#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 3.29 0.13 3.17 2.02 -1.26 -1.30 118.70 124.75 1ijc s GLU 2 Ca 0.00 -0.59 0.01 0.00 0.02 0.00 0.00 54.97 54.41 1ijc s GLU 2 Cb 0.00 -2.92 0.01 0.00 0.10 0.00 0.00 34.13 31.32 1ijc s GLU 2 CO 0.00 0.56 0.05 0.00 0.02 0.00 0.00 175.26 175.89 1ijc s TYR 4 N -1.00 2.50 0.47 0.00 2.02 -1.25 -2.01 117.35 118.07 1ijc s TYR 4 Ca 0.04 -2.17 0.04 0.00 -0.37 0.00 0.00 57.07 54.61 1ijc s TYR 4 Cb -0.00 -2.11 0.01 0.00 -0.40 0.00 0.00 41.96 39.46 1ijc s TYR 4 CO 0.03 -0.88 0.66 -0.98 -1.57 0.00 0.00 175.55 172.80 1ijc s ARG 5 N 1.34 2.80 -0.18 -0.62 3.03 0.02 -3.92 118.95 121.42 1ijc s ARG 5 Ca 0.08 -0.87 -0.02 0.00 2.03 0.00 0.00 55.73 56.95 1ijc s ARG 5 Cb -0.18 -2.62 -0.01 0.00 -1.03 0.00 0.00 34.95 31.12 1ijc s ARG 5 CO -0.17 -0.41 -0.10 0.00 -1.13 0.00 0.00 175.30 173.50 1ijc n GLY 7 N 4.35 -0.47 0.00 0.00 0.00 -0.57 -4.98 105.19 103.52 1ijc n GLY 7 Ca -0.19 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1ijc n GLY 7 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ijc n VAL 8 N 0.00 0.00 -0.56 1.61 0.31 -1.26 -4.72 118.33 113.71 1ijc n VAL 8 Ca 0.00 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 1ijc n VAL 8 Cb 0.00 0.61 0.00 0.00 -0.91 0.00 0.00 33.84 33.54 1ijc n VAL 8 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1ijc n SER 9 N -1.40 0.41 -3.99 4.52 2.88 -1.26 -5.09 113.62 109.68 1ijc n SER 9 Ca -0.00 -0.98 -0.11 0.00 -1.33 0.00 0.00 58.87 56.45 1ijc n SER 9 Cb 0.02 0.01 -0.07 0.00 -0.75 0.00 0.00 64.21 63.42 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 -0.01 0.97 -0.17 0.46 0.00 -1.26 -5.07 107.32 102.23 1ijc s GLY 10 Ca 0.00 -1.25 0.22 0.00 0.00 0.00 0.00 44.72 43.69 1ijc s GLY 10 CO 0.00 -0.95 1.14 0.00 0.00 0.00 0.00 173.10 173.30 1ijc n HIS 12 N -0.28 1.74 -3.67 0.00 -0.00 -1.25 -4.64 115.22 107.11 1ijc n HIS 12 Ca 0.11 -3.16 -0.36 0.00 -0.00 0.00 0.00 57.72 54.31 1ijc n HIS 12 Cb 0.92 -0.33 -0.09 0.00 -0.00 0.00 0.00 29.99 30.50 1ijc n HIS 12 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1ijc s LEU 13 N -3.12 4.17 -0.38 2.41 2.01 -0.87 -4.99 118.68 117.91 1ijc s LEU 13 Ca 0.36 0.21 -0.14 0.00 0.01 0.00 0.00 54.13 54.58 1ijc s LEU 13 Cb 0.41 -2.14 0.01 0.00 0.01 0.00 0.00 46.19 44.48 1ijc s LEU 13 CO -0.05 0.11 0.27 -0.75 1.01 0.00 0.00 176.35 176.94 1ijc s LYS 14 N 0.72 3.17 0.31 1.70 2.20 -1.26 -0.80 119.74 125.77 1ijc s LYS 14 Ca 0.09 -0.88 0.09 0.00 -0.36 0.00 0.00 55.97 54.91 1ijc s LYS 14 Cb -0.12 -3.89 -0.04 0.00 -1.51 0.00 0.00 37.83 32.26 1ijc s LYS 14 CO 0.02 -0.62 0.08 -1.50 -0.36 0.00 0.00 175.35 172.97 1ijc s ILE 15 N 1.69 3.19 -0.17 5.43 -1.16 -0.85 -4.95 121.20 124.37 1ijc s ILE 15 Ca 0.05 -1.78 -0.08 0.00 -0.51 0.00 