#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ihb h GLU 8 N 0.00 -0.05 -0.37 3.52 4.39 -2.03 -0.63 114.58 119.41 1ihb h GLU 8 Ca 0.00 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.61 1ihb h GLU 8 Cb 0.00 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 1ihb h GLU 8 CO 0.00 -0.04 -0.15 1.25 -1.16 0.00 0.00 179.01 178.91 1ihb h LEU 9 N -0.06 0.77 -0.05 1.33 5.85 -1.96 -2.07 115.31 119.12 1ihb h LEU 9 Ca 0.01 -0.40 -0.00 0.00 0.84 0.00 0.00 57.88 58.33 1ihb h LEU 9 Cb 0.07 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.88 1ihb h LEU 9 CO -0.03 0.99 0.02 0.00 -0.34 0.00 0.00 178.44 179.09 1ihb h ALA 10 N 0.80 0.06 -0.40 1.25 0.00 -1.89 -1.45 119.26 117.63 1ihb h ALA 10 Ca 0.08 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1ihb h ALA 10 Cb 0.69 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1ihb h ALA 10 CO 0.05 -0.36 -0.03 0.66 0.00 0.00 0.00 179.25 179.58 1ihb h SER 11 N -0.07 0.63 -0.45 0.00 4.64 -1.13 0.72 113.55 117.89 1ihb h SER 11 Ca 0.02 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 1ihb h SER 11 Cb 0.16 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.06 1ihb h SER 11 CO -0.00 0.72 0.30 0.00 -0.87 0.00 0.00 176.83 176.98 1ihb h ALA 12 N 1.35 0.57 -0.36 5.18 0.00 -1.16 -0.56 119.26 124.28 1ihb h ALA 12 Ca 0.12 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1ihb h ALA 12 Cb 0.43 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1ihb h ALA 12 CO 0.02 0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.29 1ihb h ALA 13 N 1.16 0.48 -1.01 0.00 0.00 -0.80 0.13 119.26 119.23 1ihb h ALA 13 Ca 0.16 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.86 1ihb h ALA 13 Cb -0.07 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.53 1ihb h ALA 13 CO -0.04 0.24 0.66 0.00 0.00 0.00 0.00 179.25 180.12 1ihb h ALA 14 N 0.87 1.34 -0.72 0.00 0.00 -0.53 -2.40 119.26 117.82 1ihb h ALA 14 Ca 0.10 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ihb h ALA 14 Cb 0.45 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1ihb h ALA 14 CO 0.02 0.57 0.00 2.89 0.00 0.00 0.00 179.25 182.72 1ihb n ARG 15 N -4.43 2.71 -1.66 0.00 1.85 -0.25 -3.77 116.66 111.10 1ihb n ARG 15 Ca 0.14 -2.65 -0.08 0.00 -1.00 0.00 0.00 57.85 54.25 1ihb n ARG 15 Cb 0.09 -1.57 -0.02 0.00 -1.05 0.00 0.00 32.46 29.91 1ihb n ARG 15 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1ihb n GLY 16 N 1.67 0.54 3.53 2.89 0.00 -0.82 -4.96 105.19 108.05 1ihb n GLY 16 Ca 0.24 -0.63 -0.43 0.00 0.00 0.00 0.00 46.02 45.20 1ihb n GLY 16 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ihb s ASP 17 N -2.79 6.93 0.27 1.61 -1.08 0.38 -4.80 116.67 117.18 1ihb s ASP 17 Ca 0.00 -2.66 -0.02 0.00 -0.52 0.00 0.00 52.55 49.35 1ihb s ASP 17 Cb 0.00 -2.51 0.45 0.00 -1.46 0.00 0.00 42.92 39.40 1ihb s ASP 17 CO 0.00 -1.00 1.86 0.25 0.52 0.00 0.00 175.17 176.80 1ihb h LEU 18 N 11.44 0.97 0.25 -1.34 5.85 -1.93 -0.93 115.31 129.63 1ihb h LEU 18 Ca 0.40 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 59.13 1ihb h LEU 18 Cb 0.87 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.73 1ihb h LEU 18 CO 1.37 0.58 -0.12 -0.08 -0.34 0.00 0.00 178.44 179.86 1ihb h GLU 19 N 1.08 -0.33 -0.72 1.25 4.81 -1.97 -1.08 114.58 117.62 1ihb h GLU 19 Ca 0.45 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.70 1ihb h GLU 19 Cb 0.28 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.70 1ihb h GLU 19 CO -0.21 -0.11 0.46 0.37 -0.73 0.00 0.00 179.01 178.79 1ihb h GLN 20 N -0.48 0.96 -0.30 1.92 5.75 -1.92 -1.36 115.11 119.68 1ihb h GLN 20 Ca -0.03 -0.07 0.05 0.00 -0.15 0.00 0.00 58.65 58.45 1ihb h GLN 20 Cb 0.36 -0.21 -0.05 0.00 1.07 0.00 0.00 27.48 28.66 1ihb h GLN 20 CO 0.06 0.66 0.01 1.25 -2.65 0.00 0.00 178.83 178.15 1ihb h LEU 21 N 0.98 -0.10 -1.20 -2.39 5.85 -1.09 -1.17 115.31 116.19 1ihb h LEU 21 Ca 0.26 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.98 1ihb h LEU 21 Cb -0.08 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1ihb h LEU 21 CO -0.05 -0.02 -0.21 0.74 -0.34 0.00 0.00 178.44 178.57 1ihb h THR 22 N 0.10 1.23 -0.31 1.05 2.02 -0.74 -0.26 112.91 116.00 1ihb h THR 22 Ca 0.15 -1.04 -0.06 0.00 0.77 0.00 0.00 66.41 66.22 1ihb h THR 22 Cb 0.19 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.91 1ihb h THR 22 CO -0.24 0.32 -0.04 0.28 0.37 0.00 0.00 175.52 176.22 1ihb h SER 23 N 0.28 0.58 -0.22 4.18 0.02 -0.72 -1.66 113.55 116.01 1ihb h SER 23 Ca 0.05 -0.34 0.03 0.00 -0.84 0.00 0.00 61.79 60.69 1ihb h SER 23 Cb 0.52 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.88 1ihb h SER 23 CO 0.04 0.78 0.04 -0.07 -1.14 0.00 0.00 176.83 176.48 1ihb h LEU 24 N 0.36 0.00 -1.12 5.07 4.07 -0.76 -2.18 115.31 120.76 1ihb h LEU 24 Ca 0.08 0.03 0.08 0.00 0.08 0.00 0.00 57.88 58.16 1ihb h LEU 24 Cb 0.51 0.05 -0.06 0.00 1.08 0.00 0.00 40.66 42.23 1ihb h LEU 24 CO 0.02 0.03 0.60 -0.07 -1.08 0.00 0.00 178.44 177.95 1ihb h LEU 25 N 0.12 0.91 -2.60 1.67 3.38 -0.90 -1.43 115.31 116.46 1ihb h LEU 25 Ca 0.10 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 1ihb h LEU 25 Cb 0.10 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1ihb h LEU 25 CO -0.13 0.56 -0.01 1.56 0.09 0.00 0.00 178.44 180.51 1ihb h GLN 26 N 1.02 0.00 -0.64 1.13 4.20 -0.64 -1.67 115.11 118.51 1ihb h GLN 26 Ca 0.42 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.13 1ihb h GLN 26 Cb 0.