#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ni0 n PRO 4 N 0.00 0.00 -0.26 -1.40 -0.02 -1.26 -2.26 135.00 129.80 1ni0 n PRO 4 Ca 0.00 0.46 0.07 0.00 -2.02 0.00 0.00 63.50 62.01 1ni0 n PRO 4 Cb 0.00 -1.07 0.21 0.00 -0.02 0.00 0.00 33.50 32.62 1ni0 n PRO 4 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1ni0 h ASP 5 N 0.00 0.22 -0.97 2.55 3.32 -2.08 -0.98 116.42 118.48 1ni0 h ASP 5 Ca 0.00 0.13 0.22 0.00 0.02 0.00 0.00 57.03 57.40 1ni0 h ASP 5 Cb 0.00 0.13 -0.08 0.00 0.22 0.00 0.00 39.33 39.59 1ni0 h ASP 5 CO 0.00 0.05 0.63 0.25 -1.72 0.00 0.00 179.24 178.45 1ni0 h LEU 6 N 0.39 0.48 -0.69 1.55 5.85 -1.99 -0.73 115.31 120.17 1ni0 h LEU 6 Ca 0.44 0.06 0.02 0.00 0.84 0.00 0.00 57.88 59.25 1ni0 h LEU 6 Cb 0.73 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 1ni0 h LEU 6 CO -0.46 0.16 0.44 0.78 -0.34 0.00 0.00 178.44 179.02 1ni0 h ASN 7 N 0.46 0.73 0.00 1.25 4.21 -0.72 -0.19 115.58 121.32 1ni0 h ASN 7 Ca 0.53 -0.00 0.00 0.00 1.21 0.00 0.00 56.30 58.04 1ni0 h ASN 7 Cb 1.25 -0.16 0.00 0.00 -1.12 0.00 0.00 38.32 38.28 1ni0 h ASN 7 CO -0.25 0.51 0.04 0.29 -1.29 0.00 0.00 177.43 176.74 1ni0 n LYS 8 N -4.66 0.00 -0.02 0.81 4.76 -0.28 -2.67 118.16 116.10 1ni0 n LYS 8 Ca 0.07 0.39 -0.21 0.00 -2.87 0.00 0.00 58.31 55.69 1ni0 n LYS 8 Cb 0.07 -1.54 -0.13 0.00 -1.84 0.00 0.00 35.03 31.58 1ni0 n LYS 8 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1ni0 h LEU 9 N 0.00 0.27 0.00 -0.35 7.12 -1.09 -1.77 115.31 119.49 1ni0 h LEU 9 Ca 0.00 -0.80 0.00 0.00 0.13 0.00 0.00 57.88 57.21 1ni0 h LEU 9 Cb 0.09 -0.09 0.00 0.00 -0.53 0.00 0.00 40.66 40.13 1ni0 h LEU 9 CO 0.00 1.54 0.00 -0.11 -0.13 0.00 0.00 178.44 179.74 1ni0 n LEU 10 N -4.08 0.00 -0.05 2.25 -0.00 -1.09 -2.77 117.00 111.27 1ni0 n LEU 10 Ca -0.25 0.46 -0.02 0.00 -0.00 0.00 0.00 56.01 56.19 1ni0 n LEU 10 Cb 0.82 -0.46 -0.11 0.00 -0.00 0.00 0.00 43.42 43.68 1ni0 n LEU 10 CO 0.36 -0.02 -0.85 -1.84 -0.00 0.00 0.00 177.39 175.04 1ni0 n GLU 11 N -1.46 1.42 0.08 1.96 -0.00 -1.21 -4.43 120.64 117.01 1ni0 n GLU 11 Ca 0.08 -0.04 0.12 0.00 -0.00 0.00 0.00 57.16 57.32 1ni0 n GLU 11 Cb 0.31 -1.34 0.19 0.00 -0.00 0.00 0.00 31.44 30.60 1ni0 n GLU 11 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 1ni0 h LEU 12 N 0.00 0.00 -0.38 -1.84 3.38 -1.38 -3.35 115.31 111.73 1ni0 h LEU 12 Ca -0.25 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1ni0 h LEU 12 Cb 1.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.21 1ni0 h LEU 12 CO 0.01 0.07 0.00 1.87 0.09 0.00 0.00 178.44 180.48 1ni0 n TRP 13 N -2.27 0.37 -0.04 1.13 -0.00 -1.11 -2.90 117.44 112.62 1ni0 n TRP 13 Ca 0.03 0.15 -0.16 0.00 -0.00 0.00 0.00 57.50 57.52 1ni0 n TRP 13 Cb 0.46 -0.75 -0.07 0.00 -0.00 0.00 0.00 31.31 30.95 1ni0 n TRP 13 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 1ni0 h PRO 14 N 0.00 0.67 -0.05 5.87 0.13 -1.84 -2.90 132.00 133.88 1ni0 h PRO 14 Ca 0.00 -0.52 -0.01 0.00 -0.87 0.00 0.00 66.00 64.59 1ni0 h PRO 14 Cb 0.25 0.10 -0.00 0.00 0.13 0.00 0.00 31.00 31.48 1ni0 h PRO 14 CO 0.00 1.14 -0.02 0.45 -0.23 0.00 0.00 178.00 179.34 1ni0 h HIS 15 N 0.36 0.11 -0.67 1.56 3.86 -1.83 -2.23 115.15 116.31 1ni0 h HIS 15 Ca -0.03 -0.03 0.14 0.00 -1.16 0.00 0.00 60.37 59.29 1ni0 h HIS 15 Cb 1.23 -0.03 -0.10 0.00 1.06 0.00 0.00 27.41 29.58 1ni0 h HIS 15 CO 0.10 0.48 0.15 0.82 0.86 0.00 0.00 177.93 180.34 1ni0 h ILE 16 N -0.28 0.57 -0.69 2.45 5.03 -1.65 0.28 117.51 123.22 1ni0 h ILE 16 Ca 0.01 -0.09 -0.03 0.00 -0.12 0.00 0.00 64.86 64.63 1ni0 h ILE 16 Cb 0.45 0.29 -0.03 0.00 -3.03 0.00 0.00 36.82 34.49 1ni0 h ILE 16 CO 0.01 0.05 0.31 -0.61 -0.68 0.00 0.00 178.15 177.23 1ni0 h GLN 17 N 0.27 1.01 -0.28 2.37 5.75 -1.40 -1.26 115.11 121.57 1ni0 h GLN 17 Ca 0.37 -0.16 0.01 0.00 -0.15 0.00 0.00 58.65 58.71 1ni0 h GLN 17 Cb 0.58 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.94 1ni0 h GLN 17 CO -0.46 0.82 0.18 0.93 -2.65 0.00 0.00 178.83 177.64 1ni0 h GLU 18 N 0.97 0.35 -0.92 1.69 5.08 -0.43 -0.64 114.58 120.69 1ni0 h GLU 18 Ca 0.24 -0.02 0.11 0.00 -1.00 0.00 0.00 59.36 58.68 1ni0 h GLU 18 Cb 0.15 -0.08 -0.08 0.00 0.50 0.00 0.00 28.75 29.25 1ni0 h GLU 18 CO -0.03 0.23 0.56 -0.92 -1.00 0.00 0.00 179.01 177.85 1ni0 h TYR 19 N 0.36 1.01 0.00 4.33 3.20 -0.07 0.62 116.97 126.43 1ni0 h TYR 19 Ca 0.11 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.94 1ni0 h TYR 19 Cb -0.03 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 37.92 1ni0 h TYR 19 CO -0.06 0.41 -0.33 0.37 -1.64 0.00 0.00 178.16 176.90 1ni0 h GLN 20 N 0.91 0.00 -0.28 1.82 5.75 -0.38 0.16 115.11 123.09 1ni0 h GLN 20 Ca 0.45 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.83 1ni0 h GLN 20 Cb 0.41 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.96 1ni0 h GLN 20 CO -0.25 0.33 -0.27 -0.44 -2.65 0.00 0.00 178.83 175.55 1ni0 h ASP 21 N 0.00 0.72 -0.13 -0.69 3.32 0.55 -0.64 116.42 119.55 1ni0 h ASP 21 Ca -0.00 -0.47 -0.00 0.00 0.02 0.00 0.00 57.03 56.57 1ni0 h ASP 21 Cb 0.65 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 1ni0 h ASP 21 CO 0.04 1.04 0.08 0.25 -1.72 0.00 0.00 179.24 178.93 1ni0 h LEU 22 N 0.41 0.16 -1.24 1.55 5.85 -0.64 -2.33 115.31 119.07 1ni0 h LEU 22 Ca 0.04 -0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.73 1ni0 h LEU 22 Cb 0.84 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.78 1ni0 h LEU 22 CO 0.07 0.18 0.53 0.00 -0.34 0.00 0.00 