#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oju n ASP 4 N 0.00 -0.77 -0.12 4.52 5.68 -1.26 -5.07 116.55 119.53 2oju n ASP 4 Ca 0.00 -3.15 0.14 0.00 -0.50 0.00 0.00 54.79 51.28 2oju n ASP 4 Cb 0.00 1.75 0.64 0.00 -1.14 0.00 0.00 41.12 42.37 2oju n ASP 4 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2oju n GLY 5 N -0.62 -0.93 0.06 6.12 0.00 -1.26 -5.05 105.19 103.50 2oju n GLY 5 Ca 0.07 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2oju n GLY 5 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oju n GLY 6 N 1.26 -3.29 2.94 -0.02 0.00 -1.26 -4.95 105.19 99.87 2oju n GLY 6 Ca 0.15 -1.82 -0.26 0.00 0.00 0.00 0.00 46.02 44.09 2oju n GLY 6 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2oju s MET 7 N -0.98 1.56 0.17 1.61 -1.94 -1.26 -4.58 119.30 113.88 2oju s MET 7 Ca 0.00 -0.30 0.05 0.00 -1.71 0.00 0.00 55.69 53.73 2oju s MET 7 Cb 0.00 -1.51 -0.05 0.00 2.01 0.00 0.00 34.83 35.28 2oju s MET 7 CO 0.00 -0.17 -0.09 -1.12 -0.01 0.00 0.00 175.02 173.63 2oju s SER 8 N 1.36 1.94 -0.02 3.03 0.01 -0.75 -1.17 113.70 118.11 2oju s SER 8 Ca -0.01 -1.05 0.01 0.00 1.31 0.00 0.00 55.95 56.21 2oju s SER 8 Cb -0.14 -0.03 0.01 0.00 0.21 0.00 0.00 66.02 66.07 2oju s SER 8 CO -0.04 -0.33 -0.02 -0.69 0.41 0.00 0.00 173.24 172.56 2oju s VAL 9 N -3.28 0.26 -0.19 3.43 1.01 0.13 -0.56 120.40 121.20 2oju s VAL 9 Ca 0.20 -0.05 -0.05 0.00 0.00 0.00 0.00 61.98 62.07 2oju s VAL 9 Cb 0.02 -0.28 -0.03 0.00 0.00 0.00 0.00 36.38 36.10 2oju s VAL 9 CO 0.03 0.12 0.00 -0.89 0.00 0.00 0.00 175.10 174.36 2oju s THR 10 N 0.45 4.02 -0.28 3.92 2.01 0.45 0.06 115.64 126.27 2oju s THR 10 Ca -0.05 -0.29 -0.14 0.00 0.31 0.00 0.00 61.69 61.52 2oju s THR 10 Cb -0.08 -2.81 -0.04 0.00 0.01 0.00 0.00 72.50 69.59 2oju s THR 10 CO -0.01 0.44 0.35 -0.76 -0.69 0.00 0.00 174.62 173.95 2oju s LEU 11 N 0.87 4.07 -0.54 4.42 1.43 0.64 -1.24 118.68 128.32 2oju s LEU 11 Ca 0.01 0.22 -0.19 0.00 -1.03 0.00 0.00 54.13 53.13 2oju s LEU 11 Cb -0.14 -2.39 0.07 0.00 0.03 0.00 0.00 46.19 43.77 2oju s LEU 11 CO 0.02 -0.18 0.67 -1.00 0.23 0.00 0.00 176.35 176.09 2oju s HIS 12 N 2.04 3.01 0.25 0.29 3.76 -0.00 -1.58 115.29 123.04 2oju s HIS 12 Ca 0.14 -0.68 0.08 0.00 -0.15 0.00 0.00 55.06 54.45 2oju s HIS 12 Cb -0.16 -3.75 -0.04 0.00 1.11 0.00 0.00 32.58 29.75 2oju s HIS 12 CO 0.10 -1.16 0.14 0.95 -0.85 0.00 0.00 174.74 173.92 2oju s THR 13 N 2.73 4.19 0.15 1.30 -4.23 0.29 0.22 115.64 120.29 2oju s THR 13 Ca 0.14 -1.50 0.12 0.00 -1.18 0.00 0.00 61.69 59.27 2oju s THR 13 Cb -0.21 -3.24 0.12 0.00 1.34 0.00 0.00 72.50 70.52 2oju s THR 13 CO 0.10 -0.33 1.27 0.44 -0.54 0.00 0.00 174.62 175.56 2oju h ASP 14 N 1.70 0.00 0.00 3.99 3.45 -1.72 0.11 116.42 123.94 2oju h ASP 14 Ca -0.47 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.99 2oju h ASP 14 Cb 1.24 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.01 2oju h ASP 14 CO 0.61 0.00 -0.04 1.33 -1.57 0.00 0.00 179.24 179.56 2oju n VAL 15 N -2.11 1.27 0.00 -1.35 0.24 -1.26 -5.05 118.33 110.07 2oju n VAL 15 Ca -0.01 -1.45 0.00 0.00 -2.04 0.00 0.00 64.34 60.84 2oju n VAL 15 Cb 0.41 0.18 0.00 0.00 -1.47 0.00 0.00 33.84 32.96 2oju n VAL 15 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2oju n GLY 16 N -0.87 0.97 3.90 7.63 0.00 0.38 -4.83 105.19 112.37 2oju n GLY 16 Ca 0.08 -2.08 -0.33 0.00 0.00 0.00 0.00 46.02 43.68 2oju n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2oju s ASP 17 N -0.07 6.33 -0.12 1.61 1.01 -1.26 -0.55 116.67 123.61 2oju s ASP 17 Ca 0.00 0.33 -0.01 0.00 0.71 0.00 0.00 52.55 53.59 2oju s ASP 17 Cb 0.00 -1.98 0.03 0.00 1.01 0.00 0.00 42.92 41.98 2oju s ASP 17 CO 0.00 0.26 -0.05 -0.63 0.21 0.00 0.00 175.17 174.96 2oju s ILE 18 N -1.32 0.91 -0.10 0.77 1.01 -0.62 -4.41 121.20 117.44 2oju s ILE 18 Ca 0.27 -0.32 -0.08 0.00 0.00 0.00 0.00 60.65 60.52 2oju s ILE 18 Cb -0.13 -1.02 -0.04 0.00 0.01 0.00 0.00 42.46 41.29 2oju s ILE 18 CO 0.19 0.26 0.19 -0.75 0.00 0.00 0.00 174.94 174.83 2oju s LYS 19 N 1.74 3.54 -0.06 2.79 2.20 0.45 -0.26 119.74 130.15 2oju s LYS 19 Ca 0.04 -0.03 0.02 0.00 -0.36 0.00 0.00 55.97 55.64 2oju s LYS 19 Cb -0.13 -3.20 0.01 0.00 -1.51 0.00 0.00 37.83 33.00 2oju s LYS 19 CO -0.08 0.76 -0.11 0.42 -0.36 0.00 0.00 175.35 175.98 2oju s ILE 20 N -1.02 1.04 -0.09 5.43 1.01 0.11 -2.09 121.20 125.58 2oju s ILE 20 Ca 0.17 -0.44 -0.20 0.00 0.00 0.00 0.00 60.65 60.17 2oju s ILE 20 Cb -0.13 -0.95 -0.04 0.00 0.01 0.00 0.00 42.46 41.35 2oju s ILE 20 CO 0.06 0.33 0.57 -0.70 0.00 0.00 0.00 174.94 175.19 2oju s GLU 21 N 0.58 4.37 -0.23 2.79 2.12 -0.22 -0.70 118.70 127.41 2oju s GLU 21 Ca -0.12 0.63 -0.06 0.00 0.36 0.00 0.00 54.97 55.78 2oju s GLU 21 Cb -0.14 -3.43 -0.03 0.00 0.26 0.00 0.00 34.13 30.79 2oju s GLU 21 CO 0.03 0.14 0.04 0.08 -0.54 0.00 0.00 175.26 175.01 2oju s VAL 22 N 0.61 4.12 -1.03 3.70 1.01 -0.32 -1.66 120.40 126.82 2oju s VAL 22 Ca 0.31 -0.24 -0.07 0.00 0.00 0.00 0.00 61.98 61.97 2oju s VAL 22 Cb -0.16 -2.90 -0.09 0.00 0.00 0.00 0.00 36.38 33.22 2oju s VAL 22 CO 0.14 0.37 2.59 0.49 0.00 0.00 0.00 175.10 178.69 2oju n PHE 23 N 4.71 1.53 0.25 5.22 3.72 -0.10 -4.52 117.46 128.26 2oju n PHE 23 Ca -0.17 -2.27 0.18 0.00 -0.05 0.00 0.00 57.45 55.15 2oju n PHE 23 Cb 0.51 -1.93 0.87 0.00 -0.94 0.00 0.00 39.48 37.99 2oju n PHE 23 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2oju h GLU 25 N 0.00 0.13 -0.05 