#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 2.93 0.00 3.69 2.99 -1.26 -1.08 117.98 125.25 1y2i s PHE 3 Ca 0.00 -0.46 -0.01 0.00 0.00 0.00 0.00 56.93 56.46 1y2i s PHE 3 Cb 0.00 -1.91 -0.01 0.00 0.00 0.00 0.00 43.02 41.11 1y2i s PHE 3 CO 0.00 -0.12 0.01 0.45 -0.00 0.00 0.00 175.22 175.56 1y2i s SER 4 N 0.36 0.07 0.00 1.36 0.15 -0.15 -4.99 113.70 110.50 1y2i s SER 4 Ca -0.07 -0.16 0.30 0.00 0.70 0.00 0.00 55.95 56.72 1y2i s SER 4 Cb -0.15 0.07 1.39 0.00 -1.71 0.00 0.00 66.02 65.62 1y2i s SER 4 CO 0.04 -0.13 1.95 0.35 1.20 0.00 0.00 173.24 176.65 1y2i n THR 5 N 2.47 0.00 -3.01 6.45 -2.24 -1.26 -1.07 114.28 115.62 1y2i n THR 5 Ca -0.17 -0.08 -0.33 0.00 -2.27 0.00 0.00 64.05 61.21 1y2i n THR 5 Cb 0.58 -0.12 -0.06 0.00 -2.10 0.00 0.00 70.33 68.63 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 -2.27 4.55 0.06 4.28 -4.23 -1.26 -4.18 115.64 112.59 1y2i s THR 6 Ca 0.35 1.19 0.11 0.00 -1.18 0.00 0.00 61.69 62.17 1y2i s THR 6 Cb 0.21 -3.64 -0.06 0.00 1.34 0.00 0.00 72.50 70.35 1y2i s THR 6 CO 0.42 -0.20 1.42 1.55 -0.54 0.00 0.00 174.62 177.28 1y2i h PRO 7 N 2.23 0.00 -5.47 3.99 0.13 -1.92 0.30 132.00 131.26 1y2i h PRO 7 Ca -0.48 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.10 1y2i h PRO 7 Cb 1.18 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.17 1y2i h PRO 7 CO 0.64 0.73 -0.62 0.95 -0.23 0.00 0.00 178.00 179.47 1y2i s THR 8 N -3.00 1.63 -0.32 1.56 -4.23 -1.26 -4.60 115.64 105.42 1y2i s THR 8 Ca 0.02 -2.03 0.02 0.00 -1.18 0.00 0.00 61.69 58.52 1y2i s THR 8 Cb 0.10 -2.83 0.10 0.00 1.34 0.00 0.00 72.50 71.20 1y2i s THR 8 CO 0.77 -0.05 0.06 -0.76 -0.54 0.00 0.00 174.62 174.11 1y2i s LEU 9 N -3.58 3.75 0.21 4.79 1.43 -1.26 -5.03 118.68 118.99 1y2i s LEU 9 Ca 0.35 -1.92 -0.32 0.00 -1.03 0.00 0.00 54.13 51.21 1y2i s LEU 9 Cb 0.08 -1.34 -0.15 0.00 0.03 0.00 0.00 46.19 44.82 1y2i s LEU 9 CO 0.16 -0.38 1.21 -0.62 0.23 0.00 0.00 176.35 176.94 1y2i n GLU 10 N 4.48 1.43 0.00 1.70 1.02 -1.26 -0.81 120.64 127.21 1y2i n GLU 10 Ca 0.01 0.51 0.00 0.00 -0.02 0.00 0.00 57.16 57.66 1y2i n GLU 10 Cb 0.42 -2.03 0.00 0.00 -0.02 0.00 0.00 31.44 29.81 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 1.93 1.90 3.42 0.62 0.00 -1.26 -5.02 105.19 106.78 1y2i n GLY 11 Ca 0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.94 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 2.57 -0.07 0.99 1.43 0.01 -1.72 118.68 121.89 1y2i s LEU 12 Ca 0.00 -1.08 0.04 0.00 -1.03 0.00 0.00 54.13 52.06 1y2i s LEU 12 Cb 0.00 -0.82 0.00 0.00 0.03 0.00 0.00 46.19 45.40 1y2i s LEU 12 CO 0.00 -0.15 -0.20 -0.89 0.23 0.00 0.00 176.35 175.34 1y2i s THR 13 N -2.82 1.68 -0.26 5.49 2.01 -0.28 -4.68 115.64 116.78 1y2i s THR 13 Ca 0.27 -0.82 -0.29 0.00 0.31 0.00 0.00 61.69 61.16 1y2i s THR 13 Cb -0.01 -1.46 -0.00 0.00 0.01 0.00 0.00 72.50 71.04 1y2i s THR 13 CO 0.11 0.48 1.33 -0.63 -0.69 0.00 0.00 174.62 175.21 1y2i s ILE 14 N 0.25 4.12 -0.11 1.82 1.01 -1.26 0.26 121.20 127.28 1y2i s ILE 14 Ca -0.11 1.28 0.21 0.00 0.00 0.00 0.00 60.65 62.04 1y2i s ILE 14 Cb -0.15 -4.07 -0.22 0.00 0.01 0.00 0.00 42.46 38.03 1y2i s ILE 14 CO 0.05 -0.39 0.64 1.33 0.00 0.00 0.00 174.94 176.58 1y2i n VAL 15 N 6.06 0.39 -3.76 2.92 0.24 0.43 -4.94 118.33 119.67 1y2i n VAL 15 Ca 0.15 -0.56 -0.13 0.00 -2.04 0.00 0.00 64.34 61.76 1y2i n VAL 15 Cb 0.46 -0.20 -0.10 0.00 -1.47 0.00 0.00 33.84 32.53 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 -3.34 0.50 -0.21 7.34 2.12 -1.17 -4.99 