#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 9ilb n PRO 2 N 0.00 0.00 -4.17 0.00 -0.02 -1.26 -1.20 135.00 128.34 9ilb n PRO 2 Ca 0.00 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.14 9ilb n PRO 2 Cb 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 33.50 33.36 9ilb n PRO 2 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 9ilb s VAL 3 N -0.34 3.95 0.10 -1.45 0.11 -1.26 -4.75 120.40 116.77 9ilb s VAL 3 Ca 0.00 -0.32 -0.16 0.00 -2.93 0.00 0.00 61.98 58.57 9ilb s VAL 3 Cb 0.00 -2.77 -0.07 0.00 -1.53 0.00 0.00 36.38 32.01 9ilb s VAL 3 CO 0.00 0.45 0.55 -0.13 -3.33 0.00 0.00 175.10 172.64 9ilb s ARG 4 N 0.78 4.06 0.27 1.54 0.52 -0.34 -4.99 118.95 120.79 9ilb s ARG 4 Ca -0.00 0.59 -0.01 0.00 -0.52 0.00 0.00 55.73 55.78 9ilb s ARG 4 Cb -0.14 -3.08 -0.02 0.00 0.52 0.00 0.00 34.95 32.23 9ilb s ARG 4 CO 0.02 0.56 0.30 -1.12 0.02 0.00 0.00 175.30 175.08 9ilb s SER 5 N -1.42 0.65 -0.19 0.23 0.01 -1.26 -1.35 113.70 110.38 9ilb s SER 5 Ca 0.33 -1.43 -0.19 0.00 1.31 0.00 0.00 55.95 55.97 9ilb s SER 5 Cb -0.17 0.52 0.05 0.00 0.21 0.00 0.00 66.02 66.63 9ilb s SER 5 CO 0.19 -1.04 0.54 -1.48 0.41 0.00 0.00 173.24 171.85 9ilb s LEU 6 N -3.21 -0.05 0.24 2.44 0.05 0.35 -4.96 118.68 113.55 9ilb s LEU 6 Ca 0.35 1.03 -0.22 0.00 0.05 0.00 0.00 54.13 55.33 9ilb s LEU 6 Cb 0.03 1.86 -0.09 0.00 -2.05 0.00 0.00 46.19 45.94 9ilb s LEU 6 CO 0.17 -0.22 0.80 0.20 -0.55 0.00 0.00 176.35 176.75 9ilb s ASN 7 N 0.15 7.19 0.18 1.48 0.01 -1.26 -0.83 114.94 121.86 9ilb s ASN 7 Ca -0.01 1.58 -0.24 0.00 -0.71 0.00 0.00 52.86 53.48 9ilb s ASN 7 Cb -0.04 -2.48 0.06 0.00 0.41 0.00 0.00 41.25 39.21 9ilb s ASN 7 CO 0.01 0.03 0.95 0.00 -1.51 0.00 0.00 177.10 176.59 9ilb s THR 9 N -3.09 2.10 0.10 0.00 -4.23 0.50 -0.97 115.64 110.04 9ilb s THR 9 Ca 0.14 -2.30 0.08 0.00 -1.18 0.00 0.00 61.69 58.43 9ilb s THR 9 Cb -0.02 -2.16 -0.03 0.00 1.34 0.00 0.00 72.50 71.63 9ilb s THR 9 CO 0.03 -0.49 -0.20 -0.76 -0.54 0.00 0.00 174.62 172.66 9ilb s LEU 10 N -3.39 2.29 -0.04 4.79 1.43 -1.26 -0.76 118.68 121.75 9ilb s LEU 10 Ca 0.26 -0.67 -0.02 0.00 -1.03 0.00 0.00 54.13 52.66 9ilb s LEU 10 Cb -0.03 -0.82 0.02 0.00 0.03 0.00 0.00 46.19 45.39 9ilb s LEU 10 CO 0.11 0.04 0.09 -0.13 0.23 0.00 0.00 176.35 176.69 9ilb s ARG 11 N -1.86 0.07 0.85 1.70 0.52 -0.08 -4.35 118.95 115.81 9ilb s ARG 11 Ca 0.05 0.20 -0.12 0.00 -0.52 0.00 0.00 55.73 55.35 9ilb s ARG 11 Cb -0.10 -0.07 0.10 0.00 0.52 0.00 0.00 34.95 35.41 9ilb s ARG 11 CO 0.04 -0.08 1.10 0.16 0.02 0.00 0.00 175.30 176.54 9ilb s ASP 12 N 0.54 3.98 0.00 0.23 1.47 -0.80 -0.13 116.67 121.96 9ilb s ASP 12 Ca -0.04 1.30 0.06 0.00 1.18 0.00 0.00 52.55 55.04 9ilb s ASP 12 Cb -0.06 -1.99 0.25 0.00 -0.34 0.00 0.00 42.92 40.79 9ilb s ASP 12 CO -0.02 -2.29 1.19 -1.54 0.68 0.00 0.00 175.17 173.19 9ilb n SER 13 N -3.64 0.01 -1.10 2.11 3.41 -0.39 0.50 113.62 114.51 9ilb n SER 13 Ca 0.07 0.50 0.11 0.00 -0.26 0.00 0.00 58.87 59.29 9ilb n SER 13 Cb 0.56 -0.50 0.25 0.00 -0.26 0.00 0.00 64.21 64.27 9ilb n SER 13 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 9ilb n GLN 14 N -1.51 2.42 -1.26 4.33 1.13 -1.26 -4.93 117.38 116.30 9ilb n GLN 14 Ca 0.01 -2.17 -0.09 0.00 -1.94 0.00 0.00 57.00 52.81 9ilb n GLN 14 Cb 0.07 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 28.88 9ilb n GLN 14 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 9ilb n GLN 15 N 1.34 -0.64 -2.80 -1.09 1.13 0.18 -4.99 117.38 110.50 9ilb n GLN 15 Ca 0.20 0.81 -0.40 0.00 -1.94 0.00 0.00 57.00 55.67 9ilb n GLN 15 Cb 0.56 -4.70 -0.06 0.00 0.11 0.00 0.00 30.24 26.16 9ilb n GLN 15 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 9ilb s LYS 16 N -2.74 4.77 0.26 -1.09 1.02 -1.25 -4.63 119.74 116.07 9ilb s LYS 16 Ca 0.00 1.40 -0.01 0.00 0.02 0.00 0.00 55.97 57.39 9ilb s LYS 16 Cb 0.00 -3.29 -0.04 0.00 -0.52 0.00 0.00 37.83 33.98 9ilb s LYS 16 CO 0.00 0.48 0.46 -1.12 -0.92 0.00 0.00 175.35 174.25 9ilb s SER 17 N -0.97 6.36 -0.14 2.83 0.01 0.67 -1.91 113.70 120.55 9ilb s SER 17 Ca 0.41 0.44 -0.07 0.00 1.31 0.00 0.00 55.95 58.04 9ilb s SER 17 Cb -0.25 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 63.92 9ilb s SER 17 CO 0.30 -0.14 0.09 -0.76 0.41 0.00 0.00 173.24 173.14 9ilb s LEU 18 N -3.70 4.05 0.04 2.44 1.43 -1.26 -0.70 118.68 120.99 9ilb s LEU 18 Ca 0.39 0.27 -0.01 0.00 -1.03 0.00 0.00 54.13 53.76 9ilb s LEU 18 Cb -0.10 -2.00 -0.03 0.00 0.03 0.00 0.00 46.19 44.09 9ilb s LEU 18 CO 0.31 0.31 -0.03 0.68 0.23 0.00 0.00 176.35 177.85 9ilb s VAL 19 N -0.44 0.22 -0.16 -1.59 -7.23 -0.47 -1.20 120.40 109.53 9ilb s VAL 19 Ca 0.11 -1.54 -0.29 0.00 -1.81 0.00 0.00 61.98 58.44 9ilb s VAL 19 Cb -0.12 -1.15 -0.03 0.00 0.56 0.00 0.00 36.38 35.65 9ilb s VAL 19 CO 0.02 -0.84 1.45 -0.04 -0.31 0.00 0.00 175.10 175.38 9ilb s MET 20 N -3.16 4.10 0.00 4.82 -1.94 -1.26 -0.20 119.30 121.66 9ilb s MET 20 Ca 0.00 1.77 0.00 0.00 -1.71 0.00 0.00 55.69 55.75 9ilb s MET 20 Cb 0.02 -3.89 0.00 0.00 2.01 0.00 0.00 34.83 32.97 9ilb s MET 20 CO -0.07 -0.90 0.00 0.45 -0.01 0.00 0.00 175.02 174.49 9ilb n SER 21 N 7.22 0.00 -1.80 3.03 2.88 0.35 -4.87 113.62 120.43 9ilb n SER 21 Ca 0.16 