#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ijc s GLU 2 N 0.00 1.06 0.46 2.12 2.02 -1.26 -2.12 118.70 120.97 1ijc s GLU 2 Ca 0.00 -0.52 0.07 0.00 0.02 0.00 0.00 54.97 54.54 1ijc s GLU 2 Cb 0.00 -1.03 -0.00 0.00 0.10 0.00 0.00 34.13 33.20 1ijc s GLU 2 CO 0.00 0.28 0.39 0.00 0.02 0.00 0.00 175.26 175.95 1ijc s TYR 4 N -2.57 3.63 0.68 0.00 5.04 -1.25 -1.44 117.35 121.44 1ijc s TYR 4 Ca 0.45 -2.63 -0.03 0.00 -2.44 0.00 0.00 57.07 52.42 1ijc s TYR 4 Cb -0.02 -2.99 0.09 0.00 0.35 0.00 0.00 41.96 39.39 1ijc s TYR 4 CO 0.26 -0.95 0.95 -0.98 -1.34 0.00 0.00 175.55 173.50 1ijc s ARG 5 N 1.05 2.00 -0.23 4.97 1.70 -0.09 -4.30 118.95 124.04 1ijc s ARG 5 Ca 0.08 -0.75 0.02 0.00 -0.47 0.00 0.00 55.73 54.62 1ijc s ARG 5 Cb -0.21 -2.31 0.05 0.00 -0.57 0.00 0.00 34.95 31.91 1ijc s ARG 5 CO -0.06 -1.24 -0.13 0.00 -1.08 0.00 0.00 175.30 172.80 1ijc n GLY 7 N 4.50 -1.48 0.16 0.00 0.00 0.39 -4.90 105.19 103.86 1ijc n GLY 7 Ca -0.16 -1.16 -0.23 0.00 0.00 0.00 0.00 46.02 44.47 1ijc n GLY 7 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1ijc h VAL 8 N 0.00 1.30 0.00 1.61 3.04 -2.03 -3.38 116.25 116.79 1ijc h VAL 8 Ca 0.00 -2.59 -0.02 0.00 -1.01 0.00 0.00 66.70 63.09 1ijc h VAL 8 Cb 0.00 2.93 -0.03 0.00 -2.01 0.00 0.00 31.29 32.18 1ijc h VAL 8 CO 0.00 0.78 -0.41 -0.24 -1.01 0.00 0.00 177.57 176.68 1ijc n SER 9 N -3.79 0.78 -3.97 3.17 2.88 -1.26 -5.07 113.62 106.35 1ijc n SER 9 Ca -0.15 -2.36 -0.09 0.00 -1.33 0.00 0.00 58.87 54.93 1ijc n SER 9 Cb 1.03 -0.28 -0.11 0.00 -0.75 0.00 0.00 64.21 64.10 1ijc n SER 9 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1ijc s GLY 10 N -1.67 0.22 -0.04 0.46 0.00 -1.26 -5.04 107.32 99.99 1ijc s GLY 10 Ca 0.13 -0.54 0.06 0.00 0.00 0.00 0.00 44.72 44.37 1ijc s GLY 10 CO -0.01 -0.62 0.96 0.00 0.00 0.00 0.00 173.10 173.43 1ijc n HIS 12 N -0.61 3.39 -3.66 0.00 8.25 -1.25 -4.70 115.22 116.65 1ijc n HIS 12 Ca 0.05 -3.06 -0.37 0.00 -0.26 0.00 0.00 57.72 54.09 1ijc n HIS 12 Cb 0.54 -0.26 -0.10 0.00 1.12 0.00 0.00 29.99 31.29 1ijc n HIS 12 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1ijc s LEU 13 N -3.61 4.05 -0.43 2.41 1.02 -1.07 -4.99 118.68 116.06 1ijc s LEU 13 Ca 0.48 0.07 -0.15 0.00 0.02 0.00 0.00 54.13 54.55 1ijc s LEU 13 Cb 0.40 -2.10 0.04 0.00 0.02 0.00 0.00 46.19 44.55 1ijc s LEU 13 CO -0.22 