#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fse n PRO 5 N 0.00 0.21 -2.19 5.56 -0.02 -1.26 -5.08 135.00 132.23 2fse n PRO 5 Ca 0.00 0.15 -0.04 0.00 -2.02 0.00 0.00 63.50 61.59 2fse n PRO 5 Cb 0.00 -1.72 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 2fse n PRO 5 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2fse n ARG 6 N -2.08 -2.89 -3.80 -0.52 5.12 -1.26 -5.02 116.66 106.21 2fse n ARG 6 Ca 0.05 2.36 -0.37 0.00 -1.93 0.00 0.00 57.85 57.97 2fse n ARG 6 Cb 0.41 -3.58 -0.13 0.00 -1.16 0.00 0.00 32.46 28.01 2fse n ARG 6 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 2fse s PHE 7 N -0.44 3.29 0.24 -1.55 0.08 -1.26 -5.11 117.98 113.23 2fse s PHE 7 Ca -0.18 -1.68 0.01 0.00 0.12 0.00 0.00 56.93 55.20 2fse s PHE 7 Cb 0.01 -2.34 -0.04 0.00 -0.57 0.00 0.00 43.02 40.08 2fse s PHE 7 CO 0.50 -0.78 0.41 -1.17 -0.10 0.00 0.00 175.22 174.08 2fse s LEU 8 N 1.33 4.21 -0.30 -0.37 2.96 -1.26 -5.10 118.68 120.14 2fse s LEU 8 Ca -0.02 0.33 -0.03 0.00 -0.22 0.00 0.00 54.13 54.19 2fse s LEU 8 Cb -0.20 -3.12 0.11 0.00 0.50 0.00 0.00 46.19 43.48 2fse s LEU 8 CO 0.01 -0.10 0.15 0.86 -1.32 0.00 0.00 176.35 175.95 2fse s TRP 9 N -1.98 0.41 0.07 5.38 -0.00 -1.19 -4.02 118.94 117.60 2fse s TRP 9 Ca 0.38 -1.05 -0.16 0.00 -0.00 0.00 0.00 56.10 55.27 2fse s TRP 9 Cb -0.10 -0.90 -0.06 0.00 -0.00 0.00 0.00 33.47 32.40 2fse s TRP 9 CO 0.30 -0.83 0.51 -0.65 -0.00 0.00 0.00 176.95 176.28 2fse s GLN 10 N 1.87 4.02 -0.02 5.86 -0.21 0.16 -4.98 119.66 126.37 2fse s GLN 10 Ca 0.11 0.53 0.01 0.00 0.02 0.00 0.00 55.36 56.04 2fse s GLN 10 Cb -0.18 -3.13 0.01 0.00 1.00 0.00 0.00 33.01 30.72 2fse s GLN 10 CO -0.28 0.60 -0.03 -1.17 -2.12 0.00 0.00 175.29 172.29 2fse s LEU 11 N -1.41 1.59 -0.05 2.90 2.96 -1.26 0.09 118.68 123.50 2fse s LEU 11 Ca 0.30 -0.08 0.00 0.00 -0.22 0.00 0.00 54.13 54.14 2fse s LEU 11 Cb -0.17 -0.28 0.02 0.00 0.50 0.00 0.00 46.19 46.26 2fse s LEU 11 CO 0.17 -0.02 -0.03 -0.54 -1.32 0.00 0.00 176.35 174.62 2fse s LYS 12 N 0.47 0.72 -0.46 1.98 1.02 -0.78 -5.01 119.74 117.68 2fse s LYS 12 Ca -0.05 -0.03 -0.02 0.00 0.02 0.00 0.00 55.97 55.89 2fse s LYS 12 Cb -0.09 -0.86 0.12 0.00 -0.52 0.00 0.00 37.83 36.49 2fse s LYS 12 CO -0.01 -0.16 0.26 -0.06 -0.92 0.00 0.00 175.35 174.46 2fse s PHE 13 N 1.26 3.54 0.00 3.18 0.40 -1.26 -0.87 117.98 124.23 2fse s PHE 13 Ca -0.06 -2.58 0.04 0.00 -0.60 0.00 0.00 56.93 53.74 2fse s PHE 13 Cb -0.14 -3.18 -0.03 0.00 0.51 0.00 0.00 43.02 40.18 2fse s PHE 13 CO -0.02 -0.93 -0.09 -1.83 0.70 0.00 0.00 175.22 173.05 2fse s GLU 14 N 0.75 2.47 -0.11 0.44 -1.05 -0.08 -4.99 118.70 116.13 2fse s GLU 14 Ca 0.11 -0.76 0.03 0.00 -0.15 0.00 0.00 54.97 54.20 2fse s GLU 14 Cb -0.22 -2.44 -0.00 0.00 -0.44 0.00 0.00 34.13 31.03 2fse s GLU 14 CO -0.04 0.60 -0.21 0.00 0.95 0.00 0.00 175.26 176.56 2fse s HIS 16 N 0.43 2.79 -0.07 0.00 3.76 -0.86 -4.97 115.29 116.37 2fse s HIS 16 Ca -0.15 -0.49 0.04 0.00 -0.15 0.00 0.00 55.06 54.30 2fse s HIS 16 Cb -0.17 -1.79 0.00 0.00 1.11 0.00 0.00 32.58 31.73 2fse s HIS 16 CO 0.06 -0.09 -0.19 -0.06 -0.85 0.00 0.00 174.74 173.61 2fse s PHE 17 N 0.05 2.03 -0.05 1.40 0.08 -1.26 -1.56 117.98 118.66 2fse s PHE 17 Ca -0.05 -0.74 0.06 0.00 0.12 0.00 0.00 56.93 56.33 2fse s PHE 17 Cb -0.14 -1.38 -0.01 0.00 -0.57 0.00 0.00 43.02 40.91 2fse s PHE 17 CO 0.04 -0.30 -0.24 -0.06 -0.10 0.00 0.00 175.22 174.56 2fse s PHE 18 N 0.32 2.35 -1.22 0.36 0.40 -0.23 -4.69 117.98 115.27 2fse s PHE 18 Ca -0.13 -0.66 -0.02 0.00 -0.60 0.00 0.00 56.93 55.52 2fse s PHE 18 Cb -0.16 -1.54 -0.01 0.00 0.51 0.00 0.00 43.02 41.83 2fse s PHE 18 CO 0.05 -0.19 0.83 0.09 0.70 0.00 0.00 175.22 176.71 2fse n ASN 19 N 2.89 -2.51 0.00 1.36 5.03 -1.26 -2.56 115.26 118.21 2fse n ASN 19 Ca -0.17 -0.76 0.00 0.00 0.87 0.00 0.00 54.58 54.52 2fse n ASN 19 Cb 0.52 -4.50 0.00 0.00 -1.02 0.00 0.00 39.78 34.78 2fse n ASN 19 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2fse n GLY 20 N -1.39 1.82 0.08 7.41 0.00 -1.26 -2.82 105.19 109.02 2fse n GLY 20 Ca -0.25 -0.23 0.01 0.00 0.00 0.00 0.00 46.02 45.56 2fse n GLY 20 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fse n THR 21 N 0.00 0.55 -0.13 2.61 -2.24 -1.26 -4.70 114.28 109.11 2fse n THR 21 Ca 0.00 -0.60 -0.04 0.00 -2.27 0.00 0.00 64.05 61.14 2fse n THR 21 Cb 0.00 0.62 0.04 0.00 -2.10 0.00 0.00 70.33 68.89 2fse n THR 21 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2fse h GLU 22 N 0.00 0.24 -5.13 -0.78 4.81 -1.51 -3.39 114.58 108.82 2fse h GLU 22 Ca 0.00 -0.01 -0.65 0.00 -0.13 0.00 0.00 59.36 58.57 2fse h GLU 22 Cb 0.89 -0.05 -0.34 0.00 0.63 0.00 0.00 28.75 29.89 2fse h GLU 22 CO 0.00 