0.00 3.07 -1.97 -3.06 114.58 112.70 2oju h GLU 25 Ca 0.07 -0.13 -0.21 0.00 -0.50 0.00 0.00 59.36 58.58 2oju h GLU 25 Cb 0.58 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.52 2oju h GLU 25 CO -0.00 0.87 -0.85 0.00 -1.40 0.00 0.00 179.01 177.63 2oju h ARG 26 N -0.55 0.48 -2.19 2.33 2.47 -1.78 -3.38 114.38 111.75 2oju h ARG 26 Ca -0.02 -0.45 -0.59 0.00 -1.26 0.00 0.00 59.98 57.67 2oju h ARG 26 Cb 0.93 0.11 -0.41 0.00 -1.65 0.00 0.00 29.97 28.95 2oju h ARG 26 CO 0.04 1.09 -0.80 0.25 0.56 0.00 0.00 179.97 181.10 2oju n THR 27 N -3.81 1.01 -0.16 2.04 -2.24 -0.06 -4.97 114.28 106.09 2oju n THR 27 Ca -0.06 -4.66 -0.02 0.00 -2.27 0.00 0.00 64.05 57.04 2oju n THR 27 Cb 0.78 -2.03 0.07 0.00 -2.10 0.00 0.00 70.33 67.04 2oju n THR 27 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2oju h PRO 28 N 4.27 0.16 -0.15 -0.78 0.13 -1.73 -1.43 132.00 132.47 2oju h PRO 28 Ca 0.15 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 65.21 2oju h PRO 28 Cb 0.76 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 31.85 2oju h PRO 28 CO 0.67 0.11 -0.14 0.87 -0.23 0.00 0.00 178.00 179.27 2oju h LYS 29 N 0.17 0.36 -1.00 0.86 1.57 -1.94 -0.97 116.57 115.61 2oju h LYS 29 Ca 0.25 -0.19 0.02 0.00 -1.87 0.00 0.00 60.65 58.87 2oju h LYS 29 Cb 0.37 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.63 2oju h LYS 29 CO -0.38 0.74 0.66 1.15 -0.57 0.00 0.00 179.45 181.05 2oju h THR 30 N -0.01 1.22 -0.15 -0.16 2.02 -1.89 -0.30 112.91 113.64 2oju h THR 30 Ca 0.02 -0.45 -0.02 0.00 0.77 0.00 0.00 66.41 66.73 2oju h THR 30 Cb 0.67 -0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.86 2oju h THR 30 CO 0.04 0.24 0.01 0.00 0.37 0.00 0.00 175.52 176.18 2oju h GLU 32 N 0.02 0.37 0.28 0.00 4.57 -0.60 -1.55 114.58 117.68 2oju h GLU 32 Ca 0.04 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.19 2oju h GLU 32 Cb 0.33 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.84 2oju h GLU 32 CO 0.01 0.25 -0.13 -0.97 -1.18 0.00 0.00 179.01 176.98 2oju h ASN 33 N 0.38 -0.32 -0.34 1.04 -1.24 -1.01 -2.31 115.58 111.79 2oju h ASN 33 Ca 0.21 -0.06 0.06 0.00 0.71 0.00 0.00 56.30 57.22 2oju h ASN 33 Cb 0.17 0.08 -0.05 0.00 0.73 0.00 0.00 38.32 39.25 2oju h ASN 33 CO -0.18 -0.14 0.04 0.15 -1.29 0.00 0.00 177.43 176.00 2oju h PHE 34 N -0.47 0.05 -0.37 0.67 3.57 -1.08 -0.90 116.94 118.42 2oju h PHE 34 Ca -0.04 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 2oju h PHE 34 Cb 0.36 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.11 2oju h PHE 34 CO -0.03 -0.02 0.18 -0.07 -2.23 0.00 0.00 178.31 176.14 2oju h LEU 35 N 0.14 0.47 -0.65 0.59 3.38 -1.29 -0.76 115.31 117.20 2oju h LEU 35 Ca 0.16 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2oju h LEU 35 Cb 0.20 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2oju h LEU 35 CO -0.24 0.46 0.32 0.00 0.09 0.00 0.00 178.44 179.07 2oju h ALA 36 N 1.03 0.83 -0.28 1.53 0.00 -1.13 0.28 119.26 121.53 2oju h ALA 36 Ca 0.13 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2oju h ALA 36 Cb 0.11 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2oju h ALA 36 CO -0.02 0.39 -0.20 -0.07 0.00 0.00 0.00 179.25 179.35 2oju h LEU 37 N 0.89 0.50 -0.04 0.00 3.38 -1.02 -1.05 115.31 117.97 2oju h LEU 37 Ca 0.22 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2oju h LEU 37 Cb 0.10 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 2oju h LEU 37 CO -0.03 0.71 -0.01 0.00 0.09 0.00 0.00 178.44 179.20 2oju h ALA 39 N 0.65 1.63 -0.19 0.00 0.00 -0.81 -2.12 119.26 118.42 2oju h ALA 39 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2oju h ALA 39 Cb 0.40 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2oju h ALA 39 CO 0.00 0.27 0.00 -1.13 0.00 0.00 0.00 179.25 178.40 2oju n SER 40 N -4.35 1.06 -0.50 0.00 3.41 -0.41 -4.88 113.62 107.96 2oju n SER 40 Ca -0.01 -2.01 -0.06 0.00 -0.26 0.00 0.00 58.87 56.53 2oju n SER 40 Cb 0.21 -0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 63.99 2oju n SER 40 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2oju n ASN 41 N 0.06 -4.97 -0.18 4.04 3.02 -0.80 -4.89 115.26 111.53 2oju n ASN 41 Ca 0.06 0.16 0.12 0.00 -0.03 0.00 0.00 54.58 54.89 2oju n ASN 41 Cb 0.17 -3.04 0.44 0.00 -0.61 0.00 0.00 39.78 36.74 2oju n ASN 41 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 2oju h TYR 42 N 0.00 0.63 0.00 3.10 3.20 -1.51 -2.09 116.97 120.30 2oju h TYR 42 Ca -0.13 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.76 2oju h TYR 42 Cb 0.82 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.89 2oju h TYR 42 CO 0.43 0.27 -0.59 0.66 -1.64 0.00 0.00 178.16 177.29 2oju n TYR 43 N -4.50 0.29 -1.81 -3.82 4.01 -1.25 -4.77 117.16 105.31 2oju n TYR 43 Ca 0.14 0.08 -0.42 0.00 -0.16 0.00 0.00 57.90 57.54 2oju n TYR 43 Cb 0.42 -0.47 -0.03 0.00 -0.31 0.00 0.00 39.34 38.95 2oju n TYR 43 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 2oju s ASN 44 N -3.67 6.49 0.00 7.72 0.01 -0.79 -1.21 114.94 123.49 2oju s ASN 44 Ca 0.08 2.69 0.00 0.00 -0.71 0.00 0.00 52.86 54.93 2oju s ASN 44 Cb 0.15 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 39.23 2oju s ASN 44 CO 0.71 -0.93 0.00 0.61 -1.51 0.00 0.00 177.10 175.98 2oju n GLY 45 N 4.02 2.99 3.74 0.66 0.00 -0.04 -5.03 105.19 111.55 2oju n GLY 45 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 2oju n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oju