#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y2i s PHE 3 N 0.00 1.82 -0.05 3.69 0.40 -1.26 -0.66 117.98 121.92 1y2i s PHE 3 Ca 0.00 -0.60 -0.04 0.00 -0.60 0.00 0.00 56.93 55.68 1y2i s PHE 3 Cb 0.00 -1.24 0.01 0.00 0.51 0.00 0.00 43.02 42.30 1y2i s PHE 3 CO 0.00 -0.24 0.12 0.45 0.70 0.00 0.00 175.22 176.26 1y2i s SER 4 N 0.24 -0.13 0.00 1.36 0.15 -0.33 -4.99 113.70 110.01 1y2i s SER 4 Ca -0.09 0.25 0.25 0.00 0.70 0.00 0.00 55.95 57.06 1y2i s SER 4 Cb -0.14 0.25 1.14 0.00 -1.71 0.00 0.00 66.02 65.56 1y2i s SER 4 CO 0.04 -0.04 1.83 0.35 1.20 0.00 0.00 173.24 176.61 1y2i n THR 5 N 3.01 0.24 -3.13 6.45 -2.24 -1.26 -1.33 114.28 116.01 1y2i n THR 5 Ca -0.12 0.06 -0.34 0.00 -2.27 0.00 0.00 64.05 61.38 1y2i n THR 5 Cb 0.59 -0.63 -0.06 0.00 -2.10 0.00 0.00 70.33 68.13 1y2i n THR 5 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1y2i s THR 6 N -2.89 4.65 -0.22 4.28 -4.23 -1.26 -4.06 115.64 111.91 1y2i s THR 6 Ca 0.15 1.05 0.28 0.00 -1.18 0.00 0.00 61.69 61.99 1y2i s THR 6 Cb 0.17 -3.70 0.36 0.00 1.34 0.00 0.00 72.50 70.67 1y2i s THR 6 CO 0.44 -0.04 1.79 1.55 -0.54 0.00 0.00 174.62 177.82 1y2i h PRO 7 N 2.67 0.00 -4.69 3.99 0.13 -1.92 -0.08 132.00 132.11 1y2i h PRO 7 Ca -0.48 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.41 1y2i h PRO 7 Cb 1.18 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.16 1y2i h PRO 7 CO 0.65 0.00 -0.67 0.95 -0.23 0.00 0.00 178.00 178.70 1y2i s THR 8 N -3.41 0.61 -0.28 1.56 -4.23 -1.26 -4.68 115.64 103.95 1y2i s THR 8 Ca 0.04 -1.95 0.03 0.00 -1.18 0.00 0.00 61.69 58.64 1y2i s THR 8 Cb 0.07 -1.92 0.07 0.00 1.34 0.00 0.00 72.50 72.06 1y2i s THR 8 CO 0.60 -0.64 -0.07 -0.76 -0.54 0.00 0.00 174.62 173.20 1y2i s LEU 9 N -3.10 3.71 0.45 4.79 1.43 -1.26 -5.04 118.68 119.66 1y2i s LEU 9 Ca 0.19 -1.56 -0.23 0.00 -1.03 0.00 0.00 54.13 51.49 1y2i s LEU 9 Cb 0.06 -1.55 -0.10 0.00 0.03 0.00 0.00 46.19 44.63 1y2i s LEU 9 CO -0.00 -0.24 0.98 -0.62 0.23 0.00 0.00 176.35 176.70 1y2i n GLU 10 N 4.40 1.24 0.00 1.70 1.02 -1.26 -1.37 120.64 126.38 1y2i n GLU 10 Ca -0.10 0.45 0.00 0.00 -0.02 0.00 0.00 57.16 57.49 1y2i n GLU 10 Cb 0.42 -2.04 0.00 0.00 -0.02 0.00 0.00 31.44 29.80 1y2i n GLU 10 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1y2i n GLY 11 N 1.23 2.65 3.32 0.62 0.00 -1.26 -5.01 105.19 106.74 1y2i n GLY 11 Ca 0.10 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.95 1y2i n GLY 11 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y2i s LEU 12 N 0.00 2.38 0.04 0.99 1.43 -0.47 -1.76 118.68 121.30 1y2i s LEU 12 Ca 0.00 -1.13 0.07 0.00 -1.03 0.00 0.00 54.13 52.04 1y2i s LEU 12 Cb 0.00 -0.39 -0.02 0.00 0.03 0.00 0.00 46.19 45.81 1y2i s LEU 12 CO 0.00 -0.39 -0.20 0.28 0.23 0.00 0.00 176.35 176.27 1y2i s THR 13 N -3.29 1.57 -0.10 5.49 -1.32 -0.61 -4.69 115.64 112.69 1y2i s THR 13 Ca 0.24 -1.16 -0.27 0.00 -1.21 0.00 0.00 61.69 59.30 1y2i s THR 13 Cb 0.04 -1.37 -0.02 0.00 -1.51 0.00 0.00 72.50 69.63 1y2i s THR 13 CO 0.06 0.17 0.86 -0.63 -2.21 0.00 0.00 174.62 172.87 1y2i s ILE 14 N -0.80 4.90 -0.47 5.08 1.01 -1.26 -1.36 121.20 128.30 1y2i s ILE 14 Ca 0.06 1.75 0.17 0.00 0.00 0.00 0.00 60.65 62.62 1y2i s ILE 14 Cb -0.09 -4.18 -0.21 0.00 0.01 0.00 0.00 42.46 37.99 1y2i s ILE 14 CO 0.02 0.11 0.57 1.33 0.00 0.00 0.00 174.94 176.96 1y2i n VAL 15 N 4.28 0.00 -3.73 2.92 0.24 -0.31 -4.95 118.33 116.77 1y2i n VAL 15 Ca 0.04 -0.22 -0.13 0.00 -2.04 0.00 0.00 64.34 61.99 1y2i n VAL 15 Cb 0.50 0.65 -0.11 0.00 -1.47 0.00 0.00 33.84 33.41 1y2i n VAL 15 