0.16 -0.86 0.50 -0.73 0.00 0.00 179.01 178.07 2fse s ARG 23 N -6.15 2.78 0.12 1.92 3.00 -1.06 -5.03 118.95 114.53 2fse s ARG 23 Ca -0.13 -0.78 0.05 0.00 -1.00 0.00 0.00 55.73 53.87 2fse s ARG 23 Cb 0.14 -2.19 -0.04 0.00 0.00 0.00 0.00 34.95 32.86 2fse s ARG 23 CO 0.72 0.07 -0.12 0.08 0.00 0.00 0.00 175.30 176.05 2fse s VAL 24 N 0.61 1.14 -0.23 7.11 1.01 -1.26 -1.06 120.40 127.72 2fse s VAL 24 Ca -0.13 -1.75 -0.03 0.00 0.00 0.00 0.00 61.98 60.06 2fse s VAL 24 Cb -0.17 -1.52 0.11 0.00 0.00 0.00 0.00 36.38 34.80 2fse s VAL 24 CO 0.04 -0.54 0.27 -0.60 0.00 0.00 0.00 175.10 174.27 2fse s ARG 25 N -2.93 0.25 0.04 2.72 3.52 -0.60 -4.98 118.95 116.97 2fse s ARG 25 Ca 0.09 0.22 -0.23 0.00 -0.13 0.00 0.00 55.73 55.68 2fse s ARG 25 Cb -0.03 -0.96 -0.06 0.00 -1.56 0.00 0.00 34.95 32.35 2fse s ARG 25 CO 0.01 -0.71 0.70 -1.17 -0.81 0.00 0.00 175.30 173.32 2fse s LEU 26 N 2.38 4.46 -0.11 -0.88 2.96 -1.26 -2.03 118.68 124.20 2fse s LEU 26 Ca 0.09 1.36 -0.02 0.00 -0.22 0.00 0.00 54.13 55.34 2fse s LEU 26 Cb -0.15 -3.12 0.04 0.00 0.50 0.00 0.00 46.19 43.45 2fse s LEU 26 CO -0.16 0.08 0.00 -0.76 -1.32 0.00 0.00 176.35 174.18 2fse s LEU 27 N -0.26 0.80 -0.20 -0.68 1.02 -0.29 -0.48 118.68 118.58 2fse s LEU 27 Ca 0.35 -0.29 -0.04 0.00 0.02 0.00 0.00 54.13 54.18 2fse s LEU 27 Cb -0.20 -0.52 -0.01 0.00 0.02 0.00 0.00 46.19 45.47 2fse s LEU 27 CO 0.21 -0.21 -0.04 -0.70 0.02 0.00 0.00 176.35 175.63 2fse s GLU 28 N 1.92 3.47 -0.05 1.70 2.12 -1.14 -0.90 118.70 125.81 2fse s GLU 28 Ca 0.04 -0.59 0.01 0.00 0.36 0.00 0.00 54.97 54.78 2fse s GLU 28 Cb -0.13 -2.99 0.02 0.00 0.26 0.00 0.00 34.13 31.28 2fse s GLU 28 CO -0.06 -0.08 -0.05 -0.98 -0.54 0.00 0.00 175.26 173.55 2fse s ARG 29 N 1.18 0.89 -0.30 4.30 1.70 -0.05 -0.49 118.95 126.19 2fse s ARG 29 Ca 0.02 -0.11 -0.13 0.00 -0.47 0.00 0.00 55.73 55.04 2fse s ARG 29 Cb -0.14 -0.92 -0.03 0.00 -0.57 0.00 0.00 34.95 33.29 2fse s ARG 29 CO -0.00 -0.10 0.29 0.00 -1.08 0.00 0.00 175.30 174.41 2fse s ILE 31 N 1.92 3.26 0.00 0.00 1.01 0.11 -0.34 121.20 127.17 2fse s ILE 31 Ca 0.11 -0.56 0.00 0.00 0.00 0.00 0.00 60.65 60.19 2fse s ILE 31 Cb -0.16 -2.43 0.00 0.00 0.01 0.00 0.00 42.46 39.88 2fse s ILE 31 CO 0.11 0.48 0.00 0.00 0.00 0.00 0.00 174.94 175.53 2fse n TYR 32 N 4.06 0.00 0.00 3.97 9.36 0.23 0.41 117.16 135.19 2fse n TYR 32 Ca -0.18 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.04 2fse n TYR 32 Cb 0.52 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.23 2fse n TYR 32 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 2fse n ASN 33 N 0.00 0.00 -0.18 2.98 3.02 -1.26 -3.20 115.26 116.62 2fse n ASN 33 Ca 0.00 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.60 2fse n ASN 33 Cb 0.00 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.16 2fse n ASN 33 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2fse n GLN 34 N 0.00 2.39 -3.20 3.52 3.00 -1.26 -4.63 117.38 117.20 2fse n GLN 34 Ca 0.00 -0.50 -0.40 0.00 -0.01 0.00 0.00 57.00 56.09 2fse n GLN 34 Cb 0.00 -1.05 -0.07 0.00 0.00 0.00 0.00 30.24 29.12 2fse n GLN 34 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 2fse s GLU 35 N -1.40 4.13 -0.22 -1.09 2.12 -1.26 -5.05 118.70 115.92 2fse s GLU 35 Ca 0.07 0.42 -0.28 0.00 0.36 0.00 0.00 54.97 55.54 2fse s GLU 35 Cb 0.08 -3.62 0.01 0.00 0.26 0.00 0.00 34.13 30.86 2fse s GLU 35 CO 0.26 -0.29 1.00 -2.00 -0.54 0.00 0.00 175.26 173.69 2fse s GLU 36 N 2.09 4.26 -0.17 4.30 2.12 -1.26 0.77 118.70 130.81 2fse s GLU 36 Ca 0.24 1.29 -0.15 0.00 0.36 0.00 0.00 54.97 56.71 2fse s GLU 36 Cb -0.16 -3.63 -0.11 0.00 0.26 0.00 0.00 34.13 30.50 2fse s GLU 36 CO 0.09 -0.58 0.01 -1.13 -0.54 0.00 0.00 175.26 173.11 2fse n SER 37 N 6.13 1.83 -4.63 -1.70 3.41 0.54 -4.39 113.62 114.81 2fse n SER 37 Ca 0.11 0.54 -0.27 0.00 -0.26 0.00 0.00 58.87 58.99 2fse n SER 37 Cb 0.47 -0.92 -0.10 0.00 -0.26 0.00 0.00 64.21 63.40 2fse n SER 37 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2fse s VAL 38 N -2.30 2.19 -0.20 -3.33 1.01 -1.08 -0.54 120.40 116.15 2fse s VAL 38 Ca -0.22 -1.97 -0.31 0.00 0.00 0.00 0.00 61.98 59.48 2fse s VAL 38 Cb 0.04 -2.91 0.15 0.00 0.00 0.00 0.00 36.38 33.66 2fse s VAL 38 CO 0.40 -0.06 1.17 0.00 0.00 0.00 0.00 175.10 176.60 2fse s ARG 39 N -3.73 0.35 -0.39 2.72 1.70 -1.20 -1.47 118.95 116.93 2fse s ARG 39 Ca 0.36 -0.00 0.02 0.00 -0.47 0.00 0.00 55.73 55.64 2fse s ARG 39 Cb 0.06 0.16 0.11 0.00 -0.57 0.00 0.00 34.95 34.72 2fse s ARG 39 CO 0.19 -0.13 0.15 0.12 -1.08 0.00 0.00 175.30 174.55 2fse s PHE 40 N -1.60 2.62 -0.16 5.89 2.19 0.36 -1.56 117.98 125.71 2fse s PHE 40 Ca 0.05 -2.52 -0.27 0.00 0.33 0.00 0.00 56.93 54.52 