#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2frm s GLU 19 N 0.00 0.91 0.43 0.38 0.41 -1.26 -5.12 118.70 114.45 2frm s GLU 19 Ca 0.00 -1.05 -0.26 0.00 -0.41 0.00 0.00 54.97 53.25 2frm s GLU 19 Cb 0.00 -0.93 -0.08 0.00 -1.78 0.00 0.00 34.13 31.34 2frm s GLU 19 CO 0.00 0.20 1.38 1.03 -0.49 0.00 0.00 175.26 177.38 2frm s ARG 20 N -1.98 3.80 0.53 1.61 0.52 -1.26 -4.94 118.95 117.24 2frm s ARG 20 Ca 0.02 2.31 -0.21 0.00 -0.52 0.00 0.00 55.73 57.33 2frm s ARG 20 Cb -0.09 -2.70 -0.06 0.00 0.52 0.00 0.00 34.95 32.63 2frm s ARG 20 CO 0.03 -0.68 1.21 1.03 0.02 0.00 0.00 175.30 176.91 2frm s ARG 21 N -2.36 3.35 -0.06 3.54 1.81 -1.26 -4.86 118.95 119.10 2frm s ARG 21 Ca 0.59 1.86 0.03 0.00 -1.72 0.00 0.00 55.73 56.49 2frm s ARG 21 Cb -0.41 -2.18 0.01 0.00 -0.45 0.00 0.00 34.95 31.92 2frm s ARG 21 CO 0.53 -0.91 -0.14 0.21 -0.68 0.00 0.00 175.30 174.31 2frm s LYS 22 N -3.01 1.75 -0.14 3.54 2.20 -1.26 -0.88 119.74 121.94 2frm s LYS 22 Ca 0.71 -0.49 0.00 0.00 -0.36 0.00 0.00 55.97 55.82 2frm s LYS 22 Cb -0.31 -1.46 0.02 0.00 -1.51 0.00 0.00 37.83 34.57 2frm s LYS 22 CO 0.36 0.11 -0.12 0.42 -0.36 0.00 0.00 175.35 175.75 2frm s ILE 23 N 0.42 1.42 -0.21 5.43 1.01 0.19 -0.63 121.20 128.84 2frm s ILE 23 Ca -0.11 -0.56 -0.14 0.00 0.00 0.00 0.00 60.65 59.84 2frm s ILE 23 Cb -0.14 -1.37 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 2frm s ILE 23 CO 0.03 0.42 0.33 0.00 0.00 0.00 0.00 174.94 175.72 2frm s ALA 24 N 1.54 3.57 -0.32 9.38 0.00 -0.71 -1.29 121.76 133.94 2frm s ALA 24 Ca 0.05 -0.60 -0.06 0.00 0.00 0.00 0.00 51.96 51.34 2frm s ALA 24 Cb -0.13 -2.53 0.03 0.00 0.00 0.00 0.00 23.12 20.49 2frm s ALA 24 CO -0.10 -0.23 0.08 0.08 0.00 0.00 0.00 175.76 175.59 2frm s VAL 25 N 1.16 3.73 -0.65 0.00 1.01 -0.14 -0.77 120.40 124.75 2frm s VAL 25 Ca 0.16 -1.01 -0.22 0.00 0.00 0.00 0.00 61.98 60.91 2frm s VAL 25 Cb -0.14 -3.05 0.07 0.00 0.00 0.00 0.00 36.38 33.27 2frm s VAL 25 CO 0.07 -0.07 0.93 -0.63 0.00 0.00 0.00 175.10 175.39 2frm s ILE 26 N 1.42 4.39 0.00 2.22 -1.09 -0.01 -1.29 121.20 126.84 2frm s ILE 26 Ca -0.00 -0.44 0.00 0.00 -2.23 0.00 0.00 60.65 57.98 2frm s ILE 26 Cb -0.19 -4.66 0.00 0.00 -1.58 0.00 0.00 42.46 36.04 2frm s ILE 26 CO 0.02 -1.41 0.00 0.61 -1.23 0.00 0.00 174.94 172.93 2frm n GLY 27 N 5.32 2.90 1.60 6.18 0.00 -0.43 -1.41 105.19 119.35 2frm n GLY 27 Ca -0.05 -0.77 -0.08 0.00 0.00 0.00 0.00 46.02 45.12 2frm n GLY 27 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2frm n SER 28 N 0.00 3.57 -2.48 1.61 3.41 -1.23 -3.94 113.62 114.57 2frm n SER 28 Ca 0.00 -2.82 -0.04 0.00 -0.26 0.00 0.00 58.87 55.74 2frm n SER 28 Cb 0.00 -0.67 0.03 0.00 -0.26 0.00 0.00 64.21 63.31 2frm n SER 28 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2frm n GLY 29 N -0.20 -1.84 0.22 5.00 0.00 -1.26 -4.54 105.19 102.57 2frm n GLY 29 Ca 0.29 -1.57 -0.01 0.00 0.00 0.00 0.00 46.02 44.74 2frm n GLY 29 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2frm h GLN 30 N 0.00 0.25 0.78 1.61 4.20 -1.99 -0.82 115.11 119.13 2frm h GLN 30 Ca -0.06 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 2frm h GLN 30 Cb 0.18 -0.06 0.01 0.00 0.30 0.00 0.00 27.48 27.92 2frm h GLN 30 CO 0.04 0.17 -0.37 0.82 -0.67 0.00 0.00 178.83 178.82 2frm h ILE 31 N 0.26 0.06 -0.97 2.54 2.04 -1.92 -2.58 117.51 116.95 2frm h ILE 31 Ca 0.28 -0.21 0.17 0.00 1.00 0.00 0.00 64.86 66.10 2frm h ILE 31 Cb 0.40 0.08 -0.10 0.00 -0.74 0.00 0.00 36.82 36.46 2frm h ILE 31 CO -0.36 0.01 0.57 1.23 0.00 0.00 0.00 178.15 179.60 2frm h GLY 32 N -1.24 1.67 0.98 5.37 0.00 -1.65 0.55 103.07 108.75 2frm h GLY 32 Ca -0.11 -0.34 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 2frm h GLY 32 CO 0.17 -0.02 -0.04 -1.33 0.00 0.00 0.00 176.54 175.32 2frm h GLY 33 N 0.77 -0.11 1.49 4.60 0.00 -1.15 -0.50 103.07 108.18 2frm h GLY 33 Ca 0.54 0.04 -0.07 0.00 0.00 0.00 0.00 47.33 47.84 2frm h GLY 33 CO -0.36 -0.04 -0.07 3.43 0.00 0.00 0.00 176.54 179.50 2frm h ASN 35 N -0.13 0.59 -0.41 0.19 4.21 -0.90 -0.13 115.58 119.01 2frm h ASN 35 Ca -0.01 -0.15 0.02 0.00 1.21 0.00 0.00 56.30 57.37 2frm h ASN 35 Cb 0.10 -0.16 -0.03 0.00 -1.12 0.00 0.00 38.32 37.11 2frm h ASN 35 CO 0.02 0.71 0.23 0.40 -1.29 0.00 0.00 177.43 177.50 2frm h ILE 36 N 0.57 1.03 -0.42 2.81 2.04 -0.56 0.46 117.51 123.44 2frm h ILE 36 Ca 0.11 -0.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.80 2frm h ILE 36 Cb 0.47 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 2frm h ILE 36 CO 0.02 0.09 0.25 0.00 0.00 0.00 0.00 178.15 178.51 2frm h ALA 37 N 1.19 0.54 -0.15 1.87 0.00 -0.62 -1.15 119.26 120.93 2frm h ALA 37 Ca 0.16 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.05 2frm h ALA 37 Cb 0.02 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 2frm h ALA 37 CO -0.08 0.04 -0.12 -0.92 0.00 0.00 0.00 179.25 178.16 2frm h TYR 38 N 0.55 -0.30 -0.20 0.00 3.20 -0.36 -1.44 116.97 118.43 2frm h TYR 38 Ca 0.15 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.97 2frm h TYR 38 Cb 0.01 0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.44 2frm h TYR 38 CO -0.03 -0.18 -0.14 0.82 -1.64 0.00 0.00 178.16 176.98 2frm h ILE 39 N -0.13 1.32 -0.61 1.81 1.08 -0.79 -1.16 117.51 119.04 2frm h ILE 39 Ca 0.10 -1.26 0.08 0.00 -0.39 0.00 0.00 64.86 63.39 2frm h ILE 39 Cb 0.28 1.71 -0.07 0.00 -3.07 0.00 0.00 36.82 35.67 2frm h ILE 39 CO -0.24 0.38 0.25 0.58 -0.69 0.00 0.00 178.15 178.44 2frm h VAL 40 N 0.13 0.82 -0.19 1.67 2.07 -1.14 -0.53 116.25 119.08 2frm h VAL 40 Ca 0.04 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 2frm h VAL 40 Cb 0.66 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 2frm h VAL 40 CO 0.04 0.08 0.06 1.23 0.02 0.00 0.00 177.57 179.00 2frm h GLY 41 N 0.46 0.31 0.31 2.17 0.00 -1.20 -1.41 103.07 103.71 2frm h GLY 41 Ca 0.30 -0.18 0.11 0.00 0.00 0.00 0.00 47.33 47.56 2frm h GLY 41 CO -0.27 0.17 0.30 1.70 0.00 0.00 0.00 176.54 178.44 2frm h LYS 42 N 0.13 0.47 -0.00 4.80 3.64 -0.34 -0.86 116.57 124.42 2frm h LYS 42 Ca 0.06 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2frm h LYS 42 Cb 0.22 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 2frm h LYS 42 CO -0.00 0.31 -0.12 -0.25 -2.27 0.00 0.00 179.45 177.12 2frm n ASP 43 N -4.96 0.40 -3.58 4.20 8.00 -0.29 -4.82 116.55 115.50 2frm n ASP 43 Ca 0.12 -0.43 -0.23 0.00 0.71 0.00 0.00 54.79 54.96 2frm n ASP 43 Cb 0.33 -0.10 0.08 0.00 -0.02 0.00 0.00 41.12 41.41 2frm n ASP 43 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2frm n ASN 44 N -1.06 -6.11 0.17 -2.24 5.15 -0.33 -4.90 115.26 105.94 2frm n ASN 44 Ca 0.13 -0.54 0.05 0.00 -0.60 0.00 0.00 54.58 53.62 2frm n ASN 44 Cb 0.28 -5.03 0.19 0.00 -0.53 0.00 0.00 39.78 34.69 2frm n ASN 44 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 2frm h LEU 45 N -2.66 0.00 0.00 1.20 5.85 -1.55 -3.49 115.31 114.67 2frm h LEU 45 Ca -0.57 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.15 2frm h LEU 45 Cb 1.37 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.40 2frm h LEU 45 CO 0.55 0.38 0.00 0.00 -0.34 0.00 0.00 178.44 179.04 2frm n ALA 46 N -2.23 0.00 -2.30 1.25 0.00 -1.26 -4.70 120.51 111.27 2frm n ALA 46 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.16 2frm n ALA 46 Cb 0.61 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.04 2frm n ALA 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2frm s ASP 47 N 0.00 6.43 0.03 0.00 1.01 -0.06 -4.56 116.67 119.53 2frm s ASP 47 Ca 0.00 0.96 0.06 0.00 0.71 0.00 0.00 52.55 54.28 2frm s ASP 47 Cb 0.00 -2.25 -0.02 0.00 1.01 0.00 0.00 42.92 41.66 2frm s ASP 47 CO 0.00 -0.39 -0.17 -0.69 0.21 0.00 0.00 175.17 174.13 2frm s VAL 49 N -2.39 1.34 -0.29 -1.27 1.01 0.48 -0.63 120.40 118.64 2frm s VAL 49 Ca 0.48 -0.99 0.02 0.00 0.00 0.00 0.00 61.98 61.49 2frm s VAL 49 Cb -0.10 -1.17 0.08 0.00 0.00 0.00 0.00 36.38 35.19 2frm s VAL 49 CO 0.34 0.16 -0.00 -0.69 0.00 0.00 0.00 175.10 174.91 2frm s VAL 50 N -0.72 1.89 -0.46 2.92 1.01 -0.41 -2.10 120.40 122.53 2frm s VAL 50 Ca 0.05 -1.81 -0.24 0.00 0.00 0.00 0.00 61.98 59.98 2frm s VAL 50 Cb -0.08 -2.26 0.03 0.00 0.00 0.00 0.00 36.38 34.08 2frm s VAL 50 CO 0.01 -0.37 0.85 -0.76 0.00 0.00 0.00 175.10 174.83 2frm s LEU 51 N 1.16 4.16 0.22 3.92 1.43 -0.15 -0.97 118.68 128.44 2frm s LEU 51 Ca 0.03 -0.06 0.05 0.00 -1.03 0.00 0.00 54.13 53.11 2frm s LEU 51 Cb -0.19 -3.03 -0.03 0.00 0.03 0.00 0.00 46.19 42.97 2frm s LEU 51 CO -0.09 -0.99 0.30 0.12 0.23 0.00 0.00 176.35 175.92 2frm s PHE 52 N 3.51 3.39 0.00 0.29 5.36 -0.41 -0.50 117.98 129.62 2frm s PHE 52 Ca 0.32 -0.00 0.00 0.00 -0.96 0.00 0.00 56.93 56.29 2frm s PHE 52 Cb -0.11 -1.56 0.00 0.00 -0.34 0.00 0.00 43.02 41.00 2frm s PHE 52 CO 0.24 0.48 0.00 -3.47 -1.46 0.00 0.00 175.22 171.00 2frm n ASP 53 N -1.10 0.00 -0.13 6.13 4.64 -0.83 -1.31 116.55 123.95 2frm n ASP 53 Ca -0.08 0.00 -0.07 0.00 -1.38 0.00 0.00 54.79 53.26 2frm n ASP 53 Cb 0.56 0.00 0.02 0.00 -1.04 0.00 0.00 41.12 40.66 2frm n ASP 53 CO 0.00 0.00 0.00 0.40 -0.82 0.00 0.00 177.20 176.78 2frm h ILE 54 N 0.00 1.05 -2.19 5.18 5.03 -1.89 -3.38 117.51 121.31 2frm h ILE 54 Ca 0.00 -0.17 -0.61 0.00 -0.12 0.00 0.00 64.86 63.96 2frm h ILE 54 Cb 0.00 0.49 0.06 0.00 -3.03 0.00 0.00 36.82 34.35 2frm h ILE 54 CO 0.00 0.09 0.67 0.00 -0.68 0.00 0.00 178.15 178.23 2frm n ALA 55 N -2.25 0.71 -2.41 1.87 0.00 -1.26 -4.94 120.51 112.23 2frm n ALA 55 Ca 0.02 0.46 -0.36 0.00 0.00 0.00 0.00 53.44 53.56 2frm n ALA 55 Cb 0.06 -2.26 -0.06 0.00 0.00 0.00 0.00 19.45 17.19 2frm n ALA 55 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2frm s GLU 56 N 0.56 3.95 0.00 0.00 2.02 -1.26 -4.34 118.70 119.62 2frm s GLU 56 Ca 0.78 0.44 0.00 0.00 0.02 0.00 0.00 54.97 56.21 2frm s GLU 56 Cb -0.74 -3.00 0.00 0.00 0.10 0.00 0.00 34.13 30.49 2frm s GLU 56 CO 0.42 0.53 0.00 0.41 0.02 0.00 0.00 175.26 176.64 2frm n GLY 57 N 0.99 2.22 0.42 -1.39 0.00 -1.26 -4.84 105.19 101.34 2frm n GLY 57 Ca -0.07 -0.41 -0.16 0.00 0.00 0.00 0.00 46.02 45.38 2frm n GLY 57 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2frm h ILE 58 N 0.00 0.16 -0.56 -0.61 1.08 -1.98 0.14 117.51 115.74 2frm h ILE 58 Ca 0.00 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.45 2frm h ILE 58 Cb 0.00 0.16 -0.03 0.00 -3.07 0.00 0.00 36.82 33.88 2frm h ILE 58 CO 0.00 0.00 0.27 1.55 -0.69 0.00 0.00 178.15 179.28 2frm h PRO 59 N -0.77 0.78 -0.19 2.37 0.13 -1.88 -2.35 132.00 130.08 2frm h PRO 59 Ca -0.02 -0.09 -0.03 0.00 -0.87 0.00 0.00 66.00 64.99 2frm h PRO 59 Cb 0.73 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 31.70 2frm h PRO 59 CO -0.14 0.61 0.02 1.96 -0.23 0.00 