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1ihb h GLN 26 CO -0.17 0.01 0.00 0.09 -0.67 0.00 0.00 178.83 178.08 1ihb n ASN 27 N -3.15 4.53 -3.59 1.46 3.02 -0.54 -4.93 115.26 112.05 1ihb n ASN 27 Ca -0.02 -2.55 -0.24 0.00 -0.03 0.00 0.00 54.58 51.74 1ihb n ASN 27 Cb 0.13 -0.59 0.08 0.00 -0.61 0.00 0.00 39.78 38.79 1ihb n ASN 27 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1ihb n ASN 28 N 0.79 -6.34 -4.74 6.41 5.03 -0.63 -4.97 115.26 110.81 1ihb n ASN 28 Ca 0.23 -0.54 -0.35 0.00 0.87 0.00 0.00 54.58 54.79 1ihb n ASN 28 Cb 0.90 -4.99 0.06 0.00 -1.02 0.00 0.00 39.78 34.73 1ihb n ASN 28 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1ihb s VAL 29 N -3.31 2.55 -0.65 2.41 0.11 -1.23 -4.86 120.40 115.41 1ihb s VAL 29 Ca 0.58 0.30 -0.26 0.00 -2.93 0.00 0.00 61.98 59.67 1ihb s VAL 29 Cb -0.26 -2.95 -0.02 0.00 -1.53 0.00 0.00 36.38 31.62 1ihb s VAL 29 CO 0.72 -0.12 1.84 0.21 -3.33 0.00 0.00 175.10 174.42 1ihb s ASN 30 N -1.92 5.30 0.48 3.54 2.47 -1.26 -4.85 114.94 118.70 1ihb s ASN 30 Ca 0.75 0.18 0.15 0.00 0.42 0.00 0.00 52.86 54.35 1ihb s ASN 30 Cb -0.29 -2.53 1.15 0.00 -1.45 0.00 0.00 41.25 38.13 1ihb s ASN 30 CO 0.40 -2.39 2.09 0.58 -3.72 0.00 0.00 177.10 174.06 1ihb h VAL 31 N 6.89 0.98 -0.72 -5.21 2.07 -1.89 -2.79 116.25 115.58 1ihb h VAL 31 Ca -0.22 -0.06 -0.21 0.00 0.82 0.00 0.00 66.70 67.03 1ihb h VAL 31 Cb 1.14 0.78 -0.13 0.00 -1.52 0.00 0.00 31.29 31.57 1ihb h VAL 31 CO 1.22 0.03 0.26 0.59 0.02 0.00 0.00 177.57 179.69 1ihb n ASN 32 N -4.50 4.78 -4.77 0.57 3.02 -1.26 -4.48 115.26 108.63 1ihb n ASN 32 Ca 0.01 -3.24 -0.40 0.00 -0.03 0.00 0.00 54.58 50.93 1ihb n ASN 32 Cb 0.17 -0.74 -0.02 0.00 -0.61 0.00 0.00 39.78 38.59 1ihb n ASN 32 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ihb s ALA 33 N -3.00 3.35 -0.17 5.41 0.00 -1.06 -4.92 121.76 121.37 1ihb s ALA 33 Ca 0.55 1.16 -0.07 0.00 0.00 0.00 0.00 51.96 53.60 1ihb s ALA 33 Cb 0.44 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 20.07 1ihb s ALA 33 CO 0.13 -0.63 0.07 -0.65 0.00 0.00 0.00 175.76 174.68 1ihb s GLN 34 N -1.99 3.92 0.29 0.00 -0.21 -1.26 -4.12 119.66 116.28 1ihb s GLN 34 Ca 0.52 -0.32 -0.05 0.00 0.02 0.00 0.00 55.36 55.54 1ihb s GLN 34 Cb -0.37 -3.21 0.07 0.00 1.00 0.00 0.00 33.01 30.50 1ihb s GLN 34 CO 0.48 0.33 0.33 0.27 -2.12 0.00 0.00 175.29 174.58 1ihb n ASN 35 N 3.35 -0.50 0.23 5.90 6.94 0.15 -4.76 115.26 126.57 1ihb n ASN 35 Ca -0.17 -0.95 0.15 0.00 -0.02 0.00 0.00 54.58 53.59 1ihb n ASN 35 Cb 0.52 -0.27 0.79 0.00 -2.36 0.00 0.00 39.78 38.46 1ihb n ASN 35 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 1ihb h GLY 36 N -0.72 0.00 -2.22 4.83 0.00 -1.99 0.18 103.07 103.15 1ihb h GLY 36 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.22 1ihb h GLY 36 CO 0.08 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.31 1ihb n PHE 37 N -2.55 0.71 -1.36 5.60 3.72 -1.26 -4.95 117.46 117.36 1ihb n PHE 37 Ca -0.02 -0.42 -0.05 0.00 -0.05 0.00 0.00 57.45 56.91 1ihb n PHE 37 Cb 0.10 -0.01 -0.02 0.00 -0.94 0.00 0.00 39.48 38.62 1ihb n PHE 37 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ihb n GLY 38 N 1.32 0.62 3.62 1.37 0.00 0.64 -5.04 105.19 107.72 1ihb n GLY 38 Ca 0.20 -0.81 -0.33 0.00 0.00 0.00 0.00 46.02 45.08 1ihb n GLY 38 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ihb s ARG 39 N -2.84 2.69 0.75 1.61 0.52 -1.26 -4.69 118.95 115.74 1ihb s ARG 39 Ca 0.00 -0.62 -0.06 0.00 -0.52 0.00 0.00 55.73 54.52 1ihb s ARG 39 Cb 0.00 -2.59 0.11 0.00 0.52 0.00 0.00 34.95 32.99 1ihb s ARG 39 CO 0.00 0.63 1.06 0.95 0.02 0.00 0.00 175.30 177.96 1ihb s THR 40 N -0.95 2.21 0.22 0.02 -4.23 -1.26 -0.67 115.64 110.97 1ihb s THR 40 Ca 0.16 -0.33 -0.05 0.00 -1.18 0.00 0.00 61.69 60.28 1ihb s THR 40 Cb -0.11 -2.87 0.09 0.00 1.34 0.00 0.00 72.50 70.94 1ihb s THR 40 CO 0.06 0.00 1.70 0.00 -0.54 0.00 0.00 174.62 175.84 1ihb h ALA 41 N -0.75 0.96 -0.46 3.99 0.00 -1.78 -2.35 119.26 118.86 1ihb h ALA 41 Ca -0.42 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.12 1ihb h ALA 41 Cb 1.28 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1ihb h ALA 41 CO 0.49 0.63 -0.02 1.25 0.00 0.00 0.00 179.25 181.60 1ihb h LEU 42 N 0.86 0.74 -0.45 0.00 5.85 -1.94 -0.71 115.31 119.65 1ihb h LEU 42 Ca 0.16 -0.18 -0.14 0.00 0.84 0.00 0.00 57.88 58.55 1ihb h LEU 42 Cb 0.52 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 1ihb h LEU 42 CO 0.03 0.82 -0.27 1.56 -0.34 0.00 0.00 178.44 180.23 1ihb h GLN 43 N 0.72 0.98 0.00 1.25 4.20 -1.88 -3.12 115.11 117.25 1ihb h GLN 43 Ca 0.14 -0.45 0.00 0.00 0.06 0.00 0.00 58.65 58.40 1ihb h GLN 43 Cb 0.46 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1ihb h GLN 43 CO 0.02 1.12 -0.26 -0.39 -0.67 0.00 0.00 178.83 178.66 1ihb h VAL 44 N 0.82 0.00 -1.79 -0.54 -1.51 -1.36 -3.47 116.25 108.41 1ihb h VAL 44 Ca 0.09 -0.58 -0.67 0.00 -1.23 0.00 0.00 66.70 64.31 1ihb h VAL 44 Cb 0.86 1.42 0.07 0.00 -2.13 0.00 0.00 31.29 31.51 1ihb h VAL 44 CO 0.08 0.00 0.29 0.80 -1.23 0.00 0.00 177.57 177.51 1ihb n MET 45 N -2.35 1.06 -2.55 5.19 0.00 -0.28 -3.98 117.12 114.21 1ihb n MET 45 Ca 0.04 0.38 -0.42 0.00 0.00 0.00 0.00 57.70 57.70 1ihb n MET 45 Cb 0.45 -1.91 -0.03 0.00 0.00 0.00 0.00 33.22 31.74 1ihb n MET 45 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 175.97 176.18 1ihb s LYS 46 N -0.11 