#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oci s VAL 22 N 0.00 1.87 -0.13 -3.33 1.01 -1.26 -4.63 120.40 113.92 2oci s VAL 22 Ca 0.00 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 60.97 2oci s VAL 22 Cb 0.00 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 2oci s VAL 22 CO 0.00 0.53 -0.11 -0.89 0.00 0.00 0.00 175.10 174.62 2oci s THR 23 N -0.53 3.22 -0.01 3.92 2.01 -0.45 -4.93 115.64 118.87 2oci s THR 23 Ca 0.08 -0.60 0.01 0.00 0.31 0.00 0.00 61.69 61.48 2oci s THR 23 Cb -0.09 -2.36 -0.04 0.00 0.01 0.00 0.00 72.50 70.02 2oci s THR 23 CO -0.01 0.52 0.03 -0.44 -0.69 0.00 0.00 174.62 174.03 2oci s SER 24 N 0.30 5.32 0.21 3.53 0.01 -1.26 -0.50 113.70 121.31 2oci s SER 24 Ca -0.09 0.06 -0.22 0.00 1.31 0.00 0.00 55.95 57.01 2oci s SER 24 Cb -0.15 -1.45 0.07 0.00 0.21 0.00 0.00 66.02 64.69 2oci s SER 24 CO 0.05 0.29 0.97 0.00 0.41 0.00 0.00 173.24 174.95 2oci s ALA 25 N -1.11 -1.48 0.08 1.44 0.00 -0.54 -5.00 121.76 115.16 2oci s ALA 25 Ca 0.20 -0.24 0.07 0.00 0.00 0.00 0.00 51.96 51.99 2oci s ALA 25 Cb -0.12 0.71 -0.03 0.00 0.00 0.00 0.00 23.12 23.68 2oci s ALA 25 CO 0.11 -1.05 -0.18 0.15 0.00 0.00 0.00 175.76 174.79 2oci s LYS 26 N -2.63 1.05 0.00 0.00 1.02 -1.26 -1.06 119.74 116.86 2oci s LYS 26 Ca 0.17 -1.05 0.00 0.00 0.02 0.00 0.00 55.97 55.12 2oci s LYS 26 Cb -0.03 -1.20 -0.00 0.00 -0.52 0.00 0.00 37.83 36.08 2oci s LYS 26 CO 0.05 0.28 -0.02 0.54 -0.92 0.00 0.00 175.35 175.29 2oci s VAL 27 N -1.13 0.10 -0.16 3.17 0.11 -0.48 -4.92 120.40 117.09 2oci s VAL 27 Ca 0.04 -0.21 -0.29 0.00 -2.93 0.00 0.00 61.98 58.58 2oci s VAL 27 Cb -0.10 -0.13 -0.02 0.00 -1.53 0.00 0.00 36.38 34.61 2oci s VAL 27 CO 0.03 -0.07 1.25 0.00 -3.33 0.00 0.00 175.10 172.99 2oci s ALA 28 N -0.28 3.65 -0.04 1.54 0.00 -1.26 -1.48 121.76 123.89 2oci s ALA 28 Ca -0.02 0.47 -0.01 0.00 0.00 0.00 0.00 51.96 52.39 2oci s ALA 28 Cb -0.02 -3.61 0.03 0.00 0.00 0.00 0.00 23.12 19.52 2oci s ALA 28 CO -0.00 -1.13 0.06 0.08 0.00 0.00 0.00 175.76 174.76 2oci s VAL 29 N 3.38 -0.10 -1.64 0.00 1.01 0.04 -4.91 120.40 118.18 2oci s VAL 29 Ca 0.55 0.36 -0.12 0.00 0.00 0.00 0.00 61.98 62.76 2oci s VAL 29 Cb -0.22 -0.14 0.11 0.00 0.00 0.00 0.00 36.38 36.14 2oci s VAL 29 CO 0.15 0.15 0.55 0.59 0.00 0.00 0.00 175.10 176.54 2oci n ASN 30 N 4.93 -1.74 0.00 3.32 3.02 -1.26 -1.11 115.26 122.43 2oci n ASN 30 Ca -0.11 -1.09 0.00 0.00 -0.03 0.00 0.00 54.58 53.35 2oci n ASN 30 Cb 0.50 -2.47 0.00 0.00 -0.61 0.00 0.00 39.78 37.20 2oci n ASN 30 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2oci n GLY 31 N -1.66 0.74 3.09 7.41 0.00 -1.26 -5.04 105.19 108.46 2oci n GLY 31 Ca -0.07 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.80 2oci n GLY 31 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2oci s VAL 32 N -2.71 0.70 -0.64 1.61 -7.23 -0.27 -5.02 120.40 106.84 2oci s VAL 32 Ca 0.00 -1.07 -0.21 0.00 -1.81 0.00 0.00 61.98 58.89 2oci s VAL 32 Cb 0.00 -0.72 0.09 0.00 0.56 0.00 0.00 36.38 36.30 2oci s VAL 32 CO 0.00 -0.29 0.86 -1.10 -0.31 0.00 0.00 175.10 174.27 2oci s GLN 33 N -1.49 3.09 0.01 4.82 -1.52 -1.26 -0.78 119.66 122.54 2oci s GLN 33 Ca -0.07 -1.06 -0.23 0.00 -1.95 0.00 0.00 55.36 52.06 2oci s GLN 33 Cb -0.09 -4.26 -0.05 0.00 -0.22 0.00 0.00 33.01 28.39 2oci s GLN 33 CO 0.01 -1.71 0.70 -0.51 -0.25 0.00 0.00 175.29 173.53 2oci s LEU 34 N 3.47 4.41 0.23 2.90 1.43 -0.55 -4.59 118.68 125.98 2oci s LEU 34 Ca 0.18 1.31 -0.12 0.00 -1.03 0.00 0.00 54.13 54.47 2oci s LEU 34 Cb -0.20 -3.10 -0.07 0.00 0.03 0.00 0.00 46.19 42.85 2oci s LEU 34 CO 0.08 0.02 0.58 -2.28 0.23 0.00 0.00 176.35 174.99 2oci s HIS 35 N 0.05 3.46 0.15 0.29 5.65 -1.26 -1.38 115.29 122.24 2oci s HIS 35 Ca 0.36 0.98 -0.21 0.00 0.25 0.00 0.00 55.06 56.43 2oci s HIS 35 Cb -0.19 -2.34 0.06 0.00 -1.18 0.00 0.00 32.58 28.93 2oci s HIS 35 CO 0.20 0.27 0.55 1.52 -0.65 0.00 0.00 174.74 176.64 2oci s TYR 36 N -1.77 -0.46 0.03 3.88 -0.85 -0.23 -1.36 117.35 116.60 2oci s TYR 36 Ca 0.47 0.22 0.09 0.00 -0.52 0.00 0.00 57.07 57.32 2oci s TYR 36 Cb -0.12 0.49 -0.03 0.00 0.38 0.00 0.00 41.96 42.68 2oci s TYR 36 CO 0.20 -0.82 -0.25 -0.65 -1.52 0.00 0.00 175.55 172.51 2oci s GLN 37 N -3.76 1.76 0.01 -3.49 -0.21 0.28 -1.47 119.66 112.78 2oci s GLN 37 Ca 0.02 -1.04 0.00 0.00 0.02 0.00 0.00 55.36 54.36 2oci s GLN 37 Cb -0.00 -1.88 -0.01 0.00 1.00 0.00 0.00 33.01 32.11 2oci s GLN 37 CO -0.13 0.49 -0.02 -1.14 -2.12 0.00 0.00 175.29 172.38 2oci s GLN 38 N -1.10 0.18 0.18 2.91 0.74 0.34 -0.67 119.66 122.23 2oci s GLN 38 Ca 0.11 -0.30 -0.16 0.00 0.05 0.00 0.00 55.36 55.06 2oci s GLN 38 Cb -0.10 0.01 0.03 0.00 1.10 0.00 0.00 33.01 34.05 2oci s GLN 38 CO 0.01 -0.01 0.47 -0.08 -0.55 0.00 0.00 175.29 175.13 2oci s THR 39 N -0.67 0.04 0.00 -0.34 -1.32 -0.20 -1.35 115.64 111.80 2oci s THR 39 Ca -0.07 -0.80 0.00 0.00 -1.21 0.00 0.00 61.69 59.61 2oci s THR 39 Cb -0.05 -1.52 0.00 0.00 -1.51 0.00 0.00 72.50 69.42 2oci s THR 39 CO -0.00 -0.18 0.00 0.61 -2.21 0.00 0.00 174.62 172.84 2oci n GLY 40 N -0.30 -0.62 0.00 6.08 0.00 -1.26 -0.34 105.19 108.75 2oci n GLY 40 Ca -0.11 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.27 2oci n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2oci n GLU 41 N -0.38 0.68 -0.90 1.61 4.71 0.18 -4.70 120.64 121.85 2oci n GLU 41 Ca 0.00 -0.79 -0.32 0.00 -0.01 0.00 0.00 57.16 56.04 2oci n GLU 41 Cb 0.00 -0.87 0.15 0.00 -1.01 0.00 0.00 31.44 29.71 2oci n GLU 41 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 2oci s GLY 42 N -0.36 1.87 0.00 0.62 0.00 -0.35 -4.86 107.32 104.24 2oci s GLY 42 Ca 0.00 0.67 0.28 0.00 0.00 0.00 0.00 44.72 45.67 2oci s GLY 42 CO 0.00 1.08 1.80 2.09 0.00 0.00 0.00 173.10 178.08 2oci n ASP 43 N -3.83 0.46 -4.35 1.64 5.75 -1.19 -3.68 116.55 111.35 2oci n ASP 43 Ca 0.12 -0.46 -0.43 0.00 -0.01 0.00 0.00 54.79 54.02 2oci n ASP 43 Cb 0.52 -0.07 -0.09 0.00 -1.03 0.00 0.00 41.12 40.45 2oci n ASP 43 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 2oci s HIS 44 N -2.58 3.28 0.04 2.11 2.46 -1.08 -4.97 115.29 114.56 2oci s HIS 44 Ca 0.25 -1.13 -0.30 0.00 0.47 0.00 0.00 55.06 54.35 2oci s HIS 44 Cb 0.20 -3.05 -0.04 0.00 -0.13 0.00 0.00 32.58 29.56 2oci s HIS 44 CO 0.50 -0.80 0.97 0.00 -2.47 0.00 0.00 174.74 172.94 2oci s ALA 45 N 1.56 3.19 -0.05 1.58 0.00 -1.26 -1.96 121.76 124.82 2oci s ALA 45 Ca 0.04 0.55 0.03 0.00 0.00 0.00 0.00 51.96 52.58 2oci s ALA 45 Cb -0.23 -3.31 0.01 0.00 0.00 0.00 0.00 23.12 19.58 2oci s ALA 45 CO 0.05 -0.15 -0.13 0.08 0.00 0.00 0.00 175.76 175.61 2oci s VAL 46 N 0.60 1.15 -0.15 0.00 1.01 -0.05 -0.85 120.40 122.10 2oci s VAL 46 Ca 0.50 -0.52 -0.04 0.00 0.00 0.00 0.00 61.98 61.91 2oci s VAL 46 Cb -0.22 -1.03 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 2oci s VAL 46 CO 0.29 0.35 -0.01 -0.22 0.00 0.00 0.00 175.10 175.51 2oci s LEU 47 N 0.41 3.44 -0.28 3.92 2.96 -0.49 -0.58 118.68 128.06 2oci s LEU 47 Ca -0.10 -0.04 -0.10 0.00 -0.22 0.00 0.00 54.13 53.67 2oci s LEU 47 Cb -0.13 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.68 2oci s LEU 47 CO 0.03 0.19 0.17 -0.76 -1.32 0.00 0.00 176.35 174.66 2oci s LEU 48 N 0.22 3.98 -0.29 -0.68 1.43 0.14 -1.05 118.68 122.42 2oci s LEU 48 Ca -0.00 -0.12 -0.09 0.00 -1.03 0.00 0.00 54.13 52.89 2oci s LEU 48 Cb -0.13 -2.08 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 2oci s LEU 48 CO 0.02 -0.08 0.12 -0.76 0.23 0.00 0.00 176.35 175.88 2oci s LEU 49 N 1.72 3.92 0.74 1.79 1.02 0.40 -3.15 118.68 125.12 2oci s LEU 49 Ca 0.07 -0.50 -0.11 0.00 0.02 0.00 0.00 54.13 53.60 2oci s LEU 49 Cb -0.16 -1.96 0.04 0.00 0.02 0.00 0.00 46.19 44.13 2oci s LEU 49 CO 0.09 -0.16 1.08 -2.16 0.02 0.00 0.00 176.35 175.22 2oci s PRO 50 N 1.59 2.56 0.00 1.29 0.04 -1.26 -1.37 135.00 137.84 2oci s PRO 50 Ca 0.04 0.73 0.00 0.00 0.04 0.00 0.00 61.00 61.81 2oci s PRO 50 Cb -0.17 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.41 2oci s PRO 50 CO 0.05 -1.31 0.00 0.41 0.04 0.00 0.00 177.00 176.19 2oci n GLY 51 N -2.22 0.09 3.66 0.56 0.00 -1.16 -2.73 105.19 103.39 2oci n GLY 51 Ca 0.07 -1.80 -0.50 0.00 0.00 0.00 0.00 46.02 43.79 2oci n GLY 51 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2oci n MET 52 N -0.38 1.73 -1.01 1.61 1.56 -1.26 -0.56 117.12 118.80 2oci n MET 52 Ca 0.00 0.63 -0.00 0.00 -0.27 0.00 0.00 57.70 58.05 2oci n MET 52 Cb 0.00 -2.37 -0.00 0.00 2.15 0.00 0.00 33.22 33.00 2oci n MET 52 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 175.97 176.52 2oci n LEU 53 N 4.36 0.88 -4.93 -0.89 4.77 -1.26 -4.96 117.00 114.97 2oci n LEU 53 Ca 0.20 0.01 -0.29 0.00 -0.03 0.00 0.00 56.01 55.91 2oci n LEU 53 Cb 0.24 -2.37 0.16 0.00 -2.33 0.00 0.00 43.42 39.11 2oci n LEU 53 CO 0.69 -0.93 0.83 -0.83 -1.33 0.00 0.00 177.39 