#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 2.77 0.31 -5.08 -4.23 -1.26 -4.84 115.64 103.31 1l3h s THR 2 Ca 0.00 0.01 0.05 0.00 -1.18 0.00 0.00 61.69 60.57 1l3h s THR 2 Cb 0.00 -3.20 0.30 0.00 1.34 0.00 0.00 72.50 70.94 1l3h s THR 2 CO 0.00 -0.23 1.82 0.50 -0.54 0.00 0.00 174.62 176.16 1l3h h LYS 3 N -0.62 0.79 0.95 3.99 3.64 -1.96 0.17 116.57 123.53 1l3h h LYS 3 Ca -0.45 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 58.84 1l3h h LYS 3 Cb 1.29 -0.18 0.01 0.00 -0.41 0.00 0.00 32.23 32.94 1l3h h LYS 3 CO 0.62 0.52 -0.48 0.00 -2.27 0.00 0.00 179.45 177.85 1l3h h GLN 5 N -1.30 0.94 0.83 0.00 4.20 -1.58 0.75 115.11 118.95 1l3h h GLN 5 Ca -0.13 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.48 1l3h h GLN 5 Cb 1.00 -0.21 0.01 0.00 0.30 0.00 0.00 27.48 28.58 1l3h h GLN 5 CO 0.20 0.62 -0.40 0.93 -0.67 0.00 0.00 178.83 179.51 1l3h h GLU 6 N 0.96 -1.08 -0.92 1.46 5.08 -0.69 -0.75 114.58 118.65 1l3h h GLU 6 Ca 0.27 0.07 0.07 0.00 -1.00 0.00 0.00 59.36 58.77 1l3h h GLU 6 Cb -0.08 0.25 -0.07 0.00 0.50 0.00 0.00 28.75 29.35 1l3h h GLU 6 CO -0.06 -0.71 0.58 0.93 -1.00 0.00 0.00 179.01 178.74 1l3h h GLU 7 N -1.18 1.01 0.00 2.33 5.08 -0.54 0.20 114.58 121.48 1l3h h GLU 7 Ca -0.11 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.09 1l3h h GLU 7 Cb 0.87 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 1l3h h GLU 7 CO 0.19 0.67 -0.47 0.28 -1.00 0.00 0.00 179.01 178.68 1l3h h VAL 8 N 1.04 1.28 -0.15 3.13 2.07 -0.89 0.19 116.25 122.91 1l3h h VAL 8 Ca 0.41 -1.65 -0.15 0.00 0.82 0.00 0.00 66.70 66.13 1l3h h VAL 8 Cb 0.20 1.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1l3h h VAL 8 CO -0.18 0.46 -0.49 0.28 0.02 0.00 0.00 177.57 177.65 1l3h h SER 9 N 0.00 0.70 0.39 0.57 0.02 -0.12 -3.38 113.55 111.73 1l3h h SER 9 Ca -0.00 -0.60 -0.29 0.00 -0.84 0.00 0.00 61.79 60.06 1l3h h SER 9 Cb 0.86 -0.20 0.02 0.00 0.14 0.00 0.00 62.40 63.22 1l3h h SER 9 CO 0.06 1.18 -1.25 0.45 -1.14 0.00 0.00 176.83 176.13 1l3h h HIS 10 N 0.25 0.74 -3.12 3.45 -0.00 -0.43 -3.40 115.15 112.64 1l3h h HIS 10 Ca -0.02 -0.50 -0.65 0.00 -0.00 0.00 0.00 60.37 59.20 1l3h h HIS 10 Cb 1.12 -0.05 -0.16 0.00 -0.00 0.00 0.00 27.41 28.33 1l3h h HIS 10 CO 0.10 1.37 0.30 0.42 -0.00 0.00 0.00 177.93 180.12 1l3h s ILE 11 N -2.81 4.63 0.96 2.45 1.01 0.64 -5.07 121.20 123.01 1l3h s ILE 11 Ca -0.07 -0.26 -0.12 0.00 0.00 0.00 0.00 60.65 60.20 1l3h s ILE 11 