4.39 0.59 2.12 2.20 -1.02 -4.88 119.74 123.03 1ihb s LYS 46 Ca 0.77 1.57 -0.19 0.00 -0.36 0.00 0.00 55.97 57.76 1ihb s LYS 46 Cb -0.91 -3.53 -0.03 0.00 -1.51 0.00 0.00 37.83 31.85 1ihb s LYS 46 CO 0.51 -0.37 1.25 -0.51 -0.36 0.00 0.00 175.35 175.87 1ihb s LEU 47 N 2.00 3.69 0.00 5.43 1.43 -1.26 -3.52 118.68 126.45 1ihb s LEU 47 Ca 0.53 2.51 0.00 0.00 -1.03 0.00 0.00 54.13 56.15 1ihb s LEU 47 Cb -0.23 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 41.46 1ihb s LEU 47 CO 0.21 -1.67 0.00 0.61 0.23 0.00 0.00 176.35 175.74 1ihb n GLY 48 N 0.65 1.00 2.58 -3.19 0.00 -1.26 -5.00 105.19 99.97 1ihb n GLY 48 Ca 0.13 -0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 1ihb n GLY 48 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ihb n ASN 49 N 0.00 3.12 -0.07 1.61 3.02 -1.23 -4.95 115.26 116.76 1ihb n ASN 49 Ca 0.00 -3.39 0.22 0.00 -0.03 0.00 0.00 54.58 51.38 1ihb n ASN 49 Cb 0.00 -0.61 0.68 0.00 -0.61 0.00 0.00 39.78 39.24 1ihb n ASN 49 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1ihb h PRO 50 N 3.39 0.05 -0.61 3.52 0.13 -1.92 -1.11 132.00 135.45 1ihb h PRO 50 Ca 0.13 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.20 1ihb h PRO 50 Cb 0.67 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.77 1ihb h PRO 50 CO 0.72 0.03 0.14 0.93 -0.23 0.00 0.00 178.00 179.60 1ihb h GLU 51 N 0.05 0.97 -0.41 0.86 4.39 -1.98 0.19 114.58 118.65 1ihb h GLU 51 Ca 0.31 -0.22 -0.04 0.00 0.34 0.00 0.00 59.36 59.76 1ihb h GLU 51 Cb 1.17 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.67 1ihb h GLU 51 CO -0.02 0.87 0.11 0.82 -1.16 0.00 0.00 179.01 179.62 1ihb h ILE 52 N 0.92 1.23 -0.22 3.13 2.04 -1.61 0.80 117.51 123.79 1ihb h ILE 52 Ca 0.20 -0.78 -0.00 0.00 1.00 0.00 0.00 64.86 65.27 1ihb h ILE 52 Cb 0.34 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 1ihb h ILE 52 CO 0.00 0.27 0.12 0.00 0.00 0.00 0.00 178.15 178.55 1ihb h ALA 53 N 0.96 0.29 -0.45 1.87 0.00 -1.28 -0.97 119.26 119.68 1ihb h ALA 53 Ca 0.13 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ihb h ALA 53 Cb 0.31 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1ihb h ALA 53 CO 0.00 -0.18 0.26 -0.09 0.00 0.00 0.00 179.25 179.24 1ihb h ARG 54 N 0.25 0.62 -0.18 0.00 2.43 -0.42 -1.25 114.38 115.83 1ihb h ARG 54 Ca 0.08 -0.06 -0.13 0.00 -0.81 0.00 0.00 59.98 59.05 1ihb h ARG 54 Cb 0.07 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 1ihb h ARG 54 CO -0.01 0.47 -0.45 0.00 -1.51 0.00 0.00 179.97 178.47 1ihb h ARG 55 N 0.59 0.45 -0.16 0.20 3.08 -0.60 0.06 114.38 118.00 1ihb h ARG 55 Ca 0.16 -0.24 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 1ihb h ARG 55 Cb 0.02 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1ihb h ARG 55 CO -0.03 0.81 0.03 -0.07 -1.07 0.00 0.00 179.97 179.65 1ihb h LEU 56 N 0.36 0.24 -0.44 3.04 3.38 -0.93 -2.19 115.31 118.78 1ihb h LEU 56 Ca 0.02 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1ihb h LEU 56 Cb 0.94 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 1ihb h LEU 56 CO 0.08 0.42 0.24 -0.07 0.09 0.00 0.00 178.44 179.21 1ihb h LEU 57 N 0.05 0.54 -1.07 1.67 3.38 -1.16 -1.34 115.31 117.38 1ihb h LEU 57 Ca 0.05 -0.08 0.11 0.00 0.09 0.00 0.00 57.88 58.04 1ihb h LEU 57 Cb 0.28 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 40.82 1ihb h LEU 57 CO 0.00 0.47 0.62 0.25 0.09 0.00 0.00 178.44 179.87 1ihb h LEU 58 N 0.57 0.90 -0.92 1.67 5.85 -0.89 -1.44 115.31 121.05 1ihb h LEU 58 Ca 0.15 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1ihb h LEU 58 Cb 0.04 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.92 1ihb h LEU 58 CO -0.03 0.51 0.00 0.54 -0.34 0.00 0.00 178.44 179.13 1ihb n ARG 59 N -4.57 1.59 0.00 1.25 5.12 -0.83 -4.92 116.66 114.30 1ihb n ARG 59 Ca 0.17 -0.91 0.00 0.00 -1.93 0.00 0.00 57.85 55.19 1ihb n ARG 59 Cb 0.32 -1.30 0.00 0.00 -1.16 0.00 0.00 32.46 30.31 1ihb n ARG 59 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ihb n GLY 60 N 1.00 1.32 3.75 -0.13 0.00 -0.54 -4.85 105.19 105.74 1ihb n GLY 60 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1ihb n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ihb s ALA 61 N -2.00 3.45 -0.39 4.61 0.00 -0.56 -4.79 121.76 122.08 1ihb s ALA 61 Ca 0.00 1.02 -0.29 0.00 0.00 0.00 0.00 51.96 52.69 1ihb s ALA 61 Cb 0.00 -3.40 0.01 0.00 0.00 0.00 0.00 23.12 19.73 1ihb s ALA 61 CO 0.00 -0.37 1.31 -0.80 0.00 0.00 0.00 175.76 175.89 1ihb s ASN 62 N -0.37 6.52 0.30 0.00 0.01 -1.26 -4.68 114.94 115.46 1ihb s ASN 62 Ca 0.49 0.86 0.15 0.00 -0.71 0.00 0.00 52.86 53.66 1ihb s ASN 62 Cb -0.34 -2.54 0.33 0.00 0.41 0.00 0.00 41.25 39.11 1ihb s ASN 62 CO 0.42 -1.27 1.57 1.55 -1.51 0.00 0.00 177.10 177.86 1ihb h PRO 63 N 9.87 0.00 -0.23 -0.60 0.14 -1.92 -3.31 132.00 135.95 1ihb h PRO 63 Ca -0.26 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.88 1ihb h PRO 63 Cb 1.09 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.23 1ihb h PRO 63 CO 1.08 0.52 0.00 -0.25 0.14 0.00 0.00 178.00 179.49 1ihb n ASP 64 N -3.42 1.39 -4.73 1.44 8.00 -1.26 -4.37 116.55 113.59 1ihb n ASP 64 Ca 0.00 -1.90 -0.42 0.00 0.71 0.00 0.00 54.79 53.19 1ihb n ASP 64 Cb 0.65 -0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.57 1ihb n ASP 64 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1ihb s LEU 65 N -1.16 4.38 0.07 0.64 1.43 -1.25 -4.88 118.68 117.91 1ihb s LEU 