0.00 178.00 180.22 2frm h GLN 60 N 0.78 0.33 0.08 0.86 1.08 -1.78 -2.20 115.11 114.26 2frm h GLN 60 Ca 0.20 -0.09 0.01 0.00 -1.45 0.00 0.00 58.65 57.31 2frm h GLN 60 Cb 0.08 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.45 2frm h GLN 60 CO -0.03 0.50 -0.15 0.78 -0.95 0.00 0.00 178.83 178.99 2frm h GLY 61 N 0.11 -0.25 0.79 3.46 0.00 -0.41 -0.71 103.07 106.06 2frm h GLY 61 Ca 0.06 0.17 0.02 0.00 0.00 0.00 0.00 47.33 47.58 2frm h GLY 61 CO 0.01 -0.15 0.01 0.50 0.00 0.00 0.00 176.54 176.91 2frm h LYS 62 N -0.28 0.07 -0.84 4.80 1.57 -1.46 -0.32 116.57 120.10 2frm h LYS 62 Ca 0.02 -0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.87 2frm h LYS 62 Cb 0.31 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.54 2frm h LYS 62 CO -0.09 0.04 0.51 0.00 -0.57 0.00 0.00 179.45 179.35 2frm h ALA 63 N 1.12 1.17 0.07 3.86 0.00 -1.20 0.76 119.26 125.03 2frm h ALA 63 Ca 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2frm h ALA 63 Cb 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2frm h ALA 63 CO -0.11 0.23 -0.03 -0.07 0.00 0.00 0.00 179.25 179.27 2frm h LEU 64 N 0.92 -0.08 -0.09 0.00 4.07 -0.72 0.53 115.31 119.94 2frm h LEU 64 Ca 0.38 -0.19 0.03 0.00 0.08 0.00 0.00 57.88 58.17 2frm h LEU 64 Cb 0.21 0.02 -0.03 0.00 1.08 0.00 0.00 40.66 41.94 2frm h LEU 64 CO -0.19 0.15 -0.08 -0.78 -1.08 0.00 0.00 178.44 176.46 2frm h ASP 65 N -0.30 -0.25 -0.67 -0.43 3.58 -0.45 -1.08 116.42 116.81 2frm h ASP 65 Ca -0.01 0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.50 2frm h ASP 65 Cb 0.26 0.13 -0.03 0.00 1.72 0.00 0.00 39.33 41.41 2frm h ASP 65 CO 0.02 -0.11 0.43 0.40 -2.88 0.00 0.00 179.24 177.10 2frm h ILE 66 N -0.10 1.18 -0.48 2.25 2.04 0.63 -1.71 117.51 121.32 2frm h ILE 66 Ca 0.07 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 2frm h ILE 66 Cb 0.19 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.45 2frm h ILE 66 CO -0.15 0.17 0.28 0.74 0.00 0.00 0.00 178.15 179.19 2frm h THR 67 N 0.91 1.14 0.00 -0.27 2.02 0.13 -2.20 112.91 114.65 2frm h THR 67 Ca 0.24 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 67.08 2frm h THR 67 Cb -0.09 0.48 0.00 0.00 -1.74 0.00 0.00 68.15 66.80 2frm h THR 67 CO -0.05 0.15 0.00 0.45 0.37 0.00 0.00 175.52 176.44 2frm h HIS 68 N 0.66 0.00 0.00 3.16 3.86 -0.37 -2.86 115.15 119.61 2frm h HIS 68 Ca 0.17 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.38 2frm h HIS 68 Cb -0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2frm h HIS 68 CO 0.00 0.00 -0.98 -1.13 0.86 0.00 0.00 177.93 176.68 2frm n SER 69 N -2.94 0.62 -0.24 2.45 3.41 -0.83 -4.35 113.62 111.73 2frm n SER 69 Ca 0.00 -0.23 0.02 0.00 -0.26 0.00 0.00 58.87 58.40 2frm n SER 69 Cb 0.25 0.75 0.14 0.00 -0.26 0.00 0.00 64.21 65.09 2frm n SER 69 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 2frm h MET 70 N 0.00 0.52 0.00 4.33 2.86 -1.45 0.37 114.93 121.56 2frm h MET 70 Ca 0.00 -0.03 -0.08 0.00 -2.06 0.00 0.00 59.70 57.52 2frm h MET 70 Cb 0.71 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 2frm h MET 70 CO 0.00 0.35 -0.40 -0.24 1.06 0.00 0.00 176.91 177.68 2frm h VAL 71 N 0.54 1.25 -0.74 -2.22 3.04 -1.76 0.51 116.25 116.87 2frm h VAL 71 Ca 0.36 -1.38 -0.06 0.00 -1.01 0.00 0.00 66.70 64.60 2frm h VAL 71 Cb 0.43 1.75 -0.03 0.00 -2.01 0.00 0.00 31.29 31.43 2frm h VAL 71 CO -0.30 0.39 0.21 0.24 -1.01 0.00 0.00 177.57 177.10 2frm h MET 72 N 0.00 1.16 -0.03 4.17 2.07 -1.18 -1.06 114.93 120.06 2frm h MET 72 Ca -0.00 -0.26 0.00 0.00 -2.07 0.00 0.00 59.70 57.36 2frm h MET 72 Cb 0.72 -0.16 0.00 0.00 -1.87 0.00 0.00 31.60 30.29 2frm h MET 72 CO 0.05 1.00 0.00 1.19 1.07 0.00 0.00 176.91 180.22 2frm n PHE 73 N -4.24 0.03 -3.29 -0.22 3.72 -0.72 -4.90 117.46 107.84 2frm n PHE 73 Ca 0.06 -0.01 -0.19 0.00 -0.05 0.00 0.00 57.45 57.26 2frm n PHE 73 Cb 0.24 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.84 2frm n PHE 73 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2frm n GLY 73 N 1.05 -0.24 3.55 1.37 0.00 -0.40 -5.01 105.19 105.51 2frm n GLY 73 Ca 0.20 0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.96 2frm n GLY 73 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2frm s SER 74 N -3.17 4.26 0.00 1.61 0.15 0.17 -4.99 113.70 111.73 2frm s SER 74 Ca 0.43 -0.41 0.13 0.00 0.70 0.00 0.00 55.95 56.80 2frm s SER 74 Cb -0.19 -0.78 0.19 0.00 -1.71 0.00 0.00 66.02 63.54 2frm s SER 74 CO 0.53 0.19 1.05 0.35 1.20 0.00 0.00 173.24 176.56 2frm n THR 75 N 0.85 0.34 -1.72 6.45 -2.24 -1.26 -4.01 114.28 112.68 2frm n THR 75 Ca -0.14 -0.67 -0.39 0.00 -2.27 0.00 0.00 64.05 60.58 2frm n THR 75 Cb 0.52 1.01 0.04 0.00 -2.10 0.00 0.00 70.33 69.81 2frm n THR 75 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2frm n SER 76 N 0.74 2.43 -4.73 3.42 7.64 -1.26 -4.99 113.62 116.87 2frm n SER 76 Ca 0.10 0.97 -0.35 0.00 1.01 0.00 0.00 58.87 60.60 2frm n SER 76 Cb 0.38 -1.54 -0.09 0.00 -1.01 0.00 0.00 64.21 61.95 2frm n SER 76 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2frm s LYS 77 N -2.80 3.06 -0.11 1.43 -0.14 -1.26 -4.98 119.74 114.95 2frm s LYS 77 Ca 0.71 -0.38 -0.01 0.00 -1.36 0.00 0.00 55.97 54.93 2frm s LYS 77 Cb -0.43 -2.86 0.03 0.00 -1.68 0.00 0.00 37.83 32.89 2frm s LYS 77 CO 0.50 0.71 -0.02 0.08 -0.76 0.00 0.00 175.35 175.86 2frm s VAL 78 N -0.95 0.60 0.05 3.17 1.01 -1.26 -0.38 120.40 122.63 2frm s VAL 78 Ca 0.15 -0.12 0.06 0.00 0.00 0.00 0.00 61.98 62.06 2frm s VAL 78 Cb -0.12 -0.78 -0.02 0.00 0.00 0.00 0.00 36.38 35.46 2frm s VAL 78 CO 0.04 0.21 -0.16 0.27 0.00 0.00 0.00 175.10 175.46 2frm s ILE 79 N 1.87 1.30 0.19 2.22 -4.36 -0.89 -4.57 121.20 116.96 2frm s ILE 79 Ca 0.04 -1.12 0.01 0.00 -0.26 0.00 0.00 60.65 59.32 2frm s ILE 79 Cb -0.13 -1.17 -0.04 0.00 1.25 0.00 0.00 42.46 42.37 2frm s ILE 79 CO -0.06 0.03 0.36 -0.83 0.24 0.00 0.00 174.94 174.68 2frm s GLY 80 N -1.25 1.74 0.19 6.27 0.00 -1.26 -0.98 107.32 112.03 2frm s GLY 80 Ca 0.03 -0.91 -0.23 0.00 0.00 0.00 0.00 44.72 43.61 2frm s GLY 80 CO 0.02 -0.88 0.95 -1.08 0.00 0.00 0.00 173.10 172.11 2frm s THR 81 N -1.84 0.00 0.00 0.90 -1.32 0.35 -4.72 115.64 109.01 2frm s THR 81 Ca 0.37 -0.69 0.00 0.00 -1.21 0.00 0.00 61.69 60.16 2frm s THR 81 Cb -0.11 -2.31 0.00 0.00 -1.51 0.00 0.00 72.50 68.57 2frm s THR 81 CO 0.29 0.00 0.70 -0.46 -2.21 0.00 0.00 174.62 172.94 2frm n ASN 83 N -0.75 0.00 -4.12 8.08 6.94 -1.26 -1.96 115.26 122.19 2frm n ASN 83 Ca -0.05 -1.44 -0.34 0.00 -0.02 0.00 0.00 54.58 52.72 2frm n ASN 83 Cb 0.60 -0.09 -0.14 0.00 -2.36 0.00 0.00 39.78 37.80 2frm n ASN 83 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2frm s ASP 84 N -0.44 4.85 0.63 0.53 3.68 -1.26 -4.87 116.67 119.79 2frm s ASP 84 Ca 0.00 -1.54 0.24 0.00 2.13 0.00 0.00 52.55 53.39 2frm s ASP 84 Cb 0.00 -1.69 1.21 0.00 -1.45 0.00 0.00 42.92 40.99 2frm s ASP 84 CO 0.00 -0.31 1.67 1.88 0.13 0.00 0.00 175.17 178.54 2frm h TYR 85 N 7.91 0.00 -0.41 -5.34 -1.99 -1.98 0.12 116.97 115.28 2frm h TYR 85 Ca -0.17 0.00 0.07 0.00 2.00 0.00 0.00 58.73 60.63 2frm h TYR 85 Cb 1.05 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.76 2frm h TYR 85 CO 0.59 0.00 0.28 0.00 -0.00 0.00 0.00 178.16 179.03 2frm h ALA 86 N 1.04 2.08 0.00 3.88 0.00 -1.95 -1.57 119.26 122.74 2frm h ALA 86 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2frm h ALA 86 Cb 1.41 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2frm h ALA 86 CO -0.00 -0.17 0.00 -0.25 0.00 0.00 0.00 179.25 178.83 2frm n ASP 87 N -4.47 0.00 -0.97 0.00 8.00 0.42 -2.27 116.55 117.27 2frm n ASP 87 Ca 0.06 0.07 0.12 0.00 0.71 0.00 0.00 54.79 55.74 2frm n ASP 87 Cb 0.31 -0.29 0.12 0.00 -0.02 0.00 0.00 41.12 41.24 2frm n ASP 87 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2frm n ILE 88 N -1.29 0.10 -1.65 0.53 -5.35 -0.59 -4.94 119.36 106.17 2frm n ILE 88 Ca 0.07 -0.55 -0.45 0.00 -0.27 0.00 0.00 62.75 61.56 2frm n ILE 88 Cb 0.13 1.38 -0.02 0.00 -1.74 0.00 0.00 39.64 39.39 2frm n ILE 88 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 2frm n SER 89 N 1.33 2.37 0.00 7.28 3.41 -0.96 -1.30 113.62 125.75 2frm n SER 89 Ca 0.15 1.16 0.00 0.00 -0.26 0.00 0.00 58.87 59.92 2frm n SER 89 Cb 0.58 -1.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.14 2frm n SER 89 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2frm n GLY 90 N 1.67 0.64 3.69 5.00 0.00 -0.91 -4.97 105.19 110.30 2frm n GLY 90 Ca 0.10 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.68 2frm n GLY 90 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2frm n SER 91 N -0.06 3.24 0.08 1.61 7.64 -0.42 -4.79 113.62 120.91 2frm n SER 91 Ca 0.00 1.11 -0.14 0.00 1.01 0.00 0.00 58.87 60.85 2frm n SER 91 Cb 0.03 -1.48 -0.06 0.00 -1.01 0.00 0.00 64.21 61.69 2frm n SER 91 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2frm h ASP 92 N 5.21 0.51 -4.09 6.43 3.32 -1.22 -3.36 116.42 123.21 2frm h ASP 92 Ca -0.45 -0.43 -0.17 0.00 0.02 0.00 0.00 57.03 55.99 2frm h ASP 92 Cb 1.25 -0.16 -0.25 0.00 0.22 0.00 0.00 39.33 40.39 2frm h ASP 92 CO 0.83 1.25 -0.49 0.54 -1.72 0.00 0.00 179.24 179.65 2frm s VAL 93 N -3.15 0.02 -0.17 -1.35 0.11 -1.14 -1.60 120.40 113.13 2frm s VAL 93 Ca -0.05 -0.17 0.01 0.00 -2.93 0.00 0.00 61.98 58.84 2frm s VAL 93 Cb 0.08 -0.31 0.02 0.00 -1.53 0.00 0.00 36.38 34.64 2frm s VAL 93 CO 0.87 -0.09 -0.21 -0.69 -3.33 0.00 0.00 175.10 171.65 2frm s VAL 94 N -0.27 2.06 -0.36 2.04 1.01 0.41 -1.73 120.40 123.55 2frm s VAL 94 Ca -0.04 -0.95 -0.12 0.00 0.00 0.00 0.00 61.98 60.87 2frm s VAL 94 Cb -0.03 -1.85 0.01 0.00 0.00 0.00 0.00 36.38 34.52 2frm s VAL 94 CO 0.01 0.54 0.22 -0.63 0.00 0.00 0.00 175.10 175.24 2frm s ILE 95 N 1.13 4.88 -0.29 2.22 -1.09 0.06 -0.77 121.20 127.34 2frm s ILE 95 Ca 0.01 -0.60 -0.17 0.00 -2.23 0.00 0.00 60.65 57.66 2frm s ILE 95 Cb -0.14 -3.63 -0.02 0.00 -1.58 0.00 0.00 42.46 37.09 2frm s ILE 95 CO -0.09 -0.15 0.47 -0.63 -1.23 0.00 0.00 174.94 173.31 2frm s ILE 96 N 1.63 5.08 0.00 2.92 1.01 0.14 -0.83 121.20 131.15 2frm s ILE 96 Ca 0.04 0.62 0.00 0.00 0.00 0.00 0.00 60.65 61.31 2frm s ILE 96 Cb -0.18 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.45 2frm s ILE 96 CO 0.08 0.01 0.16 0.35 0.00 0.00 0.00 174.94 175.55 2frm n THR 97 N 5.23 0.00 -1.91 2.92 -2.24 -0.50 -0.23 114.28 117.54 2frm n THR 97 Ca -0.06 -0.38 -0.43 0.00 -2.27 0.00 0.00 64.05 60.92 2frm n THR 97 Cb 0.50 1.10 -0.03 0.00 -2.10 0.00 0.00 70.33 69.80 2frm n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2frm s ALA 98 N -0.43 2.91 0.25 6.98 0.00 -0.87 -4.93 121.76 125.66 2frm s ALA 98 Ca 0.00 0.44 0.03 0.00 0.00 0.00 0.00 51.96 52.42 2frm s ALA 98 Cb 0.00 -4.00 -0.05 0.00 0.00 0.00 0.00 23.12 19.06 2frm s ALA 98 CO 0.00 -2.55 0.04 -1.12 0.00 0.00 0.00 175.76 172.13 2frm s SER 99 N 6.32 1.66 0.31 0.00 0.01 -1.26 -4.83 113.70 115.91 2frm s SER 99 Ca 0.84 -1.30 -0.28 0.00 1.31 0.00 0.00 55.95 56.51 2frm s SER 99 Cb -0.26 0.05 -0.13 0.00 0.21 0.00 0.00 66.02 65.90 2frm s SER 99 CO 0.34 -0.61 1.17 2.30 0.41 0.00 0.00 173.24 176.85 2frm n ILE 100 N -0.47 1.95 -0.43 1.44 -6.64 -1.26 -4.79 119.36 109.15 2frm n ILE 100 Ca -0.03 -0.49 -0.06 0.00 -1.77 0.00 0.00 62.75 60.40 2frm n ILE 100 Cb 0.65 -1.32 -0.06 0.00 -1.44 0.00 0.00 39.64 37.47 2frm n ILE 100 CO 0.00 0.00 0.00 -2.65 -1.77 0.00 0.00 176.55 172.13 2frm n PRO 103 N 0.69 0.92 -3.77 6.28 -0.02 -1.26 -4.71 135.00 133.13 2frm n PRO 103 Ca 0.07 -0.52 -0.29 0.00 -2.02 0.00 0.00 63.50 60.75 2frm n PRO 103 Cb 0.34 -1.79 -0.16 0.00 -0.02 0.00 0.00 33.50 31.88 2frm n PRO 103 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2frm s GLY 103 N 2.75 0.98 0.18 -1.23 0.00 -1.26 -5.11 107.32 103.63 2frm s GLY 103 Ca 0.28 -1.26 -0.33 0.00 0.00 0.00 0.00 44.72 43.40 2frm s GLY 103 CO -0.00 1.43 1.47 0.54 0.00 0.00 0.00 173.10 176.53 2frm n ARG 103 N 4.89 1.93 -1.52 2.90 3.00 -1.26 -4.73 116.66 121.87 2frm n ARG 103 Ca -0.06 0.69 -0.19 0.00 -0.01 0.00 0.00 57.85 58.28 2frm n ARG 103 Cb 0.44 -2.39 -0.17 0.00 0.00 0.00 0.00 32.46 30.34 2frm n ARG 103 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 2frm n PRO 105 N 2.75 0.22 0.02 5.56 -0.02 -1.26 -4.66 135.00 137.60 2frm n PRO 105 Ca 0.15 -0.33 0.11 0.00 -2.02 0.00 0.00 63.50 61.42 2frm n PRO 105 Cb 0.28 -2.05 -0.06 0.00 -0.02 0.00 0.00 33.50 31.66 2frm n PRO 105 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2frm n LYS 105 N 6.82 0.33 -2.27 -0.52 4.81 -1.26 -5.06 118.16 121.00 2frm n LYS 105 Ca 0.60 -0.05 -0.00 0.00 -0.87 0.00 0.00 58.31 57.99 2frm n LYS 105 Cb 0.25 -1.56 -0.00 0.00 0.02 0.00 0.00 35.03 33.74 2frm n LYS 105 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2frm n ASP 106 N -1.97 -6.71 0.00 3.14 10.43 -1.26 -5.00 116.55 115.17 2frm n ASP 106 Ca 0.01 1.62 0.00 0.00 2.57 0.00 0.00 54.79 58.99 2frm n ASP 106 Cb 0.45 -4.17 0.00 0.00 1.84 0.00 0.00 41.12 39.24 2frm n ASP 106 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 2frm n ASP 107 N 1.90 0.00 0.00 -2.24 2.03 -1.26 -5.04 116.55 111.94 2frm n ASP 107 Ca -0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.30 2frm n ASP 107 Cb 0.01 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.41 2frm n ASP 107 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2frm n ARG 109 N 0.00 0.00 0.00 -0.67 1.74 -1.26 -5.07 116.66 111.40 2frm n ARG 109 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2frm n ARG 109 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2frm n ARG 109 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2frm n SER 110 N -0.49 0.00 0.00 0.55 3.41 -1.26 -5.13 113.62 110.69 2frm n SER 110 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2frm n SER 110 Cb 0.00 0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 2frm n SER 110 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2frm n GLU 111 N -1.35 0.00 -0.86 4.33 2.13 -1.26 -4.54 120.64 119.08 2frm n GLU 111 Ca 0.00 0.00 -0.18 0.00 0.66 0.00 0.00 57.16 57.64 2frm n GLU 111 Cb 0.00 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 31.60 2frm n GLU 111 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 2frm n LEU 112 N 0.00 -0.39 0.09 4.31 -0.00 -1.26 -4.62 117.00 115.13 2frm n LEU 112 Ca 0.00 -0.12 -0.06 0.00 -0.00 0.00 0.00 56.01 55.82 2frm n LEU 112 Cb 0.00 -0.41 -0.04 0.00 -0.00 0.00 0.00 43.42 42.98 2frm n LEU 112 CO 0.00 -0.64 0.51 -0.07 -0.00 0.00 0.00 177.39 177.19 2frm h LEU 113 N 6.58 -0.52 -1.32 -1.96 3.38 -1.96 -0.04 115.31 119.47 2frm h LEU 113 Ca -0.00 0.05 0.08 0.00 0.09 0.00 0.00 57.88 58.09 2frm h LEU 113 Cb 0.70 0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.57 2frm h LEU 113 CO 0.87 -0.23 0.52 -0.26 0.09 0.00 0.00 178.44 179.42 2frm h PHE 114 N -0.35 0.83 0.66 1.13 -1.00 -1.97 0.31 116.94 116.55 2frm h PHE 114 Ca -0.02 0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.75 2frm h PHE 114 Cb 0.31 -0.27 0.01 0.00 3.61 0.00 0.00 35.95 39.61 2frm h PHE 114 CO -0.18 0.41 -0.32 0.78 -1.61 0.00 0.00 178.31 177.39 2frm h GLY 115 N 0.80 -0.93 1.75 -1.45 0.00 -1.88 0.79 103.07 102.15 2frm h GLY 115 Ca 0.35 0.34 -0.07 0.00 0.00 0.00 0.00 47.33 47.96 2frm h GLY 115 CO -0.13 -0.34 -0.19 3.43 0.00 0.00 0.00 176.54 179.31 2frm h ASN 116 N -0.90 0.29 -0.13 0.19 2.35 -0.59 -2.48 115.58 114.30 2frm h ASN 116 Ca -0.09 -0.08 -0.08 0.00 -0.55 0.00 0.00 56.30 55.50 2frm h ASN 116 Cb 0.68 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.96 2frm h ASN 116 CO 0.15 0.50 -0.16 0.00 -1.65 0.00 0.00 177.43 176.27 2frm h ALA 117 N 1.53 1.17 0.00 -0.83 0.00 -0.13 -1.73 119.26 119.28 2frm h ALA 117 Ca 0.05 -0.30 -0.16 0.00 0.00 0.00 0.00 54.91 54.50 2frm h ALA 117 Cb 0.50 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2frm h ALA 117 CO 0.03 0.53 -0.75 0.00 0.00 0.00 0.00 179.25 179.06 2frm h ARG 118 N 0.48 0.00 -0.50 0.00 3.08 -0.48 -0.96 114.38 116.01 2frm h ARG 118 Ca 0.08 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.01 2frm h ARG 118 Cb 0.56 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.60 2frm h ARG 118 CO 0.04 0.75 -0.18 0.82 -1.07 0.00 0.00 179.97 180.33 2frm h ILE 119 N 0.00 1.27 -0.37 2.04 1.08 -1.10 -2.50 117.51 117.93 2frm h ILE 119 Ca -0.01 -1.34 -0.11 0.00 -0.39 0.00 0.00 64.86 63.02 2frm h ILE 119 Cb 1.39 1.07 -0.01 0.00 -3.07 0.00 0.00 36.82 36.20 2frm h ILE 119 CO 0.10 0.46 -0.18 -0.07 -0.69 0.00 0.00 178.15 177.77 2frm h LEU 120 N 0.86 0.80 -0.94 1.44 3.38 -1.18 -2.42 115.31 117.25 2frm h LEU 120 Ca 0.12 -0.41 0.12 0.00 0.09 0.00 0.00 57.88 57.80 2frm h LEU 120 Cb 0.75 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 41.19 2frm h LEU 120 CO 0.06 1.03 0.57 0.44 0.09 0.00 0.00 178.44 180.62 2frm h ASP 121 N 0.57 0.81 -0.19 -0.43 3.45 -1.04 1.44 116.42 121.02 2frm h ASP 121 Ca 0.08 0.06 -0.01 0.00 0.43 0.00 0.00 57.03 57.59 2frm h ASP 121 Cb 0.73 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 39.39 2frm h ASP 121 CO 0.05 0.42 0.08 -1.28 -1.57 0.00 0.00 179.24 176.94 2frm h SER 122 N 0.89 0.26 -0.61 6.45 0.87 -1.25 -0.42 113.55 119.74 2frm h SER 122 Ca 0.47 -0.16 -0.10 0.00 -1.23 0.00 0.00 61.79 60.77 2frm h SER 122 Cb 0.49 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.36 2frm h SER 122 CO -0.28 0.35 -0.01 0.58 -0.53 0.00 0.00 176.83 176.95 2frm h VAL 123 N 0.15 1.27 -0.80 2.23 2.07 -0.59 -2.48 116.25 118.09 2frm h VAL 123 Ca 0.06 -1.17 0.03 0.00 0.82 0.00 0.00 66.70 66.44 2frm h VAL 123 Cb 0.17 0.80 -0.05 0.00 -1.52 0.00 0.00 31.29 30.70 2frm h VAL 123 CO -0.01 0.43 0.51 0.00 0.02 0.00 0.00 177.57 178.52 2frm h ALA 124 N 0.99 1.05 -0.32 1.67 0.00 0.21 -0.01 119.26 122.84 2frm h ALA 124 Ca 0.17 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2frm h ALA 124 Cb 0.57 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2frm h ALA 124 CO 0.03 0.34 0.20 1.49 0.00 0.00 0.00 179.25 181.31 2frm h GLU 125 N 1.00 0.39 -0.42 0.00 4.81 -0.75 -2.20 114.58 117.42 2frm h GLU 125 Ca 0.32 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.50 2frm h GLU 125 Cb -0.00 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 2frm h GLU 125 CO -0.11 0.26 0.17 0.78 -0.73 0.00 0.00 179.01 179.38 2frm h GLY 126 N 0.41 0.68 0.90 1.92 0.00 -0.95 -3.11 103.07 102.91 2frm h GLY 126 Ca 0.12 -0.37 -0.03 0.00 0.00 0.00 0.00 47.33 47.04 2frm h GLY 126 CO -0.04 0.35 -0.34 -2.08 0.00 0.00 0.00 176.54 174.43 2frm h VAL 127 N 0.54 0.23 0.00 4.60 2.07 -0.82 0.39 116.25 123.26 2frm h VAL 127 Ca 0.14 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.51 2frm h VAL 127 Cb 0.20 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 2frm h VAL 127 CO -0.01 0.01 0.00 2.29 0.02 0.00 0.00 177.57 179.88 2frm n LYS 128 N -5.46 0.04 -0.11 1.57 2.85 -0.84 0.31 118.16 116.52 2frm n LYS 128 Ca -0.13 0.47 -0.15 0.00 -1.05 0.00 0.00 58.31 57.45 2frm n LYS 128 Cb 0.39 -1.61 -0.14 0.00 -0.65 0.00 0.00 35.03 33.02 2frm n LYS 128 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 2frm n LYS 129 N -1.69 0.67 -0.02 -1.58 4.81 -1.12 -4.44 118.16 114.79 2frm n LYS 129 Ca 0.01 0.09 0.04 0.00 -0.87 0.00 0.00 58.31 57.57 2frm n LYS 129 Cb 0.06 -1.53 -0.10 0.00 0.02 0.00 0.00 35.03 33.48 2frm n LYS 129 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2frm n TYR 130 N -3.05 0.00 -2.78 5.64 4.01 0.11 -4.85 117.16 116.25 2frm n TYR 130 Ca -0.40 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.25 2frm n TYR 130 Cb 1.06 -0.36 0.06 0.00 -0.31 0.00 0.00 39.34 39.80 2frm n TYR 130 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2frm n PRO 132 N 0.92 0.01 -0.35 0.00 -0.04 -0.84 -2.35 135.00 132.35 2frm n PRO 132 Ca 0.09 0.33 0.12 0.00 -0.04 0.00 0.00 63.50 64.00 2frm n PRO 132 Cb 0.66 -1.52 0.31 0.00 -0.04 0.00 0.00 33.50 32.91 2frm n PRO 132 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2frm n ASN 132 N -1.54 3.90 -4.86 3.54 3.02 -1.26 -4.90 115.26 113.16 2frm n ASN 132 Ca 0.02 -2.00 -0.31 0.00 -0.03 0.00 0.00 54.58 52.26 2frm n ASN 132 Cb 0.12 -0.46 0.01 0.00 -0.61 0.00 0.00 39.78 38.84 2frm n ASN 132 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2frm s ALA 133 N -1.07 3.01 -0.28 5.41 0.00 -0.99 -4.96 121.76 122.87 2frm s ALA 133 Ca 0.48 -0.01 -0.15 0.00 0.00 0.00 0.00 51.96 52.28 2frm s ALA 133 Cb 0.25 -3.11 -0.03 0.00 0.00 0.00 0.00 23.12 20.23 2frm s ALA 133 CO 0.33 -0.73 0.39 0.12 0.00 0.00 0.00 175.76 175.87 2frm s PHE 134 N -3.07 3.24 -0.21 0.00 5.36 -0.63 -4.89 117.98 117.79 2frm s PHE 134 Ca 0.56 0.38 -0.07 0.00 -0.96 0.00 0.00 56.93 56.84 2frm s PHE 134 Cb -0.12 -2.61 -0.04 0.00 -0.34 0.00 0.00 43.02 39.92 2frm s PHE 134 CO 0.51 -0.26 0.07 0.08 -1.46 0.00 0.00 175.22 174.16 2frm s VAL 135 N 2.10 4.60 -0.26 3.12 1.01 0.11 -0.45 120.40 130.63 2frm s VAL 135 Ca 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 61.98 62.01 2frm s VAL 135 Cb -0.16 -3.11 0.02 0.00 0.00 0.00 0.00 36.38 33.13 2frm s VAL 135 CO 0.10 0.40 -0.01 -0.63 0.00 0.00 0.00 175.10 174.96 2frm s ILE 136 N 0.95 3.23 -0.08 2.22 1.01 0.05 -0.64 121.20 127.94 2frm s ILE 136 Ca 0.04 -0.93 -0.09 0.00 0.00 0.00 0.00 60.65 59.68 2frm s ILE 136 Cb -0.14 -2.65 -0.04 0.00 0.01 0.00 0.00 42.46 39.63 2frm s ILE 136 CO 0.03 0.15 0.22 0.00 0.00 0.00 0.00 174.94 175.34 2frm n ILE 138 N 1.84 1.36 -4.34 0.00 5.41 0.68 -0.20 119.36 124.10 2frm