#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 2.39 -0.02 3.69 0.40 -1.26 -0.82 117.98 122.37 1y2i s PHE 3 Ca 0.00 -1.14 -0.02 0.00 -0.60 0.00 0.00 56.93 55.17 1y2i s PHE 3 Cb 0.00 -1.65 0.00 0.00 0.51 0.00 0.00 43.02 41.88 1y2i s PHE 3 CO 0.00 -0.53 0.06 0.45 0.70 0.00 0.00 175.22 175.90 1y2i s SER 4 N 0.79 -0.03 0.00 1.36 0.15 -0.31 -5.00 113.70 110.66 1y2i s SER 4 Ca -0.09 0.03 0.25 0.00 0.70 0.00 0.00 55.95 56.84 1y2i s SER 4 Cb -0.16 0.13 1.20 0.00 -1.71 0.00 0.00 66.02 65.48 1y2i s SER 4 CO 0.00 -0.08 1.83 0.35 1.20 0.00 0.00 173.24 176.54 1y2i n THR 5 N 2.78 0.23 -3.09 6.45 -2.24 -1.26 -1.22 114.28 115.94 1y2i n THR 5 Ca -0.14 0.06 -0.31 0.00 -2.27 0.00 0.00 64.05 61.38 1y2i n THR 5 Cb 0.59 -0.64 -0.05 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 -2.73 4.77 0.22 4.28 -4.23 -1.26 -3.95 115.64 112.75 1y2i s THR 6 Ca 0.20 0.72 0.02 0.00 -1.18 0.00 0.00 61.69 61.44 1y2i s THR 6 Cb 0.17 -3.66 -0.04 0.00 1.34 0.00 0.00 72.50 70.31 1y2i s THR 6 CO 0.41 -0.30 1.55 1.55 -0.54 0.00 0.00 174.62 177.29 1y2i h PRO 7 N 1.90 0.35 -5.87 3.99 0.13 -1.93 -0.17 132.00 130.41 1y2i h PRO 7 Ca -0.47 -0.23 -0.58 0.00 -0.87 0.00 0.00 66.00 63.84 1y2i h PRO 7 Cb 1.18 0.03 -0.14 0.00 0.13 0.00 0.00 31.00 32.20 1y2i h PRO 7 CO 0.65 0.83 -0.70 0.95 -0.23 0.00 0.00 178.00 179.50 1y2i s THR 8 N -3.87 2.13 -0.32 1.56 -4.23 -1.26 -4.57 115.64 105.08 1y2i s THR 8 Ca -0.05 -2.23 -0.00 0.00 -1.18 0.00 0.00 61.69 58.23 1y2i s THR 8 Cb 0.12 -2.51 0.07 0.00 1.34 0.00 0.00 72.50 71.51 1y2i s THR 8 CO 0.81 -0.28 0.02 -0.76 -0.54 0.00 0.00 174.62 173.88 1y2i s LEU 9 N -3.54 4.16 0.17 4.79 1.43 -1.26 -5.03 118.68 119.39 1y2i s LEU 9 Ca 0.31 -1.53 -0.34 0.00 -1.03 0.00 0.00 54.13 51.54 1y2i s LEU 9 Cb 0.01 -1.69 -0.15 0.00 0.03 0.00 0.00 46.19 44.39 1y2i s LEU 9 CO 0.15 -0.31 1.38 -0.62 0.23 0.00 0.00 176.35 177.17 1y2i n GLU 10 N 4.54 1.65 0.00 1.70 1.02 -1.26 -1.24 120.64 127.05 1y2i n GLU 10 Ca -0.09 0.59 0.00 0.00 -0.02 0.00 0.00 57.16 57.64 1y2i n GLU 10 Cb 0.43 -2.24 0.00 0.00 -0.02 0.00 0.00 31.44 29.61 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 2.53 2.39 3.54 0.62 0.00 -1.26 -5.03 105.19 107.97 1y2i n GLY 11 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 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 2.68 -0.07 0.99 1.43 -0.37 -1.71 118.68 121.63 1y2i s LEU 12 Ca 0.00 -1.28 0.03 0.00 -1.03 0.00 0.00 54.13 51.85 1y2i s LEU 12 Cb 0.00 -0.83 0.01 0.00 0.03 0.00 0.00 46.19 45.40 1y2i s LEU 12 CO 0.00 -0.36 -0.14 -0.89 0.23 0.00 0.00 176.35 175.19 1y2i s THR 13 N -2.79 1.28 -0.16 5.49 2.01 -0.19 -4.73 115.64 116.55 1y2i s THR 13 Ca 0.33 -0.57 -0.29 0.00 0.31 0.00 0.00 61.69 61.47 1y2i s THR 13 Cb 0.06 -1.15 -0.01 0.00 0.01 0.00 0.00 72.50 71.41 1y2i s THR 13 CO 0.16 0.39 1.08 -0.63 -0.69 0.00 0.00 174.62 174.93 1y2i s ILE 14 N 0.57 4.60 -0.27 1.82 1.01 -1.26 0.33 121.20 127.99 1y2i s ILE 14 Ca -0.14 1.91 0.16 0.00 0.00 0.00 0.00 60.65 62.58 1y2i s ILE 14 Cb -0.16 -4.23 -0.23 0.00 0.01 0.00 0.00 42.46 37.86 1y2i s ILE 14 CO 0.04 -0.09 0.47 1.33 0.00 0.00 0.00 174.94 176.69 1y2i n VAL 15 N 4.99 0.00 -3.70 2.92 0.24 -0.37 -4.94 118.33 117.47 1y2i n VAL 15 Ca 0.11 -0.29 -0.11 0.00 -2.04 0.00 0.00 64.34 62.01 1y2i n VAL 15 Cb 0.47 0.42 -0.10 0.00 -1.47 0.00 0.00 33.84 33.16 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 -2.93 0.48 -0.26 7.34 2.12 -1.20 -5.00 118.70 119.25 1y2i