65 Ca 0.22 2.50 -0.08 0.00 -1.03 0.00 0.00 54.13 55.73 1ihb s LEU 65 Cb 0.11 -3.60 -0.05 0.00 0.03 0.00 0.00 46.19 42.68 1ihb s LEU 65 CO 0.16 -0.69 0.37 -0.54 0.23 0.00 0.00 176.35 175.88 1ihb s LYS 66 N 0.53 3.70 0.03 1.70 1.02 -1.26 -4.21 119.74 121.25 1ihb s LYS 66 Ca 0.63 0.08 -0.00 0.00 0.02 0.00 0.00 55.97 56.70 1ihb s LYS 66 Cb -0.40 -2.99 0.01 0.00 -0.52 0.00 0.00 37.83 33.92 1ihb s LYS 66 CO 0.35 0.57 0.04 -0.40 -0.92 0.00 0.00 175.35 174.98 1ihb n ASP 67 N 0.84 0.02 0.07 2.83 5.68 0.29 -4.89 116.55 121.39 1ihb n ASP 67 Ca -0.08 -1.02 0.12 0.00 -0.50 0.00 0.00 54.79 53.31 1ihb n ASP 67 Cb 0.52 -0.03 0.46 0.00 -1.14 0.00 0.00 41.12 40.94 1ihb n ASP 67 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 1ihb n ARG 68 N -1.07 0.14 -0.03 0.11 1.85 -1.26 -2.04 116.66 114.37 1ihb n ARG 68 Ca 0.00 0.22 0.13 0.00 -1.00 0.00 0.00 57.85 57.20 1ihb n ARG 68 Cb 0.02 -1.70 0.36 0.00 -1.05 0.00 0.00 32.46 30.09 1ihb n ARG 68 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1ihb n THR 69 N -1.95 0.07 -0.57 8.89 -1.04 -1.26 -4.94 114.28 113.48 1ihb n THR 69 Ca 0.05 -0.37 0.00 0.00 -2.04 0.00 0.00 64.05 61.68 1ihb n THR 69 Cb 0.31 0.81 0.00 0.00 -1.82 0.00 0.00 70.33 69.63 1ihb n THR 69 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ihb n GLY 70 N 1.25 0.70 3.77 3.41 0.00 -0.86 -4.63 105.19 108.81 1ihb n GLY 70 Ca 0.17 -0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 1ihb n GLY 70 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ihb s PHE 71 N -2.00 3.33 0.33 1.61 0.08 -1.26 -4.05 117.98 116.02 1ihb s PHE 71 Ca 0.00 0.32 0.02 0.00 0.12 0.00 0.00 56.93 57.39 1ihb s PHE 71 Cb 0.00 -1.84 -0.03 0.00 -0.57 0.00 0.00 43.02 40.59 1ihb s PHE 71 CO 0.00 0.58 0.50 0.00 -0.10 0.00 0.00 175.22 176.20 1ihb s ALA 72 N -0.97 3.82 0.44 5.36 0.00 -1.26 -0.54 121.76 128.60 1ihb s ALA 72 Ca 0.15 -1.07 0.14 0.00 0.00 0.00 0.00 51.96 51.18 1ihb s ALA 72 Cb -0.12 -1.97 1.03 0.00 0.00 0.00 0.00 23.12 22.07 1ihb s ALA 72 CO 0.04 0.00 1.99 0.28 0.00 0.00 0.00 175.76 178.07 1ihb h VAL 73 N 0.83 0.91 -0.13 0.00 2.07 -1.76 0.42 116.25 118.59 1ihb h VAL 73 Ca -0.49 -0.14 -0.05 0.00 0.82 0.00 0.00 66.70 66.84 1ihb h VAL 73 Cb 1.23 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 1ihb h VAL 73 CO 0.60 0.07 -0.13 -0.29 0.02 0.00 0.00 177.57 177.84 1ihb h ILE 74 N 0.40 1.17 -0.24 4.57 2.10 -1.94 0.01 117.51 123.57 1ihb h ILE 74 Ca 0.26 -0.74 -0.03 0.00 1.08 0.00 0.00 64.86 65.43 1ihb h ILE 74 Cb 0.51 1.22 -0.01 0.00 -1.09 0.00 0.00 36.82 37.44 1ihb h ILE 74 CO -0.07 0.23 0.02 0.45 -1.08 0.00 0.00 178.15 177.69 1ihb h HIS 75 N 0.19 0.44 -0.22 2.19 3.86 -1.30 -1.30 115.15 119.01 1ihb h HIS 75 Ca 0.04 -0.07 0.01 0.00 -1.16 0.00 0.00 60.37 59.19 1ihb h HIS 75 Cb 0.35 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.69 1ihb h HIS 75 CO 0.00 0.56 0.12 -0.44 0.86 0.00 0.00 177.93 179.04 1ihb h ASP 76 N 0.20 0.20 -0.44 2.45 3.32 -1.07 -0.19 116.42 120.89 1ihb h ASP 76 Ca 0.07 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1ihb h ASP 76 Cb 0.37 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 1ihb h ASP 76 CO 0.01 0.15 0.19 0.00 -1.72 0.00 0.00 179.24 177.87 1ihb h ALA 77 N 1.10 0.57 -0.50 3.45 0.00 -0.98 -1.95 119.26 120.95 1ihb h ALA 77 Ca 0.09 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1ihb h ALA 77 Cb 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1ihb h ALA 77 CO -0.04 0.16 0.10 0.00 0.00 0.00 0.00 179.25 179.47 1ihb h ALA 78 N 1.03 0.67 -0.67 0.00 0.00 -1.09 0.11 119.26 119.31 1ihb h ALA 78 Ca 0.15 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1ihb h ALA 78 Cb 0.17 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1ihb h ALA 78 CO -0.01 0.38 0.19 -0.09 0.00 0.00 0.00 179.25 179.72 1ihb h ARG 79 N 0.70 1.03 -0.01 0.00 2.43 -0.99 -2.99 114.38 114.55 1ihb h ARG 79 Ca 0.16 -0.21 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1ihb h ARG 79 Cb 0.36 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1ihb h ARG 79 CO 0.01 0.89 -0.20 0.00 -1.51 0.00 0.00 179.97 179.15 1ihb n ALA 80 N -2.45 2.97 -1.22 2.80 0.00 -0.74 -4.83 120.51 117.03 1ihb n ALA 80 Ca 0.05 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.00 1ihb n ALA 80 Cb 0.23 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.64 1ihb n ALA 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ihb n GLY 81 N 1.31 0.52 3.41 0.00 0.00 -0.26 -5.01 105.19 105.18 1ihb n GLY 81 Ca 0.14 -0.87 -0.44 0.00 0.00 0.00 0.00 46.02 44.84 1ihb n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ihb s PHE 82 N -2.00 3.81 0.15 1.61 0.08 0.21 -4.88 117.98 116.97 1ihb s PHE 82 Ca 0.00 -2.35 -0.22 0.00 0.12 0.00 0.00 56.93 54.48 1ihb s PHE 82 Cb 0.00 -4.13 0.03 0.00 -0.57 0.00 0.00 43.02 38.36 1ihb s PHE 82 CO 0.00 -1.22 1.63 1.25 -0.10 0.00 0.00 175.22 176.78 1ihb h LEU 83 N 8.51 -0.74 -0.41 -0.37 6.46 -1.95 -2.63 115.31 124.17 1ihb h LEU 83 Ca 0.26 0.14 0.08 0.00 -0.12 0.00 0.00 57.88 58.23 1ihb h LEU 83 Cb 0.87 0.36 -0.09 0.00 -0.73 0.00 0.00 40.66 41.07 1ihb h LEU 83 CO 1.15 -0.27 -0.38 0.44 -0.62 0.00 0.00 178.44 178.77 1ihb h ASP 84 N -0.23 -1.25 -0.63 1.25 5.19 -1.98 0.26 116.42 119.03 1ihb h ASP 84 Ca 0.14 0.21 -0.04 0.00 -0.62 0.00 0.00 57.03 56.72 1ihb h ASP 84 Cb 0.45 0.57 -0.03 0.00 0.18 0.00 0.00 39.33 40.49 1ihb h ASP 84 CO -0.39 -0.34 0.25 