2fse s PHE 40 Cb -0.01 -2.30 -0.01 0.00 -1.31 0.00 0.00 43.02 39.40 2fse s PHE 40 CO -0.04 -0.85 0.92 0.34 1.83 0.00 0.00 175.22 177.42 2fse s ASP 41 N 0.76 7.06 0.23 6.13 -1.08 -1.25 -2.89 116.67 125.64 2fse s ASP 41 Ca 0.13 1.31 -0.10 0.00 -0.52 0.00 0.00 52.55 53.37 2fse s ASP 41 Cb -0.21 -2.50 0.34 0.00 -1.46 0.00 0.00 42.92 39.09 2fse s ASP 41 CO -0.09 -0.46 1.62 -1.28 0.52 0.00 0.00 175.17 175.47 2fse h SER 42 N 7.29 -0.55 -0.07 -0.34 0.87 -1.13 0.09 113.55 119.71 2fse h SER 42 Ca -0.28 0.21 -0.03 0.00 -1.23 0.00 0.00 61.79 60.46 2fse h SER 42 Cb 1.12 0.41 -0.01 0.00 -0.44 0.00 0.00 62.40 63.48 2fse h SER 42 CO 0.87 -0.22 -0.02 0.44 -0.53 0.00 0.00 176.83 177.37 2fse h ASP 43 N 0.03 0.22 0.11 6.23 3.32 -1.92 -3.02 116.42 121.39 2fse h ASP 43 Ca 0.37 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.39 2fse h ASP 43 Cb 0.60 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.09 2fse h ASP 43 CO -0.71 0.28 -0.06 0.58 -1.72 0.00 0.00 179.24 177.62 2fse h VAL 44 N 0.24 1.07 0.00 -1.35 2.07 -1.41 -3.48 116.25 113.40 2fse h VAL 44 Ca 0.06 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.43 2fse h VAL 44 Cb 0.20 1.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.72 2fse h VAL 44 CO 0.01 0.26 0.00 0.61 0.02 0.00 0.00 177.57 178.46 2fse n GLY 45 N 0.42 2.78 0.87 2.17 0.00 -0.75 -5.06 105.19 105.63 2fse n GLY 45 Ca -0.08 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.88 2fse n GLY 45 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2fse n GLU 46 N -0.89 0.18 -2.95 1.61 0.28 -1.26 -4.89 120.64 112.72 2fse n GLU 46 Ca 0.00 -0.90 -0.31 0.00 -0.16 0.00 0.00 57.16 55.79 2fse n GLU 46 Cb 0.00 0.71 -0.04 0.00 1.43 0.00 0.00 31.44 33.55 2fse n GLU 46 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 2fse s TYR 47 N -2.33 3.45 -0.14 -1.84 2.02 -1.26 -3.87 117.35 113.38 2fse s TYR 47 Ca 0.10 1.06 -0.06 0.00 -0.37 0.00 0.00 57.07 57.80 2fse s TYR 47 Cb 0.00 -2.44 0.06 0.00 -0.40 0.00 0.00 41.96 39.19 2fse s TYR 47 CO 0.07 -0.04 0.31 1.03 -1.57 0.00 0.00 175.55 175.35 2fse s ARG 48 N -3.64 0.24 0.49 -0.62 1.81 -0.60 -5.00 118.95 111.63 2fse s ARG 48 Ca 0.51 0.75 -0.22 0.00 -1.72 0.00 0.00 55.73 55.05 2fse s ARG 48 Cb -0.10 0.01 -0.07 0.00 -0.45 0.00 0.00 34.95 34.33 2fse s ARG 48 CO 0.28 -0.22 1.14 0.00 -0.68 0.00 0.00 175.30 175.82 2fse s ALA 49 N 1.96 2.87 -0.10 2.13 0.00 -1.26 -3.23 121.76 124.12 2fse s ALA 49 Ca -0.04 0.87 0.11 0.00 0.00 0.00 0.00 51.96 52.89 2fse s ALA 49 Cb -0.11 -3.36 -0.15 0.00 0.00 0.00 0.00 23.12 19.50 2fse s ALA 49 CO -0.10 -0.66 0.06 0.28 0.00 0.00 0.00 175.76 175.35 2fse n VAL 50 N -0.79 0.72 -4.15 0.00 0.31 0.30 -4.98 118.33 109.74 2fse n VAL 50 Ca 0.09 -0.47 -0.10 0.00 -0.01 0.00 0.00 64.34 63.84 2fse n VAL 50 Cb 0.49 -0.60 -0.10 0.00 -0.91 0.00 0.00 33.84 32.72 2fse n VAL 50 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2fse s THR 51 N -2.34 0.62 0.48 2.52 -4.23 -1.20 -5.01 115.64 106.48 2fse s THR 51 Ca -0.06 -1.82 0.28 0.00 -1.18 0.00 0.00 61.69 58.91 2fse s THR 51 Cb 0.04 -1.54 0.47 0.00 1.34 0.00 0.00 72.50 72.81 2fse s THR 51 CO 0.48 -0.83 1.80 -0.33 -0.54 0.00 0.00 174.62 175.19 2fse h GLU 52 N 3.17 0.17 -0.11 3.99 4.39 -1.94 0.15 114.58 124.39 2fse h GLU 52 Ca -0.35 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.37 2fse h GLU 52 Cb 1.17 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.77 2fse h GLU 52 CO 0.62 0.11 0.13 -0.07 -1.16 0.00 0.00 179.01 178.64 2fse h LEU 53 N 0.18 0.00 -0.19 1.33 3.38 -1.95 -2.16 115.31 115.91 2fse h LEU 53 Ca 0.57 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.54 2fse h LEU 53 Cb 1.86 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.61 2fse h LEU 53 CO -0.14 0.00 -0.60 0.61 0.09 0.00 0.00 178.44 178.40 2fse n GLY 54 N -1.37 -0.94 0.31 0.83 0.00 0.53 -4.48 105.19 100.07 2fse n GLY 54 Ca -0.00 -0.46 0.02 0.00 0.00 0.00 0.00 46.02 45.57 2fse n GLY 54 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2fse h ARG 55 N 0.46 -0.02 0.36 1.61 2.47 -1.43 0.24 114.38 118.07 2fse h ARG 55 Ca 0.00 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.70 2fse h ARG 55 Cb 0.53 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.85 2fse h ARG 55 CO 0.00 -0.01 -0.19 -1.35 0.56 0.00 0.00 179.97 178.97 2fse h PRO 56 N -0.02 -0.49 -0.31 0.04 0.11 -1.80 -0.98 132.00 128.54 2fse h PRO 56 Ca 0.37 0.03 0.09 0.00 0.11 0.00 0.00 66.00 66.61 2fse h PRO 56 Cb 0.60 0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.81 2fse h PRO 56 CO -0.84 -0.33 0.42 -0.44 -0.21 0.00 0.00 178.00 176.61 2fse h ASP 57 N -0.51 0.00 0.11 -2.05 3.45 -1.76 0.26 116.42 