#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iwb s LEU 65 N 0.00 1.53 0.20 2.39 1.43 -1.26 -1.18 118.68 121.80 3iwb s LEU 65 Ca 0.00 -0.32 0.05 0.00 -1.03 0.00 0.00 54.13 52.83 3iwb s LEU 65 Cb 0.00 -0.87 -0.05 0.00 0.03 0.00 0.00 46.19 45.31 3iwb s LEU 65 CO 0.00 -0.01 -0.08 0.42 0.23 0.00 0.00 176.35 176.91 3iwb s THR 66 N 0.99 1.32 -0.25 5.49 -4.23 -0.04 -4.98 115.64 113.94 3iwb s THR 66 Ca -0.08 -2.10 -0.21 0.00 -1.18 0.00 0.00 61.69 58.13 3iwb s THR 66 Cb -0.15 -2.12 0.07 0.00 1.34 0.00 0.00 72.50 71.64 3iwb s THR 66 CO -0.00 -0.53 0.65 -0.51 -0.54 0.00 0.00 174.62 173.69 3iwb s ILE 67 N -3.23 -0.00 -0.06 2.99 2.07 -1.26 -1.78 121.20 119.93 3iwb s ILE 67 Ca 0.23 0.01 -0.02 0.00 -1.41 0.00 0.00 60.65 59.46 3iwb s ILE 67 Cb 0.03 -0.92 0.03 0.00 0.13 0.00 0.00 42.46 41.73 3iwb s ILE 67 CO 0.06 0.00 0.03 -1.00 -1.91 0.00 0.00 174.94 172.12 3iwb s HIS 68 N 0.71 0.39 -0.04 3.50 3.76 -0.41 -4.99 115.29 118.21 3iwb s HIS 68 Ca -0.03 0.03 0.04 0.00 -0.15 0.00 0.00 55.06 54.95 3iwb s HIS 68 Cb -0.05 -0.64 -0.03 0.00 1.11 0.00 0.00 32.58 32.97 3iwb s HIS 68 CO -0.05 -0.26 -0.14 0.95 -0.85 0.00 0.00 174.74 174.39 3iwb s THR 69 N 2.01 3.08 -0.77 1.30 -4.23 -1.26 -0.55 115.64 115.23 3iwb s THR 69 Ca 0.04 -0.78 -0.03 0.00 -1.18 0.00 0.00 61.69 59.75 3iwb s THR 69 Cb -0.12 -2.23 0.19 0.00 1.34 0.00 0.00 72.50 71.68 3iwb s THR 69 CO -0.04 0.55 0.62 0.26 -0.54 0.00 0.00 174.62 175.47 3iwb s TRP 70 N -0.77 3.65 0.27 3.99 0.51 0.78 -4.99 118.94 122.38 3iwb s TRP 70 Ca 0.12 -2.83 0.00 0.00 -2.12 0.00 0.00 56.10 51.27 3iwb s TRP 70 Cb -0.11 -3.25 0.60 0.00 -0.81 0.00 0.00 33.47 29.91 3iwb s TRP 70 CO 0.02 -0.80 1.72 -1.35 -0.51 0.00 0.00 176.95 176.03 3iwb h PRO 71 N 6.57 0.44 -0.09 4.98 0.11 -1.96 0.95 132.00 142.99 3iwb h PRO 71 Ca 0.08 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 66.19 3iwb h PRO 71 Cb 0.89 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.90 3iwb h PRO 71 CO 0.78 0.29 0.11 1.05 -0.21 0.00 0.00 178.00 180.02 3iwb h GLU 72 N 0.45 0.00 -0.01 1.05 9.09 -1.95 -2.20 114.58 121.02 3iwb h GLU 72 Ca 0.49 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.90 3iwb h GLU 72 Cb 0.84 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.94 3iwb h GLU 72 CO -0.46 0.00 -0.04 0.66 0.05 0.00 0.00 179.01 179.21 3iwb n TYR 73 N -3.74 0.00 -2.80 2.06 4.01 0.28 -4.98 117.16 111.99 3iwb n TYR 73 Ca -0.01 