0.00 60.65 58.33 1ijc s ILE 15 Cb -0.18 -2.94 -0.04 0.00 0.61 0.00 0.00 42.46 39.91 1ijc s ILE 15 CO 0.10 -0.25 0.10 -0.89 -2.81 0.00 0.00 174.94 171.18 1ijc s THR 16 N -2.39 5.13 -0.35 4.00 2.01 -1.26 -0.97 115.64 121.81 1ijc s THR 16 Ca 0.35 0.08 -0.08 0.00 0.31 0.00 0.00 61.69 62.35 1ijc s THR 16 Cb -0.04 -3.30 0.03 0.00 0.01 0.00 0.00 72.50 69.21 1ijc s THR 16 CO 0.22 0.49 0.15 0.00 -0.69 0.00 0.00 174.62 174.78 1ijc n SER 18 N 4.89 -1.86 0.17 0.00 2.88 -1.24 -4.05 113.62 114.42 1ijc n SER 18 Ca -0.12 -0.06 0.14 0.00 -1.33 0.00 0.00 58.87 57.49 1ijc n SER 18 Cb 0.45 -1.16 0.46 0.00 -0.75 0.00 0.00 64.21 63.21 1ijc n SER 18 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ijc h ALA 19 N -2.31 2.04 -0.02 -1.46 0.00 -1.98 0.34 119.26 115.87 1ijc h ALA 19 Ca -0.56 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.33 1ijc h ALA 19 Cb 1.33 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 1ijc h ALA 19 CO 0.43 -0.91 -0.03 1.49 0.00 0.00 0.00 179.25 180.24 1ijc h GLU 20 N 0.00 0.05 -4.83 0.00 4.22 -1.99 -3.42 114.58 108.61 1ijc h GLU 20 Ca 0.14 -0.03 -0.67 0.00 0.08 0.00 0.00 59.36 58.88 1ijc h GLU 20 Cb 1.65 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.66 1ijc h GLU 20 CO -0.00 0.58 -0.61 -1.83 -2.18 0.00 0.00 179.01 174.97 1ijc s GLU 21 N -4.03 3.25 0.00 1.92 -1.05 0.12 -4.15 118.70 114.76 1ijc s GLU 21 Ca -0.16 -0.76 0.00 0.00 -0.15 0.00 0.00 54.97 53.90 1ijc s GLU 21 Cb 0.02 -3.40 0.00 0.00 -0.44 0.00 0.00 34.13 30.31 1ijc s GLU 21 CO 0.69 -0.39 0.19 0.25 0.95 0.00 0.00 175.26 176.95 1ijc n THR 22 N 4.90 0.00 -3.97 1.83 -2.24 -1.11 -3.73 114.28 109.95 1ijc n THR 22 Ca -0.15 -0.37 -0.32 0.00 -2.27 0.00 0.00 64.05 60.94 1ijc n THR 22 Cb 0.49 1.14 -0.05 0.00 -2.10 0.00 0.00 70.33 69.80 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 -0.35 3.42 -0.40 4.78 0.40 -0.11 -4.59 117.98 121.13 1ijc s PHE 23 Ca 0.00 0.23 -0.03 0.00 -0.60 0.00 0.00 56.93 56.53 1ijc s PHE 23 Cb 0.00 -1.74 0.10 0.00 0.51 0.00 0.00 43.02 41.89 1ijc s PHE 23 CO 0.00 0.58 0.18 0.00 0.70 0.00 0.00 175.22 176.69 1ijc s TYR 25 N 1.17 3.22 -0.36 0.00 1.13 -0.38 -1.06 117.35 121.06 1ijc s TYR 25 Ca 0.06 -0.14 -0.00 0.00 -1.41 0.00 0.00 57.07 55.58 1ijc s TYR 25 Cb -0.22 -2.43 0.09 0.00 -1.10 0.00 0.00 41.96 38.30 1ijc s TYR 25 CO -0.03 -0.31 0.10 -1.59 -2.51 0.00 0.00 175.55 171.21 1ijc s LYS 26 N 1.72 1.93 -0.14 -3.49 -2.85 -0.48 -1.89 119.74 114.54 1ijc s LYS 26 Ca 0.06 -1.72 -0.08 0.00 -1.00 0.00 0.00 55.97 53.24 1ijc s LYS 26 Cb -0.17 -3.36 -0.04 0.00 -2.06 0.00 0.00 37.83 32.20 1ijc s LYS 26 CO 0.10 -0.93 0.13 -0.46 0.10 0.00 0.00 175.35 174.30 1ijc s TRP 27 N 1.08 3.53 -0.07 1.78 -0.00 -0.90 -2.01 118.94 122.36 1ijc s TRP 27 Ca 0.06 