115.91 2fse h ASP 57 Ca -0.05 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.41 2fse h ASP 57 Cb 0.40 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.17 2fse h ASP 57 CO 0.07 0.00 -0.05 0.00 -1.57 0.00 0.00 179.24 177.69 2fse h ALA 58 N 1.44 -0.59 -0.62 3.45 0.00 -0.09 -2.53 119.26 120.31 2fse h ALA 58 Ca 0.15 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2fse h ALA 58 Cb 0.99 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2fse h ALA 58 CO -0.00 -0.58 0.41 0.93 0.00 0.00 0.00 179.25 180.00 2fse h GLU 59 N -0.24 0.78 0.55 0.00 3.07 -0.56 -1.72 114.58 116.46 2fse h GLU 59 Ca -0.02 -0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 58.77 2fse h GLU 59 Cb 0.11 -0.18 0.01 0.00 -0.84 0.00 0.00 28.75 27.85 2fse h GLU 59 CO 0.02 0.51 -0.27 -0.92 -1.40 0.00 0.00 179.01 176.96 2fse h TYR 60 N 0.80 -0.69 0.18 4.33 3.20 -0.62 -3.22 116.97 120.95 2fse h TYR 60 Ca 0.23 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 2fse h TYR 60 Cb -0.04 0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.45 2fse h TYR 60 CO -0.00 -0.38 -0.10 -1.49 -1.64 0.00 0.00 178.16 174.55 2fse h TRP 61 N -0.87 -0.26 -0.80 -3.82 6.55 -1.31 -2.32 115.95 113.12 2fse h TRP 61 Ca -0.08 -0.00 0.23 0.00 0.95 0.00 0.00 58.89 59.99 2fse h TRP 61 Cb 0.62 0.09 -0.03 0.00 -0.86 0.00 0.00 29.16 28.98 2fse h TRP 61 CO -0.01 -0.16 1.08 -0.91 -1.05 0.00 0.00 178.44 177.39 2fse h ASN 62 N -0.27 0.00 0.60 -3.49 2.35 -1.36 0.23 115.58 113.64 2fse h ASN 62 Ca -0.02 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.47 2fse h ASN 62 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 2fse h ASN 62 CO 0.03 0.00 -1.18 0.77 -1.65 0.00 0.00 177.43 175.40 2fse h SER 63 N 0.00 0.42 -2.94 5.81 4.64 -1.42 -3.43 113.55 116.63 2fse h SER 63 Ca 0.38 -0.43 -0.57 0.00 -0.47 0.00 0.00 61.79 60.70 2fse h SER 63 Cb 2.54 -0.13 -0.04 0.00 -0.31 0.00 0.00 62.40 64.46 2fse h SER 63 CO -0.00 1.31 1.14 -1.10 -0.87 0.00 0.00 176.83 177.31 2fse s GLN 64 N -2.76 3.60 -0.01 4.77 -0.21 0.80 -4.90 119.66 120.95 2fse s GLN 64 Ca -0.04 1.32 -0.24 0.00 0.02 0.00 0.00 55.36 56.42 2fse s GLN 64 Cb 0.07 -4.06 -0.17 0.00 1.00 0.00 0.00 33.01 29.85 2fse s GLN 64 CO 0.88 -1.53 1.14 0.87 -2.12 0.00 0.00 175.29 174.53 2fse h LYS 65 N 11.21 -0.27 -0.03 2.91 1.57 -1.84 -2.87 116.57 127.24 2fse h LYS 65 Ca -0.31 0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.50 2fse h LYS 65 Cb 1.14 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.51 2fse h LYS 65 CO 1.04 0.10 0.12 0.38 -0.57 0.00 0.00 179.45 180.52 2fse h ASP 66 N -0.73 0.00 0.07 0.86 2.03 -1.98 -0.84 116.42 115.83 2fse h ASP 66 Ca -0.03 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.27 2fse h ASP 66 Cb 0.50 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.00 2fse h ASP 66 CO 0.05 0.00 -0.04 0.25 -1.03 0.00 0.00 179.24 178.47 2fse h LEU 67 N 0.00 -0.08 -1.98 0.15 5.85 -1.90 -2.99 115.31 114.35 2fse h LEU 67 Ca 0.01 -0.39 -0.02 0.00 0.84 0.00 0.00 57.88 58.32 2fse h LEU 67 Cb 0.26 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 2fse h LEU 67 CO -0.00 0.36 -0.10 -0.07 -0.34 0.00 0.00 178.44 178.29 2fse h LEU 68 N -0.55 0.00 0.19 2.25 3.38 -0.95 -2.79 115.31 116.84 2fse h LEU 68 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2fse h LEU 68 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2fse h LEU 68 CO 0.02 0.10 -0.09 -0.33 0.09 0.00 0.00 178.44 178.23 2fse h GLU 69 N 0.00 -0.25 -1.09 1.13 4.39 -1.35 0.62 114.58 118.04 2fse h GLU 69 Ca -0.00 0.02 0.30 0.00 0.34 0.00 0.00 59.36 60.02 2fse h GLU 69 Cb 0.26 0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 28.90 2fse h GLU 69 CO 0.01 0.05 0.75 0.37 -1.16 0.00 0.00 179.01 179.04 2fse h GLN 70 N -0.55 0.14 0.06 2.33 4.15 -1.35 -0.03 115.11 119.87 2fse h GLN 70 Ca -0.03 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.38 2fse h GLN 70 Cb 0.41 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.07 2fse h GLN 70 CO 0.04 0.09 -0.03 0.00 -1.93 0.00 0.00 178.83 177.01 2fse h ARG 71 N 0.15 -0.08 0.00 1.69 2.47 -1.36 0.18 114.38 117.42 2fse h ARG 71 Ca 0.56 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 59.28 2fse h ARG 71 Cb 1.90 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 30.24 2fse h ARG 71 CO -0.12 0.37 0.02 0.00 0.56 0.00 0.00 179.97 180.80 2fse h ARG 72 N -0.97 0.00 0.00 0.04 3.08 -0.11 0.19 114.38 116.61 2fse h ARG 72 Ca -0.01 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.84 2fse h ARG 72 Cb 0.48 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.49 2fse h ARG 72 CO 0.01 0.00 -2.16 0.00 -1.07 0.00 0.00 179.97 176.75 2fse n ALA 73 N -1.88 2.08 -0.31 0.04 0.00 -0.10 -4.42 120.51 115.93 2fse n ALA 73 Ca -0.02 -0.94 0.17 0.00 0.00 0.00 0.00 53.44 52.64 2fse n ALA 73 Cb 0.06 -0.47 0.35 0.00 0.00 0.00 0.00 19.45 19.39 2fse n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fse h ALA 74 N 1.45 1.49 -0.37 0.00 0.00 0.15 1.35 119.26 123.33 2fse h ALA 74 Ca -0.29 0.22 0.11 0.00 0.00 0.00 0.00 54.91 54.94 2fse h ALA 74 Cb 1.68 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.74 2fse h ALA 74 CO 0.02 -0.51 0.47 -0.24 0.00 0.00 0.00 179.25 178.99 2fse h VAL 75 N 0.23 0.29 0.00 0.00 3.04 -1.77 0.76 116.25 118.80 2fse h VAL 75 Ca 0.61 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 66.30 2fse h VAL 75 Cb 1.30 0.61 0.00 0.00 -2.01 0.00 0.00 31.29 31.19 2fse h VAL 75 CO -0.66 0.00 0.00 0.47 -1.01 0.00 0.00 177.57 176.37 2fse n ASP 76 N -3.53 0.00 0.00 3.17 8.00 0.45 -3.16 116.55 121.48 2fse n ASP 76 Ca 0.06 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.56 2fse n ASP 76 Cb 0.63 -0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.47 2fse n ASP 76 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2fse n THR 77 N -2.03 0.70 0.00 -3.53 -2.24 -0.35 -2.62 114.28 104.22 2fse n THR 77 Ca 0.00 0.25 0.00 0.00 -2.27 0.00 0.00 64.05 62.03 2fse n THR 77 Cb 0.00 -1.25 0.00 0.00 -2.10 0.00 0.00 70.33 66.98 2fse n THR 77 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fse n TYR 78 N -1.10 0.00 -0.30 4.78 9.36 0.15 -4.55 117.16 125.50 2fse n TYR 78 Ca 0.00 0.00 0.05 0.00 3.32 0.00 0.00 57.90 61.27 2fse n TYR 78 Cb 0.07 0.06 0.15 0.00 -0.63 0.00 0.00 39.34 38.99 2fse n TYR 78 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2fse h ARG 80 N 0.02 0.25 -0.82 0.00 3.08 -1.47 -2.94 114.38 112.50 2fse h ARG 80 Ca 0.44 -0.42 0.16 0.00 0.07 0.00 0.00 59.98 60.22 2fse h ARG 80 Cb 0.73 0.16 -0.06 0.00 0.08 0.00 0.00 29.97 30.88 2fse h ARG 80 CO -0.84 1.10 0.54 1.25 -1.07 0.00 0.00 179.97 180.95 2fse h HIS 81 N 0.07 0.60 0.10 3.04 2.76 -1.03 -1.69 115.15 119.00 2fse h HIS 81 Ca -0.27 0.02 -0.30 0.00 -2.20 0.00 0.00 60.37 57.62 2fse h HIS 81 Cb 2.02 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 30.78 2fse h HIS 81 CO 0.06 0.21 -1.50 -0.91 -1.30 0.00 0.00 177.93 174.49 2fse h ASN 82 N 0.50 0.32 0.09 3.26 2.35 -1.21 -3.05 115.58 117.83 2fse h ASN 82 Ca 0.41 -0.45 0.02 0.00 -0.55 0.00 0.00 56.30 55.73 2fse h ASN 82 Cb 0.87 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 39.10 2fse h ASN 82 CO -0.16 1.37 -0.22 0.22 -1.65 0.00 0.00 177.43 176.99 2fse h TYR 83 N 0.06 -0.59 -0.99 1.19 5.03 -1.19 -1.13 116.97 119.35 2fse h TYR 83 Ca -0.23 0.01 0.17 0.00 2.58 0.00 0.00 58.73 61.27 2fse h TYR 83 Cb 1.99 0.25 -0.09 0.00 1.55 0.00 0.00 36.73 40.43 2fse h TYR 83 CO 0.05 -0.32 0.62 0.78 -1.32 0.00 0.00 178.16 177.97 2fse h GLY 84 N -0.40 1.62 0.64 1.82 0.00 -1.44 0.39 103.07 105.70 2fse h GLY 84 Ca 0.03 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 2fse h GLY 84 CO -0.14 0.02 -0.04 -2.08 0.00 0.00 0.00 176.54 174.29 2fse h VAL 85 N 0.79 1.34 0.00 4.60 2.07 -1.20 -3.32 116.25 120.53 2fse h VAL 85 Ca 0.54 -1.10 0.00 0.00 0.82 0.00 0.00 66.70 66.96 2fse h VAL 85 Cb 0.80 1.93 0.00 0.00 -1.52 0.00 0.00 31.29 32.51 2fse h VAL 85 CO -0.32 0.30 -0.63 0.61 0.02 0.00 0.00 177.57 177.56 2fse n GLY 86 N 0.09 -1.24 0.31 2.17 0.00 -0.52 -4.45 105.19 101.54 2fse n GLY 86 Ca -0.07 -0.37 0.05 0.00 0.00 0.00 0.00 46.02 45.63 2fse n GLY 86 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2fse n GLU 87 N -1.63 -0.09 -0.34 1.61 2.13 0.13 -1.14 120.64 121.31 2fse n GLU 87 Ca 0.05 1.31 0.11 0.00 0.66 0.00 0.00 57.16 59.30 2fse n GLU 87 Cb 0.36 -1.96 0.31 0.00 0.27 0.00 0.00 31.44 30.42 2fse n GLU 87 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 2fse h SER 88 N 0.00 0.80 -0.10 4.31 4.64 -1.82 -2.88 113.55 118.49 2fse h SER 88 Ca 0.40 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 2fse h SER 88 Cb 0.61 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 2fse h SER 88 CO -0.87 0.35 0.00 2.22 -0.87 0.00 0.00 176.83 177.66 2fse n PHE 89 N -4.68 0.13 0.00 4.77 -1.74 -0.29 -4.38 117.46 111.27 2fse n PHE 89 Ca 0.21 -0.34 0.00 0.00 -0.56 0.00 0.00 57.45 56.76 2fse n PHE 89 Cb 0.50 -0.03 0.00 0.00 1.52 0.00 0.00 39.48 41.48 2fse n PHE 89 CO 0.00 0.00 0.00 0.25 -0.56 0.00 0.00 176.76 176.45 2fse n THR 90 N 0.04 0.00 -0.18 1.97 -2.24 -0.55 -4.41 114.28 108.90 2fse n THR 90 Ca 0.04 0.17 -0.05 0.00 -2.27 0.00 0.00 64.05 61.94 2fse n THR 90 Cb 0.26 -1.08 0.05 0.00 -2.10 0.00 0.00 70.33 67.46 2fse n THR 90 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2fse h VAL 91 N 0.00 1.02 -0.13 