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 9ilb n SER 21 Cb 0.44 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.90 9ilb n SER 21 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 9ilb n GLY 22 N 2.99 1.25 0.19 0.46 0.00 -1.21 -4.90 105.19 103.96 9ilb n GLY 22 Ca 0.00 -1.61 0.12 0.00 0.00 0.00 0.00 46.02 44.52 9ilb n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 9ilb h PRO 23 N 0.00 0.00 0.00 1.61 0.13 -2.03 -3.36 132.00 128.35 9ilb h PRO 23 Ca 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.13 9ilb h PRO 23 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 9ilb h PRO 23 CO 0.00 0.00 -0.22 0.66 -0.23 0.00 0.00 178.00 178.21 9ilb n TYR 24 N -2.98 0.00 -3.89 1.56 4.01 -1.26 -5.01 117.16 109.60 9ilb n TYR 24 Ca 0.03 -0.63 -0.11 0.00 -0.16 0.00 0.00 57.90 57.03 9ilb n TYR 24 Cb 0.54 -0.12 -0.11 0.00 -0.31 0.00 0.00 39.34 39.34 9ilb n TYR 24 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 9ilb s GLU 25 N -1.76 0.39 0.06 -0.72 2.12 -1.26 -3.52 118.70 114.01 9ilb s GLU 25 Ca 0.20 -0.34 0.05 0.00 0.36 0.00 0.00 54.97 55.24 9ilb s GLU 25 Cb 0.18 0.16 -0.04 0.00 0.26 0.00 0.00 34.13 34.69 9ilb s GLU 25 CO 0.01 -0.09 -0.07 -0.51 -0.54 0.00 0.00 175.26 174.06 9ilb s LEU 26 N -1.15 3.14 0.08 2.70 1.43 -1.26 0.13 118.68 123.75 9ilb s LEU 26 Ca -0.12 -0.26 0.04 0.00 -1.03 0.00 0.00 54.13 52.75 9ilb s LEU 26 Cb -0.07 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.24 9ilb s LEU 26 CO 0.01 0.22 -0.12 -0.54 0.23 0.00 0.00 176.35 176.15 9ilb s LYS 27 N -1.89 0.81 -0.07 1.70 1.02 0.72 -0.46 119.74 121.57 9ilb s LYS 27 Ca 0.20 -1.03 0.02 0.00 0.02 0.00 0.00 55.97 55.18 9ilb s LYS 27 Cb -0.11 -0.64 -0.03 0.00 -0.52 0.00 0.00 37.83 36.53 9ilb s LYS 27 CO 0.12 0.12 -0.11 0.00 -0.92 0.00 0.00 175.35 174.56 9ilb s ALA 28 N -1.83 2.79 0.09 5.17 0.00 0.78 -1.37 121.76 127.39 9ilb s ALA 28 Ca 0.01 -0.93 -0.25 0.00 0.00 0.00 0.00 51.96 50.78 9ilb s ALA 28 Cb -0.07 -1.11 0.08 0.00 0.00 0.00 0.00 23.12 22.02 9ilb s ALA 28 CO 0.01 0.53 0.68 -0.48 0.00 0.00 0.00 175.76 176.50 9ilb s LEU 29 N -0.64 -0.53 -0.14 0.00 0.05 0.12 -0.89 118.68 116.66 9ilb s LEU 29 Ca 0.09 0.08 -0.29 0.00 0.05 0.00 0.00 54.13 54.06 9ilb s LEU 29 Cb -0.11 2.44 -0.03 0.00 -2.05 0.00 0.00 46.19 46.44 9ilb s LEU 29 CO 0.01 -0.84 1.54 -1.00 -0.55 0.00 0.00 176.35 175.51 9ilb s HIS 30 N -3.28 2.25 0.02 3.48 3.76 -1.26 -0.24 115.29 120.01 9ilb s HIS 30 Ca 0.01 0.52 0.02 0.00 -0.15 0.00 0.00 55.06 55.45 9ilb s HIS 30 Cb -0.01 -3.84 -0.01 0.00 1.11 0.00 0.00 32.58 29.83 9ilb s HIS 30 CO -0.09 -2.99 -0.06 -1.17 -0.85 0.00 0.00 174.74 169.57 9ilb s LEU 31 N 4.28 2.14 0.10 0.89 2.96 -1.26 -4.95 118.68 122.84 9ilb s LEU 31 Ca 0.68 -0.34 -0.18 0.00 -0.22 0.00 0.00 54.13 54.07 9ilb s LEU 31 Cb -0.27 -0.19 0.04 0.00 0.50 0.00 0.00 46.19 46.26 9ilb s LEU 31 CO 0.26 -0.09 0.43 -1.58 -1.32 0.00 0.00 176.35 174.05 9ilb s GLN 32 N -0.91 1.05 6.71 1.98 0.74 -1.26 -4.84 119.66 123.13 9ilb s GLN 32 Ca -0.05 -0.55 0.00 0.00 0.05 0.00 0.00 55.36 54.81 9ilb s GLN 32 Cb -0.06 0.47 0.00 0.00 1.10 0.00 0.00 33.01 34.51 9ilb s GLN 32 CO 0.00 -0.40 0.00 0.41 -0.55 0.00 0.00 175.29 174.75 9ilb n GLY 33 N 0.00 2.27 0.29 2.59 0.00 -1.26 -2.85 105.19 106.24 9ilb n GLY 33 Ca -0.17 -0.39 0.15 0.00 0.00 0.00 0.00 46.02 45.61 9ilb n GLY 33 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 9ilb h GLN 34 N 0.00 0.00 0.00 1.61 3.07 -2.04 -2.40 115.11 115.35 9ilb h GLN 34 Ca 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.66 9ilb h GLN 34 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.55 9ilb h GLN 34 CO 0.00 0.04 -0.37 -0.44 0.09 0.00 0.00 178.83 178.14 9ilb h ASP 35 N 0.00 0.00 -0.02 0.06 3.32 -1.93 -3.21 116.42 114.63 9ilb h ASP 35 Ca -0.00 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.06 9ilb h ASP 35 Cb 0.10 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 9ilb h ASP 35 CO 0.00 0.37 0.30 -0.03 -1.72 0.00 0.00 179.24 178.17 9ilb h MET 36 N 0.00 0.00 -0.01 3.56 4.05 -1.58 0.76 114.93 121.71 9ilb h MET 36 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 9ilb h MET 36 Cb 0.79 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.59 9ilb h MET 36 CO 0.05 0.00 -0.06 0.39 0.23 0.00 0.00 176.91 177.52 9ilb n GLU 37 N -2.96 1.18 0.00 0.39 4.71 -1.21 -2.82 120.64 119.93 9ilb n GLU 37 Ca -0.02 -0.53 0.14 0.00 -0.01 0.00 0.00 57.16 56.74 9ilb n GLU 37 Cb 0.36 -1.49 0.67 0.00 -1.01 0.00 0.00 31.44 29.97 9ilb n GLU 37 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 9ilb n GLN 38 N -0.45 0.24 -2.33 3.49 6.02 0.26 -4.87 117.38 119.74 9ilb n GLN 38 Ca 0.18 0.02 -0.34 0.00 -0.01 0.00 0.00 57.00 56.84 9ilb n GLN 38 Cb 0.29 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 30.03 9ilb n GLN 38 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 9ilb s GLN 39 N -2.75 3.52 0.09 -1.09 -2.07 -1.13 -4.55 119.66 111.69 9ilb s GLN 39 Ca 0.22 1.44 -0.30 0.00 -1.82 0.00 0.00 55.36 54.89 9ilb s GLN 39 Cb 0.19 -2.05 -0.05 0.00 -1.09 0.00 0.00 33.01 30.01 9ilb s GLN 39 CO 0.47 -0.68 1.00 0.08 -1.32 0.00 0.00 175.29 174.84 9ilb s VAL 40 N -1.98 4.44 -0.32 3.63 