0.04 0.34 -0.75 0.02 0.00 0.00 176.35 175.78 1ijc s LYS 14 N 1.24 2.98 0.06 1.70 2.20 -1.26 -0.91 119.74 125.75 1ijc s LYS 14 Ca 0.07 -1.12 0.07 0.00 -0.36 0.00 0.00 55.97 54.64 1ijc s LYS 14 Cb -0.14 -4.03 -0.03 0.00 -1.51 0.00 0.00 37.83 32.11 1ijc s LYS 14 CO 0.06 -0.85 -0.17 -1.50 -0.36 0.00 0.00 175.35 172.53 1ijc s ILE 15 N 1.70 2.91 -0.17 5.43 2.07 -0.52 -4.96 121.20 127.66 1ijc s ILE 15 Ca 0.05 -1.24 -0.20 0.00 -1.41 0.00 0.00 60.65 57.86 1ijc s ILE 15 Cb -0.21 -2.27 -0.03 0.00 0.13 0.00 0.00 42.46 40.08 1ijc s ILE 15 CO 0.09 0.27 0.57 -0.89 -1.91 0.00 0.00 174.94 173.07 1ijc s THR 16 N -1.00 5.09 0.12 4.00 2.01 -1.26 -0.90 115.64 123.69 1ijc s THR 16 Ca 0.16 1.09 -0.10 0.00 0.31 0.00 0.00 61.69 63.15 1ijc s THR 16 Cb -0.11 -3.89 -0.06 0.00 0.01 0.00 0.00 72.50 68.45 1ijc s THR 16 CO 0.07 0.19 0.44 0.00 -0.69 0.00 0.00 174.62 174.64 1ijc n SER 18 N 0.60 0.16 0.05 0.00 7.64 -1.26 -4.47 113.62 116.34 1ijc n SER 18 Ca -0.05 -1.40 0.06 0.00 1.01 0.00 0.00 58.87 58.48 1ijc n SER 18 Cb 0.52 -0.73 0.26 0.00 -1.01 0.00 0.00 64.21 63.26 1ijc n SER 18 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ijc n ALA 19 N -3.57 1.23 -0.07 -0.43 0.00 -1.26 -2.37 120.51 114.03 1ijc n ALA 19 Ca -0.16 0.05 -0.15 0.00 0.00 0.00 0.00 53.44 53.18 1ijc n ALA 19 Cb 0.43 -1.17 -0.13 0.00 0.00 0.00 0.00 19.45 18.58 1ijc n ALA 19 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1ijc h GLU 20 N 0.00 0.00 -4.21 0.00 4.81 -1.98 -3.42 114.58 109.78 1ijc h GLU 20 Ca 0.00 0.00 -0.74 0.00 -0.13 0.00 0.00 59.36 58.49 1ijc h GLU 20 Cb 0.10 0.00 -0.25 0.00 0.63 0.00 0.00 28.75 29.22 1ijc h GLU 20 CO 0.00 1.00 -0.30 -1.21 -0.73 0.00 0.00 179.01 177.77 1ijc s GLU 21 N -2.24 2.84 0.00 1.92 8.01 -1.00 -4.27 118.70 123.96 1ijc s GLU 21 Ca -0.20 -1.63 0.15 0.00 0.01 0.00 0.00 54.97 53.29 1ijc s GLU 21 Cb -0.02 -4.14 0.20 0.00 -4.31 0.00 0.00 34.13 25.86 1ijc s GLU 21 CO 0.67 -1.21 1.07 0.25 0.01 0.00 0.00 175.26 176.06 1ijc n THR 22 N 5.14 0.29 -4.21 3.63 -2.24 -1.14 -4.09 114.28 111.65 1ijc n THR 22 Ca -0.12 -0.64 -0.31 0.00 -2.27 0.00 0.00 64.05 60.71 1ijc n THR 22 Cb 0.41 1.08 -0.09 0.00 -2.10 0.00 0.00 70.33 69.63 1ijc n THR 22 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1ijc s PHE 23 N -1.16 2.99 -0.37 4.78 0.40 -0.39 -4.54 117.98 119.69 1ijc s PHE 