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.53 3iwb n TYR 73 Cb 0.21 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.27 3iwb n TYR 73 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3iwb n GLY 74 N 0.53 -0.45 3.35 2.72 0.00 -0.83 -4.98 105.19 105.54 3iwb n GLY 74 Ca 0.04 0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 3iwb n GLY 74 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3iwb s TYR 75 N -3.10 2.38 -0.03 1.61 5.04 -1.19 -5.03 117.35 117.04 3iwb s TYR 75 Ca 0.20 -0.39 -0.00 0.00 -2.44 0.00 0.00 57.07 54.45 3iwb s TYR 75 Cb -0.09 -1.46 0.03 0.00 0.35 0.00 0.00 41.96 40.79 3iwb s TYR 75 CO 0.25 0.08 0.02 0.00 -1.34 0.00 0.00 175.55 174.56 3iwb s ALA 76 N -0.73 0.18 -0.27 3.97 0.00 -1.26 -0.15 121.76 123.49 3iwb s ALA 76 Ca 0.11 0.25 -0.13 0.00 0.00 0.00 0.00 51.96 52.18 3iwb s ALA 76 Cb -0.10 -0.31 -0.04 0.00 0.00 0.00 0.00 23.12 22.66 3iwb s ALA 76 CO 0.01 -0.14 0.31 0.00 0.00 0.00 0.00 175.76 175.94 3iwb s ALA 77 N 1.17 3.55 -0.01 0.00 0.00 0.29 -4.94 121.76 121.82 3iwb s ALA 77 Ca -0.08 -0.91 0.07 0.00 0.00 0.00 0.00 51.96 51.04 3iwb s ALA 77 Cb -0.13 -2.62 -0.02 0.00 0.00 0.00 0.00 23.12 20.35 3iwb s ALA 77 CO -0.03 -0.61 -0.21 0.42 0.00 0.00 0.00 175.76 175.33 3iwb s ILE 78 N 1.94 1.69 -0.08 0.00 1.01 -1.26 -1.29 121.20 123.21 3iwb s ILE 78 Ca 0.12 -0.95 0.02 0.00 0.00 0.00 0.00 60.65 59.84 3iwb s ILE 78 Cb -0.16 -1.41 0.02 0.00 0.01 0.00 0.00 42.46 40.92 3iwb s ILE 78 CO 0.10 0.45 -0.11 -1.81 0.00 0.00 0.00 174.94 173.56 3iwb s ASP 79 N -0.58 1.96 -0.44 3.58 1.01 -0.73 -4.98 116.67 116.48 3iwb s ASP 79 Ca 0.08 -0.32 0.03 0.00 0.71 0.00 0.00 52.55 53.05 3iwb s ASP 79 Cb -0.08 -0.86 0.12 0.00 1.01 0.00 0.00 42.92 43.11 3iwb s ASP 79 CO -0.00 -0.01 0.20 -0.76 0.21 0.00 0.00 175.17 174.81 3iwb s LEU 80 N 0.96 3.56 -0.31 1.23 1.43 -1.26 -0.86 118.68 123.43 3iwb s LEU 80 Ca -0.09 -2.57 -0.04 0.00 -1.03 0.00 0.00 54.13 50.40 3iwb s LEU 80 Cb -0.15 -1.33 0.03 0.00 0.03 0.00 0.00 46.19 44.78 3iwb s LEU 80 CO 0.00 -0.29 0.05 0.12 0.23 0.00 0.00 176.35 176.46 3iwb s PHE 81 N 0.36 3.21 0.35 0.29 5.36 -0.32 -4.91 117.98 122.32 3iwb s PHE 81 Ca 0.15 -1.49 0.06 0.00 -0.96 0.00 0.00 56.93 54.69 3iwb s PHE 81 Cb -0.23 -2.19 -0.07 0.00 -0.34 0.00 0.00 43.02 40.19 3iwb s PHE 81 CO -0.04 -0.72 0.00 0.95 -1.46 0.00 0.00 175.22 173.95 3iwb s THR 82 N 1.37 1.68 0.14 0.12 -4.23 -1.26 -0.73 115.64 112.73 3iwb