1.01 -0.34 -4.99 120.40 121.85 9ilb s VAL 40 Ca 0.69 1.95 -0.10 0.00 0.00 0.00 0.00 61.98 64.52 9ilb s VAL 40 Cb -0.19 -4.25 -0.00 0.00 0.00 0.00 0.00 36.38 31.93 9ilb s VAL 40 CO 0.26 0.26 0.16 -0.69 0.00 0.00 0.00 175.10 175.09 9ilb s VAL 41 N 0.25 4.59 0.71 2.92 1.01 -1.26 -4.68 120.40 123.95 9ilb s VAL 41 Ca 0.49 -0.46 -0.08 0.00 0.00 0.00 0.00 61.98 61.93 9ilb s VAL 41 Cb -0.24 -3.36 0.06 0.00 0.00 0.00 0.00 36.38 32.83 9ilb s VAL 41 CO 0.30 0.04 1.04 -0.36 0.00 0.00 0.00 175.10 176.12 9ilb s PHE 42 N 1.61 2.99 -0.38 5.22 0.08 -0.14 -0.30 117.98 127.06 9ilb s PHE 42 Ca 0.04 0.57 0.01 0.00 0.12 0.00 0.00 56.93 57.68 9ilb s PHE 42 Cb -0.17 -3.20 0.12 0.00 -0.57 0.00 0.00 43.02 39.20 9ilb s PHE 42 CO 0.06 -1.40 0.16 0.45 -0.10 0.00 0.00 175.22 174.39 9ilb s SER 43 N -4.49 3.99 -0.15 1.36 0.15 0.32 -1.71 113.70 113.17 9ilb s SER 43 Ca 0.60 -2.18 -0.29 0.00 0.70 0.00 0.00 55.95 54.77 9ilb s SER 43 Cb -0.11 -1.08 -0.01 0.00 -1.71 0.00 0.00 66.02 63.12 9ilb s SER 43 CO 0.46 -0.34 1.07 -0.32 1.20 0.00 0.00 173.24 175.31 9ilb s MET 44 N 0.91 4.33 -0.11 5.44 1.75 -0.01 -3.05 119.30 128.57 9ilb s MET 44 Ca 0.13 1.44 -0.02 0.00 -1.25 0.00 0.00 55.69 55.99 9ilb s MET 44 Cb -0.21 -3.60 -0.03 0.00 2.84 0.00 0.00 34.83 33.83 9ilb s MET 44 CO -0.11 -0.49 -0.02 -1.12 -0.65 0.00 0.00 175.02 172.62 9ilb s SER 45 N 1.27 4.99 -0.82 1.11 0.01 0.11 -0.49 113.70 119.87 9ilb s SER 45 Ca 0.48 0.01 -0.19 0.00 1.31 0.00 0.00 55.95 57.56 9ilb s SER 45 Cb -0.18 -1.54 0.12 0.00 0.21 0.00 0.00 66.02 64.62 9ilb s SER 45 CO 0.13 0.29 1.02 -0.36 0.41 0.00 0.00 173.24 174.73 9ilb s PHE 46 N -0.37 3.04 0.71 2.43 0.40 -0.45 -1.00 117.98 122.74 9ilb s PHE 46 Ca 0.06 -1.18 0.02 0.00 -0.60 0.00 0.00 56.93 55.23 9ilb s PHE 46 Cb -0.12 -4.23 0.13 0.00 0.51 0.00 0.00 43.02 39.32 9ilb s PHE 46 CO 0.02 -1.47 0.98 0.14 0.70 0.00 0.00 175.22 175.59 9ilb s VAL 47 N 2.86 2.04 0.11 -0.44 -7.23 -1.18 -4.52 120.40 112.05 9ilb s VAL 47 Ca 0.27 -0.69 -0.25 0.00 -1.81 0.00 0.00 61.98 59.50 9ilb s VAL 47 Cb -0.10 -2.36 -0.07 0.00 0.56 0.00 0.00 36.38 34.41 9ilb s VAL 47 CO -0.03 0.00 0.76 0.00 -0.31 0.00 0.00 175.10 175.52 9ilb s GLN 48 N -5.09 4.52 0.00 4.82 0.00 0.06 -4.72 119.66 119.25 9ilb s GLN 48 Ca 0.67 1.10 0.00 0.00 -0.00 0.00 0.00 55.36 57.12 9ilb s GLN 48 Cb -0.04 -3.30 0.00 0.00 0.00 0.00 0.00 33.01 29.66 9ilb s GLN 48 CO 0.44 0.46 0.00 0.41 0.00 0.00 0.00 175.29 176.60 9ilb n GLY 49 N 1.93 -1.44 3.60 2.60 0.00 -1.26 -4.82 105.19 105.80 9ilb n GLY 49 Ca -0.05 -1.03 -0.43 0.00 0.00 0.00 0.00 46.02 44.51 9ilb n GLY 49 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 9ilb s GLU 50 N -1.15 3.45 0.03 1.61 4.04 -1.26 -4.96 118.70 120.46 9ilb s GLU 50 Ca 0.00 1.19 -0.00 0.00 0.04 0.00 0.00 54.97 56.19 9ilb s GLU 50 Cb 0.00 -4.12 -0.04 0.00 0.02 0.00 0.00 34.13 30.00 9ilb s GLU 50 CO 0.00 -1.72 0.16 -2.00 -1.84 0.00 0.00 175.26 169.86 9ilb s GLU 51 N 5.31 3.28 0.23 -4.83 2.12 -1.26 -4.64 118.70 118.92 9ilb s GLU 51 Ca 0.71 -0.46 -0.05 0.00 0.36 0.00 0.00 54.97 55.52 9ilb s GLU 51 Cb -0.18 -2.97 -0.02 0.00 0.26 0.00 0.00 34.13 31.21 9ilb s GLU 51 CO 0.33 0.63 0.29 0.45 -0.54 0.00 0.00 175.26 176.42 9ilb s SER 52 N -2.22 0.17 0.35 -1.70 0.15 -0.90 -5.02 113.70 104.53 9ilb s SER 52 Ca 0.30 -1.23 0.27 0.00 0.70 0.00 0.00 55.95 55.99 9ilb s SER 52 Cb -0.13 0.49 1.06 0.00 -1.71 0.00 0.00 66.02 65.72 9ilb s SER 52 CO 0.22 -1.00 1.80 -0.55 1.20 0.00 0.00 173.24 174.92 9ilb h ASN 53 N 2.43 0.00 0.00 5.45 7.08 -2.01 -3.24 115.58 125.29 9ilb h ASN 53 Ca -0.31 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.91 9ilb h ASN 53 Cb 1.25 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.49 9ilb h ASN 53 CO 0.45 0.00 0.00 -0.90 -2.08 0.00 0.00 177.43 174.90 9ilb n ASP 54 N -2.54 0.61 -3.76 6.14 5.75 -1.26 -4.97 116.55 116.53 9ilb n ASP 54 Ca 0.02 -0.93 -0.30 0.00 -0.01 0.00 0.00 54.79 53.57 9ilb n ASP 54 Cb 0.29 0.08 -0.14 0.00 -1.03 0.00 0.00 41.12 40.31 9ilb n ASP 54 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 9ilb s LYS 55 N -0.08 1.05 -0.16 0.11 2.20 -1.22 -1.45 119.74 120.19 9ilb s LYS 55 Ca 0.00 -1.56 -0.05 0.00 -0.36 0.00 0.00 55.97 53.99 9ilb s LYS 55 Cb 0.00 -2.28 -0.03 0.00 -1.51 0.00 0.00 37.83 34.01 9ilb s LYS 55 CO 0.00 -1.06 0.02 0.42 -0.36 0.00 0.00 175.35 174.37 9ilb s ILE 56 N 0.99 4.39 0.19 5.43 -1.09 -0.07 -2.11 121.20 128.94 9ilb s ILE 56 Ca 0.13 -0.18 -0.30 0.00 -2.23 0.00 0.00 60.65 58.07 9ilb s ILE 56 Cb -0.21 -2.95 -0.08 0.00 -1.58 0.00 0.00 42.46 37.65 9ilb s ILE 56 CO -0.12 0.49 1.02 -2.16 -1.23 0.00 0.00 174.94 172.94 9ilb s PRO 57 N 0.24 4.70 0.19 2.79 0.04 -1.26 0.16 135.00 141.86 9ilb s PRO 57 Ca 0.01 1.60 -0.04 0.00 0.04 0.00 0.00 61.00 62.61 9ilb s PRO 57 Cb -0.13 -3.29 -0.03 0.00 0.04 0.00 0.00 34.50 31.09 9ilb s PRO 57 CO 0.01 0.25 0.18 0.14 0.04 0.00 0.00 177.00 177.63 9ilb s VAL 58 N -0.58 0.03 -0.03 -0.36 -7.23 0.10 -3.11 120.40 109.22 9ilb s VAL 58 Ca 0.46 -1.83 0.04 0.00 -1.81 0.00 0.00 61.98 58.84 9ilb s VAL 58 Cb -0.27 -2.29 -0.01 0.00 0.56 0.00 0.00 36.38 34.37 9ilb s VAL 58 CO 0.34 -0.13 -0.16 0.00 -0.31 0.00 0.00 175.10 