23 Ca 0.21 -0.00 -0.01 0.00 -0.60 0.00 0.00 56.93 56.53 1ijc s PHE 23 Cb 0.13 -1.58 0.10 0.00 0.51 0.00 0.00 43.02 42.18 1ijc s PHE 23 CO 0.19 0.46 0.13 0.00 0.70 0.00 0.00 175.22 176.70 1ijc s TYR 25 N 1.11 3.40 -0.37 0.00 1.13 -0.24 -0.91 117.35 121.47 1ijc s TYR 25 Ca 0.06 0.33 0.03 0.00 -1.41 0.00 0.00 57.07 56.08 1ijc s TYR 25 Cb -0.21 -2.18 0.11 0.00 -1.10 0.00 0.00 41.96 38.58 1ijc s TYR 25 CO -0.04 0.27 0.10 -1.59 -2.51 0.00 0.00 175.55 171.78 1ijc s LYS 26 N 0.43 1.39 -0.01 -3.49 -2.85 -0.27 -1.60 119.74 113.34 1ijc s LYS 26 Ca 0.08 -1.85 -0.02 0.00 -1.00 0.00 0.00 55.97 53.19 1ijc s LYS 26 Cb -0.11 -2.93 -0.04 0.00 -2.06 0.00 0.00 37.83 32.69 1ijc s LYS 26 CO -0.01 -0.99 0.14 -0.46 0.10 0.00 0.00 175.35 174.13 1ijc s TRP 27 N 0.82 3.44 -0.03 1.78 -0.00 -0.80 -2.17 118.94 121.98 1ijc s TRP 27 Ca 0.12 0.30 -0.00 0.00 -0.00 0.00 0.00 56.10 56.52 1ijc s TRP 27 Cb -0.20 -1.79 0.03 0.00 -0.00 0.00 0.00 33.47 31.51 1ijc s TRP 27 CO -0.10 0.61 0.02 -1.17 -0.00 0.00 0.00 176.95 176.31 1ijc s LEU 28 N -1.86 1.02 -0.31 5.86 2.96 -0.40 -0.95 118.68 125.00 1ijc s LEU 28 Ca 0.25 0.01 -0.07 0.00 -0.22 0.00 0.00 54.13 54.10 1ijc s LEU 28 Cb -0.12 -0.16 0.02 0.00 0.50 0.00 0.00 46.19 46.42 1ijc s LEU 28 CO 0.17 -0.13 0.10 0.21 -1.32 0.00 0.00 176.35 175.38 1ijc s ASN 29 N 1.18 5.25 0.00 3.68 3.84 -0.28 -1.48 114.94 127.13 1ijc s ASN 29 Ca -0.08 -0.80 0.00 0.00 0.21 0.00 0.00 52.86 52.19 1ijc s ASN 29 Cb -0.13 -1.90 0.00 0.00 -0.55 0.00 0.00 41.25 38.67 1ijc s ASN 29 CO -0.02 -0.24 0.66 0.29 -2.79 0.00 0.00 177.10 175.00 1ijc n LYS 30 N 4.88 0.92 -0.06 0.43 4.76 -0.16 -0.98 118.16 127.96 1ijc n LYS 30 Ca -0.14 0.00 -0.06 0.00 -2.87 0.00 0.00 58.31 55.24 1ijc n LYS 30 Cb 0.47 -1.27 -0.02 0.00 -1.84 0.00 0.00 35.03 32.37 1ijc n LYS 30 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 1ijc n ILE 31 N -0.19 1.28 0.36 -0.18 2.08 -1.26 -4.77 119.36 116.67 1ijc n ILE 31 Ca 0.00 0.22 0.09 0.00 0.56 0.00 0.00 62.75 63.62 1ijc n ILE 31 Cb 0.13 -2.11 -0.13 0.00 -0.75 0.00 0.00 39.64 36.79 1ijc n ILE 31 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 1ijc n SER 32 N -4.06 0.74 0.00 4.38 2.88 -1.25 -4.98 113.62 111.33 1ijc n SER 32 Ca -0.10 -0.39 0.00 0.00 -1.33 0.00 0.00 58.87 57.05 1ijc n SER 32 Cb 0.37 1.51 0.00 0.00 -0.75 0.00 0.00 64.21 