178.44 178.88 1ni0 h ALA 23 N 0.99 1.51 -0.48 1.25 0.00 -0.47 -2.28 119.26 119.78 1ni0 h ALA 23 Ca 0.05 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 1ni0 h ALA 23 Cb 0.05 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1ni0 h ALA 23 CO -0.01 0.41 -0.21 1.25 0.00 0.00 0.00 179.25 180.69 1ni0 h LEU 24 N 0.99 1.00 -2.74 0.00 5.85 -0.85 -0.84 115.31 118.71 1ni0 h LEU 24 Ca 0.32 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.67 1ni0 h LEU 24 Cb 0.04 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.79 1ni0 h LEU 24 CO -0.09 1.16 0.00 0.50 -0.34 0.00 0.00 178.44 179.67 1ni0 h LYS 25 N 0.84 0.00 -0.58 1.25 3.64 -0.87 -1.48 116.57 119.37 1ni0 h LYS 25 Ca 0.11 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 59.25 1ni0 h LYS 25 Cb 0.78 0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 32.46 1ni0 h LYS 25 CO 0.07 0.00 0.19 0.72 -2.27 0.00 0.00 179.45 178.15 1ni0 n HIS 26 N -2.99 1.86 -0.91 1.91 8.25 -0.61 -4.95 115.22 117.78 1ni0 n HIS 26 Ca -0.03 -1.44 0.00 0.00 -0.26 0.00 0.00 57.72 56.00 1ni0 n HIS 26 Cb 0.08 -0.62 0.00 0.00 1.12 0.00 0.00 29.99 30.58 1ni0 n HIS 26 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ni0 n GLY 27 N -0.78 0.51 3.35 -1.41 0.00 -0.56 -4.71 105.19 101.58 1ni0 n GLY 27 Ca 0.39 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.96 1ni0 n GLY 27 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ni0 s ILE 28 N -2.37 5.19 0.38 -0.61 1.01 -0.42 -4.96 121.20 119.41 1ni0 s ILE 28 Ca 0.00 -1.27 0.15 0.00 0.00 0.00 0.00 60.65 59.53 1ni0 s ILE 28 Cb 0.00 -4.27 0.14 0.00 0.01 0.00 0.00 42.46 38.35 1ni0 s ILE 28 CO 0.00 -0.77 1.89 0.78 0.00 0.00 0.00 174.94 176.84 1ni0 h ASN 29 N 8.86 0.00 -2.59 3.58 4.21 -1.91 -3.16 115.58 124.57 1ni0 h ASN 29 Ca -0.29 0.00 -0.36 0.00 1.21 0.00 0.00 56.30 56.86 1ni0 h ASN 29 Cb 1.10 0.00 -0.37 0.00 -1.12 0.00 0.00 38.32 37.94 1ni0 h ASN 29 CO 0.98 0.30 -0.66 -0.62 -1.29 0.00 0.00 177.43 176.14 1ni0 s ASP 30 N -6.81 1.70 0.57 5.81 2.15 -1.26 -4.93 116.67 113.90 1ni0 s ASP 30 Ca -0.03 -0.41 0.34 0.00 0.43 0.00 0.00 52.55 52.88 1ni0 s ASP 30 Cb 0.14 0.25 1.70 0.00 -0.30 0.00 0.00 42.92 44.71 1ni0 s ASP 30 CO 0.70 -0.34 2.14 0.16 -0.17 0.00 0.00 175.17 177.65 1ni0 h ILE 31 N 6.33 0.28 -0.22 4.11 3.07 -1.88 -2.45 117.51 126.74 1ni0 h ILE 31 Ca -0.17 -0.37 0.00 0.00 1.55 0.00 0.00 64.86 65.87 1ni0 h ILE 31 Cb 1.14 1.29 0.00 0.00 -0.27 0.00 0.00 36.82 38.97 1ni0 h ILE 31 CO 0.30 0.06 0.00 0.49 -1.05 0.00 0.00 178.15 177.94 1ni0 n PHE 32 N -3.36 0.29 -4.35 0.16 3.72 -1.26 -1.05 117.46 111.61 1ni0 n PHE 32 Ca -0.02 -0.15 -0.25 0.00 -0.05 0.00 0.00 57.45 56.99 1ni0 n PHE 32 Cb 0.21 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.63 1ni0 n PHE 32 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1ni0 s GLN 33 N -1.71 1.32 -1.73 -1.08 -0.21 -0.92 -4.79 119.66 110.54 1ni0 s GLN 33 Ca 0.28 -1.36 -0.14 0.00 0.02 0.00 0.00 55.36 54.16 1ni0 s GLN 33 Cb 0.15 -1.60 0.14 0.00 1.00 0.00 0.00 33.01 32.70 1ni0 s GLN 33 CO 0.21 0.36 0.36 -0.25 -2.12 0.00 0.00 175.29 173.85 1ni0 n ASP 34 N 0.64 -0.73 -2.06 5.90 8.00 -1.26 -0.51 116.55 126.53 1ni0 n ASP 34 Ca -0.16 -1.24 -0.16 0.00 0.71 0.00 0.00 54.79 53.95 1ni0 n ASP 34 Cb 0.55 -1.57 -0.03 0.00 -0.02 0.00 0.00 41.12 40.05 1ni0 n ASP 34 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1ni0 n ASN 35 N -2.58 -4.45 -0.26 -2.24 3.02 -1.26 -4.86 115.26 102.63 1ni0 n ASN 35 Ca -0.05 0.22 0.15 0.00 -0.03 0.00 0.00 54.58 54.87 1ni0 n ASN 35 Cb 0.54 -3.86 0.44 0.00 -0.61 0.00 0.00 39.78 36.28 1ni0 n ASN 35 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1ni0 h GLY 36 N 0.00 1.10 1.84 7.41 0.00 -0.85 0.59 103.07 113.16 1ni0 h GLY 36 Ca -0.35 -0.25 -0.06 0.00 0.00 0.00 0.00 47.33 46.67 1ni0 h GLY 36 CO 0.45 0.03 -0.20 -1.33 0.00 0.00 0.00 176.54 175.49 1ni0 h GLY 37 N 0.56 0.21 0.42 4.60 0.00 -1.35 -1.50 103.07 106.01 1ni0 h GLY 37 Ca 0.47 -0.14 -0.07 0.00 0.00 0.00 0.00 47.33 47.58 1ni0 h GLY 37 CO -0.21 0.13 -0.30 0.50 0.00 0.00 0.00 176.54 176.66 1ni0 h LYS 38 N 0.18 0.17 -0.94 4.80 1.57 -1.22 -3.30 116.57 117.83 1ni0 h LYS 38 Ca 0.03 -0.21 0.18 0.00 -1.87 0.00 0.00 60.65 58.78 1ni0 h LYS 38 Cb 0.47 0.07 -0.08 0.00 0.08 0.00 0.00 32.23 32.76 1ni0 h LYS 38 CO 0.03 0.99 0.60 1.25 -0.57 0.00 0.00 179.45 181.75 1ni0 h LEU 39 N -0.55 0.63 -0.78 2.94 5.85 -1.20 0.59 115.31 122.79 1ni0 h LEU 39 Ca -0.04 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1ni0 h LEU 39 Cb 1.11 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.05 1ni0 h LEU 39 CO 0.06 0.26 0.44 0.25 -0.34 0.00 0.00 178.44 179.11 1ni0 h LEU 40 N 0.63 0.96 -0.10 2.25 5.85 -1.36 -0.92 115.31 122.63 1ni0 h LEU 40 Ca 0.51 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 59.17 1ni0 h LEU 40 Cb 0.94 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 41.66 1ni0 h LEU 40 CO -0.26 0.77 -0.48 1.56 -0.34 0.00 0.00 178.44 179.69 1ni0 h GLN 41 N 1.08 -0.54 -0.71 1.25 4.20 -0.96 0.11 115.11 119.53 1ni0 h GLN 41 Ca 0.28 0.04 0.07 0.00 0.06 0.00 0.00 58.65 59.09 1ni0 h GLN 41 Cb 0.01 0.12 -0.06 0.00 0.30 0.00 0.00 27.48 27.85 1ni0 h GLN 41 CO -0.05 -0.36 0.40 0.28 -0.67 0.00 0.00 178.83 178.43 1ni0 h VAL 42 N -0.56 0.96 -0.49 -0.54 2.07 -1.20 -1.21 116.25 115.27 1ni0 h VAL 42 Ca 0.05 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 67.30 1ni0 h VAL 42 Cb 0.67 