s ILE 47 N -1.35 3.03 -0.65 0.00 -4.36 -1.26 -0.67 121.20 115.94 2oju s ILE 47 Ca 0.76 -2.11 -0.24 0.00 -0.26 0.00 0.00 60.65 58.81 2oju s ILE 47 Cb -0.39 -2.60 0.06 0.00 1.25 0.00 0.00 42.46 40.78 2oju s ILE 47 CO 0.44 -0.37 1.01 -0.36 0.24 0.00 0.00 174.94 175.90 2oju s PHE 48 N -2.37 2.64 -0.45 1.37 0.40 -0.98 -4.33 117.98 114.26 2oju s PHE 48 Ca 0.30 -0.34 0.23 0.00 -0.60 0.00 0.00 56.93 56.52 2oju s PHE 48 Cb -0.06 -4.30 0.35 0.00 0.51 0.00 0.00 43.02 39.52 2oju s PHE 48 CO 0.18 -1.65 1.56 1.12 0.70 0.00 0.00 175.22 177.13 2oju h HIS 49 N 9.58 0.00 -3.19 0.36 2.07 -1.76 -3.40 115.15 118.81 2oju h HIS 49 Ca -0.28 0.00 -0.48 0.00 -2.85 0.00 0.00 60.37 56.76 2oju h HIS 49 Cb 1.07 0.00 -0.40 0.00 2.57 0.00 0.00 27.41 30.65 2oju h HIS 49 CO 0.98 0.00 -0.76 0.50 -3.07 0.00 0.00 177.93 175.58 2oju s ARG 50 N -3.21 0.41 -0.30 5.12 3.52 -1.22 -3.80 118.95 119.46 2oju s ARG 50 Ca 0.07 -0.21 0.02 0.00 -0.13 0.00 0.00 55.73 55.47 2oju s ARG 50 Cb 0.06 -1.82 0.09 0.00 -1.56 0.00 0.00 34.95 31.72 2oju s ARG 50 CO 0.68 -0.60 0.03 1.21 -0.81 0.00 0.00 175.30 175.80 2oju s ASN 51 N 1.98 4.32 -0.42 -2.12 2.47 -0.53 0.05 114.94 120.69 2oju s ASN 51 Ca 0.01 -1.72 -0.06 0.00 0.42 0.00 0.00 52.86 51.50 2oju s ASN 51 Cb -0.16 -1.30 0.10 0.00 -1.45 0.00 0.00 41.25 38.44 2oju s ASN 51 CO -0.08 -0.34 0.24 -0.63 -3.72 0.00 0.00 177.10 172.57 2oju s ILE 52 N 1.23 3.77 0.22 -5.21 1.01 -0.57 -4.83 121.20 116.83 2oju s ILE 52 Ca 0.05 -1.73 -0.29 0.00 0.00 0.00 0.00 60.65 58.68 2oju s ILE 52 Cb -0.19 -3.44 -0.16 0.00 0.01 0.00 0.00 42.46 38.69 2oju s ILE 52 CO -0.12 -0.60 0.82 1.17 0.00 0.00 0.00 174.94 176.20 2oju n LYS 53 N 4.77 0.65 0.00 2.79 4.81 -1.26 -0.70 118.16 129.22 2oju n LYS 53 Ca -0.07 0.23 0.00 0.00 -0.87 0.00 0.00 58.31 57.60 2oju n LYS 53 Cb 0.42 -1.46 0.00 0.00 0.02 0.00 0.00 35.03 34.01 2oju n LYS 53 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2oju n GLY 54 N 1.69 2.15 0.00 3.14 0.00 -1.26 -4.77 105.19 106.14 2oju n GLY 54 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2oju n GLY 54 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2oju n PHE 55 N -1.91 0.00 -3.75 1.61 7.35 0.12 -4.41 117.46 116.48 2oju n PHE 55 Ca 0.00 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.64 2oju n PHE 55 Cb 0.00 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 39.81 2oju n PHE 55 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2oju s MET 56 N 0.00 1.34 -0.04 -4.13 0.23 -0.94 -1.28 119.30 114.48 2oju s MET 56 Ca 0.00 -0.71 0.06 0.00 -1.03 0.00 0.00 55.69 54.01 2oju s MET 56 Cb 0.00 0.47 -0.01 0.00 -1.53 0.00 0.00 34.83 33.76 2oju s MET 56 CO 0.00 -0.61 -0.23 0.54 -2.03 0.00 0.00 175.02 172.69 2oju s VAL 57 N -3.48 1.89 0.05 5.16 0.11 -0.38 -1.51 120.40 122.24 2oju s VAL 57 Ca 0.11 -0.99 0.08 0.00 -2.93 0.00 0.00 61.98 58.25 2oju s VAL 57 Cb -0.03 -1.59 -0.03 0.00 -1.53 0.00 0.00 36.38 33.21 2oju s VAL 57 CO 0.02 0.53 -0.22 -1.58 -3.33 0.00 0.00 175.10 170.52 2oju s GLN 58 N -0.29 1.93 0.00 1.54 0.74 0.11 -1.39 119.66 122.29 2oju s GLN 58 Ca 0.01 -1.05 0.00 0.00 0.05 0.00 0.00 55.36 54.37 2oju s GLN 58 Cb -0.12 -2.09 0.00 0.00 1.10 0.00 0.00 33.01 31.90 2oju s GLN 58 CO 0.02 0.52 0.00 -2.37 -0.55 0.00 0.00 175.29 172.91 2oju n THR 59 N 1.60 0.00 -0.52 -0.34 5.66 -0.74 -2.09 114.28 117.84 2oju n THR 59 Ca -0.17 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.83 2oju n THR 59 Cb 0.52 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 2oju n THR 59 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2oju n GLY 60 N 0.00 0.72 3.06 1.09 0.00 -1.26 -2.17 105.19 106.62 2oju n GLY 60 Ca 0.00 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.16 2oju n GLY 60 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2oju s ASP 61 N -2.50 4.55 0.32 1.61 2.15 -1.26 -3.34 116.67 118.21 2oju s ASP 61 Ca 0.00 -1.61 0.07 0.00 0.43 0.00 0.00 52.55 51.44 2oju s ASP 61 Cb 0.00 -1.58 0.78 0.00 -0.30 0.00 0.00 42.92 41.83 2oju s ASP 61 CO 0.00 -0.25 1.79 -0.65 -0.17 0.00 0.00 175.17 175.90 2oju h PRO 62 N 7.73 0.71 0.00 4.34 0.11 -1.88 0.31 132.00 143.32 2oju h PRO 62 Ca -0.15 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.87 2oju h PRO 62 Cb 1.03 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.98 2oju h PRO 62 CO 0.48 0.47 -0.22 1.79 -0.21 0.00 0.00 178.00 180.30 2oju h THR 63 N 0.73 0.56 0.00 -1.15 1.35 -1.94 -3.47 112.91 108.99 2oju h THR 63 Ca 0.56 -1.09 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 2oju h THR 63 Cb 0.92 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 2oju h THR 63 CO -0.34 0.22 0.00 0.61 -0.25 0.00 0.00 175.52 175.75 2oju n GLY 64 N 0.10 1.37 0.16 5.82 0.00 0.10 -4.85 105.19 107.88 2oju n GLY 64 Ca -0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.06 2oju n GLY 64 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2oju h THR 65 N 0.00 0.77 0.00 2.61 1.35 -1.90 -3.47 112.91 112.27 2oju h THR 65 Ca 0.00 -1.91 0.00 0.00 -0.55 0.00 0.00 66.41 63.95 2oju h THR 65 Cb 0.00 2.