118.70 118.95 1y2i s GLU 16 Ca -0.06 0.21 -0.08 0.00 0.36 0.00 0.00 54.97 55.40 1y2i s GLU 16 Cb 0.12 0.23 -0.04 0.00 0.26 0.00 0.00 34.13 34.70 1y2i s GLU 16 CO 0.86 -0.10 0.08 0.71 -0.54 0.00 0.00 175.26 176.27 1y2i s TYR 17 N -0.41 3.22 -0.16 5.30 1.51 -1.26 -1.45 117.35 124.10 1y2i s TYR 17 Ca -0.05 -0.01 0.17 0.00 -1.01 0.00 0.00 57.07 56.17 1y2i s TYR 17 Cb -0.04 -2.15 0.39 0.00 -0.11 0.00 0.00 41.96 40.05 1y2i s TYR 17 CO 0.02 0.02 1.26 0.00 -1.11 0.00 0.00 175.55 175.74 1y2i n GLY 19 N -1.10 1.68 3.72 0.00 0.00 -1.25 -4.75 105.19 103.49 1y2i n GLY 19 Ca 0.19 -1.94 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 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 -2.48 4.87 0.18 1.61 1.01 -1.26 -1.12 120.40 123.21 1y2i s VAL 20 Ca 0.00 1.83 0.10 0.00 0.00 0.00 0.00 61.98 63.91 1y2i s VAL 20 Cb 0.00 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 1y2i s VAL 20 CO 0.00 0.23 -0.16 0.68 0.00 0.00 0.00 175.10 175.85 1y2i s VAL 21 N 0.71 2.85 0.07 2.92 -7.23 0.50 -4.92 120.40 115.31 1y2i s VAL 21 Ca 0.46 -1.79 0.01 0.00 -1.81 0.00 0.00 61.98 58.85 1y2i s VAL 21 Cb -0.20 -2.39 -0.04 0.00 0.56 0.00 0.00 36.38 34.31 1y2i s VAL 21 CO 0.25 -0.10 -0.06 0.42 -0.31 0.00 0.00 175.10 175.30 1y2i s THR 22 N -1.65 0.57 0.08 5.32 -4.23 -1.26 -1.40 115.64 113.06 1y2i s THR 22 Ca 0.23 -1.62 -0.12 0.00 -1.18 0.00 0.00 61.69 59.01 1y2i s THR 22 Cb -0.09 -1.28 0.01 0.00 1.34 0.00 0.00 72.50 72.49 1y2i s THR 22 CO 0.13 -0.72 0.26 -0.83 -0.54 0.00 0.00 174.62 172.92 1y2i s GLY 23 N -2.52 -0.05 0.05 3.99 0.00 0.68 -3.89 107.32 105.59 1y2i s GLY 23 Ca 0.03 -0.30 -0.27 0.00 0.00 0.00 0.00 44.72 44.18 1y2i s GLY 23 CO -0.04 -0.51 0.80 -1.83 0.00 0.00 0.00 173.10 171.52 1y2i s GLU 24 N -3.38 0.99 0.02 2.90 1.03 -1.26 0.05 118.70 119.05 1y2i s GLU 24 Ca 0.01 -0.38 -0.06 0.00 0.03 0.00 0.00 54.97 54.57 1y2i s GLU 24 Cb 0.02 0.45 -0.00 0.00 -0.80 0.00 0.00 34.13 33.79 1y2i s GLU 24 CO -0.09 -0.43 0.12 0.00 -1.33 0.00 0.00 175.26 173.53 1y2i s ALA 25 N -3.33 -0.21 -0.11 -0.84 0.00 -0.71 -4.33 121.76 112.24 1y2i s ALA 25 Ca 0.04 -0.32 0.03 0.00 0.00 0.00 0.00 51.96 51.71 1y2i s ALA 25 Cb -0.01 0.17 -0.01 0.00 0.00 0.00 0.00 23.12 23.28 1y2i s ALA 25 CO -0.10 -0.25 -0.20 0.42 0.00 0.00 0.00 175.76 175.63 1y2i s ILE 26 N -1.89 2.40 -0.25 0.00 1.01 -1.26 -1.29 121.20 119.92 1y2i s ILE 26 Ca -0.11 -0.90 -0.17 0.00 0.00 0.00 0.00 60.65 59.48 1y2i s ILE 26 Cb -0.05 -1.95 -0.03 0.00 0.01 0.00 0.00 42.46 40.43 1y2i s ILE 26 CO -0.01 0.55 0.45 -0.76 0.00 0.00 0.00 174.94 175.17 1y2i s LEU 27 N 0.33 4.07 0.74 2.97 1.02 0.63 -4.99 118.68 123.46 1y2i s LEU 27 Ca -0.16 0.46 -0.11 0.00 0.02 0.00 0.00 54.13 54.34 1y2i s LEU 27 Cb -0.17 -2.57 0.04 0.00 0.02 0.00 0.00 46.19 43.51 1y2i s LEU 27 CO 0.08 -0.21 1.09 -0.83 0.02 0.00 0.00 176.35 176.50 1y2i s GLY 28 N 1.44 1.63 0.41 -3.19 0.00 -1.26 -2.27 107.32 104.09 1y2i s GLY 28 Ca 0.19 -0.19 0.14 0.00 0.00 0.00 0.00 44.72 44.86 1y2i s GLY 28 CO 0.09 0.19 1.91 0.00 0.00 0.00 0.00 173.10 175.29 1y2i h ALA 29 N -0.84 2.06 -0.81 3.20 0.00 -1.99 -1.96 119.26 118.91 1y2i h ALA 29 Ca -0.46 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 1y2i h ALA 29 Cb 1.25 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 1y2i h ALA 29 CO 0.60 -0.26 0.36 -2.95 0.00 0.00 0.00 179.25 177.01 1y2i h ASN 30 N 0.47 1.08 -0.31 0.00 -0.00 -1.93 0.17 115.58 115.06 1y2i h ASN 30 Ca 0.38 -0.14 -0.06 0.00 -0.00 0.00 0.00 56.30 56.47 