2.28 2.07 -1.72 -1.97 116.25 117.81 2fse h VAL 91 Ca 0.00 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2fse h VAL 91 Cb 0.00 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 2fse h VAL 91 CO 0.00 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.70 2fse n GLN 92 N -4.81 1.31 -2.01 1.57 6.02 -1.11 -4.87 117.38 113.48 2fse n GLN 92 Ca 0.05 -0.47 -0.42 0.00 -0.01 0.00 0.00 57.00 56.14 2fse n GLN 92 Cb 0.10 -1.13 -0.03 0.00 1.02 0.00 0.00 30.24 30.20 2fse n GLN 92 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2fse s ARG 93 N -1.83 4.22 -0.06 -1.09 6.06 -0.74 -4.94 118.95 120.57 2fse s ARG 93 Ca 0.12 2.23 -0.02 0.00 -2.50 0.00 0.00 55.73 55.55 2fse s ARG 93 Cb 0.06 -3.56 0.04 0.00 0.06 0.00 0.00 34.95 31.55 2fse s ARG 93 CO 0.08 -0.68 0.11 1.03 -2.50 0.00 0.00 175.30 173.34 2fse s ARG 94 N 2.44 -0.01 -0.07 5.12 0.52 -1.26 -4.06 118.95 121.64 2fse s ARG 94 Ca 0.71 0.43 0.01 0.00 -0.52 0.00 0.00 55.73 56.36 2fse s ARG 94 Cb -0.38 -0.34 0.02 0.00 0.52 0.00 0.00 34.95 34.77 2fse s ARG 94 CO 0.31 -0.28 -0.07 0.08 0.02 0.00 0.00 175.30 175.35 2fse s VAL 95 N 1.96 0.83 0.48 3.52 1.01 -0.27 -4.97 120.40 122.96 2fse s VAL 95 Ca 0.01 -0.26 -0.23 0.00 0.00 0.00 0.00 61.98 61.50 2fse s VAL 95 Cb -0.12 -0.83 -0.07 0.00 0.00 0.00 0.00 36.38 35.37 2fse s VAL 95 CO -0.04 0.30 1.28 -1.61 0.00 0.00 0.00 175.10 175.03 2fse s GLU 96 N 1.10 3.56 0.37 2.72 2.02 -1.26 -2.86 118.70 124.35 2fse s GLU 96 Ca -0.07 2.07 -0.22 0.00 0.02 0.00 0.00 54.97 56.77 2fse s GLU 96 Cb -0.14 -2.44 -0.10 0.00 0.10 0.00 0.00 34.13 31.54 2fse s GLU 96 CO -0.01 -0.80 0.91 -2.14 0.02 0.00 0.00 175.26 173.25 2fse s PRO 97 N -2.66 4.33 -0.42 0.39 0.02 -1.24 -4.38 135.00 131.04 2fse s PRO 97 Ca 0.65 1.13 -0.04 0.00 0.02 0.00 0.00 61.00 62.77 2fse s PRO 97 Cb -0.36 -2.46 0.11 0.00 0.02 0.00 0.00 34.50 31.81 2fse s PRO 97 CO 0.44 0.12 0.23 0.99 -0.33 0.00 0.00 177.00 178.45 2fse s THR 98 N -1.93 3.42 0.53 0.99 2.01 0.37 -4.97 115.64 116.06 2fse s THR 98 Ca 0.56 -2.03 -0.16 0.00 0.31 0.00 0.00 61.69 60.37 2fse s THR 98 Cb -0.13 -3.33 -0.07 0.00 0.01 0.00 0.00 72.50 68.98 2fse s THR 98 CO 0.18 -0.71 1.00 -0.69 -0.69 0.00 0.00 174.62 173.71 2fse s VAL 99 N 1.16 4.35 -0.28 3.82 1.01 -1.26 -2.51 120.40 126.69 2fse s VAL 99 Ca 0.08 1.13 -0.19 0.00 0.00 0.00 0.00 61.98 63.00 2fse s VAL 99 Cb -0.23 -3.64 0.09 0.00 0.00 0.00 0.00 36.38 32.60 2fse s VAL 99 CO -0.04 -0.64 0.76 -0.89 0.00 0.00 0.00 175.10 174.29 2fse s THR 100 N -2.58 0.00 -0.14 3.92 2.01 -0.44 -4.99 115.64 113.43 2fse s THR 100 Ca 0.60 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.61 2fse s THR 100 Cb -0.11 -1.00 -0.00 0.00 0.01 0.00 0.00 72.50 71.39 2fse s THR 100 CO 0.33 0.00 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.40 2fse s VAL 101 N 1.20 2.65 0.11 3.82 1.01 -1.26 -0.74 120.40 127.18 2fse s VAL 101 Ca -0.07 -0.79 -0.14 0.00 0.00 0.00 0.00 61.98 60.99 2fse s VAL 101 Cb -0.05 -2.10 0.02 0.00 0.00 0.00 0.00 36.38 34.26 2fse s VAL 101 CO -0.13 0.53 0.33 -0.72 0.00 0.00 0.00 175.10 175.11 2fse s TYR 102 N 0.59 -0.09 0.48 5.22 1.13 -0.05 -4.96 117.35 119.67 2fse s TYR 102 Ca -0.10 -0.24 -0.08 0.00 -1.41 0.00 0.00 57.07 55.24 2fse s TYR 102 Cb -0.16 0.15 0.12 0.00 -1.10 0.00 0.00 41.96 40.98 2fse s TYR 102 CO 0.03 -0.64 0.36 -2.30 -2.51 0.00 0.00 175.55 170.49 2fse n PRO 103 N -0.11 -2.32 0.08 -3.49 -0.02 -1.26 0.32 135.00 128.19 2fse n PRO 103 Ca -0.16 -0.59 0.00 0.00 -2.02 0.00 0.00 63.50 60.73 2fse n PRO 103 Cb 0.63 -0.63 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2fse n PRO 103 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2fse n THR 104 N -3.64 0.17 -3.36 3.45 -1.04 -1.20 -4.67 114.28 103.99 2fse n THR 104 Ca 0.05 0.06 -0.21 0.00 -2.04 0.00 0.00 64.05 61.91 2fse n THR 104 Cb 0.21 -0.73 0.01 0.00 -1.82 0.00 0.00 70.33 68.01 2fse n THR 104 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2fse s LYS 105 N -2.00 2.48 0.50 -2.82 1.02 -1.26 -5.05 119.74 112.60 2fse s LYS 105 Ca 0.00 -1.60 -0.21 0.00 0.02 0.00 0.00 55.97 54.18 2fse s LYS 105 Cb 0.00 -2.48 -0.09 0.00 -0.52 0.00 0.00 37.83 34.74 2fse s LYS 105 CO 0.00 -0.48 0.86 2.41 -0.92 0.00 0.00 175.35 177.22 2fse n THR 106 N -1.85 2.68 -1.56 2.17 -1.04 -1.26 -4.92 114.28 108.50 2fse n THR 106 Ca 0.07 -0.50 -0.30 0.00 -2.04 0.00 0.00 64.05 61.27 2fse n THR 106 Cb 0.62 -1.01 -0.01 0.00 -1.82 0.00 0.00 70.33 68.11 2fse n THR 106 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2fse n GLN 107 N -0.16 2.47 -3.10 -2.82 6.02 -1.26 -5.01 117.38 113.52 2fse n GLN 107 Ca 0.11 -2.69 -0.20 0.00 -0.01 0.00 0.00 57.00 54.21 2fse n GLN 107 Cb 