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.67 2oju h THR 65 CO 0.00 0.41 0.00 0.61 -0.25 0.00 0.00 175.52 176.29 2oju n GLY 66 N 0.94 0.68 0.00 5.82 0.00 -1.26 -4.89 105.19 106.48 2oju n GLY 66 Ca 0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.10 2oju n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oju n ARG 67 N -2.00 1.77 -1.28 1.61 1.74 -1.26 -5.04 116.66 112.20 2oju n ARG 67 Ca 0.00 -0.05 -0.03 0.00 -0.77 0.00 0.00 57.85 57.00 2oju n ARG 67 Cb 0.00 -1.19 0.01 0.00 -1.02 0.00 0.00 32.46 30.26 2oju n ARG 67 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2oju n GLY 68 N 1.50 1.99 0.00 -0.13 0.00 -1.26 -5.08 105.19 102.20 2oju n GLY 68 Ca 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 43.88 2oju n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oju n GLY 69 N 4.10 2.55 3.44 -0.02 0.00 -1.26 -4.76 105.19 109.24 2oju n GLY 69 Ca 0.02 -1.63 -0.10 0.00 0.00 0.00 0.00 46.02 44.31 2oju n GLY 69 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2oju s ASN 70 N 0.00 -0.12 0.88 1.61 3.84 -1.26 -4.51 114.94 115.38 2oju s ASN 70 Ca 0.00 -0.66 -0.14 0.00 0.21 0.00 0.00 52.86 52.27 2oju s ASN 70 Cb 0.00 0.51 0.14 0.00 -0.55 0.00 0.00 41.25 41.35 2oju s ASN 70 CO 0.00 -0.98 1.25 -0.94 -2.79 0.00 0.00 177.10 173.64 2oju s SER 71 N -2.92 3.85 0.50 -4.21 1.04 -1.24 -3.78 113.70 106.94 2oju s SER 71 Ca 0.13 0.54 0.22 0.00 0.48 0.00 0.00 55.95 57.31 2oju s SER 71 Cb 0.01 -0.82 1.30 0.00 0.10 0.00 0.00 66.02 66.61 2oju s SER 71 CO -0.02 -2.30 2.06 -0.29 0.98 0.00 0.00 173.24 173.68 2oju h ILE 72 N -1.33 0.81 -0.02 -1.02 6.09 -1.86 -0.80 117.51 119.38 2oju h ILE 72 Ca -0.45 -0.50 0.00 0.00 -1.37 0.00 0.00 64.86 62.54 2oju h ILE 72 Cb 1.28 1.29 0.00 0.00 0.47 0.00 0.00 36.82 39.87 2oju h ILE 72 CO 0.53 0.13 0.00 0.79 -3.07 0.00 0.00 178.15 176.52 2oju n TRP 73 N -3.98 0.03 -0.60 2.19 8.01 -1.26 -4.89 117.44 116.93 2oju n TRP 73 Ca -0.02 -0.01 0.00 0.00 -1.31 0.00 0.00 57.50 56.15 2oju n TRP 73 Cb 0.22 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.52 2oju n TRP 73 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2oju n GLY 74 N 0.99 1.04 3.02 6.99 0.00 -0.31 -4.97 105.19 111.96 2oju n GLY 74 Ca 0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.09 2oju n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oju s LYS 75 N -0.24 0.43 0.67 1.61 -2.85 -1.26 -4.81 119.74 113.28 2oju s LYS 75 Ca 0.00 -0.62 -0.17 0.00 -1.00 0.00 0.00 55.97 54.18 2oju s LYS 75 Cb 0.00 -0.17 -0.01 0.00 -2.06 0.00 0.00 37.83 35.59 2oju s LYS 75 CO 0.00 0.02 1.08 1.63 0.10 0.00 0.00 175.35 178.18 2oju n LYS 76 N 1.72 0.79 -4.42 1.78 4.76 -1.26 -4.49 118.16 117.03 2oju n LYS 76 Ca -0.22 0.32 -0.21 0.00 -2.87 0.00 0.00 58.31 55.34 2oju n LYS 76 Cb 0.55 -2.31 -0.10 0.00 -1.84 0.00 0.00 35.03 31.33 2oju n LYS 76 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 2oju s PHE 77 N -1.61 1.92 0.77 2.13 -0.71 -0.95 -4.89 117.98 114.64 2oju s PHE 77 Ca 0.77 -0.77 -0.12 0.00 -1.04 0.00 0.00 56.93 55.76 2oju s PHE 77 Cb -0.37 -1.13 0.06 0.00 -1.21 0.00 0.00 43.02 40.36 2oju s PHE 77 CO 0.46 0.19 1.14 -1.21 -1.34 0.00 0.00 175.22 174.46 2oju s GLU 78 N -3.77 2.06 0.52 1.99 8.01 -1.26 -2.87 118.70 123.38 2oju s GLU 78 Ca 0.31 1.45 -0.14 0.00 0.01 0.00 0.00 54.97 56.59 2oju s GLU 78 Cb 0.05 -1.85 -0.07 0.00 -4.31 0.00 0.00 34.13 27.95 2oju s GLU 78 CO 0.12 -1.83 0.96 -0.51 0.01 0.00 0.00 175.26 174.01 2oju s ASP 79 N -2.71 6.53 -0.48 -0.19 1.01 -1.26 -4.89 116.67 114.68 2oju s ASP 79 Ca 0.67 1.47 0.04 0.00 0.71 0.00 0.00 52.55 55.44 2oju s ASP 79 Cb -0.22 -2.47 0.17 0.00 1.01 0.00 0.00 42.92 41.41 2oju s ASP 79 CO 0.51 -0.61 0.36 -1.61 0.21 0.00 0.00 175.17 174.03 2oju s GLU 80 N -4.24 1.28 0.61 8.23 2.02 -1.26 -5.03 118.70 120.31 2oju s GLU 80 Ca 0.57 -2.36 -0.09 0.00 0.02 0.00 0.00 54.97 53.11 2oju s GLU 80 Cb -0.10 -1.95 -0.02 0.00 0.10 0.00 0.00 34.13 32.17 2oju s GLU 80 CO 0.35 -1.34 0.98 0.71 0.02 0.00 0.00 175.26 175.99 2oju s TYR 81 N -0.23 3.47 -0.27 1.61 2.02 -1.26 -4.61 117.35 118.08 2oju s TYR 81 Ca 0.29 1.02 -0.25 0.00 -0.37 0.00 0.00 57.07 57.76 2oju s TYR 81 Cb -0.01 -2.74 0.08 0.00 -0.40 0.00 0.00 41.96 38.88 2oju s TYR 81 CO -0.17 -0.77 0.76 0.45 -1.57 0.00 0.00 175.55 174.25 2oju s SER 82 N -4.24 -0.70 0.14 2.29 0.15 -1.26 -5.02 113.70 105.05 2oju s SER 82 Ca 0.54 1.35 0.23 0.00 0.70 0.00 0.00 55.95 58.77 2oju s SER 82 Cb -0.11 1.36 0.91 0.00 -1.71 0.00 0.00 66.02 66.47 2oju s SER 82 CO 0.50 -0.24 1.72 -1.84 1.20 0.00 0.00 173.24 174.58 2oju n GLU 83 N 2.58 0.14 0.05 5.44 0.00 -1.26 -2.67 120.64 124.92 2oju n GLU 83 Ca -0.14 0.25 -0.05 0.00 0.00 0.00 0.00 57.16 57.22 2oju n GLU 83 Cb 0.55 -1.71 -0.10 0.00 0.00 0.00 0.00 31.44 30.19 2oju n GLU 83 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.13 179.01 2oju h TYR 84 N 0.00 0.00 -3.68 -1.84 0.05 -2.03 -3.43 116.97 106.03 2oju h TYR 84 Ca 0.00 0.00 -0.68 0.00 0.05 0.00 0.00 58.73 58.10 2oju h TYR 84 Cb 0.47 0.00 -0.20 0.00 1.01 0.00 0.00 36.73 38.01 2oju h TYR 84 CO 0.00 0.89 -0.49 -0.51 -1.05 0.00 0.00 178.16 177.01 2oju s LEU 85 N -6.44 4.53 0.08 3.88 1.43 -1.09 -5.07 118.68 116.00 2oju s LEU 85 Ca -0.00 -0.50 -0.00 0.00 -1.03 0.00 0.00 54.13 52.59 2oju s LEU 85 Cb 0.09 -2.12 -0.04 0.00 0.03 0.00 0.00 46.19 44.15 2oju s LEU 85 CO 0.81 -0.26 -0.02 -0.54 0.23 0.00 0.00 176.35 176.57 2oju s LYS 86 N 1.70 0.75 -1.41 1.70 1.02 -1.26 -4.61 119.74 117.62 2oju s LYS 86 Ca 0.06 -1.30 -0.08 0.00 0.02 0.00 0.00 55.97 54.66 2oju s LYS 86 Cb -0.18 0.10 0.06 0.00 -0.52 0.00 0.00 37.83 37.30 2oju s LYS 86 CO 0.10 -0.12 2.42 0.72 -0.92 0.00 0.00 175.35 177.55 2oju n HIS 87 N 0.02 2.72 1.01 3.18 8.25 -1.26 -4.58 