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 1ni0 h VAL 42 CO -0.40 0.13 0.24 -0.07 0.02 0.00 0.00 177.57 177.50 1ni0 h LEU 43 N 0.73 0.64 -0.75 2.57 3.38 -0.12 -1.15 115.31 120.61 1ni0 h LEU 43 Ca 0.32 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 58.06 1ni0 h LEU 43 Cb 0.22 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1ni0 h LEU 43 CO -0.20 0.59 -0.22 -0.07 0.09 0.00 0.00 178.44 178.63 1ni0 h LEU 44 N 0.65 0.72 0.43 1.67 3.38 -0.40 0.71 115.31 122.48 1ni0 h LEU 44 Ca 0.17 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1ni0 h LEU 44 Cb 0.11 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1ni0 h LEU 44 CO -0.02 0.93 -0.21 0.40 0.09 0.00 0.00 178.44 179.63 1ni0 h ILE 45 N 0.63 0.53 0.00 1.22 2.04 -1.01 -3.33 117.51 117.59 1ni0 h ILE 45 Ca 0.09 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1ni0 h ILE 45 Cb 0.71 0.70 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1ni0 h ILE 45 CO 0.05 0.06 0.00 0.71 0.00 0.00 0.00 178.15 178.98 1ni0 h THR 46 N -0.82 0.00 0.00 -0.27 1.35 -1.21 -3.48 112.91 108.48 1ni0 h THR 46 Ca -0.06 -0.82 0.00 0.00 -0.55 0.00 0.00 66.41 64.98 1ni0 h THR 46 Cb 0.55 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 68.79 1ni0 h THR 46 CO 0.10 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.98 1ni0 n GLY 47 N 0.88 0.65 3.82 5.82 0.00 0.24 -5.04 105.19 111.55 1ni0 n GLY 47 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1ni0 n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ni0 s LEU 48 N 0.00 2.70 -0.04 0.99 1.02 -1.18 -4.65 118.68 117.52 1ni0 s LEU 48 Ca 0.00 1.30 0.05 0.00 0.02 0.00 0.00 54.13 55.49 1ni0 s LEU 48 Cb 0.00 -3.97 -0.01 0.00 0.02 0.00 0.00 46.19 42.24 1ni0 s LEU 48 CO 0.00 -1.81 -0.18 -0.89 0.02 0.00 0.00 176.35 173.49 1ni0 s THR 49 N -3.19 1.46 0.43 5.49 2.01 -0.74 -4.84 115.64 116.26 1ni0 s THR 49 Ca 0.60 -0.74 -0.20 0.00 0.31 0.00 0.00 61.69 61.66 1ni0 s THR 49 Cb -0.14 -1.24 -0.10 0.00 0.01 0.00 0.00 72.50 71.03 1ni0 s THR 49 CO 0.54 0.42 0.93 -0.69 -0.69 0.00 0.00 174.62 175.13 1ni0 s VAL 50 N -0.08 4.44 0.11 3.82 1.01 -1.26 -1.36 120.40 127.08 1ni0 s VAL 50 Ca -0.01 1.40 0.03 0.00 0.00 0.00 0.00 61.98 63.40 1ni0 s VAL 50 Cb -0.11 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 1ni0 s VAL 50 CO 0.02 -0.35 0.12 -0.76 0.00 0.00 0.00 175.10 174.13 1ni0 s LEU 51 N -3.26 3.87 0.32 3.92 1.43 -0.04 -4.88 118.68 120.04 1ni0 s LEU 51 Ca 0.61 -0.02 -0.28 0.00 -1.03 0.00 0.00 54.13 53.41 1ni0 s LEU 51 Cb -0.09 -2.52 -0.13 0.00 0.03 0.00 0.00 46.19 43.48 1ni0 s LEU 51 CO 0.16 0.13 1.14 -2.65 0.23 0.00 0.00 176.35 175.36 1ni0 n PRO 52 N 0.11 1.72 0.01 1.29 -0.02 -1.26 -4.83 135.00 132.02 1ni0 n PRO 52 Ca -0.08 0.60 0.23 0.00 -2.02 0.00 0.00 63.50 62.23 1ni0 n PRO 52 Cb 0.53 -2.08 0.70 0.00 -0.02 0.00 0.00 33.50 32.63 1ni0 n PRO 52 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1ni0 h GLY 53 N 2.24 0.00 2.00 -1.23 0.00 -1.97 0.43 103.07 104.55 1ni0 h GLY 53 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1ni0 h GLY 53 CO 0.61 0.00 0.00 0.07 0.00 0.00 0.00 176.54 177.22 1ni0 h ARG 54 N 0.00 0.00 -6.99 4.80 0.11 -1.94 -3.45 114.38 106.91 1ni0 h ARG 54 Ca 0.27 0.00 -0.50 0.00 0.10 0.00 0.00 59.98 59.85 1ni0 h ARG 54 Cb 1.46 0.00 0.05 0.00 1.11 0.00 0.00 29.97 32.59 1ni0 h ARG 54 CO -0.00 0.00 0.47 -1.21 0.10 0.00 0.00 179.97 179.33 1ni0 s GLU 55 N -3.38 3.88 0.07 0.08 0.41 0.14 -4.97 118.70 114.93 1ni0 s GLU 55 Ca 0.05 1.73 -0.28 0.00 -0.41 0.00 0.00 54.97 56.06 1ni0 s GLU 55 Cb 0.09 -2.47 -0.17 0.00 -1.78 0.00 0.00 34.13 29.80 1ni0 s GLU 55 CO 0.52 -0.44 1.64 0.78 -0.49 0.00 0.00 175.26 177.27 1ni0 h GLY 56 N 2.21 -0.48 -1.06 -1.39 0.00 -1.87 -3.44 103.07 97.04 1ni0 h GLY 56 Ca -0.49 0.18 -0.46 0.00 0.00 0.00 0.00 47.33 46.56 1ni0 h GLY 56 CO 0.61 -0.18 0.25 -1.31 0.00 0.00 0.00 176.54 175.92 1ni0 s ASN 57 N -4.81 4.67 -0.01 0.19 0.01 -1.26 -5.03 114.94 108.70 1ni0 s ASN 57 Ca -0.15 0.45 0.11 0.00 -0.71 0.00 0.00 52.86 52.55 1ni0 s ASN 57 Cb 0.04 -1.04 -0.15 0.00 0.41 0.00 0.00 41.25 40.52 1ni0 s ASN 57 CO 0.63 -1.70 0.34 0.47 -1.51 0.00 0.00 177.10 175.33 1ni0 n ASP 58 N -3.00 1.59 -3.89 -1.22 8.00 -0.87 -4.77 116.55 112.38 1ni0 n ASP 58 Ca 0.09 -0.34 -0.09 0.00 0.71 0.00 0.00 54.79 55.16 1ni0 n ASP 58 Cb 0.60 1.27 -0.05 0.00 -0.02 0.00 0.00 41.12 42.93 1ni0 n ASP 58 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ni0 s ALA 59 N -2.42 -0.58 -0.07 2.24 0.00 -0.86 -0.86 121.76 119.20 1ni0 s ALA 59 Ca -0.00 -0.58 -0.20 0.00 0.00 0.00 0.00 51.96 51.18 1ni0 s ALA 59 Cb 0.07 0.94 0.04 0.00 0.00 0.00 0.00 23.12 24.18 1ni0 s ALA 59 CO 0.45 -0.84 0.46 0.54 0.00 0.00 0.00 175.76 176.37 1ni0 s VAL 60 N -3.95 0.03 0.69 0.00 0.11 -0.46 -0.60 120.40 116.21 1ni0 s VAL 60 Ca 0.16 -0.21 0.03 0.00 -2.93 0.00 0.00 61.98 59.03 1ni0 s VAL 60 Cb -0.01 -0.74 0.12 0.00 -1.53 0.00 0.00 36.38 34.22 1ni0 s VAL 60 CO 0.04 -0.12 0.95 1.51 -3.33 0.00 0.00 175.10 174.15 1ni0 s ASP 61 N -0.85 4.51 0.03 3.54 1.47 -0.11 -1.79 116.67 123.46 1ni0 s ASP 61 Ca -0.09 -0.60 0.05 0.00 1.18 0.00 0.00 52.55 53.08 1ni0 s ASP 61 Cb -0.03 0.23 0.22 0.00 -0.34 0.00 0.00 42.92 43.00 1ni0 s ASP 61 CO 0.05 -1.76 1.15 0.59 0.68 0.00 0.00 175.17 175.88 1ni0 n ASN 62 N -2.67 0.05 -1.10 2.11 5.03 -1.26 -1.82 115.26 115.60 1ni0 n ASN 62 Ca 0.16 0.52 0.08 0.00 0.87 0.00 0.00 54.58 56.21 1ni0 n ASN 62 Cb 0.61 -0.53 