n ILE 138 Ca -0.17 -4.81 -0.17 0.00 1.00 0.00 0.00 62.75 58.59 2frm n ILE 138 Cb 0.54 -2.05 -0.10 0.00 -0.71 0.00 0.00 39.64 37.31 2frm n ILE 138 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 2frm s THR 139 N -1.97 0.92 -0.00 1.39 2.01 -1.26 -4.56 115.64 112.16 2frm s THR 139 Ca 0.37 -2.02 0.00 0.00 0.31 0.00 0.00 61.69 60.36 2frm s THR 139 Cb 0.14 -2.47 0.00 0.00 0.01 0.00 0.00 72.50 70.18 2frm s THR 139 CO -0.06 -0.21 -0.01 0.20 -0.69 0.00 0.00 174.62 173.86 2frm s ASN 140 N -3.33 0.13 -0.18 3.53 0.01 -1.26 -1.57 114.94 112.27 2frm s ASN 140 Ca 0.32 -0.01 -0.29 0.00 -0.71 0.00 0.00 52.86 52.17 2frm s ASN 140 Cb 0.07 -0.03 -0.05 0.00 0.41 0.00 0.00 41.25 41.65 2frm s ASN 140 CO 0.11 -0.01 1.89 -2.84 -1.51 0.00 0.00 177.10 174.73 2frm s PRO 141 N 0.15 3.62 0.10 -0.60 0.02 -1.26 -4.68 135.00 132.35 2frm s PRO 141 Ca -0.01 1.94 -0.23 0.00 0.02 0.00 0.00 61.00 62.72 2frm s PRO 141 Cb -0.02 -4.18 -0.07 0.00 0.02 0.00 0.00 34.50 30.25 2frm s PRO 141 CO -0.00 -1.53 1.39 1.25 -0.33 0.00 0.00 177.00 177.78 2frm h LEU 142 N 12.70 -1.44 -1.39 -5.54 5.85 -1.71 0.15 115.31 123.93 2frm h LEU 142 Ca -0.39 0.20 0.15 0.00 0.84 0.00 0.00 57.88 58.68 2frm h LEU 142 Cb 1.20 0.61 -0.06 0.00 0.37 0.00 0.00 40.66 42.78 2frm h LEU 142 CO 0.98 -0.24 0.56 0.44 -0.34 0.00 0.00 178.44 179.84 2frm h ASP 143 N -0.16 0.55 0.13 1.25 3.32 -1.90 0.21 116.42 119.82 2frm h ASP 143 Ca 0.08 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 2frm h ASP 143 Cb 0.37 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.85 2frm h ASP 143 CO -0.54 0.27 -0.06 0.58 -1.72 0.00 0.00 179.24 177.77 2frm h VAL 144 N 0.58 1.00 -0.60 -1.35 2.07 -1.60 -2.75 116.25 113.59 2frm h VAL 144 Ca 0.43 -1.15 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 2frm h VAL 144 Cb 0.81 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 32.20 2frm h VAL 144 CO -0.18 0.25 0.37 0.24 0.02 0.00 0.00 177.57 178.27 2frm h MET 145 N -0.78 0.81 0.04 1.57 2.86 -0.20 -0.19 114.93 119.04 2frm h MET 145 Ca -0.02 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 2frm h MET 145 Cb 0.54 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.03 2frm h MET 145 CO 0.03 0.56 -0.02 0.28 1.06 0.00 0.00 176.91 178.83 2frm h VAL 146 N 0.83 1.16 -1.00 -2.22 2.07 -0.67 0.96 116.25 117.37 2frm h VAL 146 Ca 0.22 -0.63 0.09 0.00 0.82 0.00 0.00 66.70 67.20 2frm h VAL 146 Cb -0.04 1.58 -0.08 0.00 -1.52 0.00 0.00 31.29 31.23 2frm h VAL 146 CO -0.04 0.16 0.64 -1.28 0.02 0.00 0.00 177.57 177.07 2frm h SER 147 N -0.33 0.98 0.21 0.57 0.87 -1.15 -1.02 113.55 113.68 2frm h SER 147 Ca -0.01 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.57 2frm h SER 147 Cb 0.30 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 2frm h SER 147 CO 0.01 0.58 -0.10 -0.74 -0.53 0.00 0.00 176.83 176.04 2frm h HIS 148 N 1.08 -0.27 -0.90 2.24 6.17 -0.74 -2.25 115.15 120.49 2frm h HIS 148 Ca 0.46 -0.01 0.13 0.00 0.71 0.00 0.00 60.37 61.66 2frm h HIS 148 Cb 0.33 0.09 -0.09 0.00 2.52 0.00 0.00 27.41 30.26 2frm h HIS 148 CO -0.00 -0.07 0.53 0.35 0.71 0.00 0.00 177.93 179.44 2frm h PHE 149 N -0.41 0.94 -0.69 5.26 3.57 -0.06 0.24 116.94 125.80 2frm h PHE 149 Ca -0.03 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.53 2frm h PHE 149 Cb 0.31 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 38.73 2frm h PHE 149 CO -0.03 0.33 0.43 0.37 -2.23 0.00 0.00 178.31 177.18 2frm h GLN 150 N 0.81 0.83 0.87 1.11 -0.00 -1.00 0.32 115.11 118.05 2frm h GLN 150 Ca 0.46 -0.05 -0.04 0.00 -0.00 0.00 0.00 58.65 59.02 2frm h GLN 150 Cb 0.53 -0.19 0.01 0.00 0.00 0.00 0.00 27.48 27.83 2frm h GLN 150 CO -0.30 0.55 -0.42 0.87 0.00 0.00 0.00 178.83 179.53 2frm h LYS 151 N 0.85 -1.13 0.00 1.69 1.57 -0.37 -1.28 116.57 117.91 2frm h LYS 151 Ca 0.27 0.08 -0.15 0.00 -1.87 0.00 0.00 60.65 58.98 2frm h LYS 151 Cb 0.00 0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 2frm h LYS 151 CO -0.10 -0.75 -0.70 -0.39 -0.57 0.00 0.00 179.45 176.94 2frm h VAL 152 N -1.27 1.50 -0.02 0.50 -1.51 -1.39 -3.16 116.25 110.90 2frm h VAL 152 Ca -0.12 -2.39 -0.19 0.00 -1.23 0.00 0.00 66.70 62.76 2frm h VAL 152 Cb 0.90 2.29 -0.01 0.00 -2.13 0.00 0.00 31.29 32.35 2frm h VAL 152 CO 0.20 0.68 -0.84 0.77 -1.23 0.00 0.00 177.57 177.15 2frm h SER 153 N 0.00 0.34 0.00 4.19 4.64 -1.00 -3.46 113.55 118.26 2frm h SER 153 Ca -0.01 -0.26 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 2frm h SER 153 Cb 1.24 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 2frm h SER 153 CO 0.09 1.03 0.00 0.61 -0.87 0.00 0.00 176.83 177.69 2frm n GLY 154 N 0.78 0.89 3.78 -0.77 0.00 -0.48 -4.64 105.19 104.74 2frm n GLY 154 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 2frm n GLY 154 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2frm s LEU 155 N 0.00 3.52 0.38 0.99 1.43 -1.24 -4.96 118.68 118.80 2frm s LEU 155 Ca 0.00 2.03 -0.27 0.00 -1.03 0.00 0.00 54.13 54.86 2frm s LEU 155 Cb 0.00 -4.56 -0.11 0.00 0.03 0.00 0.00 46.19 41.55 2frm s LEU 155 CO 0.00 -1.43 1.33 -2.65 0.23 0.00 0.00 176.35 173.83 2frm n PRO 156 N -1.99 2.17 0.28 1.29 -0.02 -1.26 -4.87 135.00 130.60 2frm n PRO 156 Ca 0.11 0.77 0.12 0.00 -2.02 0.00 0.00 63.50 62.47 2frm n PRO 156 Cb 0.52 -2.42 0.77 0.00 -0.02 0.00 0.00 33.50 32.35 2frm n PRO 156 CO 0.00 0.00 0.00 1.12 1.98 0.00 0.00 175.50 178.60 2frm h HIS 157 N 2.46 0.00 0.00 6.00 2.07 -1.93 -0.14 115.15 123.62 2frm h HIS 157 Ca -0.48 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.04 2frm h HIS 157 Cb 1.28 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.26 2frm h HIS 157 CO 0.50 0.01 0.00 0.27 -3.07 0.00 0.00 177.93 175.65 2frm n ASN 158 N -4.15 0.00 -0.89 3.10 6.94 -1.26 -2.59 115.26 116.41 2frm n ASN 158 Ca -0.03 0.49 0.11 0.00 -0.02 0.00 0.00 54.58 55.13 2frm n ASN 158 Cb 0.10 -0.50 0.11 0.00 -2.36 0.00 0.00 39.78 37.13 2frm n ASN 158 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2frm n LYS 159 N -1.50 2.03 -4.10 -3.83 4.76 -0.07 -0.90 118.16 114.55 2frm n LYS 159 Ca 0.05 -1.84 -0.28 0.00 -2.87 0.00 0.00 58.31 53.38 2frm n LYS 159 Cb 0.23 -1.42 -0.17 0.00 -1.84 0.00 0.00 35.03 31.83 2frm n LYS 159 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2frm s VAL 160 N -1.72 1.24 0.26 -0.18 1.01 -1.07 0.08 120.40 120.03 2frm s VAL 160 Ca 0.27 -0.45 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 2frm s VAL 160 Cb 0.18 -1.19 -0.02 0.00 0.00 0.00 0.00 36.38 35.34 2frm s VAL 160 CO 0.27 0.40 0.28 0.00 0.00 0.00 0.00 175.10 176.05 2frm s GLY 162 N -3.20 0.91 -0.26 0.00 0.00 -0.29 0.15 107.32 104.62 2frm s GLY 162 Ca 0.35 -0.92 -0.16 0.00 0.00 0.00 0.00 44.72 44.00 2frm s GLY 162 CO 0.16 -0.88 0.42 -0.29 0.00 0.00 0.00 173.10 172.51 2frm s MET 163 N -1.21 4.05 0.20 2.90 1.75 0.72 -1.13 119.30 126.57 2frm s MET 163 Ca 0.03 0.14 0.00 0.00 -1.25 0.00 0.00 55.69 54.62 2frm s MET 163 Cb -0.08 -3.64 0.00 0.00 2.84 0.00 0.00 34.83 33.94 2frm s MET 163 CO 0.02 -0.28 0.00 0.00 -0.65 0.00 0.00 175.02 174.11 2frm n ALA 164 N 5.32 0.00 -0.29 4.11 0.00 -1.26 -4.78 120.51 123.60 2frm n ALA 164 Ca -0.07 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.45 2frm n ALA 164 Cb 0.50 0.00 0.24 0.00 0.00 0.00 0.00 19.45 20.19 2frm n ALA 164 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2frm h GLY 165 N 0.00 1.36 1.00 0.00 0.00 -1.82 0.26 103.07 103.88 2frm h GLY 165 Ca 0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 47.33 47.09 2frm h GLY 165 CO 0.00 -0.11 0.23 -2.08 0.00 0.00 0.00 176.54 174.58 2frm h VAL 166 N 0.52 1.24 0.12 4.60 2.07 -1.66 0.72 116.25 123.85 2frm h VAL 166 Ca 0.48 -0.76 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 2frm h VAL 166 Cb 0.76 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2frm h VAL 166 CO -0.42 0.29 -0.06 0.25 0.02 0.00 0.00 177.57 177.66 2frm h LEU 167 N 0.87 -0.14 0.00 2.57 5.85 -1.47 0.11 115.31 123.11 2frm h LEU 167 Ca 0.20 -0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 2frm h LEU 167 Cb 0.23 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.29 2frm h LEU 167 CO -0.01 0.15 -0.00 0.44 -0.34 0.00 0.00 178.44 178.68 2frm h ASP 168 N -0.43 -0.00 -0.89 1.25 3.32 -0.35 -2.02 116.42 117.29 2frm h ASP 168 Ca -0.02 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.03 2frm h ASP 168 Cb 0.35 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.86 2frm h ASP 168 CO 0.03 0.01 0.58 0.28 -1.72 0.00 0.00 179.24 178.41 2frm h SER 169 N -0.01 1.03 -0.70 6.45 0.02 0.44 -0.33 113.55 120.45 2frm h SER 169 Ca -0.00 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.89 2frm h SER 169 Cb 0.01 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.26 2frm h SER 169 CO 0.00 0.76 0.37 0.28 -1.14 0.00 0.00 176.83 177.10 2frm h SER 170 N 1.21 0.91 -0.09 3.07 0.02 -0.43 0.22 113.55 118.46 2frm h SER 170 Ca 0.32 -0.09 -0.06 0.00 -0.84 0.00 0.00 61.79 61.13 2frm h SER 170 Cb -0.12 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.19 2frm h SER 170 CO -0.07 0.75 -0.18 0.03 -1.14 0.00 0.00 176.83 176.23 2frm h ARG 171 N 1.01 0.28 -0.26 3.45 3.08 -0.75 -1.08 114.38 120.11 2frm h ARG 171 Ca 0.25 -0.18 0.06 0.00 0.07 0.00 0.00 59.98 60.18 2frm h ARG 171 Cb 0.07 0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.08 2frm h ARG 171 CO -0.04 0.77 -0.12 0.35 -1.07 0.00 0.00 179.97 179.86 2frm h PHE 172 N -0.17 -0.29 -0.97 3.04 3.57 -0.78 -0.33 116.94 121.01 2frm h PHE 172 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2frm h PHE 172 Cb 0.76 0.17 -0.05 0.00 2.79 0.00 0.00 35.95 39.62 2frm h PHE 172 CO 0.11 -0.19 0.61 0.00 -2.23 0.00 0.00 178.31 176.61 2frm h ARG 173 N -0.09 1.30 -0.51 1.11 3.08 -0.53 -2.21 114.38 116.53 2frm h ARG 173 Ca 0.14 -0.10 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 2frm h ARG 173 Cb 0.30 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 2frm h ARG 173 CO -0.32 0.88 0.16 1.15 -1.07 0.00 0.00 179.97 180.78 2frm h THR 174 N 1.33 1.23 -0.03 2.04 2.02 -0.24 0.32 112.91 119.58 2frm h THR 174 Ca 0.35 -0.76 -0.10 0.00 0.77 0.00 0.00 66.41 66.67 2frm h THR 174 Cb -0.10 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 2frm h THR 174 CO -0.07 0.28 -0.45 -0.26 0.37 0.00 0.00 175.52 175.39 2frm h PHE 175 N 0.69 0.08 -0.05 3.16 0.04 -0.84 -0.09 116.94 119.93 2frm h PHE 175 Ca 0.16 -0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.89 2frm h PHE 175 Cb 0.27 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.40 2frm h PHE 175 CO 0.01 0.51 -0.06 0.82 -0.60 0.00 0.00 178.31 179.00 2frm h ILE 176 N 0.06 1.38 -0.70 -0.55 2.04 -1.13 -2.56 117.51 116.05 2frm h