1y2i h ASN 30 Cb 0.80 -0.28 -0.01 0.00 -0.00 0.00 0.00 38.32 38.83 1y2i h ASN 30 CO -0.13 0.93 -0.03 0.40 -0.00 0.00 0.00 177.43 178.60 1y2i h ILE 31 N 1.17 1.27 0.31 6.14 1.08 -1.73 -0.87 117.51 124.87 1y2i h ILE 31 Ca 0.28 -1.03 0.00 0.00 -0.39 0.00 0.00 64.86 63.72 1y2i h ILE 31 Cb 0.16 1.31 -0.02 0.00 -3.07 0.00 0.00 36.82 35.19 1y2i h ILE 31 CO -0.03 0.33 -0.31 0.15 -0.69 0.00 0.00 178.15 177.60 1y2i h PHE 32 N 0.36 -0.84 -0.69 1.37 3.57 -1.10 -0.22 116.94 119.39 1y2i h PHE 32 Ca 0.08 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.71 1y2i h PHE 32 Cb 0.50 0.33 -0.08 0.00 2.79 0.00 0.00 35.95 39.48 1y2i h PHE 32 CO 0.04 -0.45 0.28 0.00 -2.23 0.00 0.00 178.31 175.95 1y2i h ARG 33 N -0.65 0.44 0.00 1.11 3.08 -0.67 0.10 114.38 117.79 1y2i h ARG 33 Ca -0.02 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1y2i h ARG 33 Cb 0.60 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.55 1y2i h ARG 33 CO -0.06 0.29 0.00 -0.44 -1.07 0.00 0.00 179.97 178.69 1y2i h ASP 34 N 0.45 0.00 0.00 7.04 3.32 -0.74 -3.35 116.42 123.14 1y2i h ASP 34 Ca 0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.41 1y2i h ASP 34 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1y2i h ASP 34 CO -0.35 0.00 -0.58 0.49 -1.72 0.00 0.00 179.24 177.08 1y2i n PHE 35 N -3.10 0.00 -0.09 4.55 3.01 -0.13 -4.91 117.46 116.79 1y2i n PHE 35 Ca 0.03 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.36 1y2i n PHE 35 Cb 0.48 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.86 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 -1.25 0.00 0.22 1.38 3.01 -0.08 -4.25 117.46 116.49 1y2i n PHE 36 Ca 0.00 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.52 1y2i n PHE 36 Cb 0.22 -0.72 0.52 0.00 -0.01 0.00 0.00 39.48 39.49 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 -0.01 1.63 -0.02 4.37 0.00 -1.42 -2.70 119.26 121.11 1y2i h ALA 37 Ca -0.42 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1y2i h ALA 37 Cb 1.64 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1y2i h ALA 37 CO -0.07 0.24 0.00 0.41 0.00 0.00 0.00 179.25 179.83 1y2i n GLY 38 N -0.94 -0.60 3.75 0.00 0.00 -1.26 -4.95 105.19 101.19 1y2i n GLY 38 Ca -0.02 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 1y2i n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y2i s ILE 39 N -1.99 2.73 0.07 -0.61 1.01 -1.02 -5.00 121.20 116.40 1y2i s ILE 39 Ca 0.42 0.66 0.09 0.00 0.00 0.00 0.00 60.65 61.81 1y2i s ILE 39 Cb 0.20 -3.42 -0.03 0.00 0.01 0.00 0.00 42.46 39.22 1y2i s ILE 39 CO 0.33 0.12 -0.24 -0.13 0.00 0.00 0.00 174.94 175.02 1y2i s ARG 40 N -0.88 1.52 4.21 2.79 0.52 -1.26 -5.05 118.95 120.79 1y2i s ARG 40 Ca 0.55 -1.13 0.00 0.00 -0.52 0.00 0.00 55.73 54.63 1y2i s ARG 40 Cb -0.41 -1.77 0.00 0.00 0.52 0.00 0.00 34.95 33.30 1y2i s ARG 40 CO 0.46 0.44 0.00 -0.25 0.02 0.00 0.00 175.30 175.98 1y2i n ASP 41 N 1.49 0.00 -4.33 0.23 8.00 -1.26 -4.57 116.55 116.11 1y2i n ASP 41 Ca -0.18 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 54.98 1y2i n ASP 41 Cb 0.53 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.49 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 3.33 -0.16 0.53 1.01 -1.26 -5.09 121.20 119.55 1y2i s ILE 42 Ca 0.00 -0.52 0.01 0.00 0.00 0.00 0.00 60.65 60.13 1y2i s ILE 42 Cb 0.00 -2.49 0.02 0.00 0.01 0.00 0.00 42.46 40.01 1y2i s ILE 42 CO 0.00 0.45 -0.17 -0.69 0.00 0.00 0.00 174.94 174.54 1y2i s VAL 43 N 1.17 1.78 0.51 2.92 1.01 -1.26 -5.13 120.40 121.40 