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1y2i s GLU 16 N -2.80 0.42 -0.28 7.34 2.12 -1.19 -4.98 118.70 119.33 1y2i s GLU 16 Ca 0.01 0.57 -0.10 0.00 0.36 0.00 0.00 54.97 55.81 1y2i s GLU 16 Cb 0.12 0.15 -0.04 0.00 0.26 0.00 0.00 34.13 34.62 1y2i s GLU 16 CO 0.68 -0.08 0.16 0.71 -0.54 0.00 0.00 175.26 176.20 1y2i s TYR 17 N 0.48 3.19 -1.22 5.30 1.51 -1.26 -1.46 117.35 123.88 1y2i s TYR 17 Ca -0.02 -0.07 0.17 0.00 -1.01 0.00 0.00 57.07 56.14 1y2i s TYR 17 Cb -0.04 -2.35 0.57 0.00 -0.11 0.00 0.00 41.96 40.03 1y2i s TYR 17 CO -0.02 -0.24 1.49 0.00 -1.11 0.00 0.00 175.55 175.67 1y2i n GLY 19 N 0.96 1.84 3.71 0.00 0.00 -1.24 -4.80 105.19 105.66 1y2i n GLY 19 Ca 0.21 -2.00 -0.42 0.00 0.00 0.00 0.00 46.02 43.81 1y2i n GLY 19 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y2i s VAL 20 N -2.29 4.01 0.25 1.61 1.01 -1.26 -0.86 120.40 122.87 1y2i s VAL 20 Ca 0.00 1.43 0.11 0.00 0.00 0.00 0.00 61.98 63.52 1y2i s VAL 20 Cb 0.00 -3.92 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 1y2i s VAL 20 CO 0.00 0.09 -0.17 0.68 0.00 0.00 0.00 175.10 175.71 1y2i s VAL 21 N 1.25 2.67 0.05 2.92 -7.23 0.02 -4.91 120.40 115.17 1y2i s VAL 21 Ca 0.59 -2.20 0.01 0.00 -1.81 0.00 0.00 61.98 58.56 1y2i s VAL 21 Cb -0.29 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.24 1y2i s VAL 21 CO 0.28 -0.32 -0.05 0.42 -0.31 0.00 0.00 175.10 175.12 1y2i s THR 22 N -2.26 0.36 0.08 5.32 -4.23 -1.26 -1.67 115.64 111.98 1y2i s THR 22 Ca 0.28 -1.46 0.01 0.00 -1.18 0.00 0.00 61.69 59.34 1y2i s THR 22 Cb -0.06 -1.05 -0.04 0.00 1.34 0.00 0.00 72.50 72.69 1y2i s THR 22 CO 0.15 -0.72 -0.06 -0.83 -0.54 0.00 0.00 174.62 172.62 1y2i s GLY 23 N -2.31 0.65 0.28 3.99 0.00 0.07 -3.93 107.32 106.07 1y2i s GLY 23 Ca -0.01 -1.19 -0.09 0.00 0.00 0.00 0.00 44.72 43.43 1y2i s GLY 23 CO -0.04 -1.29 0.46 -1.83 0.00 0.00 0.00 173.10 170.40 1y2i s GLU 24 N -3.35 1.66 -0.08 2.90 1.03 -1.26 0.39 118.70 120.00 1y2i s GLU 24 Ca 0.06 -1.46 -0.15 0.00 0.03 0.00 0.00 54.97 53.45 1y2i s GLU 24 Cb 0.02 0.45 0.03 0.00 -0.80 0.00 0.00 34.13 33.84 1y2i s GLU 24 CO -0.05 -0.69 0.37 0.00 -1.33 0.00 0.00 175.26 173.57 1y2i s ALA 25 N -3.64 -0.93 -0.11 -0.84 0.00 -0.68 -4.27 121.76 111.29 1y2i s ALA 25 Ca 0.26 0.74 0.02 0.00 0.00 0.00 0.00 51.96 52.99 1y2i s ALA 25 Cb -0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 23.12 22.85 1y2i s ALA 25 CO 0.13 -0.23 -0.19 0.42 0.00 0.00 0.00 175.76 175.88 1y2i s ILE 26 N -0.60 2.47 -0.26 0.00 1.01 -1.26 -1.07 121.20 121.48 1y2i s ILE 26 Ca -0.07 -0.87 -0.16 0.00 0.00 0.00 0.00 60.65 59.54 1y2i s ILE 26 Cb -0.04 -1.99 -0.03 0.00 0.01 0.00 0.00 42.46 40.41 1y2i s ILE 26 CO 0.03 0.54 0.44 -0.76 0.00 0.00 0.00 174.94 175.19 1y2i s LEU 27 N 0.36 4.06 0.91 2.97 1.02 -0.39 -4.99 118.68 122.61 1y2i s LEU 27 Ca -0.15 0.42 -0.12 0.00 0.02 0.00 0.00 54.13 54.30 1y2i s LEU 27 Cb -0.17 -2.54 0.13 0.00 0.02 0.00 0.00 46.19 43.63 1y2i s LEU 27 CO 0.07 -0.22 1.09 -0.83 0.02 0.00 0.00 176.35 176.49 1y2i s GLY 28 N 1.53 1.61 0.58 -3.19 0.00 -1.26 -2.22 107.32 104.37 1y2i s GLY 28 Ca 0.18 -0.12 0.27 0.00 0.00 0.00 0.00 44.72 45.05 1y2i s GLY 28 CO 0.09 0.39 2.17 0.00 0.00 0.00 0.00 173.10 175.75 1y2i h ALA 29 N -1.58 1.76 -0.40 3.20 0.00 -1.98 -2.00 119.26 118.26 1y2i h ALA 29 Ca -0.50 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.35 1y2i h ALA 29 Cb 1.29 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 1y2i h ALA 29 CO 0.55 -0.14 0.02 -2.95 0.00 0.00 0.00 179.25 176.72 1y2i h ASN 30 N 0.00 0.68 -0.42 0.00 -1.07 -1.92 0.20 