Cb 0.06 -4.45 0.17 0.00 0.01 0.00 0.00 42.46 38.25 1l3h s ILE 11 CO 0.91 -1.03 1.10 -2.16 0.00 0.00 0.00 174.94 173.76 1l3h s PRO 12 N 3.28 0.70 0.60 2.79 0.04 -1.26 -4.60 135.00 136.56 1l3h s PRO 12 Ca 0.21 0.48 0.30 0.00 0.04 0.00 0.00 61.00 62.03 1l3h s PRO 12 Cb -0.17 -1.77 1.68 0.00 0.04 0.00 0.00 34.50 34.28 1l3h s PRO 12 CO 0.14 -2.54 2.07 0.00 0.04 0.00 0.00 177.00 176.71 1l3h h ALA 13 N -1.75 1.74 0.00 8.56 0.00 -1.96 -3.07 119.26 122.78 1l3h h ALA 13 Ca -0.53 -0.01 -0.67 0.00 0.00 0.00 0.00 54.91 53.71 1l3h h ALA 13 Cb 1.32 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 1l3h h ALA 13 CO 0.58 -0.34 2.91 0.28 0.00 0.00 0.00 179.25 182.68 1l3h n VAL 14 N -3.62 2.95 -0.17 0.00 0.31 -1.26 -4.67 118.33 111.87 1l3h n VAL 14 Ca 0.02 -2.42 0.09 0.00 -0.01 0.00 0.00 64.34 62.02 1l3h n VAL 14 Cb 0.36 -2.49 0.24 0.00 -0.91 0.00 0.00 33.84 31.04 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 6.19 0.69 -1.47 3.52 1.44 -1.16 -5.06 115.22 119.37 1l3h n HIS 15 Ca 0.53 -0.44 -0.51 0.00 -2.01 0.00 0.00 57.72 55.30 1l3h n HIS 15 Cb 0.36 -0.01 -0.04 0.00 0.12 0.00 0.00 29.99 30.42 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 1.20 0.27 0.00 -1.40 -0.02 -1.26 -0.84 135.00 132.94 1l3h n PRO 16 Ca 0.19 0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1l3h n PRO 16 Cb 0.54 -1.32 0.00 0.00 -0.02 0.00 0.00 33.50 32.70 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 1.81 3.00 3.36 -1.23 0.00 -1.26 -5.03 105.19 105.84 1l3h n GLY 17 Ca 0.17 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.33 1.96 0.29 1.61 1.04 -0.02 -5.02 113.70 112.22 1l3h s SER 18 Ca 0.00 -1.26 -0.22 0.00 0.48 0.00 0.00 55.95 54.95 1l3h s SER 18 Cb 0.00 -0.01 -0.09 0.00 0.10 0.00 0.00 66.02 66.02 1l3h s SER 18 CO 0.00 -0.53 0.84 0.12 0.98 0.00 0.00 173.24 174.65 1l3h s PHE 19 N -3.39 3.63 -0.07 5.02 5.36 -1.26 -4.20 117.98 123.07 1l3h s PHE 19 Ca 0.31 1.57 -0.00 0.00 -0.96 0.00 0.00 56.93 57.85 1l3h s PHE 19 Cb 0.06 -2.77 0.02 0.00 -0.34 0.00 0.00 43.02 40.00 1l3h s PHE 19 CO 0.11 0.24 -0.04 0.50 -1.46 0.00 0.00 175.22 174.57 1l3h s ARG 20 N -2.13 0.91 1.24 10.12 3.52 -1.26 -5.05 118.95 126.29 1l3h s ARG 20 Ca 0.48 -0.06 -0.18 0.00 -0.13 0.00 0.00 55.73 55.84 1l3h s ARG 20 Cb -0.17 -1.05 0.30 0.00 -1.56 0.00 0.00 34.95 32.47 1l3h s ARG 20 CO 0.22 -0.20 1.04 -2.14 -0.81 0.00 0.00 175.30 173.40 1l3h s PRO 21 N 1.48 -1.48 0.02 5.12 0.02 -1.26 -4.73 135.00 134.17 1l3h s PRO 21 Ca -0.02 0.21 0.02 0.00 0.02 0.00 0.00 61.00 61.23 1l3h s PRO 21 Cb -0.13 -1.54 -0.02 0.00 0.02 0.00 0.00 34.50 32.83 1l3h s PRO 21 CO -0.03 -3.94 -0.06 0.15 -0.33 0.00 0.00 177.00 172.79 1l3h s LYS 22 N -5.09 0.43 0.07 5.54 3.01 -1.26 -4.86 119.74 117.57 1l3h s LYS 22 Ca 0.69 -0.52 0.02 0.00 -1.01 0.00 0.00 55.97 55.16 1l3h s LYS 22 Cb -0.14 -0.25 -0.03 0.00 -1.01 0.00 0.00 37.83 36.39 1l3h s LYS 22 CO 0.58 0.05 -0.08 0.00 0.51 0.00 0.00 175.35 176.41 1l3h n ASP 24 N 0.92 1.09 0.30 0.00 5.75 0.10 -4.64 116.55 120.07 1l3h n ASP 24 Ca -0.19 -1.86 0.16 0.00 -0.01 0.00 0.00 54.79 52.89 1l3h n ASP 24 Cb 0.57 -0.37 0.92 0.00 -1.03 0.00 0.00 41.12 41.21 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 -0.22 0.11 9.09 -1.98 0.75 114.58 122.34 1l3h h GLU 25 Ca -0.20 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.21 1l3h h GLU 25 Cb 0.81 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.91 1l3h h GLU 25 CO 0.24 0.02 0.00 0.09 0.05 0.00 0.00 179.01 179.42 1l3h n ASN 26 N -3.68 1.27 0.00 3.06 3.02 -1.26 -4.93 115.26 112.74 1l3h n ASN 26 Ca -0.03 -1.91 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 1l3h n ASN 26 Cb 0.11 -0.14 0.00 0.00 -0.61 0.00 0.00 39.78 39.14 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 0.92 0.28 3.91 7.41 0.00 0.26 -4.98 105.19 112.98 1l3h n GLY 27 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.24 4.73 0.26 1.61 0.01 -1.26 -4.35 114.94 113.70 1l3h s ASN 28 Ca 0.00 0.63 -0.31 0.00 -0.71 0.00 0.00 52.86 52.48 1l3h s ASN 28 Cb 0.00 -1.23 -0.11 0.00 0.41 0.00 0.00 41.25 40.32 1l3h s ASN 28 CO 0.00 -1.70 1.60 -0.31 -1.51 0.00 0.00 177.10 175.18 1l3h s TYR 29 N -3.39 2.84 0.52 2.20 1.51 -0.69 -0.72 117.35 119.61 1l3h s TYR 29 Ca 0.61 0.70 -0.22 0.00 -1.01 0.00 0.00 57.07 57.14 1l3h s TYR 29 Cb -0.11 -4.05 -0.06 0.00 -0.11 0.00 0.00 41.96 37.63 1l3h s TYR 29 CO 0.47 -3.63 1.27 1.28 -1.11 0.00 0.00 175.55 173.83 1l3h n LEU 30 N 2.72 4.79 0.12 -1.29 4.77 0.23 -4.60 117.00 123.75 1l3h n LEU 30 Ca 0.10 0.99 0.11 0.00 -0.03 0.00 0.00 56.01 57.19 1l3h n LEU 30 Cb 0.37 -1.53 0.48 0.00 -2.33 0.00 0.00 43.42 40.42 1l3h n LEU 30 CO 0.63 -0.79 0.84 -0.81 -1.33 0.00 0.00 177.39 175.93 1l3h n PRO 31 N -0.68 0.17 -4.59 3.23 -0.04 -1.26 -4.35 135.00 127.48 1l3h n PRO 31 Ca 0.10 0.44 -0.34 0.00 -0.04 0.00 0.00 63.50 63.66 1l3h n PRO 31 Cb 0.43 -1.85 -0.12 0.00 -0.04 0.00 0.00 33.50 31.92 1l3h n PRO 31 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1l3h s LEU 32 N -4.36 3.12 0.08 1.53 2.96 -1.26 -0.66 118.68 120.09 1l3h s LEU 32 Ca 0.04 -0.10 0.06 0.00 -0.22 0.00 0.00 54.13 53.91 1l3h s LEU 32 Cb 0.09 -1.70 -0.03 0.00 0.50 0.00 0.00 46.19 45.04 1l3h s LEU 32 CO 0.36 0.28 -0.17 -1.10 -1.32 0.00 0.00 176.35 174.40 1l3h s GLN 33 N -0.29 0.93 -0.02 1.98 -1.52 0.10 -4.82 119.66 116.03 1l3h s GLN 33 Ca 0.04 -1.03 -0.01 0.00 -1.95 0.00 0.00 55.36 52.41 1l3h s GLN 33 Cb -0.13 -1.02 0.02 0.00 -0.22 0.00 0.00 33.01 31.66 1l3h s GLN 33 CO 0.02 0.23 0.04 0.00 -0.25 0.00 0.00 175.29 175.34 1l3h n TYR 35 N 3.65 3.86 -0.34 0.00 4.19 0.41 -4.42 117.16 124.51 1l3h n TYR 35 Ca -0.20 -2.95 0.23 0.00 3.31 0.00 0.00 57.90 58.29 1l3h n TYR 35 Cb 0.55 -2.43 0.49 0.00 0.49 0.00 0.00 39.34 38.44 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 10.25 1.43 2.00 2.98 0.00 -1.80 0.23 103.07 118.16 1l3h h GLY 36 Ca 0.48 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1l3h h GLY 36 CO 1.67 -0.21 0.00 -1.26 0.00 0.00 0.00 176.54 176.74 1l3h n SER 37 N -4.72 0.21 0.00 0.19 2.88 -1.26 -2.02 113.62 108.91 1l3h n SER 37 Ca 0.27 0.58 0.00 0.00 -1.33 0.00 0.00 58.87 58.39 1l3h n SER 37 Cb 0.91 -0.61 0.00 0.00 -0.75 0.00 0.00 64.21 63.75 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 -1.76 0.00 -0.98 2.46 -5.35 -0.02 -4.75 119.36 108.95 1l3h n ILE 38 Ca 0.01 -0.38 0.00 0.00 -0.27 0.00 0.00 62.75 62.11 1l3h n ILE 38 Cb 0.08 1.11 0.00 0.00 -1.74 0.00 0.00 39.64 39.09 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 0.40 0.45 3.83 3.28 0.00 -0.63 -5.04 105.19 107.49 1l3h n GLY 39 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.04 3.46 0.16 1.61 1.51 -1.24 -3.64 117.35 117.17 1l3h s TYR 40 Ca 0.00 1.40 0.02 0.00 -1.01 0.00 0.00 57.07 57.48 1l3h s TYR 40 Cb 0.00 -2.66 -0.05 0.00 -0.11 0.00 0.00 41.96 39.14 1l3h s TYR 40 CO 0.00 0.12 -0.00 0.00 -1.11 0.00 0.00 175.55 174.56 1l3h s TRP 42 N -3.68 0.21 0.36 0.00 -2.14 -0.14 -0.39 118.94 113.15 1l3h s TRP 42 Ca 0.23 -0.58 -0.08 0.00 2.66 0.00 0.00 56.10 58.33 1l3h s TRP 42 Cb 0.06 0.05 -0.06 0.00 -3.10 0.00 0.00 33.47 30.42 1l3h s TRP 42 CO 0.03 -0.71 0.68 0.00 -2.66 0.00 0.00 176.95 174.28 1l3h s VAL 44 N -2.28 1.02 0.77 0.00 -7.23 0.16 -0.52 120.40 112.33 1l3h s VAL 44 Ca 0.48 -1.75 -0.11 0.00 -1.81 0.00 0.00 61.98 58.79 1l3h s VAL 44 Cb -0.10 -1.49 0.05 0.00 0.56 0.00 0.00 36.38 35.40 1l3h s VAL 44 CO 0.32 -0.59 1.10 -0.36 -0.31 0.00 0.00 175.10 175.25 1l3h s PHE 45 N -2.63 2.97 0.54 2.82 0.08 0.49 -4.63 117.98 117.60 1l3h s PHE 45 Ca 0.08 1.11 0.30 0.00 0.12 0.00 0.00 56.93 58.55 1l3h s PHE 45 Cb -0.02 -3.12 1.47 0.00 -0.57 0.00 0.00 43.02 40.78 1l3h s PHE 45 CO 0.00 -1.61 1.91 -1.35 -0.10 0.00 0.00 175.22 174.07 1l3h h PRO 46 N -0.97 0.00 0.00 0.24 0.11 -1.85 0.48 132.00 130.01 1l3h h PRO 46 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1l3h h PRO 46 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1l3h h PRO 46 CO 0.61 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.67 1l3h n ASN 47 N -4.29 0.00 0.00 -2.05 6.94 -1.26 -1.71 115.26 112.90 1l3h n ASN 47 Ca 0.17 -0.04 0.00 0.00 -0.02 0.00 0.00 54.58 54.68 1l3h n ASN 47 Cb 0.89 -0.32 0.00 0.00 -2.36 0.00 0.00 39.78 37.99 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 1.27 0.67 3.70 4.83 0.00 0.16 -4.92 105.19 110.89 1l3h n GLY 48 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.53 3.70 0.83 2.61 2.01 -1.26 -4.78 115.64 116.22 1l3h s THR 49 Ca 0.00 1.13 -0.11 0.00 0.31 0.00 0.00 61.69 63.02 1l3h s THR 49 Cb 0.00 -3.72 0.09 0.00 0.01 0.00 0.00 72.50 68.88 1l3h s THR 49 CO 0.00 0.02 1.09 -1.83 -0.69 0.00 0.00 174.62 173.22 1l3h s GLU 50 N 2.03 1.76 -0.69 4.92 1.03 -1.26 -0.38 118.70 126.11 1l3h s GLU 50 Ca 0.63 1.08 -0.15 0.00 0.03 0.00 0.00 54.97 56.56 1l3h s GLU 50 Cb -0.32 -1.85 0.17 0.00 -0.80 0.00 0.00 34.13 31.33 1l3h s GLU 50 CO 0.27 -1.97 0.66 0.08 -1.33 0.00 0.00 175.26 172.97 1l3h s VAL 51 N -2.88 5.35 -0.64 1.83 1.01 0.32 -4.79 120.40 120.60 1l3h s VAL 51 Ca 0.62 -1.91 0.00 0.00 0.00 0.00 0.00 61.98 60.70 1l3h s VAL 51 Cb -0.18 -4.43 0.00 0.00 0.00 0.00 0.00 36.38 31.77 1l3h s VAL 51 CO 0.57 -0.98 0.31 -0.81 0.00 0.00 0.00 175.10 174.18 1l3h n PRO 52 N 4.79 0.46 0.00 2.72 -0.04 -1.26 -0.92 135.00 140.74 1l3h n PRO 52 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1l3h n PRO 52 Cb 0.44 -1.24 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 0.45 0.47 0.15 3.54 5.03 -1.26 -4.73 115.26 118.91 1l3h n ASN 53 Ca 0.00 -0.77 0.12 0.00 0.87 0.00 0.00 54.58 54.80 1l3h n ASN 53 Cb 0.16 0.27 0.06 0.00 -1.02 0.00 0.00 39.78 39.25 1l3h n ASN 53 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.26 176.14 1l3h h THR 54 N 0.16 0.00 -1.17 3.41 1.35 -1.41 -3.47 112.91 111.78 