s THR 82 Ca -0.02 -2.04 0.02 0.00 -1.18 0.00 0.00 61.69 58.47 3iwb s THR 82 Cb -0.19 -2.79 -0.04 0.00 1.34 0.00 0.00 72.50 70.82 3iwb s THR 82 CO 0.01 -0.08 -0.04 0.00 -0.54 0.00 0.00 174.62 173.97 3iwb n GLY 84 N -0.17 -2.08 0.26 0.00 0.00 -1.26 -4.33 105.19 97.61 3iwb n GLY 84 Ca -0.09 -1.25 0.14 0.00 0.00 0.00 0.00 46.02 44.82 3iwb n GLY 84 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3iwb h GLU 85 N 0.00 0.00 -0.10 1.61 9.09 -2.06 -2.47 114.58 120.65 3iwb h GLU 85 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3iwb h GLU 85 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 3iwb h GLU 85 CO 0.00 0.11 0.00 -0.40 0.05 0.00 0.00 179.01 178.77 3iwb n ASP 86 N -3.35 0.77 -4.03 3.06 5.75 -1.26 -4.67 116.55 112.81 3iwb n ASP 86 Ca -0.01 -1.69 -0.31 0.00 -0.01 0.00 0.00 54.79 52.77 3iwb n ASP 86 Cb 0.31 -0.06 -0.15 0.00 -1.03 0.00 0.00 41.12 40.18 3iwb n ASP 86 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3iwb s VAL 87 N -1.87 2.01 -0.35 2.12 1.01 -0.93 -5.09 120.40 117.30 3iwb s VAL 87 Ca 0.24 -1.62 -0.13 0.00 0.00 0.00 0.00 61.98 60.47 3iwb s VAL 87 Cb 0.12 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.29 3iwb s VAL 87 CO 0.18 -0.12 0.24 -0.62 0.00 0.00 0.00 175.10 174.78 3iwb s ASP 88 N 1.15 5.99 0.50 3.32 2.15 -1.26 -4.76 116.67 123.76 3iwb s ASP 88 Ca -0.06 -0.57 0.25 0.00 0.43 0.00 0.00 52.55 52.60 3iwb s ASP 88 Cb -0.20 -2.12 1.30 0.00 -0.30 0.00 0.00 42.92 41.60 3iwb s ASP 88 CO -0.06 -0.29 2.02 1.55 -0.17 0.00 0.00 175.17 178.22 3iwb h PRO 89 N 8.50 0.00 0.00 4.34 0.13 -1.97 -2.64 132.00 140.37 3iwb h PRO 89 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 3iwb h PRO 89 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3iwb h PRO 89 CO 0.65 0.16 0.00 -1.49 -0.23 0.00 0.00 178.00 177.09 3iwb h TRP 90 N 0.00 0.00 0.00 1.56 4.06 -1.95 -1.99 115.95 117.64 3iwb h TRP 90 Ca -0.00 0.00 -0.16 0.00 2.06 0.00 0.00 58.89 60.79 3iwb h TRP 90 Cb 0.41 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.55 3iwb h TRP 90 CO 0.00 0.00 -0.76 0.87 -3.56 0.00 0.00 178.44 174.99 3iwb h LYS 91 N 0.00 0.00 -0.02 0.49 1.79 -1.90 -2.16 116.57 114.76 3iwb h LYS 91 Ca 0.00 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.33 3iwb h LYS 91 Cb 0.44 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.10 3iwb h LYS 91 CO 0.00 0.76 -0.52 0.00 -1.08 0.00 0.00 179.45 178.61 3iwb h ALA 92 N 1.24 