115.58 113.06 1y2i h ASN 30 Ca 0.05 -0.30 0.01 0.00 0.07 0.00 0.00 56.30 56.12 1y2i h ASN 30 Cb 0.24 -0.18 -0.02 0.00 -2.07 0.00 0.00 38.32 36.28 1y2i h ASN 30 CO -0.00 0.81 0.27 0.40 0.07 0.00 0.00 177.43 178.98 1y2i h ILE 31 N 0.53 1.10 -0.60 6.14 1.08 -1.74 -0.68 117.51 123.35 1y2i h ILE 31 Ca 0.12 -0.19 0.01 0.00 -0.39 0.00 0.00 64.86 64.40 1y2i h ILE 31 Cb 0.45 0.50 -0.03 0.00 -3.07 0.00 0.00 36.82 34.67 1y2i h ILE 31 CO 0.02 0.10 0.40 0.15 -0.69 0.00 0.00 178.15 178.13 1y2i h PHE 32 N 0.56 0.75 -0.39 1.37 3.57 -1.15 -0.82 116.94 120.83 1y2i h PHE 32 Ca 0.15 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.68 1y2i h PHE 32 Cb -0.06 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.40 1y2i h PHE 32 CO -0.05 0.47 0.24 -0.09 -2.23 0.00 0.00 178.31 176.66 1y2i h ARG 33 N 0.81 0.48 -0.14 1.11 2.43 -0.46 -0.74 114.38 117.87 1y2i h ARG 33 Ca 0.22 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 59.24 1y2i h ARG 33 Cb -0.09 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.36 1y2i h ARG 33 CO -0.05 0.32 -0.41 -0.44 -1.51 0.00 0.00 179.97 177.88 1y2i h ASP 34 N 0.49 0.61 0.00 -3.80 3.32 -0.74 -3.37 116.42 112.93 1y2i h ASP 34 Ca 0.15 -0.59 0.00 0.00 0.02 0.00 0.00 57.03 56.61 1y2i h ASP 34 Cb -0.03 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.34 1y2i h ASP 34 CO -0.05 1.09 -1.08 0.49 -1.72 0.00 0.00 179.24 177.96 1y2i n PHE 35 N -4.29 0.00 -0.08 4.55 3.01 -0.35 -4.81 117.46 115.50 1y2i n PHE 35 Ca -0.07 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.27 1y2i n PHE 35 Cb 0.54 -0.10 -0.07 0.00 -0.01 0.00 0.00 39.48 39.84 1y2i n PHE 35 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1y2i n PHE 36 N -1.60 0.00 -0.09 1.38 3.01 -0.71 -3.35 117.46 116.10 1y2i n PHE 36 Ca -0.01 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.43 1y2i n PHE 36 Cb 0.13 -0.58 0.22 0.00 -0.01 0.00 0.00 39.48 39.24 1y2i n PHE 36 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1y2i h ALA 37 N -0.15 1.26 0.00 4.37 0.00 -1.33 -2.85 119.26 120.56 1y2i h ALA 37 Ca -0.36 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1y2i h ALA 37 Cb 1.48 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1y2i h ALA 37 CO -0.10 0.51 0.00 0.41 0.00 0.00 0.00 179.25 180.06 1y2i n GLY 38 N -0.88 -0.96 3.70 0.00 0.00 -1.26 -4.91 105.19 100.89 1y2i n GLY 38 Ca 0.03 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 1y2i n GLY 38 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1y2i n ILE 39 N -0.64 0.19 -4.29 -0.61 5.41 -1.08 -5.00 119.36 113.34 1y2i n ILE 39 Ca 0.06 -0.03 -0.29 0.00 1.00 0.00 0.00 62.75 63.49 1y2i n ILE 39 Cb 0.03 -2.00 -0.11 0.00 -0.71 0.00 0.00 39.64 36.85 1y2i n ILE 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1y2i s ARG 40 N 1.98 1.83 2.80 0.38 1.70 -1.26 -5.05 118.95 121.34 1y2i s ARG 40 Ca 0.79 -1.16 0.00 0.00 -0.47 0.00 0.00 55.73 54.89 1y2i s ARG 40 Cb -0.52 -2.14 0.00 0.00 -0.57 0.00 0.00 34.95 31.72 1y2i s ARG 40 CO 0.36 0.48 0.00 -0.25 -1.08 0.00 0.00 175.30 174.81 1y2i n ASP 41 N 0.77 -0.47 -4.52 -2.89 8.00 -1.26 -4.55 116.55 111.63 1y2i n ASP 41 Ca -0.15 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 54.99 1y2i n ASP 41 Cb 0.53 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.51 1y2i n ASP 41 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1y2i s ILE 42 N 0.00 4.41 -0.19 0.53 1.01 -1.26 -5.08 121.20 120.62 1y2i s ILE 42 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.50 1y2i s ILE 42 Cb 0.00 -3.02 0.05 0.00 0.01 0.00 0.00 