#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iwb s SER 3 N 0.00 0.02 0.53 3.14 1.04 -1.26 -5.03 113.70 112.14 3iwb s SER 3 Ca 0.00 -0.69 0.30 0.00 0.48 0.00 0.00 55.95 56.05 3iwb s SER 3 Cb 0.00 0.41 1.46 0.00 0.10 0.00 0.00 66.02 67.99 3iwb s SER 3 CO 0.00 -0.83 2.04 -0.07 0.98 0.00 0.00 173.24 175.36 3iwb h LEU 4 N 2.58 0.00 -7.68 2.42 3.38 -2.13 -3.45 115.31 110.42 3iwb h LEU 4 Ca -0.33 0.00 0.06 0.00 0.09 0.00 0.00 57.88 57.70 3iwb h LEU 4 Cb 1.22 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.90 3iwb h LEU 4 CO 0.51 0.10 0.26 -0.83 0.09 0.00 0.00 178.44 178.56 3iwb s GLY 5 N -4.20 -0.25 -0.06 0.83 0.00 -1.26 -5.15 107.32 97.22 3iwb s GLY 5 Ca -0.02 -0.02 0.03 0.00 0.00 0.00 0.00 44.72 44.72 3iwb s GLY 5 CO 0.56 -0.00 -0.16 0.50 0.00 0.00 0.00 173.10 174.00 3iwb s ARG 6 N -3.79 2.65 -0.14 2.90 0.52 -1.26 -5.12 118.95 114.70 3iwb s ARG 6 Ca 0.08 -0.73 -0.02 0.00 -0.52 0.00 0.00 55.73 54.55 3iwb s ARG 6 Cb -0.04 -2.38 0.04 0.00 0.52 0.00 0.00 34.95 33.09 3iwb s ARG 6 CO 0.01 0.52 0.00 -1.58 0.02 0.00 0.00 175.30 174.27 3iwb s HIS 7 N -0.47 1.06 -0.24 -0.53 5.65 -1.26 -5.11 115.29 114.39 3iwb s HIS 7 Ca 0.06 -0.67 -0.11 0.00 0.25 0.00 0.00 55.06 54.58 3iwb s HIS 7 Cb -0.12 -1.02 -0.05 0.00 -1.18 0.00 0.00 32.58 30.21 3iwb s HIS 7 CO 0.02 -0.51 0.21 -0.51 -0.65 0.00 0.00 174.74 173.29 3iwb s LEU 8 N 1.84 4.10 -0.36 8.88 1.43 -1.26 -5.04 118.68 128.27 3iwb s LEU 8 Ca 0.02 0.15 -0.07 0.00 -1.03 0.00 0.00 54.13 53.20 3iwb s LEU 8 Cb -0.15 -2.17 0.05 0.00 0.03 0.00 0.00 46.19 43.95 3iwb s LEU 8 CO -0.07 0.02 0.15 -0.69 0.23 0.00 0.00 176.35 175.99 3iwb s VAL 9 N 1.25 3.86 0.02 -1.59 1.01 -1.26 -5.09 120.40 118.60 3iwb s VAL 9 Ca 0.09 -1.26 0.08 0.00 0.00 0.00 0.00 61.98 60.90 3iwb s VAL 9 Cb -0.14 -3.26 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 3iwb s VAL 9 CO 0.06 -0.29 -0.25 0.00 0.00 0.00 0.00 175.10 174.62 3iwb s ALA 10 N 1.39 2.12 -0.20 5.51 0.00 -1.26 -5.11 121.76 124.21 3iwb s ALA 10 Ca 0.00 -1.17 -0.06 0.00 0.00 0.00 0.00 51.96 50.74 3iwb s ALA 10 Cb -0.21 -0.48 -0.03 0.00 0.00 0.00 0.00 23.12 22.41 3iwb s ALA 10 CO 0.02 0.51 0.02 -1.21 0.00 0.00 0.00 175.76 175.09 3iwb s GLU 11 N -0.99 3.67 -0.18 0.00 0.41 -1.26 -5.09 118.70 115.26 3iwb s GLU 11 Ca 0.10 -0.49 -0.03 0.00 -0.41 0.00 0.00 54.97 54.14 3iwb s GLU 11 Cb -0.10 -3.12 -0.01 0.00 -1.78 0.00 0.00 34.13 29.12 3iwb s GLU 11 CO 0.01 0.03 -0.07 -0.06 -0.49 0.00 0.00 175.26 174.68 3iwb s PHE 12 N 0.96 2.93 0.25 1.61 2.99 -1.26 -5.11 117.98 120.35 3iwb s PHE 12 Ca 0.02 -0.74 0.10 