0.09 -0.06 3.86 0.00 -1.49 -3.14 119.26 119.77 3iwb h ALA 92 Ca -0.01 -0.54 0.03 0.00 0.00 0.00 0.00 54.91 54.40 3iwb h ALA 92 Cb 1.48 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.26 3iwb h ALA 92 CO 0.10 0.31 -0.12 0.35 0.00 0.00 0.00 179.25 179.88 3iwb h PHE 93 N -0.12 -0.31 -0.72 0.00 3.57 -1.40 -1.83 116.94 116.13 3iwb h PHE 93 Ca -0.06 0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.54 3iwb h PHE 93 Cb 1.22 0.15 -0.07 0.00 2.79 0.00 0.00 35.95 40.04 3iwb h PHE 93 CO 0.14 -0.19 0.38 1.49 -2.23 0.00 0.00 178.31 177.91 3iwb h GLU 94 N -0.18 0.64 0.02 1.11 4.57 -1.49 0.24 114.58 119.49 3iwb h GLU 94 Ca 0.07 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.21 3iwb h GLU 94 Cb 0.27 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 3iwb h GLU 94 CO -0.17 0.42 -0.01 1.25 -1.18 0.00 0.00 179.01 179.32 3iwb h HIS 95 N 0.66 -0.03 -0.76 0.92 2.76 -1.44 -2.43 115.15 114.83 3iwb h HIS 95 Ca 0.34 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.50 3iwb h HIS 95 Cb 0.31 0.01 -0.04 0.00 1.55 0.00 0.00 27.41 29.24 3iwb h HIS 95 CO -0.09 0.07 0.44 -0.07 -1.30 0.00 0.00 177.93 176.98 3iwb h LEU 96 N -0.11 0.92 -0.43 0.26 3.38 -0.73 0.83 115.31 119.43 3iwb h LEU 96 Ca -0.00 -0.08 0.05 0.00 0.09 0.00 0.00 57.88 57.95 3iwb h LEU 96 Cb 0.10 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 3iwb h LEU 96 CO 0.00 0.73 0.15 0.50 0.09 0.00 0.00 178.44 179.91 3iwb h LYS 97 N 1.04 0.30 0.11 1.13 3.11 -0.39 -0.60 116.57 121.27 3iwb h LYS 97 Ca 0.27 -0.02 -0.01 0.00 -2.81 0.00 0.00 60.65 58.09 3iwb h LYS 97 Cb -0.01 -0.07 0.00 0.00 -1.00 0.00 0.00 32.23 31.15 3iwb h LYS 97 CO -0.05 0.20 -0.05 -0.22 -2.81 0.00 0.00 179.45 176.52 3iwb h LYS 98 N 0.31 -0.15 -0.97 1.90 1.63 -0.94 -1.92 116.57 116.44 3iwb h LYS 98 Ca 0.20 0.01 0.11 0.00 -0.85 0.00 0.00 60.65 60.12 3iwb h LYS 98 Cb 0.20 0.03 -0.08 0.00 -0.60 0.00 0.00 32.23 31.78 3iwb h LYS 98 CO -0.21 -0.03 0.60 0.00 -3.45 0.00 0.00 179.45 176.37 3iwb h ALA 99 N 0.64 1.43 0.00 5.00 0.00 -0.30 -2.64 119.26 123.39 3iwb h ALA 99 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3iwb h ALA 99 Cb 0.19 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3iwb h ALA 99 CO 0.03 0.23 -0.66 -0.07 0.00 0.00 0.00 179.25 178.77 3iwb h LEU 100 N 0.98 0.00 0.71 0.00 4.07 -1.13 -3.48 115.31 116.46 3iwb h LEU 100 Ca 0.47 -0.03 -0.28 0.00 0.08 0.00 0.00 57.88 58.12 3iwb h LEU 100 