s GLU 16 Ca -0.02 0.78 -0.12 0.00 0.36 0.00 0.00 54.97 55.97 1y2i s GLU 16 Cb 0.11 0.10 -0.05 0.00 0.26 0.00 0.00 34.13 34.56 1y2i s GLU 16 CO 0.68 -0.12 0.24 0.71 -0.54 0.00 0.00 175.26 176.22 1y2i s TYR 17 N 1.00 3.26 -0.60 5.30 1.51 -1.26 -1.36 117.35 125.21 1y2i s TYR 17 Ca -0.06 0.25 0.14 0.00 -1.01 0.00 0.00 57.07 56.39 1y2i s TYR 17 Cb -0.06 -2.41 0.46 0.00 -0.11 0.00 0.00 41.96 39.84 1y2i s TYR 17 CO -0.09 -0.11 1.38 0.00 -1.11 0.00 0.00 175.55 175.63 1y2i n GLY 19 N 0.11 1.48 3.73 0.00 0.00 -1.24 -4.79 105.19 104.48 1y2i n GLY 19 Ca 0.18 -1.94 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 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 -2.37 3.58 0.19 1.61 1.01 -1.26 -1.16 120.40 122.01 1y2i s VAL 20 Ca 0.00 1.23 0.11 0.00 0.00 0.00 0.00 61.98 63.32 1y2i s VAL 20 Cb 0.00 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 1y2i s VAL 20 CO 0.00 0.15 -0.22 0.68 0.00 0.00 0.00 175.10 175.71 1y2i s VAL 21 N 0.48 2.46 0.15 2.92 -7.23 -0.13 -4.90 120.40 114.16 1y2i s VAL 21 Ca 0.57 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.75 1y2i s VAL 21 Cb -0.33 -2.19 -0.04 0.00 0.56 0.00 0.00 36.38 34.38 1y2i s VAL 21 CO 0.34 -0.12 0.04 0.42 -0.31 0.00 0.00 175.10 175.46 1y2i s THR 22 N -1.69 0.34 0.04 5.32 -4.23 -1.26 -1.78 115.64 112.38 1y2i s THR 22 Ca 0.21 -1.94 -0.20 0.00 -1.18 0.00 0.00 61.69 58.58 1y2i s THR 22 Cb -0.08 -2.11 0.04 0.00 1.34 0.00 0.00 72.50 71.69 1y2i s THR 22 CO 0.11 -0.44 0.46 -0.83 -0.54 0.00 0.00 174.62 173.37 1y2i s GLY 23 N -3.11 -0.34 0.23 3.99 0.00 -0.50 -3.79 107.32 103.80 1y2i s GLY 23 Ca 0.25 0.45 -0.22 0.00 0.00 0.00 0.00 44.72 45.20 1y2i s GLY 23 CO 0.03 0.18 0.71 -1.83 0.00 0.00 0.00 173.10 172.19 1y2i s GLU 24 N -2.38 1.59 -0.12 2.90 1.03 -1.26 -0.62 118.70 119.86 1y2i s GLU 24 Ca -0.06 -0.81 -0.21 0.00 0.03 0.00 0.00 54.97 53.92 1y2i s GLU 24 Cb -0.01 0.59 0.05 0.00 -0.80 0.00 0.00 34.13 33.96 1y2i s GLU 24 CO -0.01 -0.72 0.51 0.00 -1.33 0.00 0.00 175.26 173.70 1y2i s ALA 25 N -3.82 -1.29 -0.08 -0.84 0.00 -0.83 -4.32 121.76 110.58 1y2i s ALA 25 Ca 0.08 1.16 0.03 0.00 0.00 0.00 0.00 51.96 53.23 1y2i s ALA 25 Cb -0.04 -0.41 -0.02 0.00 0.00 0.00 0.00 23.12 22.65 1y2i s ALA 25 CO 0.01 -0.28 -0.17 0.42 0.00 0.00 0.00 175.76 175.73 1y2i s ILE 26 N -0.49 2.74 -0.30 0.00 1.01 -1.26 -1.03 121.20 121.87 1y2i s ILE 26 Ca -0.06 -0.81 -0.11 0.00 0.00 0.00 0.00 60.65 59.67 1y2i s ILE 26 Cb -0.03 -2.08 -0.03 0.00 0.01 0.00 0.00 42.46 40.32 1y2i s ILE 26 CO 0.04 0.56 0.19 -0.22 0.00 0.00 0.00 174.94 175.51 1y2i s LEU 27 N -0.15 4.13 0.81 2.97 0.20 0.19 -4.99 118.68 121.85 1y2i s LEU 27 Ca -0.02 -0.23 -0.11 0.00 0.69 0.00 0.00 54.13 54.46 1y2i s LEU 27 Cb -0.14 -2.09 0.08 0.00 -0.43 0.00 0.00 46.19 43.62 1y2i s LEU 27 CO 0.04 -0.13 1.09 -0.83 -0.29 0.00 0.00 176.35 176.23 1y2i s GLY 28 N 1.71 1.65 0.31 7.98 0.00 -1.26 -2.12 107.32 115.59 1y2i s GLY 28 Ca 0.06 0.10 0.03 0.00 0.00 0.00 0.00 44.72 44.92 1y2i s GLY 28 CO 0.09 0.51 1.87 0.00 0.00 0.00 0.00 173.10 175.56 1y2i h ALA 29 N -1.26 1.60 -0.69 3.20 0.00 -1.99 -2.43 119.26 117.70 1y2i h ALA 29 Ca -0.46 0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.54 1y2i h ALA 29 Cb 1.25 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.77 1y2i h ALA 29 CO 0.53 0.19 0.36 -2.95 0.00 0.00 0.00 179.25 177.38 1y2i h ASN 30 N 0.93 0.50 -0.59 0.00 -0.00 -1.93 0.28 115.58 114.77 1y2i h ASN 30 Ca 0.46 