1y2i s VAL 43 Ca 0.02 -0.77 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 1y2i s VAL 43 Cb -0.14 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.59 1y2i s VAL 43 CO -0.01 0.49 0.78 -0.83 0.00 0.00 0.00 175.10 175.53 1y2i s GLY 44 N 1.40 1.56 0.30 4.51 0.00 -1.26 -4.86 107.32 108.97 1y2i s GLY 44 Ca 0.05 -0.80 -0.02 0.00 0.00 0.00 0.00 44.72 43.95 1y2i s GLY 44 CO -0.12 -0.59 1.97 -1.33 0.00 0.00 0.00 173.10 173.03 1y2i h GLY 45 N 0.14 1.16 0.03 0.20 0.00 -2.00 0.30 103.07 102.91 1y2i h GLY 45 Ca -0.46 -0.44 0.22 0.00 0.00 0.00 0.00 47.33 46.65 1y2i h GLY 45 CO 0.60 0.43 0.62 3.21 0.00 0.00 0.00 176.54 181.39 1y2i h ARG 46 N 1.12 0.58 0.00 4.80 3.08 -2.01 -3.16 114.38 118.79 1y2i h ARG 46 Ca 0.30 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.32 1y2i h ARG 46 Cb -0.13 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 29.79 1y2i h ARG 46 CO -0.07 0.38 -1.47 0.43 -1.07 0.00 0.00 179.97 178.18 1y2i n SER 47 N -4.73 2.69 -4.77 7.04 7.64 -0.89 -5.04 113.62 115.57 1y2i n SER 47 Ca 0.24 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.74 1y2i n SER 47 Cb 0.70 1.45 -0.06 0.00 -1.01 0.00 0.00 64.21 65.29 1y2i n SER 47 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1y2i s GLY 48 N -3.18 2.91 0.43 0.23 0.00 0.04 -4.95 107.32 102.81 1y2i s GLY 48 Ca -0.04 0.51 0.23 0.00 0.00 0.00 0.00 44.72 45.43 1y2i s GLY 48 CO 0.42 1.00 1.81 0.00 0.00 0.00 0.00 173.10 176.33 1y2i h ALA 49 N 3.66 1.01 0.00 3.20 0.00 -1.89 -2.56 119.26 122.69 1y2i h ALA 49 Ca -0.46 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.22 1y2i h ALA 49 Cb 1.20 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1y2i h ALA 49 CO 0.66 0.30 -0.03 0.10 0.00 0.00 0.00 179.25 180.29 1y2i h TYR 50 N 0.00 0.00 -0.65 0.00 -0.00 -1.93 -3.18 116.97 111.21 1y2i h TYR 50 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 58.72 1y2i h TYR 50 Cb 0.77 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 37.47 1y2i h TYR 50 CO 0.00 0.03 0.40 1.49 -0.00 0.00 0.00 178.16 180.07 1y2i h GLU 51 N 0.00 0.89 0.00 0.10 4.57 -1.73 -1.41 114.58 117.00 1y2i h GLU 51 Ca -0.00 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 1y2i h GLU 51 Cb 0.06 -0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 28.46 1y2i h GLU 51 CO 0.00 0.63 -0.07 1.57 -1.18 0.00 0.00 179.01 179.97 1y2i h LYS 52 N 0.89 0.00 -0.01 1.92 2.10 -1.75 0.10 116.57 119.82 1y2i h LYS 52 Ca 0.24 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.88 1y2i h LYS 52 Cb -0.03 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.30 1y2i h LYS 52 CO -0.04 0.07 -0.00 0.93 -2.00 0.00 0.00 179.45 178.40 1y2i h GLU 53 N 0.00 0.01 -0.52 0.07 4.39 -1.45 -1.43 114.58 115.66 1y2i h GLU 53 Ca -0.00 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 1y2i h GLU 53 Cb 0.13 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 1y2i h GLU 53 CO 0.01 0.42 0.22 -0.07 -1.16 0.00 0.00 179.01 178.43 1y2i h LEU 54 N -0.40 0.70 -0.51 1.33 3.38 -1.05 -0.84 115.31 117.94 1y2i h LEU 54 Ca 0.00 -0.16 0.06 0.00 0.09 0.00 0.00 57.88 57.87 1y2i h LEU 54 Cb 0.42 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 1y2i h LEU 54 CO 0.00 0.67 0.22 -0.09 0.09 0.00 0.00 178.44 179.33 1y2i h ARG 55 N 0.70 0.42 -0.31 1.13 2.43 -1.01 0.29 114.38 118.03 1y2i h ARG 55 Ca 0.18 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.31 1y2i h ARG 55 Cb 0.17 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1y2i h ARG 55 CO -0.02 