0.00 0.00 0.00 0.00 56.93 56.31 3iwb s PHE 12 Cb -0.14 -2.00 -0.05 0.00 0.00 0.00 0.00 43.02 40.83 3iwb s PHE 12 CO 0.02 -0.36 -0.10 0.71 -0.00 0.00 0.00 175.22 175.49 3iwb s TYR 13 N 0.95 2.51 -1.24 0.36 2.02 -1.26 -4.79 117.35 115.91 3iwb s TYR 13 Ca -0.01 -0.27 -0.13 0.00 -0.37 0.00 0.00 57.07 56.29 3iwb s TYR 13 Cb -0.15 -1.13 -0.00 0.00 -0.40 0.00 0.00 41.96 40.28 3iwb s TYR 13 CO 0.00 0.63 0.66 0.39 -1.57 0.00 0.00 175.55 175.66 3iwb n GLU 14 N -0.57 -2.13 -2.79 -0.62 1.02 -1.26 -4.99 120.64 109.29 3iwb n GLU 14 Ca -0.07 0.44 -0.21 0.00 -0.02 0.00 0.00 57.16 57.29 3iwb n GLU 14 Cb 0.59 -4.27 0.03 0.00 -0.02 0.00 0.00 31.44 27.76 3iwb n GLU 14 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3iwb s ASP 16 N -4.35 6.18 0.50 0.00 -1.08 -1.26 -4.86 116.67 111.80 3iwb s ASP 16 Ca 0.54 1.76 0.28 0.00 -0.52 0.00 0.00 52.55 54.60 3iwb s ASP 16 Cb -0.10 -2.53 1.27 0.00 -1.46 0.00 0.00 42.92 40.10 3iwb s ASP 16 CO 0.38 -1.40 1.97 0.03 0.52 0.00 0.00 175.17 176.67 3iwb h ARG 17 N 11.69 0.00 -0.01 4.34 3.08 -1.99 -0.50 114.38 131.00 3iwb h ARG 17 Ca -0.37 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.54 3iwb h ARG 17 Cb 1.18 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.21 3iwb h ARG 17 CO 0.99 0.15 -0.66 0.93 -1.07 0.00 0.00 179.97 180.31 3iwb h GLU 18 N 0.00 0.02 -0.05 0.04 3.07 -1.94 -2.46 114.58 113.26 3iwb h GLU 18 Ca -0.00 -0.02 -0.13 0.00 -0.50 0.00 0.00 59.36 58.71 3iwb h GLU 18 Cb 0.51 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.44 3iwb h GLU 18 CO 0.02 0.67 -0.46 0.28 -1.40 0.00 0.00 179.01 178.12 3iwb h VAL 19 N 0.02 1.41 -0.02 3.13 2.07 -1.69 -3.27 116.25 117.90 3iwb h VAL 19 Ca -0.01 -1.88 -0.01 0.00 0.82 0.00 0.00 66.70 65.62 3iwb h VAL 19 Cb 1.16 2.40 -0.00 0.00 -1.52 0.00 0.00 31.29 33.33 3iwb h VAL 19 CO 0.09 0.55 -0.05 -0.07 0.02 0.00 0.00 177.57 178.10 3iwb h LEU 20 N -0.07 0.02 -3.97 2.57 3.38 -1.06 -2.77 115.31 113.40 3iwb h LEU 20 Ca -0.04 -0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.27 3iwb h LEU 20 Cb 1.14 -0.01 -0.32 0.00 0.09 0.00 0.00 40.66 41.56 3iwb h LEU 20 CO 0.09 0.08 0.50 -0.67 0.09 0.00 0.00 178.44 178.53 3iwb n ASP 21 N -4.46 7.08 -3.71 -0.43 2.03 -0.93 -4.15 116.55 111.97 3iwb n ASP 21 Ca -0.03 -3.78 -0.30 0.00 0.52 0.00 0.00 54.79 51.21 3iwb n ASP 21 Cb 0.14 -0.84 -0.14 0.00 -0.72 0.00 0.00 41.12 39.57 3iwb n ASP 21 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 3iwb s ASN 22 N -2.22 3.74 0.22 1.67 3.84 -1.05 -4.95 114.94 116.20 3iwb s ASN 22 Ca 0.62 -2.33 -0.08 0.00 0.21 0.00 0.00 52.86 