0.05 -0.10 0.00 -0.00 0.00 0.00 56.30 56.70 1y2i h ASN 30 Cb 0.47 -0.04 -0.02 0.00 -0.00 0.00 0.00 38.32 38.72 1y2i h ASN 30 CO -0.22 0.30 -0.01 0.40 -0.00 0.00 0.00 177.43 177.91 1y2i h ILE 31 N 0.64 1.26 -0.07 6.14 1.08 -1.82 -0.98 117.51 123.76 1y2i h ILE 31 Ca 0.33 -1.16 0.00 0.00 -0.39 0.00 0.00 64.86 63.64 1y2i h ILE 31 Cb 0.28 0.81 -0.00 0.00 -3.07 0.00 0.00 36.82 34.84 1y2i h ILE 31 CO -0.23 0.42 0.05 0.15 -0.69 0.00 0.00 178.15 177.85 1y2i h PHE 32 N 0.96 0.09 -0.62 1.37 3.57 -0.83 0.13 116.94 121.63 1y2i h PHE 32 Ca 0.17 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.63 1y2i h PHE 32 Cb 0.56 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.24 1y2i h PHE 32 CO 0.04 0.07 0.22 0.00 -2.23 0.00 0.00 178.31 176.41 1y2i h ARG 33 N 0.10 0.91 -0.22 1.11 3.08 -0.36 0.10 114.38 119.11 1y2i h ARG 33 Ca 0.03 -0.16 -0.18 0.00 0.07 0.00 0.00 59.98 59.74 1y2i h ARG 33 Cb -0.01 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 29.89 1y2i h ARG 33 CO -0.01 0.76 -0.59 -0.44 -1.07 0.00 0.00 179.97 178.63 1y2i h ASP 34 N 0.89 0.79 0.00 7.04 5.19 -0.95 -3.38 116.42 126.01 1y2i h ASP 34 Ca 0.21 -0.44 -0.04 0.00 -0.62 0.00 0.00 57.03 56.14 1y2i h ASP 34 Cb 0.21 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.49 1y2i h ASP 34 CO -0.01 1.20 -1.27 0.49 -3.12 0.00 0.00 179.24 176.52 1y2i n PHE 35 N -3.96 0.00 -0.06 4.55 3.01 0.01 -4.89 117.46 116.12 1y2i n PHE 35 Ca -0.04 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.32 1y2i n PHE 35 Cb 0.64 -0.17 -0.05 0.00 -0.01 0.00 0.00 39.48 39.89 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 -1.88 0.00 -0.10 1.38 3.01 -0.13 -4.26 117.46 115.47 1y2i n PHE 36 Ca -0.04 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.56 1y2i n PHE 36 Cb 0.35 -0.47 0.52 0.00 -0.01 0.00 0.00 39.48 39.87 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 -0.16 2.09 -0.05 4.37 0.00 -1.32 -2.66 119.26 121.54 1y2i h ALA 37 Ca -0.29 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1y2i h ALA 37 Cb 1.37 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1y2i h ALA 37 CO -0.10 -0.25 0.00 0.41 0.00 0.00 0.00 179.25 179.32 1y2i n GLY 38 N -1.53 -0.35 3.72 0.00 0.00 -1.26 -4.94 105.19 100.82 1y2i n GLY 38 Ca 0.11 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.95 2.85 0.04 -0.61 1.01 -1.01 -5.01 121.20 116.53 1y2i s ILE 39 Ca 0.37 0.61 0.05 0.00 0.00 0.00 0.00 60.65 61.68 1y2i s ILE 39 Cb 0.19 -3.39 -0.03 0.00 0.01 0.00 0.00 42.46 39.24 1y2i s ILE 39 CO 0.30 0.05 -0.11 -0.13 0.00 0.00 0.00 174.94 175.05 1y2i s ARG 40 N 1.16 2.28 5.70 2.79 0.52 -1.26 -5.04 118.95 125.11 1y2i s ARG 40 Ca 0.68 -0.89 0.00 0.00 -0.52 0.00 0.00 55.73 55.01 1y2i s ARG 40 Cb -0.41 -2.35 0.00 0.00 0.52 0.00 0.00 34.95 32.71 1y2i s ARG 40 CO 0.31 0.56 0.00 -0.25 0.02 0.00 0.00 175.30 175.94 1y2i n ASP 41 N 1.34 0.00 -4.06 0.23 10.43 -1.26 -4.54 116.55 118.68 1y2i n ASP 41 Ca -0.15 0.00 -0.32 0.00 2.57 0.00 0.00 54.79 56.89 1y2i n ASP 41 Cb 0.52 0.00 -0.15 0.00 1.84 0.00 0.00 41.12 43.33 1y2i n ASP 41 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1y2i s ILE 42 N 0.00 2.01 -0.17 0.53 1.01 -1.26 -5.09 121.20 118.23 1y2i s ILE 42 Ca 0.00 -1.29 -0.00 0.00 0.00 0.00 0.00 60.65 59.35 1y2i s ILE 42 Cb 0.00 -2.03 -0.00 0.00 0.01 0.00 0.00 42.46 40.44 1y2i s ILE 42 CO 0.00 0.17 -0.14 -0.69 0.00 0.00 0.00 174.94 174.29 1y2i s VAL 43 N 1.22 2.75 0.44 2.92 1.01 -1.26 -5.12 