0.46 0.03 0.00 -0.00 0.00 0.00 56.10 56.65 1ijc s TRP 27 Cb -0.21 -2.00 0.00 0.00 -0.00 0.00 0.00 33.47 31.27 1ijc s TRP 27 CO -0.05 0.60 -0.17 -1.17 -0.00 0.00 0.00 176.95 176.16 1ijc s LEU 28 N -0.63 1.86 -0.26 5.86 2.96 -0.50 -0.88 118.68 127.10 1ijc s LEU 28 Ca 0.13 -0.40 -0.04 0.00 -0.22 0.00 0.00 54.13 53.60 1ijc s LEU 28 Cb -0.12 -1.06 0.02 0.00 0.50 0.00 0.00 46.19 45.53 1ijc s LEU 28 CO 0.02 0.11 -0.00 0.21 -1.32 0.00 0.00 176.35 175.37 1ijc s ASN 29 N 0.36 4.64 0.00 3.68 3.04 -0.16 -1.58 114.94 124.93 1ijc s ASN 29 Ca -0.12 -0.75 0.26 0.00 0.04 0.00 0.00 52.86 52.29 1ijc s ASN 29 Cb -0.15 -1.76 1.51 0.00 -1.54 0.00 0.00 41.25 39.31 1ijc s ASN 29 CO 0.05 -0.14 1.98 0.29 -3.04 0.00 0.00 177.10 176.24 1ijc n LYS 30 N 4.76 1.07 -0.11 0.43 4.76 -0.74 -0.11 118.16 128.21 1ijc n LYS 30 Ca -0.16 -0.10 -0.21 0.00 -2.87 0.00 0.00 58.31 54.97 1ijc n LYS 30 Cb 0.48 -1.42 -0.09 0.00 -1.84 0.00 0.00 35.03 32.16 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 -0.80 1.25 0.04 -0.18 2.08 -1.26 -4.63 119.36 115.86 1ijc n ILE 31 Ca 0.20 -0.38 0.06 0.00 0.56 0.00 0.00 62.75 63.19 1ijc n ILE 31 Cb 0.12 -1.61 0.12 0.00 -0.75 0.00 0.00 39.64 37.52 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 -3.70 2.64 -1.31 4.38 2.88 -1.24 -4.95 113.62 112.32 1ijc n SER 32 Ca -0.43 -1.83 -0.12 0.00 -1.33 0.00 0.00 58.87 55.17 1ijc n SER 32 Cb 0.85 -0.16 -0.05 0.00 -0.75 0.00 0.00 64.21 64.10 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 0.60 -3.26 -4.78 -3.46 5.15 0.85 -4.90 115.26 105.44 1ijc n ASN 33 Ca 0.10 0.29 -0.38 0.00 -0.60 0.00 0.00 54.58 53.99 1ijc n ASN 33 Cb 0.39 -3.05 -0.06 0.00 -0.53 0.00 0.00 39.78 36.53 1ijc n ASN 33 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 1ijc s GLU 34 N -2.98 4.21 -0.10 1.20 2.12 -1.22 -4.80 118.70 117.14 1ijc s GLU 34 Ca 0.00 0.62 0.02 0.00 0.36 0.00 0.00 54.97 55.97 1ijc s GLU 34 Cb 0.00 -3.31 0.01 0.00 0.26 0.00 0.00 34.13 31.09 1ijc s GLU 34 CO 0.00 0.46 -0.16 -0.98 -0.54 0.00 0.00 175.26 174.03 1ijc s ARG 35 N -0.43 2.27 -0.94 4.30 3.03 -1.26 -0.99 118.95 124.94 1ijc s ARG 35 Ca 0.28 -0.59 -0.10 0.00 2.03 0.00 0.00 55.73 57.34 1ijc s ARG 35 Cb -0.18 -1.86 0.24 0.00 -1.03 0.00 0.00 34.95 32.13 1ijc s ARG 35 CO 0.16 0.01 0.90 -1.58 -1.13 0.00 0.00 175.30 173.65 1ijc s TRP 36 N 0.76 3.97 -0.31 5.89 0.51 -0.06 -4.85 118.94 124.86 1ijc s TRP 36 Ca -0.11 -2.42 -0.09 0.00 -2.12 0.00 0.00 56.10 51.36 1ijc s TRP 36 Cb -0.16 -3.74 0.00 0.00 -0.81 0.00 0.00 33.47 28.76 1ijc s TRP 36 CO 0.02 -0.94 0.13 -0.51 -0.51 0.00 0.00 176.95 175.14 1ijc s LEU 37 N -0.58 4.08 0.00 2.99 1.02 -1.24 -2.11 118.68 122.83 1ijc s LEU 37 Ca 0.24 -0.64 -0.15 0.00 0.02 0.00 0.00 54.13 53.60 1ijc s LEU 37 Cb -0.10 -1.96 0.06 0.00 0.02 0.00 0.00 46.19 44.20 1ijc s LEU 37 CO -0.08 -0.21 0.75 0.61 0.02 0.00 0.00 176.35 177.43 1ijc n GLY 38 N 4.94 0.94 3.73 -3.19 0.00 -0.79 -4.35 105.19 106.47 1ijc n GLY 38 Ca -0.14 -1.16 -0.35 0.00 0.00 0.00 0.00 46.02 44.37 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 0.34 1.80 0.03 0.00 0.00 -0.15 -4.76 121.76 119.02 1ijc s ALA 40 Ca 0.10 -1.83 -0.16 0.00 0.00 0.00 0.00 51.96 50.06 1ijc s ALA 40 Cb -0.11 0.77 -0.35 0.00 0.00 0.00 0.00 23.12 23.42 1ijc s ALA 40 CO -0.01 -0.36 1.01 1.57 0.00 0.00 0.00 175.76 177.97 1ijc h LYS 41 N 2.41 0.55 0.00 0.00 -0.00 -1.89 -0.21 116.57 117.43 1ijc h LYS 41 Ca -0.38 -0.92 0.00 0.00 -0.00 0.00 0.00 60.65 59.35 1ijc h LYS 41 Cb 1.23 0.34 0.00 0.00 -0.00 0.00 0.00 32.23 33.80 1ijc h LYS 41 CO 0.63 1.44 0.00 0.25 -0.00 0.00 0.00 179.45 181.77 1ijc n THR 42 N -3.74 0.00 -4.73 0.07 -2.24 -1.26 -4.75 114.28 97.63 1ijc n THR 42 Ca -0.17 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.31 1ijc n THR 42 Cb 1.09 -0.20 -0.13 0.00 -2.10 0.00 0.00 70.33 68.99 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 1.58 1.57 -1.57 0.00 5.66 -1.26 -5.08 114.28 115.18 1ijc n THR 44 Ca -0.17 -2.60 -0.53 0.00 -3.05 0.00 0.00 64.05 57.70 1ijc n THR 44 Cb 0.52 0.12 -0.06 0.00 -1.55 0.00 0.00 70.33 69.36 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 -0.65 0.92 -3.50 1.09 2.13 -1.26 -4.79 120.64 114.58 1ijc n GLU 45 Ca 0.15 0.33 -0.28 0.00 0.66 0.00 0.00 57.16 58.02 1ijc n GLU 45 Cb 0.82 -1.92 -0.11 0.00 0.27 0.00 0.00 31.44 30.50 1ijc n GLU 45 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 1ijc s ILE 46 N 0.30 0.63 -0.83 6.31 1.01 -0.69 -4.88 121.20 123.05 1ijc s ILE 46 Ca 0.84 -2.47 -0.17 0.00 0.00 0.00 0.00 60.65 58.86 1ijc s ILE 46 Cb -1.00 -1.45 0.16 0.00 0.01 0.00 0.00 42.46 40.19 1ijc s ILE 46 CO 0.49 -1.09 0.90 -1.81 0.00 0.00 0.00 174.94 173.43 1ijc s ASP 47 N 0.30 6.61 0.00 3.58 1.11 -1.26 -1.51 116.67 125.50 1ijc s ASP 47 Ca 0.25 -2.21 0.00 0.00 0.18 0.00 0.00 52.55 50.77 1ijc s ASP 47 Cb -0.09 -2.30 0.00 0.00 1.07 0.00 0.00 42.92 41.59 1ijc s ASP 47 CO -0.10 -0.87 0.00 0.35 1.18 0.00 0.00 175.17 175.73 1ijc n THR 48 N 4.86 0.00 -0.10 -1.27 -2.24 -0.36 -5.04 114.28 110.13 1ijc n THR 48 Ca 0.14 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.78 1ijc n THR 48 Cb 0.47 0.00 -0.09 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 0.00 -0.01 4.78 4.27 -1.26 -4.72 117.44 120.50 1ijc n TRP 49 Ca 0.00 0.00 0.02 0.00 -3.89 0.00 0.00 57.50 53.63 1ijc n TRP 49 Cb 0.00 -0.76 -0.06 0.00 -1.36 0.00 0.00 31.31 29.13 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 -3.11 3.22 -4.81 -0.67 2.04 -1.26 -4.99 115.26 105.68 1ijc n ASN 50 Ca -0.35 0.00 -0.36 