175.81 2oci s GLY 54 N -2.02 1.75 0.19 -0.72 0.00 0.28 -4.56 107.32 102.23 2oci s GLY 54 Ca 0.00 -1.16 -0.24 0.00 0.00 0.00 0.00 44.72 43.32 2oci s GLY 54 CO 0.00 -0.46 0.86 -1.35 0.00 0.00 0.00 173.10 172.15 2oci s SER 55 N -4.82 -0.24 0.27 1.64 1.04 -1.26 -3.73 113.70 106.60 2oci s SER 55 Ca 0.71 -0.42 -0.03 0.00 0.48 0.00 0.00 55.95 56.68 2oci s SER 55 Cb -0.05 0.57 0.35 0.00 0.10 0.00 0.00 66.02 66.99 2oci s SER 55 CO 0.51 -1.04 1.87 1.23 0.98 0.00 0.00 173.24 176.80 2oci h GLY 56 N 2.00 1.11 1.18 7.32 0.00 -1.82 0.10 103.07 112.96 2oci h GLY 56 Ca -0.23 -0.53 -0.08 0.00 0.00 0.00 0.00 47.33 46.50 2oci h GLY 56 CO 0.26 0.51 0.08 0.83 0.00 0.00 0.00 176.54 178.22 2oci h GLU 57 N 1.03 1.00 0.00 4.80 3.07 -1.94 -2.35 114.58 120.19 2oci h GLU 57 Ca 0.25 -0.26 -0.10 0.00 -0.50 0.00 0.00 59.36 58.75 2oci h GLU 57 Cb 0.09 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 27.87 2oci h GLU 57 CO -0.03 0.94 -1.85 0.25 -1.40 0.00 0.00 179.01 176.91 2oci n THR 58 N -4.22 0.54 -0.01 1.13 -2.24 -1.12 -4.54 114.28 103.83 2oci n THR 58 Ca 0.04 -0.61 0.07 0.00 -2.27 0.00 0.00 64.05 61.28 2oci n THR 58 Cb 0.29 -0.25 -0.13 0.00 -2.10 0.00 0.00 70.33 68.14 2oci n THR 58 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2oci n ASP 59 N -2.51 1.20 -0.78 3.42 9.92 0.34 -4.79 116.55 123.34 2oci n ASP 59 Ca -0.10 0.00 0.05 0.00 -0.53 0.00 0.00 54.79 54.21 2oci n ASP 59 Cb 0.73 1.67 0.10 0.00 -0.64 0.00 0.00 41.12 42.98 2oci n ASP 59 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 2oci n PHE 60 N -2.13 0.00 -0.09 1.24 3.01 -0.89 -4.89 117.46 113.72 2oci n PHE 60 Ca -0.05 -0.86 -0.07 0.00 1.01 0.00 0.00 57.45 57.47 2oci n PHE 60 Cb 0.49 -0.17 -0.01 0.00 -0.01 0.00 0.00 39.48 39.78 2oci n PHE 60 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2oci h GLY 61 N 0.67 -0.15 1.04 1.37 0.00 -1.80 -1.49 103.07 102.71 2oci h GLY 61 Ca -0.07 0.34 0.05 0.00 0.00 0.00 0.00 47.33 47.65 2oci h GLY 61 CO 0.03 -0.21 0.51 -2.55 0.00 0.00 0.00 176.54 174.32 2oci h PRO 62 N -0.23 0.85 -0.11 4.80 0.11 -1.90 -1.61 132.00 133.90 2oci h PRO 62 Ca 0.16 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 66.07 2oci h PRO 62 Cb 0.49 -0.19 0.01 0.00 0.11 0.00 0.00 31.00 31.42 2oci h PRO 62 CO -0.47 0.56 -0.54 1.96 -0.21 0.00 0.00 178.00 179.31 2oci h GLN 63 N 0.88 0.56 0.00 1.05 7.50 -1.80 0.13 115.11 123.44 2oci h GLN 63 Ca 0.32 -0.46 -0.03 0.00 0.50 0.00 0.00 58.65 58.99 2oci h GLN 63 Cb 0.16 0.09 -0.00 0.00 0.05 0.00 0.00 27.48 27.78 2oci h GLN 63 CO -0.10 1.08 -0.14 -0.07 -1.50 0.00 0.00 178.83 178.10 2oci h LEU 64 N 0.19 0.00 0.00 1.46 3.38 -1.07 -1.65 115.31 117.61 2oci h LEU 64 Ca -0.04 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.78 2oci h LEU 64 Cb 1.18 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 2oci h LEU 64 CO 0.11 0.14 -0.88 0.50 0.09 0.00 0.00 178.44 178.39 2oci h LYS 65 N 0.00 0.00 0.00 1.13 3.64 -1.21 -3.44 116.57 116.69 2oci h LYS 65 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2oci h LYS 65 Cb 0.46 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 2oci h LYS 65 CO 0.02 0.95 -1.73 0.09 -2.27 0.00 0.00 179.45 176.51 2oci n ASN 66 N -4.49 0.26 -4.73 4.20 5.03 0.44 -4.96 115.26 111.00 2oci n ASN 66 Ca -0.25 -0.20 -0.42 0.00 0.87 0.00 0.00 54.58 54.58 2oci n ASN 66 Cb 0.60 1.70 -0.01 0.00 -1.02 0.00 0.00 39.78 41.05 2oci n ASN 66 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 2oci n LEU 67 N -2.10 4.15 -4.48 3.41 4.77 -0.63 -4.75 117.00 117.37 2oci n LEU 67 Ca -0.02 1.19 -0.51 0.00 -0.03 0.00 0.00 56.01 56.64 2oci n LEU 67 Cb 0.51 -1.56 -0.07 0.00 -2.33 0.00 0.00 43.42 39.98 2oci n LEU 67 CO 0.45 -0.08 1.75 -3.20 -1.33 0.00 0.00 177.39 174.99 2oci n ASN 68 N 1.26 2.27 0.05 -1.43 2.85 -1.26 -4.84 115.26 114.16 2oci n ASN 68 Ca 0.06 0.49 0.11 0.00 -0.11 0.00 0.00 54.58 55.12 2oci n ASN 68 Cb 0.37 -1.27 0.44 0.00 1.24 0.00 0.00 39.78 40.56 2oci n ASN 68 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2oci n LYS 69 N 7.93 0.09 0.02 1.20 5.02 -1.26 -1.28 118.16 129.88 2oci n LYS 69 Ca 0.39 0.24 -0.16 0.00 -2.02 0.00 0.00 58.31 56.75 2oci n LYS 69 Cb 0.23 -1.65 -0.14 0.00 -0.02 0.00 0.00 35.03 33.45 2oci n LYS 69 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2oci h LYS 70 N 0.00 0.19 0.15 1.97 1.57 -1.93 0.64 116.57 119.16 2oci h LYS 70 Ca 0.00 -0.32 -0.32 0.00 -1.87 0.00 0.00 60.65 58.14 2oci h LYS 70 Cb 0.41 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2oci h LYS 70 CO 0.00 0.99 -1.56 -0.07 -0.57 0.00 0.00 179.45 178.23 2oci h LEU 71 N 0.05 0.50 -9.18 2.94 3.38 -1.89 -3.27 115.31 107.83 2oci h LEU 71 Ca -0.30 -0.67 -0.51 0.00 0.09 0.00 0.00 57.88 56.48 2oci h LEU 71 Cb 2.02 -0.16 -0.14 0.00 0.09 0.00 0.00 40.66 42.47 2oci h LEU 71 CO 0.12 1.56 -0.67 -0.36 0.09 0.00 0.00 178.44 179.17 2oci s PHE 72 N -2.61 2.02 -0.23 1.13 0.40 -0.41 -2.64 117.98 115.65 2oci s PHE 72 Ca -0.10 -0.67 0.02 0.00 -0.60 0.00 0.00 56.93 55.57 2oci s PHE 72 Cb 0.06 -1.15 0.05 0.00 0.51 0.00 0.00 43.02 42.49 2oci s PHE 72 CO 0.87 0.32 -0.12 0.99 0.70 0.00 0.00 175.22 177.98 2oci s THR 73 N -2.96 1.94 -0.15 0.64 2.01 -0.83 -1.21 115.64 115.08 2oci s THR 73 Ca 0.30 -1.31 -0.06 0.00 0.31 0.00 0.00 61.69 60.92 2oci s THR 73 Cb 0.04 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.50 2oci s THR 73 CO 0.13 0.11 0.07 -0.69 -0.69 0.00 0.00 174.62 173.55 2oci s VAL 74 N 1.24 4.92 -0.06 3.82 1.01 0.54 -0.87 120.40 131.00 2oci s VAL 74 Ca -0.04 0.00 0.03 0.00 0.00 0.00 0.00 61.98 61.97 2oci s VAL 74 Cb -0.18 -3.18 0.01 0.00 0.00 0.00 0.00 36.38 33.04 2oci s VAL 74 CO -0.07 0.52 -0.14 -0.69 0.00 0.00 0.00 175.10 174.72 2oci s VAL 75 N -0.20 1.25 -0.21 2.92 1.01 0.25 -1.03 120.40 124.39 2oci s VAL 75 Ca 0.08 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.51 2oci s VAL 75 Cb -0.12 -1.12 0.02 0.00 0.00 0.00 0.00 36.38 35.16 2oci s VAL 75 CO 0.01 0.38 -0.14 0.00 0.00 0.00 0.00 175.10 175.35 2oci s ALA 76 N 0.54 2.49 0.28 5.51 0.00 0.15 0.23 121.76 130.97 2oci s ALA 76 Ca -0.13 -1.35 0.07 0.00 0.00 0.00 0.00 51.96 50.54 2oci s ALA 76 Cb -0.15 -1.40 -0.03 0.00 0.00 0.00 0.00 23.12 21.54 2oci s ALA 76 CO 0.04 -0.59 0.30 1.67 0.00 0.00 0.00 175.76 177.18 2oci s TRP 77 N 1.29 3.14 -0.26 0.00 1.48 -1.19 -0.56 118.94 122.84 2oci s TRP 77 Ca 0.02 -0.15 -0.03 0.00 -1.06 0.00 0.00 56.10 54.88 2oci s TRP 77 Cb -0.15 -1.62 0.02 0.00 -1.16 0.00 0.00 33.47 30.56 2oci s TRP 77 CO -0.09 0.34 -0.03 -0.51 -4.06 0.00 0.00 176.95 172.61 2oci s ASP 78 N -3.96 4.53 0.77 -2.66 1.01 -0.47 -4.09 116.67 111.81 2oci s ASP 78 Ca 0.37 -0.88 -0.15 0.00 0.71 0.00 0.00 52.55 52.60 2oci s ASP 78 Cb -0.08 -1.71 0.04 0.00 1.01 0.00 0.00 42.92 42.18 2oci s ASP 78 CO 0.27 -0.15 1.00 -2.65 0.21 0.00 0.00 175.17 173.85 2oci n PRO 79 N 4.70 0.32 -1.67 8.23 -0.02 -1.26 -4.37 135.00 140.92 2oci n PRO 79 Ca -0.16 0.17 -0.46 0.00 -2.02 0.00 0.00 63.50 61.04 2oci n PRO 79 Cb 0.47 -2.26 -0.04 0.00 -0.02 0.00 0.00 33.50 31.65 2oci n PRO 79 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2oci n ARG 80 N -2.35 2.09 0.00 -0.52 1.85 -1.26 -0.70 116.66 115.77 2oci n ARG 80 Ca 0.13 0.75 0.00 0.00 -1.00 0.00 0.00 57.85 57.73 2oci n ARG 80 Cb 0.50 -2.48 0.00 0.00 -1.05 0.00 0.00 32.46 29.43 2oci n ARG 80 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2oci n GLY 81 N 2.93 1.78 3.72 2.89 0.00 -0.30 -4.65 105.19 111.56 2oci n GLY 81 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 2oci n GLY 81 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2oci s TYR 82 N -2.52 2.73 0.00 1.61 4.12 0.12 -4.09 117.35 119.32 2oci s TYR 82 Ca 0.00 -0.33 0.00 0.00 0.02 0.00 0.00 57.07 56.76 2oci s TYR 82 Cb 0.00 -1.51 0.00 0.00 -1.52 0.00 0.00 41.96 38.93 2oci s TYR 82 CO 0.00 0.42 0.00 0.41 0.02 0.00 0.00 175.55 176.40 2oci n GLY 83 N -1.09 3.09 1.32 0.71 0.00 -1.24 -1.34 105.19 106.64 2oci n GLY 83 Ca -0.04 0.05 0.10 0.00 0.00 0.00 0.00 46.02 46.12 2oci n GLY 83 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2oci n HIS 84 N 14.00 1.10 -1.63 1.61 8.25 -1.26 -4.56 115.22 132.73 2oci n HIS 84 Ca 0.00 -0.56 -0.32 0.00 -0.26 0.00 0.00 57.72 56.58 2oci n HIS 84 Cb 0.00 -0.11 -0.05 0.00 1.12 0.00 0.00 29.99 30.95 2oci n HIS 84 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2oci n SER 85 N 1.20 7.19 -3.91 0.41 7.64 -0.45 -4.58 113.62 121.12 2oci n SER 85 Ca 0.23 -3.05 -0.19 0.00 1.01 0.00 0.00 58.87 56.87 2oci n SER 85 Cb 0.71 -1.33 -0.16 0.00 -1.01 0.00 0.00 64.21 62.42 2oci n SER 85 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2oci s ARG 86 N -0.87 0.73 1.01 1.43 0.52 -1.26 -1.14 118.95 119.36 2oci s ARG 86 Ca 0.59 -0.12 -0.12 0.00 -0.52 0.00 0.00 55.73 55.56 2oci s ARG 86 