120.40 122.37 1y2i s VAL 43 Ca -0.03 -0.73 -0.09 0.00 0.00 0.00 0.00 61.98 61.13 1y2i s VAL 43 Cb -0.17 -2.18 -0.05 0.00 0.00 0.00 0.00 36.38 33.98 1y2i s VAL 43 CO -0.08 0.50 0.79 -0.83 0.00 0.00 0.00 175.10 175.48 1y2i s GLY 44 N 0.95 1.78 0.64 4.51 0.00 -1.26 -4.88 107.32 109.05 1y2i s GLY 44 Ca -0.03 -0.30 0.39 0.00 0.00 0.00 0.00 44.72 44.78 1y2i s GLY 44 CO -0.02 -0.11 2.33 -1.33 0.00 0.00 0.00 173.10 173.97 1y2i h GLY 45 N 0.84 0.00 1.26 0.20 0.00 -2.00 -0.55 103.07 102.82 1y2i h GLY 45 Ca -0.47 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 46.77 1y2i h GLY 45 CO 0.63 0.00 -0.04 3.21 0.00 0.00 0.00 176.54 180.34 1y2i h ARG 46 N 0.00 0.89 0.00 4.80 3.08 -2.00 -3.32 114.38 117.83 1y2i h ARG 46 Ca -0.00 -0.27 -0.10 0.00 0.07 0.00 0.00 59.98 59.67 1y2i h ARG 46 Cb 0.00 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1y2i h ARG 46 CO 0.00 0.91 -1.77 -1.13 -1.07 0.00 0.00 179.97 176.91 1y2i n SER 47 N -4.18 1.69 -4.72 7.04 3.41 -1.09 -5.00 113.62 110.77 1y2i n SER 47 Ca 0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.21 1y2i n SER 47 Cb 0.34 1.31 -0.03 0.00 -0.26 0.00 0.00 64.21 65.57 1y2i n SER 47 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1y2i s GLY 48 N -4.08 2.19 0.43 5.00 0.00 -0.23 -4.92 107.32 105.70 1y2i s GLY 48 Ca -0.06 1.01 0.15 0.00 0.00 0.00 0.00 44.72 45.83 1y2i s GLY 48 CO 0.58 2.20 1.96 0.00 0.00 0.00 0.00 173.10 177.83 1y2i h ALA 49 N 6.65 1.58 -0.55 3.20 0.00 -1.89 -2.51 119.26 125.73 1y2i h ALA 49 Ca -0.42 -0.21 0.12 0.00 0.00 0.00 0.00 54.91 54.40 1y2i h ALA 49 Cb 1.21 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 1y2i h ALA 49 CO 0.83 0.28 0.38 0.10 0.00 0.00 0.00 179.25 180.85 1y2i h TYR 50 N 0.00 0.26 -0.01 0.00 -0.00 -1.92 -2.27 116.97 113.04 1y2i h TYR 50 Ca -0.00 0.01 -0.03 0.00 0.00 0.00 0.00 58.73 58.70 1y2i h TYR 50 Cb 0.41 -0.08 -0.00 0.00 0.00 0.00 0.00 36.73 37.05 1y2i h TYR 50 CO 0.00 0.12 -0.14 1.49 -0.00 0.00 0.00 178.16 179.62 1y2i h GLU 51 N 0.24 0.02 -0.56 0.10 4.57 -1.72 0.16 114.58 117.39 1y2i h GLU 51 Ca 0.26 -0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.42 1y2i h GLU 51 Cb 0.70 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.26 1y2i h GLU 51 CO -0.05 0.16 0.26 0.87 -1.18 0.00 0.00 179.01 179.07 1y2i h LYS 52 N 0.02 0.78 -0.04 1.92 1.57 -1.56 0.44 116.57 119.69 1y2i h LYS 52 Ca 0.00 -0.10 -0.10 0.00 -1.87 0.00 0.00 60.65 58.58 1y2i h LYS 52 Cb 0.27 -0.15 0.01 0.00 0.08 0.00 0.00 32.23 32.43 1y2i h LYS 52 CO 0.02 0.61 -0.38 0.93 -0.57 0.00 0.00 179.45 180.07 1y2i h GLU 53 N 0.78 0.33 -0.29 3.15 4.39 -0.84 -2.35 114.58 119.75 1y2i h GLU 53 Ca 0.19 -0.30 0.03 0.00 0.34 0.00 0.00 59.36 59.62 1y2i h GLU 53 Cb 0.09 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.78 1y2i h GLU 53 CO -0.03 0.96 0.12 -0.07 -1.16 0.00 0.00 179.01 178.83 1y2i h LEU 54 N -0.19 0.15 -1.20 1.33 3.38 -1.04 0.73 115.31 118.47 1y2i h LEU 54 Ca -0.03 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1y2i h LEU 54 Cb 1.06 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 1y2i h LEU 54 CO 0.08 0.12 0.19 0.08 0.09 0.00 0.00 178.44 179.00 1y2i h ARG 55 N 0.26 0.75 -0.47 1.13 0.11 -0.93 0.29 114.38 115.52 1y2i h ARG 55 Ca 0.12 -0.12 -0.01 0.00 0.10 0.00 0.00 59.98 60.08 1y2i h ARG 55 Cb 0.07 -0.13 -0.02 0.00 1.11 0.00 0.00 29.97 31.00 1y2i h ARG 55 CO -0.11 0.63 0.25 -0.22 0.10 0.00 0.00 179.97 180.62 1y2i h LYS 56 N 