65.34 1ijc n SER 32 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1ijc n ASN 33 N -1.86 -1.80 -4.71 -3.46 4.05 -0.15 -5.04 115.26 102.28 1ijc n ASN 33 Ca -0.01 0.00 -0.41 0.00 0.45 0.00 0.00 54.58 54.62 1ijc n ASN 33 Cb 0.41 -0.30 -0.04 0.00 1.23 0.00 0.00 39.78 41.08 1ijc n ASN 33 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 177.26 173.51 1ijc s GLU 34 N -0.94 4.46 -0.13 1.20 2.12 -1.24 -4.79 118.70 119.39 1ijc s GLU 34 Ca 0.00 1.05 0.02 0.00 0.36 0.00 0.00 54.97 56.40 1ijc s GLU 34 Cb 0.00 -3.46 -0.00 0.00 0.26 0.00 0.00 34.13 30.93 1ijc s GLU 34 CO 0.00 -0.01 -0.19 1.03 -0.54 0.00 0.00 175.26 175.55 1ijc s ARG 35 N 0.99 3.16 -1.05 4.30 3.00 -1.26 -1.12 118.95 126.97 1ijc s ARG 35 Ca 0.42 -0.80 -0.10 0.00 0.00 0.00 0.00 55.73 55.25 1ijc s ARG 35 Cb -0.19 -2.48 0.27 0.00 0.00 0.00 0.00 34.95 32.55 1ijc s ARG 35 CO 0.20 0.11 1.03 -1.58 0.00 0.00 0.00 175.30 175.06 1ijc s TRP 36 N 0.56 4.16 -0.24 -0.53 0.51 -0.13 -4.77 118.94 118.51 1ijc s TRP 36 Ca -0.11 -2.54 -0.08 0.00 -2.12 0.00 0.00 56.10 51.25 1ijc s TRP 36 Cb -0.16 -3.83 -0.04 0.00 -0.81 0.00 0.00 33.47 28.63 1ijc s TRP 36 CO 0.04 -0.96 0.10 -0.51 -0.51 0.00 0.00 176.95 175.10 1ijc s LEU 37 N -0.95 3.67 0.00 2.99 1.02 -1.25 -1.91 118.68 122.25 1ijc s LEU 37 Ca 0.28 -0.09 0.00 0.00 0.02 0.00 0.00 54.13 54.34 1ijc s LEU 37 Cb -0.10 -1.98 0.00 0.00 0.02 0.00 0.00 46.19 44.13 1ijc s LEU 37 CO -0.08 0.02 0.00 0.61 0.02 0.00 0.00 176.35 176.91 1ijc n GLY 38 N 4.59 -1.29 3.85 -3.19 0.00 -0.63 -4.04 105.19 104.48 1ijc n GLY 38 Ca -0.16 -0.92 -0.37 0.00 0.00 0.00 0.00 46.02 44.58 1ijc n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ijc s ALA 40 N -0.74 1.10 -0.14 0.00 0.00 -0.26 -4.86 121.76 116.86 1ijc s ALA 40 Ca 0.15 -1.64 -0.27 0.00 0.00 0.00 0.00 51.96 50.19 1ijc s ALA 40 Cb -0.12 1.26 -0.24 0.00 0.00 0.00 0.00 23.12 24.01 1ijc s ALA 40 CO 0.04 -0.56 0.71 0.87 0.00 0.00 0.00 175.76 176.81 1ijc h LYS 41 N 2.68 0.00 0.00 0.00 1.57 -1.88 -0.99 116.57 117.95 1ijc h LYS 41 Ca -0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 1ijc h LYS 41 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 1ijc h LYS 41 CO 0.55 0.93 0.00 0.25 -0.57 0.00 0.00 179.45 180.61 1ijc n THR 42 N -4.62 0.00 -5.00 -0.16 -2.24 -1.26 -4.66 114.28 96.34 1ijc n THR 42 Ca -0.10 