1l3h h THR 54 Ca 0.00 -0.99 -0.50 0.00 -0.55 0.00 0.00 66.41 64.36 1l3h h THR 54 Cb 0.08 1.67 -0.02 0.00 -1.73 0.00 0.00 68.15 68.15 1l3h h THR 54 CO 0.00 0.00 1.63 -1.14 -0.25 0.00 0.00 175.52 175.76 1l3h n ARG 55 N -2.82 0.84 -4.31 4.72 0.00 -1.26 -4.61 116.66 109.23 1l3h n ARG 55 Ca 0.01 0.06 -0.16 0.00 -0.00 0.00 0.00 57.85 57.77 1l3h n ARG 55 Cb 0.54 -2.84 -0.10 0.00 0.00 0.00 0.00 32.46 30.06 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 10.63 1.64 0.00 6.15 0.01 0.47 -4.98 113.70 127.63 1l3h s SER 56 Ca 1.09 -1.22 0.02 0.00 1.31 0.00 0.00 55.95 57.15 1l3h s SER 56 Cb -0.53 0.04 0.09 0.00 0.21 0.00 0.00 66.02 65.83 1l3h s SER 56 CO 0.35 -0.54 0.83 0.54 0.41 0.00 0.00 173.24 174.84 1l3h n ARG 57 N -0.38 0.03 -2.41 12.44 5.12 -1.26 -0.76 116.66 129.44 1l3h n ARG 57 Ca -0.05 0.24 0.00 0.00 -1.93 0.00 0.00 57.85 56.11 1l3h n ARG 57 Cb 0.64 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.44 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 -1.11 0.70 3.54 -0.13 0.00 -1.24 -4.42 105.19 102.53 1l3h n GLY 58 Ca 0.01 -0.93 -0.30 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.27 -0.39 -3.89 1.61 8.25 -1.26 -4.09 115.22 115.18 1l3h n HIS 59 Ca 0.01 0.11 -0.09 0.00 -0.26 0.00 0.00 57.72 57.49 1l3h n HIS 59 Cb 0.18 -1.82 -0.04 0.00 1.12 0.00 0.00 29.99 29.42 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 -2.50 0.11 -1.16 4.41 -3.43 -1.26 -5.05 115.29 106.41 1l3h s HIS 60 Ca 0.67 -0.49 -0.07 0.00 -0.80 0.00 0.00 55.06 54.37 1l3h s HIS 60 Cb -0.24 0.33 -0.04 0.00 -1.43 0.00 0.00 32.58 31.21 1l3h s HIS 60 CO 0.62 -1.00 2.87 0.09 -2.00 0.00 0.00 174.74 175.33 1l3h n ASN 61 N -0.37 7.78 -4.74 7.38 4.13 -1.26 -4.93 115.26 123.24 1l3h n ASN 61 Ca -0.05 -2.80 -0.31 0.00 1.68 0.00 0.00 54.58 53.10 1l3h n ASN 61 Cb 0.62 -1.44 0.11 0.00 -1.54 0.00 0.00 39.78 37.52 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 -3.59 -0.04 -0.57 0.00 7.64 -1.26 -4.87 113.62 110.93 1l3h n SER 63 Ca 0.10 -1.31 0.00 0.00 1.01 0.00 0.00 58.87 58.67 1l3h n SER 63 Cb 0.53 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 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 0.01 0.53 0.00 1.43 1.02 -1.26 -5.01 120.64 117.36 1l3h n GLU 64 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1l3h n GLU 64 Cb 0.57 -1.26 0.00 0.00 -0.02 0.00 0.00 31.44 30.73 1l3h n GLU 64 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74