115.22 124.56 2oju n HIS 87 Ca -0.12 -2.91 0.11 0.00 -0.26 0.00 0.00 57.72 54.54 2oju n HIS 87 Cb 0.62 -2.12 -0.03 0.00 1.12 0.00 0.00 29.99 29.58 2oju n HIS 87 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2oju n ASN 88 N 3.17 1.23 -3.85 0.41 2.04 -1.26 0.04 115.26 117.03 2oju n ASN 88 Ca 0.61 -1.06 -0.16 0.00 -0.44 0.00 0.00 54.58 53.54 2oju n ASN 88 Cb 0.28 0.74 -0.09 0.00 -2.53 0.00 0.00 39.78 38.18 2oju n ASN 88 CO 0.00 0.00 0.00 0.68 -0.44 0.00 0.00 177.26 177.50 2oju s VAL 89 N -2.83 0.04 0.39 3.53 -7.23 -1.26 -4.46 120.40 108.58 2oju s VAL 89 Ca 0.12 -2.00 -0.25 0.00 -1.81 0.00 0.00 61.98 58.04 2oju s VAL 89 Cb 0.17 -2.50 -0.09 0.00 0.56 0.00 0.00 36.38 34.52 2oju s VAL 89 CO 0.76 0.00 1.06 -0.60 -0.31 0.00 0.00 175.10 176.01 2oju s ARG 90 N -3.85 4.19 0.00 4.82 3.52 -1.26 -3.87 118.95 122.51 2oju s ARG 90 Ca 0.39 1.56 0.00 0.00 -0.13 0.00 0.00 55.73 57.56 2oju s ARG 90 Cb 0.05 -2.61 0.00 0.00 -1.56 0.00 0.00 34.95 30.83 2oju s ARG 90 CO 0.19 -0.13 0.00 0.41 -0.81 0.00 0.00 175.30 174.96 2oju n GLY 91 N 0.45 0.53 3.80 8.12 0.00 0.14 -4.82 105.19 113.41 2oju n GLY 91 Ca 0.04 -0.86 -0.37 0.00 0.00 0.00 0.00 46.02 44.83 2oju n GLY 91 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oju s VAL 92 N -2.00 4.54 -0.23 1.61 1.01 -1.25 -0.19 120.40 123.89 2oju s VAL 92 Ca 0.00 1.38 -0.04 0.00 0.00 0.00 0.00 61.98 63.32 2oju s VAL 92 Cb 0.00 -3.93 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 2oju s VAL 92 CO 0.00 0.32 -0.03 -0.69 0.00 0.00 0.00 175.10 174.70 2oju s VAL 93 N -1.38 3.43 0.19 2.92 1.01 0.23 -1.08 120.40 125.71 2oju s VAL 93 Ca 0.40 -0.51 0.05 0.00 0.00 0.00 0.00 61.98 61.92 2oju s VAL 93 Cb -0.19 -2.58 -0.05 0.00 0.00 0.00 0.00 36.38 33.57 2oju s VAL 93 CO 0.22 0.39 -0.07 -0.44 0.00 0.00 0.00 175.10 175.21 2oju s SER 94 N 1.48 1.95 -0.15 3.32 0.01 -0.31 -1.24 113.70 118.76 2oju s SER 94 Ca 0.05 -1.10 -0.19 0.00 1.31 0.00 0.00 55.95 56.03 2oju s SER 94 Cb -0.14 -0.03 -0.04 0.00 0.21 0.00 0.00 66.02 66.02 2oju s SER 94 CO -0.03 -0.38 0.53 -0.04 0.41 0.00 0.00 173.24 173.73 2oju s MET 95 N -3.78 4.28 0.70 12.44 -1.94 -0.28 -0.08 119.30 130.63 2oju s MET 95 Ca 0.22 0.49 -0.11 0.00 -1.71 0.00 0.00 55.69 54.58 2oju s MET 95 Cb 0.03 -3.50 0.01 0.00 2.01 0.00 0.00 34.83 33.38 2oju s MET 95 CO 0.05 -0.01 1.07 0.00 -0.01 0.00 0.00 175.02 176.12 2oju s ALA 96 N 1.16 2.77 0.22 3.03 0.00 -0.59 -4.19 121.76 124.17 2oju s ALA 96 Ca 0.26 -0.14 -0.12 0.00 0.00 0.00 0.00 51.96 51.97 2oju s ALA 96 Cb -0.15 -3.09 0.05 0.00 0.00 0.00 0.00 23.12 19.92 2oju s ALA 96 CO 0.11 -1.15 0.61 0.27 0.00 0.00 0.00 175.76 175.60 2oju n ASN 97 N -3.05 -1.47 -2.36 0.00 0.23 -1.26 -4.53 115.26 102.82 2oju n ASN 97 Ca 0.07 -1.94 -0.17 0.00 -0.53 0.00 0.00 54.58 52.01 2oju n ASN 97 Cb 0.55 2.43 0.03 0.00 -2.08 0.00 0.00 39.78 40.70 2oju n ASN 97 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2oju n ASN 98 N -1.27 3.72 0.00 0.53 3.02 -1.26 -5.08 115.26 114.91 2oju n ASN 98 Ca -0.05 -3.20 0.00 0.00 -0.03 0.00 0.00 54.58 51.31 2oju n ASN 98 Cb 0.41 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2oju n ASN 98 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2oju n GLY 99 N -0.59 2.15 3.48 7.41 0.00 -1.26 -4.97 105.19 111.41 2oju n GLY 99 Ca 0.31 -2.09 -0.46 0.00 0.00 0.00 0.00 46.02 43.77 2oju n GLY 99 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2oju n PRO 100 N 0.06 0.62 -3.86 1.61 -0.04 -1.26 -3.28 135.00 128.84 2oju n PRO 100 Ca 0.00 0.22 -0.33 0.00 -0.04 0.00 0.00 63.50 63.35 2oju n PRO 100 Cb 0.00 -1.39 0.02 0.00 -0.04 0.00 0.00 33.50 32.09 2oju n PRO 100 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2oju n ASN 101 N 1.64 -3.41 -1.54 3.54 3.02 -1.26 -4.91 115.26 112.32 2oju n ASN 101 Ca 0.14 -1.08 0.04 0.00 -0.03 0.00 0.00 54.58 53.64 2oju n ASN 101 Cb 0.29 -2.87 0.03 0.00 -0.61 0.00 0.00 39.78 36.61 2oju n ASN 101 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2oju n THR 102 N -4.44 0.22 -2.18 3.41 -2.24 -1.21 -4.54 114.28 103.31 2oju n THR 102 Ca -0.17 -1.27 -0.41 0.00 -2.27 0.00 0.00 64.05 59.93 2oju n THR 102 Cb 0.62 0.94 -0.03 0.00 -2.10 0.00 0.00 70.33 69.76 2oju n THR 102 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2oju s ASN 103 N -2.20 6.86 0.00 3.42 0.01 -1.14 -4.48 114.94 117.41 2oju s ASN 103 Ca 0.34 2.44 0.00 0.00 -0.71 0.00 0.00 52.86 54.93 2oju s ASN 103 Cb 0.38 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 39.43 2oju s ASN 103 CO -0.15 -0.56 0.00 0.61 -1.51 0.00 0.00 177.10 175.49 2oju n GLY 104 N 2.37 1.41 0.00 0.66 0.00 -1.26 -2.23 105.19 106.14 2oju n GLY 104 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2oju n GLY 104 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2oju n SER 105 N 0.00 4.51 -4.74 1.61 3.41 -1.25 -3.63 113.62 113.53 2oju n SER 105 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 2oju n SER 105 Cb 0.00 0.46 -0.02 0.00 -0.26 0.00 0.00 64.21 64.38 2oju n SER 105 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2oju s GLN 106 N -1.90 4.18 0.21 4.33 -0.21 -1.21 -4.72 119.66 120.33 2oju s GLN 106 Ca 0.00 2.47 -0.02 0.00 0.02 0.00 0.00 55.36 57.83 2oju s GLN 106 Cb 0.00 -3.08 -0.04 0.00 1.00 0.00 0.00 33.01 30.89 2oju s GLN 106 CO 0.00 -0.60 0.18 -0.59 -2.12 0.00 0.00 175.29 172.16 2oju s PHE 107 N 0.46 1.08 0.08 0.91 -0.12 -0.92 -1.54 117.98 117.93 2oju