ILE 176 Ca 0.00 -1.23 0.06 0.00 1.00 0.00 0.00 64.86 64.70 2frm h ILE 176 Cb 0.82 2.08 -0.06 0.00 -0.74 0.00 0.00 36.82 38.93 2frm h ILE 176 CO 0.06 0.33 0.39 0.00 0.00 0.00 0.00 178.15 178.94 2frm h ALA 177 N 0.54 0.94 -0.46 1.87 0.00 -0.69 -1.20 119.26 120.26 2frm h ALA 177 Ca 0.01 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2frm h ALA 177 Cb 0.57 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2frm h ALA 177 CO 0.01 0.07 0.21 1.96 0.00 0.00 0.00 179.25 181.51 2frm h GLN 178 N 0.72 0.65 0.18 0.00 4.20 -1.00 0.67 115.11 120.53 2frm h GLN 178 Ca 0.31 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.94 2frm h GLN 178 Cb 0.20 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.85 2frm h GLN 178 CO -0.19 0.52 -0.09 1.25 -0.67 0.00 0.00 178.83 179.65 2frm h HIS 179 N 0.65 -0.22 0.00 2.96 2.76 -0.81 -3.15 115.15 117.34 2frm h HIS 179 Ca 0.16 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 2frm h HIS 179 Cb 0.09 0.07 0.00 0.00 1.55 0.00 0.00 27.41 29.12 2frm h HIS 179 CO 0.01 0.11 0.00 1.19 -1.30 0.00 0.00 177.93 177.94 2frm n PHE 180 N -5.04 0.33 -3.05 5.26 3.72 -0.85 -4.93 117.46 112.90 2frm n PHE 180 Ca -0.09 0.10 -0.13 0.00 -0.05 0.00 0.00 57.45 57.28 2frm n PHE 180 Cb 0.23 -0.66 0.04 0.00 -0.94 0.00 0.00 39.48 38.15 2frm n PHE 180 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2frm n GLY 181 N 1.28 0.10 3.43 1.37 0.00 0.22 -5.04 105.19 106.55 2frm n GLY 181 Ca 0.06 -0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.68 2frm n GLY 181 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2frm s VAL 182 N -3.13 2.26 0.08 1.61 -7.23 -0.59 -5.03 120.40 108.37 2frm s VAL 182 Ca 0.30 -2.32 -0.34 0.00 -1.81 0.00 0.00 61.98 57.81 2frm s VAL 182 Cb -0.13 -2.21 -0.13 0.00 0.56 0.00 0.00 36.38 34.47 2frm s VAL 182 CO 0.38 -0.43 1.68 -3.20 -0.31 0.00 0.00 175.10 173.22 2frm n ASN 183 N -0.48 3.24 0.20 4.85 5.15 -1.26 -4.56 115.26 122.40 2frm n ASN 183 Ca -0.06 1.04 0.06 0.00 -0.60 0.00 0.00 54.58 55.02 2frm n ASN 183 Cb 0.60 -1.41 0.56 0.00 -0.53 0.00 0.00 39.78 39.00 2frm n ASN 183 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2frm h ALA 184 N 7.07 1.86 0.00 5.20 0.00 -1.91 -0.84 119.26 130.63 2frm h ALA 184 Ca -0.46 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 2frm h ALA 184 Cb 1.26 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 2frm h ALA 184 CO 0.91 0.11 -0.01 0.77 0.00 0.00 0.00 179.25 181.03 2frm h SER 185 N 0.11 0.00 -0.34 0.00 0.02 -1.94 -0.94 113.55 110.46 2frm h SER 185 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2frm h SER 185 Cb 0.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.62 2frm h SER 185 CO 0.00 0.01 0.00 0.47 -1.14 0.00 0.00 176.83 176.18 2frm n ASP 186 N -3.21 2.33 -4.76 3.07 8.00 -0.32 -4.86 116.55 116.80 2frm n ASP 186 Ca -0.02 -1.89 -0.36 0.00 0.71 0.00 0.00 54.79 53.23 2frm n ASP 186 Cb 0.15 -0.22 -0.08 0.00 -0.02 0.00 0.00 41.12 40.95 2frm n ASP 186 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2frm s VAL 187 N -1.56 4.89 -0.20 2.53 1.01 -0.36 -4.56 120.40 122.16 2frm s VAL 187 Ca 0.33 -0.02 -0.02 0.00 0.00 0.00 0.00 61.98 62.26 2frm s VAL 187 Cb 0.18 -3.12 -0.00 0.00 0.00 0.00 0.00 36.38 33.44 2frm s VAL 187 CO 0.25 0.59 -0.09 -0.55 0.00 0.00 0.00 175.10 175.30 2frm s SER 188 N -0.73 4.03 -0.29 3.32 0.15 0.83 -4.99 113.70 116.02 2frm s SER 188 Ca 0.12 -0.43 -0.13 0.00 0.70 0.00 0.00 55.95 56.21 2frm s SER 188 Cb -0.12 -1.67 0.11 0.00 -1.71 0.00 0.00 66.02 62.64 2frm s SER 188 CO 0.03 0.01 0.72 0.00 1.20 0.00 0.00 173.24 175.19 2frm s ALA 189 N 1.27 -2.04 0.12 5.45 0.00 -1.26 -0.93 121.76 124.37 2frm s ALA 189 Ca 0.03 2.35 0.08 0.00 0.00 0.00 0.00 51.96 54.43 2frm s ALA 189 Cb -0.14 -1.65 -0.04 0.00 0.00 0.00 0.00 23.12 21.29 2frm s ALA 189 CO -0.04 -0.66 -0.14 -0.80 0.00 0.00 0.00 175.76 174.13 2frm s ASN 190 N 2.22 4.13 -0.17 0.00 0.01 -1.26 -4.66 114.94 115.21 2frm s ASN 190 Ca -0.08 -0.50 0.01 0.00 -0.71 0.00 0.00 52.86 51.58 2frm s ASN 190 Cb -0.08 -0.68 0.02 0.00 0.41 0.00 0.00 41.25 40.92 2frm s ASN 190 CO -0.19 0.17 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.71 2frm s VAL 191 N -1.25 1.85 0.18 1.60 1.01 -1.26 -1.58 120.40 120.96 2frm s VAL 191 Ca 0.20 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.35 2frm s VAL 191 Cb -0.11 -1.72 0.01 0.00 0.00 0.00 0.00 36.38 34.57 2frm s VAL 191 CO 0.12 0.47 0.09 2.30 0.00 0.00 0.00 175.10 178.09 2frm n ILE 192 N 4.68 0.00 -3.12 2.22 -5.35 -0.68 -4.71 119.36 112.38 2frm n ILE 192 Ca -0.19 -0.78 0.00 0.00 -0.27 0.00 0.00 62.75 61.52 2frm n ILE 192 Cb 0.50 -0.17 0.00 0.00 -1.74 0.00 0.00 39.64 38.23 2frm n ILE 192 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2frm n GLY 193 N 2.79 -0.90 0.00 3.28 0.00 -0.38 -0.25 105.19 109.73 2frm n GLY 193 Ca -0.03 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.63 2frm n GLY 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2frm n GLY 194 N 0.00 0.76 2.77 -0.02 0.00 -0.44 -2.22 105.19 106.04 2frm n GLY 194 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2frm n GLY 194 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2frm n HIS 195 N 0.00 0.29 0.00 1.61 -0.00 -1.26 -3.39 115.22 112.47 2frm n HIS 195 Ca 0.00 -2.11 0.00 0.00 0.46 0.00 0.00 57.72 56.07 2frm n HIS 195 Cb 0.00 -0.06 0.00 0.00 -0.12 0.00 0.00 29.99 29.81 2frm n HIS 195 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2frm n GLY 196 N -0.15 3.88 0.14 1.57 0.00 -1.26 0.49 105.19 109.85 2frm n GLY 196 Ca -0.07 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.06 2frm n GLY 196 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2frm h ASP 197 N 0.00 0.00 1.23 1.61 3.32 -1.96 -3.10 116.42 117.53 2frm h ASP 197 Ca 0.00 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.03 2frm h ASP 197 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2frm h ASP 197 CO 0.00 0.01 0.00 1.23 -1.72 0.00 0.00 179.24 178.76 2frm h GLY 198 N 4.33 0.00 -2.83 2.75 0.00 -0.29 -3.44 103.07 103.59 2frm h GLY 198 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 2frm h GLY 198 CO 0.00 0.00 0.56 -0.29 0.00 0.00 0.00 176.54 176.81 2frm s MET 199 N -3.24 3.46 -0.41 4.80 0.00 -0.95 -1.33 119.30 121.63 2frm s MET 199 Ca 0.07 2.06 0.02 0.00 0.00 0.00 0.00 55.69 57.84 2frm s MET 199 Cb 0.10 -2.37 0.15 0.00 0.00 0.00 0.00 34.83 32.71 2frm s MET 199 CO 0.53 -0.88 0.26 0.08 0.00 0.00 0.00 175.02 175.02 2frm s VAL 200 N -1.39 0.71 -0.39 10.11 1.01 0.66 -4.84 120.40 126.27 2frm s VAL 200 Ca 0.67 -2.32 -0.28 0.00 0.00 0.00 0.00 61.98 60.05 2frm s VAL 200 Cb -0.36 -1.50 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 2frm s VAL 200 CO 0.43 -1.02 1.63 -2.16 0.00 0.00 0.00 175.10 173.98 2frm s PRO 201 N 0.49 3.39 -0.90 2.72 0.04 -1.26 -1.69 135.00 137.78 2frm s PRO 201 Ca 0.22 1.14 -0.24 0.00 0.04 0.00 0.00 61.00 62.15 2frm s PRO 201 Cb -0.16 -4.13 -0.02 0.00 0.04 0.00 0.00 34.50 30.22 2frm s PRO 201 CO -0.05 -1.79 1.82 0.00 0.04 0.00 0.00 177.00 177.02 2frm s ALA 202 N 6.36 1.94 0.46 8.56 0.00 -0.61 -4.82 121.76 133.65 2frm s ALA 202 Ca 0.70 -1.61 0.22 0.00 0.00 0.00 0.00 51.96 51.28 2frm s ALA 202 Cb -0.18 -4.53 1.22 0.00 0.00 0.00 0.00 23.12 19.64 2frm s ALA 202 CO 0.32 -4.47 1.87 1.79 0.00 0.00 0.00 175.76 175.27 2frm h THR 203 N 7.11 0.64 0.00 0.00 1.35 -1.90 0.44 112.91 120.55 2frm h THR 203 Ca 0.09 -0.09 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2frm h THR 203 Cb 1.02 0.36 0.00 0.00 -1.73 0.00 0.00 68.15 67.79 2frm h THR 203 CO 1.26 0.05 0.00 -1.54 -0.25 0.00 0.00 175.52 175.04 2frm n SER 204 N -4.43 0.07 -0.28 5.36 3.41 -1.26 -1.93 113.62 114.55 2frm n SER 204 Ca 0.19 0.52 0.12 0.00 -0.26 0.00 0.00 58.87 59.43 2frm n SER 204 Cb 0.78 -0.53 0.23 0.00 -0.26 0.00 0.00 64.21 64.42 2frm n SER 204 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2frm n SER 205 N -1.58 1.27 -4.74 4.04 3.41 0.16 -4.90 113.62 111.28 2frm n SER 205 Ca 0.04 -1.03 -0.41 0.00 -0.26 0.00 0.00 58.87 57.22 2frm n SER 205 Cb 0.20 0.29 -0.05 0.00 -0.26 0.00 0.00 64.21 64.39 2frm n SER 205 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2frm s VAL 206 N -2.56 4.18 -0.14 -3.33 1.01 -0.81 -4.16 120.40 114.58 2frm s VAL 206 Ca 0.21 1.98 -0.29 0.00 0.00 0.00 0.00 61.98 63.88 2frm s VAL 206 Cb 0.19 -4.26 0.08 0.00 0.00 0.00 0.00 36.38 32.38 2frm s VAL 206 CO 0.57 0.38 0.73 -0.94 0.00 0.00 0.00 175.10 175.84 2frm s SER 207 N -0.52 -0.67 -0.24 3.32 1.04 -0.11 -2.94 113.70 113.59 2frm s SER 207 Ca 0.45 0.97 0.12 0.00 0.48 0.00 0.00 55.95 57.97 2frm s SER 207 Cb -0.26 0.87 0.45 0.00 0.10 0.00 0.00 66.02 67.19 2frm s SER 207 CO 0.32 -0.45 1.19 0.52 0.98 0.00 0.00 173.24 175.80 2frm n VAL 208 N 1.59 2.08 0.00 5.02 0.31 -1.26 -0.12 118.33 125.95 2frm n VAL 208 Ca -0.16 -3.49 0.00 0.00 -0.01 0.00 0.00 64.34 60.67 2frm n VAL 208 Cb 0.56 -0.40 0.00 0.00 -0.91 0.00 0.00 33.84 33.10 2frm n VAL 208 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2frm n GLY 209 N -0.74 0.00 3.58 2.92 0.00 -1.26 -4.81 105.19 104.87 2frm n GLY 209 Ca 0.28 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.89 2frm n GLY 209 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2frm s VAL 209 N 0.00 4.98 0.58 1.61 1.01 -1.26 -5.04 120.40 122.27 2frm s VAL 209 Ca 0.00 0.60 -0.21 0.00 0.00 0.00 0.00 61.98 62.37 2frm s VAL 209 Cb 0.00 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 2frm s VAL 209 CO 0.00 -0.17 1.35 -2.84 0.00 0.00 0.00 175.10 173.44 2frm s PRO 209 N 2.50 2.96 0.48 2.72 0.02 -1.26 -4.33 135.00 138.09 2frm s PRO 209 Ca 0.22 2.21 0.13 0.00 0.02 0.00 0.00 61.00 63.58 2frm s PRO 209 Cb -0.15 -2.14 1.13 0.00 0.02 0.00 0.00 34.50 33.36 2frm s PRO 209 CO 0.13 -1.32 2.10 1.25 -0.33 0.00 0.00 177.00 178.83 2frm h LEU 210 N 1.19 0.18 -0.71 -5.54 5.85 -1.84 -2.05 115.31 112.38 2frm h LEU 210 Ca -0.51 -0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.17 2frm h LEU 210 Cb 1.31 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.27 2frm h LEU 210 CO 0.56 0.13 0.30 0.77 -0.34 0.00 0.00 178.44 179.86 2frm h SER 210 N 0.21 0.97 -0.11 1.25 4.64 -1.89 -2.48 113.55 116.13 2frm h SER 210 Ca 0.08 -0.16 -0.04 0.00 -0.47 0.00 0.00 61.79 61.20 2frm h SER 210 Cb 0.06 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.88 2frm h SER 210 CO -0.02 0.86 -0.03 0.28 -0.87 0.00 0.00 176.83 177.06 2frm h SER 211 N 1.01 0.32 0.02 4.97 0.02 -1.73 -1.71 113.55 116.45 2frm h SER 211 Ca 0.24 -0.05 -0.05 0.00 -0.84 0.00 0.00 61.79 61.09 2frm h SER 211 Cb 0.18 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 2frm h SER 211 CO -0.02 0.41 -0.12 -0.26 -1.14 0.00 0.00 176.83 175.70 2frm h PHE 212 N 0.34 0.23 -0.28 3.45 -1.00 -1.30 -0.66 116.94 117.71 2frm h PHE 212 Ca 0.08 -0.02 -0.06 0.00 2.81 0.00 0.00 57.97 60.78 2frm h PHE 212 Cb 0.28 -0.07 -0.01 0.00 3.61 0.00 0.00 35.95 39.77 2frm h PHE 212 CO 0.01 0.34 -0.04 0.82 -1.61 0.00 0.00 178.31 177.82 2frm h ILE 213 N 0.21 1.27 -0.38 -0.55 2.04 -1.15 0.17 117.51 119.12 2frm h ILE 213 Ca 0.04 -1.03 -0.09 0.00 1.00 0.00 0.00 64.86 64.78 2frm h ILE 213 Cb 0.34 1.