Cb 0.28 -0.74 0.20 0.00 0.52 0.00 0.00 34.95 35.21 2oci s ARG 86 CO -0.13 -0.04 1.08 -1.25 0.02 0.00 0.00 175.30 174.98 2oci s PRO 87 N 0.69 0.30 0.97 3.54 0.04 -1.26 -5.07 135.00 134.20 2oci s PRO 87 Ca -0.09 0.66 -0.15 0.00 0.04 0.00 0.00 61.00 61.46 2oci s PRO 87 Cb -0.12 -1.71 0.22 0.00 0.04 0.00 0.00 34.50 32.93 2oci s PRO 87 CO 0.00 -2.86 1.32 -1.25 0.04 0.00 0.00 177.00 174.25 2oci s PRO 88 N -4.85 0.49 0.43 0.56 0.04 -1.25 -4.58 135.00 125.84 2oci s PRO 88 Ca 0.66 -0.61 -0.07 0.00 0.04 0.00 0.00 61.00 61.02 2oci s PRO 88 Cb -0.20 -1.88 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 2oci s PRO 88 CO 0.59 -2.47 0.76 -0.51 0.04 0.00 0.00 177.00 175.40 2oci s ASP 89 N -4.94 6.38 0.21 6.66 -0.00 -1.26 -3.38 116.67 120.34 2oci s ASP 89 Ca 0.76 0.98 -0.30 0.00 -0.00 0.00 0.00 52.55 53.99 2oci s ASP 89 Cb -0.02 -2.26 -0.08 0.00 -0.00 0.00 0.00 42.92 40.55 2oci s ASP 89 CO 0.53 -0.47 1.09 -0.60 -0.00 0.00 0.00 175.17 175.72 2oci s ARG 90 N -4.29 4.62 0.05 8.23 6.06 -1.26 -4.65 118.95 127.72 2oci s ARG 90 Ca 0.48 1.73 0.00 0.00 -2.50 0.00 0.00 55.73 55.44 2oci s ARG 90 Cb -0.10 -3.25 -0.03 0.00 0.06 0.00 0.00 34.95 31.62 2oci s ARG 90 CO 0.38 0.14 -0.04 0.16 -2.50 0.00 0.00 175.30 173.44 2oci s ASP 91 N -0.40 0.59 -0.67 -2.12 -4.77 -1.26 -5.01 116.67 103.02 2oci s ASP 91 Ca 0.47 -0.83 0.05 0.00 -3.30 0.00 0.00 52.55 48.95 2oci s ASP 91 Cb -0.30 0.14 0.17 0.00 -1.09 0.00 0.00 42.92 41.84 2oci s ASP 91 CO 0.36 -0.46 0.50 0.49 0.70 0.00 0.00 175.17 176.77 2oci n PHE 92 N 0.61 2.83 -1.24 2.11 3.01 -1.26 -4.99 117.46 118.53 2oci n PHE 92 Ca -0.17 -4.20 -0.30 0.00 1.01 0.00 0.00 57.45 53.79 2oci n PHE 92 Cb 0.59 -0.53 0.13 0.00 -0.01 0.00 0.00 39.48 39.66 2oci n PHE 92 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2oci s PRO 93 N -1.38 1.33 0.48 -1.08 0.04 -1.26 -4.78 135.00 128.35 2oci s PRO 93 Ca 0.27 0.80 0.27 0.00 0.04 0.00 0.00 61.00 62.37 2oci s PRO 93 Cb -0.02 -1.82 1.34 0.00 0.04 0.00 0.00 34.50 34.04 2oci s PRO 93 CO -0.16 -2.18 1.84 0.00 0.04 0.00 0.00 177.00 176.53 2oci h ALA 94 N -1.51 2.64 -0.79 8.56 0.00 -1.99 -0.03 119.26 126.16 2oci h ALA 94 Ca -0.49 -0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.08 2oci h ALA 94 Cb 1.28 0.05 -0.20 0.00 0.00 0.00 0.00 17.79 18.92 2oci h ALA 94 CO 0.55 -0.96 0.38 -0.40 0.00 0.00 0.00 179.25 178.82 2oci n ASP 95 N -4.38 4.07 0.15 0.00 3.85 -1.26 -4.71 116.55 114.27 2oci n ASP 95 Ca 0.22 -3.45 0.10 0.00 -0.71 0.00 0.00 54.79 50.95 2oci n ASP 95 Cb 0.96 -0.77 0.61 0.00 -1.35 0.00 0.00 41.12 40.57 2oci n ASP 95 CO 0.00 0.00 0.00 2.19 -1.01 0.00 0.00 177.20 178.38 2oci h PHE 96 N 1.73 0.11 -0.29 2.11 -5.15 -1.32 -0.69 116.94 113.44 2oci h PHE 96 Ca 0.41 0.00 -0.16 0.00 -0.20 0.00 0.00 57.97 58.02 2oci h PHE 96 Cb 2.46 -0.04 -0.00 0.00 0.22 0.00 0.00 35.95 38.59 2oci h PHE 96 CO 1.36 0.06 -0.47 0.74 -2.00 0.00 0.00 178.31 178.00 2oci h PHE 97 N 0.11 0.96 -0.27 6.09 -1.00 -1.85 -1.96 116.94 119.02 2oci h PHE 97 Ca 0.08 -0.31 -0.12 0.00 2.81 0.00 0.00 57.97 60.43 2oci h PHE 97 Cb 0.19 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 39.55 2oci h PHE 97 CO -0.00 1.10 -0.32 0.93 -1.61 0.00 0.00 178.31 178.41 2oci h GLU 98 N 0.62 0.57 -0.47 1.51 5.08 -1.62 -0.68 114.58 119.58 2oci h GLU 98 Ca 0.03 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 58.07 2oci h GLU 98 Cb 1.05 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.27 2oci h GLU 98 CO 0.10 0.82 0.05 -0.09 -1.00 0.00 0.00 179.01 178.90 2oci h ARG 99 N 0.49 0.80 -0.67 2.33 2.43 -1.05 -1.37 114.38 117.34 2oci h ARG 99 Ca 0.06 -0.23 -0.06 0.00 -0.81 0.00 0.00 59.98 58.93 2oci h ARG 99 Cb 0.80 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.24 2oci h ARG 99 CO 0.07 0.83 0.18 -0.44 -1.51 0.00 0.00 179.97 179.09 2oci h ASP 100 N 0.67 1.01 -0.96 -3.80 3.32 -1.17 -1.42 116.42 114.06 2oci h ASP 100 Ca 0.14 -0.22 0.00 0.00 0.02 0.00 0.00 57.03 56.97 2oci h ASP 100 Cb 0.43 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.67 2oci h ASP 100 CO 0.01 0.97 0.62 0.00 -1.72 0.00 0.00 179.24 179.12 2oci h ALA 101 N 1.08 1.22 -0.27 3.45 0.00 -0.80 0.61 119.26 124.54 2oci h ALA 101 Ca 0.21 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 2oci h ALA 101 Cb 0.34 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2oci h ALA 101 CO -0.00 0.64 -0.15 -0.22 0.00 0.00 0.00 179.25 179.51 2oci h LYS 102 N 1.31 0.57 -0.79 0.00 3.64 -1.01 -2.62 116.57 117.68 2oci h LYS 102 Ca 0.35 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2oci h LYS 102 Cb -0.12 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.65 2oci h LYS 102 CO -0.07 0.83 0.49 -0.44 -2.27 0.00 0.00 179.45 177.99 2oci h ASP 103 N 0.30 0.93 -0.08 4.20 3.32 -0.84 0.27 116.42 124.51 2oci h ASP 103 Ca 0.06 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 2oci h ASP 103 Cb 0.67 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.99 2oci h ASP 103 CO 0.04 0.70 0.05 0.00 -1.72 0.00 0.00 179.24 178.31 2oci h ALA 104 N 1.27 0.11 -0.45 3.45 0.00 -0.84 0.20 119.26 122.99 2oci h ALA 104 Ca 0.28 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.04 2oci h ALA 104 Cb -0.07 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2oci h ALA 104 CO -0.06 -0.38 -0.19 0.28 0.00 0.00 0.00 179.25 178.90 2oci h VAL 105 N 0.07 1.27 -0.25 0.00 2.07 -1.31 -2.40 116.25 115.70 2oci h VAL 105 Ca 0.03 -1.34 -0.06 0.00 0.82 0.00 0.00 66.70 66.14 2oci h VAL 105 Cb 0.04 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 2oci h VAL 105 CO -0.01 0.46 -0.12 0.44 0.02 0.00 0.00 177.57 178.36 2oci h ASP 106 N 0.76 0.39 -0.30 0.57 3.32 -0.77 -1.05 116.42 119.35 2oci h ASP 106 Ca 0.10 -0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 2oci h ASP 106 Cb 0.76 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 2oci h ASP 106 CO 0.06 0.55 0.07 0.25 -1.72 0.00 0.00 179.24 178.45 2oci h LEU 107 N 0.38 0.45 -0.94 1.55 6.46 -0.40 0.97 115.31 123.78 2oci h LEU 107 Ca 0.07 -0.23 -0.09 0.00 -0.12 0.00 0.00 57.88 57.51 2oci h LEU 107 Cb 0.45 -0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 40.25 2oci h LEU 107 CO 0.03 0.57 -0.17 0.24 -0.62 0.00 0.00 178.44 178.48 2oci h MET 108 N 0.31 0.58 -0.39 1.25 2.86 -1.11 -1.37 114.93 117.07 2oci h MET 108 Ca 0.09 -0.20 -0.11 0.00 -2.06 0.00 0.00 59.70 57.43 2oci h MET 108 Cb 0.29 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 2oci h MET 108 CO 0.00 0.73 -0.21 0.87 1.06 0.00 0.00 176.91 179.36 2oci h LYS 109 N 0.52 0.76 0.00 1.72 1.57 -0.94 -2.16 116.57 118.04 2oci h LYS 109 Ca 0.09 -0.30 -0.05 0.00 -1.87 0.00 0.00 60.65 58.52 2oci h LYS 109 Cb 0.60 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 2oci h LYS 109 CO 0.04 0.91 -0.24 0.00 -0.57 0.00 0.00 179.45 179.59 2oci h ALA 110 N 1.10 1.41 -0.19 3.86 0.00 -0.30 -0.91 119.26 124.23 2oci h ALA 110 Ca 0.10 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2oci h ALA 110 Cb 0.71 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2oci h ALA 110 CO 0.05 0.30 0.00 1.28 0.00 0.00 0.00 179.25 180.88 2oci n LEU 111 N -3.98 1.20 -0.52 0.00 4.77 -0.56 -4.92 117.00 112.99 2oci n LEU 111 Ca -0.02 -0.57 -0.07 0.00 -0.03 0.00 0.00 56.01 55.32 2oci n LEU 111 Cb 0.32 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.25 2oci n LEU 111 CO 0.35 0.29 -0.06 0.29 -1.33 0.00 0.00 177.39 176.92 2oci n LYS 112 N 0.11 -0.46 -3.03 3.23 4.76 -0.35 -5.03 118.16 117.39 2oci n LYS 112 Ca 0.10 0.71 -0.40 0.00 -2.87 0.00 0.00 58.31 55.85 2oci n LYS 112 Cb 0.21 -4.49 -0.05 0.00 -1.84 0.00 0.00 35.03 28.86 2oci n LYS 112 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2oci s PHE 113 N -2.25 3.74 -0.28 2.13 0.40 -0.89 -4.96 117.98 115.87 2oci s PHE 113 Ca 0.00 1.43 0.20 0.00 -0.60 0.00 0.00 56.93 57.97 2oci s PHE 113 Cb 0.00 -2.77 0.12 0.00 0.51 0.00 0.00 43.02 40.88 2oci s PHE 113 CO 0.00 0.32 1.31 0.87 0.70 0.00 0.00 175.22 178.42 2oci h LYS 114 N 5.51 0.00 -1.80 0.44 1.57 -1.95 -3.40 116.57 116.93 2oci h LYS 114 Ca -0.45 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.34 2oci h LYS 114 Cb 1.20 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 33.30 2oci h LYS 114 CO 0.70 0.14 0.33 0.21 -0.57 0.00 0.00 179.45 180.26 2oci s LYS 115 N -3.17 0.80 0.10 3.15 2.20 -1.26 -4.88 119.74 116.68 2oci s LYS 115 Ca 0.03 0.38 -0.04 0.00 -0.36 0.00 0.00 55.97 55.99 2oci s LYS 115 Cb 0.07 0.38 -0.03 0.00 -1.51 0.00 0.00 37.83 36.74 2oci s LYS 115 CO 0.74 -0.21 0.09 0.14 -0.36 0.00 0.00 175.35 175.74 2oci s VAL 116 N -0.72 0.15 0.19 4.02 -7.23 -0.59 -4.43 120.40 111.78 2oci s VAL 116 Ca -0.04 -1.66 0.07 0.00 -1.81 0.00 0.00 61.98 58.54 2oci s VAL 116 Cb -0.02 -1.69 -0.04 0.00 0.56 0.00 0.00 36.38 35.19 2oci s VAL 