0.74 -3.12 0.00 0.00 179.24 176.38 1ihb h THR 85 N -0.28 1.23 -0.45 0.35 2.02 -1.89 -1.77 112.91 112.11 1ihb h THR 85 Ca 0.16 -0.73 -0.02 0.00 0.77 0.00 0.00 66.41 66.59 1ihb h THR 85 Cb 0.56 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 1ihb h THR 85 CO -0.57 0.29 0.21 0.25 0.37 0.00 0.00 175.52 176.07 1ihb h LEU 86 N 0.95 0.60 -0.60 2.58 6.46 -1.00 -0.49 115.31 123.81 1ihb h LEU 86 Ca 0.22 -0.14 -0.01 0.00 -0.12 0.00 0.00 57.88 57.82 1ihb h LEU 86 Cb 0.19 -0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 39.94 1ihb h LEU 86 CO -0.02 0.58 0.32 1.56 -0.62 0.00 0.00 178.44 180.26 1ihb h GLN 87 N 0.59 0.84 -0.41 1.25 4.20 -0.64 -1.98 115.11 118.96 1ihb h GLN 87 Ca 0.15 -0.10 -0.11 0.00 0.06 0.00 0.00 58.65 58.65 1ihb h GLN 87 Cb 0.14 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 1ihb h GLN 87 CO -0.02 0.65 -0.20 0.00 -0.67 0.00 0.00 178.83 178.59 1ihb h THR 88 N 0.81 1.27 -0.48 -0.54 1.03 -1.06 -1.33 112.91 112.61 1ihb h THR 88 Ca 0.21 -1.31 0.05 0.00 -0.01 0.00 0.00 66.41 65.34 1ihb h THR 88 Cb 0.06 1.17 -0.04 0.00 -1.07 0.00 0.00 68.15 68.26 1ihb h THR 88 CO -0.03 0.44 0.23 -0.07 -0.01 0.00 0.00 175.52 176.08 1ihb h LEU 89 N 0.71 0.31 -1.15 0.00 4.07 -0.83 -2.19 115.31 116.22 1ihb h LEU 89 Ca 0.10 0.03 -0.07 0.00 0.08 0.00 0.00 57.88 58.03 1ihb h LEU 89 Cb 0.71 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 42.42 1ihb h LEU 89 CO 0.05 0.22 -0.15 -0.07 -1.08 0.00 0.00 178.44 177.41 1ihb h LEU 90 N 0.44 0.40 0.00 1.67 3.38 -0.87 -1.56 115.31 118.77 1ihb h LEU 90 Ca 0.21 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1ihb h LEU 90 Cb 0.15 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1ihb h LEU 90 CO -0.17 0.58 0.00 -0.62 0.09 0.00 0.00 178.44 178.32 1ihb n GLU 91 N -4.20 0.01 -1.26 1.13 1.02 -0.54 -2.41 120.64 114.38 1ihb n GLU 91 Ca 0.00 0.24 -0.11 0.00 -0.02 0.00 0.00 57.16 57.27 1ihb n GLU 91 Cb 0.32 -1.50 0.12 0.00 -0.02 0.00 0.00 31.44 30.37 1ihb n GLU 91 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1ihb n PHE 92 N -1.49 1.58 -0.95 -0.32 3.72 -0.64 -4.97 117.46 114.39 1ihb n PHE 92 Ca 0.04 -1.93 0.00 0.00 -0.05 0.00 0.00 57.45 55.51 1ihb n PHE 92 Cb 0.17 -0.44 0.00 0.00 -0.94 0.00 0.00 39.48 38.27 1ihb n PHE 92 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1ihb n GLN 93 N -0.95 -0.59 -1.62 -1.08 6.02 -1.01 -4.88 117.38 113.26 1ihb n GLN 93 Ca 0.36 0.15 -0.40 0.00 -0.01 0.00 0.00 57.00 57.09 1ihb n GLN 93 Cb 0.88 -3.66 0.02 0.00 1.02 0.00 0.00 30.24 28.51 1ihb n GLN 93 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ihb n ALA 94 N 1.00 0.33 -2.53 -1.58 0.00 -0.90 -4.89 120.51 111.95 1ihb n ALA 94 Ca 0.00 0.16 -0.43 0.00 0.00 0.00 0.00 53.44 53.17 1ihb n ALA 94 Cb 0.15 -2.11 -0.02 0.00 0.00 0.00 0.00 19.45 17.46 1ihb n ALA 94 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ihb s ASP 95 N -0.87 6.63 0.50 0.00 2.15 -1.26 -4.74 116.67 119.08 1ihb s ASP 95 Ca 0.67 0.75 0.29 0.00 0.43 0.00 0.00 52.55 54.68 1ihb s ASP 95 Cb -0.50 -2.55 1.24 0.00 -0.30 0.00 0.00 42.92 40.82 1ihb s ASP 95 CO 0.54 -1.21 1.95 -0.37 -0.17 0.00 0.00 175.17 175.92 1ihb h VAL 96 N 6.16 0.37 -0.74 1.11 -1.51 -1.94 -3.03 116.25 116.66 1ihb h VAL 96 Ca -0.24 -0.76 -0.22 0.00 -1.23 0.00 0.00 66.70 64.25 1ihb h VAL 96 Cb 1.07 1.56 -0.13 0.00 -2.13 0.00 0.00 31.29 31.66 1ihb h VAL 96 CO 1.09 0.12 0.28 0.59 -1.23 0.00 0.00 177.57 178.43 1ihb n ASN 97 N -3.34 4.78 -4.74 4.19 3.02 -1.26 -4.28 115.26 113.63 1ihb n ASN 97 Ca -0.00 -3.20 -0.41 0.00 -0.03 0.00 0.00 54.58 50.94 1ihb n ASN 97 Cb 0.33 -0.75 -0.03 0.00 -0.61 0.00 0.00 39.78 38.72 1ihb n ASN 97 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1ihb s ILE 98 N -2.93 3.52 -0.11 2.41 2.07 -1.15 -4.97 121.20 120.04 1ihb s ILE 98 Ca 0.54 1.26 -0.05 0.00 -1.41 0.00 0.00 60.65 60.99 1ihb s ILE 98 Cb 0.43 -3.81 -0.04 0.00 0.13 0.00 0.00 42.46 39.18 1ihb s ILE 98 CO 0.13 0.19 0.09 -1.61 -1.91 0.00 0.00 174.94 171.83 1ihb s GLU 99 N -0.13 3.29 0.20 3.50 2.02 -1.26 -4.29 118.70 122.03 1ihb s GLU 99 Ca 0.54 -0.24 -0.03 0.00 0.02 0.00 0.00 54.97 55.26 1ihb s GLU 99 Cb -0.33 -3.05 0.04 0.00 0.10 0.00 0.00 34.13 30.90 1ihb s GLU 99 CO 0.36 0.74 0.27 -0.40 0.02 0.00 0.00 175.26 176.25 1ihb n ASP 100 N 2.08 0.06 0.31 -0.19 5.68 -0.32 -4.87 116.55 119.30 1ihb n ASP 100 Ca -0.19 -1.12 0.20 0.00 -0.50 0.00 0.00 54.79 53.17 1ihb n ASP 100 Cb 0.54 -0.20 1.01 0.00 -1.14 0.00 0.00 41.12 41.33 1ihb n ASP 100 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 1ihb h ASN 101 N -0.34 0.00 -0.59 -1.12 2.35 -1.82 -1.61 115.58 112.46 1ihb h ASN 101 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1ihb h ASN 101 Cb 0.