0.43 -2.14 0.06 0.00 1.02 0.00 0.00 30.24 29.60 2fse n GLN 107 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.06 173.91 2fse s PRO 108 N -2.57 2.28 -0.06 -1.09 0.01 -1.26 -5.08 135.00 127.23 2fse s PRO 108 Ca 0.55 -1.69 0.04 0.00 0.01 0.00 0.00 61.00 59.91 2fse s PRO 108 Cb 0.40 -2.61 -0.02 0.00 0.01 0.00 0.00 34.50 32.28 2fse s PRO 108 CO -0.25 -0.87 -0.18 -0.51 0.01 0.00 0.00 177.00 175.20 2fse s LEU 109 N -4.65 2.50 -0.63 -5.54 1.02 -1.26 -4.49 118.68 105.64 2fse s LEU 109 Ca 0.60 -0.32 -0.01 0.00 0.02 0.00 0.00 54.13 54.42 2fse s LEU 109 Cb -0.05 -1.50 0.00 0.00 0.02 0.00 0.00 46.19 44.66 2fse s LEU 109 CO 0.38 0.29 0.60 1.67 0.02 0.00 0.00 176.35 179.31 2fse n GLN 110 N 2.70 -1.20 -4.09 1.70 7.27 -1.26 -5.11 117.38 117.39 2fse n GLN 110 Ca -0.17 1.40 -0.20 0.00 0.07 0.00 0.00 57.00 58.10 2fse n GLN 110 Cb 0.52 -5.20 -0.16 0.00 2.41 0.00 0.00 30.24 27.80 2fse n GLN 110 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 2fse s HIS 111 N -2.96 0.73 0.74 3.69 2.46 -1.26 -5.11 115.29 113.59 2fse s HIS 111 Ca 0.01 -0.20 -0.14 0.00 0.47 0.00 0.00 55.06 55.20 2fse s HIS 111 Cb -0.00 -0.68 0.05 0.00 -0.13 0.00 0.00 32.58 31.81 2fse s HIS 111 CO 0.65 -0.21 1.16 -1.01 -2.47 0.00 0.00 174.74 172.86 2fse s HIS 112 N 1.08 2.20 -0.28 3.88 0.09 -1.26 -4.58 115.29 116.42 2fse s HIS 112 Ca -0.09 1.61 -0.25 0.00 -0.00 0.00 0.00 55.06 56.34 2fse s HIS 112 Cb -0.14 -3.33 0.09 0.00 -0.00 0.00 0.00 32.58 29.21 2fse s HIS 112 CO -0.01 -2.30 0.86 0.54 -0.00 0.00 0.00 174.74 173.82 2fse s ASN 113 N -2.42 -0.62 -0.04 1.40 2.20 -0.88 -5.00 114.94 109.57 2fse s ASN 113 Ca 0.70 1.19 -0.30 0.00 -0.94 0.00 0.00 52.86 53.51 2fse s ASN 113 Cb -0.25 1.21 -0.04 0.00 -2.00 0.00 0.00 41.25 40.18 2fse s ASN 113 CO 0.47 -0.21 1.29 -0.22 -2.94 0.00 0.00 177.10 175.50 2fse s LEU 114 N 0.37 4.29 0.04 3.54 2.96 -1.26 -3.69 118.68 124.92 2fse s LEU 114 Ca 0.01 1.94 -0.13 0.00 -0.22 0.00 0.00 54.13 55.73 2fse s LEU 114 Cb -0.05 -3.56 -0.06 0.00 0.50 0.00 0.00 46.19 43.03 2fse s LEU 114 CO -0.03 -0.66 0.41 -0.76 -1.32 0.00 0.00 176.35 173.99 2fse s LEU 115 N 2.39 4.42 -0.08 -0.68 1.43 0.30 -3.21 118.68 123.25 2fse s LEU 115 Ca 0.59 0.89 0.04 0.00 -1.03 0.00 0.00 54.13 54.62 2fse s LEU 115 Cb -0.27 -2.76 0.00 0.00 0.03 0.00 0.00 46.19 43.18 2fse s LEU 115 CO 0.24 0.26 -0.19 -0.69 0.23 0.00 0.00 176.35 176.19 2fse s VAL 116 N -1.22 1.66 -0.76 -1.59 1.01 0.15 0.08 120.40 119.73 2fse s VAL 116 Ca 0.28 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.43 2fse s VAL 116 Cb -0.15 -1.45 0.19 0.00 0.00 0.00 0.00 36.38 34.97 2fse s VAL 116 CO 0.15 0.47 0.61 0.00 0.00 0.00 0.00 175.10 176.33 2fse s SER 118 N 0.39 6.73 -0.37 0.00 0.15 0.08 -2.76 113.70 117.92 2fse s SER 118 Ca 0.22 2.11 0.02 0.00 0.70 0.00 0.00 55.95 58.99 2fse s SER 118 Cb -0.14 -2.53 0.10 0.00 -1.71 0.00 0.00 66.02 61.74 2fse s SER 118 CO -0.08 -0.89 0.10 -0.69 1.20 0.00 0.00 173.24 172.89 2fse s VAL 119 N 3.90 2.62 0.46 4.45 1.01 -0.16 -1.32 120.40 131.35 2fse s VAL 119 Ca 0.69 -2.27 0.05 0.00 0.00 0.00 0.00 61.98 60.45 2fse s VAL 119 Cb -0.31 -2.88 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 2fse s VAL 119 CO 0.26 -0.63 0.06 -0.94 0.00 0.00 0.00 175.10 173.85 2fse s SER 120 N 1.19 4.11 -0.18 3.32 1.04 -1.04 -0.47 113.70 121.67 2fse s SER 120 Ca 0.10 -1.42 -0.07 0.00 0.48 0.00 0.00 55.95 55.05 2fse s SER 120 Cb -0.20 -0.03 0.01 0.00 0.10 0.00 0.00 66.02 65.90 2fse s SER 120 CO -0.07 -0.65 0.14 -0.67 0.98 0.00 0.00 173.24 172.97 2fse n ASP 121 N -1.17 -6.92 -3.53 7.02 2.03 -1.02 -0.48 116.55 112.48 2fse n ASP 121 Ca -0.09 0.61 -0.09 0.00 0.52 0.00 0.00 54.79 55.74 2fse n ASP 121 Cb 0.66 -2.90 -0.03 0.00 -0.72 0.00 0.00 41.12 38.14 2fse n ASP 121 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 2fse s PHE 122 N -1.36 -0.34 -0.25 -0.67 -0.71 -1.23 -3.61 117.98 109.81 2fse s PHE 122 Ca 0.08 0.31 -0.22 0.00 -1.04 0.00 0.00 56.93 56.06 2fse s PHE 122 Cb -0.01 0.51 0.07 0.00 -1.21 0.00 0.00 43.02 42.38 2fse s PHE 122 CO 0.40 -0.47 0.66 -0.47 -1.34 0.00 0.00 175.22 174.01 2fse s TYR 123 N -2.55 -0.77 1.07 3.49 6.14 -1.14 0.74 117.35 124.33 2fse s TYR 123 Ca 0.04 1.82 -0.17 0.00 0.64 0.00 0.00 57.07 59.40 2fse s TYR 123 Cb -0.01 0.30 0.23 0.00 0.42 0.00 0.00 41.96 42.90 2fse s TYR 123 CO -0.06 -0.38 1.18 -2.14 0.64 0.00 0.00 175.55 174.80 2fse s PRO 124 N 0.56 -0.14 0.30 4.97 0.02 -1.26 -1.11 135.00 138.33 2fse s PRO 124 Ca -0.02 -0.09 0.04 0.00 0.02 0.00 0.00 61.00 60.95 2fse s PRO 124 Cb -0.05 -1.73 0.46 0.00 0.02 0.00 0.00 34.50 33.21 2fse s PRO 124 CO -0.02 -2.99 1.75 0.78 -0.33 0.00 0.00 177.00 176.19 