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.36 1ijc n THR 42 Cb 0.45 -0.74 -0.15 0.00 -2.10 0.00 0.00 70.33 67.79 1ijc n THR 42 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ijc n THR 44 N 2.91 2.31 -1.55 0.00 5.66 -1.26 -5.04 114.28 117.30 1ijc n THR 44 Ca -0.18 -2.26 -0.61 0.00 -3.05 0.00 0.00 64.05 57.95 1ijc n THR 44 Cb 0.52 -0.28 -0.09 0.00 -1.55 0.00 0.00 70.33 68.94 1ijc n THR 44 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1ijc n GLU 45 N -0.88 0.00 -3.56 1.09 0.00 -1.26 -4.78 120.64 111.25 1ijc n GLU 45 Ca 0.24 0.00 -0.28 0.00 0.00 0.00 0.00 57.16 57.13 1ijc n GLU 45 Cb 0.90 -1.41 -0.11 0.00 0.00 0.00 0.00 31.44 30.82 1ijc n GLU 45 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1ijc s ILE 46 N 1.78 1.14 -0.88 6.31 1.01 -0.62 -4.87 121.20 125.06 1ijc s ILE 46 Ca 0.94 -3.07 -0.16 0.00 0.00 0.00 0.00 60.65 58.35 1ijc s ILE 46 Cb -1.33 -1.78 0.17 0.00 0.01 0.00 0.00 42.46 39.54 1ijc s ILE 46 CO 0.68 -1.13 0.96 -1.81 0.00 0.00 0.00 174.94 173.64 1ijc s ASP 47 N -0.31 6.70 0.00 3.58 1.01 -1.26 -1.45 116.67 124.94 1ijc s ASP 47 Ca 0.29 -2.37 0.00 0.00 0.71 0.00 0.00 52.55 51.18 1ijc s ASP 47 Cb -0.02 -2.31 0.00 0.00 1.01 0.00 0.00 42.92 41.60 1ijc s ASP 47 CO -0.17 -0.82 0.00 0.35 0.21 0.00 0.00 175.17 174.74 1ijc n THR 48 N 4.74 0.00 -0.13 -1.27 -2.24 -0.41 -5.03 114.28 109.93 1ijc n THR 48 Ca 0.19 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.69 1ijc n THR 48 Cb 0.48 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.61 1ijc n THR 48 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 1ijc n TRP 49 N 0.00 0.13 0.28 4.78 4.27 -1.26 -4.69 117.44 120.95 1ijc n TRP 49 Ca 0.00 0.05 0.05 0.00 -3.89 0.00 0.00 57.50 53.71 1ijc n TRP 49 Cb 0.00 -1.01 -0.06 0.00 -1.36 0.00 0.00 31.31 28.87 1ijc n TRP 49 CO 0.00 0.00 0.00 0.27 -2.29 0.00 0.00 177.69 175.67 1ijc n ASN 50 N -4.22 1.32 -4.80 -0.67 0.23 -1.26 -4.99 115.26 100.86 1ijc n ASN 50 Ca -0.52 -0.45 -0.36 0.00 -0.53 0.00 0.00 54.58 52.72 1ijc n ASN 50 Cb 0.87 1.17 -0.07 0.00 -2.08 0.00 0.00 39.78 39.67 1ijc n ASN 50 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1ijc s VAL 51 N -2.21 5.10 -0.22 3.53 1.01 -1.26 -0.99 120.40 125.37 1ijc s VAL 51 Ca 0.01 0.05 -0.05 0.00 0.00 0.00 0.00 61.98 62.00 1ijc s VAL 51 Cb 0.07 -3.20 0.08 0.00 0.00 0.00 