0.28 0.17 -0.22 -1.51 0.00 0.00 179.97 178.67 1y2i h LYS 56 N 0.44 0.42 -0.62 0.20 3.11 -0.88 -1.32 116.57 117.92 1y2i h LYS 56 Ca 0.23 -0.05 0.01 0.00 -2.81 0.00 0.00 60.65 58.04 1y2i h LYS 56 Cb 0.19 -0.08 -0.03 0.00 -1.00 0.00 0.00 32.23 31.30 1y2i h LYS 56 CO -0.20 0.35 0.40 0.00 -2.81 0.00 0.00 179.45 177.20 1y2i h ALA 57 N 1.05 0.80 -0.60 5.00 0.00 -0.71 -2.09 119.26 122.70 1y2i h ALA 57 Ca 0.11 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1y2i h ALA 57 Cb 0.05 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 1y2i h ALA 57 CO -0.02 0.19 0.39 0.00 0.00 0.00 0.00 179.25 179.81 1y2i h ARG 58 N 0.82 0.75 -0.23 0.00 3.08 -0.74 -1.71 114.38 116.35 1y2i h ARG 58 Ca 0.24 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.24 1y2i h ARG 58 Cb -0.06 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.81 1y2i h ARG 58 CO -0.07 0.50 0.14 0.93 -1.07 0.00 0.00 179.97 180.40 1y2i h GLU 59 N 0.78 0.31 -0.44 0.04 5.08 -0.89 -0.13 114.58 119.32 1y2i h GLU 59 Ca 0.23 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.59 1y2i h GLU 59 Cb -0.04 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 1y2i h GLU 59 CO -0.07 0.25 0.25 0.82 -1.00 0.00 0.00 179.01 179.25 1y2i h ILE 60 N 0.29 1.02 -0.21 3.13 2.04 -1.26 -0.99 117.51 121.54 1y2i h ILE 60 Ca 0.08 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.78 1y2i h ILE 60 Cb 0.01 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 1y2i h ILE 60 CO -0.02 0.09 0.13 0.00 0.00 0.00 0.00 178.15 178.36 1y2i h ALA 61 N 1.21 0.26 -0.49 1.87 0.00 -0.96 -2.11 119.26 119.04 1y2i h ALA 61 Ca 0.18 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1y2i h ALA 61 Cb 0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1y2i h ALA 61 CO -0.10 -0.26 0.09 0.74 0.00 0.00 0.00 179.25 179.71 1y2i h PHE 62 N 0.28 0.78 -0.28 0.00 -1.00 -0.87 0.09 116.94 115.93 1y2i h PHE 62 Ca 0.08 -0.08 0.03 0.00 2.81 0.00 0.00 57.97 60.81 1y2i h PHE 62 Cb -0.03 -0.23 -0.03 0.00 3.61 0.00 0.00 35.95 39.28 1y2i h PHE 62 CO -0.07 0.68 0.10 1.49 -1.61 0.00 0.00 178.31 178.90 1y2i h GLU 63 N 0.72 0.22 -0.44 1.51 4.81 -1.05 0.44 114.58 120.79 1y2i h GLU 63 Ca 0.16 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.34 1y2i h GLU 63 Cb 0.32 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1y2i h GLU 63 CO 0.00 0.14 0.15 1.49 -0.73 0.00 0.00 179.01 180.07 1y2i h GLU 64 N 0.22 0.67 -0.28 1.92 4.81 -1.02 0.03 114.58 120.93 1y2i h GLU 64 Ca 0.12 -0.14 0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1y2i h GLU 64 Cb 0.09 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 1y2i h GLU 64 CO -0.12 0.64 0.11 1.25 -0.73 0.00 0.00 179.01 180.16 1y2i h LEU 65 N 0.57 0.14 0.05 1.64 5.85 -0.78 -1.86 115.31 120.92 1y2i h LEU 65 Ca 0.14 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.91 1y2i h LEU 65 Cb 0.24 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.22 1y2i h LEU 65 CO -0.01 0.12 -0.38 1.23 -0.34 0.00 0.00 178.44 179.06 1y2i h GLY 66 N 0.25 -0.71 1.76 3.75 0.00 0.41 -1.70 103.07 106.83 1y2i h GLY 66 Ca 0.12 0.46 -0.11 0.00 0.00 0.00 0.00 47.33 47.80 1y2i h GLY 66 CO -0.11 -0.25 -0.43 1.48 0.00 0.00 0.00 176.54 177.23 1y2i h SER 67 N -0.57 0.28 -0.41 0.19 4.64 -0.98 -1.08 113.55 115.63 1y2i h SER 67 Ca 0.04 -0.12 0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1y2i h SER 67 Cb 0.63 -0.08 -0.04 0.00 -0.31 0.00 0.00 62.40 62.60 1y2i h SER 67 CO -0.26 0.68 0.18 1.56 -0.87 0.00 0.00 176.83 178.11 