42.46 39.50 1y2i s ILE 42 CO 0.00 0.40 -0.07 -0.69 0.00 0.00 0.00 174.94 174.58 1y2i s VAL 43 N 1.00 1.40 0.70 2.92 1.01 -1.26 -5.12 120.40 121.05 1y2i s VAL 43 Ca 0.03 -0.90 -0.06 0.00 0.00 0.00 0.00 61.98 61.05 1y2i s VAL 43 Cb -0.14 -1.56 0.07 0.00 0.00 0.00 0.00 36.38 34.75 1y2i s VAL 43 CO 0.03 0.09 1.01 -0.83 0.00 0.00 0.00 175.10 175.39 1y2i s GLY 44 N 1.49 1.70 0.42 4.51 0.00 -1.26 -4.86 107.32 109.33 1y2i s GLY 44 Ca -0.01 -0.99 0.11 0.00 0.00 0.00 0.00 44.72 43.83 1y2i s GLY 44 CO -0.08 -0.58 2.00 -1.33 0.00 0.00 0.00 173.10 173.12 1y2i h GLY 45 N -0.58 0.59 0.51 0.20 0.00 -2.00 -2.83 103.07 98.97 1y2i h GLY 45 Ca -0.44 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 46.71 1y2i h GLY 45 CO 0.58 0.14 -0.37 3.21 0.00 0.00 0.00 176.54 180.10 1y2i h ARG 46 N 0.47 -0.69 0.12 4.80 3.08 -2.01 -3.31 114.38 116.84 1y2i h ARG 46 Ca 0.24 0.05 -0.28 0.00 0.07 0.00 0.00 59.98 60.06 1y2i h ARG 46 Cb 0.34 0.16 0.01 0.00 0.08 0.00 0.00 29.97 30.56 1y2i h ARG 46 CO -0.06 -0.46 -1.21 0.77 -1.07 0.00 0.00 179.97 177.94 1y2i h SER 47 N -0.71 0.61 -3.82 7.04 0.02 -1.90 -3.48 113.55 111.30 1y2i h SER 47 Ca -0.01 -0.59 -0.48 0.00 -0.84 0.00 0.00 61.79 59.87 1y2i h SER 47 Cb 0.67 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 1y2i h SER 47 CO -0.12 1.43 0.29 -0.83 -1.14 0.00 0.00 176.83 176.45 1y2i s GLY 48 N -4.55 2.72 0.31 -3.77 0.00 -1.09 -5.00 107.32 95.95 1y2i s GLY 48 Ca -0.06 0.42 -0.00 0.00 0.00 0.00 0.00 44.72 45.08 1y2i s GLY 48 CO 0.90 0.83 1.96 0.00 0.00 0.00 0.00 173.10 176.79 1y2i h ALA 49 N 3.13 1.42 -0.18 3.20 0.00 -1.91 -3.13 119.26 121.79 1y2i h ALA 49 Ca -0.47 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.41 1y2i h ALA 49 Cb 1.19 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1y2i h ALA 49 CO 0.65 0.50 0.17 0.10 0.00 0.00 0.00 179.25 180.67 1y2i h TYR 50 N 0.97 0.00 -0.66 0.00 -0.00 -1.94 -3.22 116.97 112.12 1y2i h TYR 50 Ca 0.26 0.00 -0.07 0.00 0.00 0.00 0.00 58.73 58.92 1y2i h TYR 50 Cb -0.05 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 36.66 1y2i h TYR 50 CO 0.00 0.00 0.14 1.49 -0.00 0.00 0.00 178.16 179.80 1y2i h GLU 51 N 0.00 1.06 -0.95 0.10 4.57 -1.83 -0.95 114.58 116.57 1y2i h GLU 51 Ca 0.08 -0.25 0.20 0.00 -1.18 0.00 0.00 59.36 58.21 1y2i h GLU 51 Cb 0.42 -0.14 -0.11 0.00 -0.16 0.00 0.00 28.75 28.76 1y2i h GLU 51 CO -0.00 0.95 0.53 -0.22 -1.18 0.00 0.00 179.01 179.08 1y2i h LYS 52 N 1.00 0.60 0.03 1.92 3.64 -1.78 -1.78 116.57 120.19 1y2i h LYS 52 Ca 0.21 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1y2i h LYS 52 Cb 0.38 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1y2i h LYS 52 CO 0.00 0.39 -0.01 0.93 -2.27 0.00 0.00 179.45 178.50 1y2i h GLU 53 N 0.61 -0.04 -0.39 1.90 4.39 -1.39 -1.97 114.58 117.70 1y2i h GLU 53 Ca 0.57 0.00 0.07 0.00 0.34 0.00 0.00 59.36 60.35 1y2i h GLU 53 Cb 0.97 0.01 -0.09 0.00 -0.10 0.00 0.00 28.75 29.54 1y2i h GLU 53 CO -0.43 0.63 -0.38 -0.07 -1.16 0.00 0.00 179.01 177.59 1y2i h LEU 54 N -0.77 -1.27 -0.57 1.33 3.38 -1.39 0.19 115.31 116.21 1y2i h LEU 54 Ca -0.00 0.20 0.11 0.00 0.09 0.00 0.00 57.88 58.28 1y2i h LEU 54 Cb 0.68 0.57 -0.08 0.00 0.09 0.00 0.00 40.66 41.92 1y2i h LEU 54 CO 0.01 -0.35 0.10 -0.09 0.09 0.00 0.00 178.44 178.20 1y2i h ARG 55 N -0.30 0.23 -0.53 1.13 2.43 -1.37 0.14 114.38 116.09 1y2i h ARG 55 Ca 0.15 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.24 1y2i h ARG 55 Cb 0.57 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 1y2i h ARG 55 CO -0.55 0.15 0.04 -0.22 -1.51 