43 3.38 0.61 2.82 0.08 0.47 -4.46 117.98 118.45 1l3h s PHE 45 Ca 0.07 1.36 0.28 0.00 0.12 0.00 0.00 56.93 58.75 1l3h s PHE 45 Cb -0.03 -2.80 1.43 0.00 -0.57 0.00 0.00 43.02 41.05 1l3h s PHE 45 CO 0.01 -0.95 1.83 -1.35 -0.10 0.00 0.00 175.22 174.66 1l3h h PRO 46 N -0.49 0.00 -0.00 0.24 0.11 -1.76 0.15 132.00 130.24 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 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1l3h h PRO 46 CO 0.59 0.00 -0.06 0.27 -0.21 0.00 0.00 178.00 178.59 1l3h n ASN 47 N -3.47 0.27 0.00 -2.05 6.94 -1.26 -0.44 115.26 115.25 1l3h n ASN 47 Ca 0.07 -0.45 0.00 0.00 -0.02 0.00 0.00 54.58 54.18 1l3h n ASN 47 Cb 0.68 -0.14 0.00 0.00 -2.36 0.00 0.00 39.78 37.96 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 1.26 0.54 3.62 4.83 0.00 0.52 -4.87 105.19 111.09 1l3h n GLY 48 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 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 3.74 0.28 2.61 2.01 -1.23 -4.75 115.64 116.30 1l3h s THR 49 Ca 0.00 0.82 -0.30 0.00 0.31 0.00 0.00 61.69 62.52 1l3h s THR 49 Cb 0.00 -3.80 -0.13 0.00 0.01 0.00 0.00 72.50 68.59 1l3h s THR 49 CO 0.00 -0.37 1.38 1.21 -0.69 0.00 0.00 174.62 176.16 1l3h n GLU 50 N 7.74 2.14 -2.73 4.92 2.13 -1.26 -0.39 120.64 133.19 1l3h n GLU 50 Ca 0.19 0.76 -0.43 0.00 0.66 0.00 0.00 57.16 58.33 1l3h n GLU 50 Cb 0.46 -2.40 -0.03 0.00 0.27 0.00 0.00 31.44 29.74 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 -0.43 4.35 0.79 6.31 1.01 0.55 -4.86 120.40 128.13 1l3h s VAL 51 Ca 0.63 0.91 -0.13 0.00 0.00 0.00 0.00 61.98 63.39 1l3h s VAL 51 Cb -0.60 -4.51 0.08 0.00 0.00 0.00 0.00 36.38 31.34 1l3h s VAL 51 CO 0.54 -0.93 1.18 -2.16 0.00 0.00 0.00 175.10 173.73 1l3h s PRO 52 N 4.07 1.78 0.00 2.72 0.04 -1.26 -2.83 135.00 139.51 1l3h s PRO 52 Ca 0.41 1.65 0.00 0.00 0.04 0.00 0.00 61.00 63.10 1l3h s PRO 52 Cb -0.09 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.65 1l3h s PRO 52 CO 0.28 -2.09 0.00 0.09 0.04 0.00 0.00 177.00 175.33 1l3h n ASN 53 N -3.28 -1.17 0.13 6.66 4.13 -1.26 -4.80 115.26 115.67 1l3h n ASN 53 Ca 0.13 0.00 -0.02 0.00 1.68 0.00 0.00 54.58 56.37 1l3h n ASN 53 Cb 0.51 -2.63 0.18 0.00 -1.54 0.00 0.00 39.78 36.30 1l3h n ASN 53 CO 0.00 0.00 0.00 0.71 0.28 0.00 0.00 177.26 178.25 1l3h h THR 54 N 0.00 1.40 -1.46 3.41 1.35 -1.90 -3.46 112.91 112.24 1l3h h THR 54 Ca 0.00 -1.93 -0.76 0.00 -0.55 0.00 0.00 66.41 63.17 1l3h h THR 54 Cb 0.20 2.01 0.02 0.00 -1.73 0.00 0.00 