0.27 0.00 -1.02 0.00 0.00 39.78 39.11 1ni0 n ASN 62 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ni0 n ALA 63 N -1.52 2.74 -0.90 5.41 0.00 -1.26 -4.96 120.51 120.02 1ni0 n ALA 63 Ca 0.01 -1.62 0.00 0.00 0.00 0.00 0.00 53.44 51.83 1ni0 n ALA 63 Cb 0.04 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1ni0 n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ni0 n GLY 64 N 0.54 0.76 3.72 0.00 0.00 -0.76 -5.03 105.19 104.43 1ni0 n GLY 64 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1ni0 n GLY 64 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ni0 s GLN 65 N -0.10 4.55 0.26 1.61 2.00 -1.26 -4.84 119.66 121.87 1ni0 s GLN 65 Ca 0.00 1.26 0.05 0.00 -2.00 0.00 0.00 55.36 54.67 1ni0 s GLN 65 Cb 0.00 -3.42 -0.03 0.00 0.80 0.00 0.00 33.01 30.36 1ni0 s GLN 65 CO 0.00 0.08 0.38 -1.21 -0.50 0.00 0.00 175.29 174.05 1ni0 s GLU 66 N 0.59 3.38 0.03 1.67 2.02 -1.26 -0.93 118.70 124.20 1ni0 s GLU 66 Ca 0.46 -0.80 -0.05 0.00 0.02 0.00 0.00 54.97 54.60 1ni0 s GLU 66 Cb -0.21 -2.87 -0.01 0.00 0.10 0.00 0.00 34.13 31.14 1ni0 s GLU 66 CO 0.25 0.36 0.09 0.71 0.02 0.00 0.00 175.26 176.69 1ni0 s TYR 67 N -2.02 0.19 0.01 1.61 1.51 0.23 -4.20 117.35 114.67 1ni0 s TYR 67 Ca 0.36 -0.47 -0.10 0.00 -1.01 0.00 0.00 57.07 55.85 1ni0 s TYR 67 Cb -0.09 -0.14 -0.05 0.00 -0.11 0.00 0.00 41.96 41.57 1ni0 s TYR 67 CO 0.30 -0.35 0.33 -1.21 -1.11 0.00 0.00 175.55 173.51 1ni0 s GLU 68 N -2.42 3.72 -0.27 -0.62 0.41 -0.92 -2.04 118.70 116.55 1ni0 s GLU 68 Ca -0.07 0.14 0.02 0.00 -0.41 0.00 0.00 54.97 54.65 1ni0 s GLU 68 Cb -0.02 -3.11 0.07 0.00 -1.78 0.00 0.00 34.13 29.29 1ni0 s GLU 68 CO -0.04 0.65 -0.02 -0.51 -0.49 0.00 0.00 175.26 174.85 1ni0 s LEU 69 N -1.50 3.23 0.21 1.80 1.43 -1.26 -1.45 118.68 121.13 1ni0 s LEU 69 Ca 0.26 -1.51 0.08 0.00 -1.03 0.00 0.00 54.13 51.94 1ni0 s LEU 69 Cb -0.14 -1.32 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 1ni0 s LEU 69 CO 0.14 -0.28 -0.01 -0.54 0.23 0.00 0.00 176.35 175.89 1ni0 s LYS 70 N 1.24 2.32 0.14 1.70 -0.14 -0.92 -5.01 119.74 119.07 1ni0 s LYS 70 Ca -0.01 -1.24 -0.24 0.00 -1.36 0.00 0.00 55.97 53.13 1ni0 s LYS 70 Cb -0.19 -2.26 0.07 0.00 -1.68 0.00 0.00 37.83 33.77 1ni0 s LYS 70 CO -0.09 0.42 0.63 -1.54 -0.76 0.00 0.00 175.35 174.02 1ni0 s SER 71 N -3.18 -0.55 0.18 2.83 1.04 -1.26 -1.76 113.70 111.00 1ni0 s SER 71 Ca 0.28 0.03 -0.16 0.00 0.48 0.00 0.00 55.95 56.58 1ni0 s SER 71 Cb -0.08 0.58 0.03 0.00 0.10 0.00 0.00 66.02 66.64 1ni0 s SER 71 CO 0.18 -0.92 0.47 0.27 0.98 0.00 0.00 173.24 174.23 1ni0 s ILE 72 N -3.58 0.04 -0.26 -1.02 -4.36 -0.78 -4.72 121.20 106.51 1ni0 s ILE 72 Ca 0.01 -0.80 -0.04 0.00 -0.26 0.00 0.00 60.65 59.56 1ni0 s ILE 72 Cb -0.01 -1.52 0.02 0.00 1.25 0.00 0.00 42.46 42.19 1ni0 s ILE 72 CO -0.12 -0.17 -0.01 0.21 0.24 0.00 0.00 174.94 175.09 1ni0 s ASN 73 N -2.87 4.58 0.00 4.36 3.04 -1.26 -0.38 114.94 122.41 1ni0 s ASN 73 Ca 0.09 -0.77 0.22 0.00 0.04 0.00 0.00 52.86 52.44 1ni0 s ASN 73 Cb 0.00 -1.74 0.99 0.00 -1.54 0.00 0.00 41.25 38.96 1ni0 s ASN 73 CO -0.04 -0.14 1.71 2.30 -3.04 0.00 0.00 177.10 177.89 1ni0 n ILE 74 N 4.75 0.44 0.30 -5.21 -6.64 0.19 -2.51 119.36 110.68 1ni0 n ILE 74 Ca -0.16 0.11 0.12 0.00 -1.77 0.00 0.00 62.75 61.05 1ni0 n ILE 74 Cb 0.48 -0.73 0.53 0.00 -1.44 0.00 0.00 39.64 38.48 1ni0 n ILE 74 CO 0.00 0.00 0.00 0.47 -1.77 0.00 0.00 176.55 175.25 1ni0 n ASP 75 N -1.45 0.63 0.00 7.28 8.00 -1.26 -3.68 116.55 126.07 1ni0 n ASP 75 Ca 0.07 0.71 0.00 0.00 0.71 0.00 0.00 54.79 56.27 1ni0 n ASP 75 Cb 0.24 -0.82 0.00 0.00 -0.02 0.00 0.00 41.12 40.52 1ni0 n ASP 75 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ni0 n LEU 76 N -2.26 0.00 -3.70 0.64 -0.00 -1.05 -5.05 117.00 105.59 1ni0 n LEU 76 Ca 0.01 -0.12 -0.10 0.00 -0.00 0.00 0.00 56.01 55.80 1ni0 n LEU 76 Cb 0.15 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.52 1ni0 n LEU 76 CO 0.16 0.00 0.12 0.28 -0.00 0.00 0.00 177.39 177.94 1ni0 s THR 77 N -0.41 0.08 0.00 1.47 -1.32 -1.04 -5.05 115.64 109.36 1ni0 s THR 77 Ca 0.00 -0.74 0.00 0.00 -1.21 0.00 0.00 61.69 59.74 1ni0 s THR 77 Cb 0.00 -1.27 0.00 0.00 -1.51 0.00 0.00 72.50 69.72 1ni0 s THR 77 CO 0.00 -0.35 0.57 0.29 -2.21 0.00 0.00 174.62 172.92 1ni0 n LYS 78 N -0.21 0.26 -5.09 7.08 4.76 -1.26 -4.13 118.16 119.58 1ni0 n LYS 78 Ca -0.15 -0.71 -0.31 0.00 -2.87 0.00 0.00 58.31 54.27 1ni0 n LYS 78 Cb 0.63 -0.91 -0.15 0.00 -1.84 0.00 0.00 35.03 32.77 1ni0 n LYS 78 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1ni0 s GLY 79 N -0.27 1.38 -0.03 0.72 0.00 -1.26 -1.03 107.32 106.84 1ni0 s GLY 79 Ca 0.00 -1.12 -0.21 0.00 0.00 0.00 0.00 44.72 43.39 1ni0 s GLY 79 CO 0.00 -0.94 0.62 -1.36 0.00 0.00 0.00 173.10 171.42 1ni0 s PHE 80 N -0.70 3.64 0.58 1.90 0.08 0.21 -4.80 117.98 118.90 1ni0 s PHE 80 Ca 0.11 1.20 -0.18 0.00 0.12 0.00 0.00 56.93 58.18 1ni0 s PHE 80 Cb -0.10 -2.66 -0.04 0.00 -0.57 0.00 0.00 43.02 39.65 1ni0 s PHE 80 CO 0.00 0.27 1.11 -1.12 -0.10 0.00 0.00 175.22 175.38 1ni0 s SER 81 N 0.13 5.58 0.04 1.36 0.01 -1.26 -1.63 113.70 117.92 1ni0 s SER 81 Ca 0.32 2.05 0.00 0.00 1.31 0.00 0.00 55.95 59.63 1ni0 s SER 81 Cb -0.18 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.49 1ni0 s SER 81 CO 0.17 -1.31 0.00 0.35 0.41 0.00 0.00 173.24 172.86 1ni0 n THR 82 N -1.74 0.25 -3.64 1.44 -2.24 -1.25 -4.89 114.28 102.20 1ni0 n THR 82 Ca 0.11 0.08 -0.08 0.00 -2.27 0.00 0.00 64.05 