0.00 0.00 179.97 177.88 1y2i h LYS 56 N 0.23 0.87 -0.36 0.20 3.64 -0.76 -1.46 116.57 118.93 1y2i h LYS 56 Ca 0.30 -0.23 -0.04 0.00 -1.27 0.00 0.00 60.65 59.41 1y2i h LYS 56 Cb 0.44 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 1y2i h LYS 56 CO -0.40 0.84 0.06 0.00 -2.27 0.00 0.00 179.45 177.69 1y2i h ALA 57 N 1.22 0.48 -0.02 5.00 0.00 0.09 -2.36 119.26 123.68 1y2i h ALA 57 Ca 0.16 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1y2i h ALA 57 Cb 0.43 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1y2i h ALA 57 CO 0.02 0.19 -0.11 0.00 0.00 0.00 0.00 179.25 179.34 1y2i h ARG 58 N 0.44 -0.17 -0.53 0.00 3.08 -0.51 -1.94 114.38 114.74 1y2i h ARG 58 Ca 0.11 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.22 1y2i h ARG 58 Cb 0.36 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.40 1y2i h ARG 58 CO 0.01 -0.12 0.27 1.49 -1.07 0.00 0.00 179.97 180.55 1y2i h GLU 59 N -0.18 0.50 -0.59 0.04 4.81 -1.25 0.27 114.58 118.19 1y2i h GLU 59 Ca 0.05 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1y2i h GLU 59 Cb 0.25 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 1y2i h GLU 59 CO -0.13 0.33 0.37 0.82 -0.73 0.00 0.00 179.01 179.67 1y2i h ILE 60 N 0.52 1.10 -0.49 2.32 2.04 -1.33 0.87 117.51 122.54 1y2i h ILE 60 Ca 0.24 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 1y2i h ILE 60 Cb 0.15 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 1y2i h ILE 60 CO -0.17 0.14 0.28 0.00 0.00 0.00 0.00 178.15 178.40 1y2i h ALA 61 N 1.24 0.63 -0.60 1.87 0.00 -0.66 -1.45 119.26 120.28 1y2i h ALA 61 Ca 0.23 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1y2i h ALA 61 Cb -0.02 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1y2i h ALA 61 CO -0.08 0.14 0.12 0.74 0.00 0.00 0.00 179.25 180.17 1y2i h PHE 62 N 0.65 1.00 -0.28 0.00 -1.00 -0.72 -1.30 116.94 115.29 1y2i h PHE 62 Ca 0.17 -0.12 0.02 0.00 2.81 0.00 0.00 57.97 60.86 1y2i h PHE 62 Cb 0.03 -0.28 -0.03 0.00 3.61 0.00 0.00 35.95 39.28 1y2i h PHE 62 CO -0.02 0.84 0.12 1.49 -1.61 0.00 0.00 178.31 179.13 1y2i h GLU 63 N 0.91 0.25 -0.84 1.51 4.22 -0.54 0.38 114.58 120.47 1y2i h GLU 63 Ca 0.19 -0.02 -0.03 0.00 0.08 0.00 0.00 59.36 59.59 1y2i h GLU 63 Cb 0.37 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.52 1y2i h GLU 63 CO 0.01 0.17 0.43 1.49 -2.18 0.00 0.00 179.01 178.92 1y2i h GLU 64 N 0.26 1.20 -0.35 1.92 4.81 -1.04 0.11 114.58 121.49 1y2i h GLU 64 Ca 0.12 -0.16 -0.13 0.00 -0.13 0.00 0.00 59.36 59.05 1y2i h GLU 64 Cb 0.07 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 1y2i h GLU 64 CO -0.11 0.91 -0.32 1.25 -0.73 0.00 0.00 179.01 180.02 1y2i h LEU 65 N 1.19 0.79 -0.25 1.64 5.85 -0.88 -1.94 115.31 121.71 1y2i h LEU 65 Ca 0.29 -0.33 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 1y2i h LEU 65 Cb 0.09 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 1y2i h LEU 65 CO -0.04 1.05 0.05 1.23 -0.34 0.00 0.00 178.44 180.39 1y2i h GLY 66 N 0.94 0.45 1.00 3.75 0.00 0.35 -1.96 103.07 107.60 1y2i h GLY 66 Ca 0.07 -0.29 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 1y2i h GLY 66 CO 0.07 0.27 0.39 1.48 0.00 0.00 0.00 176.54 178.76 1y2i h SER 67 N 0.23 0.77 -0.46 0.19 4.64 -0.74 -0.07 113.55 118.11 1y2i h SER 67 Ca 0.08 -0.06 0.05 0.00 -0.47 0.00 0.00 61.79 61.39 1y2i h SER 67 Cb 0.31 -0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 62.17 1y2i h SER 67 CO 0.00 0.60 0.21 1.56 -0.87 0.00 0.00 176.83 178.34 1y2i h GLN 68 N 0.87 0.41 0.10 4.77 4.20 -1.26 -0.20 115.11 124.00 1y2i h GLN 68 Ca 0.23 