174.84 9ilb s ALA 59 N -4.10 1.43 -0.33 1.32 0.00 -0.17 -0.56 121.76 119.35 9ilb s ALA 59 Ca 0.31 -0.67 -0.01 0.00 0.00 0.00 0.00 51.96 51.59 9ilb s ALA 59 Cb 0.06 -0.44 0.07 0.00 0.00 0.00 0.00 23.12 22.80 9ilb s ALA 59 CO 0.08 0.28 0.06 -0.51 0.00 0.00 0.00 175.76 175.68 9ilb s LEU 60 N -0.08 4.35 0.41 0.00 1.43 -1.26 -0.72 118.68 122.81 9ilb s LEU 60 Ca -0.01 -1.57 0.07 0.00 -1.03 0.00 0.00 54.13 51.60 9ilb s LEU 60 Cb -0.10 -1.73 -0.06 0.00 0.03 0.00 0.00 46.19 44.33 9ilb s LEU 60 CO 0.01 -0.35 0.15 -0.83 0.23 0.00 0.00 176.35 175.56 9ilb s GLY 61 N 1.38 2.33 0.13 -3.19 0.00 -1.17 -1.21 107.32 105.59 9ilb s GLY 61 Ca 0.00 -2.12 -0.16 0.00 0.00 0.00 0.00 44.72 42.44 9ilb s GLY 61 CO -0.03 -1.93 0.57 1.08 0.00 0.00 0.00 173.10 172.79 9ilb s LEU 62 N -3.87 4.40 0.04 0.66 1.02 -0.62 -0.52 118.68 119.80 9ilb s LEU 62 Ca 0.40 1.16 -0.32 0.00 0.02 0.00 0.00 54.13 55.39 9ilb s LEU 62 Cb 0.04 -3.18 -0.11 0.00 0.02 0.00 0.00 46.19 42.96 9ilb s LEU 62 CO 0.22 0.15 1.84 1.17 0.02 0.00 0.00 176.35 179.75 9ilb n LYS 63 N 1.08 2.51 -1.04 1.70 4.81 0.59 -1.91 118.16 125.91 9ilb n LYS 63 Ca -0.07 0.92 -0.01 0.00 -0.87 0.00 0.00 58.31 58.28 9ilb n LYS 63 Cb 0.51 -2.79 -0.01 0.00 0.02 0.00 0.00 35.03 32.77 9ilb n LYS 63 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 9ilb n GLU 64 N 6.01 -1.44 -5.05 1.64 1.02 -1.26 -4.97 120.64 116.59 9ilb n GLU 64 Ca 0.20 0.43 -0.28 0.00 -0.02 0.00 0.00 57.16 57.49 9ilb n GLU 64 Cb 0.34 -4.53 -0.16 0.00 -0.02 0.00 0.00 31.44 27.07 9ilb n GLU 64 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 9ilb s LYS 65 N -1.63 1.77 -0.83 3.49 1.02 -0.80 -5.03 119.74 117.73 9ilb s LYS 65 Ca 0.00 -0.76 -0.07 0.00 0.02 0.00 0.00 55.97 55.16 9ilb s LYS 65 Cb 0.00 -1.69 -0.12 0.00 -0.52 0.00 0.00 37.83 35.50 9ilb s LYS 65 CO 0.00 0.45 3.14 0.27 -0.92 0.00 0.00 175.35 178.29 9ilb n ASN 66 N 2.60 7.06 -4.06 2.83 2.04 -1.26 -4.20 115.26 120.27 9ilb n ASN 66 Ca -0.16 -2.67 -0.24 0.00 -0.44 0.00 0.00 54.58 51.07 9ilb n ASN 66 Cb 0.53 -1.45 -0.16 0.00 -2.53 0.00 0.00 39.78 36.17 9ilb n ASN 66 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 9ilb s LEU 67 N -0.42 1.78 0.03 -4.53 1.43 -1.26 -1.84 118.68 113.87 9ilb s LEU 67 Ca 0.66 -0.30 0.04 0.00 -1.03 0.00 0.00 54.13 53.50 9ilb s LEU 67 Cb 0.26 -0.82 -0.02 0.00 0.03 0.00 0.00 46.19 45.63 9ilb s LEU 67 CO -0.06 0.09 -0.12 -0.31 0.23 0.00 0.00 176.35 176.18 9ilb s TYR 68 N 0.33 1.01 0.21 0.29 2.02 0.15 -1.59 117.35 119.77 9ilb s TYR 68 Ca -0.08 -0.34 -0.30 0.00 -0.37 0.00 0.00 57.07 55.98 9ilb s TYR 68 Cb -0.13 -0.61 -0.09 0.00 -0.40 0.00 0.00 41.96 40.74 9ilb s TYR 68 CO 0.02 0.01 1.28 -0.51 -1.57 0.00 0.00 175.55 174.78 9ilb s LEU 69 N -1.07 4.43 0.03 -1.29 1.43 -0.35 -0.57 118.68 121.29 9ilb s LEU 69 Ca -0.01 2.38 0.01 0.00 -1.03 0.00 0.00 54.13 55.48 9ilb s LEU 69 Cb -0.07 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.51 9ilb s LEU 69 CO 0.01 -0.49 -0.05 -0.55 0.23 0.00 0.00 176.35 175.50 9ilb s SER 70 N 0.22 0.51 -0.22 2.29 0.15 0.20 -4.56 113.70 112.29 9ilb s SER 70 Ca 0.55 -0.49 -0.04 0.00 0.70 0.00 0.00 55.95 56.66 9ilb s SER 70 Cb -0.36 0.06 -0.01 0.00 -1.71 0.00 0.00 66.02 64.00 9ilb s SER 70 CO 0.39 -0.24 -0.02 0.00 1.20 0.00 0.00 173.24 174.57 9ilb s VAL 72 N 1.49 0.16 -0.10 0.00 -7.23 0.69 -4.71 120.40 110.71 9ilb s VAL 72 Ca 0.06 -1.35 -0.30 0.00 -1.81 0.00 0.00 61.98 58.58 9ilb s VAL 72 Cb -0.14 -1.06 -0.02 0.00 0.56 0.00 0.00 36.38 35.72 9ilb s VAL 72 CO -0.02 -0.75 1.14 -0.76 -0.31 0.00 0.00 175.10 174.40 9ilb s LEU 73 N -2.37 4.24 -0.18 1.32 1.43 -1.26 0.13 118.68 121.99 9ilb s LEU 73 Ca -0.01 1.68 -0.03 0.00 -1.03 0.00 0.00 54.13 54.74 9ilb s LEU 73 Cb 0.01 -3.55 0.06 0.00 0.03 0.00 0.00 46.19 42.74 9ilb s LEU 73 CO -0.07 -0.57 0.04 -0.54 0.23 0.00 0.00 176.35 175.45 9ilb s LYS 74 N 2.38 0.52 -0.72 1.70 -0.14 0.11 -4.69 119.74 118.89 9ilb s LYS 74 Ca 0.53 -0.29 -0.03 0.00 -1.36 0.00 0.00 55.97 54.81 9ilb s LYS 74 Cb -0.22 -1.93 0.00 0.00 -1.68 0.00 0.00 37.83 34.01 9ilb s LYS 74 CO 0.19 -0.61 0.62 -3.47 -0.76 0.00 0.00 175.35 171.31 9ilb n ASP 75 N 5.11 -3.39 -3.50 2.83 2.03 -1.26 -3.04 116.55 115.33 9ilb n ASP 75 Ca -0.08 -0.32 -0.25 0.00 0.52 0.00 0.00 54.79 54.66 9ilb n ASP 75 Cb 0.48 -3.05 0.05 0.00 -0.72 0.00 0.00 41.12 37.88 9ilb n ASP 75 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 9ilb n ASP 76 N -1.53 -5.69 -3.68 1.67 8.00 -1.26 -4.96 116.55 109.10 9ilb n ASP 76 Ca -0.07 -0.52 -0.10 0.00 0.71 0.00 0.00 54.79 54.81 9ilb n ASP 76 Cb 0.56 -4.54 -0.09 0.00 -0.02 0.00 0.00 41.12 37.03 9ilb n ASP 76 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 9ilb s LYS 77 N -6.20 0.52 0.13 -1.24 3.01 -1.17 -5.12 119.74 109.68 9ilb s LYS 77 Ca 0.51 0.87 -0.34 0.00 -1.01 0.00 0.00 55.97 56.01 9ilb s LYS 77 Cb -0.24 0.10 -0.13 0.00 -1.01 0.00 0.00 37.83 36.55 9ilb s LYS 77 CO 0.64 -0.13 1.64 -2.30 0.51 0.00 0.00 175.35 175.71 9ilb n PRO 78 N 3.85 2.25 -4.07 -1.68 -0.02 -1.26 0.03 135.00 134.11 9ilb n PRO 78 Ca -0.20 0.81 -0.14 0.00 -2.02 0.00 0.00 63.50 61.96 9ilb n PRO 78 Cb 0.56 -2.61 -0.13 0.00 -0.02 0.00 0.00 33.50 31.30 9ilb n