68.15 68.64 1l3h h THR 54 CO 0.00 0.56 0.84 -2.11 -0.25 0.00 0.00 175.52 174.56 1l3h n ARG 55 N -3.88 0.96 -3.84 4.72 -4.01 -1.26 -4.73 116.66 104.62 1l3h n ARG 55 Ca -0.02 0.35 -0.10 0.00 -1.04 0.00 0.00 57.85 57.05 1l3h n ARG 55 Cb 0.58 -2.00 -0.05 0.00 -3.04 0.00 0.00 32.46 27.94 1l3h n ARG 55 CO 0.00 0.00 0.00 -1.12 -3.04 0.00 0.00 177.63 173.47 1l3h s SER 56 N 3.30 -0.12 0.00 2.89 0.01 0.02 -4.99 113.70 114.81 1l3h s SER 56 Ca 0.99 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 57.60 1l3h s SER 56 Cb -1.14 0.51 0.00 0.00 0.21 0.00 0.00 66.02 65.60 1l3h s SER 56 CO 0.67 -0.97 0.54 0.54 0.41 0.00 0.00 173.24 174.43 1l3h n ARG 57 N -0.28 0.85 -3.98 12.44 3.00 -1.26 -0.33 116.66 127.10 1l3h n ARG 57 Ca -0.09 0.00 0.01 0.00 -0.01 0.00 0.00 57.85 57.76 1l3h n ARG 57 Cb 0.63 -1.31 0.01 0.00 0.00 0.00 0.00 32.46 31.79 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 -0.42 -0.06 0.99 -0.13 0.00 -1.24 -4.74 107.32 101.72 1l3h s GLY 58 Ca 0.00 -0.07 -0.12 0.00 0.00 0.00 0.00 44.72 44.53 1l3h s GLY 58 CO 0.00 5.14 1.08 0.30 0.00 0.00 0.00 173.10 179.62 1l3h s HIS 59 N -2.03 1.96 0.22 1.90 3.76 -1.26 -4.21 115.29 115.62 1l3h s HIS 59 Ca 0.28 1.20 -0.16 0.00 -0.15 0.00 0.00 55.06 56.23 1l3h s HIS 59 Cb -0.01 -3.19 0.02 0.00 1.11 0.00 0.00 32.58 30.50 1l3h s HIS 59 CO 0.01 -2.94 0.52 -3.38 -0.85 0.00 0.00 174.74 168.10 1l3h s HIS 60 N -2.81 0.03 -1.60 1.40 -3.43 -1.26 -5.07 115.29 102.55 1l3h s HIS 60 Ca 0.65 -0.39 -0.10 0.00 -0.80 0.00 0.00 55.06 54.42 1l3h s HIS 60 Cb -0.20 0.35 -0.07 0.00 -1.43 0.00 0.00 32.58 31.23 1l3h s HIS 60 CO 0.59 -0.96 2.86 0.09 -2.00 0.00 0.00 174.74 175.32 1l3h n ASN 61 N -0.36 8.16 -4.55 7.38 4.13 -1.26 -4.94 115.26 123.83 1l3h n ASN 61 Ca -0.07 -2.62 -0.36 0.00 1.68 0.00 0.00 54.58 53.21 1l3h n ASN 61 Cb 0.62 -1.57 -0.03 0.00 -1.54 0.00 0.00 39.78 37.26 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 14.29 1.51 -1.65 0.00 2.88 -1.26 -4.44 113.62 124.95 1l3h n SER 63 Ca 0.29 -1.71 -0.07 0.00 -1.33 0.00 0.00 58.87 56.05 1l3h n SER 63 Cb 0.52 -0.43 0.18 0.00 -0.75 0.00 0.00 64.21 63.74 1l3h n SER 63 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1l3h n GLU 64 N 0.26 2.60 0.00 -1.46 4.71 -1.26 -5.17 120.64 120.32 1l3h n GLU 64 Ca 0.00 -2.04 0.00 0.00 -0.01 0.00 0.00 57.16 55.11 1l3h n GLU 64 Cb 0.30 -1.88 0.00 0.00 -1.01 0.00 0.00 31.44 28.84 1l3h n GLU 64 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65