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.91 1y2i h GLN 68 Cb -0.03 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.66 1y2i h GLN 68 CO -0.04 0.27 -0.05 0.00 -0.67 0.00 0.00 178.83 178.34 1y2i h ALA 69 N 1.26 -0.13 -0.57 3.87 0.00 -1.00 -2.67 119.26 120.02 1y2i h ALA 69 Ca 0.21 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1y2i h ALA 69 Cb 0.14 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1y2i h ALA 69 CO -0.16 -0.50 0.34 -0.09 0.00 0.00 0.00 179.25 178.83 1y2i h ARG 70 N -0.27 0.78 -0.56 0.00 2.43 -0.85 0.09 114.38 115.99 1y2i h ARG 70 Ca -0.01 -0.07 0.14 0.00 -0.81 0.00 0.00 59.98 59.23 1y2i h ARG 70 Cb 0.22 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 1y2i h ARG 70 CO 0.02 0.57 0.40 0.00 -1.51 0.00 0.00 179.97 179.44 1y2i h ALA 71 N 1.17 2.36 -0.00 2.80 0.00 -1.03 -1.44 119.26 123.12 1y2i h ALA 71 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1y2i h ALA 71 Cb -0.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1y2i h ALA 71 CO -0.04 -0.52 -0.07 1.28 0.00 0.00 0.00 179.25 179.90 1y2i n LEU 72 N -4.41 0.46 0.00 0.00 4.77 -0.04 -4.89 117.00 112.89 1y2i n LEU 72 Ca 0.10 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1y2i n LEU 72 Cb 0.55 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 1y2i n LEU 72 CO 0.36 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1y2i n GLY 73 N 1.23 0.70 3.87 -0.72 0.00 -0.54 -5.04 105.19 104.69 1y2i n GLY 73 Ca 0.16 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1y2i n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y2i s ALA 74 N -2.00 3.23 0.00 4.61 0.00 -0.86 -4.82 121.76 121.92 1y2i s ALA 74 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 51.82 1y2i s ALA 74 Cb 0.00 -2.88 0.00 0.00 0.00 0.00 0.00 23.12 20.24 1y2i s ALA 74 CO 0.00 -0.29 0.41 -0.40 0.00 0.00 0.00 175.76 175.48 1y2i n ASP 75 N -1.90 0.82 -3.85 0.00 5.75 -0.26 -4.34 116.55 112.77 1y2i n ASP 75 Ca 0.04 -0.95 -0.10 0.00 -0.01 0.00 0.00 54.79 53.77 1y2i n ASP 75 Cb 0.54 0.09 -0.08 0.00 -1.03 0.00 0.00 41.12 40.64 1y2i n ASP 75 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1y2i s ALA 76 N -0.09 -0.31 -0.16 2.12 0.00 -0.78 -3.22 121.76 119.31 1y2i s ALA 76 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 51.96 51.57 1y2i s ALA 76 Cb 0.00 0.34 0.03 0.00 0.00 0.00 0.00 23.12 23.49 1y2i s ALA 76 CO 0.00 -0.41 -0.11 0.08 0.00 0.00 0.00 175.76 175.32 1y2i s VAL 77 N -2.97 1.46 0.33 0.00 1.01 0.17 -1.01 120.40 119.40 1y2i s VAL 77 Ca -0.02 -0.70 0.09 0.00 0.00 0.00 0.00 61.98 61.35 1y2i s VAL 77 Cb 0.01 -1.47 -0.05 0.00 0.00 0.00 0.00 36.38 34.87 1y2i s VAL 77 CO -0.06 0.32 -0.01 0.68 0.00 0.00 0.00 175.10 176.03 1y2i s VAL 78 N 1.51 2.66 -1.17 2.92 -7.23 -0.71 -1.19 120.40 117.19 1y2i s VAL 78 Ca 0.03 -2.01 -0.03 0.00 -1.81 0.00 0.00 61.98 58.16 1y2i s VAL 78 Cb -0.14 -2.76 0.00 0.00 0.56 0.00 0.00 36.38 34.04 1y2i s VAL 78 CO -0.09 -0.22 0.99 0.61 -0.31 0.00 0.00 175.10 176.08 1y2i n GLY 79 N -0.92 -0.35 3.77 2.32 0.00 -0.05 -0.55 105.19 109.40 1y2i n GLY 79 Ca -0.04 0.11 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 1y2i n GLY 79 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y2i s ILE 80 N -3.32 4.20 -0.02 -0.61 1.01 -0.44 -4.38 121.20 117.64 1y2i s ILE 80 Ca 0.22 1.89 0.03 0.00 0.00 0.00 0.00 60.65 62.78 1y2i s ILE 80 Cb -0.09 -4.19 0.00 0.00 0.01 0.00 0.00 42.46 38.18 1y2i s ILE 80 CO 0.67 0.42 -0.09 -0.62 0.00 0.00 0.00 174.94 175.32 1y2i s ASP 81 N -1.29 1.22 -0.15 3.58 2.15 0.19 -4.49 