0.74 0.67 0.01 0.08 3.64 -1.13 -1.18 116.57 119.40 1y2i h LYS 56 Ca 0.18 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1y2i h LYS 56 Cb 0.17 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1y2i h LYS 56 CO -0.01 0.54 -0.01 0.00 -2.27 0.00 0.00 179.45 177.69 1y2i h ALA 57 N 1.09 -0.01 -0.34 5.00 0.00 0.72 -2.10 119.26 123.62 1y2i h ALA 57 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1y2i h ALA 57 Cb 0.07 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1y2i h ALA 57 CO -0.03 -0.51 0.22 0.00 0.00 0.00 0.00 179.25 178.94 1y2i h ARG 58 N -0.01 0.45 -0.62 0.00 3.08 -0.46 -1.36 114.38 115.45 1y2i h ARG 58 Ca 0.00 -0.03 0.08 0.00 0.07 0.00 0.00 59.98 60.10 1y2i h ARG 58 Cb 0.01 -0.10 -0.06 0.00 0.08 0.00 0.00 29.97 29.90 1y2i h ARG 58 CO -0.00 0.31 0.29 1.49 -1.07 0.00 0.00 179.97 180.98 1y2i h GLU 59 N 0.45 0.51 -0.55 0.04 4.57 -1.10 0.18 114.58 118.68 1y2i h GLU 59 Ca 0.12 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1y2i h GLU 59 Cb -0.04 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.41 1y2i h GLU 59 CO -0.03 0.33 0.34 0.82 -1.18 0.00 0.00 179.01 179.29 1y2i h ILE 60 N 0.52 1.16 -0.24 2.32 2.04 -1.07 -0.72 117.51 121.52 1y2i h ILE 60 Ca 0.30 -0.36 0.02 0.00 1.00 0.00 0.00 64.86 65.82 1y2i h ILE 60 Cb 0.29 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 1y2i h ILE 60 CO -0.24 0.17 0.10 0.00 0.00 0.00 0.00 178.15 178.17 1y2i h ALA 61 N 1.17 0.28 -0.40 1.87 0.00 0.22 -2.41 119.26 119.99 1y2i h ALA 61 Ca 0.20 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 1y2i h ALA 61 Cb -0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1y2i h ALA 61 CO -0.04 -0.31 0.06 0.74 0.00 0.00 0.00 179.25 179.70 1y2i h PHE 62 N 0.22 0.61 -0.39 0.00 -1.00 -0.66 -1.61 116.94 114.11 1y2i h PHE 62 Ca 0.10 -0.05 0.03 0.00 2.81 0.00 0.00 57.97 60.86 1y2i h PHE 62 Cb 0.05 -0.18 -0.03 0.00 3.61 0.00 0.00 35.95 39.40 1y2i h PHE 62 CO -0.11 0.55 0.19 1.49 -1.61 0.00 0.00 178.31 178.82 1y2i h GLU 63 N 0.58 0.38 -0.56 1.51 4.81 -0.87 -0.04 114.58 120.38 1y2i h GLU 63 Ca 0.13 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.28 1y2i h GLU 63 Cb 0.28 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1y2i h GLU 63 CO 0.00 0.25 0.13 1.49 -0.73 0.00 0.00 179.01 180.15 1y2i h GLU 64 N 0.39 0.91 -0.08 1.92 4.81 -1.12 -0.74 114.58 120.67 1y2i h GLU 64 Ca 0.17 -0.23 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1y2i h GLU 64 Cb 0.08 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.34 1y2i h GLU 64 CO -0.12 0.85 0.02 1.25 -0.73 0.00 0.00 179.01 180.28 1y2i h LEU 65 N 0.81 0.12 -0.85 1.64 5.85 -0.98 -0.15 115.31 121.75 1y2i h LEU 65 Ca 0.18 -0.23 -0.10 0.00 0.84 0.00 0.00 57.88 58.57 1y2i h LEU 65 Cb 0.36 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1y2i h LEU 65 CO 0.00 0.32 -0.22 1.23 -0.34 0.00 0.00 178.44 179.43 1y2i h GLY 66 N -0.09 0.66 1.04 3.75 0.00 -1.01 -1.41 103.07 106.02 1y2i h GLY 66 Ca 0.02 -0.54 -0.11 0.00 0.00 0.00 0.00 47.33 46.71 1y2i h GLY 66 CO 0.00 0.49 -0.16 1.48 0.00 0.00 0.00 176.54 178.35 1y2i h SER 67 N 0.54 0.90 -0.57 0.19 4.64 -0.98 0.14 113.55 118.42 1y2i h SER 67 Ca 0.08 -0.38 0.08 0.00 -0.47 0.00 0.00 61.79 61.10 1y2i h SER 67 Cb 0.67 -0.25 -0.07 0.00 -0.31 0.00 0.00 62.40 62.45 1y2i h SER 67 CO 0.05 1.08 0.20 -0.61 -0.87 0.00 0.00 176.83 176.68 1y2i h GLN 68 N 0.71 0.37 -0.45 4.77 4.15 -0.85 -2.02 115.11 121.79 1y2i h GLN 68 Ca 