Cb 0.43 0.00 -0.11 0.00 1.08 0.00 0.00 40.66 42.06 3iwb h LEU 100 CO -0.25 0.01 -0.26 0.29 -1.08 0.00 0.00 178.44 177.15 3iwb n LYS 101 N -2.71 -0.96 -1.60 1.13 5.02 -0.73 -4.93 118.16 113.38 3iwb n LYS 101 Ca 0.02 0.97 -0.50 0.00 -2.02 0.00 0.00 58.31 56.78 3iwb n LYS 101 Cb 0.53 -5.06 -0.05 0.00 -0.02 0.00 0.00 35.03 30.43 3iwb n LYS 101 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3iwb n ALA 102 N 1.14 -0.49 0.82 7.82 0.00 -1.16 -4.90 120.51 123.73 3iwb n ALA 102 Ca -0.14 0.48 0.09 0.00 0.00 0.00 0.00 53.44 53.87 3iwb n ALA 102 Cb 0.46 -2.10 -0.04 0.00 0.00 0.00 0.00 19.45 17.77 3iwb n ALA 102 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3iwb n LYS 103 N 2.27 1.42 -3.64 0.00 4.76 -1.26 -4.92 118.16 116.77 3iwb n LYS 103 Ca 0.16 -0.54 -0.04 0.00 -2.87 0.00 0.00 58.31 55.03 3iwb n LYS 103 Cb 0.23 -1.34 -0.05 0.00 -1.84 0.00 0.00 35.03 32.03 3iwb n LYS 103 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 3iwb s ARG 104 N -2.32 0.63 0.15 1.97 3.52 -1.26 -5.17 118.95 116.47 3iwb s ARG 104 Ca 0.12 1.36 0.05 0.00 -0.13 0.00 0.00 55.73 57.12 3iwb s ARG 104 Cb 0.14 0.57 -0.04 0.00 -1.56 0.00 0.00 34.95 34.05 3iwb s ARG 104 CO 0.56 -0.18 -0.11 0.14 -0.81 0.00 0.00 175.30 174.91 3iwb s VAL 105 N 2.37 1.20 -0.07 7.11 -7.23 -1.26 -5.13 120.40 117.38 3iwb s VAL 105 Ca -0.08 -2.04 -0.03 0.00 -1.81 0.00 0.00 61.98 58.02 3iwb s VAL 105 Cb -0.09 -1.83 0.04 0.00 0.56 0.00 0.00 36.38 35.06 3iwb s VAL 105 CO -0.19 -0.72 0.14 -2.28 -0.31 0.00 0.00 175.10 171.74 3iwb s HIS 106 N -3.23 -0.14 -0.04 2.82 5.04 -1.26 -5.15 115.29 113.33 3iwb s HIS 106 Ca 0.16 0.53 0.03 0.00 -1.54 0.00 0.00 55.06 54.24 3iwb s HIS 106 Cb 0.02 -0.25 0.01 0.00 0.04 0.00 0.00 32.58 32.40 3iwb s HIS 106 CO 0.01 -0.23 -0.11 0.08 -2.34 0.00 0.00 174.74 172.15 3iwb s VAL 107 N 2.00 0.98 -0.16 0.89 1.01 -1.26 -5.10 120.40 118.76 3iwb s VAL 107 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.55 3iwb s VAL 107 Cb -0.12 -0.88 0.00 0.00 0.00 0.00 0.00 36.38 35.38 3iwb s VAL 107 CO -0.05 0.31 -0.16 0.54 0.00 0.00 0.00 175.10 175.73 3iwb s VAL 108 N 0.35 2.57 -0.22 2.92 0.11 -1.26 -5.10 120.40 119.77 3iwb s VAL 108 Ca -0.07 -0.79 -0.16 0.00 -2.93 0.00 0.00 61.98 58.03 3iwb s VAL 108 Cb -0.12 -2.09 -0.04 0.00 -1.53 0.00 0.00 36.38 32.61 3iwb s VAL 108 CO 0.02 0.51 0.40 -0.70 -3.33 0.00 0.00 175.10 172.00 3iwb s GLU 109 N 0.95 4.14 -0.04 1.54 2.12 -1.26 -5.07 118.70 121.08 3iwb s GLU 109 Ca -0.03 0.18 0.00 0.00 0.36 0.00 0.00 54.97 55.48 3iwb s GLU 109 Cb -0.15 -3.57 -0.03 0.00 0.26 0.00 0.00 34.13 30.64 3iwb s GLU 109 CO -0.03 -0.11 0.00 -1.01 -0.54 0.00 0.00 175.26 173.58 3iwb s HIS 110 N 1.53 3.11 -0.29 5.30 3.76 -1.26 -5.09 115.29 122.35 3iwb s HIS 110 Ca 0.18 0.13 -0.13 0.00 -0.15 0.00 0.00 55.06 55.09 3iwb s HIS 110 Cb -0.15 -1.72 -0.04 0.00 1.11 0.00 0.00 32.58 31.78 3iwb s HIS 110 CO 0.08 0.46 0.29 -1.21 -0.85 0.00 0.00 174.74 173.51 3iwb s GLU 111 N -1.25 3.87 -0.24 1.40 2.02 -1.26 -5.05 118.70 118.19 3iwb s GLU 111 Ca 0.17 -0.23 -0.12 0.00 0.02 0.00 0.00 54.97 54.81 3iwb s GLU 111 Cb -0.11 -3.70 -0.05 0.00 0.10 0.00 0.00 34.13 30.37 3iwb s GLU 111 CO 0.07 -0.30 0.21 1.03 0.02 0.00 0.00 175.26 176.29 3iwb s ARG 112 N 1.91 4.06 -0.65 1.61 1.81 -1.26 -4.56 118.95 121.87 3iwb s ARG 112 Ca 0.11 -0.20 -0.02 0.00 -1.72 0.00 0.00 55.73 53.90 3iwb s ARG 112 Cb -0.16 -3.56 -0.03 0.00 -0.45 0.00 0.00 34.95 30.75 3iwb s ARG 112 CO 0.11 -0.00 0.59 0.41 -0.68 0.00 0.00 175.30 175.73 3iwb n GLY 113 N 4.37 -0.80 3.75 -3.53 0.00 -1.26 -4.97 105.19 102.75 3iwb n GLY 113 Ca -0.14 0.32 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 3iwb n GLY 113 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3iwb s ARG 114 N -3.50 3.16 0.20 1.61 0.52 -1.26 -4.89 118.95 114.78 3iwb s ARG 114 Ca 0.17 2.25 -0.08 0.00 -0.52 0.00 0.00 55.73 57.55 3iwb s ARG 114 Cb -0.02 -2.27 0.12 0.00 0.52 0.00 0.00 34.95 33.29 3iwb s ARG 114 CO 0.55 -1.18 1.67 1.88 0.02 0.00 0.00 175.30 178.24 3iwb h TYR 115 N 1.49 1.14 0.00 -0.53 0.05 -2.00 -2.11 116.97 115.01 3iwb h TYR 115 Ca -0.51 -0.18 0.00 0.00 0.05 0.00 0.00 58.73 58.09 3iwb h TYR 115 Cb 1.30 -0.30 0.00 0.00 1.01 0.00 0.00 36.73 38.73 3iwb h TYR 115 CO 0.46 0.99 0.00 -0.40 -1.05 0.00 0.00 178.16 178.16 3iwb n ASP 116 N -4.19 0.19 -0.00 3.88 3.85 -1.26 -2.85 116.55 116.17 3iwb n ASP 116 Ca 0.03 -1.49 -0.00 0.00 -0.71 0.00 0.00 54.79 52.63 3iwb n ASP 116 Cb 0.33 -0.10 -0.00 0.00 -1.35 0.00 0.00 41.12 40.00 3iwb n ASP 116 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 3iwb n GLU 117 N -0.34 2.98 0.00 0.11 -0.58 -0.83 -5.26 120.64 116.72 3iwb n GLU 117 Ca 0.00 0.00 0.13 0.00 -0.42 0.00 0.00 57.16 56.87 3iwb n GLU 117 Cb 0.05 -1.00 0.34 0.00 -0.57 0.00 0.00 31.44 30.25 3iwb n GLU 117 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09