61.89 1ni0 n THR 82 Cb 0.52 -0.93 -0.07 0.00 -2.10 0.00 0.00 70.33 67.75 1ni0 n THR 82 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1ni0 s HIS 83 N -1.25 -1.02 0.59 4.78 2.46 -1.26 -5.08 115.29 114.50 1ni0 s HIS 83 Ca 0.00 2.07 -0.16 0.00 0.47 0.00 0.00 55.06 57.44 1ni0 s HIS 83 Cb 0.00 0.59 -0.04 0.00 -0.13 0.00 0.00 32.58 33.00 1ni0 s HIS 83 CO 0.00 -0.50 1.06 -1.01 -2.47 0.00 0.00 174.74 171.82 1ni0 s HIS 84 N 1.49 2.97 -1.40 3.88 3.76 -1.26 -2.17 115.29 122.55 1ni0 s HIS 84 Ca -0.09 1.52 -0.01 0.00 -0.15 0.00 0.00 55.06 56.33 1ni0 s HIS 84 Cb -0.05 -3.03 0.00 0.00 1.11 0.00 0.00 32.58 30.61 1ni0 s HIS 84 CO -0.17 -1.13 0.42 0.72 -0.85 0.00 0.00 174.74 173.73 1ni0 n HIS 85 N -1.95 -1.64 -2.31 1.40 8.25 -1.24 -4.82 115.22 112.91 1ni0 n HIS 85 Ca 0.09 0.72 -0.42 0.00 -0.26 0.00 0.00 57.72 57.85 1ni0 n HIS 85 Cb 0.53 -3.69 -0.03 0.00 1.12 0.00 0.00 29.99 27.92 1ni0 n HIS 85 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 1ni0 s MET 86 N -6.56 4.32 0.35 -0.41 0.00 -0.20 -4.78 119.30 112.01 1ni0 s MET 86 Ca 0.03 1.87 0.04 0.00 0.00 0.00 0.00 55.69 57.63 1ni0 s MET 86 Cb -0.01 -3.52 -0.03 0.00 0.00 0.00 0.00 34.83 31.27 1ni0 s MET 86 CO 0.89 -0.50 0.17 0.54 0.00 0.00 0.00 175.02 176.13 1ni0 s ASN 87 N 1.63 2.08 0.40 1.11 2.20 -1.26 -0.82 114.94 120.28 1ni0 s ASN 87 Ca 0.61 -1.65 0.29 0.00 -0.94 0.00 0.00 52.86 51.17 1ni0 s ASN 87 Cb -0.30 0.46 1.27 0.00 -2.00 0.00 0.00 41.25 40.69 1ni0 s ASN 87 CO 0.26 -0.94 1.85 1.55 -2.94 0.00 0.00 177.10 176.88 1ni0 h PRO 88 N 2.03 0.00 0.22 3.55 0.13 -1.95 -1.58 132.00 134.39 1ni0 h PRO 88 Ca -0.32 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.50 1ni0 h PRO 88 Cb 1.25 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.42 1ni0 h PRO 88 CO 0.51 0.00 -1.31 0.28 -0.23 0.00 0.00 178.00 177.24 1ni0 h VAL 89 N 0.00 1.33 -0.39 1.56 2.07 -1.98 -1.25 116.25 117.60 1ni0 h VAL 89 Ca 0.00 -2.64 0.01 0.00 0.82 0.00 0.00 66.70 64.89 1ni0 h VAL 89 Cb 0.33 3.05 -0.02 0.00 -1.52 0.00 0.00 31.29 33.13 1ni0 h VAL 89 CO 0.00 0.78 0.24 0.40 0.02 0.00 0.00 177.57 179.02 1ni0 h ILE 90 N 0.04 1.07 0.26 4.57 1.08 -1.89 -0.84 117.51 121.81 1ni0 h ILE 90 Ca -0.23 -0.17 0.01 0.00 -0.39 0.00 0.00 64.86 64.08 1ni0 h ILE 90 Cb 2.03 0.53 -0.03 0.00 -3.07 0.00 0.00 36.82 36.29 1ni0 h ILE 90 CO 0.25 0.09 -0.34 0.40 -0.69 0.00 0.00 178.15 177.85 1ni0 h ILE 91 N 0.50 0.29 -1.02 -0.67 1.08 -1.31 -0.50 117.51 115.88 1ni0 h ILE 91 Ca 0.15 0.00 0.25 0.00 -0.39 0.00 0.00 64.86 64.87 1ni0 h ILE 91 Cb -0.03 0.29 -0.11 0.00 -3.07 0.00 0.00 36.82 33.89 1ni0 h ILE 91 CO -0.05 0.00 0.62 0.00 -0.69 0.00 0.00 178.15 178.04 1ni0 h ALA 92 N -0.13 1.94 -0.07 1.87 0.00 -0.56 0.23 119.26 122.55 1ni0 h ALA 92 Ca -0.00 0.10 -0.23 0.00 0.00 0.00 0.00 54.91 54.77 1ni0 h ALA 92 Cb 0.63 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.44 1ni0 h ALA 92 CO -0.11 -0.38 -0.89 0.87 0.00 0.00 0.00 179.25 178.73 1ni0 h LYS 93 N 0.53 0.66 -0.42 0.00 1.57 -0.51 -3.32 116.57 115.07 1ni0 h LYS 93 Ca 0.62 -0.62 0.02 0.00 -1.87 0.00 0.00 60.65 58.81 1ni0 h LYS 93 Cb 1.30 0.15 -0.03 0.00 0.08 0.00 0.00 32.23 33.73 1ni0 h LYS 93 CO -0.40 1.22 0.23 0.74 -0.57 0.00 0.00 179.45 180.68 1ni0 h PHE 94 N 0.41 0.44 0.00 -1.35 0.04 0.10 -2.78 116.94 113.80 1ni0 h PHE 94 Ca -0.08 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.70 1ni0 h PHE 94 Cb 1.52 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 39.54 1ni0 h PHE 94 CO 0.08 0.24 0.00 2.89 -0.60 0.00 0.00 178.31 180.93 1ni0 n ARG 95 N -4.88 0.40 0.06 1.51 1.85 -0.24 -2.48 116.66 112.88 1ni0 n ARG 95 Ca 0.02 0.00 0.11 0.00 -1.00 0.00 0.00 57.85 56.98 1ni0 n ARG 95 Cb 0.08 -1.41 0.02 0.00 -1.05 0.00 0.00 32.46 30.10 1ni0 n ARG 95 CO 0.00 0.00 0.00 0.94 -0.01 0.00 0.00 177.63 178.56 1ni0 n GLN 96 N -0.91 0.44 -4.36 2.89 7.27 -1.05 -4.78 117.38 116.88 1ni0 n GLN 96 Ca 0.08 0.04 -0.23 0.00 0.07 0.00 0.00 57.00 56.95 1ni0 n GLN 96 Cb 0.04 -1.68 -0.11 0.00 2.41 0.00 0.00 30.24 30.89 1ni0 n GLN 96 CO 0.00 0.00 0.00 0.14 0.07 0.00 0.00 177.06 177.27 1ni0 s VAL 97 N -3.28 1.97 0.68 1.69 -7.23 -1.04 -4.94 120.40 108.24 1ni0 s VAL 97 Ca 0.01 -1.96 -0.14 0.00 -1.81 0.00 0.00 61.98 58.09 1ni0 s VAL 97 Cb 0.12 -1.92 0.01 0.00 0.56 0.00 0.00 36.38 35.15 1ni0 s VAL 97 CO 0.79 -0.27 1.09 -2.84 -0.31 0.00 0.00 175.10 173.57 1ni0 s PRO 98 N -2.78 2.78 0.05 4.82 0.02 -1.26 -4.41 135.00 134.22 1ni0 s PRO 98 Ca 0.17 1.27 0.09 0.00 0.02 0.00 0.00 61.00 62.55 1ni0 s PRO 98 Cb -0.06 -1.96 -0.03 0.00 0.02 0.00 0.00 34.50 32.47 1ni0 s PRO 98 CO 0.08 -1.25 -0.25 -1.58 -0.33 0.00 0.00 177.00 173.67 1ni0 s TRP 99 N -2.55 2.37 -0.08 6.54 0.52 -0.31 -2.17 118.94 123.26 1ni0 s TRP 99 Ca 0.64 -0.38 0.04 0.00 0.02 0.00 0.00 56.10 56.43 1ni0 s TRP 99 Cb -0.18 -1.39 -0.00 0.00 -1.15 0.00 0.00 33.47 30.75 1ni0 s TRP 99 CO 0.45 0.17 -0.22 0.96 0.02 0.00 0.00 176.95 178.34 1ni0 s ILE 100 N -0.86 1.86 -0.14 2.03 -5.25 -0.53 -1.17 121.20 117.13 1ni0 s ILE 100 Ca 0.13 -0.92 -0.01 0.00 -0.99 0.00 0.00 60.65 58.85 1ni0 s ILE 100 Cb -0.10 -1.60 -0.02 0.00 2.95 0.00 0.00 42.46 43.69 1ni0 s ILE 100 CO 0.03 0.52 -0.10 -0.36 -1.79 0.00 0.00 174.94 173.24 1ni0 s PHE 101 N 0.24 2.89 -0.19 1.37 0.40 0.17 -2.17 117.98 120.70 1ni0 s PHE 101 Ca -0.13 -0.56 -0.06 0.00 -0.60 0.00 0.00 56.93 55.57 1ni0 s PHE 101 Cb -0.16 -1.90 -0.03 0.00 0.51 0.00 0.00 43.02 41.44 