0.10 -0.02 -0.08 0.00 0.77 0.00 0.00 58.65 59.42 1y2i h GLN 68 Cb 0.72 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.30 1y2i h GLN 68 CO 0.05 0.24 -0.06 0.00 -1.93 0.00 0.00 178.83 177.14 1y2i h ALA 69 N 1.39 1.05 -0.67 3.38 0.00 -1.01 -2.88 119.26 120.52 1y2i h ALA 69 Ca 0.28 -0.29 0.05 0.00 0.00 0.00 0.00 54.91 54.95 1y2i h ALA 69 Cb 0.34 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 1y2i h ALA 69 CO -0.29 0.58 0.39 -0.09 0.00 0.00 0.00 179.25 179.85 1y2i h ARG 70 N 0.71 0.72 0.00 0.00 2.43 -0.13 -1.79 114.38 116.32 1y2i h ARG 70 Ca 0.13 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 1y2i h ARG 70 Cb 0.52 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 1y2i h ARG 70 CO 0.03 0.48 -0.25 0.00 -1.51 0.00 0.00 179.97 178.72 1y2i h ALA 71 N 1.33 1.04 0.00 2.80 0.00 -1.17 -2.25 119.26 121.00 1y2i h ALA 71 Ca 0.29 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1y2i h ALA 71 Cb 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1y2i h ALA 71 CO -0.15 0.31 -0.13 1.28 0.00 0.00 0.00 179.25 180.56 1y2i n LEU 72 N -3.45 0.34 0.00 0.00 4.77 -0.99 -4.91 117.00 112.76 1y2i n LEU 72 Ca -0.00 0.42 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 1y2i n LEU 72 Cb 0.43 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1y2i n LEU 72 CO 0.34 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 1y2i n GLY 73 N 1.44 0.92 3.87 -0.72 0.00 -0.85 -5.05 105.19 104.80 1y2i n GLY 73 Ca 0.06 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 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 3.17 -0.24 4.61 0.00 -0.71 -4.81 121.76 121.78 1y2i s ALA 74 Ca 0.00 -0.09 0.03 0.00 0.00 0.00 0.00 51.96 51.90 1y2i s ALA 74 Cb 0.00 -2.96 -0.00 0.00 0.00 0.00 0.00 23.12 20.16 1y2i s ALA 74 CO 0.00 -0.40 0.37 -0.40 0.00 0.00 0.00 175.76 175.33 1y2i n ASP 75 N -2.11 0.73 -3.99 0.00 5.75 -0.24 -4.44 116.55 112.25 1y2i n ASP 75 Ca 0.05 -0.86 -0.08 0.00 -0.01 0.00 0.00 54.79 53.88 1y2i n ASP 75 Cb 0.54 0.45 -0.09 0.00 -1.03 0.00 0.00 41.12 41.00 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 -0.69 0.20 -0.16 2.12 0.00 -0.63 -2.69 121.76 119.91 1y2i s ALA 76 Ca 0.02 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 51.02 1y2i s ALA 76 Cb 0.02 0.45 0.03 0.00 0.00 0.00 0.00 23.12 23.63 1y2i s ALA 76 CO 0.07 -0.46 -0.11 0.08 0.00 0.00 0.00 175.76 175.33 1y2i s VAL 77 N -3.91 1.49 0.38 0.00 1.01 0.00 -0.85 120.40 118.53 1y2i s VAL 77 Ca 0.08 -0.71 0.08 0.00 0.00 0.00 0.00 61.98 61.43 1y2i s VAL 77 Cb 0.06 -1.49 -0.05 0.00 0.00 0.00 0.00 36.38 34.90 1y2i s VAL 77 CO -0.09 0.33 0.11 0.68 0.00 0.00 0.00 175.10 176.13 1y2i s VAL 78 N 1.50 2.45 -1.34 2.92 -7.23 -0.14 -1.17 120.40 117.39 1y2i s VAL 78 Ca 0.03 -1.81 -0.02 0.00 -1.81 0.00 0.00 61.98 58.37 1y2i s VAL 78 Cb -0.14 -2.94 0.01 0.00 0.56 0.00 0.00 36.38 33.88 1y2i s VAL 78 CO -0.09 -0.08 0.77 0.61 -0.31 0.00 0.00 175.10 175.99 1y2i n GLY 79 N -1.12 -0.33 3.75 2.32 0.00 -0.08 -0.54 105.19 109.20 1y2i n GLY 79 Ca -0.03 0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 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 -3.59 4.26 -0.06 -0.61 1.01 -0.35 -4.42 121.20 117.44 1y2i s ILE 80 Ca 0.12 1.94 0.05 0.00 0.00 0.00 0.00 60.65 62.77 1y2i s ILE 80 Cb -0.06 -4.26 -0.02 0.00 0.01 0.00 0.00 42.46 38.14 1y2i s ILE 80 CO 0.81 0.47 -0.22 -1.81 0.00 0.00 0.00 174.94 174.19 1y2i s ASP 81 N -0.93 3.36 -0.15 3.58 1.01 0.45 -4.38 116.67 119.61 1y2i s ASP 81 Ca 0.40 -0.42 -0.01 0.00 0.71 0.00 0.00 52.55 53.23 1y2i s ASP 81 Cb -0.24 -0.83 -0.01 0.00 1.01 0.00 0.00 42.92 42.85 1y2i s ASP 81 CO 0.29 0.27 -0.12 -0.63 0.21 0.00 0.00 175.17 175.20 1y2i s ILE 82 N -0.31 3.08 0.06 0.77 1.01 -1.26 -1.29 121.20 123.26 1y2i s ILE 82 Ca 0.01 -0.64 0.05 0.00 0.00 0.00 0.00 60.65 60.08 1y2i s ILE 82 Cb -0.13 -2.32 -0.03 0.00 0.01 0.00 0.00 42.46 40.00 1y2i s ILE 82 CO 0.02 0.51 -0.14 -1.81 0.00 0.00 0.00 174.94 173.52 1y2i s ASP 83 N 0.60 1.65 -0.10 3.58 1.01 0.12 -4.98 116.67 118.55 1y2i s ASP 83 Ca -0.07 -0.58 0.04 0.00 0.71 0.00 0.00 52.55 52.65 1y2i s ASP 83 Cb -0.15 -0.06 -0.00 0.00 1.01 0.00 0.00 42.92 43.71 1y2i s ASP 83 CO 0.03 -0.05 -0.22 -0.31 0.21 0.00 0.00 175.17 174.82 1y2i s TYR 84 N -1.18 2.59 -0.06 4.23 1.51 -1.26 -0.61 117.35 122.57 1y2i s TYR 84 Ca -0.01 -0.93 0.02 0.00 -1.01 0.00 0.00 57.07 55.14 1y2i s TYR 84 Cb -0.09 -1.72 0.01 0.00 -0.11 0.00 0.00 41.96 40.05 1y2i s TYR 84 CO 0.02 -0.35 -0.11 -2.00 -1.11 0.00 0.00 175.55 172.00 1y2i s GLU 85 N 0.26 1.51 0.06 -0.62 2.56 -1.26 -5.03 118.70 116.19 1y2i s GLU 85 Ca -0.15 -0.35 -0.29 0.00 0.00 0.00 0.00 54.97 54.17 1y2i s GLU 85 Cb -0.17 -1.28 -0.05 0.00 2.00 0.00 0.00 34.13 34.63 1y2i s GLU 85 CO 0.08 0.01 0.95 0.99 -0.56 0.00 0.00 175.26 176.73 1y2i s THR 86 N 0.68 4.66 0.15 -1.70 2.01 -1.26 -4.39 115.64 115.79 1y2i s THR 86 Ca -0.14 2.02 0.04 0.00 0.31 0.00 0.00 61.69 63.92 1y2i s THR 86 Cb -0.15 -4.30 -0.05 0.00 0.01 0.00 0.00 72.50 68.01 1y2i s THR 86 CO 0.03 0.27 -0.07 0.68 -0.69 0.00 0.00 174.62 174.83 1y2i s VAL 87 N 0.36 1.02 0.00 3.82 -7.23 -1.26 -4.99 120.40 112.12 1y2i s VAL 87 Ca 0.48 -2.03 0.00 0.00 -1.81 0.00 0.00 61.98 58.62 1y2i s VAL 87 Cb -0.22 -1.91 0.00 0.00 0.56 0.00 0.00 36.38 34.81 1y2i s VAL 87 CO 0.28 -0.69 0.00 0.61 -0.31 0.00 0.00 175.10 175.00 1y2i n GLY 88 N -0.20 0.77 0.20 2.32 0.00 -1.26 -3.67 105.19 103.35 1y2i n GLY 88 Ca -0.09 -2.09 0.05 0.00 0.00 0.00 0.00 46.02 43.89 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 0.00 -0.14 1.61 4.20 -2.01 -3.16 115.11 115.61 1y2i h GLN 89 Ca 0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1y2i h GLN 89 Cb 0.00 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 1y2i h GLN 89 CO 0.00 0.31 -0.08 0.09 -0.67 0.00 0.00 178.83 178.48 1y2i n ASN 90 N -3.88 2.74 -4.37 1.46 5.03 -1.26 -4.96 115.26 110.02 1y2i n ASN 90 Ca -0.02 -3.30 -0.39 0.00 0.87 0.00 0.00 54.58 51.74 1y2i n ASN 90 Cb 0.39 -0.51 -0.05 0.00 -1.02 0.00 0.00 39.78 38.58 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 -1.06 -0.43 2.70 7.41 0.00 -1.20 -5.11 105.19 107.50 1y2i n GLY 91 Ca 0.21 0.10 -0.26 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.54 3.64 -1.79 1.61 7.64 -1.24 -4.86 113.62 116.08 1y2i n SER 92 Ca 0.10 -3.50 -0.00 0.00 1.01 0.00 0.00 58.87 56.48 1y2i n SER 92 Cb 0.47 -0.59 0.01 0.00 -1.01 0.00 0.00 64.21 63.08 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 0.11 0.00 -3.29 -3.43 7.94 -0.90 -3.71 117.00 113.72 1y2i n LEU 94 Ca 0.29 -0.32 0.03 0.00 -1.11 0.00 0.00 56.01 54.91 1y2i n LEU 94 Cb 0.44 0.75 -0.03 0.00 0.53 0.00 0.00 43.42 45.11 1y2i n LEU 94 CO 0.33 -0.11 0.57 -0.69 -1.11 0.00 0.00 177.39 176.38 1y2i s VAL 96 N -2.28 -0.48 -0.07 1.96 1.01 -0.19 -0.64 120.40 119.69 1y2i s VAL 96 Ca 0.08 0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.09 1y2i s VAL 96 Cb -0.01 