0.00 -0.44 0.00 0.00 54.58 53.43 1ijc n ASN 50 Cb 0.87 1.21 -0.07 0.00 -2.53 0.00 0.00 39.78 39.26 1ijc n ASN 50 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 1ijc s VAL 51 N -2.46 5.36 -0.30 3.53 1.01 -1.26 -1.80 120.40 124.48 1ijc s VAL 51 Ca -0.03 0.16 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 1ijc s VAL 51 Cb 0.04 -3.37 0.10 0.00 0.00 0.00 0.00 36.38 33.16 1ijc s VAL 51 CO 0.32 0.55 0.14 -0.47 0.00 0.00 0.00 175.10 175.64 1ijc s TYR 52 N -0.51 0.36 -0.15 5.22 5.04 -0.61 -1.23 117.35 125.47 1ijc s TYR 52 Ca 0.12 -0.95 -0.03 0.00 -2.44 0.00 0.00 57.07 53.78 1ijc s TYR 52 Cb -0.12 -0.90 -0.02 0.00 0.35 0.00 0.00 41.96 41.27 1ijc s TYR 52 CO 0.02 -0.83 -0.06 1.21 -1.34 0.00 0.00 175.55 174.54 1ijc s ASN 53 N 2.01 4.55 -0.09 4.32 2.47 -0.57 -1.40 114.94 126.23 1ijc s ASN 53 Ca 0.10 -0.19 0.02 0.00 0.42 0.00 0.00 52.86 53.20 1ijc s ASN 53 Cb -0.17 -1.73 0.01 0.00 -1.45 0.00 0.00 41.25 37.92 1ijc s ASN 53 CO -0.34 0.16 -0.13 -0.75 -3.72 0.00 0.00 177.10 172.32 1ijc s LYS 54 N 0.38 1.96 -0.05 0.43 2.36 -0.85 -1.70 119.74 122.27 1ijc s LYS 54 Ca -0.06 -0.48 -0.05 0.00 -2.55 0.00 0.00 55.97 52.84 1ijc s LYS 54 Cb -0.15 -1.68 -0.04 0.00 -1.05 0.00 0.00 37.83 34.91 1ijc s LYS 54 CO 0.04 -0.05 0.17 0.00 1.55 0.00 0.00 175.35 177.06 1ijc n THR 57 N -0.74 0.00 -1.58 0.00 -2.24 -1.26 -1.96 114.28 106.49 1ijc n THR 57 Ca -0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1ijc n THR 57 Cb 0.66 0.75 0.00 0.00 -2.10 0.00 0.00 70.33 69.64 1ijc n THR 57 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1ijc n THR 58 N 0.00 0.00 -3.86 4.28 -2.24 -1.26 -4.96 114.28 106.24 1ijc n THR 58 Ca 0.00 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.45 1ijc n THR 58 Cb 0.60 -0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.67 1ijc n THR 58 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1ijc s ASN 59 N -0.20 6.40 0.00 3.42 2.47 -1.26 -4.56 114.94 121.22 1ijc s ASN 59 Ca 0.00 0.39 0.00 0.00 0.42 0.00 0.00 52.86 53.67 1ijc s ASN 59 Cb 0.00 -2.01 0.00 0.00 -1.45 0.00 0.00 41.25 37.79 1ijc s ASN 59 CO 0.00 0.20 0.00 0.18 -3.72 0.00 0.00 177.10 173.76 1ijc n LEU 60 N 0.65 0.00 0.00 3.21 4.77 -0.36 -4.56 117.00 120.71 1ijc n LEU 60 Ca -0.08 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 55.99 1ijc n LEU 60 Cb 0.52 0.00 0.51 0.00 -2.33 0.00 0.00 43.42 42.12 1ijc n LEU 60 CO 0.47 0.00 0.80 0.00 -1.33 0.00 0.00 177.39 177.33 1ijc n ASN 62 N -0.79 0.00 0.00 0.00 4.13 -1.26 -5.00 115.26 112.34 1ijc n ASN 62 Ca 0.13 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.39 1ijc n ASN 62 Cb 0.06 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.30 1ijc n ASN 62 CO 0.00 0.00 0.00 1.07 0.28 0.00 0.00 177.26 178.61