0.00 36.38 33.32 1ijc s VAL 51 CO 0.40 0.60 0.11 -0.47 0.00 0.00 0.00 175.10 175.75 1ijc s TYR 52 N -0.89 0.22 -0.17 5.22 5.04 -0.55 -1.29 117.35 124.93 1ijc s TYR 52 Ca 0.14 -0.51 0.00 0.00 -2.44 0.00 0.00 57.07 54.26 1ijc s TYR 52 Cb -0.12 -0.76 0.00 0.00 0.35 0.00 0.00 41.96 41.44 1ijc s TYR 52 CO 0.03 -0.64 -0.16 1.21 -1.34 0.00 0.00 175.55 174.66 1ijc s ASN 53 N 2.13 3.54 -0.10 4.32 2.47 -0.53 -1.27 114.94 125.50 1ijc s ASN 53 Ca 0.05 -0.52 0.02 0.00 0.42 0.00 0.00 52.86 52.83 1ijc s ASN 53 Cb -0.16 -1.55 0.01 0.00 -1.45 0.00 0.00 41.25 38.10 1ijc s ASN 53 CO -0.20 0.04 -0.17 -0.75 -3.72 0.00 0.00 177.10 172.31 1ijc s LYS 54 N 1.05 2.31 0.01 0.43 2.36 -0.92 -1.59 119.74 123.39 1ijc s LYS 54 Ca -0.01 -0.60 -0.02 0.00 -2.55 0.00 0.00 55.97 52.79 1ijc s LYS 54 Cb -0.15 -1.91 -0.04 0.00 -1.05 0.00 0.00 37.83 34.69 1ijc s LYS 54 CO -0.04 -0.01 0.18 0.00 1.55 0.00 0.00 175.35 177.03 1ijc n THR 57 N -0.52 0.00 -3.71 0.00 -2.24 -1.26 -1.19 114.28 105.37 1ijc n THR 57 Ca 0.06 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.62 1ijc n THR 57 Cb 0.49 1.73 -0.03 0.00 -2.10 0.00 0.00 70.33 70.42 1ijc n THR 57 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1ijc s THR 58 N 0.00 2.34 0.80 4.28 -1.32 -1.26 -4.92 115.64 115.55 1ijc s THR 58 Ca 0.00 -1.42 -0.14 0.00 -1.21 0.00 0.00 61.69 58.92 1ijc s THR 58 Cb 0.00 -2.76 0.06 0.00 -1.51 0.00 0.00 72.50 68.29 1ijc s THR 58 CO 0.00 0.00 1.07 -3.20 -2.21 0.00 0.00 174.62 170.28 1ijc n ASN 59 N -1.58 0.62 -2.13 8.08 4.05 -1.26 -3.03 115.26 120.00 1ijc n ASN 59 Ca 0.02 0.59 0.00 0.00 0.45 0.00 0.00 54.58 55.64 1ijc n ASN 59 Cb 0.63 -1.46 0.00 0.00 1.23 0.00 0.00 39.78 40.18 1ijc n ASN 59 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1ijc n LEU 60 N -2.70 0.00 0.11 1.20 4.77 -0.13 -4.62 117.00 115.64 1ijc n LEU 60 Ca 0.13 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.09 1ijc n LEU 60 Cb 0.50 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.64 1ijc n LEU 60 CO 0.49 0.00 0.37 0.00 -1.33 0.00 0.00 177.39 176.92 1ijc s ASN 62 N -6.66 5.56 0.00 0.00 4.22 -1.26 -4.98 114.94 111.82 1ijc s ASN 62 Ca 0.01 -1.35 0.07 0.00 -2.14 0.00 0.00 52.86 49.45 1ijc s ASN 62 Cb 0.10 -1.96 0.06 0.00 1.28 0.00 0.00 41.25 40.73 1ijc s ASN 62 CO 0.77 -0.46 0.73 0.35 -2.04 0.00 0.00 177.10 176.45