116 CO 0.04 -0.66 0.06 -0.44 -0.31 0.00 0.00 175.10 173.79 2oci s SER 117 N -2.96 5.05 -0.06 4.85 0.01 -0.03 -0.35 113.70 120.21 2oci s SER 117 Ca 0.13 -0.33 0.05 0.00 1.31 0.00 0.00 55.95 57.11 2oci s SER 117 Cb 0.07 -1.17 -0.00 0.00 0.21 0.00 0.00 66.02 65.13 2oci s SER 117 CO -0.05 0.06 -0.21 -0.76 0.41 0.00 0.00 173.24 172.69 2oci s LEU 118 N -3.20 1.97 -0.32 2.44 1.43 -0.26 -1.39 118.68 119.34 2oci s LEU 118 Ca 0.30 -0.44 0.02 0.00 -1.03 0.00 0.00 54.13 52.98 2oci s LEU 118 Cb -0.09 -1.17 0.09 0.00 0.03 0.00 0.00 46.19 45.05 2oci s LEU 118 CO 0.21 0.18 0.02 -0.76 0.23 0.00 0.00 176.35 176.23 2oci s LEU 119 N 0.07 4.38 -0.15 1.79 1.02 -0.21 0.10 118.68 125.68 2oci s LEU 119 Ca -0.07 -1.85 -0.00 0.00 0.02 0.00 0.00 54.13 52.23 2oci s LEU 119 Cb -0.14 -1.64 -0.01 0.00 0.02 0.00 0.00 46.19 44.42 2oci s LEU 119 CO 0.04 -0.34 -0.14 -0.83 0.02 0.00 0.00 176.35 175.11 2oci s GLY 120 N 1.11 1.51 -0.23 -3.19 0.00 0.14 -0.46 107.32 106.20 2oci s GLY 120 Ca 0.04 -0.98 -0.08 0.00 0.00 0.00 0.00 44.72 43.70 2oci s GLY 120 CO -0.06 -0.05 0.08 0.86 0.00 0.00 0.00 173.10 173.93 2oci s TRP 121 N 0.64 3.14 0.00 1.90 -0.00 -0.47 -1.98 118.94 122.18 2oci s TRP 121 Ca -0.07 -0.20 0.00 0.00 -0.00 0.00 0.00 56.10 55.82 2oci s TRP 121 Cb -0.16 -2.21 0.00 0.00 -0.00 0.00 0.00 33.47 31.10 2oci s TRP 121 CO 0.03 -0.18 0.00 0.45 -0.00 0.00 0.00 176.95 177.24 2oci n SER 122 N 4.54 0.00 0.10 5.86 2.88 0.27 -0.04 113.62 127.23 2oci n SER 122 Ca -0.16 0.00 0.16 0.00 -1.33 0.00 0.00 58.87 57.54 2oci n SER 122 Cb 0.52 0.00 0.69 0.00 -0.75 0.00 0.00 64.21 64.66 2oci n SER 122 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2oci h ASP 123 N 0.00 0.00 0.80 -3.46 3.45 -1.83 0.37 116.42 115.75 2oci h ASP 123 Ca 0.00 0.00 -0.08 0.00 0.43 0.00 0.00 57.03 57.38 2oci h ASP 123 Cb 0.00 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.76 2oci h ASP 123 CO 0.00 0.00 -0.39 1.23 -1.57 0.00 0.00 179.24 178.51 2oci h GLY 124 N 0.00 0.00 1.32 2.75 0.00 -0.26 -0.87 103.07 106.02 2oci h GLY 124 Ca 0.16 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.25 2oci h GLY 124 CO -0.00 0.00 -0.90 -1.33 0.00 0.00 0.00 176.54 174.31 2oci h GLY 125 N 2.00 0.70 0.94 4.60 0.00 -0.29 -0.03 103.07 110.99 2oci h GLY 125 Ca -0.00 -1.12 -0.01 0.00 0.00 0.00 0.00 47.33 46.20 2oci h GLY 125 CO 0.05 0.99 0.13 -2.22 0.00 0.00 0.00 176.54 175.50 2oci h ILE 126 N 0.39 1.14 -0.86 2.60 2.04 -1.07 -0.68 117.51 121.07 2oci h ILE 126 Ca -0.08 -0.40 0.02 0.00 1.00 0.00 0.00 64.86 65.40 2oci h ILE 126 Cb 1.53 0.91 -0.05 0.00 -0.74 0.00 0.00 36.82 38.48 2oci h ILE 126 CO 0.17 0.14 0.56 0.74 0.00 0.00 0.00 178.15 179.77 2oci h THR 127 N 0.31 1.19 -0.43 -0.27 2.02 -1.07 -2.10 112.91 112.55 2oci h THR 127 Ca 0.09 -0.39 -0.04 0.00 0.77 0.00 0.00 66.41 66.85 2oci h THR 127 Cb 0.11 -0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.45 2oci h THR 127 CO -0.01 0.21 0.12 0.00 0.37 0.00 0.00 175.52 176.21 2oci h ALA 128 N 1.33 0.56 -0.59 6.16 0.00 -0.64 -1.18 119.26 124.91 2oci h ALA 128 Ca 0.33 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 55.11 2oci h ALA 128 Cb -0.08 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.50 2oci h ALA 128 CO -0.09 0.22 0.31 -0.07 0.00 0.00 0.00 179.25 179.63 2oci h LEU 129 N 0.55 0.46 -0.46 0.00 3.38 -0.72 -0.40 115.31 118.13 2oci h LEU 129 Ca 0.14 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 2oci h LEU 129 Cb 0.28 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 2oci h LEU 129 CO -0.00 0.31 0.16 0.40 0.09 0.00 0.00 178.44 179.40 2oci h ILE 130 N 0.60 1.22 -0.56 1.22 2.04 -1.17 -1.89 117.51 118.96 2oci h ILE 130 Ca 0.26 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 2oci h ILE 130 Cb 0.15 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 2oci h ILE 130 CO -0.17 0.25 0.32 0.00 0.00 0.00 0.00 178.15 178.56 2oci h ALA 131 N 1.01 0.72 -0.65 1.87 0.00 -0.69 0.30 119.26 121.82 2oci h ALA 131 Ca 0.15 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2oci h ALA 131 Cb 0.23 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2oci h ALA 131 CO -0.01 0.22 0.23 0.00 0.00 0.00 0.00 179.25 179.70 2oci h ALA 132 N 1.15 1.18 -0.04 0.00 0.00 -0.92 0.85 119.26 121.47 2oci h ALA 132 Ca 0.20 -0.19 -0.19 0.00 0.00 0.00 0.00 54.91 54.74 2oci h ALA 132 Cb 0.02 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2oci h ALA 132 CO -0.03 0.58 -0.78 0.00 0.00 0.00 0.00 179.25 179.02 2oci h ALA 133 N 1.30 0.59 0.00 0.00 0.00 -0.98 -2.86 119.26 117.32 2oci h ALA 133 Ca 0.22 -0.64 -0.13 0.00 0.00 0.00 0.00 54.91 54.35 2oci h ALA 133 Cb 0.23 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2oci h ALA 133 CO -0.01 0.81 -1.28 0.87 0.00 0.00 0.00 179.25 179.64 2oci h LYS 134 N 0.20 0.00 -2.06 0.00 1.57 -0.73 -3.39 116.57 112.16 2oci h LYS 134 Ca -0.04 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.22 2oci h LYS 134 Cb 1.36 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 33.26 2oci h LYS 134 CO 0.13 0.25 -0.96 0.66 -0.57 0.00 0.00 179.45 178.95 2oci n TYR 135 N -2.87 1.87 0.18 -1.35 4.02 0.27 -4.95 117.16 114.33 2oci n TYR 135 Ca -0.07 -3.83 0.13 0.00 -0.01 0.00 0.00 57.90 54.12 2oci n TYR 135 Cb 0.78 -0.44 0.70 0.00 -0.02 0.00 0.00 39.34 40.36 2oci n TYR 135 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2oci h PRO 136 N 2.98 0.00 0.00 -0.72 0.13 -1.69 -1.69 132.00 131.01 2oci h PRO 136 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2oci h PRO 136 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 2oci h PRO 136 CO 0.64 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.28 2oci n SER 137 N -4.36 0.69 0.00 1.44 3.41 -1.26 -3.41 113.62 110.13 2oci n SER 137 Ca 0.01 0.60 0.11 0.00 -0.26 0.00 0.00 58.87 59.33 2oci n SER 137 Cb 0.27 -0.77 -0.14 0.00 -0.26 0.00 0.00 64.21 63.32 2oci n SER 137 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2oci n TYR 138 N -2.18 0.08 -3.70 7.33 9.36 -0.65 -4.93 117.16 122.47 2oci n TYR 138 Ca 0.05 0.02 -0.36 0.00 3.32 0.00 0.00 57.90 60.92 2oci n TYR 138 Cb 0.35 -0.43 -0.10 0.00 -0.63 0.00 0.00 39.34 38.54 2oci n TYR 138 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 2oci s ILE 139 N -3.39 5.21 -0.07 2.97 -1.09 -1.17 -1.55 121.20 122.11 2oci s ILE 139 Ca -0.04 0.13 -0.02 0.00 -2.23 0.00 0.00 60.65 58.49 2oci s ILE 139 Cb 0.14 -3.43 -0.01 0.00 -1.58 0.00 0.00 42.46 37.59 2oci s ILE 139 CO 0.89 0.35 -0.03 -0.74 -1.23 0.00 0.00 174.94 174.17 2oci h HIS 140 N 7.56 0.00 -4.43 3.97 -0.00 -1.01 -3.45 115.15 117.78 2oci h HIS 140 Ca -0.38 0.00 -0.21 0.00 -0.00 0.00 0.00 60.37 59.78 2oci h HIS 140 Cb 1.17 0.00 -0.15 0.00 -0.00 0.00 0.00 27.41 28.43 2oci h HIS 140 CO 0.67 0.00 -0.64 0.15 -0.00 0.00 0.00 177.93 178.11 2oci s LYS 141 N -1.49 1.03 -0.10 5.26 1.02 -1.26 -4.15 119.74 120.05 2oci s LYS 141 Ca -0.03 -1.51 -0.09 0.00 0.02 0.00 0.00 55.97 54.36 2oci s LYS 141 Cb 0.00 0.22 0.03 0.00 -0.52 0.00 0.00 37.83 37.56 2oci s LYS 141 CO 0.04 -0.30 0.26 1.41 -0.92 0.00 0.00 175.35 175.84 2oci s MET 142 N -4.08 0.30 -0.14 1.68 -2.45 -0.80 -1.10 119.30 112.71 2oci s MET 142 Ca 0.29 0.36 -0.00 0.00 -1.25 0.00 0.00 55.69 55.09 2oci s MET 142 Cb 0.07 0.14 0.03 0.00 1.25 0.00 0.00 34.83 36.32 2oci s MET 142 CO 0.05 -0.04 -0.10 0.08 1.05 0.00 0.00 175.02 176.06 2oci s VAL 143 N 0.15 1.29 0.04 10.11 1.01 0.12 -1.06 120.40 132.06 2oci s VAL 143 Ca -0.00 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 61.52 2oci s VAL 143 Cb -0.02 -1.28 -0.02 0.00 0.00 0.00 0.00 36.38 35.06 2oci s VAL 143 CO 0.00 0.37 -0.13 0.27 0.00 0.00 0.00 175.10 175.62 2oci s ILE 144 N 1.59 0.98 -0.11 2.22 -4.36 -0.60 -0.68 121.20 120.24 2oci s ILE 144 Ca 0.04 -1.01 -0.13 0.00 -0.26 0.00 0.00 60.65 59.30 2oci s ILE 144 Cb -0.13 -0.91 0.03 0.00 1.25 0.00 0.00 42.46 42.70 2oci s ILE 144 CO -0.09 -0.08 0.34 -1.66 0.24 0.00 0.00 174.94 173.69 2oci s TRP 145 N -0.95 -0.35 -0.11 1.37 -2.14 -0.84 -1.16 118.94 114.77 2oci s TRP 145 Ca -0.01 0.83 0.00 0.00 2.66 0.00 0.00 56.10 59.58 2oci s TRP 145 Cb -0.08 0.13 0.00 0.00 -3.10 0.00 0.00 33.47 30.41 2oci s TRP 145 CO 0.01 -0.22 0.00 0.41 -2.66 0.00 0.00 176.95 174.49 2oci n GLY 146 N 2.62 0.49 3.89 3.67 0.00 -1.25 -0.57 105.19 114.06 2oci n GLY 146 Ca -0.14 -0.34 -0.29 0.00 0.00 0.00 0.00 46.02 45.24 2oci n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oci s ALA 147 N -1.95 3.57 -0.05 4.61 0.00 -1.26 -4.11 121.76 122.57 2oci s ALA 147 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 51.51 2oci s ALA 147 Cb 0.00 -2.39 0.02 0.00 0.00 0.00 0.00 23.12 20.75 2oci s ALA 147 CO 0.00 0.24 -0.03 0.54 0.00 0.00 0.00 175.76 176.51 2oci s ASN 148 N -3.04 1.06 0.00 0.00 4.22 -1.26 -4.56 114.94 111.36 