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 2frm h ILE 213 CO 0.02 0.33 -0.15 0.11 0.00 0.00 0.00 178.15 178.46 2frm h LYS 214 N 0.29 0.70 0.00 2.37 1.57 -1.28 -1.86 116.57 118.37 2frm h LYS 214 Ca 0.07 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 2frm h LYS 214 Cb 0.50 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2frm h LYS 214 CO 0.02 0.82 0.00 1.04 -0.57 0.00 0.00 179.45 180.76 2frm n GLN 215 N -4.15 0.42 -1.76 3.15 6.02 -0.29 -4.87 117.38 115.89 2frm n GLN 215 Ca 0.01 0.05 -0.09 0.00 -0.01 0.00 0.00 57.00 56.95 2frm n GLN 215 Cb 0.38 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.12 2frm n GLN 215 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2frm n GLY 216 N 0.77 0.49 0.09 1.08 0.00 -0.70 -4.92 105.19 102.00 2frm n GLY 216 Ca 0.13 -0.56 0.12 0.00 0.00 0.00 0.00 46.02 45.70 2frm n GLY 216 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2frm n LEU 218 N -1.18 0.83 -3.61 0.99 4.77 0.53 -4.93 117.00 114.41 2frm n LEU 218 Ca -0.10 -0.22 -0.13 0.00 -0.03 0.00 0.00 56.01 55.53 2frm n LEU 218 Cb 0.45 -0.15 -0.07 0.00 -2.33 0.00 0.00 43.42 41.32 2frm n LEU 218 CO 0.13 0.19 0.54 -0.51 -1.33 0.00 0.00 177.39 176.41 2frm s ILE 219 N -2.86 0.00 0.18 -0.08 2.07 -1.18 -4.98 121.20 114.35 2frm s ILE 219 Ca 0.14 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.40 2frm s ILE 219 Cb 0.18 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.73 2frm s ILE 219 CO 0.69 0.00 0.32 0.42 -1.91 0.00 0.00 174.94 174.46 2frm s THR 220 N -0.07 5.30 0.31 4.00 -4.23 -1.26 -4.13 115.64 115.56 2frm s THR 220 Ca -0.01 -0.72 0.02 0.00 -1.18 0.00 0.00 61.69 59.79 2frm s THR 220 Cb -0.04 -3.77 0.16 0.00 1.34 0.00 0.00 72.50 70.19 2frm s THR 220 CO 0.01 -0.16 1.86 -0.61 -0.54 0.00 0.00 174.62 175.17 2frm h GLN 221 N 1.88 0.66 -0.54 3.99 5.75 -1.99 0.31 115.11 125.16 2frm h GLN 221 Ca -0.49 -0.14 -0.02 0.00 -0.15 0.00 0.00 58.65 57.85 2frm h GLN 221 Cb 1.20 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 29.63 2frm h GLN 221 CO 0.67 0.63 0.26 0.93 -2.65 0.00 0.00 178.83 178.67 2frm h GLU 222 N 0.63 0.76 -0.11 1.69 3.07 -2.00 -1.37 114.58 117.25 2frm h GLU 222 Ca 0.14 -0.09 -0.14 0.00 -0.50 0.00 0.00 59.36 58.77 2frm h GLU 222 Cb 0.31 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.06 2frm h GLU 222 CO 0.00 0.59 -0.54 1.96 -1.40 0.00 0.00 179.01 179.63 2frm h GLN 223 N 0.76 0.33 -0.61 2.33 4.20 -1.39 -2.80 115.11 117.92 2frm h GLN 223 Ca 0.19 -0.20 -0.08 0.00 0.06 0.00 0.00 58.65 58.62 2frm h GLN 223 Cb 0.08 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 2frm h GLN 223 CO -0.03 0.78 0.06 0.82 -0.67 0.00 0.00 178.83 179.80 2frm h ILE 225 N 0.25 1.26 -0.33 2.54 2.04 -0.11 -2.76 117.51 120.41 2frm h ILE 225 Ca 0.01 -1.07 -0.08 0.00 1.00 0.00 0.00 64.86 64.72 2frm h ILE 225 Cb 1.03 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 2frm h ILE 225 CO 0.09 0.39 -0.15 0.44 0.00 0.00 0.00 178.15 178.92 2frm h ASP 226 N 0.95 0.56 -0.33 1.72 3.32 -1.20 -1.12 116.42 120.32 2frm h ASP 226 Ca 0.18 -0.16 -0.03 0.00 0.02 0.00 0.00 57.03 57.04 2frm h ASP 226 Cb 0.48 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 2frm h ASP 226 CO 0.02 0.74 0.10 -0.08 -1.72 0.00 0.00 179.24 178.30 2frm h GLU 227 N 0.52 0.59 0.09 3.56 4.22 -1.31 0.12 114.58 122.38 2frm h GLU 227 Ca 0.09 -0.10 -0.00 0.00 0.08 0.00 0.00 59.36 59.43 2frm h GLU 227 Cb 0.56 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2frm h GLU 227 CO 0.04 0.54 -0.05 0.82 -2.18 0.00 0.00 179.01 178.18 2frm h ILE 228 N 0.58 1.13 -0.74 2.32 1.08 -1.09 0.20 117.51 120.99 2frm h ILE 228 Ca 0.13 -0.93 0.11 0.00 -0.39 0.00 0.00 64.86 63.79 2frm h ILE 228 Cb 0.21 1.71 -0.08 0.00 -3.07 0.00 0.00 36.82 35.59 2frm h ILE 228 CO -0.00 0.22 0.35 0.58 -0.69 0.00 0.00 178.15 178.61 2frm h VAL 229 N -0.56 0.78 -0.25 1.67 2.07 -0.89 0.13 116.25 119.20 2frm h VAL 229 Ca -0.01 -0.19 -0.19 0.00 0.82 0.00 0.00 66.70 67.12 2frm h VAL 229 Cb 0.46 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 2frm h VAL 229 CO 0.02 0.10 -0.59 0.00 0.02 0.00 0.00 177.57 177.12 2frm h HIS 231 N 0.62 0.54 -0.63 0.00 6.17 0.34 -1.93 115.15 120.26 2frm h HIS 231 Ca 0.00 -0.01 -0.07 0.00 0.71 0.00 0.00 60.37 61.00 2frm h HIS 231 Cb 1.20 -0.17 -0.03 0.00 2.52 0.00 0.00 27.41 30.93 2frm h HIS 231 CO 0.07 0.42 0.13 1.15 0.71 0.00 0.00 177.93 180.42 2frm h THR 232 N 0.55 1.26 -0.02 6.26 2.02 -0.61 0.29 112.91 122.66 2frm h THR 232 Ca 0.14 -0.96 -0.13 0.00 0.77 0.00 0.00 66.41 66.23 2frm h THR 232 Cb 0.10 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 2frm h THR 232 CO -0.02 0.36 -0.60 0.03 0.37 0.00 0.00 175.52 175.66 2frm h ARG 233 N 0.93 0.08 -0.20 6.66 3.08 -1.10 -3.26 114.38 120.57 2frm h ARG 233 Ca 0.19 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.19 2frm h ARG 233 Cb 0.38 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.44 2frm h ARG 233 CO 0.01 0.66 0.00 0.44 -1.07 0.00 0.00 179.97 180.01 2frm n ILE 234 N -3.84 0.38 -0.34 2.04 -5.35 -0.87 -4.63 119.36 106.75 2frm n ILE 234 Ca -0.02 -0.69 0.19 0.00 -0.27 0.00 0.00 62.75 61.97 2frm n ILE 234 Cb 0.61 1.01 0.43 0.00 -1.74 0.00 0.00 39.64 39.95 2frm n ILE 234 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2frm h ALA 235 N 3.03 1.95 -0.73 -1.28 0.00 -0.98 -0.79 119.26 120.46 2frm h ALA 235 Ca 0.00 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2frm h ALA 235 Cb 0.73 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 2frm h ALA 235 CO 0.00 -0.40 0.37 0.11 0.00 0.00 0.00 179.25 179.33 2frm h TRP 236 N 0.52 1.04 -0.57 0.00 0.09 -1.84 -2.59 115.95 112.61 2frm h TRP 236 Ca 0.62 -0.04 -0.08 0.00 0.09 0.00 0.00 58.89 59.48 2frm h TRP 236 Cb 1.32 -0.33 -0.02 0.00 0.08 0.00 0.00 29.16 30.21 2frm h TRP 236 CO -0.00 0.76 0.02 -0.22 0.09 0.00 0.00 178.44 179.08 2frm h LYS 237 N 1.02 0.96 -0.53 0.12 3.64 -1.49 0.18 116.57 120.48 2frm h LYS 237 Ca 0.25 -0.28 0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2frm h LYS 237 Cb 0.10 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 2frm h LYS 237 CO -0.03 0.94 0.35 1.49 -2.27 0.00 0.00 179.45 179.93 2frm h GLU 238 N 0.89 0.64 -0.00 1.90 4.81 -1.17 0.62 114.58 122.27 2frm h GLU 238 Ca 0.17 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.30 2frm h GLU 238 Cb 0.50 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.74 2frm h GLU 238 CO 0.02 0.42 -0.22 0.28 -0.73 0.00 0.00 179.01 178.79 2frm h VAL 239 N 0.66 1.56 -0.82 0.32 2.07 -1.01 -3.29 116.25 115.74 2frm h VAL 239 Ca 0.21 -1.93 0.05 0.00 0.82 0.00 0.00 66.70 65.85 2frm h VAL 239 Cb 0.02 2.78 -0.06 0.00 -1.52 0.00 0.00 31.29 32.51 2frm h VAL 239 CO -0.05 0.53 0.50 0.00 0.02 0.00 0.00 177.57 178.57 2frm h ALA 240 N 0.25 1.11 -0.95 1.67 0.00 -0.13 -2.13 119.26 119.08 2frm h ALA 240 Ca -0.03 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2frm h ALA 240 Cb 0.98 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.50 2frm h ALA 240 CO 0.04 0.25 0.62 -0.44 0.00 0.00 0.00 179.25 179.73 2frm h ASP 240 N 0.93 1.09 0.71 0.00 3.32 -1.00 -1.09 116.42 120.38 2frm h ASP 240 Ca 0.35 -0.03 -0.18 0.00 0.02 0.00 0.00 57.03 57.18 2frm h ASP 240 Cb 0.14 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 2frm h ASP 240 CO -0.16 0.80 -0.85 0.78 -1.72 0.00 0.00 179.24 178.09 2frm h ASN 241 N 1.28 0.12 0.82 6.45 4.21 -1.54 -2.93 115.58 124.00 2frm h ASN 241 Ca 0.35 -0.10 0.00 0.00 1.21 0.00 0.00 56.30 57.76 2frm h ASN 241 Cb -0.14 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.02 2frm h ASN 241 CO -0.07 0.91 0.00 0.18 -1.29 0.00 0.00 177.43 177.16 2frm n LEU 242 N -3.61 0.00 0.00 1.61 4.77 -0.83 -4.90 117.00 114.03 2frm n LEU 242 Ca -0.02 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 2frm n LEU 242 Cb 0.80 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 2frm n LEU 242 CO 0.46 -0.02 0.00 0.29 -1.33 0.00 0.00 177.39 176.79 2frm n LYS 243 N -1.44 0.00 -4.43 3.23 4.76 -0.45 -4.59 118.16 115.25 2frm n LYS 243 Ca 0.09 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 55.19 2frm n LYS 243 Cb 0.29 0.00 -0.13 0.00 -1.84 0.00 0.00 35.03 33.36 2frm n LYS 243 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2frm s THR 243 N 0.00 3.66 0.00 -0.18 -4.23 -1.26 -4.84 115.64 108.79 2frm s THR 243 Ca 0.00 -0.44 0.00 0.00 -1.18 0.00 0.00 61.69 60.07 2frm s THR 243 Cb 0.00 -2.60 0.00 0.00 1.34 0.00 0.00 72.50 71.24 2frm s THR 243 CO 0.00 0.49 0.00 0.61 -0.54 0.00 0.00 174.62 175.18 2frm n GLY 244 N 3.68 -0.08 3.81 3.99 0.00 -1.26 -5.08 105.19 110.26 2frm n GLY 244 Ca -0.18 -1.75 -0.32 0.00 0.00 0.00 0.00 46.02 43.77 2frm n GLY 244 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2frm s THR 245 N -2.28 1.21 0.25 2.61 -4.23 -1.26 -4.68 115.64 107.26 2frm s THR 245 Ca 0.00 -1.87 -0.30 0.00 -1.18 0.00 0.00 61.69 58.33 2frm s THR 245 Cb 0.00 -2.08 -0.14 0.00 1.34 0.00 0.00 72.50 71.63 2frm s THR 245 CO 0.00 0.00 1.30 0.00 -0.54 0.00 0.00 174.62 175.38 2frm n ALA 246 N -1.42 0.68 0.00 3.99 0.00 -1.26 -4.91 120.51 117.58 2frm n ALA 246 Ca -0.16 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.69 2frm n ALA 246 Cb 0.66 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.91 2frm n ALA 246 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2frm n TYR 247 N 1.33 0.00 0.05 0.00 0.18 -1.26 -4.70 117.16 112.76 2frm n TYR 247 Ca 0.11 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.76 2frm n TYR 247 Cb 0.31 0.00 -0.08 0.00 -0.38 0.00 0.00 39.34 39.19 2frm n TYR 247 CO 0.00 0.00 0.00 0.74 -2.08 0.00 0.00 176.86 175.52 2frm h PHE 248 N 0.00 -0.08 -0.19 -3.48 -1.00 -1.92 -1.79 116.94 108.49 2frm h PHE 248 Ca 0.00 -0.00 -0.17 0.00 2.81 0.00 0.00 57.97 60.61 2frm h PHE 248 Cb 0.19 0.03 0.00 0.00 3.61 0.00 0.00 35.95 39.78 2frm h PHE 248 CO 0.00 0.11 -0.54 0.00 -1.61 0.00 0.00 178.31 176.28 2frm h ALA 249 N 0.66 0.32 -0.36 2.45 0.00 -1.99 -2.45 119.26 117.89 2frm h ALA 249 Ca -0.01 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 2frm h ALA 249 Cb 0.23 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2frm