116.67 117.88 1y2i s ASP 81 Ca 0.42 -0.19 -0.01 0.00 0.43 0.00 0.00 52.55 53.20 1y2i s ASP 81 Cb -0.23 -0.30 -0.01 0.00 -0.30 0.00 0.00 42.92 42.08 1y2i s ASP 81 CO 0.28 0.08 -0.12 -0.63 -0.17 0.00 0.00 175.17 174.60 1y2i s ILE 82 N 0.13 3.00 0.14 4.11 1.01 -1.26 -1.19 121.20 127.13 1y2i s ILE 82 Ca -0.02 -0.67 0.10 0.00 0.00 0.00 0.00 60.65 60.07 1y2i s ILE 82 Cb -0.08 -2.28 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 1y2i s ILE 82 CO 0.00 0.51 -0.24 -1.81 0.00 0.00 0.00 174.94 173.40 1y2i s ASP 83 N 0.62 3.15 -0.10 3.58 1.01 1.00 -4.98 116.67 120.94 1y2i s ASP 83 Ca -0.07 -0.77 0.04 0.00 0.71 0.00 0.00 52.55 52.45 1y2i s ASP 83 Cb -0.15 -0.21 0.00 0.00 1.01 0.00 0.00 42.92 43.57 1y2i s ASP 83 CO 0.03 0.13 -0.23 -0.31 0.21 0.00 0.00 175.17 175.00 1y2i s TYR 84 N -1.30 2.46 -0.08 4.23 1.51 -1.26 -0.74 117.35 122.17 1y2i s TYR 84 Ca 0.14 -1.03 0.00 0.00 -1.01 0.00 0.00 57.07 55.18 1y2i s TYR 84 Cb -0.09 -1.65 0.02 0.00 -0.11 0.00 0.00 41.96 40.13 1y2i s TYR 84 CO 0.07 -0.43 -0.06 -1.21 -1.11 0.00 0.00 175.55 172.81 1y2i s GLU 85 N 0.43 1.13 0.17 -0.62 8.01 -1.26 -5.03 118.70 121.53 1y2i s GLU 85 Ca -0.17 -0.15 -0.28 0.00 0.01 0.00 0.00 54.97 54.38 1y2i s GLU 85 Cb -0.17 -1.19 -0.08 0.00 -4.31 0.00 0.00 34.13 28.38 1y2i s GLU 85 CO 0.07 -0.17 0.88 0.95 0.01 0.00 0.00 175.26 177.00 1y2i s THR 86 N 1.38 4.30 0.20 3.63 -4.23 -1.26 -4.42 115.64 115.24 1y2i s THR 86 Ca -0.03 1.93 0.01 0.00 -1.18 0.00 0.00 61.69 62.43 1y2i s THR 86 Cb -0.13 -4.25 -0.05 0.00 1.34 0.00 0.00 72.50 69.40 1y2i s THR 86 CO -0.03 0.46 0.04 0.68 -0.54 0.00 0.00 174.62 175.23 1y2i s VAL 87 N -0.82 0.56 0.00 2.29 -7.23 -1.26 -4.99 120.40 108.95 1y2i s VAL 87 Ca 0.40 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.59 1y2i s VAL 87 Cb -0.24 -2.30 0.00 0.00 0.56 0.00 0.00 36.38 34.40 1y2i s VAL 87 CO 0.29 -0.30 0.00 0.61 -0.31 0.00 0.00 175.10 175.39 1y2i n GLY 88 N -0.30 -0.73 0.25 2.32 0.00 -1.26 -3.70 105.19 101.77 1y2i n GLY 88 Ca -0.04 -1.65 -0.06 0.00 0.00 0.00 0.00 46.02 44.27 1y2i n GLY 88 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1y2i h GLN 89 N 0.00 -0.16 -0.30 1.61 4.20 -2.02 -2.18 115.11 116.26 1y2i h GLN 89 Ca 0.00 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1y2i h GLN 89 Cb 0.00 0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.82 1y2i h GLN 89 CO 0.00 -0.10 0.00 0.09 -0.67 0.00 0.00 178.83 178.15 1y2i n ASN 90 N -5.37 1.67 -2.66 1.46 5.03 -1.26 -4.87 115.26 109.25 1y2i n ASN 90 Ca 0.01 -1.97 -0.16 0.00 0.87 0.00 0.00 54.58 53.33 1y2i n ASN 90 Cb 0.28 -0.20 -0.00 0.00 -1.02 0.00 0.00 39.78 38.84 1y2i n ASN 90 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1y2i n GLY 91 N 1.01 -0.50 2.73 7.41 0.00 -0.82 -5.11 105.19 109.91 1y2i n GLY 91 Ca 0.11 0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 1y2i n GLY 91 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1y2i n SER 92 N -1.99 4.85 -0.83 1.61 7.64 -1.24 -4.77 113.62 118.88 1y2i n SER 92 Ca -0.13 -3.58 0.00 0.00 1.01 0.00 0.00 58.87 56.17 1y2i n SER 92 Cb 0.61 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 1y2i n SER 92 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1y2i n LEU 94 N 0.33 0.00 -3.55 -3.43 0.00 -0.94 -3.45 117.00 105.96 1y2i n LEU 94 Ca 0.32 0.00 -0.00 0.00 0.00 0.00 0.00 56.01 56.33 1y2i n LEU 94 Cb 0.37 0.00 -0.04 0.00 0.00 0.00 0.00 43.42 43.75 1y2i n LEU 94 CO 0.43 0.00 0.41 -0.69 0.00 0.00 0.00 177.39 177.54 1y2i s VAL 96 N -2.27 -0.76 -0.09 1.96 1.01 -0.23 -1.26 120.40 118.75 