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.62 1ihb h ASN 101 CO 0.07 0.02 0.00 -0.62 -1.65 0.00 0.00 177.43 175.24 1ihb n GLU 102 N -3.21 2.64 -0.94 0.81 1.02 -1.26 -4.95 120.64 114.76 1ihb n GLU 102 Ca -0.02 -2.51 0.00 0.00 -0.02 0.00 0.00 57.16 54.61 1ihb n GLU 102 Cb 0.15 -1.55 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 1ihb n GLU 102 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ihb n GLY 103 N 1.59 0.51 3.78 0.62 0.00 -0.60 -1.03 105.19 110.05 1ihb n GLY 103 Ca 0.22 -0.21 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 1ihb n GLY 103 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ihb s ASN 104 N -2.19 7.34 0.49 1.61 0.01 -1.26 -4.09 114.94 116.85 1ihb s ASN 104 Ca 0.00 1.64 0.03 0.00 -0.71 0.00 0.00 52.86 53.83 1ihb s ASN 104 Cb 0.00 -2.50 0.02 0.00 0.41 0.00 0.00 41.25 39.18 1ihb s ASN 104 CO 0.00 0.14 0.69 -0.76 -1.51 0.00 0.00 177.10 175.66 1ihb s LEU 105 N -1.41 3.45 0.46 0.60 1.43 -1.26 -1.18 118.68 120.78 1ihb s LEU 105 Ca 0.39 -0.12 0.13 0.00 -1.03 0.00 0.00 54.13 53.50 1ihb s LEU 105 Cb -0.22 -2.82 1.08 0.00 0.03 0.00 0.00 46.19 44.26 1ihb s LEU 105 CO 0.25 -0.96 2.07 -0.65 0.23 0.00 0.00 176.35 177.30 1ihb h PRO 106 N 0.31 0.28 -0.78 1.29 0.11 -1.75 -0.72 132.00 130.74 1ihb h PRO 106 Ca -0.42 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.69 1ihb h PRO 106 Cb 1.29 -0.06 -0.04 0.00 0.11 0.00 0.00 31.00 32.29 1ihb h PRO 106 CO 0.50 0.18 0.51 1.25 -0.21 0.00 0.00 178.00 180.24 1ihb h LEU 107 N 0.28 0.87 -0.20 2.35 5.85 -1.93 -0.32 115.31 122.22 1ihb h LEU 107 Ca 0.13 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 1ihb h LEU 107 Cb 0.15 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1ihb h LEU 107 CO -0.03 0.62 0.10 0.45 -0.34 0.00 0.00 178.44 179.25 1ihb h HIS 108 N 1.03 0.27 -0.63 1.25 3.86 -1.48 -0.62 115.15 118.84 1ihb h HIS 108 Ca 0.29 -0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.47 1ihb h HIS 108 Cb -0.09 -0.09 -0.03 0.00 1.06 0.00 0.00 27.41 28.27 1ihb h HIS 108 CO -0.02 0.26 0.29 -0.07 0.86 0.00 0.00 177.93 179.25 1ihb h LEU 109 N 0.21 0.83 -0.55 2.43 3.38 -1.09 0.08 115.31 120.60 1ihb h LEU 109 Ca 0.07 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 1ihb h LEU 109 Cb 0.08 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1ihb h LEU 109 CO -0.01 0.74 -0.09 0.00 0.09 0.00 0.00 178.44 179.17 1ihb h ALA 110 N 1.13 0.76 -0.06 1.53 0.00 -0.98 -2.53 119.26 119.10 1ihb h ALA 110 Ca 0.21 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1ihb h ALA 110 Cb 0.14 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1ihb h ALA 110 CO -0.02 0.66 0.01 0.00 0.00 0.00 0.00 179.25 179.90 1ihb h ALA 111 N 0.94 0.08 -0.81 0.00 0.00 -0.78 -0.19 119.26 118.50 1ihb h ALA 111 Ca 0.15 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 54.99 1ihb h ALA 111 Cb 0.66 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.37 1ihb h ALA 111 CO 0.05 -0.29 0.53 -0.22 0.00 0.00 0.00 179.25 179.32 1ihb h LYS 112 N -0.12 0.87 -0.00 0.00 3.64 -1.00 -1.92 116.57 118.04 1ihb h LYS 112 Ca 0.02 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1ihb h LYS 112 Cb 0.25 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1ihb h LYS 112 CO 0.00 0.57 -0.16 0.39 -2.27 0.00 0.00 179.45 177.98 1ihb n GLU 113 N -4.48 0.63 -2.08 1.90 -0.58 -0.96 -4.89 120.64 110.19 1ihb n GLU 113 Ca 0.12 -0.26 -0.07 0.00 -0.42 0.00 0.00 57.16 56.53 1ihb n GLU 113 Cb 0.21 -1.49 -0.00 0.00 -0.57 0.00 0.00 31.44 29.58 1ihb n GLU 113 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ihb n GLY 114 N 1.32 0.13 3.43 0.62 0.00 -0.61 -4.93 105.19 105.14 1ihb n GLY 114 Ca 0.13 -0.60 -0.44 0.00 0.00 0.00 0.00 46.02 45.11 1ihb n GLY 114 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ihb n HIS 115 N -3.94 4.77 -0.22 1.61 8.25 -0.18 -4.87 115.22 120.65 1ihb n HIS 115 Ca -0.08 -3.24 -0.02 0.00 -0.26 0.00 0.00 57.72 54.12 1ihb n HIS 115 Cb 0.54 -2.24 0.05 0.00 1.12 0.00 0.00 29.99 29.46 1ihb n HIS 115 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1ihb h LEU 116 N 9.99 -0.83 -1.38 2.41 5.85 -1.92 -0.68 115.31 128.75 1ihb h LEU 116 Ca 0.35 0.21 -0.06 0.00 0.84 0.00 0.00 57.88 59.22 1ihb h LEU 116 Cb 0.85 0.48 -0.01 0.00 0.37 0.00 0.00 40.66 42.35 1ihb h LEU 116 CO 1.31 -0.26 -0.25 0.03 -0.34 0.00 0.00 178.44 178.93 1ihb h ARG 117 N -0.07 0.09 -0.07 1.25 3.08 -1.98 0.44 114.38 117.11 1ihb h ARG 117 Ca 0.29 -0.02 -0.12 0.00 0.07 0.00 0.00 59.98 60.19 1ihb h ARG 117 Cb 0.52 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.57 1ihb h ARG 117 CO -0.69 0.34 -0.44 0.28 -1.07 0.00 0.00 179.97 178.39 1ihb h VAL 118 N 0.08 1.40 -0.50 2.04 2.07 -1.71 -2.24 116.25 117.39 1ihb h VAL 118 Ca 0.01 -1.83 -0.04 0.00 0.82 0.00 0.00 66.70 65.66 1ihb h VAL 118 Cb 0.49 2.33 -0.02 0.00 -1.52 0.00 0.00 31.29 32.57 1ihb h VAL 118 CO 0.03 0.54 0.16 0.58 0.02 0.00 0.00 177.57 178.90 1ihb h VAL 119 N -0.04 1.23 -0.32 2.57 2.07 -0.83 -1.88 116.25 119.05 1ihb h VAL 119 Ca -0.04 -0.77 0.06 0.00 0.82 0.00 0.00 66.70 66.78 1ihb h VAL 119 Cb 1.10 0.78 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 1ihb h VAL 119 CO 0.09 0.28 -0.04 -0.08 0.02 0.00 0.00 177.57 177.84 1ihb h GLU 120 N 0.68 0.04 -0.57 1.57 4.81 -0.13 -1.23 114.58 119.74 1ihb h GLU 120 Ca 0.16 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.36 1ihb h GLU 120 Cb 0.27 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 1ihb h GLU 120 CO -0.00 0.03 0.23 0.35 -0.73 0.00 0.00 179.01 178.88 1ihb h PHE 121 N 0.04 0.87 -0.65 0.92 3.57 -1.15 -2.33 116.94 118.22 1ihb h PHE 121 Ca 0.16 -0.07 -0.05 0.00 3.53 0.00 0.00 57.97 61.54 1ihb h PHE 121 Cb 0.23 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 1ihb h PHE 121 CO -0.27 0.70 0.21 -0.07 -2.23 0.00 0.00 178.31 176.66 1ihb h LEU 122 N 0.79 0.93 -0.39 0.59 3.38 -0.96 -0.01 115.31 119.64 1ihb h LEU 122 Ca 0.19 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1ihb h LEU 122 Cb 0.20 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1ihb