2oci s ASN 148 Ca 0.46 -0.11 0.30 0.00 -2.14 0.00 0.00 52.86 51.37 2oci s ASN 148 Cb -0.11 -0.42 1.43 0.00 1.28 0.00 0.00 41.25 43.43 2oci s ASN 148 CO 0.29 -0.10 1.98 0.00 -2.04 0.00 0.00 177.10 177.23 2oci n ALA 149 N 4.34 2.66 -3.80 3.54 0.00 -1.26 -4.85 120.51 121.14 2oci n ALA 149 Ca -0.20 -0.23 -0.05 0.00 0.00 0.00 0.00 53.44 52.95 2oci n ALA 149 Cb 0.51 -1.40 -0.01 0.00 0.00 0.00 0.00 19.45 18.55 2oci n ALA 149 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2oci s TYR 150 N -2.37 -0.08 -0.05 0.00 -0.85 -1.26 -1.06 117.35 111.67 2oci s TYR 150 Ca 0.33 -0.31 0.06 0.00 -0.52 0.00 0.00 57.07 56.63 2oci s TYR 150 Cb 0.21 0.69 -0.01 0.00 0.38 0.00 0.00 41.96 43.22 2oci s TYR 150 CO 0.44 -1.02 -0.24 0.14 -1.52 0.00 0.00 175.55 173.36 2oci s VAL 151 N -3.15 1.93 0.53 -3.49 -7.23 -0.27 -4.93 120.40 103.79 2oci s VAL 151 Ca 0.14 -1.00 0.02 0.00 -1.81 0.00 0.00 61.98 59.32 2oci s VAL 151 Cb -0.03 -1.64 0.01 0.00 0.56 0.00 0.00 36.38 35.28 2oci s VAL 151 CO 0.05 0.54 0.12 0.42 -0.31 0.00 0.00 175.10 175.92 2oci s THR 152 N -0.16 1.23 0.29 5.32 -4.23 -1.26 -4.53 115.64 112.29 2oci s THR 152 Ca -0.03 -1.85 -0.01 0.00 -1.18 0.00 0.00 61.69 58.62 2oci s THR 152 Cb -0.13 -2.08 0.19 0.00 1.34 0.00 0.00 72.50 71.82 2oci s THR 152 CO 0.03 0.00 1.87 0.44 -0.54 0.00 0.00 174.62 176.42 2oci h ASP 153 N 1.13 0.82 -0.33 3.99 3.32 -2.00 -0.63 116.42 122.72 2oci h ASP 153 Ca -0.42 -0.11 -0.05 0.00 0.02 0.00 0.00 57.03 56.47 2oci h ASP 153 Cb 1.32 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.64 2oci h ASP 153 CO 0.69 0.73 0.04 -0.08 -1.72 0.00 0.00 179.24 178.89 2oci h GLU 154 N 0.89 0.65 -0.33 3.56 4.81 -2.01 -2.45 114.58 119.70 2oci h GLU 154 Ca 0.21 -0.14 -0.16 0.00 -0.13 0.00 0.00 59.36 59.13 2oci h GLU 154 Cb 0.17 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.45 2oci h GLU 154 CO -0.02 0.65 -0.44 -0.44 -0.73 0.00 0.00 179.01 178.02 2oci h ASP 155 N 0.62 0.93 -0.60 1.04 3.45 -1.70 -3.17 116.42 116.98 2oci h ASP 155 Ca 0.13 -0.45 0.08 0.00 0.43 0.00 0.00 57.03 57.22 2oci h ASP 155 Cb 0.34 -0.26 -0.06 0.00 -0.56 0.00 0.00 39.33 38.78 2oci h ASP 155 CO 0.01 1.23 0.27 0.28 -1.57 0.00 0.00 179.24 179.46 2oci h SER 156 N 0.69 0.33 -0.55 6.45 0.02 -0.68 0.65 113.55 120.47 2oci h SER 156 Ca 0.04 0.06 0.01 0.00 -0.84 0.00 0.00 61.79 61.06 2oci h SER 156 Cb 1.03 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.55 2oci h SER 156 CO 0.10 0.21 0.36 0.24 -1.14 0.00 0.00 176.83 176.60 2oci h MET 157 N 0.49 0.68 0.26 3.45 2.86 -1.49 -1.01 114.93 120.17 2oci h MET 157 Ca 0.29 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.88 2oci h MET 157 Cb 0.29 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.80 2oci h MET 157 CO -0.25 0.45 -0.12 0.82 1.06 0.00 0.00 176.91 178.87 2oci h ILE 158 N 0.71 0.71 0.00 -1.22 2.04 -0.91 -2.54 117.51 116.29 2oci h ILE 158 Ca 0.21 -0.82 -0.11 0.00 1.00 0.00 0.00 64.86 65.13 2oci h ILE 158 Cb -0.03 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 2oci h ILE 158 CO -0.05 0.15 -0.53 0.10 0.00 0.00 0.00 178.15 177.83 2oci h TYR 159 N -0.83 0.00 -0.30 1.37 -0.00 -1.07 -2.50 116.97 113.63 2oci h TYR 159 Ca -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 58.73 58.60 2oci h TYR 159 Cb 0.51 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.23 2oci h TYR 159 CO 0.05 0.53 -0.23 0.93 -0.00 0.00 0.00 178.16 179.44 2oci h GLU 160 N 0.00 0.58 0.00 0.10 4.39 -1.29 -2.60 114.58 115.77 2oci h GLU 160 Ca -0.01 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.48 2oci h GLU 160 Cb 0.96 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.57 2oci h GLU 160 CO 0.07 0.77 0.00 0.41 -1.16 0.00 0.00 179.01 179.09 2oci n GLY 161 N -0.35 -0.93 0.35 -3.84 0.00 -0.95 -2.53 105.19 96.94 2oci n GLY 161 Ca -0.00 -0.04 0.04 0.00 0.00 0.00 0.00 46.02 46.01 2oci n GLY 161 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2oci n ILE 162 N -1.50 0.31 -0.31 -0.61 -5.35 -0.99 -4.67 119.36 106.25 2oci n ILE 162 Ca 0.03 -0.65 0.04 0.00 -0.27 0.00 0.00 62.75 61.89 2oci n ILE 162 Cb 0.14 0.96 0.18 0.00 -1.74 0.00 0.00 39.64 39.18 2oci n ILE 162 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 2oci h ARG 163 N 1.47 0.81 -5.44 6.28 2.43 -1.40 -3.37 114.38 115.16 2oci h ARG 163 Ca 0.00 -0.05 -0.64 0.00 -0.81 0.00 0.00 59.98 58.48 2oci h ARG 163 Cb 0.42 -0.18 -0.15 0.00 -0.42 0.00 0.00 29.97 29.64 2oci h ARG 163 CO 0.00 0.53 0.38 0.34 -1.51 0.00 0.00 179.97 179.71 2oci s ASP 164 N -5.62 6.26 0.22 -3.80 3.68 -1.26 -4.27 116.67 111.88 2oci s ASP 164 Ca -0.12 -0.71 0.14 0.00 2.13 0.00 0.00 52.55 53.99 2oci s ASP 164 Cb 0.20 -2.38 0.78 0.00 -1.45 0.00 0.00 42.92 40.07 2oci s ASP 164 CO 0.79 -1.16 1.42 1.33 0.13 0.00 0.00 175.17 177.68 2oci n VAL 165 N 5.93 1.27 -0.23 1.11 0.24 -1.26 -1.84 118.33 123.54 2oci n VAL 165 Ca -0.02 0.67 -0.05 0.00 -2.04 0.00 0.00 64.34 62.89 2oci n VAL 165 Cb 0.46 -1.67 0.09 0.00 -1.47 0.00 0.00 33.84 31.26 2oci n VAL 165 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2oci h SER 166 N 0.00 1.01 0.73 -1.34 0.02 -1.93 -2.44 113.55 109.59 2oci h SER 166 Ca 0.00 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 2oci h SER 166 Cb 0.06 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.34 2oci h SER 166 CO 0.00 0.94 -0.15 0.29 -1.14 0.00 0.00 176.83 176.77 2oci n LYS 167 N -4.26 0.15 -0.75 3.45 5.02 -0.76 -4.91 118.16 116.09 2oci n LYS 167 Ca 0.06 -0.04 -0.32 0.00 -2.02 0.00 0.00 58.31 55.98 2oci n LYS 167 Cb 0.23 -1.50 0.14 0.00 -0.02 0.00 0.00 35.03 33.88 2oci n LYS 167 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 2oci n TRP 168 N -1.39 -0.34 -2.00 2.13 7.02 -0.92 -4.92 117.44 117.02 2oci n TRP 168 Ca 0.08 0.31 -0.39 0.00 -1.02 0.00 0.00 57.50 56.49 2oci n TRP 168 Cb 0.32 -1.89 0.01 0.00 -2.42 0.00 0.00 31.31 27.33 2oci n TRP 168 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2oci s SER 169 N -2.29 5.97 0.20 -0.99 0.15 -1.26 -4.88 113.70 110.58 2oci s SER 169 Ca 0.62 2.64 -0.10 0.00 0.70 0.00 0.00 55.95 59.80 2oci s SER 169 Cb -0.22 -2.63 0.13 0.00 -1.71 0.00 0.00 66.02 61.58 2oci s SER 169 CO 0.63 -1.09 1.81 -0.08 1.20 0.00 0.00 173.24 175.71 2oci h GLU 170 N 2.19 0.99 -0.31 5.44 4.57 -1.96 -0.93 114.58 124.57 2oci h GLU 170 Ca -0.50 -0.12 -0.14 0.00 -1.18 0.00 0.00 59.36 57.42 2oci h GLU 170 Cb 1.26 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 29.65 2oci h GLU 170 CO 0.60 0.74 -0.39 0.07 -1.18 0.00 0.00 179.01 178.86 2oci h ARG 171 N 0.97 0.73 0.00 1.92 0.11 -2.01 -2.55 114.38 113.55 2oci h ARG 171 Ca 0.25 -0.38 -0.12 0.00 0.10 0.00 0.00 59.98 59.83 2oci h ARG 171 Cb 0.05 0.01 -0.02 0.00 1.11 0.00 0.00 29.97 31.12 2oci h ARG 171 CO -0.04 0.99 -0.57 1.79 0.10 0.00 0.00 179.97 182.25 2oci h THR 172 N 0.60 1.07 0.23 0.08 1.35 -1.90 -3.33 112.91 111.00 2oci h THR 172 Ca 0.05 -2.25 -0.34 0.00 -0.55 0.00 0.00 66.41 63.32 2oci h THR 172 Cb 0.94 2.35 0.03 0.00 -1.73 0.00 0.00 68.15 69.74 2oci h THR 172 CO 0.09 0.56 -1.53 -0.09 -0.25 0.00 0.00 175.52 174.29 2oci h ARG 173 N 0.00 0.48 -0.64 4.72 2.43 -1.15 -3.39 114.38 116.83 2oci h ARG 173 Ca -0.01 -0.82 0.12 0.00 -0.81 0.00 0.00 59.98 58.46 2oci h ARG 173 Cb 1.31 0.31 -0.12 0.00 -0.42 0.00 0.00 29.97 31.04 2oci h ARG 173 CO 0.07 1.39 -0.28 -0.22 -1.51 0.00 0.00 179.97 179.42 2oci h LYS 174 N 0.13 -0.10 -0.63 0.20 3.64 -1.56 0.84 116.57 119.09 2oci h LYS 174 Ca -0.27 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.09 2oci h LYS 174 Cb 2.14 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 33.95 2oci h LYS 174 CO 0.25 -0.07 0.26 -1.00 -2.27 0.00 0.00 179.45 176.62 2oci h PRO 175 N -0.10 0.91 0.06 1.90 0.13 -1.75 -0.67 132.00 132.48 2oci h PRO 175 Ca 0.27 -0.14 -0.25 0.00 -0.87 0.00 0.00 66.00 65.02 2oci h PRO 175 Cb 0.54 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 31.51 2oci h PRO 175 CO -0.71 0.74 -1.07 -0.07 -0.23 0.00 0.00 178.00 176.66 2oci h LEU 176 N 0.90 0.49 -0.94 1.56 3.38 -1.58 -2.27 115.31 116.84 2oci h LEU 176 Ca 0.22 -0.45 -0.09 0.00 0.09 0.00 0.00 57.88 57.65 2oci h LEU 176 Cb 0.16 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2oci h LEU 176 CO -0.02 1.28 -0.16 -0.08 0.09 0.00 0.00 178.44 179.55 2oci h GLU 177 N 0.16 0.59 -0.27 1.13 4.81 -0.69 -0.74 114.58 119.56 2oci h GLU 177 Ca -0.11 -0.19 -0.15 0.00 -0.13 0.00 0.00 59.36 58.78 2oci h GLU 177 Cb 1.75 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 31.08 2oci h GLU 177 CO 0.18 0.73 -0.41 0.00 -0.73 0.00 0.00 179.01 178.78 2oci h ALA 178 N 1.29 0.41 -0.16 2.92 0.00 -1.10 0.26 119.26 122.90 2oci h ALA 178 Ca 0.09 -0.46 -0.07 0.00 0.00 0.00 0.00 54.91 54.47 2oci h ALA 178 Cb 0.59 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 