1y2i h GLN 68 N 0.22 0.35 -0.62 4.77 4.20 -1.20 -1.01 115.11 121.82 1y2i h GLN 68 Ca 0.02 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1y2i h GLN 68 Cb 0.85 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.52 1y2i h GLN 68 CO 0.07 0.23 0.35 0.00 -0.67 0.00 0.00 178.83 178.81 1y2i h ALA 69 N 1.24 0.79 -0.39 3.87 0.00 -0.90 -3.13 119.26 120.75 1y2i h ALA 69 Ca 0.18 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1y2i h ALA 69 Cb 0.13 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1y2i h ALA 69 CO -0.16 0.30 0.26 0.00 0.00 0.00 0.00 179.25 179.65 1y2i h ARG 70 N 0.84 0.51 -0.13 0.00 3.08 -0.76 -1.95 114.38 115.96 1y2i h ARG 70 Ca 0.22 -0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.28 1y2i h ARG 70 Cb 0.02 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 1y2i h ARG 70 CO -0.04 0.34 0.11 0.00 -1.07 0.00 0.00 179.97 179.30 1y2i h ALA 71 N 1.14 1.99 -0.02 0.04 0.00 -1.17 -0.10 119.26 121.14 1y2i h ALA 71 Ca 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1y2i h ALA 71 Cb -0.06 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1y2i h ALA 71 CO -0.03 -0.17 0.00 1.28 0.00 0.00 0.00 179.25 180.32 1y2i n LEU 72 N -4.27 0.86 0.00 0.00 4.77 -0.82 -4.91 117.00 112.63 1y2i n LEU 72 Ca 0.00 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.68 1y2i n LEU 72 Cb 0.23 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1y2i n LEU 72 CO 0.32 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1y2i n GLY 73 N 1.08 0.78 3.80 -0.72 0.00 -0.05 -5.02 105.19 105.06 1y2i n GLY 73 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 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 -3.10 3.04 -1.43 4.61 0.00 -0.80 -4.83 121.76 119.25 1y2i s ALA 74 Ca 0.00 0.51 0.12 0.00 0.00 0.00 0.00 51.96 52.59 1y2i s ALA 74 Cb 0.00 -3.20 0.13 0.00 0.00 0.00 0.00 23.12 20.05 1y2i s ALA 74 CO 0.00 -0.01 0.93 -0.40 0.00 0.00 0.00 175.76 176.28 1y2i n ASP 75 N -0.44 2.13 -3.54 0.00 5.75 -0.07 -4.33 116.55 116.06 1y2i n ASP 75 Ca 0.06 -1.57 -0.15 0.00 -0.01 0.00 0.00 54.79 53.13 1y2i n ASP 75 Cb 0.52 -0.03 -0.05 0.00 -1.03 0.00 0.00 41.12 40.53 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 -1.00 -1.50 -0.19 2.12 0.00 -0.93 -3.59 121.76 116.67 1y2i s ALA 76 Ca 0.15 0.84 0.01 0.00 0.00 0.00 0.00 51.96 52.96 1y2i s ALA 76 Cb 0.10 0.29 0.04 0.00 0.00 0.00 0.00 23.12 23.55 1y2i s ALA 76 CO 0.15 -0.48 -0.10 0.08 0.00 0.00 0.00 175.76 175.41 1y2i s VAL 77 N -2.09 1.60 0.52 0.00 1.01 -0.24 -0.42 120.40 120.78 1y2i s VAL 77 Ca -0.07 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.02 1y2i s VAL 77 Cb -0.01 -1.66 0.02 0.00 0.00 0.00 0.00 36.38 34.73 1y2i s VAL 77 CO 0.02 0.20 0.32 0.68 0.00 0.00 0.00 175.10 176.32 1y2i s VAL 78 N 1.42 1.71 -1.47 2.92 -7.23 -0.66 -0.97 120.40 116.13 1y2i s VAL 78 Ca -0.00 -1.58 -0.11 0.00 -1.81 0.00 0.00 61.98 58.48 1y2i s VAL 78 Cb -0.16 -2.29 0.06 0.00 0.56 0.00 0.00 36.38 34.55 1y2i s VAL 78 CO -0.08 0.00 0.82 0.61 -0.31 0.00 0.00 175.10 176.14 1y2i n GLY 79 N -1.62 -0.51 3.77 2.32 0.00 0.11 -0.92 105.19 108.35 1y2i n GLY 79 Ca -0.04 0.17 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.19 3.86 -0.03 -0.61 1.01 -0.23 -4.48 121.20 117.53 1y2i s ILE 80 Ca 0.53 1.60 0.04 0.00 0.00 0.00 0.00 60.65 62.82 1y2i s ILE 80 Cb -0.26 -3.91 -0.01 0.00 0.01 0.00 0.00 42.46 38.29 1y2i s ILE 80 CO 0.65 0.18 -0.16 -1.81 0.00 0.00 0.00 174.94 173.80 1y2i s ASP 81 N -1.39 2.03 -0.13 3.58 1.01 -0.20 -4.44 116.67 117.13 1y2i s ASP 81 Ca 0.51 -0.33 0.00 0.00 0.71 0.00 0.00 52.55 53.45 1y2i s ASP 81 Cb -0.24 -0.47 -0.01 0.00 1.01 0.00 0.00 42.92 43.21 1y2i s ASP 81 CO 0.30 0.16 -0.14 -0.63 0.21 0.00 0.00 175.17 175.06 1y2i s ILE 82 N -0.07 2.92 0.04 0.77 1.01 -1.26 -1.82 121.20 122.79 1y2i s ILE 82 Ca -0.01 -0.71 0.06 0.00 0.00 0.00 0.00 60.65 59.99 1y2i s ILE 82 Cb -0.10 -2.21 -0.02 0.00 0.01 0.00 0.00 42.46 40.14 1y2i s ILE 82 CO 0.01 0.53 -0.17 -1.81 0.00 0.00 0.00 174.94 173.50 1y2i s ASP 83 N 0.35 2.05 -0.16 3.58 1.01 0.29 -4.97 116.67 118.81 1y2i s ASP 83 Ca -0.12 -0.47 -0.01 0.00 0.71 0.00 0.00 52.55 52.66 1y2i s ASP 83 Cb -0.16 -0.16 -0.01 0.00 1.01 0.00 0.00 42.92 43.59 1y2i s ASP 83 CO 0.06 0.11 -0.10 -0.31 0.21 0.00 0.00 175.17 175.14 1y2i s TYR 84 N -0.78 2.87 -0.10 4.23 1.51 -1.26 -0.31 117.35 123.51 1y2i s TYR 84 Ca 0.05 -0.71 0.00 0.00 -1.01 0.00 0.00 57.07 55.40 1y2i s TYR 84 Cb -0.08 -1.93 0.02 0.00 -0.11 0.00 0.00 41.96 39.87 1y2i s TYR 84 CO 0.01 -0.29 -0.09 -1.21 -1.11 0.00 0.00 175.55 172.86 1y2i s GLU 85 N 0.66 1.64 -0.02 -0.62 0.41 -1.26 -5.02 118.70 114.49 1y2i s GLU 85 Ca -0.05 -0.32 -0.30 0.00 -0.41 0.00 0.00 54.97 53.88 1y2i s GLU 85 Cb -0.15 -1.59 -0.04 0.00 -1.78 0.00 0.00 34.13 30.57 1y2i s GLU 85 CO 0.02 -0.19 1.28 -0.08 -0.49 0.00 0.00 175.26 175.81 1y2i s THR 86 N 1.41 4.00 0.27 3.63 -1.32 -1.26 -4.42 115.64 117.96 1y2i s THR 86 Ca -0.00 1.37 0.07 0.00 -1.21 0.00 0.00 61.69 61.92 1y2i s THR 86 Cb -0.13 -3.88 -0.06 0.00 -1.51 0.00 0.00 72.50 66.92 1y2i s THR 86 CO -0.05 0.01 -0.08 0.68 -2.21 0.00 0.00 174.62 172.96 1y2i s VAL 87 N 2.18 1.75 0.00 5.08 -7.23 -1.26 -4.99 120.40 115.93 1y2i s VAL 87 Ca 0.59 -2.16 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 1y2i s VAL 87 Cb -0.28 -2.40 0.00 0.00 0.56 0.00 0.00 36.38 34.26 1y2i s VAL 87 CO 0.24 -0.34 0.00 0.61 -0.31 0.00 0.00 175.10 175.30 1y2i n GLY 88 N -0.57 0.45 0.29 2.32 0.00 -1.26 -3.81 105.19 102.61 1y2i n GLY 88 Ca -0.06 -1.94 0.06 0.00 0.00 0.00 0.00 46.02 44.08 1y2i n GLY 88 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1y2i h GLN 89 N 0.00 0.29 -0.03 1.61 -0.00 -2.01 -3.09 115.11 111.88 1y2i h GLN 89 Ca 0.00 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.65 58.63 1y2i h GLN 89 Cb 0.00 -0.06 -0.00 0.00 -0.00 0.00 0.00 27.48 27.41 1y2i h GLN 89 CO 0.00 0.19 -0.15 0.09 -0.00 0.00 0.00 178.83 178.97 1y2i n ASN 90 N -4.50 2.26 -3.14 0.06 3.02 -1.26 -4.95 115.26 106.75 1y2i n ASN 90 Ca 0.00 -3.35 -0.16 0.00 -0.03 0.00 0.00 54.58 51.05 1y2i n ASN 90 Cb 0.08 -0.47 -0.02 0.00 -0.61 0.00 0.00 39.78 38.75 1y2i n ASN 90 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1y2i n GLY 91 N -1.28 -0.47 2.76 7.41 0.00 -1.17 -5.13 105.19 107.30 1y2i n GLY 91 Ca 0.18 0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.91 4.99 -1.00 1.61 7.64 -1.25 -4.83 113.62 118.87 1y2i n SER 92 Ca 0.01 -3.60 0.00 0.00 1.01 0.00 0.00 58.87 56.29 1y2i n SER 92 Cb 0.51 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 62.94 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 0.23 0.00 -3.41 -3.43 7.94 -0.96 -3.82 117.00 113.55 1y2i n LEU 94 Ca 0.33 0.00 0.02 0.00 -1.11 0.00 0.00 56.01 55.24 1y2i n LEU 94 Cb 0.37 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.28 1y2i n LEU 94 CO 0.43 0.00 0.57 -0.69 -1.11 0.00 0.00 177.39 176.59 1y2i s VAL 96 N -2.37 -0.55 -0.04 1.96 1.01 -0.42 -0.27 120.40 119.73 1y2i s VAL 96 