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 1y2i s VAL 96 CO 0.01 0.00 -0.17 -0.44 0.00 0.00 0.00 175.10 174.50 1y2i s SER 97 N 2.65 3.74 -0.02 3.32 0.01 0.22 -1.96 113.70 121.66 1y2i s SER 97 Ca 0.00 -0.33 0.05 0.00 1.31 0.00 0.00 55.95 56.99 1y2i s SER 97 Cb -0.08 -1.06 -0.01 0.00 0.21 0.00 0.00 66.02 65.07 1y2i s SER 97 CO -0.16 0.26 -0.18 -0.69 0.41 0.00 0.00 173.24 172.89 1y2i s VAL 98 N -0.25 1.43 0.05 3.43 1.01 0.21 0.16 120.40 126.44 1y2i s VAL 98 Ca 0.01 -0.76 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 1y2i s VAL 98 Cb -0.13 -1.19 -0.03 0.00 0.00 0.00 0.00 36.38 35.03 1y2i s VAL 98 CO 0.03 0.40 0.01 -0.94 0.00 0.00 0.00 175.10 174.61 1y2i s SER 99 N -0.35 0.38 0.00 3.32 1.04 -0.41 -1.42 113.70 116.26 1y2i s SER 99 Ca 0.05 -0.85 0.00 0.00 0.48 0.00 0.00 55.95 55.63 1y2i s SER 99 Cb -0.08 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.25 1y2i s SER 99 CO -0.00 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.25 1y2i n GLY 100 N 0.31 0.87 3.08 7.32 0.00 -0.73 -0.41 105.19 115.63 1y2i n GLY 100 Ca -0.16 -0.82 -0.32 0.00 0.00 0.00 0.00 46.02 44.72 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 -2.26 1.89 0.19 2.61 2.01 0.30 -0.95 115.64 119.43 1y2i s THR 101 Ca 0.00 -0.84 -0.30 0.00 0.31 0.00 0.00 61.69 60.86 1y2i s THR 101 Cb 0.00 -1.73 -0.08 0.00 0.01 0.00 0.00 72.50 70.70 1y2i s THR 101 CO 0.00 0.50 1.09 0.00 -0.69 0.00 0.00 174.62 175.52 1y2i s ALA 102 N 1.36 3.37 -0.01 7.40 0.00 -0.31 -0.97 121.76 132.61 1y2i s ALA 102 Ca 0.05 0.81 -0.11 0.00 0.00 0.00 0.00 51.96 52.70 1y2i s ALA 102 Cb -0.13 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.66 1y2i s ALA 102 CO -0.12 -0.19 0.23 0.14 0.00 0.00 0.00 175.76 175.82 1y2i s VAL 103 N -0.35 0.07 -0.04 0.00 -7.23 -0.03 -0.34 120.40 112.48 1y2i s VAL 103 Ca 0.49 -0.57 -0.15 0.00 -1.81 0.00 0.00 61.98 59.94 1y2i s VAL 103 Cb -0.29 -0.53 -0.05 0.00 0.56 0.00 0.00 36.38 36.07 1y2i s VAL 103 CO 0.35 -0.31 0.40 -0.54 -0.31 0.00 0.00 175.10 174.70 1y2i s LYS 104 N -1.33 4.03 0.27 4.82 1.02 -0.46 -1.08 119.74 127.01 1y2i s LYS 104 Ca -0.14 0.38 0.12 0.00 0.02 0.00 0.00 55.97 56.34 1y2i s LYS 104 Cb -0.06 -3.29 -0.05 0.00 -0.52 0.00 0.00 37.83 33.91 1y2i s LYS 104 CO 0.03 0.54 -0.20 0.95 -0.92 0.00 0.00 175.35 175.75 1y2i s THR 105 N -0.57 2.44 -0.08 2.17 -4.23 -1.26 -1.23 115.64 112.88 1y2i s THR 105 Ca 0.23 -2.38 -0.00 0.00 -1.18 0.00 0.00 61.69 58.36 1y2i s THR 105 Cb -0.16 -2.28 0.02 0.00 1.34 0.00 0.00 72.50 71.43 1y2i s THR 105 CO 0.12 -0.39 -0.04 -0.60 -0.54 0.00 0.00 174.62 173.16 1y2i s ARG 106 N -3.47 0.99 0.20 3.99 3.52 0.15 -4.86 118.95 119.47 1y2i s ARG 106 Ca 0.29 -0.07 -0.31 0.00 -0.13 0.00 0.00 55.73 55.51 1y2i s ARG 106 Cb -0.05 -1.16 -0.11 0.00 -1.56 0.00 0.00 34.95 32.07 1y2i s ARG 106 CO 0.14 -0.23 1.58 0.50 -0.81 0.00 0.00 175.30 176.48 1y2i s ARG 107 N 1.63 4.19 0.60 5.12 3.00 -1.26 -1.03 118.95 131.21 1y2i s ARG 107 Ca 0.01 2.42 0.40 0.00 -1.00 0.00 0.00 55.73 57.56 1y2i s ARG 107 Cb -0.13 -3.12 2.01 0.00 0.00 0.00 0.00 34.95 33.72 1y2i s ARG 107 CO -0.05 -0.61 2.20 -0.91 0.00 0.00 0.00 175.30 175.93 1y2i h ASN 108 N 6.31 0.00 -0.01 -2.12 2.35 -1.66 -3.47 115.58 116.98 1y2i h ASN 108 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 1y2i h ASN 108 Cb 1.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.58 1y2i h ASN 108 CO 0.89 0.00 0.00 -0.38 -1.65 0.00 0.00 177.43 176.29