PRO 78 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 9ilb s THR 79 N 1.41 0.34 0.18 3.45 2.01 0.34 -4.83 115.64 118.53 9ilb s THR 79 Ca 0.80 -0.42 -0.16 0.00 0.31 0.00 0.00 61.69 62.23 9ilb s THR 79 Cb -0.65 -0.33 -0.07 0.00 0.01 0.00 0.00 72.50 71.45 9ilb s THR 79 CO 0.39 -0.06 0.61 -0.22 -0.69 0.00 0.00 174.62 174.65 9ilb s LEU 80 N -0.51 4.33 0.03 4.42 2.96 -1.26 -0.22 118.68 128.43 9ilb s LEU 80 Ca -0.02 1.19 -0.28 0.00 -0.22 0.00 0.00 54.13 54.80 9ilb s LEU 80 Cb -0.04 -3.40 0.09 0.00 0.50 0.00 0.00 46.19 43.34 9ilb s LEU 80 CO -0.00 0.07 0.86 0.00 -1.32 0.00 0.00 176.35 175.95 9ilb s GLN 81 N -2.02 0.92 -0.09 1.98 -2.07 0.02 -4.90 119.66 113.51 9ilb s GLN 81 Ca 0.40 -0.36 -0.16 0.00 -1.82 0.00 0.00 55.36 53.42 9ilb s GLN 81 Cb -0.15 0.41 -0.05 0.00 -1.09 0.00 0.00 33.01 32.13 9ilb s GLN 81 CO 0.20 -0.40 0.43 -0.51 -1.32 0.00 0.00 175.29 173.68 9ilb s LEU 82 N -2.56 4.33 0.02 2.60 2.01 -1.23 0.62 118.68 124.48 9ilb s LEU 82 Ca 0.05 0.81 0.06 0.00 0.01 0.00 0.00 54.13 55.06 9ilb s LEU 82 Cb -0.01 -2.61 -0.02 0.00 0.01 0.00 0.00 46.19 43.56 9ilb s LEU 82 CO -0.08 0.11 -0.16 -0.70 1.01 0.00 0.00 176.35 176.52 9ilb s GLU 83 N 0.09 1.18 0.16 1.70 2.12 0.27 -4.91 118.70 119.31 9ilb s GLU 83 Ca 0.24 -0.74 -0.19 0.00 0.36 0.00 0.00 54.97 54.63 9ilb s GLU 83 Cb -0.15 -1.20 -0.08 0.00 0.26 0.00 0.00 34.13 32.96 9ilb s GLU 83 CO 0.10 0.31 0.66 -1.12 -0.54 0.00 0.00 175.26 174.67 9ilb s SER 84 N -0.89 7.07 0.19 -1.70 0.01 -1.26 -0.68 113.70 116.44 9ilb s SER 84 Ca 0.05 1.35 0.00 0.00 1.31 0.00 0.00 55.95 58.66 9ilb s SER 84 Cb -0.07 -2.39 -0.04 0.00 0.21 0.00 0.00 66.02 63.72 9ilb s SER 84 CO 0.01 0.13 0.07 0.68 0.41 0.00 0.00 173.24 174.54 9ilb s VAL 85 N -1.35 0.37 -0.10 3.43 -7.23 -0.77 -4.98 120.40 109.76 9ilb s VAL 85 Ca 0.37 -1.97 -0.29 0.00 -1.81 0.00 0.00 61.98 58.28 9ilb s VAL 85 Cb -0.18 -2.31 -0.06 0.00 0.56 0.00 0.00 36.38 34.39 9ilb s VAL 85 CO 0.21 -0.25 1.83 -0.62 -0.31 0.00 0.00 175.10 175.96 9ilb s ASP 86 N -3.18 6.32 0.63 4.85 -1.08 -1.26 -4.81 116.67 118.14 9ilb s ASP 86 Ca 0.31 2.12 0.33 0.00 -0.52 0.00 0.00 52.55 54.79 9ilb s ASP 86 Cb 0.07 -2.53 1.84 0.00 -1.46 0.00 0.00 42.92 40.84 9ilb s ASP 86 CO 0.08 -1.23 2.11 1.55 0.52 0.00 0.00 175.17 178.19 9ilb h PRO 87 N 11.12 0.00 0.00 4.34 0.13 -1.92 -2.22 132.00 143.46 9ilb h PRO 87 Ca -0.41 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.53 9ilb h PRO 87 Cb 1.20 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.30 9ilb h PRO 87 CO 0.97 0.00 -1.07 0.87 -0.23 0.00 0.00 178.00 178.53 9ilb h LYS 88 N 0.00 0.00 -0.14 0.86 6.56 -2.02 -3.37 116.57 118.45 9ilb h LYS 88 Ca 0.04 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.63 9ilb h LYS 88 Cb 0.45 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.11 9ilb h LYS 88 CO -0.00 0.62 0.00 0.09 -2.06 0.00 0.00 179.45 178.10 9ilb n ASN 89 N -3.16 2.97 -4.26 0.86 3.02 -0.84 -4.96 115.26 108.89 9ilb n ASN 89 Ca -0.05 -1.95 -0.19 0.00 -0.03 0.00 0.00 54.58 52.36 9ilb n ASN 89 Cb 0.88 -0.08 -0.11 0.00 -0.61 0.00 0.00 39.78 39.86 9ilb n ASN 89 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 9ilb s TYR 90 N -1.84 1.52 0.95 3.10 1.51 -1.22 -4.16 117.35 117.20 9ilb s TYR 90 Ca 0.32 -0.52 -0.15 0.00 -1.01 0.00 0.00 57.07 55.71 9ilb s TYR 90 Cb 0.21 -0.79 0.19 0.00 -0.11 0.00 0.00 41.96 41.46 9ilb s TYR 90 CO 0.31 0.19 1.31 -1.25 -1.11 0.00 0.00 175.55 174.99 9ilb s PRO 91 N -2.57 0.73 0.06 -1.71 0.04 -1.26 -4.92 135.00 125.36 9ilb s PRO 91 Ca 0.09 -0.40 -0.03 0.00 0.04 0.00 0.00 61.00 60.70 9ilb s PRO 91 Cb -0.06 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.59 9ilb s PRO 91 CO 0.04 -2.35 0.04 -1.59 0.04 0.00 0.00 177.00 173.18 9ilb s LYS 92 N -5.86 0.64 0.29 4.56 -2.85 -1.26 -4.90 119.74 110.37 9ilb s LYS 92 Ca 0.73 -1.05 0.01 0.00 -1.00 0.00 0.00 55.97 54.66 9ilb s LYS 92 Cb -0.04 0.24 0.46 0.00 -2.06 0.00 0.00 37.83 36.42 9ilb s LYS 92 CO 0.53 -0.15 1.82 1.57 0.10 0.00 0.00 175.35 179.22 9ilb h LYS 93 N 3.22 0.70 -3.54 1.78 2.10 -1.92 -3.34 116.57 115.57 9ilb h LYS 93 Ca -0.34 -0.16 -0.74 0.00 -2.00 0.00 0.00 60.65 57.42 9ilb h LYS 93 Cb 1.17 -0.10 -0.32 0.00 -0.90 0.00 0.00 32.23 32.08 9ilb h LYS 93 CO 0.60 0.69 -0.05 0.21 -2.00 0.00 0.00 179.45 178.89 9ilb s LYS 94 N -5.04 3.28 0.45 0.07 2.47 -1.26 -0.77 119.74 118.94 9ilb s LYS 94 Ca -0.09 -2.86 -0.09 0.00 -1.56 0.00 0.00 55.97 51.37 9ilb s LYS 94 Cb 0.15 -4.08 -0.05 0.00 -1.46 0.00 0.00 37.83 32.38 9ilb s LYS 94 CO 0.79 -1.24 0.80 -1.64 0.16 0.00 0.00 175.35 174.22 9ilb s MET 95 N -0.61 3.69 0.53 4.03 -1.94 -1.25 -5.03 119.30 118.70 9ilb s MET 95 Ca 0.23 0.41 -0.20 0.00 -1.71 0.00 0.00 55.69 54.41 9ilb s MET 95 Cb -0.12 -2.35 -0.06 0.00 2.01 0.00 0.00 34.83 34.30 9ilb s MET 95 CO -0.08 -0.14 1.15 -1.21 -0.01 0.00 0.00 175.02 174.73 9ilb s GLU 96 N -4.26 3.41 0.41 2.03 8.01 -1.26 -4.91 118.70 122.13 9ilb s GLU 96 Ca 0.50 1.69 0.15 0.00 0.01 0.00 0.00 54.97 57.32 9ilb s GLU 96 Cb -0.10 -2.10 1.02 0.00 -4.31 0.00 0.00 34.13 28.63 9ilb s GLU 96 CO 0.38 -0.82 1.87 -0.22 0.01 0.00 0.00 175.26 176.48 9ilb h LYS 97 N 1.38 0.46 0.00 1.61 1.63 -1.96 -0.13 116.57 119.56 9ilb h LYS 97 Ca -0.50 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.27 9ilb h LYS 97 Cb 1.26 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.79 9ilb h LYS 97 CO 0.58 0.30 0.00 0.07 -3.45 0.00 0.00 179.45 176.95 9ilb h ARG 98 N 0.47 0.00 0.00 1.90 0.11 -1.91 -2.39 114.38 112.56 9ilb h ARG 98 Ca 0.45 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.53 9ilb h ARG 98 Cb 1.02 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.10 9ilb h ARG 98 CO -0.18 0.00 -0.61 1.19 0.10 0.00 0.00 179.97 180.47 9ilb n PHE 99 N -3.06 0.09 -3.14 4.08 3.72 -0.06 -0.63 117.46 118.45 9ilb n PHE 99 Ca -0.01 0.03 -0.39 0.00 -0.05 0.00 0.00 57.45 57.02 9ilb n PHE 99 Cb 0.20 -0.30 -0.06 0.00 -0.94 0.00 0.00 39.48 38.39 9ilb n PHE 99 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 9ilb s VAL 100 N -3.04 5.07 0.02 -4.37 1.01 -0.90 -4.38 120.40 113.80 9ilb s VAL 100 Ca 0.09 1.21 0.07 0.00 0.00 0.00 0.00 61.98 63.35 9ilb s VAL 100 Cb 0.17 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.57 9ilb s VAL 100 CO 0.73 0.20 -0.20 -0.36 0.00 0.00 0.00 175.10 175.47 9ilb s PHE 101 N 1.27 2.51 -0.34 5.22 0.40 0.28 -0.78 117.98 126.54 9ilb s PHE 101 Ca 0.31 -0.29 -0.19 0.00 -0.60 0.00 0.00 56.93 56.16 9ilb s PHE 101 Cb -0.16 -1.48 -0.01 0.00 0.51 0.00 0.00 43.02 41.88 9ilb s PHE 101 CO 0.13 0.18 0.54 -0.80 0.70 0.00 0.00 175.22 175.96 9ilb s ASN 102 N -1.16 6.36 -0.26 1.36 0.02 0.30 0.02 114.94 121.58 9ilb s ASN 102 Ca 0.13 0.09 -0.28 0.00 -1.02 0.00 0.00 52.86 51.78 9ilb s ASN 102 Cb -0.10 -2.28 0.01 0.00 0.02 0.00 0.00 41.25 38.89 9ilb s ASN 102 CO 0.03 -0.48 0.98 -0.75 0.02 0.00 0.00 177.10 176.90 9ilb s LYS 103 N 2.45 4.17 -0.19 -0.60 2.20 0.42 -2.05 119.74 126.14 9ilb s LYS 103 Ca 0.20 1.14 -0.03 0.00 -0.36 0.00 0.00 55.97 56.92 9ilb s LYS 103 Cb -0.15 -3.67 -0.01 0.00 -1.51 0.00 0.00 37.83 32.49 9ilb s LYS 103 CO 0.13 -0.68 -0.07 0.42 -0.36 0.00 0.00 175.35 174.80 9ilb s ILE 104 N 3.21 3.30 -0.45 5.43 1.01 -0.07 -0.89 121.20 132.74 9ilb s ILE 104 Ca 0.41 -0.53 -0.24 0.00 0.00 0.00 0.00 60.65 60.29 9ilb s ILE 104 Cb -0.14 -2.47 0.03 0.00 0.01 0.00 0.00 42.46 39.88 9ilb s ILE 104 CO 0.09 0.46 0.83 -1.61 0.00 0.00 0.00 174.94 174.71 9ilb s GLU 105 N 1.12 3.44 0.00 2.79 2.02 -0.53 -1.86 118.70 125.69 9ilb s GLU 105 Ca 0.01 -0.02 0.00 0.00 0.02 0.00 0.00 54.97 54.98 9ilb s GLU 105 Cb -0.15 -3.94 0.00 0.00 0.10 0.00 0.00 34.13 30.15 9ilb s GLU 105 CO -0.01 -1.16 0.00 0.44 0.02 0.00 0.00 175.26 174.55 9ilb n ILE 106 N 6.24 0.00 0.00 -1.63 -5.35 0.13 -4.97 119.36 113.78 9ilb n ILE 106 Ca 0.04 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.52 9ilb n ILE 106 Cb 0.48 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.38 9ilb n ILE 106 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 9ilb n ASN 107 N 0.00 0.00 -0.28 7.28 2.04 -1.26 -4.16 115.26 118.88 9ilb n ASN 107 Ca 0.00 0.00 0.01 0.00 -0.44 0.00 0.00 54.58 54.15 9ilb n ASN 107 Cb 0.00 0.00 0.02 0.00 -2.53 0.00 0.00 39.78 37.27 9ilb n ASN 107 CO 0.00 0.00 0.00 -0.46 -0.44 0.00 0.00 177.26 176.36 9ilb n ASN 108 N 0.00 0.40 -4.83 0.53 0.23 -1.26 -5.06 115.26 105.27 9ilb n ASN 108 Ca 0.00 -1.86 -0.21 0.00 -0.53 0.00 0.00 54.58 51.98 9ilb n ASN 108 Cb 0.00 -0.16 -0.04 0.00 -2.08 0.00 0.00 39.78 37.50 9ilb n ASN 108 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 9ilb s LYS 109 N -0.41 2.66 0.24 -3.83 -0.14 -1.26 -4.91 119.74 112.11 9ilb s LYS 109 Ca 0.04 -1.34 0.11 0.00 -1.36 0.00 0.00 55.97 53.41 9ilb s LYS 109 Cb 0.03 -2.42 -0.05 0.00 -1.68 0.00 0.00 37.83 33.71 9ilb s LYS 109 CO 0.00 0.09 -0.14 -0.51 -0.76 0.00 0.00 175.35 174.04 9ilb s LEU 110 N -3.97 2.80 0.00 3.17 1.43 0.22 0.20 118.68 122.52 9ilb s LEU 110 Ca 0.40 -0.82 -0.01 0.00 -1.03 0.00 0.00 54.13 52.68 9ilb s LEU 110 Cb -0.05 -1.38 -0.00 0.00 0.03 0.00 0.00 46.19 44.79 9ilb s LEU 110 CO 0.26 0.05 0.01 -1.61 0.23 0.00 0.00 176.35 175.29 9ilb s GLU 111 N -3.29 0.14 -0.26 1.70 2.02 -0.78 -1.29 118.70 116.94 9ilb s GLU 111 Ca 0.28 -0.19 0.02 0.00 0.02 0.00 0.00 54.97 55.10 9ilb s GLU 111 Cb -0.07 0.05 0.06 0.00 0.10 0.00 0.00 34.13 34.28 9ilb s GLU 111 CO 0.15 -0.02 -0.08 -0.06 0.02 0.00 0.00 175.26 175.27 9ilb s PHE 112 N -0.52 3.05 -0.10 1.61 0.08 -1.26 -0.89 117.98 119.95 9ilb s PHE 112 Ca -0.06 -2.22 -0.04 0.00 0.12 0.00 0.00 56.93 54.73 9ilb s PHE 112 Cb -0.04 -1.91 -0.04 0.00 -0.57 0.00 0.00 43.02 40.47 9ilb s PHE 112 CO -0.00 -0.86 0.07 -2.00 -0.10 0.00 0.00 175.22 172.34 9ilb s GLU 113 N 1.17 3.21 0.23 0.44 2.12 -0.87 -0.77 118.70 124.22 9ilb s GLU 113 Ca -0.06 -0.28 -0.30 0.00 0.36 0.00 0.00 54.97 54.69 9ilb s GLU 113 Cb -0.20 -2.99 -0.09 0.00 0.26 0.00 0.00 34.13 31.11 9ilb s GLU 113 CO -0.06 0.74 1.33 0.45 -0.54 0.00 0.00 175.26 177.18 9ilb s SER 114 N -1.02 6.84 0.16 -1.70 0.15 0.20 0.11 113.70 118.43 9ilb s SER 114 Ca 0.15 2.49 -0.05 0.00 0.70 0.00 0.00 55.95 59.24 9ilb s SER 114 Cb -0.12 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 9ilb s SER 114 CO 0.04 -0.56 1.40 0.00 1.20 0.00 0.00 173.24 175.33 9ilb h ALA 115 N 5.05 0.52 -0.43 5.45 0.00 -1.21 -3.27 119.26 125.37 9ilb