h LEU 122 CO -0.02 0.88 -0.27 -0.37 0.09 0.00 0.00 178.44 178.76 1ihb h VAL 123 N 0.93 0.51 0.04 1.22 -1.51 -1.17 -3.22 116.25 113.05 1ihb h VAL 123 Ca 0.21 -1.52 -0.37 0.00 -1.23 0.00 0.00 66.70 63.79 1ihb h VAL 123 Cb 0.28 2.09 -0.05 0.00 -2.13 0.00 0.00 31.29 31.47 1ihb h VAL 123 CO -0.01 0.27 -2.25 0.29 -1.23 0.00 0.00 177.57 174.64 1ihb n LYS 124 N -3.23 0.69 -0.39 5.19 5.02 -0.88 -4.76 118.16 119.80 1ihb n LYS 124 Ca 0.02 0.18 0.07 0.00 -2.02 0.00 0.00 58.31 56.56 1ihb n LYS 124 Cb 0.58 -1.60 0.13 0.00 -0.02 0.00 0.00 35.03 34.11 1ihb n LYS 124 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1ihb n HIS 125 N -3.26 0.00 -4.29 2.13 8.25 -0.02 -5.07 115.22 112.95 1ihb n HIS 125 Ca -0.38 -0.96 -0.19 0.00 -0.26 0.00 0.00 57.72 55.93 1ihb n HIS 125 Cb 1.03 -0.16 -0.08 0.00 1.12 0.00 0.00 29.99 31.90 1ihb n HIS 125 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1ihb s THR 126 N -2.35 0.04 -0.66 1.59 -1.32 -1.21 -4.97 115.64 106.75 1ihb s THR 126 Ca 0.29 -2.00 0.09 0.00 -1.21 0.00 0.00 61.69 58.86 1ihb s THR 126 Cb 0.27 -2.49 0.49 0.00 -1.51 0.00 0.00 72.50 69.27 1ihb s THR 126 CO -0.02 0.00 1.26 0.00 -2.21 0.00 0.00 174.62 173.65 1ihb n ALA 127 N -0.60 3.27 -1.70 11.08 0.00 -1.26 -4.91 120.51 126.39 1ihb n ALA 127 Ca 0.06 -1.13 -0.44 0.00 0.00 0.00 0.00 53.44 51.94 1ihb n ALA 127 Cb 0.63 -1.07 -0.02 0.00 0.00 0.00 0.00 19.45 18.99 1ihb n ALA 127 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1ihb n SER 128 N 0.41 3.08 -4.52 0.00 7.64 -1.26 -4.84 113.62 114.12 1ihb n SER 128 Ca 0.17 1.15 -0.42 0.00 1.01 0.00 0.00 58.87 60.78 1ihb n SER 128 Cb 0.79 -1.48 -0.03 0.00 -1.01 0.00 0.00 64.21 62.48 1ihb n SER 128 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1ihb s ASN 129 N 0.28 6.41 0.60 6.43 3.84 -1.26 -4.84 114.94 126.40 1ihb s ASN 129 Ca 0.65 -1.31 0.30 0.00 0.21 0.00 0.00 52.86 52.72 1ihb s ASN 129 Cb -0.60 -2.51 1.69 0.00 -0.55 0.00 0.00 41.25 39.28 1ihb s ASN 129 CO 0.51 -1.48 2.08 -0.37 -2.79 0.00 0.00 177.10 175.05 1ihb h VAL 130 N 6.33 0.39 -0.11 -5.21 -1.51 -1.95 -1.40 116.25 112.79 1ihb h VAL 130 Ca 0.03 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.50 1ihb h VAL 130 Cb 1.03 0.81 0.00 0.00 -2.13 0.00 0.00 31.29 31.00 1ihb h VAL 130 CO 1.30 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 178.25 1ihb n GLY 131 N -1.38 0.52 3.72 5.19 0.00 -1.26 -4.46 105.19 107.51 1ihb n GLY 131 Ca 0.02 -0.53 -0.43 0.00 0.00 0.00 0.00 46.02 45.08 1ihb n GLY 131 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1ihb n HIS 132 N 0.63 2.61 -4.22 1.61 -0.00 -0.53 -4.86 115.22 110.47 1ihb n HIS 132 Ca 0.17 0.27 -0.35 0.00 0.46 0.00 0.00 57.72 58.27 1ihb n HIS 132 Cb 0.43 -2.57 -0.08 0.00 -0.12 0.00 0.00 29.99 27.65 1ihb n HIS 132 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 1ihb s ARG 133 N -0.08 3.08 0.37 1.57 0.52 -1.26 -4.11 118.95 119.04 1ihb s ARG 133 Ca 0.68 -0.37 -0.04 0.00 -0.52 0.00 0.00 55.73 55.48 1ihb s ARG 133 Cb -0.55 -2.88 0.08 0.00 0.52 0.00 0.00 34.95 32.12 1ihb s ARG 133 CO 0.45 0.70 0.51 0.27 0.02 0.00 0.00 175.30 177.25 1ihb n ASN 134 N 1.89 0.27 0.20 0.23 0.23 -0.52 -4.84 115.26 112.73 1ihb n ASN 134 Ca -0.18 -1.33 0.13 0.00 -0.53 0.00 0.00 54.58 52.67 1ihb n ASN 134 Cb 0.54 -0.37 0.71 0.00 -2.08 0.00 0.00 39.78 38.58 1ihb n ASN 134 CO 0.00 0.00 0.00 0.45 -0.93 0.00 0.00 177.26 176.78 1ihb h HIS 135 N -0.96 0.00 -0.00 -2.53 3.86 -1.33 0.32 115.15 114.51 1ihb h HIS 135 Ca -0.17 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.04 1ihb h HIS 135 Cb 0.51 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.98 1ihb h HIS 135 CO 0.00 0.00 -0.07 1.63 0.86 0.00 0.00 177.93 180.35 1ihb n LYS 136 N -4.32 0.89 -0.50 2.45 5.02 -1.26 -4.91 118.16 115.53 1ihb n LYS 136 Ca 0.00 -0.28 0.00 0.00 -2.02 0.00 0.00 58.31 56.01 1ihb n LYS 136 Cb 0.24 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.75 1ihb n LYS 136 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ihb n GLY 137 N 1.21 0.72 3.83 0.72 0.00 0.10 -5.07 105.19 106.69 1ihb n GLY 137 Ca 0.17 -0.28 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 1ihb n GLY 137 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ihb s ASP 138 N -2.26 6.48 0.71 1.61 1.01 -1.26 -4.69 116.67 118.28 1ihb s ASP 138 Ca 0.00 0.57 -0.06 0.00 0.71 0.00 0.00 52.55 53.77 1ihb s ASP 138 Cb 0.00 -2.14 0.07 0.00 1.01 0.00 0.00 42.92 41.86 1ihb s ASP 138 CO 0.00 0.31 1.01 0.42 0.21 0.00 0.00 175.17 177.12 1ihb s THR 139 N -0.62 2.27 0.31 -1.27 -4.23 -1.26 -1.44 115.64 109.41 1ihb s THR 139 Ca 0.17 -0.30 -0.00 0.00 -1.18 0.00 0.00 61.69 60.38 1ihb s THR 139 Cb -0.13 -2.98 0.24 0.00 1.34 0.00 0.00 72.50 70.97 1ihb s THR 139 CO 0.06 0.00 1.95 0.00 -0.54 0.00 0.00 174.62 176.09 1ihb h ALA 140 N -0.61 1.42 -0.19 3.99 0.00 -1.78 -1.35 119.26 120.75 1ihb h ALA 140 Ca -0.44 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.27 1ihb h ALA 140 Cb 1.31 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1ihb h ALA 140 CO 0.58 0.50 -0.40 0.00 0.00 0.00 0.00 179.25 179.93 1ihb h ASP 142 N 0.35 0.34 -0.70 0.00 3.32 -1.67 -1.99 116.42 116.07 1ihb h ASP 142 Ca 0.03 -0.11 0.03 0.00 0.02 0.00 0.00 57.03 56.99 1ihb h ASP 142 Cb 0.86 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 40.28 1ihb h ASP 142 CO 0.07 0.36 0.44 -0.07 -1.72 0.00 0.00 179.24 178.32 