1ni0 s PHE 101 CO 0.06 -0.18 0.03 0.00 0.70 0.00 0.00 175.22 175.83 1ni0 s ALA 102 N 0.43 3.22 -0.30 5.36 0.00 -0.72 -0.43 121.76 129.32 1ni0 s ALA 102 Ca -0.08 -0.85 -0.03 0.00 0.00 0.00 0.00 51.96 51.00 1ni0 s ALA 102 Cb -0.15 -1.83 0.04 0.00 0.00 0.00 0.00 23.12 21.18 1ni0 s ALA 102 CO 0.04 0.05 0.01 0.42 0.00 0.00 0.00 175.76 176.28 1ni0 s ILE 103 N 0.63 3.15 0.28 0.00 1.01 0.97 -1.87 121.20 125.37 1ni0 s ILE 103 Ca 0.01 -1.24 0.09 0.00 0.00 0.00 0.00 60.65 59.51 1ni0 s ILE 103 Cb -0.14 -2.76 -0.04 0.00 0.01 0.00 0.00 42.46 39.53 1ni0 s ILE 103 CO 0.02 -0.06 0.05 -0.31 0.00 0.00 0.00 174.94 174.64 1ni0 s TYR 104 N 1.30 2.76 -0.38 3.97 1.51 0.49 -0.06 117.35 126.94 1ni0 s TYR 104 Ca -0.03 -0.23 -0.01 0.00 -1.01 0.00 0.00 57.07 55.78 1ni0 s TYR 104 Cb -0.19 -1.30 0.10 0.00 -0.11 0.00 0.00 41.96 40.46 1ni0 s TYR 104 CO -0.01 0.56 0.15 1.03 -1.11 0.00 0.00 175.55 176.17 1ni0 s ARG 105 N -3.73 1.94 7.84 -0.62 1.81 0.16 0.56 118.95 126.91 1ni0 s ARG 105 Ca 0.33 -1.77 0.00 0.00 -1.72 0.00 0.00 55.73 52.57 1ni0 s ARG 105 Cb -0.06 -3.46 0.00 0.00 -0.45 0.00 0.00 34.95 30.98 1ni0 s ARG 105 CO 0.21 -0.99 0.00 0.41 -0.68 0.00 0.00 175.30 174.25 1ni0 n GLY 106 N 4.53 3.27 0.00 -3.53 0.00 -1.26 -2.02 105.19 106.18 1ni0 n GLY 106 Ca -0.02 -0.15 0.09 0.00 0.00 0.00 0.00 46.02 45.94 1ni0 n GLY 106 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ni0 n ILE 107 N 0.00 0.00 -2.31 -0.61 -5.35 -1.26 -4.82 119.36 105.01 1ni0 n ILE 107 Ca 0.00 -0.07 -0.42 0.00 -0.27 0.00 0.00 62.75 61.99 1ni0 n ILE 107 Cb 0.00 0.93 -0.03 0.00 -1.74 0.00 0.00 39.64 38.80 1ni0 n ILE 107 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ni0 s ALA 108 N -2.88 3.52 -0.11 -1.28 0.00 -0.86 -4.86 121.76 115.30 1ni0 s ALA 108 Ca 0.06 0.84 -0.30 0.00 0.00 0.00 0.00 51.96 52.57 1ni0 s ALA 108 Cb 0.15 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.70 1ni0 s ALA 108 CO 0.80 -0.75 1.24 -1.50 0.00 0.00 0.00 175.76 175.56 1ni0 s ILE 109 N 1.93 4.25 -0.24 0.00 1.10 -1.26 -0.67 121.20 126.31 1ni0 s ILE 109 Ca 0.61 1.55 0.05 0.00 -0.51 0.00 0.00 60.65 62.35 1ni0 s ILE 109 Cb -0.30 -4.00 -0.19 0.00 0.15 0.00 0.00 42.46 38.12 1ni0 s ILE 109 CO 0.26 -0.07 -0.14 -0.62 -2.11 0.00 0.00 174.94 172.26 1ni0 n GLU 110 N 5.93 0.66 -3.49 3.50 -0.58 0.91 -4.57 120.64 123.01 1ni0 n GLU 110 Ca 0.13 0.12 -0.10 0.00 -0.42 0.00 0.00 57.16 56.88 1ni0 n GLU 110 Cb 0.45 -1.53 -0.03 0.00 -0.57 0.00 0.00 31.44 29.77 1ni0 n GLU 110 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ni0 s ALA 111 N -2.52 -1.78 -0.05 0.62 0.00 -0.99 -1.13 121.76 115.92 1ni0 s ALA 111 Ca -0.29 0.97 0.01 0.00 0.00 0.00 0.00 51.96 52.65 1ni0 s ALA 111 Cb 0.08 0.39 0.02 0.00 0.00 0.00 0.00 23.12 23.61 1ni0 s ALA 111 CO 0.66 -0.65 -0.05 0.42 0.00 0.00 0.00 175.76 176.14 1ni0 s ILE 112 N -2.93 0.63 0.14 0.00 1.01 -0.80 -0.02 121.20 119.23 1ni0 s ILE 112 Ca 0.02 -0.17 0.11 0.00 0.00 0.00 0.00 60.65 60.62 1ni0 s ILE 112 Cb -0.01 -0.64 -0.04 0.00 0.01 0.00 0.00 42.46 41.78 1ni0 s ILE 112 CO -0.08 0.25 -0.26 -0.31 0.00 0.00 0.00 174.94 174.54 1ni0 s TYR 113 N 0.95 2.31 -0.15 3.97 1.51 0.43 -1.17 117.35 125.20 1ni0 s TYR 113 Ca -0.10 -0.37 0.02 0.00 -1.01 0.00 0.00 57.07 55.60 1ni0 s TYR 113 Cb -0.14 -1.23 0.01 0.00 -0.11 0.00 0.00 41.96 40.49 1ni0 s TYR 113 CO 0.00 0.38 -0.21 0.50 -1.11 0.00 0.00 175.55 175.11 1ni0 s ARG 114 N -2.20 2.89 -0.15 -0.62 3.52 -0.25 0.46 118.95 122.61 1ni0 s ARG 114 Ca 0.16 -0.80 -0.04 0.00 -0.13 0.00 0.00 55.73 54.91 1ni0 s ARG 114 Cb -0.10 -2.39 -0.03 0.00 -1.56 0.00 0.00 34.95 30.88 1ni0 s ARG 114 CO 0.07 -0.07 -0.03 -0.51 -0.81 0.00 0.00 175.30 173.95 1ni0 s LEU 115 N 0.96 3.32 0.83 -0.88 1.43 -0.32 -1.82 118.68 122.21 1ni0 s LEU 115 Ca -0.04 -0.09 -0.11 0.00 -1.03 0.00 0.00 54.13 52.85 1ni0 s LEU 115 Cb -0.15 -1.80 0.09 0.00 0.03 0.00 0.00 46.19 44.36 1ni0 s LEU 115 CO -0.05 0.18 1.10 -1.61 0.23 0.00 0.00 176.35 176.20 1ni0 s GLU 116 N 0.31 1.79 0.19 1.70 0.41 -1.26 -1.16 118.70 120.68 1ni0 s GLU 116 Ca -0.03 0.71 -0.14 0.00 -0.41 0.00 0.00 54.97 55.10 1ni0 s GLU 116 Cb -0.14 -1.88 0.19 0.00 -1.78 0.00 0.00 34.13 30.52 1ni0 s GLU 116 CO 0.03 -1.84 1.66 -1.35 -0.49 0.00 0.00 175.26 173.27 1ni0 h PRO 117 N -1.25 0.06 -0.16 0.39 0.11 -1.86 -0.28 132.00 128.99 1ni0 h PRO 117 Ca -0.48 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 1ni0 h PRO 117 Cb 1.27 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 1ni0 h PRO 117 CO 0.57 0.04 0.03 1.57 -0.21 0.00 0.00 178.00 180.00 1ni0 h LYS 118 N 0.06 0.22 0.00 1.05 2.10 -1.92 -2.14 116.57 115.94 1ni0 h LYS 118 Ca 0.26 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.88 1ni0 h LYS 118 Cb 0.40 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.68 1ni0 h LYS 118 CO -0.48 0.22 0.00 -0.25 -2.00 0.00 0.00 179.45 176.94 1ni0 n ASP 119 N -4.43 0.00 -0.23 7.07 8.00 -0.12 -1.01 116.55 125.83 1ni0 n ASP 119 Ca -0.01 0.40 0.06 0.00 0.71 0.00 0.00 54.79 55.96 1ni0 n ASP 119 Cb 0.14 -0.42 -0.02 0.00 -0.02 0.00 0.00 41.12 40.81 1ni0 n ASP 119 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1ni0 n LEU 120 N -1.42 1.24 -0.33 0.64 4.77 -0.81 -4.63 117.00 116.48 1ni0 n LEU 120 Ca 0.01 -0.71 0.24 0.00 -0.03 0.00 0.00 56.01 55.53 1ni0 n LEU 120 Cb 0.04 0.00 0.47 0.00 -2.33 0.00 0.00 43.42 41.60 1ni0 n LEU 120 CO 0.03 0.25 1.01 -0.08 -1.33 0.00 0.00 177.39 177.27 1ni0 h