s PHE 107 Ca 0.66 -1.31 -0.06 0.00 -0.05 0.00 0.00 56.93 56.17 2oju s PHE 107 Cb -0.46 -0.47 -0.02 0.00 -0.63 0.00 0.00 43.02 41.45 2oju s PHE 107 CO 0.40 -0.69 0.12 -0.59 -0.05 0.00 0.00 175.22 174.41 2oju s PHE 108 N -4.12 0.30 -0.13 3.49 -0.71 0.88 -1.80 117.98 115.89 2oju s PHE 108 Ca 0.37 -0.76 0.03 0.00 -1.04 0.00 0.00 56.93 55.53 2oju s PHE 108 Cb 0.06 -0.18 0.01 0.00 -1.21 0.00 0.00 43.02 41.70 2oju s PHE 108 CO 0.12 -0.50 -0.23 0.42 -1.34 0.00 0.00 175.22 173.70 2oju s ILE 109 N -3.89 2.08 0.31 -4.49 1.01 -0.49 -1.16 121.20 114.57 2oju s ILE 109 Ca 0.07 -0.99 -0.20 0.00 0.00 0.00 0.00 60.65 59.53 2oju s ILE 109 Cb 0.06 -1.82 -0.09 0.00 0.01 0.00 0.00 42.46 40.62 2oju s ILE 109 CO -0.10 0.55 0.81 0.42 0.00 0.00 0.00 174.94 176.63 2oju s THR 110 N 0.63 4.49 -0.96 2.92 -4.23 -0.24 -1.24 115.64 117.01 2oju s THR 110 Ca -0.12 1.35 0.24 0.00 -1.18 0.00 0.00 61.69 61.98 2oju s THR 110 Cb -0.16 -3.78 -0.04 0.00 1.34 0.00 0.00 72.50 69.86 2oju s THR 110 CO 0.02 0.00 1.31 -1.22 -0.54 0.00 0.00 174.62 174.19 2oju n TYR 111 N 0.17 0.04 -3.97 3.99 0.53 -0.40 0.27 117.16 117.79 2oju n TYR 111 Ca 0.02 0.01 0.01 0.00 -1.02 0.00 0.00 57.90 56.92 2oju n TYR 111 Cb 0.52 -0.24 0.02 0.00 -1.03 0.00 0.00 39.34 38.60 2oju n TYR 111 CO 0.00 0.00 0.00 0.20 -1.02 0.00 0.00 176.86 176.04 2oju s GLY 112 N -3.08 -0.02 0.23 2.72 0.00 -1.26 -4.65 107.32 101.27 2oju s GLY 112 Ca 0.10 -0.14 -0.31 0.00 0.00 0.00 0.00 44.72 44.37 2oju s GLY 112 CO 0.73 4.74 1.40 1.17 0.00 0.00 0.00 173.10 181.14 2oju n LYS 113 N -0.85 1.99 -3.08 2.90 4.81 -1.26 -4.59 118.16 118.07 2oju n LYS 113 Ca 0.02 0.71 -0.20 0.00 -0.87 0.00 0.00 58.31 57.97 2oju n LYS 113 Cb 0.59 -2.36 -0.04 0.00 0.02 0.00 0.00 35.03 33.24 2oju n LYS 113 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2oju n GLN 114 N 2.05 0.69 0.21 1.64 1.13 0.11 -4.99 117.38 118.21 2oju n GLN 114 Ca 0.12 -2.82 0.18 0.00 -1.94 0.00 0.00 57.00 52.54 2oju n GLN 114 Cb 0.31 -1.31 0.83 0.00 0.11 0.00 0.00 30.24 30.18 2oju n GLN 114 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 2oju h PRO 115 N 4.12 0.00 0.00 -1.09 0.13 -1.93 -2.08 132.00 131.15 2oju h PRO 115 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 2oju h PRO 115 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 2oju h PRO 115 CO 0.41 0.00 0.00 -2.39 -0.23 0.00 0.00 178.00 175.79 2oju n HIS 116 N -3.55 0.00 0.32 1.56 1.44 -1.26 -2.59 115.22 111.14 2oju n HIS 116 Ca 0.02 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.84 2oju n HIS 116 Cb 0.40 -0.30 -0.05 0.00 0.12 0.00 0.00 29.99 30.16 2oju n HIS 116 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2oju n LEU 117 N -1.30 0.51 -4.72 2.39 4.77 -0.78 -4.90 117.00 112.96 2oju n LEU 117 Ca 0.09 0.03 -0.43 0.00 -0.03 0.00 0.00 56.01 55.68 2oju n LEU 117 Cb 0.16 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.18 2oju n LEU 117 CO 0.15 -0.01 1.22 0.47 -1.33 0.00 0.00 177.39 177.90 2oju n ASP 118 N -2.18 3.63 -0.41 -1.43 8.00 -1.07 -2.03 116.55 121.06 2oju n ASP 118 Ca -0.00 1.12 -0.05 0.00 0.71 0.00 0.00 54.79 56.57 2oju n ASP 118 Cb 0.49 -1.55 -0.02 0.00 -0.02 0.00 0.00 41.12 40.02 2oju n ASP 118 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2oju n MET 119 N 2.59 -0.86 0.00 -1.24 2.81 -1.26 -4.76 117.12 114.40 2oju n MET 119 Ca 0.11 0.56 0.00 0.00 -1.81 0.00 0.00 57.70 56.57 2oju n MET 119 Cb 0.35 -4.41 0.00 0.00 -0.71 0.00 0.00 33.22 28.45 2oju n MET 119 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2oju n LYS 120 N -1.87 2.71 -4.21 0.03 5.02 -0.86 -5.04 118.16 113.94 2oju n LYS 120 Ca -0.05 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.04 2oju n LYS 120 Cb 0.30 -0.77 -0.16 0.00 -0.02 0.00 0.00 35.03 34.38 2oju n LYS 120 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2oju s TYR 121 N -1.13 0.79 -0.06 2.13 1.51 -1.01 -4.89 117.35 114.70 2oju s TYR 121 Ca 0.00 -0.22 -0.30 0.00 -1.01 0.00 0.00 57.07 55.54 2oju s TYR 121 Cb 0.00 -0.67 -0.05 0.00 -0.11 0.00 0.00 41.96 41.13 2oju s TYR 121 CO 0.00 -0.18 1.59 0.99 -1.11 0.00 0.00 175.55 176.84 2oju s THR 122 N 0.81 3.65 -0.00 -0.71 2.01 -1.26 -4.85 115.64 115.28 2oju s THR 122 Ca -0.11 0.83 -0.20 0.00 0.31 0.00 0.00 61.69 62.51 2oju s THR 122 Cb -0.14 -3.53 -0.05 0.00 0.01 0.00 0.00 72.50 68.78 2oju s THR 122 CO 0.01 -0.06 0.58 -0.69 -0.69 0.00 0.00 174.62 173.76 2oju s VAL 123 N 3.78 4.91 0.00 3.82 1.01 -1.26 -1.13 120.40 131.53 2oju s VAL 123 Ca 0.70 1.21 0.00 0.00 0.00 0.00 0.00 61.98 63.90 2oju s VAL 123 Cb -0.32 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.14 2oju s VAL 123 CO 0.28 0.43 0.27 2.22 0.00 0.00 0.00 175.10 178.30 2oju n PHE 124 N 2.65 0.00 -3.74 5.22 -1.74 -0.38 -4.87 117.46 114.60 2oju n PHE 124 Ca -0.07 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.82 2oju n PHE 124 Cb 0.51 0.01 -0.00 0.00 1.52 0.00 0.00 39.48 41.52 2oju n PHE 124 CO 0.00 0.00 0.00 0.20 -0.56 0.00 0.00 176.76 176.40 2oju s GLY 125 N 0.00 -0.26 -0.03 4.97 0.00 -1.12 -0.92 107.32 109.95 2oju s GLY 125 Ca 0.00 0.33 -0.08 0.00 0.00 0.00 0.00 44.72 44.97 2oju s GLY 125 CO 0.00 1.32 0.18 1.25 0.00 0.00 0.00 173.10 175.85 2oju s LYS 126 N -2.50 0.39 -0.27 2.90 2.20 -0.67 -0.60 119.74 121.20 2oju s LYS 126 Ca 0.17 -0.08 -0.29 0.00 -0.36 0.00 0.00 55.97 55.41 2oju s LYS 126 Cb 0.02 0.17 -0.00 0.00 -1.51 0.00 0.00 37.83 36.51 2oju