51.28 3iwb s ASN 22 Cb 0.49 -0.97 0.34 0.00 -0.55 0.00 0.00 41.25 40.56 3iwb s ASN 22 CO -0.01 -0.31 1.70 1.62 -2.79 0.00 0.00 177.10 177.31 3iwb h VAL 23 N 5.60 0.62 -0.28 -5.21 3.04 -1.87 -0.29 116.25 117.85 3iwb h VAL 23 Ca -0.04 -0.10 -0.06 0.00 -1.01 0.00 0.00 66.70 65.49 3iwb h VAL 23 Cb 0.96 0.31 -0.01 0.00 -2.01 0.00 0.00 31.29 30.54 3iwb h VAL 23 CO 0.47 0.05 -0.06 -0.61 -1.01 0.00 0.00 177.57 176.41 3iwb h GLN 24 N 0.28 0.53 0.11 4.17 5.75 -1.97 -2.49 115.11 121.50 3iwb h GLN 24 Ca 0.35 -0.20 -0.01 0.00 -0.15 0.00 0.00 58.65 58.64 3iwb h GLN 24 Cb 0.53 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.05 3iwb h GLN 24 CO -0.43 0.73 -0.05 1.25 -2.65 0.00 0.00 178.83 177.68 3iwb h LEU 25 N 0.29 -0.13 -0.74 -2.39 5.85 -1.82 -2.17 115.31 114.22 3iwb h LEU 25 Ca 0.07 -0.12 0.16 0.00 0.84 0.00 0.00 57.88 58.83 3iwb h LEU 25 Cb 0.52 0.03 -0.11 0.00 0.37 0.00 0.00 40.66 41.48 3iwb h LEU 25 CO 0.03 0.04 0.21 0.40 -0.34 0.00 0.00 178.44 178.78 3iwb h ILE 26 N -0.30 0.55 -0.84 4.05 1.08 -1.08 0.23 117.51 121.21 3iwb h ILE 26 Ca -0.02 -0.11 -0.01 0.00 -0.39 0.00 0.00 64.86 64.34 3iwb h ILE 26 Cb 0.24 0.21 -0.04 0.00 -3.07 0.00 0.00 36.82 34.16 3iwb h ILE 26 CO 0.03 0.06 0.50 -0.08 -0.69 0.00 0.00 178.15 177.96 3iwb h GLU 27 N 0.31 1.14 0.42 2.37 4.81 -1.23 0.48 114.58 122.88 3iwb h GLU 27 Ca 0.42 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.52 3iwb h GLU 27 Cb 0.69 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 3iwb h GLU 27 CO -0.48 0.81 -0.31 1.96 -0.73 0.00 0.00 179.01 180.26 3iwb h GLN 28 N 1.15 -0.70 -0.28 1.92 4.20 -0.09 0.30 115.11 121.61 3iwb h GLN 28 Ca 0.30 0.05 0.02 0.00 0.06 0.00 0.00 58.65 59.08 3iwb h GLN 28 Cb -0.03 0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.88 3iwb h GLN 28 CO -0.05 -0.47 0.13 0.93 -0.67 0.00 0.00 178.83 178.70 3iwb h GLU 29 N -0.73 0.27 -0.75 1.46 4.39 -0.38 -1.17 114.58 117.67 3iwb h GLU 29 Ca -0.04 -0.02 0.02 0.00 0.34 0.00 0.00 59.36 59.67 3iwb h GLU 29 Cb 0.62 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 29.17 3iwb h GLU 29 CO 0.01 0.18 0.48 0.52 -1.16 0.00 0.00 179.01 179.04 3iwb h MET 30 N 0.27 0.93 -0.46 2.33 2.86 0.24 0.14 114.93 121.25 3iwb h MET 30 Ca 0.12 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.69 3iwb h MET 30 Cb 0.05 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 31.48 3iwb h MET 30 CO -0.10 0.62 0.23 0.87 1.06 0.00 0.00 176.91 179.59 3iwb h LYS 31 N 0.96 0.66 -0.76 1.72 1.57 -0.03 -2.13 116.57 118.56 3iwb h LYS 31 Ca 0.29 -0.09 -0.04 0.00 -1.87 0.00 0.00 