h ALA 249 CO 0.01 0.52 0.21 -1.35 0.00 0.00 0.00 179.25 178.65 2frm h PRO 250 N 0.40 0.49 -0.16 0.00 0.11 -1.83 -0.14 132.00 130.86 2frm h PRO 250 Ca -0.01 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.02 2frm h PRO 250 Cb 1.16 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 2frm h PRO 250 CO 0.12 0.35 -0.07 0.00 -0.21 0.00 0.00 178.00 178.19 2frm h ALA 251 N 1.74 0.23 -0.70 -0.75 0.00 -1.22 -2.61 119.26 115.95 2frm h ALA 251 Ca 0.13 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.81 2frm h ALA 251 Cb -0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2frm h ALA 251 CO -0.02 0.02 0.44 0.00 0.00 0.00 0.00 179.25 179.68 2frm h ALA 252 N 0.69 0.91 0.04 0.00 0.00 -0.94 -2.33 119.26 117.63 2frm h ALA 252 Ca 0.04 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2frm h ALA 252 Cb 0.53 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2frm h ALA 252 CO 0.02 0.21 -0.18 0.00 0.00 0.00 0.00 179.25 179.30 2frm h ALA 253 N 1.30 -0.26 -0.44 0.00 0.00 -0.96 -1.15 119.26 117.75 2frm h ALA 253 Ca 0.28 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.24 2frm h ALA 253 Cb 0.02 0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 2frm h ALA 253 CO -0.11 -0.69 0.14 0.00 0.00 0.00 0.00 179.25 178.59 2frm h ALA 254 N 0.56 0.52 -0.56 0.00 0.00 -1.20 -1.76 119.26 116.81 2frm h ALA 254 Ca 0.04 0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.08 2frm h ALA 254 Cb 0.37 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 2frm h ALA 254 CO -0.15 -0.26 0.26 0.28 0.00 0.00 0.00 179.25 179.39 2frm h VAL 255 N 0.29 0.89 -0.95 0.00 2.07 -1.07 0.62 116.25 118.10 2frm h VAL 255 Ca 0.21 -0.17 0.06 0.00 0.82 0.00 0.00 66.70 67.62 2frm h VAL 255 Cb 0.22 0.36 -0.06 0.00 -1.52 0.00 0.00 31.29 30.29 2frm h VAL 255 CO -0.23 0.09 0.61 0.11 0.02 0.00 0.00 177.57 178.17 2frm h LYS 256 N 0.49 1.08 -0.55 1.57 1.79 -0.39 0.46 116.57 121.03 2frm h LYS 256 Ca 0.26 -0.07 -0.10 0.00 -2.18 0.00 0.00 60.65 58.57 2frm h LYS 256 Cb 0.23 -0.24 -0.02 0.00 -1.58 0.00 0.00 32.23 30.62 2frm h LYS 256 CO -0.21 0.72 -0.05 0.52 -1.08 0.00 0.00 179.45 179.34 2frm h MET 257 N 1.11 1.00 -0.74 3.15 2.86 -0.57 -1.24 114.93 120.51 2frm h MET 257 Ca 0.41 -0.35 -0.03 0.00 -2.06 0.00 0.00 59.70 57.67 2frm h MET 257 Cb 0.14 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.69 2frm h MET 257 CO -0.17 1.03 0.35 0.00 1.06 0.00 0.00 176.91 179.18 2frm h ALA 258 N 0.94 0.95 -0.06 6.32 0.00 0.45 -2.87 119.26 124.99 2frm h ALA 258 Ca 0.15 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2frm h ALA 258 Cb 0.61 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 2frm h ALA 258 CO 0.04 0.52 0.04 0.93 0.00 0.00 0.00 179.25 180.78 2frm h GLU 259 N 1.04 0.08 -0.93 0.00 5.08 0.21 -0.93 114.58 119.13 2frm h GLU 259 Ca 0.25 -0.01 0.20 0.00 -1.00 0.00 0.00 59.36 58.81 2frm h GLU 259 Cb 0.13 -0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.28 2frm h GLU 259 CO -0.03 0.06 0.60 0.00 -1.00 0.00 0.00 179.01 178.64 2frm h ALA 260 N 1.02 2.09 0.11 3.43 0.00 -1.05 0.96 119.26 125.82 2frm h ALA 260 Ca 0.02 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2frm h ALA 260 Cb -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2frm h ALA 260 CO -0.00 -0.39 -0.05 -0.92 0.00 0.00 0.00 179.25 177.88 2frm h TYR 261 N 0.49 -0.14 -0.72 0.00 3.20 -1.26 -1.01 116.97 117.52 2frm h TYR 261 Ca 0.49 -0.00 0.12 0.00 3.14 0.00 0.00 58.73 62.48 2frm h TYR 261 Cb 1.11 0.05 -0.05 0.00 1.54 0.00 0.00 36.73 39.38 2frm h TYR 261 CO -0.00 0.07 0.48 -0.07 -1.64 0.00 0.00 178.16 176.99 2frm h LEU 262 N -1.02 0.45 -2.48 2.82 3.38 -0.85 -0.72 115.31 116.90 2frm h LEU 262 Ca -0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2frm h LEU 262 Cb 0.27 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2frm h LEU 262 CO 0.03 0.25 0.00 0.29 0.09 0.00 0.00 178.44 179.10 2frm n LYS 263 N -4.49 2.59 -4.13 1.13 4.76 0.30 -4.95 118.16 113.37 2frm n LYS 263 Ca 0.13 -2.44 -0.34 0.00 -2.87 0.00 0.00 58.31 52.79 2frm n LYS 263 Cb 0.44 -1.54 -0.04 0.00 -1.84 0.00 0.00 35.03 32.05 2frm n LYS 263 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2frm n ASP 264 N 1.56 -1.10 0.13 4.39 2.03 -0.28 -4.84 116.55 118.44 2frm n ASP 264 Ca 0.22 -1.21 0.13 0.00 0.52 0.00 0.00 54.79 54.45 2frm n ASP 264 Cb 0.61 -2.05 0.43 0.00 -0.72 0.00 0.00 41.12 39.39 2frm n ASP 264 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2frm h LYS 265 N -2.03 0.00 -5.91 -0.67 1.57 -1.34 -3.43 116.57 104.76 2frm h LYS 265 Ca -0.67 0.00 -0.41 0.00 -1.87 0.00 0.00 60.65 57.70 2frm h LYS 265 Cb 1.39 0.00 0.12 0.00 0.08 0.00 0.00 32.23 33.82 2frm h LYS 265 CO 0.62 0.00 -0.70 1.63 -0.57 0.00 0.00 179.45 180.44 2frm n LYS 266 N -2.34 -7.52 -3.11 3.15 4.01 -0.27 -4.94 118.16 107.13 2frm n LYS 266 Ca 0.04 0.80 -0.35 0.00 -0.51 0.00 0.00 58.31 58.28 2frm n LYS 266 Cb 0.36 -5.82 -0.06 0.00 -0.51 0.00 0.00 35.03 29.00 2frm n LYS 266 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2frm s ALA 267 N -3.32 3.39 -0.39 7.82 0.00 -0.93 -4.69 121.76 123.64 2frm s ALA 267 Ca 0.55 0.13 -0.29 0.00 0.00 0.00 0.00 51.96 52.35 2frm s ALA 267 Cb -0.25 -2.80 0.01 0.00 0.00 0.00 0.00 23.12 20.08 2frm s ALA 267 CO 0.75 0.33 1.29 0.08 0.00 0.00 0.00 175.76 178.21 2frm s VAL 268 N -1.64 4.09 -0.20 0.00 1.01 -1.26 -1.16 120.40 121.23 2frm s VAL 268 Ca 0.46 1.16 0.00 0.00 0.00 0.00 0.00 61.98 63.59 2frm s VAL 268 Cb -0.15 -4.30 0.05 0.00 0.00 0.00 0.00 36.38 31.98 2frm s VAL 268 CO 0.20 -0.72 -0.05 -0.69 0.00 0.00 0.00 175.10 173.84 2frm s VAL 269 N 4.77 1.31 -0.35 2.92 1.01 0.23 -4.92 120.40 125.38 2frm s VAL 269 Ca 0.55 -0.91 -0.29 0.00 0.00 0.00 0.00 61.98 61.33 2frm s VAL 269 Cb -0.13 -1.53 0.01 0.00 0.00 0.00 0.00 36.38 34.73 2frm s VAL 269 CO 0.28 0.02 1.26 -2.16 0.00 0.00 0.00 175.10 174.50 2frm s PRO 270 N 1.52 3.85 0.32 2.72 0.04 -1.26 -0.94 135.00 141.25 2frm s PRO 270 Ca -0.02 1.06 -0.11 0.00 0.04 0.00 0.00 61.00 61.97 2frm s PRO 270 Cb -0.17 -3.88 0.02 0.00 0.04 0.00 0.00 34.50 30.50 2frm s PRO 270 CO -0.07 -1.20 0.58 0.00 0.04 0.00 0.00 177.00 176.35 2frm s SER 272 N -3.09 6.11 0.20 0.00 0.15 -0.28 -1.67 113.70 115.11 2frm s SER 272 Ca 0.22 -0.05 0.04 0.00 0.70 0.00 0.00 55.95 56.86 2frm s SER 272 Cb -0.02 -2.55 -0.05 0.00 -1.71 0.00 0.00 66.02 61.69 2frm s SER 272 CO 0.13 -1.79 -0.04 0.00 1.20 0.00 0.00 173.24 172.74 2frm s ALA 273 N 6.04 1.67 -0.47 5.45 0.00 -0.80 -1.14 121.76 132.51 2frm s ALA 273 Ca 0.45 -1.65 -0.29 0.00 0.00 0.00 0.00 51.96 50.47 2frm s ALA 273 Cb -0.09 0.31 0.02 0.00 0.00 0.00 0.00 23.12 23.36 2frm s ALA 273 CO 0.20 -0.19 1.31 0.12 0.00 0.00 0.00 175.76 177.20 2frm s PHE 274 N -3.38 2.53 -0.23 0.00 2.19 -1.26 -1.86 117.98 115.97 2frm s PHE 274 Ca 0.24 0.64 -0.06 0.00 0.33 0.00 0.00 56.93 58.07 2frm s PHE 274 Cb 0.04 -4.39 -0.03 0.00 -1.31 0.00 0.00 43.02 37.34 2frm s PHE 274 CO 0.05 -1.72 0.04 0.00 1.83 0.00 0.00 175.22 175.43 2frm n SER 276 N 4.69 2.65 -2.36 0.00 3.41 -1.26 -2.42 113.62 118.33 2frm n SER 276 Ca -0.17 -0.18 -0.03 0.00 -0.26 0.00 0.00 58.87 58.24 2frm n SER 276 Cb 0.51 0.89 0.05 0.00 -0.26 0.00 0.00 64.21 65.40 2frm n SER 276 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2frm n ASN 277 N -1.15 2.00 -3.65 4.04 5.15 -1.26 -4.29 115.26 116.09 2frm n ASN 277 Ca 0.00 -2.38 -0.11 0.00 -0.60 0.00 0.00 54.58 51.50 2frm n ASN 277 Cb 0.00 -0.43 -0.05 0.00 -0.53 0.00 0.00 39.78 38.77 2frm n ASN 277 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 2frm s HIS 278 N -3.04 -0.18 -1.32 1.20 3.76 -1.26 -4.93 115.29 109.51 2frm s HIS 278 Ca 0.33 -0.12 -0.01 0.00 -0.15 0.00 0.00 55.06 55.11 2frm s HIS 278 Cb 0.35 0.23 0.00 0.00 1.11 0.00 0.00 32.58 34.27 2frm s HIS 278 CO -0.05 -0.67 0.06 0.66 -0.85 0.00 0.00 174.74 173.88 2frm n TYR 279 N -0.13 -1.34 -0.84 1.40 4.02 -1.26 -2.24 117.16 116.78 2frm n TYR 279 Ca -0.16 0.05 0.00 0.00 -0.01 0.00 0.00 57.90 57.78 2frm n TYR 279 Cb 0.63 -3.24 0.00 0.00 -0.02 0.00 0.00 39.34 36.71 2frm n TYR 279 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2frm n GLY 280 N -0.93 0.33 3.95 2.72 0.00 -1.26 -5.00 105.19 105.01 2frm n GLY 280 Ca -0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.62 2frm n GLY 280 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2frm s VAL 281 N -1.90 4.25 -0.04 1.61 -7.23 -0.95 -5.03 120.40 111.11 2frm s VAL 281 Ca 0.00 -0.50 0.17 0.00 -1.81 0.00 0.00 61.98 59.84 2frm s VAL 281 Cb 0.00 -3.56 -0.26 0.00 0.56 0.00 0.00 36.38 33.12 2frm s VAL 281 CO 0.00 -0.38 0.34 2.29 -0.31 0.00 0.00 175.10 177.04 2frm n LYS 282 N -2.00 0.64 0.00 4.82 2.85 -1.26 -4.20 118.16 119.01 2frm n LYS 282 Ca 0.00 -0.14 0.00 0.00 -1.05 0.00 0.00 58.31 57.12 2frm n LYS 282 Cb 0.57 -1.42 0.00 0.00 -0.65 0.00 0.00 35.03 33.54 2frm n LYS 282 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2frm n GLY 283 N 1.57 -1.41 3.34 2.58 0.00 -1.12 -4.50 105.19 105.66 2frm n GLY 283 Ca -0.06 0.64 -0.10 0.00 0.00 0.00 0.00 46.02 46.50 2frm n GLY 283 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2frm s ILE 285 N 0.00 0.06 0.06 -0.61 -0.00 -1.01 -4.93 121.20 114.77 2frm s ILE 285 Ca 0.00 -1.40 -0.27 0.00 -0.00 0.00 0.00 60.65 58.98 2frm s ILE 285 Cb 0.00 -1.86 -0.05 0.00 -0.00 0.00 0.00 42.46 40.54 2frm s ILE 285 CO 0.00 -0.28 0.86 -0.31 -0.00 0.00 0.00 174.94 175.20 2frm s TYR 286 N -3.97 3.75 0.21 1.37 1.51 -1.26 -1.54 117.35 117.42 2frm s TYR 286 Ca 0.18 1.60 -0.22 0.00 -1.01 0.00 0.00 57.07 57.62 2frm s TYR 286 Cb 0.03 -2.94 0.05 0.00 -0.11 0.00 0.00 41.96 38.99 2frm s TYR 286 CO 0.00 0.21 0.65 0.00 -1.11 0.00 0.00 175.55 175.31 2frm s MET 287 N 0.11 1.50 -0.34 -0.62 0.23 -0.78 -4.89 119.30 114.52 2frm s MET 287 Ca 0.43 -0.70 -0.29 0.00 -1.03 0.00 0.00 55.69 54.10 2frm s MET 287 Cb -0.21 0.60 -0.01 0.00 -1.53 0.00 0.00 34.83 33.68 2frm s MET 287 CO 0.26 -0.67 1.56 0.20 -2.03 0.00 0.00 175.02 174.33 2frm s GLY 288 N -2.83 1.05 0.06 3.16 0.00 -0.94 -1.91 107.32 105.92 2frm s GLY 288 Ca 0.05 0.11 -0.04 0.00 0.00 0.00 0.00 44.72 44.85 2frm s GLY 288 CO -0.04 2.95 0.06 -1.34 0.00 0.00 0.00 173.10 174.73 2frm s VAL 289 N 5.74 0.18 -0.60 1.40 -7.23 -0.67 -1.25 120.40 117.98 2frm s VAL 289 Ca 0.68 -1.51 -0.27 0.00 -1.81 0.00 0.00 61.98 59.07 2frm s VAL 289 Cb -0.19 -1.40 0.04 0.00 0.56 0.00 0.00 36.38 35.39 2frm s VAL 289 CO 0.32 -0.84 1.12 -2.84 -0.31 0.00 0.00 175.10 172.55 2frm s PRO 290 N -3.80 3.40 0.41 4.82 0.02 -1.26 -1.41 135.00 137.18 2frm s PRO 290 Ca 0.05 -0.01 0.07 0.00 0.02 0.00 0.00 61.00 61.13 2frm s PRO 290 Cb 0.06 -4.06 0.01 0.00 0.02 0.00 0.00 