1ihb h LEU 143 N 0.30 0.74 -0.51 1.55 3.38 -1.04 -0.28 115.31 119.44 1ihb h LEU 143 Ca 0.09 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.09 1ihb h LEU 143 Cb 0.10 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1ihb h LEU 143 CO -0.01 0.51 0.27 0.00 0.09 0.00 0.00 178.44 179.31 1ihb h ALA 144 N 1.29 0.65 -0.09 1.53 0.00 -0.96 -0.94 119.26 120.73 1ihb h ALA 144 Ca 0.28 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.06 1ihb h ALA 144 Cb -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1ihb h ALA 144 CO -0.10 -0.06 -0.53 -0.09 0.00 0.00 0.00 179.25 178.48 1ihb h ARG 145 N 0.54 0.26 -0.91 0.00 2.43 -1.00 0.40 114.38 116.10 1ihb h ARG 145 Ca 0.22 -0.16 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1ihb h ARG 145 Cb 0.09 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.61 1ihb h ARG 145 CO -0.13 0.72 0.51 1.25 -1.51 0.00 0.00 179.97 180.81 1ihb h LEU 146 N 0.20 1.12 -2.58 3.80 5.85 -0.61 -2.48 115.31 120.61 1ihb h LEU 146 Ca 0.00 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1ihb h LEU 146 Cb 1.00 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.74 1ihb h LEU 146 CO 0.08 0.89 0.00 -1.22 -0.34 0.00 0.00 178.44 177.85 1ihb n TYR 147 N -4.34 0.98 -3.29 1.25 4.02 -0.40 -4.96 117.16 110.43 1ihb n TYR 147 Ca 0.10 -0.47 -0.17 0.00 -0.01 0.00 0.00 57.90 57.34 1ihb n TYR 147 Cb 0.09 -0.03 0.06 0.00 -0.02 0.00 0.00 39.34 39.44 1ihb n TYR 147 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ihb n GLY 148 N 1.53 -0.20 3.05 2.72 0.00 -0.66 -4.95 105.19 106.69 1ihb n GLY 148 Ca 0.23 0.03 -0.43 0.00 0.00 0.00 0.00 46.02 45.85 1ihb n GLY 148 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ihb n ARG 149 N -3.85 4.16 -0.05 1.61 5.12 0.13 -4.89 116.66 118.89 1ihb n ARG 149 Ca -0.05 -4.54 0.02 0.00 -1.93 0.00 0.00 57.85 51.35 1ihb n ARG 149 Cb 0.57 -2.51 0.35 0.00 -1.16 0.00 0.00 32.46 29.72 1ihb n ARG 149 CO 0.00 0.00 0.00 -2.95 -1.93 0.00 0.00 177.63 172.75 1ihb h ASN 150 N 5.65 0.57 -0.67 0.55 -1.07 -1.93 -1.13 115.58 117.55 1ihb h ASN 150 Ca 0.19 -0.03 -0.08 0.00 0.07 0.00 0.00 56.30 56.45 1ihb h ASN 150 Cb 0.67 -0.14 -0.03 0.00 -2.07 0.00 0.00 38.32 36.75 1ihb h ASN 150 CO 1.24 0.46 0.12 -0.33 0.07 0.00 0.00 177.43 178.99 1ihb h GLU 151 N 0.65 1.11 -0.48 4.14 5.08 -1.97 0.11 114.58 123.22 1ihb h GLU 151 Ca 0.17 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 1ihb h GLU 151 Cb 0.01 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 1ihb h GLU 151 CO -0.03 1.01 0.17 0.28 -1.00 0.00 0.00 179.01 179.44 1ihb h VAL 152 N 1.04 1.22 -0.46 3.13 2.07 -1.81 0.43 116.25 121.86 1ihb h VAL 152 Ca 0.21 -0.71 -0.00 0.00 0.82 0.00 0.00 66.70 67.02 1ihb h VAL 152 Cb 0.42 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1ihb h VAL 152 CO 0.01 0.26 0.29 0.58 0.02 0.00 0.00 177.57 178.73 1ihb h VAL 153 N 0.64 1.14 -0.53 2.57 2.07 -0.66 -1.40 116.25 120.07 1ihb h VAL 153 Ca 0.16 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 1ihb h VAL 153 Cb 0.24 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 1ihb h VAL 153 CO -0.01 0.14 0.31 0.28 0.02 0.00 0.00 177.57 178.31 1ihb h SER 154 N 0.62 0.65 -0.30 0.57 0.02 -0.49 -1.44 113.55 113.19 1ihb h SER 154 Ca 0.17 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1ihb h SER 154 Cb -0.03 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 1ihb h SER 154 CO -0.03 0.54 0.17 0.25 -1.14 0.00 0.00 176.83 176.61 1ihb h LEU 155 N 0.71 0.37 -0.49 5.07 5.85 -0.64 -0.78 115.31 125.40 1ihb h LEU 155 Ca 0.19 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1ihb h LEU 155 Cb 0.02 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 1ihb h LEU 155 CO -0.03 0.33 0.26 0.24 -0.34 0.00 0.00 178.44 178.90 1ihb h MET 156 N 0.37 0.69 -0.01 1.25 2.86 -1.13 -2.27 114.93 116.71 1ihb h MET 156 Ca 0.11 -0.09 -0.08 0.00 -2.06 0.00 0.00 59.70 57.58 1ihb h MET 156 Cb 0.04 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.55 1ihb h MET 156 CO -0.02 0.55 -0.36 1.96 1.06 0.00 0.00 176.91 180.10 1ihb h GLN 157 N 0.65 0.02 0.00 1.72 4.20 -1.14 0.31 115.11 120.87 1ihb h GLN 157 Ca 0.17 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.88 1ihb h GLN 157 Cb 0.07 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.85 1ihb h GLN 157 CO -0.03 0.38 0.00 0.00 -0.67 0.00 0.00 178.83 178.51 1ihb n ALA 158 N -2.47 2.09 -0.69 3.87 0.00 -0.31 -3.41 120.51 119.59 1ihb n ALA 158 Ca -0.02 -0.05 0.07 0.00 0.00 0.00 0.00 53.44 53.44 1ihb n ALA 158 Cb 0.40 -1.41 0.14 0.00 0.00 0.00 0.00 19.45 18.58 1ihb n ALA 158 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ihb n ASN 159 N -1.78 2.75 -0.06 0.00 4.13 -0.63 -4.97 115.26 114.70 1ihb n ASN 159 Ca 0.05 -2.68 -0.01 0.00 1.68 0.00 0.00 54.58 53.63 1ihb n ASN 159 Cb 0.31 -0.34 -0.00 0.00 -1.54 0.00 0.00 39.78 38.21 1ihb n ASN 159 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ihb n GLY 160 N -0.71 0.43 1.54 7.41 0.00 -0.98 -4.91 105.19 107.96 1ihb n GLY 160 Ca 0.13 -0.12 0.09 0.00 0.00 0.00 0.00 46.02 46.12 1ihb n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ihb n ALA 161 N 1.02 3.12 1.56 4.61 0.00 1.00 -4.99 120.51 126.82 1ihb n ALA 161 Ca -0.01 -1.66 0.14 0.00 0.00 0.00 0.00 53.44 51.91 1ihb n ALA 161 Cb 0.14 -0.98 0.58 0.00 0.00 0.00 0.00 19.45 19.20 1ihb n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91