GLU 121 N 1.15 0.10 -0.31 3.23 4.57 -1.11 0.12 114.58 122.33 1ni0 h GLU 121 Ca 0.00 -0.01 0.05 0.00 -1.18 0.00 0.00 59.36 58.22 1ni0 h GLU 121 Cb 0.41 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.94 1ni0 h GLU 121 CO 0.00 0.07 0.05 0.35 -1.18 0.00 0.00 179.01 178.30 1ni0 h PHE 122 N 0.11 0.08 -0.11 0.92 3.57 -1.82 -1.75 116.94 117.93 1ni0 h PHE 122 Ca 0.74 0.02 -0.19 0.00 3.53 0.00 0.00 57.97 62.07 1ni0 h PHE 122 Cb 1.78 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 40.53 1ni0 h PHE 122 CO -0.13 0.00 -0.71 1.88 -2.23 0.00 0.00 178.31 177.12 1ni0 h TYR 123 N 0.16 0.68 -0.08 0.41 -1.99 -1.33 -2.45 116.97 112.36 1ni0 h TYR 123 Ca 0.15 -0.29 0.00 0.00 2.00 0.00 0.00 58.73 60.59 1ni0 h TYR 123 Cb 0.17 -0.11 -0.00 0.00 2.00 0.00 0.00 36.73 38.79 1ni0 h TYR 123 CO -0.19 1.06 0.05 1.88 -0.00 0.00 0.00 178.16 180.96 1ni0 h TYR 124 N 0.35 0.11 -0.18 4.88 0.05 -1.24 0.10 116.97 121.04 1ni0 h TYR 124 Ca -0.03 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.78 1ni0 h TYR 124 Cb 1.29 -0.04 -0.02 0.00 1.01 0.00 0.00 36.73 38.97 1ni0 h TYR 124 CO 0.05 0.09 0.03 -0.44 -1.05 0.00 0.00 178.16 176.85 1ni0 h ASP 125 N 0.09 0.00 -0.29 3.88 3.32 -1.32 -1.95 116.42 120.16 1ni0 h ASP 125 Ca 0.03 0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.16 1ni0 h ASP 125 Cb 0.01 0.04 -0.05 0.00 0.22 0.00 0.00 39.33 39.55 1ni0 h ASP 125 CO -0.01 0.03 -0.02 0.50 -1.72 0.00 0.00 179.24 178.02 1ni0 h LYS 126 N 0.10 0.06 -0.10 3.56 3.64 -1.23 -2.08 116.57 120.52 1ni0 h LYS 126 Ca 0.08 -0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1ni0 h LYS 126 Cb 0.08 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1ni0 h LYS 126 CO -0.11 0.04 0.07 -1.49 -2.27 0.00 0.00 179.45 175.69 1ni0 h TRP 127 N 0.06 0.06 -0.18 1.91 6.55 -0.45 -2.20 115.95 121.69 1ni0 h TRP 127 Ca 0.14 0.00 -0.05 0.00 0.95 0.00 0.00 58.89 59.93 1ni0 h TRP 127 Cb 0.19 -0.02 -0.01 0.00 -0.86 0.00 0.00 29.16 28.47 1ni0 h TRP 127 CO -0.23 0.04 -0.07 0.93 -1.05 0.00 0.00 178.44 178.05 1ni0 h GLU 128 N 0.06 0.37 -0.52 0.49 5.08 -0.65 -3.14 114.58 116.27 1ni0 h GLU 128 Ca 0.04 -0.16 0.08 0.00 -1.00 0.00 0.00 59.36 58.33 1ni0 h GLU 128 Cb 0.10 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.27 1ni0 h GLU 128 CO -0.00 0.66 0.15 0.00 -1.00 0.00 0.00 179.01 178.81 1ni0 h ARG 129 N 0.07 0.29 0.00 2.33 2.47 -1.15 0.17 114.38 118.57 1ni0 h ARG 129 Ca 0.04 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.75 1ni0 h ARG 129 Cb 0.54 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.79 1ni0 h ARG 129 CO 0.02 0.19 0.00 1.17 0.56 0.00 0.00 179.97 181.92 1ni0 n LYS 130 N -5.06 0.39 -0.05 0.04 4.81 -1.06 -0.14 118.16 117.09 1ni0 n LYS 130 Ca 0.06 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.40 1ni0 n LYS 130 Cb 0.24 -1.35 -0.03 0.00 0.02 0.00 0.00 35.03 33.91 1ni0 n LYS 130 CO 0.00 0.00 0.00 1.87 1.17 0.00 0.00 177.40 180.44 1ni0 n TRP 131 N -0.85 0.00 0.01 5.64 -0.00 -0.05 -4.36 117.44 117.84 1ni0 n TRP 131 Ca 0.07 0.00 -0.18 0.00 -0.00 0.00 0.00 57.50 57.39 1ni0 n TRP 131 Cb 0.03 -0.38 -0.12 0.00 -0.00 0.00 0.00 31.31 30.84 1ni0 n TRP 131 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 177.69 179.57 1ni0 h TYR 132 N -0.51 0.56 0.00 5.87 -1.99 -1.09 -1.02 116.97 118.79 1ni0 h TYR 132 Ca -0.17 -0.33 -0.06 0.00 2.00 0.00 0.00 58.73 60.16 1ni0 h TYR 132 Cb 0.90 -0.05 -0.01 0.00 2.00 0.00 0.00 36.73 39.57 1ni0 h TYR 132 CO -0.14 1.18 -0.30 1.03 -0.00 0.00 0.00 178.16 179.93 1ni0 h SER 133 N -0.22 0.00 0.00 3.88 0.87 -0.76 0.11 113.55 117.43 1ni0 h SER 133 Ca -0.09 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.47 1ni0 h SER 133 Cb 1.39 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.35 1ni0 h SER 133 CO 0.12 0.30 0.00 -0.67 -0.53 0.00 0.00 176.83 176.05 1ni0 n ASP 134 N -4.10 0.00 0.00 6.23 -0.08 -1.19 -4.85 116.55 112.57 1ni0 n ASP 134 Ca -0.02 -0.46 0.00 0.00 -1.51 0.00 0.00 54.79 52.80 1ni0 n ASP 134 Cb 0.35 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.81 1ni0 n ASP 134 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1ni0 n GLY 135 N -0.10 2.16 0.00 0.27 0.00 0.39 -4.73 105.19 103.18 1ni0 n GLY 135 Ca 0.11 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1ni0 n GLY 135 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ni0 n HIS 136 N 0.00 0.00 0.00 1.61 8.25 -0.40 -4.63 115.22 120.05 1ni0 n HIS 136 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1ni0 n HIS 136 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1ni0 n HIS 136 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1ni0 n LYS 137 N -0.61 0.00 -0.70 -0.41 4.81 -1.25 -4.98 118.16 115.02 1ni0 n LYS 137 Ca 0.00 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 57.11 1ni0 n LYS 137 Cb 0.00 0.00 0.16 0.00 0.02 0.00 0.00 35.03 35.21 1ni0 n LYS 137 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1ni0 n ASP 138 N 0.00 -2.48 -4.10 3.14 8.00 -1.26 -4.63 116.55 115.22 1ni0 n ASP 138 Ca 0.00 -0.13 -0.32 0.00 0.71 0.00 0.00 54.79 55.05 1ni0 n ASP 138 Cb 0.00 -0.88 -0.16 0.00 -0.02 0.00 0.00 41.12 40.05 1ni0 n ASP 138 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ni0 s ILE 139 N -2.19 1.90 -1.10 0.53 1.01 0.00 -4.91 121.20 116.44 1ni0 s ILE 139 Ca 0.53 -0.85 -0.21 0.00 0.00 0.00 0.00 60.65 60.12 1ni0 s ILE 139 Cb -0.08 -1.72 0.07 0.00 0.01 0.00 0.00 42.46 40.73 1ni0 s ILE 139 CO 0.65 