s LYS 126 CO -0.01 -0.08 1.26 0.08 -0.36 0.00 0.00 175.35 176.23 2oju s VAL 127 N -0.72 4.24 -1.75 4.02 1.01 0.74 -1.05 120.40 126.88 2oju s VAL 127 Ca -0.08 1.43 0.14 0.00 0.00 0.00 0.00 61.98 63.47 2oju s VAL 127 Cb -0.05 -4.15 0.10 0.00 0.00 0.00 0.00 36.38 32.28 2oju s VAL 127 CO 0.01 -0.38 0.94 2.30 0.00 0.00 0.00 175.10 177.97 2oju n ILE 128 N 5.94 0.00 -3.59 2.22 -5.35 -0.89 -4.95 119.36 112.73 2oju n ILE 128 Ca 0.14 -0.48 -0.11 0.00 -0.27 0.00 0.00 62.75 62.03 2oju n ILE 128 Cb 0.46 1.29 -0.06 0.00 -1.74 0.00 0.00 39.64 39.59 2oju n ILE 128 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2oju s ASP 129 N -1.26 -0.40 0.00 7.28 -1.08 -1.23 -4.97 116.67 115.00 2oju s ASP 129 Ca 0.16 0.53 0.00 0.00 -0.52 0.00 0.00 52.55 52.72 2oju s ASP 129 Cb 0.12 0.45 0.00 0.00 -1.46 0.00 0.00 42.92 42.03 2oju s ASP 129 CO 0.20 -0.31 0.00 0.61 0.52 0.00 0.00 175.17 176.19 2oju n GLY 130 N 1.08 0.85 0.39 2.66 0.00 -1.26 -0.41 105.19 108.50 2oju n GLY 130 Ca -0.11 -0.06 0.26 0.00 0.00 0.00 0.00 46.02 46.11 2oju n GLY 130 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2oju h LEU 131 N 0.00 0.45 -2.28 0.99 -0.00 -1.93 0.94 115.31 113.47 2oju h LEU 131 Ca 0.00 0.14 0.00 0.00 -0.00 0.00 0.00 57.88 58.03 2oju h LEU 131 Cb 0.00 0.09 -0.00 0.00 -0.00 0.00 0.00 40.66 40.75 2oju h LEU 131 CO 0.00 -0.07 0.01 1.05 -0.00 0.00 0.00 178.44 179.43 2oju h GLU 132 N 0.31 0.00 -0.05 1.13 9.09 -1.92 0.11 114.58 123.25 2oju h GLU 132 Ca 0.71 0.00 -0.19 0.00 0.05 0.00 0.00 59.36 59.93 2oju h GLU 132 Cb 1.81 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.90 2oju h GLU 132 CO -0.47 0.00 -0.77 1.15 0.05 0.00 0.00 179.01 178.97 2oju h THR 133 N 0.00 1.41 -0.53 -1.06 2.02 0.67 -2.88 112.91 112.54 2oju h THR 133 Ca 0.01 -2.27 -0.02 0.00 0.77 0.00 0.00 66.41 64.90 2oju h THR 133 Cb 0.03 2.22 -0.03 0.00 -1.74 0.00 0.00 68.15 68.63 2oju h THR 133 CO -0.00 0.67 0.26 -0.07 0.37 0.00 0.00 175.52 176.76 2oju h LEU 134 N 0.22 0.66 -0.54 2.58 3.38 -0.62 -2.08 115.31 118.91 2oju h LEU 134 Ca -0.04 -0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.74 2oju h LEU 134 Cb 1.36 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 2oju h LEU 134 CO 0.13 0.56 -0.26 0.44 0.09 0.00 0.00 178.44 179.39 2oju h ASP 135 N 0.74 0.93 -0.05 -0.43 3.32 -1.22 -2.12 116.42 117.59 2oju h ASP 135 Ca 0.19 -0.37 -0.06 0.00 0.02 0.00 0.00 57.03 56.81 2oju h ASP 135 Cb 0.07 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 2oju h ASP 135 CO -0.03 1.13 -0.12 -0.33 -1.72 0.00 0.00 179.24 178.17 2oju h GLU 136 N 0.77 0.35 -0.18 3.56 4.39 -1.21 -2.83 114.58 119.43 2oju h GLU 136 Ca 0.09 -0.09 -0.13 0.00 0.34 0.00 0.00 59.36 59.57 2oju h GLU 136 Cb 0.82 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.43 2oju h GLU 136 CO 0.07 0.48 -0.40 -0.07 -1.16 0.00 0.00 179.01 177.94 2oju h LEU 137 N 0.33 0.66 -2.37 1.33 3.38 -1.17 -3.14 115.31 114.33 2oju h LEU 137 Ca 0.07 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2oju h LEU 137 Cb 0.42 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2oju h LEU 137 CO 0.02 1.10 0.00 -0.08 0.09 0.00 0.00 178.44 179.57 2oju h GLU 138 N 0.24 0.00 -0.02 1.13 4.81 -1.17 -2.19 114.58 117.39 2oju h GLU 138 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2oju h GLU 138 Cb 1.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.38 2oju h GLU 138 CO 0.09 0.00 -0.26 1.63 -0.73 0.00 0.00 179.01 179.74 2oju n LYS 139 N -3.02 1.59 -1.94 1.92 5.02 -1.09 -4.69 118.16 115.96 2oju n LYS 139 Ca -0.02 -1.28 -0.41 0.00 -2.02 0.00 0.00 58.31 54.59 2oju n LYS 139 Cb 0.15 -1.47 -0.02 0.00 -0.02 0.00 0.00 35.03 33.67 2oju n LYS 139 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2oju s LEU 140 N -2.28 4.37 0.31 -0.35 1.43 -0.83 -4.97 118.68 116.37 2oju s LEU 140 Ca 0.24 2.80 -0.29 0.00 -1.03 0.00 0.00 54.13 55.84 2oju s LEU 140 Cb 0.19 -3.64 -0.10 0.00 0.03 0.00 0.00 46.19 42.67 2oju s LEU 140 CO 0.46 -0.76 1.22 -2.84 0.23 0.00 0.00 176.35 174.66 2oju s PRO 141 N -0.87 4.48 0.15 1.29 0.02 -1.26 -4.98 135.00 133.82 2oju s PRO 141 Ca 0.58 2.04 -0.00 0.00 0.02 0.00 0.00 61.00 63.64 2oju s PRO 141 Cb -0.44 -3.12 -0.04 0.00 0.02 0.00 0.00 34.50 30.92 2oju s PRO 141 CO 0.49 -0.02 0.04 0.14 -0.33 0.00 0.00 177.00 177.32 2oju s VAL 142 N -1.15 0.29 0.13 3.83 -7.23 -1.26 -1.73 120.40 113.28 2oju s VAL 142 Ca 0.47 -1.93 -0.31 0.00 -1.81 0.00 0.00 61.98 58.40 2oju s VAL 142 Cb -0.36 -2.08 -0.09 0.00 0.56 0.00 0.00 36.38 34.41 2oju s VAL 142 CO 0.48 -0.46 1.51 0.21 -0.31 0.00 0.00 175.10 176.53 2oju s ASN 143 N -3.09 6.68 0.59 4.85 3.84 -0.03 -4.80 114.94 122.98 2oju s ASN 143 Ca 0.24 2.48 0.30 0.00 0.21 0.00 0.00 52.86 56.09 2oju s ASN 143 Cb 0.07 -2.59 1.78 0.00 -0.55 0.00 0.00 41.25 39.97 2oju s ASN 143 CO 0.03 -0.77 2.20 -0.33 -2.79 0.00 0.00 177.10 175.43 2oju h GLU 144 N 7.07 0.00 0.01 0.43 5.08 -1.97 0.16 114.58 125.36 2oju h GLU 144 Ca -0.42 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 57.55 2oju h GLU 144 Cb 1.20 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.40 2oju h GLU 144 CO 0.90 0.00 -2.18 1.63 -1.00 0.00 0.00 179.01 178.36 2oju n LYS 145 N -3.79 0.61 0.02 2.33 5.02 -1.26 -4.59 118.16 116.51 2oju n LYS 145 Ca -0.01 0.32 0.11 0.00 -2.02 0.00 0.00 58.31 56.71 2oju n LYS 145 Cb 0.18 -1.58 0.11 0.00 -0.02 0.00 0.00 35.03 33.72 2oju n LYS 145 