60.65 58.94 3iwb h LYS 31 Cb -0.03 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.13 3iwb h LYS 31 CO -0.10 0.55 0.32 0.37 -0.57 0.00 0.00 179.45 180.03 3iwb h GLN 32 N 0.60 1.12 -0.94 3.15 5.75 -0.53 -1.96 115.11 122.30 3iwb h GLN 32 Ca 0.16 -0.19 0.08 0.00 -0.15 0.00 0.00 58.65 58.54 3iwb h GLN 32 Cb 0.11 -0.19 -0.07 0.00 1.07 0.00 0.00 27.48 28.40 3iwb h GLN 32 CO -0.02 0.90 0.59 0.00 -2.65 0.00 0.00 178.83 177.65 3iwb h ALA 33 N 1.16 1.33 -0.60 3.38 0.00 -0.44 0.21 119.26 124.31 3iwb h ALA 33 Ca 0.25 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 3iwb h ALA 33 Cb 0.19 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3iwb h ALA 33 CO -0.02 0.32 0.36 0.00 0.00 0.00 0.00 179.25 179.91 3iwb h ALA 34 N 1.45 0.76 -0.59 0.00 0.00 -0.71 -2.37 119.26 117.80 3iwb h ALA 34 Ca 0.42 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.28 3iwb h ALA 34 Cb 0.24 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3iwb h ALA 34 CO -0.20 0.23 0.37 -0.92 0.00 0.00 0.00 179.25 178.74 3iwb h TYR 35 N 0.81 0.69 -0.94 0.00 3.20 -0.41 -2.72 116.97 117.60 3iwb h TYR 35 Ca 0.21 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.10 3iwb h TYR 35 Cb -0.03 -0.23 -0.05 0.00 1.54 0.00 0.00 36.73 37.97 3iwb h TYR 35 CO -0.02 0.41 0.57 0.93 -1.64 0.00 0.00 178.16 178.41 3iwb h GLU 36 N 0.74 1.28 0.00 1.82 4.39 -0.73 -0.84 114.58 121.24 3iwb h GLU 36 Ca 0.23 -0.12 0.00 0.00 0.34 0.00 0.00 59.36 59.81 3iwb h GLU 36 Cb -0.02 -0.27 0.00 0.00 -0.10 0.00 0.00 28.75 28.36 3iwb h GLU 36 CO -0.08 0.90 0.00 -1.13 -1.16 0.00 0.00 179.01 177.54 3iwb n SER 37 N -4.36 0.50 0.00 1.42 3.41 -0.93 -4.85 113.62 108.81 3iwb n SER 37 Ca 0.11 0.65 0.00 0.00 -0.26 0.00 0.00 58.87 59.36 3iwb n SER 37 Cb 0.06 -0.74 0.00 0.00 -0.26 0.00 0.00 64.21 63.27 3iwb n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3iwb n GLY 38 N -0.33 0.53 3.94 5.00 0.00 -0.32 -5.05 105.19 108.95 3iwb n GLY 38 Ca 0.02 -0.71 -0.24 0.00 0.00 0.00 0.00 46.02 45.08 3iwb n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iwb s ALA 39 N -2.00 3.67 -0.21 4.61 0.00 -1.10 -5.05 121.76 121.67 3iwb s ALA 39 Ca 0.00 -0.89 -0.09 0.00 0.00 0.00 0.00 51.96 50.98 3iwb s ALA 39 Cb 0.00 -2.18 -0.05 0.00 0.00 0.00 0.00 23.12 20.90 3iwb s ALA 39 CO 0.00 -0.14 0.12 0.99 0.00 0.00 0.00 175.76 176.72 3iwb s THR 40 N -2.42 5.09 -0.10 0.00 2.01 -1.26 -4.52 115.64 114.43 3iwb s THR 40 Ca 0.43 0.08 -0.29 0.00 0.31 0.00 0.00 61.69 62.22 3iwb s THR 40 Cb -0.10 -3.34 -0.01 0.00 0.01 0.00 0.00 72.50 69.06 3iwb s THR 40 CO 0.38 0.40 0.97 -0.63 -0.69 0.00 0.00 174.62 175.04 3iwb s ILE 41 N 0.76 4.81 -0.18 1.82 1.01 -1.26 -4.32 121.20 123.84 3iwb s ILE 41 Ca 0.06 1.97 -0.16 0.00 0.00 0.00 0.00 60.65 62.52 3iwb s ILE 41 Cb -0.13 -4.28 -0.22 0.00 0.01 0.00 0.00 42.46 37.84 3iwb s ILE 41 CO 0.02 0.03 0.26 0.52 0.00 0.00 0.00 174.94 175.77 3iwb n VAL 42 N 4.49 1.63 -3.59 2.92 0.31 0.75 -4.97 118.33 119.86 3iwb n VAL 42 Ca 0.08 -0.27 -0.08 0.00 -0.01 0.00 0.00 64.34 64.05 3iwb n VAL 42 Cb 0.49 -1.93 -0.02 0.00 -0.91 0.00 0.00 33.84 31.48 3iwb n VAL 42 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3iwb s THR 43 N -2.44 0.00 -0.13 2.52 -1.32 -1.13 -5.01 115.64 108.13 3iwb s THR 43 Ca -0.27 -0.32 -0.11 0.00 -1.21 0.00 0.00 61.69 59.79 3iwb s THR 43 Cb 0.06 -1.39 0.04 0.00 -1.51 0.00 0.00 72.50 69.70 3iwb s THR 43 CO 0.66 0.00 0.33 -0.94 -2.21 0.00 0.00 174.62 172.46 3iwb s SER 44 N -2.74 -0.36 -0.11 8.08 1.04 -1.26 -0.74 113.70 117.61 3iwb s SER 44 Ca 0.06 0.68 -0.04 0.00 0.48 0.00 0.00 55.95 57.14 3iwb s SER 44 Cb -0.02 0.67 0.06 0.00 0.10 0.00 0.00 66.02 66.82 3iwb s SER 44 CO -0.05 -0.13 0.15 0.28 0.98 0.00 0.00 173.24 174.47 3iwb s THR 45 N 0.40 -0.23 0.00 2.02 -1.32 -0.70 -5.01 115.64 110.81 3iwb s THR 45 Ca -0.02 0.20 0.06 0.00 -1.21 0.00 0.00 61.69 60.73 3iwb s THR 45 Cb -0.04 -0.39 -0.03 0.00 -1.51 0.00 0.00 72.50 70.54 3iwb s THR 45 CO -0.02 0.02 -0.19 -0.36 -2.21 0.00 0.00 174.62 171.86 3iwb s PHE 46 N 2.26 2.54 0.02 9.09 0.08 -1.26 -1.75 117.98 128.96 3iwb s PHE 46 Ca 0.04 -0.28 0.03 0.00 0.12 0.00 0.00 56.93 56.85 3iwb s PHE 46 Cb -0.13 -1.51 -0.02 0.00 -0.57 0.00 0.00 43.02 40.79 3iwb s PHE 46 CO -0.07 0.16 -0.10 -1.01 -0.10 0.00 0.00 175.22 174.10 3iwb s HIS 47 N -0.80 0.92 -0.51 0.36 3.76 0.30 -4.98 115.29 114.35 3iwb s HIS 47 Ca 0.13 -0.30 -0.14 0.00 -0.15 0.00 0.00 55.06 54.60 3iwb s HIS 47 Cb -0.10 -0.56 0.12 0.00 1.11 0.00 0.00 32.58 33.14 3iwb s HIS 47 CO 0.02 -0.01 0.44 0.50 -0.85 0.00 0.00 174.74 174.85 3iwb s ARG 48 N -0.85 2.86 0.90 1.40 3.52 -1.26 -0.60 118.95 124.92 3iwb s ARG 48 Ca -0.00 -1.67 -0.11 0.00 -0.13 0.00 0.00 55.73 53.82 3iwb s ARG 48 Cb -0.06 -4.18 0.13 0.00 -1.56 0.00 0.00 34.95 29.28 3iwb s ARG 48 CO 0.00 -1.25 1.10 -0.06 -0.81 0.00 0.00 175.30 174.29 3iwb s PHE 49 N 1.55 2.01 -0.06 5.12 0.08 -0.45 -4.98 117.98 121.25 3iwb s PHE 49 Ca 0.04 1.53 0.05 0.00 0.12 0.00 0.00 56.93 58.66 3iwb s PHE 49 Cb -0.28 -3.19 -0.00 0.00 -0.57 0.00 0.00 43.02 38.98 3iwb s PHE 49 CO 0.03 -2.56 -0.20 -0.48 -0.10 0.00 0.00 175.22 171.90 3iwb s LEU 50 N -6.40 1.96 0.00 -0.37 0.05 -1.26 -4.08 118.68 108.58 3iwb s LEU 50 Ca 0.65 -0.44 0.00 0.00 0.05 0.00 0.00 54.13 54.39 3iwb s LEU 50 Cb -0.20 -1.16 0.00 0.00 -2.05 0.00 0.00 46.19 42.77 3iwb s LEU 50 CO 0.58 0.17 0.00 -0.81 -0.55 0.00 0.00 176.35 175.74 3iwb n PRO 51 N 3.25 0.00 -2.55 1.48 -0.04 -1.26 -5.01 135.00 130.86 3iwb n PRO 51 Ca -0.19 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 62.87 3iwb n PRO 51 Cb 0.52 -0.16 -0.05 0.00 -0.04 0.00 0.00 33.50 33.77 3iwb n PRO 51 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3iwb s TYR 52 N 0.00 3.69 0.00 0.54 2.02 -1.26 -4.98 117.35 117.36 3iwb s TYR 52 Ca 0.00 1.75 0.00 0.00 -0.37 0.00 0.00 57.07 58.45 3iwb s TYR 52 Cb 0.00 -3.20 0.00 0.00 -0.40 0.00 0.00 41.96 38.36 3iwb s TYR 52 CO 0.00 -0.28 0.00 0.41 -1.57 0.00 0.00 175.55 174.11 3iwb n GLY 53 N 1.35 4.70 2.94 0.71 0.00 -1.26 -4.88 105.19 108.76 3iwb n GLY 53 Ca -0.01 -1.00 -0.15 0.00 0.00 0.00 0.00 46.02 44.86 3iwb n GLY 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iwb s VAL 54 N -1.54 0.34 -0.02 1.61 1.01 -1.26 -1.34 120.40 119.20 3iwb s VAL 54 Ca 0.00 -0.18 0.01 0.00 0.00 0.00 0.00 61.98 61.81 3iwb s VAL 54 Cb 0.00 -0.29 0.01 0.00 0.00 0.00 0.00 36.38 36.11 3iwb s VAL 54 CO 0.00 0.10 -0.01 -0.44 0.00 0.00 0.00 175.10 174.74 3iwb s SER 55 N -0.09 0.41 0.01 3.32 0.01 0.23 -4.91 113.70 112.68 3iwb s SER 55 Ca 0.02 -0.04 -0.28 0.00 1.31 0.00 0.00 55.95 56.95 3iwb s SER 55 Cb -0.02 -0.15 0.08 0.00 0.21 0.00 0.00 66.02 66.14 3iwb s SER 55 CO -0.00 -0.04 0.70 -0.83 0.41 0.00 0.00 173.24 173.48 3iwb s GLY 56 N 0.55 -0.55 0.02 3.44 0.00 -1.26 0.11 107.32 109.62 3iwb s GLY 56 Ca -0.05 1.12 0.02 0.00 0.00 0.00 0.00 44.72 45.80 3iwb s GLY 56 CO -0.01 0.68 -0.06 0.54 0.00 0.00 0.00 173.10 174.25 3iwb s VAL 57 N -2.09 0.48 -0.24 1.40 0.11 -0.72 -4.99 120.40 114.36 3iwb s VAL 57 Ca -0.05 -0.62 0.01 0.00 -2.93 0.00 0.00 61.98 58.39 3iwb s VAL 57 Cb -0.00 -0.47 0.06 0.00 -1.53 0.00 0.00 36.38 34.44 3iwb s VAL 57 CO 0.01 -0.11 -0.04 -0.69 -3.33 0.00 0.00 175.10 170.94 3iwb s VAL 58 N -0.69 1.51 0.07 2.04 1.01 -1.26 -1.71 120.40 121.36 3iwb s VAL 58 Ca -0.03 -1.25 -0.29 0.00 0.00 0.00 0.00 61.98 60.41 3iwb s VAL 58 Cb -0.06 -1.80 -0.05 0.00 0.00 0.00 0.00 36.38 34.47 3iwb s VAL 58 CO 0.00 -0.14 0.94 -0.69 0.00 0.00 0.00 175.10 175.21 3iwb s VAL 59 N 1.40 4.62 0.00 2.92 1.01 0.08 -4.97 120.40 125.46 3iwb s VAL 59 Ca -0.05 2.00 0.00 0.00 0.00 0.00 0.00 61.98 63.93 3iwb s VAL 59 Cb -0.19 -4.29 0.00 0.00 0.00 0.00 0.00 36.38 31.90 3iwb s VAL 59 CO -0.07 0.29 0.34 2.30 0.00 0.00 0.00 175.10 177.96