h ALA 115 Ca -0.45 -0.60 -0.03 0.00 0.00 0.00 0.00 54.91 53.83 9ilb h ALA 115 Cb 1.22 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 9ilb h ALA 115 CO 0.76 0.73 0.14 0.37 0.00 0.00 0.00 179.25 181.26 9ilb h GLN 116 N 0.37 0.67 -3.94 0.00 5.75 -1.76 -3.38 115.11 112.82 9ilb h GLN 116 Ca -0.03 -0.14 -0.64 0.00 -0.15 0.00 0.00 58.65 57.69 9ilb h GLN 116 Cb 1.31 -0.10 -0.40 0.00 1.07 0.00 0.00 27.48 29.36 9ilb h GLN 116 CO 0.13 0.64 -0.70 -0.06 -2.65 0.00 0.00 178.83 176.19 9ilb s PHE 117 N -5.43 3.06 0.27 3.99 0.08 -1.23 -5.09 117.98 113.63 9ilb s PHE 117 Ca -0.13 -2.78 -0.29 0.00 0.12 0.00 0.00 56.93 53.84 9ilb s PHE 117 Cb 0.11 -2.58 -0.14 0.00 -0.57 0.00 0.00 43.02 39.84 9ilb s PHE 117 CO 0.77 -0.86 1.11 -2.30 -0.10 0.00 0.00 175.22 173.84 9ilb n PRO 118 N 3.94 1.48 -1.11 0.24 -0.02 -1.25 -1.57 135.00 136.70 9ilb n PRO 118 Ca 0.04 0.52 -0.04 0.00 -2.02 0.00 0.00 63.50 62.00 9ilb n PRO 118 Cb 0.38 -1.97 -0.02 0.00 -0.02 0.00 0.00 33.50 31.88 9ilb n PRO 118 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 9ilb n ASN 119 N 1.42 -4.25 -4.55 2.55 4.13 -1.26 -5.00 115.26 108.30 9ilb n ASN 119 Ca 0.10 0.10 -0.34 0.00 1.68 0.00 0.00 54.58 56.12 9ilb n ASN 119 Cb 0.31 -2.09 -0.11 0.00 -1.54 0.00 0.00 39.78 36.35 9ilb n ASN 119 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 9ilb s TRP 120 N -1.88 3.08 0.15 3.10 0.52 -0.61 -4.44 118.94 118.86 9ilb s TRP 120 Ca 0.00 -0.16 0.08 0.00 0.02 0.00 0.00 56.10 56.03 9ilb s TRP 120 Cb 0.00 -1.96 -0.04 0.00 -1.15 0.00 0.00 33.47 30.32 9ilb s TRP 120 CO 0.00 0.06 -0.17 0.71 0.02 0.00 0.00 176.95 177.58 9ilb s TYR 121 N 0.21 1.68 0.08 -1.98 2.02 -0.45 -0.63 117.35 118.28 9ilb s TYR 121 Ca -0.01 -0.50 -0.31 0.00 -0.37 0.00 0.00 57.07 55.88 9ilb s TYR 121 Cb -0.13 -0.85 -0.08 0.00 -0.40 0.00 0.00 41.96 40.50 9ilb s TYR 121 CO 0.02 0.26 1.44 0.42 -1.57 0.00 0.00 175.55 176.13 9ilb s ILE 122 N -2.09 3.32 0.13 2.71 1.01 0.05 -1.07 121.20 125.25 9ilb s ILE 122 Ca 0.13 0.88 0.02 0.00 0.00 0.00 0.00 60.65 61.68 9ilb s ILE 122 Cb -0.05 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 9ilb s ILE 122 CO 0.05 0.04 -0.03 -0.44 0.00 0.00 0.00 174.94 174.56 9ilb s SER 123 N 1.48 1.11 0.21 3.58 0.01 0.13 -4.59 113.70 115.63 9ilb s SER 123 Ca 0.66 -1.08 0.04 0.00 1.31 0.00 0.00 55.95 56.88 9ilb s SER 123 Cb -0.36 0.12 -0.05 0.00 0.21 0.00 0.00 66.02 65.93 9ilb s SER 123 CO 0.30 -0.52 -0.03 0.42 0.41 0.00 0.00 173.24 173.81 9ilb s THR 124 N -3.67 1.11 0.34 1.44 -4.23 -0.36 -0.86 115.64 109.41 9ilb s THR 124 Ca 0.17 -2.05 0.01 0.00 -1.18 0.00 0.00 61.69 58.64 9ilb s THR 124 Cb 0.06 -2.22 -0.03 0.00 1.34 0.00 0.00 72.50 71.65 9ilb s THR 124 CO -0.01 -0.43 0.54 -0.55 -0.54 0.00 0.00 174.62 173.62 9ilb s SER 125 N -3.28 6.27 0.29 3.99 0.15 -1.26 -0.89 113.70 118.97 9ilb s SER 125 Ca 0.25 0.40 0.06 0.00 0.70 0.00 0.00 55.95 57.36 9ilb s SER 125 Cb 0.05 -1.98 0.44 0.00 -1.71 0.00 0.00 66.02 62.82 9ilb s SER 125 CO 0.07 -0.30 1.70 1.56 1.20 0.00 0.00 173.24 177.47 9ilb h GLN 126 N 0.77 0.28 -7.15 5.44 1.08 -1.97 -3.45 115.11 110.11 9ilb h GLN 126 Ca -0.50 -0.13 -0.50 0.00 -1.45 0.00 0.00 58.65 56.08 9ilb h GLN 126 Cb 1.22 -0.00 0.07 0.00 -0.05 0.00 0.00 27.48 28.72 9ilb h GLN 126 CO 0.61 0.63 0.39 0.00 -0.95 0.00 0.00 178.83 179.52 9ilb s ALA 127 N -4.20 2.66 0.34 3.87 0.00 -1.26 -5.03 121.76 118.14 9ilb s ALA 127 Ca -0.05 0.59 -0.26 0.00 0.00 0.00 0.00 51.96 52.24 9ilb s ALA 127 Cb 0.13 -3.30 -0.10 0.00 0.00 0.00 0.00 23.12 19.86 9ilb s ALA 127 CO 0.78 -0.87 0.99 -2.00 0.00 0.00 0.00 175.76 174.65 9ilb s GLU 128 N -3.74 4.48 -1.37 0.00 2.56 -1.26 -4.06 118.70 115.30 9ilb s GLU 128 Ca 0.68 1.43 0.00 0.00 0.00 0.00 0.00 54.97 57.08 9ilb s GLU 128 Cb -0.20 -2.77 0.00 0.00 2.00 0.00 0.00 34.13 33.16 9ilb s GLU 128 CO 0.33 0.16 0.00 -1.71 -0.56 0.00 0.00 175.26 173.48 9ilb n ASN 129 N 0.46 -4.53 -4.95 -1.70 5.15 -0.06 -5.00 115.26 104.63 9ilb n ASN 129 Ca 0.02 0.24 -0.23 0.00 -0.60 0.00 0.00 54.58 54.02 9ilb n ASN 129 Cb 0.49 -3.35 -0.01 0.00 -0.53 0.00 0.00 39.78 36.38 9ilb n ASN 129 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 9ilb s MET 130 N -3.56 3.34 0.49 1.20 -1.94 -1.24 -4.76 119.30 112.83 9ilb s MET 130 Ca 0.00 -0.50 -0.21 0.00 -1.71 0.00 0.00 55.69 53.27 9ilb s MET 130 Cb 0.00 -2.69 -0.08 0.00 2.01 0.00 0.00 34.83 34.08 9ilb s MET 130 CO 0.00 0.08 1.09 -2.14 -0.01 0.00 0.00 175.02 174.04 9ilb s PRO 131 N -4.31 3.70 0.24 2.03 0.02 -1.26 -0.16 135.00 135.26 9ilb s PRO 131 Ca 0.42 1.52 -0.30 0.00 0.02 0.00 0.00 61.00 62.66 9ilb s PRO 131 Cb -0.10 -2.17 -0.09 0.00 0.02 0.00 0.00 34.50 32.17 9ilb s PRO 131 CO 0.35 -0.54 1.05 0.08 -0.33 0.00 0.00 177.00 177.61 9ilb s VAL 132 N -1.81 3.77 0.30 3.83 1.01 0.39 -4.67 120.40 123.23 9ilb s VAL 132 Ca 0.67 1.71 -0.02 0.00 0.00 0.00 0.00 61.98 64.34 9ilb s VAL 132 Cb -0.21 -4.09 -0.01 0.00 0.00 0.00 0.00 36.38 32.07 9ilb s VAL 132 CO 0.25 0.38 0.38 0.72 0.00 0.00 0.00 175.10 176.83 9ilb s PHE 133 N -0.90 1.10 -0.41 5.22 -0.71 -0.04 -4.83 117.98 117.42 9ilb s PHE 133 Ca 0.45 -1.29 -0.17 0.00 -1.04 0.00 0.00 56.93 54.88 9ilb s PHE 133 Cb -0.29 -0.24 0.01 0.00 -1.21 0.00 0.00 43.02 41.30 9ilb s PHE 133 CO 0.37 -0.98 0.43 -1.17 -1.34 0.00 0.00 175.22 172.53 9ilb s LEU 134 N -3.21 4.76 -0.10 -1.99 2.96 -1.26 0.20 118.68 120.04 9ilb s LEU 134 Ca 0.33 -0.57 -0.02 0.00 -0.22 0.00 0.00 54.13 53.65 9ilb s LEU 134 Cb 0.01 -2.40 -0.03 0.00 0.50 0.00 0.00 46.19 44.27 9ilb s LEU 134 CO 0.18 -0.54 -0.00 -0.83 -1.32 0.00 0.00 176.35 173.84 9ilb s GLY 135 N 1.80 1.83 0.00 7.98 0.00 -0.23 -4.85 107.32 113.85 9ilb s GLY 135 Ca 0.13 -0.81 0.15 0.00 0.00 0.00 0.00 44.72 44.19 9ilb s GLY 135 CO 0.13 -0.47 1.39 0.61 0.00 0.00 0.00 173.10 174.76 9ilb n GLY 136 N 2.41 0.49 3.04 0.20 0.00 -1.26 -1.34 105.19 108.73 9ilb n GLY 136 Ca -0.18 -0.40 -0.18 0.00 0.00 0.00 0.00 46.02 45.26 9ilb n GLY 136 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 9ilb s THR 137 N -1.64 0.73 0.33 2.61 -4.23 -1.26 -4.80 115.64 107.38 9ilb s THR 137 Ca 0.28 -0.53 0.07 0.00 -1.18 0.00 0.00 61.69 60.32 9ilb s THR 137 Cb 0.15 -0.64 -0.02 0.00 1.34 0.00 0.00 72.50 73.33 9ilb s THR 137 CO 0.21 0.11 0.40 -0.54 -0.54 0.00 0.00 174.62 174.25 9ilb s LYS 138 N -0.48 2.97 -0.47 3.99 1.02 -1.26 -4.76 119.74 120.75 9ilb s LYS 138 Ca 0.02 -1.12 -0.38 0.00 0.02 0.00 0.00 55.97 54.51 9ilb s LYS 138 Cb -0.05 -2.69 0.06 0.00 -0.52 0.00 0.00 37.83 34.63 9ilb s LYS 138 CO -0.00 0.08 0.67 0.41 -0.92 0.00 0.00 175.35 175.59 9ilb n GLY 139 N -1.53 0.13 0.00 -3.33 0.00 -1.26 -4.94 105.19 94.26 9ilb n GLY 139 Ca -0.01 1.15 0.00 0.00 0.00 0.00 0.00 46.02 47.16 9ilb n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 9ilb n GLY 140 N -0.24 3.55 0.30 -0.02 0.00 -1.26 -5.02 105.19 102.49 9ilb n GLY 140 Ca -0.10 -0.58 -0.05 0.00 0.00 0.00 0.00 46.02 45.29 9ilb n GLY 140 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 9ilb h GLN 141 N 0.00 0.89 -6.88 1.61 7.50 -1.95 -3.44 115.11 112.85 9ilb h GLN 141 Ca 0.00 -0.23 -0.48 0.00 0.50 0.00 0.00 58.65 58.44 9ilb h GLN 141 Cb 0.00 -0.11 -0.01 0.00 0.05 0.00 0.00 27.48 27.41 9ilb h GLN 141 CO 0.00 0.86 0.18 -0.51 -1.50 0.00 0.00 178.83 177.86 9ilb s ASP 142 N -6.60 6.72 -0.20 1.46 1.01 -1.26 -4.47 116.67 113.33 9ilb s ASP 142 Ca -0.10 1.36 -0.16 0.00 0.71 0.00 0.00 52.55 54.36 9ilb s ASP 142 Cb 0.15 -2.41 -0.04 0.00 1.01 0.00 0.00 42.92 41.63 9ilb s ASP 142 CO 0.82 -0.33 0.39 -0.63 0.21 0.00 0.00 175.17 175.64 9ilb s ILE 143 N -2.20 5.20 -0.34 0.77 1.01 -0.07 -4.74 121.20 120.84 9ilb s ILE 143 Ca 0.55 0.70 0.05 0.00 0.00 0.00 0.00 60.65 61.96 9ilb s ILE 143 Cb -0.10 -3.73 -0.03 0.00 0.01 0.00 0.00 42.46 38.61 9ilb s ILE 143 CO 0.22 0.26 0.32 0.35 0.00 0.00 0.00 174.94 176.08 9ilb n THR 144 N 4.29 0.00 -4.24 2.92 -2.24 -1.26 -1.22 114.28 112.53 9ilb n THR 144 Ca -0.08 -0.41 -0.27 0.00 -2.27 0.00 0.00 64.05 61.01 9ilb n THR 144 Cb 0.51 1.03 -0.09 0.00 -2.10 0.00 0.00 70.33 69.68 9ilb n THR 144 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 9ilb s ASP 145 N -1.25 4.48 0.29 3.42 1.47 -1.26 -4.41 116.67 119.42 9ilb s ASP 145 Ca 0.03 -0.46 0.01 0.00 1.18 0.00 0.00 52.55 53.31 9ilb s ASP 145 Cb 0.04 -0.86 -0.02 0.00 -0.34 0.00 0.00 42.92 41.74 9ilb s ASP 145 CO 0.17 0.12 0.30 -0.36 0.68 0.00 0.00 175.17 176.08 9ilb s PHE 146 N -1.59 1.33 0.14 2.11 0.40 -0.41 -1.26 117.98 118.70 9ilb s PHE 146 Ca 0.25 -1.43 0.06 0.00 -0.60 0.00 0.00 56.93 55.21 9ilb s PHE 146 Cb -0.10 -0.46 -0.04 0.00 0.51 0.00 0.00 43.02 42.94 9ilb s PHE 146 CO 0.16 -0.88 -0.14 0.95 0.70 0.00 0.00 175.22 176.01 9ilb s THR 147 N -3.60 1.40 0.11 0.64 -4.23 0.82 -0.61 115.64 110.17 9ilb s THR 147 Ca 0.37 -1.85 0.10 0.00 -1.18 0.00 0.00 61.69 59.12 9ilb s THR 147 Cb 0.03 -1.67 -0.04 0.00 1.34 0.00 0.00 72.50 72.16 9ilb s THR 147 CO 0.20 -0.48 -0.24 -0.32 -0.54 0.00 0.00 174.62 173.24 9ilb s MET 148 N -2.97 1.32 -0.05 3.99 1.75 -1.26 -0.90 119.30 121.18 9ilb s MET 148 Ca 0.12 -1.24 0.03 0.00 -1.25 0.00 0.00 55.69 53.35 9ilb s MET 148 Cb -0.03 -1.69 0.01 0.00 2.84 0.00 0.00 34.83 35.96 9ilb s MET 148 CO 0.03 0.40 -0.12 -0.65 -0.65 0.00 0.00 175.02 174.04 9ilb s GLN 149 N -1.89 1.47 0.41 4.11 1.11 0.06 -4.95 119.66 119.98 9ilb s GLN 149 Ca 0.11 -0.40 -0.22 0.00 0.01 0.00 0.00 55.36 54.86 9ilb s GLN 149 Cb -0.10 -1.27 -0.11 0.00 -1.01 0.00 0.00 33.01 30.53 9ilb s GLN 149 CO 0.05 0.08 0.96 -0.06 0.01 0.00 0.00 175.29 176.32 9ilb s PHE 150 N 0.46 3.37 0.03 0.91 0.40 -1.26 -0.37 117.98 121.52 9ilb s PHE 150 Ca -0.10 1.64 0.04 0.00 -0.60 0.00 0.00 56.93 57.92 9ilb s PHE 150 Cb -0.13 -2.88 -0.02 0.00 0.51 0.00 0.00 43.02 40.49 9ilb s PHE 150 CO 0.02 -0.10 -0.13 0.14 0.70 0.00 0.00 175.22 175.86 9ilb s VAL 151 N -2.04 1.00 0.61 -0.44 -7.23 -1.02 -4.88 120.40 106.40 9ilb s VAL 151 Ca 0.60 -0.93 0.19 0.00 -1.81 0.00 0.00 61.98 60.03 9ilb s VAL 151 Cb -0.12 -0.92 0.19 0.00 0.56 0.00 0.00 36.38 36.10 9ilb s VAL 151 CO 0.16 -0.01 1.56 0.77 -0.31 0.00 0.00 175.10 177.27 9ilb h SER 152 N 5.01 0.00 0.00 4.85 4.64 -1.97 -3.41 113.55 122.67 9ilb h SER 152 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 9ilb h SER 152 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 9ilb h SER 152 CO 0.44 0.00 0.00 -0.24 -0.87 0.00 0.00 176.83 176.16