1y2i s VAL 96 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 61.98 62.02 1y2i s VAL 96 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.38 1y2i s VAL 96 CO 0.00 0.00 -0.23 -0.55 0.00 0.00 0.00 175.10 174.32 1y2i s SER 97 N 2.67 2.93 0.06 3.32 0.15 0.08 -1.69 113.70 121.21 1y2i s SER 97 Ca -0.05 -0.53 0.09 0.00 0.70 0.00 0.00 55.95 56.17 1y2i s SER 97 Cb -0.09 -1.30 -0.03 0.00 -1.71 0.00 0.00 66.02 62.88 1y2i s SER 97 CO -0.18 0.15 -0.25 -0.69 1.20 0.00 0.00 173.24 173.46 1y2i s VAL 98 N 0.35 2.07 0.03 4.45 1.01 0.16 -0.00 120.40 128.47 1y2i s VAL 98 Ca -0.18 -1.41 -0.05 0.00 0.00 0.00 0.00 61.98 60.35 1y2i s VAL 98 Cb -0.17 -1.78 -0.01 0.00 0.00 0.00 0.00 36.38 34.41 1y2i s VAL 98 CO 0.08 0.30 0.08 -0.94 0.00 0.00 0.00 175.10 174.62 1y2i s SER 99 N -1.34 0.18 0.10 3.32 1.04 -0.34 -0.75 113.70 115.91 1y2i s SER 99 Ca 0.11 -0.51 -0.12 0.00 0.48 0.00 0.00 55.95 55.91 1y2i s SER 99 Cb -0.10 0.21 0.04 0.00 0.10 0.00 0.00 66.02 66.27 1y2i s SER 99 CO 0.03 -0.47 0.56 0.61 0.98 0.00 0.00 173.24 174.94 1y2i n GLY 100 N 0.92 0.93 3.27 7.32 0.00 -0.67 -0.63 105.19 116.33 1y2i n GLY 100 Ca -0.20 -1.05 -0.35 0.00 0.00 0.00 0.00 46.02 44.43 1y2i n GLY 100 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y2i s THR 101 N -2.30 3.12 0.18 2.61 2.01 0.28 -0.80 115.64 120.75 1y2i s THR 101 Ca 0.12 -0.59 -0.30 0.00 0.31 0.00 0.00 61.69 61.23 1y2i s THR 101 Cb -0.02 -2.41 -0.08 0.00 0.01 0.00 0.00 72.50 70.00 1y2i s THR 101 CO 0.03 0.43 1.19 0.00 -0.69 0.00 0.00 174.62 175.58 1y2i s ALA 102 N 1.44 3.43 0.02 7.40 0.00 -0.04 -1.74 121.76 132.27 1y2i s ALA 102 Ca 0.05 0.94 -0.04 0.00 0.00 0.00 0.00 51.96 52.91 1y2i s ALA 102 Cb -0.14 -3.41 -0.01 0.00 0.00 0.00 0.00 23.12 19.56 1y2i s ALA 102 CO -0.05 -0.36 0.06 0.14 0.00 0.00 0.00 175.76 175.55 1y2i s VAL 103 N -0.04 0.12 -0.16 0.00 -7.23 -0.18 0.08 120.40 112.99 1y2i s VAL 103 Ca 0.53 -0.96 -0.11 0.00 -1.81 0.00 0.00 61.98 59.62 1y2i s VAL 103 Cb -0.32 -0.61 -0.05 0.00 0.56 0.00 0.00 36.38 35.96 1y2i s VAL 103 CO 0.36 -0.53 0.20 -0.54 -0.31 0.00 0.00 175.10 174.28 1y2i s LYS 104 N -1.99 4.07 0.15 4.82 1.02 -0.54 -1.11 119.74 126.16 1y2i s LYS 104 Ca -0.10 -0.08 0.07 0.00 0.02 0.00 0.00 55.97 55.88 1y2i s LYS 104 Cb -0.05 -3.37 -0.04 0.00 -0.52 0.00 0.00 37.83 33.85 1y2i s LYS 104 CO -0.02 0.38 -0.02 0.95 -0.92 0.00 0.00 175.35 175.73 1y2i s THR 105 N 0.08 3.71 -0.04 2.17 -4.23 -1.26 -1.16 115.64 114.91 1y2i s THR 105 Ca 0.13 -1.33 0.01 0.00 -1.18 0.00 0.00 61.69 59.32 1y2i s THR 105 Cb -0.12 -2.83 0.02 0.00 1.34 0.00 0.00 72.50 70.91 1y2i s THR 105 CO 0.02 -0.04 -0.03 -0.60 -0.54 0.00 0.00 174.62 173.43 1y2i s ARG 106 N -2.72 0.66 0.42 3.99 6.06 -0.46 -4.87 118.95 122.02 1y2i s ARG 106 Ca 0.26 -0.05 -0.26 0.00 -2.50 0.00 0.00 55.73 53.19 1y2i s ARG 106 Cb -0.10 -0.72 -0.10 0.00 0.06 0.00 0.00 34.95 34.09 1y2i s ARG 106 CO 0.18 -0.10 1.31 -2.13 -2.50 0.00 0.00 175.30 172.06 1y2i n ARG 107 N 4.08 2.04 0.25 5.12 0.00 -1.26 -1.57 116.66 125.32 1y2i n ARG 107 Ca -0.25 0.73 0.12 0.00 -0.00 0.00 0.00 57.85 58.45 1y2i n ARG 107 Cb 0.51 -2.44 0.61 0.00 0.00 0.00 0.00 32.46 31.14 1y2i n ARG 107 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.63 176.72 1y2i h ASN 108 N 2.21 0.00 -0.01 6.15 -0.26 -1.68 -3.46 115.58 118.53 1y2i h ASN 108 Ca -0.48 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.26 1y2i h ASN 108 Cb 1.29 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.55 1y2i h ASN 108 CO 0.61 0.15 0.00 -0.38 -1.06 0.00 0.00 177.43 176.75