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 61.98 62.04 1y2i s VAL 96 Cb 0.00 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.37 1y2i s VAL 96 CO 0.00 0.00 -0.23 -0.94 0.00 0.00 0.00 175.10 173.93 1y2i s SER 97 N 2.52 2.82 -0.02 3.32 1.04 0.58 -1.73 113.70 122.23 1y2i s SER 97 Ca -0.02 -0.45 0.06 0.00 0.48 0.00 0.00 55.95 56.02 1y2i s SER 97 Cb -0.07 -0.58 -0.02 0.00 0.10 0.00 0.00 66.02 65.46 1y2i s SER 97 CO -0.17 0.25 -0.21 -0.69 0.98 0.00 0.00 173.24 173.40 1y2i s VAL 98 N -0.30 1.66 0.09 5.02 1.01 0.11 -0.55 120.40 127.44 1y2i s VAL 98 Ca 0.02 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.10 1y2i s VAL 98 Cb -0.11 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.84 1y2i s VAL 98 CO 0.01 0.47 -0.02 -0.94 0.00 0.00 0.00 175.10 174.62 1y2i s SER 99 N -0.46 0.73 0.00 3.32 1.04 -0.75 -0.23 113.70 117.35 1y2i s SER 99 Ca 0.07 -1.05 -0.16 0.00 0.48 0.00 0.00 55.95 55.29 1y2i s SER 99 Cb -0.08 0.18 0.05 0.00 0.10 0.00 0.00 66.02 66.26 1y2i s SER 99 CO -0.01 -0.58 0.73 0.61 0.98 0.00 0.00 173.24 174.98 1y2i n GLY 100 N -0.00 0.45 3.19 7.32 0.00 -0.49 -1.03 105.19 114.63 1y2i n GLY 100 Ca -0.11 -0.97 -0.33 0.00 0.00 0.00 0.00 46.02 44.60 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 -2.10 2.43 0.12 2.61 2.01 -0.09 -0.37 115.64 120.25 1y2i s THR 101 Ca 0.17 -0.83 -0.30 0.00 0.31 0.00 0.00 61.69 61.04 1y2i s THR 101 Cb -0.01 -2.04 -0.06 0.00 0.01 0.00 0.00 72.50 70.40 1y2i s THR 101 CO 0.00 0.51 1.11 0.00 -0.69 0.00 0.00 174.62 175.55 1y2i s ALA 102 N 1.16 3.34 0.04 7.40 0.00 -0.28 -1.65 121.76 131.78 1y2i s ALA 102 Ca 0.01 0.78 -0.00 0.00 0.00 0.00 0.00 51.96 52.75 1y2i s ALA 102 Cb -0.14 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.58 1y2i s ALA 102 CO -0.07 -0.27 -0.03 0.14 0.00 0.00 0.00 175.76 175.53 1y2i s VAL 103 N 0.32 0.17 -0.16 0.00 -7.23 0.44 -0.19 120.40 113.75 1y2i s VAL 103 Ca 0.52 -1.34 -0.09 0.00 -1.81 0.00 0.00 61.98 59.27 1y2i s VAL 103 Cb -0.28 -0.86 -0.05 0.00 0.56 0.00 0.00 36.38 35.75 1y2i s VAL 103 CO 0.32 -0.73 0.14 -0.54 -0.31 0.00 0.00 175.10 173.98 1y2i s LYS 104 N -2.62 3.82 0.32 4.82 1.02 -0.53 -0.89 119.74 125.68 1y2i s LYS 104 Ca -0.05 -0.16 0.09 0.00 0.02 0.00 0.00 55.97 55.87 1y2i s LYS 104 Cb -0.02 -3.30 -0.06 0.00 -0.52 0.00 0.00 37.83 33.93 1y2i s LYS 104 CO -0.05 0.54 -0.11 0.95 -0.92 0.00 0.00 175.35 175.76 1y2i s THR 105 N -0.34 2.19 -0.08 2.17 -4.23 -1.26 -0.43 115.64 113.66 1y2i s THR 105 Ca 0.12 -2.23 -0.02 0.00 -1.18 0.00 0.00 61.69 58.38 1y2i s THR 105 Cb -0.12 -2.56 0.03 0.00 1.34 0.00 0.00 72.50 71.20 1y2i s THR 105 CO 0.01 -0.25 0.03 -0.60 -0.54 0.00 0.00 174.62 173.27 1y2i s ARG 106 N -3.61 0.31 -0.00 3.99 3.52 0.14 -4.83 118.95 118.46 1y2i s ARG 106 Ca 0.32 0.16 -0.37 0.00 -0.13 0.00 0.00 55.73 55.70 1y2i s ARG 106 Cb 0.01 -0.94 -0.16 0.00 -1.56 0.00 0.00 34.95 32.30 1y2i s ARG 106 CO 0.15 -0.36 1.45 -2.13 -0.81 0.00 0.00 175.30 173.60 1y2i n ARG 107 N 5.21 1.19 0.23 5.12 0.00 -1.26 -1.13 116.66 126.02 1y2i n ARG 107 Ca -0.06 0.43 0.16 0.00 -0.00 0.00 0.00 57.85 58.38 1y2i n ARG 107 Cb 0.50 -2.09 0.72 0.00 0.00 0.00 0.00 32.46 31.58 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 5.30 0.00 -0.00 6.15 -0.26 -1.67 -3.47 115.58 121.63 1y2i h ASN 108 Ca -0.47 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.27 1y2i h ASN 108 Cb 1.33 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.59 1y2i h ASN 108 CO 0.83 0.00 0.00 -0.38 -1.06 0.00 0.00 177.43 176.82