2oci h ALA 178 CO 0.04 0.52 -0.17 1.25 0.00 0.00 0.00 179.25 180.89 2oci h LEU 179 N 0.50 0.42 0.00 0.00 5.85 -1.20 -3.37 115.31 117.50 2oci h LEU 179 Ca 0.03 -0.49 -0.14 0.00 0.84 0.00 0.00 57.88 58.12 2oci h LEU 179 Cb 1.00 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.89 2oci h LEU 179 CO 0.09 0.82 -2.02 -1.22 -0.34 0.00 0.00 178.44 175.77 2oci n TYR 180 N -4.52 0.00 0.00 1.25 4.02 -0.30 -5.09 117.16 112.52 2oci n TYR 180 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.83 2oci n TYR 180 Cb 0.38 -0.62 0.00 0.00 -0.02 0.00 0.00 39.34 39.08 2oci n TYR 180 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2oci n GLY 181 N 1.62 0.61 0.23 2.72 0.00 0.93 -4.42 105.19 106.88 2oci n GLY 181 Ca -0.14 -1.60 -0.07 0.00 0.00 0.00 0.00 46.02 44.21 2oci n GLY 181 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2oci h TYR 182 N 0.00 -0.46 0.13 1.61 3.20 -1.90 -2.77 116.97 116.78 2oci h TYR 182 Ca 0.00 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.92 2oci h TYR 182 Cb 0.00 0.25 -0.05 0.00 1.54 0.00 0.00 36.73 38.47 2oci h TYR 182 CO 0.00 -0.26 -0.53 -0.44 -1.64 0.00 0.00 178.16 175.29 2oci h ASP 183 N -0.15 -1.59 -0.73 -2.11 3.32 -1.95 0.15 116.42 113.37 2oci h ASP 183 Ca 0.16 0.17 -0.00 0.00 0.02 0.00 0.00 57.03 57.37 2oci h ASP 183 Cb 0.39 0.58 -0.04 0.00 0.22 0.00 0.00 39.33 40.49 2oci h ASP 183 CO -0.39 -0.56 0.44 0.22 -1.72 0.00 0.00 179.24 177.23 2oci h TYR 184 N -0.76 0.96 0.65 4.55 3.20 -1.77 -0.75 116.97 123.05 2oci h TYR 184 Ca -0.01 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.83 2oci h TYR 184 Cb 0.76 -0.32 0.01 0.00 1.54 0.00 0.00 36.73 38.72 2oci h TYR 184 CO -0.45 0.64 -0.31 0.35 -1.64 0.00 0.00 178.16 176.75 2oci h PHE 185 N 1.01 -0.80 0.02 -3.82 3.57 -1.18 -1.01 116.94 114.73 2oci h PHE 185 Ca 0.27 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.77 2oci h PHE 185 Cb -0.04 0.27 -0.04 0.00 2.79 0.00 0.00 35.95 38.92 2oci h PHE 185 CO 0.00 -0.48 -0.23 0.00 -2.23 0.00 0.00 178.31 175.38 2oci h ALA 186 N -0.64 -0.32 -0.55 2.41 0.00 -0.47 -1.67 119.26 118.03 2oci h ALA 186 Ca -0.09 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2oci h ALA 186 Cb 0.69 0.40 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 2oci h ALA 186 CO 0.15 -0.74 0.32 0.07 0.00 0.00 0.00 179.25 179.05 2oci h ARG 187 N -0.37 0.75 -0.19 0.00 -0.00 -1.16 -2.11 114.38 111.29 2oci h ARG 187 Ca 0.06 -0.08 -0.07 0.00 -0.00 0.00 0.00 59.98 59.89 2oci h ARG 187 Cb 0.45 -0.15 -0.01 0.00 -0.00 0.00 0.00 29.97 30.25 2oci h ARG 187 CO -0.20 0.56 -0.20 1.15 -0.00 0.00 0.00 179.97 181.28 2oci h THR 188 N 0.74 1.23 -0.54 0.08 2.02 -1.05 -0.63 112.91 114.75 2oci h THR 188 Ca 0.20 -1.06 -0.08 0.00 0.77 0.00 0.00 66.41 66.23 2oci h THR 188 Cb 0.01 1.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 2oci h THR 188 CO -0.03 0.33 0.03 0.00 0.37 0.00 0.00 175.52 176.22 2oci h GLU 190 N 0.82 1.03 -0.05 0.00 5.08 -0.85 -1.73 114.58 118.88 2oci h GLU 190 Ca 0.16 -0.24 -0.08 0.00 -1.00 0.00 0.00 59.36 58.19 2oci h GLU 190 Cb 0.49 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 2oci h GLU 190 CO 0.02 0.92 -0.36 0.87 -1.00 0.00 0.00 179.01 179.45 2oci h LYS 191 N 0.95 0.09 -0.21 2.33 1.57 -0.81 -1.77 116.57 118.73 2oci h LYS 191 Ca 0.20 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.90 2oci h LYS 191 Cb 0.34 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 2oci h LYS 191 CO -0.00 0.45 -0.05 2.35 -0.57 0.00 0.00 179.45 181.63 2oci h TRP 192 N 0.08 0.45 -0.92 -1.35 7.01 -0.36 -1.25 115.95 119.60 2oci h TRP 192 Ca 0.01 -0.09 -0.01 0.00 2.11 0.00 0.00 58.89 60.90 2oci h TRP 192 Cb 0.69 -0.11 -0.04 0.00 -2.10 0.00 0.00 29.16 27.59 2oci h TRP 192 CO 0.00 0.64 0.53 0.28 -2.79 0.00 0.00 178.44 177.10 2oci h VAL 193 N 0.12 1.26 -0.51 2.65 2.07 -1.11 -1.17 116.25 119.56 2oci h VAL 193 Ca 0.05 -0.61 -0.04 0.00 0.82 0.00 0.00 66.70 66.92 2oci h VAL 193 Cb 0.49 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 2oci h VAL 193 CO 0.02 0.28 0.16 0.44 0.02 0.00 0.00 177.57 178.49 2oci h ASP 194 N 1.28 0.70 -0.48 0.57 3.32 -1.16 -1.38 116.42 119.27 2oci h ASP 194 Ca 0.33 -0.10 -0.10 0.00 0.02 0.00 0.00 57.03 57.17 2oci h ASP 194 Cb -0.01 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 2oci h ASP 194 CO -0.06 0.67 -0.10 1.23 -1.72 0.00 0.00 179.24 179.26 2oci h GLY 195 N 0.91 0.98 1.16 2.75 0.00 -0.29 -3.07 103.07 105.52 2oci h GLY 195 Ca 0.17 -0.80 -0.10 0.00 0.00 0.00 0.00 47.33 46.59 2oci h GLY 195 CO -0.01 0.73 -0.07 -2.22 0.00 0.00 0.00 176.54 174.98 2oci h ILE 196 N 0.76 1.26 -0.98 2.60 5.03 -0.88 -2.85 117.51 122.46 2oci h ILE 196 Ca 0.12 -1.21 0.18 0.00 -0.12 0.00 0.00 64.86 63.83 2oci h ILE 196 Cb 0.65 0.92 -0.09 0.00 -3.03 0.00 0.00 36.82 35.27 2oci h ILE 196 CO 0.04 0.43 0.61 0.03 -0.68 0.00 0.00 178.15 178.59 2oci h ARG 197 N 0.89 0.72 -0.12 2.37 3.08 -1.17 -0.23 114.38 119.92 2oci h ARG 197 Ca 0.15 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.17 2oci h ARG 197 Cb 0.62 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2oci h ARG 197 CO 0.04 0.48 0.08 1.96 -1.07 0.00 0.00 179.97 181.46 2oci h GLN 198 N 0.74 0.07 0.00 0.04 1.08 -1.45 -1.57 115.11 114.02 2oci h GLN 198 Ca 0.53 -0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.62 2oci h GLN 198 Cb 0.86 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.26 2oci h GLN 198 CO -0.31 0.05 -0.51 0.74 -0.95 0.00 0.00 178.83 177.85 2oci h PHE 199 N 0.07 0.00 0.00 2.96 0.05 -1.13 -2.92 116.94 115.97 2oci h PHE 199 Ca 0.05 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.82 2oci h PHE 199 Cb 0.12 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 38.06 2oci h PHE 199 CO -0.00 0.51 -0.11 -0.22 -0.18 0.00 0.00 178.31 178.32 2oci h LYS 200 N 0.00 0.00 0.00 1.51 1.63 -1.28 -2.22 116.57 116.21 2oci h LYS 200 Ca -0.01 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 2oci h LYS 200 Cb 0.91 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.54 2oci h LYS 200 CO 0.07 0.11 -0.01 0.45 -3.45 0.00 0.00 179.45 176.61 2oci h HIS 201 N 0.00 0.00 -4.21 1.91 3.86 -1.57 -3.41 115.15 111.73 2oci h HIS 201 Ca -0.00 0.00 -0.50 0.00 -1.16 0.00 0.00 60.37 58.71 2oci h HIS 201 Cb 0.21 0.00 0.06 0.00 1.06 0.00 0.00 27.41 28.74 2oci h HIS 201 CO 0.00 0.00 0.36 -0.51 0.86 0.00 0.00 177.93 178.64 2oci s LEU 202 N -4.97 3.26 0.32 2.43 1.43 -0.83 -4.95 118.68 115.37 2oci s LEU 202 Ca 0.10 1.27 -0.29 0.00 -1.03 0.00 0.00 54.13 54.18 2oci s LEU 202 Cb 0.10 -4.27 -0.12 0.00 0.03 0.00 0.00 46.19 41.93 2oci s LEU 202 CO 0.62 -0.88 1.36 -2.65 0.23 0.00 0.00 176.35 175.03 2oci n PRO 203 N -2.69 2.22 -1.09 1.29 -0.02 -1.26 -1.02 135.00 132.43 2oci n PRO 203 Ca 0.05 0.78 -0.04 0.00 -2.02 0.00 0.00 63.50 62.27 2oci n PRO 203 Cb 0.55 -2.41 -0.02 0.00 -0.02 0.00 0.00 33.50 31.60 2oci n PRO 203 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2oci n ASP 204 N 1.11 -5.68 -2.56 2.55 9.92 -1.26 -1.97 116.55 118.65 2oci n ASP 204 Ca 0.06 0.10 -0.16 0.00 -0.53 0.00 0.00 54.79 54.26 2oci n ASP 204 Cb 0.36 -3.66 -0.00 0.00 -0.64 0.00 0.00 41.12 37.17 2oci n ASP 204 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2oci n GLY 205 N 0.69 -0.50 3.75 0.44 0.00 -0.19 -4.56 105.19 104.82 2oci n GLY 205 Ca -0.04 0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 2oci n GLY 205 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2oci n ASN 206 N -1.95 3.78 0.01 1.61 5.15 -0.83 -1.12 115.26 121.91 2oci n ASN 206 Ca -0.15 1.16 -0.02 0.00 -0.60 0.00 0.00 54.58 54.97 2oci n ASN 206 Cb 0.62 -1.59 -0.01 0.00 -0.53 0.00 0.00 39.78 38.28 2oci n ASN 206 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 2oci n ILE 207 N 1.85 0.69 -2.18 -1.44 5.41 -0.36 -4.86 119.36 118.47 2oci n ILE 207 Ca 0.08 0.17 -0.03 0.00 1.00 0.00 0.00 62.75 63.96 2oci n ILE 207 Cb 0.37 -1.60 -0.04 0.00 -0.71 0.00 0.00 39.64 37.66 2oci n ILE 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2oci h ARG 209 N 0.35 1.10 0.00 0.00 3.08 -1.92 -1.95 114.38 115.05 2oci h ARG 209 Ca -0.43 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.55 2oci h ARG 209 Cb 1.57 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 31.38 2oci h ARG 209 CO -0.14 0.73 0.00 1.12 -1.07 0.00 0.00 179.97 180.61 2oci h HIS 210 N 1.13 0.00 0.00 3.04 2.07 -1.92 -3.09 115.15 116.39 2oci h HIS 210 Ca 0.44 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.96 2oci h HIS 210 Cb 0.22 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.20 2oci h HIS 210 CO -0.00 0.00 -1.28 1.28 -3.07 0.00 0.00 177.93 174.85 2oci n LEU 211 N -2.86 0.61 -0.16 6.12 4.77 -0.75 -4.36 117.00 120.38 2oci n LEU 211 Ca 0.01 0.24 -0.02 0.00 -0.03 0.00 0.00 56.01 56.20 2oci n LEU 