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2oju n THR 146 N -4.04 0.13 -1.29 -0.18 -2.24 -1.23 -4.95 114.28 100.48 2oju n THR 146 Ca -0.46 -0.14 -0.10 0.00 -2.27 0.00 0.00 64.05 61.08 2oju n THR 146 Cb 0.87 0.25 -0.04 0.00 -2.10 0.00 0.00 70.33 69.31 2oju n THR 146 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2oju n TYR 147 N -1.79 0.00 -2.64 4.78 4.02 0.56 -4.82 117.16 117.27 2oju n TYR 147 Ca 0.03 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.51 2oju n TYR 147 Cb 0.39 -2.45 -0.03 0.00 -0.02 0.00 0.00 39.34 37.23 2oju n TYR 147 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 2oju s ARG 148 N -2.72 4.56 0.18 -0.72 3.52 -1.25 -1.45 118.95 121.07 2oju s ARG 148 Ca 0.00 1.52 -0.32 0.00 -0.13 0.00 0.00 55.73 56.80 2oju s ARG 148 Cb 0.00 -3.41 -0.12 0.00 -1.56 0.00 0.00 34.95 29.86 2oju s ARG 148 CO 0.00 -0.04 1.71 -2.30 -0.81 0.00 0.00 175.30 173.86 2oju n PRO 149 N 3.60 2.63 -0.28 5.12 -0.02 -1.26 -0.85 135.00 143.94 2oju n PRO 149 Ca 0.06 0.95 0.05 0.00 -2.02 0.00 0.00 63.50 62.54 2oju n PRO 149 Cb 0.49 -2.79 0.20 0.00 -0.02 0.00 0.00 33.50 31.39 2oju n PRO 149 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2oju h LEU 150 N 6.90 0.45 -8.52 2.45 3.38 -1.65 -3.37 115.31 114.96 2oju h LEU 150 Ca -0.44 0.09 -0.66 0.00 0.09 0.00 0.00 57.88 56.96 2oju h LEU 150 Cb 1.22 0.02 -0.25 0.00 0.09 0.00 0.00 40.66 41.74 2oju h LEU 150 CO 0.94 0.20 -0.64 0.20 0.09 0.00 0.00 178.44 179.23 2oju s ASN 151 N -5.42 4.99 -0.04 -0.43 0.01 -1.26 -5.06 114.94 107.73 2oju s ASN 151 Ca -0.12 -0.40 -0.36 0.00 -0.71 0.00 0.00 52.86 51.27 2oju s ASN 151 Cb 0.21 -1.88 -0.14 0.00 0.41 0.00 0.00 41.25 39.85 2oju s ASN 151 CO 0.77 -0.08 1.68 0.47 -1.51 0.00 0.00 177.10 178.43 2oju n ASP 152 N 4.89 2.82 -4.14 -1.22 8.00 -1.26 -4.97 116.55 120.66 2oju n ASP 152 Ca -0.16 1.05 -0.34 0.00 0.71 0.00 0.00 54.79 56.05 2oju n ASP 152 Cb 0.50 -1.30 -0.14 0.00 -0.02 0.00 0.00 41.12 40.16 2oju n ASP 152 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2oju s VAL 153 N 2.54 2.73 0.45 2.53 1.01 -1.26 -5.06 120.40 123.34 2oju s VAL 153 Ca 0.89 -1.43 0.07 0.00 0.00 0.00 0.00 61.98 61.51 2oju s VAL 153 Cb -0.82 -2.57 0.02 0.00 0.00 0.00 0.00 36.38 33.01 2oju s VAL 153 CO 0.50 -0.06 0.61 -1.00 0.00 0.00 0.00 175.10 175.16 2oju s HIS 154 N 1.21 2.81 -0.36 5.22 0.09 -1.26 -2.32 115.29 120.68 2oju s HIS 154 Ca -0.06 -0.33 -0.09 0.00 -0.00 0.00 0.00 55.06 54.58 2oju s HIS 154 Cb -0.20 -2.45 0.03 0.00 -0.00 0.00 0.00 32.58 29.97 2oju s HIS 154 CO -0.03 -0.51 0.16 0.42 -0.00 0.00 0.00 174.74 174.78 2oju s ILE 155 N -2.43 4.23 -0.02 0.60 1.01 0.15 -1.84 121.20 122.90 2oju s ILE 155 Ca 0.55 -0.95 -0.20 0.00 0.00 0.00 0.00 60.65 60.06 2oju s ILE 155 Cb -0.10 -3.36 -0.11 0.00 0.01 0.00 0.00 42.46 38.89 2oju s ILE 155 CO 0.34 -0.19 0.83 0.11 0.00 0.00 0.00 174.94 176.02 2oju h LYS 156 N 8.34 -0.58 -3.85 2.79 1.57 -0.55 -0.07 116.57 124.22 2oju h LYS 156 Ca -0.25 0.04 -0.17 0.00 -1.87 0.00 0.00 60.65 58.40 2oju h LYS 156 Cb 1.10 0.13 -0.08 0.00 0.08 0.00 0.00 32.23 33.46 2oju h LYS 156 CO 0.64 -0.33 -0.13 0.34 -0.57 0.00 0.00 179.45 179.40 2oju s ASP 157 N -4.88 0.45 0.07 0.86 3.68 -1.18 -4.21 116.67 111.47 2oju s ASP 157 Ca -0.11 -1.26 0.02 0.00 2.13 0.00 0.00 52.55 53.33 2oju s ASP 157 Cb 0.01 0.65 -0.03 0.00 -1.45 0.00 0.00 42.92 42.10 2oju s ASP 157 CO 0.34 -1.28 -0.07 0.27 0.13 0.00 0.00 175.17 174.56 2oju s ILE 158 N -3.32 0.63 -0.07 4.11 -5.25 -1.26 -0.82 121.20 115.22 2oju s ILE 158 Ca 0.26 -1.54 0.04 0.00 -0.99 0.00 0.00 60.65 58.43 2oju s ILE 158 Cb -0.01 -1.19 -0.00 0.00 2.95 0.00 0.00 42.46 44.21 2oju s ILE 158 CO 0.15 -0.64 -0.20 -0.89 -1.79 0.00 0.00 174.94 171.57 2oju s THR 159 N -2.58 1.73 -0.24 8.37 2.01 -0.38 -4.95 115.64 119.60 2oju s THR 159 Ca 0.02 -0.86 -0.09 0.00 0.31 0.00 0.00 61.69 61.08 2oju s THR 159 Cb -0.02 -1.49 -0.04 0.00 0.01 0.00 0.00 72.50 70.96 2oju s THR 159 CO -0.02 0.49 0.11 -0.63 -0.69 0.00 0.00 174.62 173.88 2oju s ILE 160 N 0.19 4.82 -0.51 1.82 1.01 -1.26 -0.41 121.20 126.85 2oju s ILE 160 Ca -0.10 -0.01 -0.16 0.00 0.00 0.00 0.00 60.65 60.38 2oju s ILE 160 Cb -0.15 -3.25 0.11 0.00 0.01 0.00 0.00 42.46 39.18 2oju s ILE 160 CO 0.05 0.34 0.46 -1.00 0.00 0.00 0.00 174.94 174.79 2oju s HIS 161 N 1.31 3.25 -0.00 3.97 3.76 0.27 -5.00 115.29 122.85 2oju s HIS 161 Ca 0.06 -1.16 -0.29 0.00 -0.15 0.00 0.00 55.06 53.52 2oju s HIS 161 Cb -0.15 -3.56 0.07 0.00 1.11 0.00 0.00 32.58 30.05 2oju s HIS 161 CO 0.05 -0.94 0.65 0.00 -0.85 0.00 0.00 174.74 173.65 2oju s ALA 162 N 1.61 -1.70 -0.26 -1.40 0.00 -1.26 -1.81 121.76 116.94 2oju s ALA 162 Ca 0.03 1.10 0.02 0.00 0.00 0.00 0.00 51.96 53.11 2oju s ALA 162 Cb -0.28 0.21 0.07 0.00 0.00 0.00 0.00 23.12 23.12 2oju s ALA 162 CO 0.04 -0.46 -0.04 1.21 0.00 0.00 0.00 175.76 176.52 2oju s ASN 163 N -1.56 4.15 0.46 0.00 3.04 -1.26 -4.99 114.94 114.79 2oju s ASN 163 Ca -0.08 -1.42 0.21 0.00 0.04 0.00 0.00 52.86 51.60 2oju s ASN 163 Cb -0.00 -1.31 1.14 0.00 -1.54 0.00 0.00 41.25 39.53 2oju s ASN 163 CO 0.05 -0.26 1.97 1.55 -3.04 0.00 0.00 177.10 177.37 2oju h PRO 164 N 7.87 0.00 0.00 0.43 0.13 -2.00 -3.48 132.00 134.95 2oju h PRO 164 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 2oju h PRO 164 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 2oju h PRO 164 CO 0.45 0.20 0.00 1.19 -0.23 0.00 0.00 178.00 179.61