34.50 30.53 2frm s PRO 290 CO -0.10 -1.70 0.56 0.95 -0.33 0.00 0.00 177.00 176.38 2frm s THR 291 N 4.74 3.24 -0.24 0.99 -4.23 -0.12 -0.37 115.64 119.65 2frm s THR 291 Ca 0.37 -0.97 -0.02 0.00 -1.18 0.00 0.00 61.69 59.89 2frm s THR 291 Cb -0.09 -3.10 0.02 0.00 1.34 0.00 0.00 72.50 70.67 2frm s THR 291 CO 0.21 -0.04 -0.06 -0.63 -0.54 0.00 0.00 174.62 173.56 2frm s ILE 292 N -2.34 2.92 -0.11 2.99 -1.09 -0.55 0.76 121.20 123.78 2frm s ILE 292 Ca 0.53 -0.96 -0.02 0.00 -2.23 0.00 0.00 60.65 57.97 2frm s ILE 292 Cb -0.10 -2.46 -0.03 0.00 -1.58 0.00 0.00 42.46 38.29 2frm s ILE 292 CO 0.33 0.23 -0.03 -0.63 -1.23 0.00 0.00 174.94 173.60 2frm s ILE 293 N 1.34 3.97 0.00 2.92 1.01 -0.31 -0.84 121.20 129.29 2frm s ILE 293 Ca 0.01 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.30 2frm s ILE 293 Cb -0.16 -2.68 0.00 0.00 0.01 0.00 0.00 42.46 39.63 2frm s ILE 293 CO -0.04 0.56 0.00 0.61 0.00 0.00 0.00 174.94 176.07 2frm n GLY 294 N 2.69 4.37 0.40 6.18 0.00 -0.42 -1.11 105.19 117.30 2frm n GLY 294 Ca -0.18 -1.28 0.21 0.00 0.00 0.00 0.00 46.02 44.77 2frm n GLY 294 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2frm h LYS 295 N 0.00 0.00 -0.48 1.61 2.10 -1.81 0.63 116.57 118.62 2frm h LYS 295 Ca 0.00 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.54 2frm h LYS 295 Cb 0.00 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 31.26 2frm h LYS 295 CO 0.00 0.00 0.09 -1.71 -2.00 0.00 0.00 179.45 175.83 2frm n ASN 296 N -3.58 4.15 0.00 7.07 4.05 -1.26 -5.03 115.26 120.65 2frm n ASN 296 Ca 0.08 -3.22 0.00 0.00 0.45 0.00 0.00 54.58 51.89 2frm n ASN 296 Cb 0.70 -0.65 0.00 0.00 1.23 0.00 0.00 39.78 41.06 2frm n ASN 296 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2frm n GLY 297 N -0.40 0.55 3.60 8.20 0.00 0.21 -4.62 105.19 112.73 2frm n GLY 297 Ca 0.31 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 45.14 2frm n GLY 297 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2frm s VAL 298 N 0.00 3.84 -0.52 1.61 1.01 -0.08 -1.30 120.40 124.96 2frm s VAL 298 Ca 0.00 0.84 0.22 0.00 0.00 0.00 0.00 61.98 63.04 2frm s VAL 298 Cb 0.00 -4.16 -0.25 0.00 0.00 0.00 0.00 36.38 31.97 2frm s VAL 298 CO 0.00 -0.76 0.76 -0.62 0.00 0.00 0.00 175.10 174.48 2frm n GLU 299 N 8.19 0.33 -3.69 2.72 1.02 -0.02 -4.81 120.64 124.38 2frm n GLU 299 Ca 0.17 -0.08 -0.00 0.00 -0.02 0.00 0.00 57.16 57.23 2frm n GLU 299 Cb 0.48 -1.53 -0.01 0.00 -0.02 0.00 0.00 31.44 30.36 2frm n GLU 299 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2frm s ASP 301 N -3.84 -0.10 -0.03 1.62 2.15 -1.22 -4.98 116.67 110.28 2frm s ASP 301 Ca 0.01 -0.26 0.01 0.00 0.43 0.00 0.00 52.55 52.74 2frm s ASP 301 Cb 0.15 0.30 0.02 0.00 -0.30 0.00 0.00 42.92 43.08 2frm s ASP 301 CO 0.87 -0.55 -0.03 -0.63 -0.17 0.00 0.00 175.17 174.65 2frm s ILE 302 N -2.74 0.40 0.07 4.11 1.01 -1.26 -1.49 121.20 121.30 2frm s ILE 302 Ca 0.14 -0.10 -0.21 0.00 0.00 0.00 0.00 60.65 60.49 2frm s ILE 302 Cb 0.02 -0.42 -0.07 0.00 0.01 0.00 0.00 42.46 42.01 2frm s ILE 302 CO -0.01 0.17 0.61 -0.76 0.00 0.00 0.00 174.94 174.95 2frm s LEU 303 N 0.62 4.51 -0.43 2.97 1.02 0.50 -5.01 118.68 122.86 2frm s LEU 303 Ca -0.07 1.31 -0.18 0.00 0.02 0.00 0.00 54.13 55.20 2frm s LEU 303 Cb -0.11 -2.97 0.03 0.00 0.02 0.00 0.00 46.19 43.16 2frm s LEU 303 CO -0.00 0.22 0.48 -1.61 0.02 0.00 0.00 176.35 175.46 2frm s GLU 304 N -0.88 3.12 0.41 1.70 0.41 -1.26 -4.42 118.70 117.77 2frm s GLU 304 Ca 0.31 -0.75 -0.19 0.00 -0.41 0.00 0.00 54.97 53.93 2frm s GLU 304 Cb -0.20 -3.99 -0.10 0.00 -1.78 0.00 0.00 34.13 28.06 2frm s GLU 304 CO 0.20 -0.92 0.91 -0.51 -0.49 0.00 0.00 175.26 174.45 2frm s LEU 305 N 2.26 3.95 -0.97 1.80 1.02 -1.26 -4.99 118.68 120.48 2frm s LEU 305 Ca 0.13 1.60 -0.19 0.00 0.02 0.00 0.00 54.13 55.69 2frm s LEU 305 Cb -0.17 -4.44 0.12 0.00 0.02 0.00 0.00 46.19 41.72 2frm s LEU 305 CO 0.14 -0.34 1.21 -1.81 0.02 0.00 0.00 176.35 175.57 2frm s ASP 306 N -2.24 6.64 0.47 2.29 -0.00 -1.26 -5.01 116.67 117.56 2frm s ASP 306 Ca 0.60 -2.03 -0.14 0.00 -0.00 0.00 0.00 52.55 50.98 2frm s ASP 306 Cb -0.09 -2.43 -0.07 0.00 -0.00 0.00 0.00 42.92 40.32 2frm s ASP 306 CO 0.15 -1.11 0.90 -0.76 -0.00 0.00 0.00 175.17 174.34 2frm s LEU 307 N 3.00 3.72 0.45 1.23 1.02 -1.26 -4.73 118.68 122.11 2frm s LEU 307 Ca 0.36 1.41 -0.02 0.00 0.02 0.00 0.00 54.13 55.90 2frm s LEU 307 Cb -0.04 -4.32 -0.02 0.00 0.02 0.00 0.00 46.19 41.83 2frm s LEU 307 CO -0.09 -0.50 0.70 0.42 0.02 0.00 0.00 176.35 176.91 2frm s THR 308 N -2.50 4.55 0.16 5.49 -4.23 -1.26 -4.84 115.64 113.01 2frm s THR 308 Ca 0.56 -0.20 -0.21 0.00 -1.18 0.00 0.00 61.69 60.66 2frm s THR 308 Cb -0.10 -3.70 0.07 0.00 1.34 0.00 0.00 72.50 70.11 2frm s THR 308 CO 0.30 -0.58 1.62 1.55 -0.54 0.00 0.00 174.62 176.97 2frm h PRO 309 N 0.36 -0.20 0.00 3.99 0.13 -1.99 0.28 132.00 134.58 2frm h PRO 309 Ca -0.47 0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2frm h PRO 309 Cb 1.23 0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.40 2frm h PRO 309 CO 0.60 -0.14 -0.01 1.25 -0.23 0.00 0.00 178.00 179.47 2frm h LEU 310 N -0.21 0.00 0.17 1.56 6.46 -1.99 -0.42 115.31 120.87 2frm h LEU 310 Ca 0.18 0.00 -0.31 0.00 -0.12 0.00 0.00 57.88 57.62 2frm h LEU 310 Cb 0.49 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.43 2frm h LEU 310 CO -0.49 0.01 -1.48 -0.33 -0.62 0.00 0.00 178.44 175.53 2frm h GLU 311 N 0.00 0.35 -0.27 1.25 5.08 -0.97 -2.45 114.58 117.58 2frm h GLU 311 Ca -0.00 -0.61 -0.08 0.00 -1.00 0.00 0.00 59.36 57.67 2frm h GLU 311 Cb 0.08 0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 2frm h GLU 311 CO 0.00 1.26 -0.19 1.96 -1.00 0.00 0.00 179.01 181.04 2frm h GLN 312 N 0.10 0.49 0.14 2.33 4.20 0.44 -0.14 115.11 122.67 2frm h GLN 312 Ca -0.24 -0.16 -0.01 0.00 0.06 0.00 0.00 58.65 58.30 2frm h GLN 312 Cb 2.06 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 29.80 2frm h GLN 312 CO 0.21 0.66 -0.07 -0.22 -0.67 0.00 0.00 178.83 178.74 2frm h LYS 313 N 0.44 -0.18 -0.66 1.46 3.64 -1.16 0.81 116.57 120.92 2frm h LYS 313 Ca 0.07 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.53 2frm h LYS 313 Cb 0.59 0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.39 2frm h LYS 313 CO 0.04 0.16 0.36 -0.07 -2.27 0.00 0.00 179.45 177.66 2frm h LEU 314 N -0.53 0.52 -0.91 5.20 3.38 -1.31 -0.89 115.31 120.77 2frm h LEU 314 Ca -0.02 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 2frm h LEU 314 Cb 0.42 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 2frm h LEU 314 CO 0.03 0.33 0.33 0.25 0.09 0.00 0.00 178.44 179.47 2frm h LEU 315 N 0.66 1.02 -0.37 1.67 5.85 -0.91 -2.48 115.31 120.75 2frm h LEU 315 Ca 0.30 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.89 2frm h LEU 315 Cb 0.21 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 2frm h LEU 315 CO -0.19 0.89 0.24 1.23 -0.34 0.00 0.00 178.44 180.27 2frm h GLY 316 N 1.13 0.52 0.92 3.75 0.00 0.48 -1.53 103.07 108.34 2frm h GLY 316 Ca 0.26 -0.19 0.03 0.00 0.00 0.00 0.00 47.33 47.43 2frm h GLY 316 CO -0.03 0.18 0.65 0.83 0.00 0.00 0.00 176.54 178.17 2frm h GLU 317 N 0.49 1.23 -0.61 4.80 5.08 -1.02 -0.49 114.58 124.06 2frm h GLU 317 Ca 0.14 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.35 2frm h GLU 317 Cb -0.05 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 28.90 2frm h GLU 317 CO -0.04 0.81 0.08 1.03 -1.00 0.00 0.00 179.01 179.89 2frm h SER 318 N 1.26 0.96 -0.24 1.42 0.87 -0.98 -0.71 113.55 116.13 2frm h SER 318 Ca 0.39 -0.23 -0.06 0.00 -1.23 0.00 0.00 61.79 60.66 2frm h SER 318 Cb -0.02 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.68 2frm h SER 318 CO -0.11 0.97 -0.10 0.40 -0.53 0.00 0.00 176.83 177.46 2frm h ILE 319 N 0.94 1.30 -0.20 2.23 2.04 -0.66 -2.20 117.51 120.95 2frm h ILE 319 Ca 0.18 -1.15 0.03 0.00 1.00 0.00 0.00 64.86 64.92 2frm h ILE 319 Cb 0.44 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 38.04 2frm h ILE 319 CO 0.01 0.36 0.02 -1.13 0.00 0.00 0.00 178.15 177.41 2frm h ASN 320 N 0.21 -0.03 -0.41 1.72 -1.24 -0.88 0.24 115.58 115.19 2frm h ASN 320 Ca 0.06 0.04 0.05 0.00 0.71 0.00 0.00 56.30 57.16 2frm h ASN 320 Cb 0.59 0.06 -0.05 0.00 0.73 0.00 0.00 38.32 39.65 2frm h ASN 320 CO 0.03 0.01 0.13 -0.08 -1.29 0.00 0.00 177.43 176.23 2frm h GLU 321 N 0.09 0.28 -0.67 6.67 4.81 -1.10 0.15 114.58 124.82 2frm h GLU 321 Ca 0.09 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.27 2frm h GLU 321 Cb 0.10 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 2frm h GLU 321 CO -0.14 0.18 0.27 0.28 -0.73 0.00 0.00 179.01 178.87 2frm h VAL 322 N 0.28 1.24 -0.40 0.32 2.07 -0.94 -1.51 116.25 117.31 2frm h VAL 322 Ca 0.19 -0.75 -0.03 0.00 0.82 0.00 0.00 66.70 66.94 2frm h VAL 322 Cb 0.20 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 2frm h VAL 322 CO -0.21 0.30 0.12 -1.13 0.02 0.00 0.00 177.57 176.67 2frm h ASN 323 N 0.95 0.58 -0.01 0.57 -1.24 0.32 -2.71 115.58 114.03 2frm h ASN 323 Ca 0.22 -0.20 -0.02 0.00 0.71 0.00 0.00 56.30 57.01 2frm h ASN 323 Cb 0.20 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 39.10 2frm h ASN 323 CO -0.02 0.63 -0.06 0.71 -1.29 0.00 0.00 177.43 177.40 2frm h THR 324 N 0.50 1.50 -0.12 -3.57 1.35 -0.62 -3.21 112.91 108.73 2frm h THR 324 Ca 0.13 -1.55 0.04 0.00 -0.55 0.00 0.00 66.41 64.47 2frm h THR 324 Cb 0.26 2.51 -0.00 0.00 -1.73 0.00 0.00 68.15 69.18 2frm h THR 324 CO -0.00 0.41 0.11 0.40 -0.25 0.00 0.00 175.52 176.19 2frm h ILE 325 N -0.56 0.68 -0.11 6.82 2.04 -1.36 -1.00 117.51 124.04 2frm h ILE 325 Ca -0.00 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.74 2frm h ILE 325 Cb 0.70 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.69 2frm h ILE 325 CO 0.01 0.00 -0.43 0.28 0.00 0.00 0.00 178.15 178.01 2frm h SER 326 N 0.00 0.26 0.27 1.72 0.02 -1.48 -3.02 113.55 111.31 2frm h SER 326 Ca 0.06 -0.11 -0.11 0.00 -0.84 0.00 0.00 61.79 60.79 2frm h SER 326 Cb 0.28 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 2frm h SER 326 CO -0.00 0.67 -0.43 0.11 -1.14 0.00 0.00 176.83 176.04 2frm h LYS 327 N 0.20 0.21 -0.81 3.45 1.57 -1.19 -2.80 116.57 117.20 2frm h LYS 327 Ca 0.02 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2frm h LYS 327 Cb 0.86 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.16 2frm h LYS 327 CO 0.07 0.60 0.00 1.33 -0.57 0.00 0.00 179.45 180.88 2frm n VAL 328 N -4.01 1.09 -0.12 0.50 0.24 -1.14 -5.15 118.33 109.73 2frm n VAL 328 Ca -0.02 -0.56 0.00 0.00 -2.04 0.00 0.00 64.34 61.72 2frm n VAL 328 Cb 0.49 -0.39 0.00 0.00 -1.47 0.00 0.00 33.84 32.46 2frm n VAL 328 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58