0.51 1.50 0.21 0.00 0.00 0.00 174.94 177.82 1ni0 s ASN 140 N 1.23 6.64 -1.01 3.58 2.47 -1.26 -1.04 114.94 125.56 1ni0 s ASN 140 Ca 0.02 -1.88 -0.05 0.00 0.42 0.00 0.00 52.86 51.37 1ni0 s ASN 140 Cb -0.14 -2.55 -0.06 0.00 -1.45 0.00 0.00 41.25 37.06 1ni0 s ASN 140 CO -0.10 -1.33 0.88 -3.20 -3.72 0.00 0.00 177.10 169.63 1ni0 n ASN 141 N 8.36 -5.83 -4.63 -4.21 5.15 -0.92 -4.91 115.26 108.26 1ni0 n ASN 141 Ca 0.37 -0.66 -0.30 0.00 -0.60 0.00 0.00 54.58 53.39 1ni0 n ASN 141 Cb 0.49 -4.93 0.18 0.00 -0.53 0.00 0.00 39.78 34.99 1ni0 n ASN 141 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1ni0 s PRO 142 N -4.43 0.60 0.25 1.20 0.04 -1.26 -4.68 135.00 126.72 1ni0 s PRO 142 Ca 0.38 1.38 0.09 0.00 0.04 0.00 0.00 61.00 62.89 1ni0 s PRO 142 Cb -0.05 -1.69 -0.04 0.00 0.04 0.00 0.00 34.50 32.76 1ni0 s PRO 142 CO 0.70 -2.86 -0.03 0.15 0.04 0.00 0.00 177.00 175.00 1ni0 s LYS 143 N -4.61 2.24 -0.24 4.56 -0.14 -1.26 -3.79 119.74 116.49 1ni0 s LYS 143 Ca 0.67 -1.39 0.00 0.00 -1.36 0.00 0.00 55.97 53.89 1ni0 s LYS 143 Cb -0.23 -2.16 0.04 0.00 -1.68 0.00 0.00 37.83 33.80 1ni0 s LYS 143 CO 0.59 0.38 -0.09 0.42 -0.76 0.00 0.00 175.35 175.89 1ni0 s ILE 144 N -2.20 2.53 0.17 2.17 1.01 -0.65 -4.85 121.20 119.38 1ni0 s ILE 144 Ca 0.30 -1.23 -0.33 0.00 0.00 0.00 0.00 60.65 59.39 1ni0 s ILE 144 Cb -0.07 -2.33 -0.13 0.00 0.01 0.00 0.00 42.46 39.95 1ni0 s ILE 144 CO 0.19 0.16 1.66 -2.65 0.00 0.00 0.00 174.94 174.29 1ni0 n PRO 145 N 4.58 2.43 -0.16 2.79 -0.02 -1.26 0.67 135.00 144.03 1ni0 n PRO 145 Ca -0.16 0.88 0.10 0.00 -2.02 0.00 0.00 63.50 62.29 1ni0 n PRO 145 Cb 0.46 -2.68 0.42 0.00 -0.02 0.00 0.00 33.50 31.67 1ni0 n PRO 145 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1ni0 h VAL 146 N 3.78 0.93 -0.17 -1.45 2.07 -1.45 -1.82 116.25 118.14 1ni0 h VAL 146 Ca -0.44 -0.21 0.05 0.00 0.82 0.00 0.00 66.70 66.92 1ni0 h VAL 146 Cb 1.23 0.28 -0.05 0.00 -1.52 0.00 0.00 31.29 31.23 1ni0 h VAL 146 CO 0.92 0.11 -0.15 0.50 0.02 0.00 0.00 177.57 178.97 1ni0 h LYS 147 N 0.60 -0.16 -0.58 1.57 3.64 -1.91 -0.29 116.57 119.44 1ni0 h LYS 147 Ca 0.33 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.77 1ni0 h LYS 147 Cb 0.48 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.29 1ni0 h LYS 147 CO -0.11 -0.11 0.31 -0.92 -2.27 0.00 0.00 179.45 176.35 1ni0 h TYR 148 N -0.17 0.56 -0.55 1.91 5.03 -1.73 0.46 116.97 122.49 1ni0 h TYR 148 Ca 0.11 0.02 0.04 0.00 2.58 0.00 0.00 58.73 61.48 1ni0 h TYR 148 Cb 0.32 -0.17 -0.04 0.00 1.55 0.00 0.00 36.73 38.39 1ni0 h TYR 148 CO -0.28 0.27 0.30 0.28 -1.32 0.00 0.00 178.16 177.41 1ni0 h VAL 149 N 0.58 1.00 -0.17 1.81 2.07 -0.88 -0.44 116.25 120.23 1ni0 h VAL 149 Ca 0.26 -0.20 -0.09 0.00 0.82 0.00 0.00 66.70 67.48 1ni0 h VAL 149 Cb 0.16 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 1ni0 h VAL 149 CO -0.17 0.11 -0.31 0.24 0.02 0.00 0.00 177.57 177.46 1ni0 h MET 150 N 0.59 0.34 -0.16 1.57 2.86 -0.21 0.12 114.93 120.03 1ni0 h MET 150 Ca 0.23 -0.13 -0.16 0.00 -2.06 0.00 0.00 59.70 57.58 1ni0 h MET 150 Cb 0.09 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 1ni0 h MET 150 CO -0.14 0.62 -0.58 1.49 1.06 0.00 0.00 176.91 179.36 1ni0 h GLU 151 N 0.29 0.52 0.00 1.72 4.57 -0.43 -3.37 114.58 117.88 1ni0 h GLU 151 Ca 0.04 -0.34 0.00 0.00 -1.18 0.00 0.00 59.36 57.88 1ni0 h GLU 151 Cb 0.70 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.33 1ni0 h GLU 151 CO 0.05 0.95 -0.45 0.72 -1.18 0.00 0.00 179.01 179.11 1ni0 n HIS 152 N -3.94 0.00 -2.65 0.92 8.25 -0.22 -5.04 115.22 112.54 1ni0 n HIS 152 Ca -0.03 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.21 1ni0 n HIS 152 Cb 0.62 -0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.78 1ni0 n HIS 152 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1ni0 s GLY 153 N -1.88 1.80 -0.16 -1.41 0.00 0.40 -4.85 107.32 101.23 1ni0 s GLY 153 Ca 0.03 -1.49 -0.03 0.00 0.00 0.00 0.00 44.72 43.23 1ni0 s GLY 153 CO 0.37 -1.12 -0.06 -1.08 0.00 0.00 0.00 173.10 171.22 1ni0 s THR 154 N -2.86 3.64 -0.32 0.90 -1.32 -0.75 -4.87 115.64 110.05 1ni0 s THR 154 Ca 0.60 -0.44 -0.29 0.00 -1.21 0.00 0.00 61.69 60.35 1ni0 s THR 154 Cb -0.09 -2.59 -0.00 0.00 -1.51 0.00 0.00 72.50 68.32 1ni0 s THR 154 CO 0.40 0.49 1.39 -0.75 -2.21 0.00 0.00 174.62 173.94 1ni0 s LYS 155 N 0.49 3.79 0.00 7.08 2.20 -1.26 -1.09 119.74 130.94 1ni0 s LYS 155 Ca -0.05 1.23 0.24 0.00 -0.36 0.00 0.00 55.97 57.04 1ni0 s LYS 155 Cb -0.15 -3.95 0.25 0.00 -1.51 0.00 0.00 37.83 32.47 1ni0 s LYS 155 CO 0.03 -1.28 1.27 0.44 -0.36 0.00 0.00 175.35 175.45 1ni0 n ILE 156 N 6.50 0.00 -3.59 5.43 -5.35 -0.32 -4.96 119.36 117.07 1ni0 n ILE 156 Ca 0.16 -0.36 -0.13 0.00 -0.27 0.00 0.00 62.75 62.15 1ni0 n ILE 156 Cb 0.47 1.22 -0.06 0.00 -1.74 0.00 0.00 39.64 39.53 1ni0 n ILE 156 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 1ni0 s TYR 157 N -2.22 -0.62 -0.08 4.28 6.14 -1.16 -4.97 117.35 118.73 1ni0 s TYR 157 Ca 0.25 1.35 -0.10 0.00 0.64 0.00 0.00 57.07 59.21 1ni0 s TYR 157 Cb 0.19 0.35 0.02 0.00 0.42 0.00 0.00 41.96 42.95 1ni0 s TYR 157 CO 0.42 -0.40 0.27 0.00 0.64 0.00 0.00 175.55 176.48 1ni0 s ALA 158 N -0.29 -0.66 -2.00 3.97 0.00 -1.26 -1.90 121.76 119.62 1ni0 s ALA 158 Ca -0.02 0.60 0.26 0.00 0.00 0.00 0.00 51.96 52.79 1ni0 s ALA 158 Cb -0.03 -0.30 1.54 0.00 0.00 0.00 0.00 23.12 24.33 1ni0 s ALA 158 CO 0.02 -0.16 1.89 0.00 0.00 0.00 0.00 175.76 177.51