211 Cb 0.27 -0.04 0.06 0.00 -2.33 0.00 0.00 43.42 41.38 2oci n LEU 211 CO 0.25 -0.14 0.86 -0.07 -1.33 0.00 0.00 177.39 176.96 2oci h LEU 212 N 0.00 -0.17 -0.32 2.23 3.38 -1.43 0.24 115.31 119.24 2oci h LEU 212 Ca 0.00 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2oci h LEU 212 Cb 1.00 0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2oci h LEU 212 CO 0.00 -0.05 0.00 -2.65 0.09 0.00 0.00 178.44 175.83 2oci n PRO 213 N -5.21 0.05 -0.00 1.13 -0.02 -1.22 -1.81 135.00 127.92 2oci n PRO 213 Ca 0.06 0.43 0.13 0.00 -2.02 0.00 0.00 63.50 62.09 2oci n PRO 213 Cb 0.27 -1.62 0.22 0.00 -0.02 0.00 0.00 33.50 32.35 2oci n PRO 213 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2oci n ARG 214 N -1.72 2.14 -2.48 -0.52 1.74 0.06 -4.87 116.66 111.02 2oci n ARG 214 Ca 0.01 -1.66 -0.42 0.00 -0.77 0.00 0.00 57.85 55.01 2oci n ARG 214 Cb 0.09 -1.47 -0.03 0.00 -1.02 0.00 0.00 32.46 30.04 2oci n ARG 214 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2oci s VAL 215 N -1.99 4.32 -1.11 1.55 1.01 -0.75 -4.47 120.40 118.96 2oci s VAL 215 Ca 0.31 1.63 0.13 0.00 0.00 0.00 0.00 61.98 64.06 2oci s VAL 215 Cb 0.20 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 2oci s VAL 215 CO 0.31 -0.03 0.72 0.00 0.00 0.00 0.00 175.10 176.10 2oci n GLN 216 N 5.48 2.03 -3.77 2.72 6.02 -1.26 -4.58 117.38 124.01 2oci n GLN 216 Ca 0.11 -0.57 -0.22 0.00 -0.01 0.00 0.00 57.00 56.31 2oci n GLN 216 Cb 0.46 -1.18 -0.02 0.00 1.02 0.00 0.00 30.24 30.53 2oci n GLN 216 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2oci s PRO 218 N -4.09 4.19 0.03 0.00 0.02 -1.26 -4.88 135.00 129.02 2oci s PRO 218 Ca 0.37 2.42 0.05 0.00 0.02 0.00 0.00 61.00 63.86 2oci s PRO 218 Cb -0.09 -3.13 -0.02 0.00 0.02 0.00 0.00 34.50 31.28 2oci s PRO 218 CO 0.31 -0.63 -0.16 0.00 -0.33 0.00 0.00 177.00 176.19 2oci s ALA 219 N 1.04 1.32 -0.19 -1.55 0.00 -1.26 -1.90 121.76 119.22 2oci s ALA 219 Ca 0.70 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 51.84 2oci s ALA 219 Cb -0.45 -0.25 0.03 0.00 0.00 0.00 0.00 23.12 22.45 2oci s ALA 219 CO 0.33 0.28 -0.16 -1.17 0.00 0.00 0.00 175.76 175.04 2oci s LEU 220 N -0.95 2.34 -0.28 0.00 2.96 -0.22 -1.08 118.68 121.46 2oci s LEU 220 Ca 0.04 -0.81 -0.10 0.00 -0.22 0.00 0.00 54.13 53.04 2oci s LEU 220 Cb -0.08 -1.41 -0.04 0.00 0.50 0.00 0.00 46.19 45.16 2oci s LEU 220 CO 0.01 -0.07 0.16 -0.63 -1.32 0.00 0.00 176.35 174.50 2oci s ILE 221 N 1.30 5.04 -0.08 6.68 1.01 0.11 -1.56 121.20 133.71 2oci s ILE 221 Ca 0.01 0.04 -0.01 0.00 0.00 0.00 0.00 60.65 60.69 2oci s ILE 221 Cb -0.15 -3.41 -0.03 0.00 0.01 0.00 0.00 42.46 38.88 2oci s ILE 221 CO -0.10 0.25 -0.02 -0.69 0.00 0.00 0.00 174.94 174.38 2oci s VAL 222 N 1.72 4.16 -0.02 2.92 1.01 -0.31 0.05 120.40 129.93 2oci s VAL 222 Ca 0.07 -0.30 -0.00 0.00 0.00 0.00 0.00 61.98 61.74 2oci s VAL 222 Cb -0.16 -2.74 0.02 0.00 0.00 0.00 0.00 36.38 33.50 2oci s VAL 222 CO 0.09 0.60 0.03 -2.28 0.00 0.00 0.00 175.10 173.54 2oci s HIS 223 N -0.82 -0.00 -0.27 5.22 5.04 -0.15 -3.77 115.29 120.54 2oci s HIS 223 Ca 0.12 0.12 -0.21 0.00 -1.54 0.00 0.00 55.06 53.55 2oci s HIS 223 Cb -0.11 -0.12 -0.01 0.00 0.04 0.00 0.00 32.58 32.37 2oci s HIS 223 CO 0.02 -0.06 0.65 0.20 -2.34 0.00 0.00 174.74 173.21 2oci s GLY 224 N 0.62 1.79 0.60 1.59 0.00 -1.26 -0.93 107.32 109.74 2oci s GLY 224 Ca -0.05 -0.48 0.41 0.00 0.00 0.00 0.00 44.72 44.59 2oci s GLY 224 CO -0.02 1.49 2.24 0.83 0.00 0.00 0.00 173.10 177.65 2oci h GLU 225 N 7.99 0.00 -0.51 2.90 5.08 -0.81 -0.36 114.58 128.87 2oci h GLU 225 Ca -0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2oci h GLU 225 Cb 1.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2oci h GLU 225 CO 0.80 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 180.44 2oci n LYS 226 N -2.92 3.68 -1.64 2.33 5.02 -0.12 -4.96 118.16 119.54 2oci n LYS 226 Ca -0.03 -2.83 -0.42 0.00 -2.02 0.00 0.00 58.31 53.01 2oci n LYS 226 Cb 0.06 -1.88 -0.03 0.00 -0.02 0.00 0.00 35.03 33.16 2oci n LYS 226 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2oci n ASP 227 N 0.59 3.88 0.03 4.39 -0.08 -0.15 -4.67 116.55 120.55 2oci n ASP 227 Ca 0.23 0.68 0.13 0.00 -1.51 0.00 0.00 54.79 54.33 2oci n ASP 227 Cb 0.89 -1.53 0.42 0.00 2.34 0.00 0.00 41.12 43.24 2oci n ASP 227 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2oci n PRO 228 N 7.91 0.10 -0.09 -0.67 -0.04 -1.26 -4.21 135.00 136.74 2oci n PRO 228 Ca 0.23 0.06 -0.18 0.00 -0.04 0.00 0.00 63.50 63.58 2oci n PRO 228 Cb 0.42 -1.60 -0.13 0.00 -0.04 0.00 0.00 33.50 32.15 2oci n PRO 228 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2oci n LEU 229 N -1.76 2.52 -4.15 1.53 4.77 -1.26 -4.88 117.00 113.76 2oci n LEU 229 Ca 0.06 -0.03 -0.34 0.00 -0.03 0.00 0.00 56.01 55.67 2oci n LEU 229 Cb 0.37 -0.77 -0.14 0.00 -2.33 0.00 0.00 43.42 40.55 2oci n LEU 229 CO 0.31 0.86 -0.37 -0.69 -1.33 0.00 0.00 177.39 176.17 2oci s VAL 230 N -2.53 2.83 0.62 4.08 1.01 -1.26 -4.99 120.40 120.16 2oci s VAL 230 Ca -0.28 -1.47 -0.19 0.00 0.00 0.00 0.00 61.98 60.03 2oci s VAL 230 Cb 0.08 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.78 2oci s VAL 230 CO 0.67 -0.12 1.23 -2.65 0.00 0.00 0.00 175.10 174.23 2oci n PRO 231 N 4.58 1.18 0.30 2.72 -0.02 -1.26 -4.80 135.00 137.69 2oci n PRO 231 Ca -0.13 0.45 0.16 0.00 -2.02 0.00 0.00 63.50 61.97 2oci n PRO 231 Cb 0.43 -2.45 0.92 0.00 -0.02 0.00 0.00 33.50 32.37 2oci n PRO 231 CO 0.00 0.00 0.00 0.07 1.98 0.00 0.00 175.50 177.55 2oci h ARG 232 N 0.70 0.00 -0.03 -0.52 0.11 -1.93 -2.51 114.38 110.20 2oci h ARG 232 Ca -0.50 0.00 0.01 0.00 0.10 0.00 0.00 59.98 59.59 2oci h ARG 232 Cb 1.34 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.42 2oci h ARG 232 CO 0.53 0.04 0.06 0.27 0.10 0.00 0.00 179.97 180.97 2oci h PHE 233 N 0.00 0.00 -0.22 4.08 -5.15 -1.99 -0.71 116.94 112.95 2oci h PHE 233 Ca -0.00 0.00 -0.18 0.00 -0.20 0.00 0.00 57.97 57.59 2oci h PHE 233 Cb 0.14 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.31 2oci h PHE 233 CO 0.00 0.00 -0.59 0.45 -2.00 0.00 0.00 178.31 176.17 2oci h HIS 234 N 0.00 0.89 -0.17 6.09 3.86 -1.80 -0.99 115.15 123.03 2oci h HIS 234 Ca 0.02 -0.33 -0.19 0.00 -1.16 0.00 0.00 60.37 58.71 2oci h HIS 234 Cb 0.14 -0.16 -0.00 0.00 1.06 0.00 0.00 27.41 28.44 2oci h HIS 234 CO 0.00 1.11 -0.66 0.00 0.86 0.00 0.00 177.93 179.25 2oci h ALA 235 N 0.81 0.53 -0.72 2.45 0.00 -1.34 -2.33 119.26 118.67 2oci h ALA 235 Ca 0.00 -0.56 -0.04 0.00 0.00 0.00 0.00 54.91 54.31 2oci h ALA 235 Cb 1.17 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 2oci h ALA 235 CO 0.12 0.70 0.27 -0.44 0.00 0.00 0.00 179.25 179.90 2oci h ASP 236 N 0.46 0.99 -0.30 0.00 3.32 -1.20 -0.82 116.42 118.87 2oci h ASP 236 Ca -0.02 -0.15 -0.05 0.00 0.02 0.00 0.00 57.03 56.83 2oci h ASP 236 Cb 1.24 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.52 2oci h ASP 236 CO 0.13 0.89 -0.00 0.15 -1.72 0.00 0.00 179.24 178.68 2oci h PHE 237 N 1.04 0.58 -0.61 4.55 3.57 -1.07 0.09 116.94 125.09 2oci h PHE 237 Ca 0.24 -0.10 -0.05 0.00 3.53 0.00 0.00 57.97 61.59 2oci h PHE 237 Cb 0.22 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 2oci h PHE 237 CO 0.02 0.66 0.19 0.82 -2.23 0.00 0.00 178.31 177.77 2oci h ILE 238 N 0.32 1.24 -0.56 1.41 2.04 -1.26 -2.00 117.51 118.71 2oci h ILE 238 Ca 0.08 -0.83 -0.00 0.00 1.00 0.00 0.00 64.86 65.11 2oci h ILE 238 Cb 0.44 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 2oci h ILE 238 CO 0.02 0.32 0.33 -0.74 0.00 0.00 0.00 178.15 178.08 2oci h HIS 239 N 0.86 0.74 -0.76 1.37 2.76 -1.03 -0.90 115.15 118.19 2oci h HIS 239 Ca 0.20 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.38 2oci h HIS 239 Cb 0.29 -0.24 -0.04 0.00 1.55 0.00 0.00 27.41 28.97 2oci h HIS 239 CO 0.02 0.51 0.50 -0.22 -1.30 0.00 0.00 177.93 177.44 2oci h LYS 240 N 0.75 0.98 -0.00 5.26 3.64 -0.62 -3.23 116.57 123.34 2oci h LYS 240 Ca 0.20 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 2oci h LYS 240 Cb -0.01 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.59 2oci h LYS 240 CO -0.04 0.65 -0.68 0.72 -2.27 0.00 0.00 179.45 177.84 2oci n HIS 241 N -4.57 0.00 -3.24 1.91 8.25 -0.78 -4.73 115.22 112.06 2oci n HIS 241 Ca 0.08 0.00 -0.45 0.00 -0.26 0.00 0.00 57.72 57.09 2oci n HIS 241 Cb 0.04 -0.09 -0.06 0.00 1.12 0.00 0.00 29.99 31.00 2oci n HIS 241 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2oci s VAL 242 N -2.85 5.02 0.25 1.59 1.01 -0.36 -3.40 120.40 121.65 2oci s VAL 242 Ca 0.13 -0.94 -0.31 0.00 0.00 0.00 0.00 61.98 60.86 2oci s VAL 242 Cb 0.17 -4.30 -0.13 0.00 0.00 0.00 0.00 36.38 32.12 2oci s VAL 242 CO 0.73 -0.83 1.36 0.29 0.00 0.00 0.00 175.10 176.65 2oci n LYS 243 N 5.78 1.95 -0.87 2.72 5.02 -1.26 -1.93 118.16 129.57 2oci n LYS 243 Ca -0.10 0.69 0.00 0.00 -2.02 0.00 0.00 58.31 56.88 2oci n LYS 243 Cb 0.43 -2.32 0.00 0.00 -0.02 0.00 0.00 35.03 33.12 2oci n LYS 243 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2oci n GLY 244 N 1.97 0.53 3.79 0.72 0.00 -1.26 -4.82 105.19 106.13 2oci n GLY 244 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 2oci n GLY 244 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2oci s SER 245 N -2.44 4.98 0.05 1.61 1.04 -0.81 -4.56 113.70 113.57 2oci s SER 245 Ca 0.00 1.74 0.09 0.00 0.48 0.00 0.00 55.95 58.26 2oci s SER 245 Cb 0.00 -2.51 -0.03 0.00 0.10 0.00 0.00 66.02 63.58 2oci s SER 245 CO 0.00 -1.71 -0.25 -0.13 0.98 0.00 0.00 173.24 172.13 2oci s ARG 246 N -4.88 1.66 -0.17 4.02 0.52 -0.24 -4.99 118.95 114.87 2oci s ARG 246 Ca 0.60 -1.07 0.01 0.00 -0.52 0.00 0.00 55.73 54.76 2oci s ARG 246 Cb -0.16 -1.83 0.02 0.00 0.52 0.00 0.00 34.95 33.50 2oci s ARG 246 CO 0.54 0.47 -0.20 -1.17 0.02 0.00 0.00 175.30 174.96 2oci s LEU 247 N -1.25 2.14 -0.22 2.53 2.96 -1.26 0.09 118.68 123.67 2oci s LEU 247 Ca 0.11 -0.63 -0.02 0.00 -0.22 0.00 0.00 54.13 53.36 2oci s LEU 247 Cb -0.10 -1.48 0.01 0.00 0.50 0.00 0.00 46.19 45.12 2oci s LEU 247 CO 0.02 0.02 -0.07 -2.28 -1.32 0.00 0.00 176.35 172.72 2oci s HIS 248 N 1.18 2.95 -0.18 5.38 5.65 0.11 -4.97 115.29 125.41 2oci s HIS 248 Ca 0.02 -1.23 -0.09 0.00 0.25 0.00 0.00 55.06 54.01 2oci s HIS 248 Cb -0.14 -2.06 -0.05 0.00 -1.18 0.00 0.00 32.58 29.15 2oci s HIS 248 CO -0.10 -0.64 0.12 -0.51 -0.65 0.00 0.00 174.74 172.95 2oci s LEU 249 N 1.41 4.17 -0.34 8.88 1.43 -1.26 -0.98 118.68 131.99 2oci s LEU 249 Ca 0.04 0.25 -0.06 0.00 -1.03 0.00 0.00 54.13 53.33 2oci s LEU 249 Cb -0.15 -2.06 0.05 0.00 0.03 0.00 0.00 46.19 44.06 2oci s LEU 249 CO -0.05 0.23 0.11 -0.04 0.23 0.00 0.00 176.35 176.82 2oci s MET 250 N 0.08 2.56 0.31 1.70 -1.94 -0.10 -4.97 119.30 116.94 2oci s MET 250 Ca 0.09 -1.25 0.07 0.00 -1.71 0.00 0.00 55.69 52.89 2oci s MET 250 Cb -0.11 -3.46 0.82 0.00 2.01 0.00 0.00 34.83 34.09 2oci s MET 250 CO -0.01 -0.71 1.73 -1.35 -0.01 0.00 0.00 175.02 174.68 2oci h PRO 251 N 8.20 0.56 -0.01 2.03 0.11 -1.96 0.06 132.00 140.99 2oci h PRO 251 Ca -0.22 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2oci h PRO 251 Cb 1.08 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.06 2oci h PRO 251 CO 0.61 0.37 -0.65 0.39 -0.21 0.00 0.00 178.00 178.51 2oci n GLU 252 N -4.90 0.59 -2.15 1.05 -0.58 -1.26 -4.17 120.64 109.23 2oci n GLU 252 Ca 0.25 -0.47 -0.39 0.00 -0.42 0.00 0.00 57.16 56.13 2oci n GLU 252 Cb 0.69 -1.49 -0.01 0.00 -0.57 0.00 0.00 31.44 30.06 2oci n GLU 252 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2oci s GLY 253 N -2.73 2.90 0.00 0.62 0.00 -0.79 -4.73 107.32 102.59 2oci s GLY 253 Ca 0.15 1.12 0.00 0.00 0.00 0.00 0.00 44.72 45.99 2oci s GLY 253 CO 0.69 1.68 0.00 0.28 0.00 0.00 0.00 173.10 175.75 2oci n LYS 254 N 0.09 3.89 0.03 2.90 5.02 -1.26 -0.95 118.16 127.88 2oci n LYS 254 Ca 0.04 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.26 2oci n LYS 254 Cb 0.45 0.00 0.11 0.00 -0.02 0.00 0.00 35.03 35.57 2oci n LYS 254 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2oci h HIS 255 N 0.00 0.55 -0.81 2.13 2.76 -1.89 -3.22 115.15 114.68 2oci h HIS 255 Ca 0.00 -0.18 -0.55 0.00 -2.20 0.00 0.00 60.37 57.44 2oci h HIS 255 Cb 0.00 -0.11 -0.24 0.00 1.55 0.00 0.00 27.41 28.61 2oci h HIS 255 CO 0.00 0.86 0.71 0.27 -1.30 0.00 0.00 177.93 178.47 2oci n ASN 256 N -3.98 7.22 0.09 3.26 6.94 -1.26 -4.74 115.26 122.80 2oci n ASN 256 Ca -0.02 -3.53 0.17 0.00 -0.02 0.00 0.00 54.58 51.18 2oci n ASN 256 Cb 0.56 -1.00 0.71 0.00 -2.36 0.00 0.00 39.78 37.68 2oci n ASN 256 CO 0.00 0.00 0.00 0.17 -1.03 0.00 0.00 177.26 176.40 2oci h LEU 257 N 2.17 0.00 0.00 -4.53 8.10 -1.94 -0.81 115.31 118.30 2oci h LEU 257 Ca 0.50 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.49 2oci h LEU 257 Cb 0.87 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.09 2oci h LEU 257 CO 1.30 0.00 0.00 0.00 -4.11 0.00 0.00 178.44 175.63 2oci n HIS 258 N -4.28 0.00 -0.09 0.17 1.44 -1.26 -0.68 115.22 110.52 2oci n HIS 258 Ca 0.06 0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.59 2oci n HIS 258 Cb 0.45 -0.45 -0.07 0.00 0.12 0.00 0.00 29.99 30.03 2oci n HIS 258 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2oci n LEU 259 N -1.45 2.02 0.07 2.39 4.77 -0.39 -3.61 117.00 120.80 2oci n LEU 259 Ca 0.06 0.10 -0.05 0.00 -0.03 0.00 0.00 56.01 56.09 2oci n LEU 259 Cb 0.24 -0.59 0.13 0.00 -2.33 0.00 0.00 43.42 40.87 2oci n LEU 259 CO 0.20 0.57 0.51 -0.09 -1.33 0.00 0.00 177.39 177.24 2oci h ARG 260 N -0.41 0.29 -1.47 3.23 9.65 -1.39 -3.28 114.38 121.01 2oci h ARG 260 Ca -0.45 -0.19 -0.52 0.00 -1.10 0.00 0.00 59.98 57.72 2oci h ARG 260 Cb 1.51 0.02 -0.41 0.00 -1.39 0.00 0.00 29.97 29.69 2oci h ARG 260 CO -0.20 0.77 -0.87 1.19 2.80 0.00 0.00 179.97 183.67 2oci n PHE 261 N -3.91 2.74 -0.16 2.20 3.01 0.14 -4.94 117.46 116.55 2oci n PHE 261 Ca -0.02 -3.14 -0.03 0.00 1.01 0.00 0.00 57.45 55.26 2oci n PHE 261 Cb 0.59 -0.21 0.06 0.00 -0.01 0.00 0.00 39.48 39.91 2oci n PHE 261 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2oci h ALA 262 N 2.75 0.59 -0.56 4.37 0.00 -1.62 0.49 119.26 125.28 2oci h ALA 262 Ca 0.17 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 2oci h ALA 262 Cb 0.95 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2oci h ALA 262 CO 0.74 -0.21 0.21 -0.44 0.00 0.00 0.00 179.25 179.55 2oci h ASP 263 N 0.36 0.78 -0.19 0.00 3.32 -1.92 0.40 116.42 119.18 2oci h ASP 263 Ca 0.23 -0.18 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 2oci h ASP 263 Cb 0.24 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2oci h ASP 263 CO -0.23 0.75 0.05 -0.08 -1.72 0.00 0.00 179.24 178.00 2oci h GLU 264 N 0.77 0.29 -0.14 3.56 4.81 -1.89 -1.93 114.58 120.05 2oci h GLU 264 Ca 0.18 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2oci h GLU 264 Cb 0.22 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 2oci h GLU 264 CO -0.01 0.42 0.05 0.35 -0.73 0.00 0.00 179.01 179.09 2oci h PHE 265 N 0.11 0.22 -0.94 0.92 3.57 -0.69 -1.53 116.94 118.60 2oci h PHE 265 Ca 0.06 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.58 2oci h PHE 265 Cb 0.26 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 38.88 2oci h PHE 265 CO 0.01 0.31 0.61 -0.91 -2.23 0.00 0.00 178.31 176.10 2oci h ASN 266 N 0.07 1.02 -0.27 0.41 2.35 -0.17 0.12 115.58 119.10 2oci h ASN 266 Ca 0.05 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 2oci h ASN 266 Cb 0.19 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 2oci h ASN 266 CO -0.00 0.69 0.11 0.50 -1.65 0.00 0.00 177.43 177.08 2oci h LYS 267 N 1.18 0.41 -0.23 0.81 1.63 -1.21 0.13 116.57 119.30 2oci h LYS 267 Ca 0.38 -0.08 0.03 0.00 -0.85 0.00 0.00 60.65 60.13 2oci h LYS 267 Cb 0.01 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.54 2oci h LYS 267 CO -0.12 0.45 0.05 1.25 -3.45 0.00 0.00 179.45 177.62 2oci h LEU 268 N 0.29 0.02 -0.18 5.20 5.85 -0.59 -0.87 115.31 125.04 2oci h LEU 268 Ca 0.09 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 2oci h LEU 268 Cb 0.19 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 2oci h LEU 268 CO -0.01 0.04 0.03 0.00 -0.34 0.00 0.00 178.44 178.17 2oci h ALA 269 N 1.17 0.24 -0.87 1.25 0.00 -0.59 -2.27 119.26 118.18 2oci h ALA 269 Ca 0.11 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.87 2oci h ALA 269 Cb 0.10 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 2oci h ALA 269 CO -0.14 -0.10 0.57 0.93 0.00 0.00 0.00 179.25 180.52 2oci h GLU 270 N 0.09 1.13 -0.48 0.00 5.08 -0.60 -0.76 114.58 119.03 2oci h GLU 270 Ca 0.05 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2oci h GLU 270 Cb 0.30 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2oci h GLU 270 CO 0.00 0.75 0.18 -0.44 -1.00 0.00 0.00 179.01 178.50 2oci h ASP 271 N 1.16 0.67 -0.46 1.42 3.32 -1.08 -2.76 116.42 118.70 2oci h ASP 271 Ca 0.32 -0.18 -0.06 0.00 0.02 0.00 0.00 57.03 57.14 2oci h ASP 271 Cb -0.11 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.25 2oci h ASP 271 CO -0.08 0.67 0.07 0.15 -1.72 0.00 0.00 179.24 178.33 2oci h PHE 272 N 0.64 0.81 0.00 4.55 3.57 -1.00 -3.16 116.94 122.34 2oci h PHE 272 Ca 0.16 -0.12 -0.05 0.00 3.53 0.00 0.00 57.97 61.49 2oci h PHE 272 Cb 0.21 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 2oci h PHE 272 CO 0.01 0.76 -0.24 -0.07 -2.23 0.00 0.00 178.31 176.54 2oci h LEU 273 N 0.62 0.00 0.00 0.59 3.38 -1.08 -3.51 115.31 115.32 2oci h LEU 273 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2oci h LEU 273 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2oci h LEU 273 CO 0.01 0.24 0.00 0.00 0.09 0.00 0.00 178.44 178.78