2fse h GLY 125 N -2.06 0.47 -5.17 0.52 0.00 -1.98 -3.44 103.07 91.40 2fse h GLY 125 Ca -0.46 -0.37 -0.54 0.00 0.00 0.00 0.00 47.33 45.96 2fse h GLY 125 CO 0.41 0.34 1.10 0.54 0.00 0.00 0.00 176.54 178.93 2fse s ASN 126 N -6.82 6.58 0.09 0.19 4.22 -1.26 -4.97 114.94 112.97 2fse s ASN 126 Ca -0.06 2.45 -0.17 0.00 -2.14 0.00 0.00 52.86 52.94 2fse s ASN 126 Cb 0.14 -2.54 0.04 0.00 1.28 0.00 0.00 41.25 40.16 2fse s ASN 126 CO 0.78 -0.95 0.41 -0.51 -2.04 0.00 0.00 177.10 174.79 2fse s ILE 127 N 3.62 0.06 -0.09 0.54 2.07 -1.26 -4.67 121.20 121.47 2fse s ILE 127 Ca 0.78 -0.53 0.03 0.00 -1.41 0.00 0.00 60.65 59.52 2fse s ILE 127 Cb -0.38 -1.08 0.01 0.00 0.13 0.00 0.00 42.46 41.13 2fse s ILE 127 CO 0.34 -0.29 -0.18 -1.61 -1.91 0.00 0.00 174.94 171.28 2fse s GLU 128 N -3.27 2.46 -0.18 3.50 0.41 -0.95 -5.02 118.70 115.66 2fse s GLU 128 Ca -0.00 -0.67 0.00 0.00 -0.41 0.00 0.00 54.97 53.89 2fse s GLU 128 Cb 0.01 -1.95 0.04 0.00 -1.78 0.00 0.00 34.13 30.45 2fse s GLU 128 CO -0.08 0.06 -0.08 0.08 -0.49 0.00 0.00 175.26 174.75 2fse s VAL 129 N 0.62 1.41 -0.05 2.63 1.01 -1.26 -1.81 120.40 122.96 2fse s VAL 129 Ca -0.14 -0.84 0.07 0.00 0.00 0.00 0.00 61.98 61.07 2fse s VAL 129 Cb -0.16 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.67 2fse s VAL 129 CO 0.04 0.16 -0.25 -0.13 0.00 0.00 0.00 175.10 174.92 2fse s ARG 130 N 1.50 2.42 0.29 2.72 0.52 -1.05 -4.99 118.95 120.35 2fse s ARG 130 Ca -0.00 -0.90 -0.03 0.00 -0.52 0.00 0.00 55.73 54.27 2fse s ARG 130 Cb -0.16 -2.14 -0.05 0.00 0.52 0.00 0.00 34.95 33.13 2fse s ARG 130 CO -0.08 0.45 0.53 -1.58 0.02 0.00 0.00 175.30 174.64 2fse s TRP 131 N -0.33 3.48 -0.02 -0.53 0.52 -1.26 -0.73 118.94 120.08 2fse s TRP 131 Ca 0.01 0.54 -0.05 0.00 0.02 0.00 0.00 56.10 56.63 2fse s TRP 131 Cb -0.12 -2.03 0.00 0.00 -1.15 0.00 0.00 33.47 30.17 2fse s TRP 131 CO 0.02 0.19 0.10 -0.06 0.02 0.00 0.00 176.95 177.22 2fse s PHE 132 N -2.11 -0.00 -0.22 -1.98 0.40 0.13 -2.20 117.98 112.00 2fse s PHE 132 Ca 0.42 0.01 0.00 0.00 -0.60 0.00 0.00 56.93 56.76 2fse s PHE 132 Cb -0.11 -0.03 0.06 0.00 0.51 0.00 0.00 43.02 43.45 2fse s PHE 132 CO 0.31 -0.17 -0.04 0.50 0.70 0.00 0.00 175.22 176.52 2fse s ARG 133 N -0.74 1.47 -1.28 0.44 3.52 0.11 -0.25 118.95 122.22 2fse s ARG 133 Ca -0.08 -0.86 -0.15 0.00 -0.13 0.00 0.00 55.73 54.51 2fse s ARG 133 Cb -0.05 -2.46 0.01 0.00 -1.56 0.00 0.00 34.95 30.89 2fse s ARG 133 CO 0.01 -0.59 0.57 0.09 -0.81 0.00 0.00 175.30 174.57 2fse n ASN 134 N 4.75 -2.83 0.00 -2.12 3.02 0.56 -0.84 115.26 117.81 2fse n ASN 134 Ca -0.12 -1.10 0.00 0.00 -0.03 0.00 0.00 54.58 53.33 2fse n ASN 134 Cb 0.45 -2.74 0.00 0.00 -0.61 0.00 0.00 39.78 36.88 2fse n ASN 134 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2fse n GLY 135 N -1.96 1.91 3.79 7.41 0.00 -1.26 -4.97 105.19 110.11 2fse n GLY 135 Ca -0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 2fse n GLY 135 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fse s LYS 136 N 0.00 4.00 0.14 1.61 -0.14 -0.02 -5.04 119.74 120.30 2fse s LYS 136 Ca 0.00 0.15 -0.31 0.00 -1.36 0.00 0.00 55.97 54.45 2fse s LYS 136 Cb 0.00 -3.32 -0.08 0.00 -1.68 0.00 0.00 37.83 32.74 2fse s LYS 136 CO 0.00 0.47 1.39 -2.00 -0.76 0.00 0.00 175.35 174.45 2fse s GLU 137 N -0.26 4.33 -0.78 1.68 2.12 -1.26 -0.71 118.70 123.81 2fse s GLU 137 Ca 0.18 2.10 -0.20 0.00 0.36 0.00 0.00 54.97 57.42 2fse s GLU 137 Cb -0.14 -3.22 0.11 0.00 0.26 0.00 0.00 34.13 31.14 2fse s GLU 137 CO 0.07 -0.41 0.99 -2.00 -0.54 0.00 0.00 175.26 173.37 2fse s GLU 138 N 0.75 3.35 -0.02 4.30 2.56 -0.94 -4.88 118.70 123.82 2fse s GLU 138 Ca 0.63 -1.43 -0.01 0.00 0.00 0.00 0.00 54.97 54.16 2fse s GLU 138 Cb -0.37 -4.57 -0.01 0.00 2.00 0.00 0.00 34.13 31.18 2fse s GLU 138 CO 0.33 -1.73 0.12 0.93 -0.56 0.00 0.00 175.26 174.34 2fse h GLU 139 N 9.08 -0.03 -6.10 4.30 4.39 -1.92 -3.42 114.58 120.87 2fse h GLU 139 Ca -0.06 0.00 -0.76 0.00 0.34 0.00 0.00 59.36 58.88 2fse h GLU 139 Cb 1.05 0.01 0.04 0.00 -0.10 0.00 0.00 28.75 29.75 2fse h GLU 139 CO 1.12 -0.02 0.34 2.41 -1.16 0.00 0.00 179.01 181.69 2fse n THR 140 N -2.70 0.03 -3.06 1.13 -1.04 -1.26 -4.37 114.28 103.01 2fse n THR 140 Ca -0.00 -0.00 -0.00 0.00 -2.04 0.00 0.00 64.05 62.00 2fse n THR 140 Cb 0.01 -0.43 -0.00 0.00 -1.82 0.00 0.00 70.33 68.09 2fse n THR 140 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2fse n GLY 141 N 2.37 -1.05 2.75 3.41 0.00 -1.26 -5.02 105.19 106.39 2fse n GLY 141 Ca 0.21 0.16 -0.26 0.00 0.00 0.00 0.00 46.02 46.14 2fse n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fse s ILE 142 N -0.99 0.48 0.21 -0.61 1.01 -1.26 -4.64 121.20 115.40 2fse s ILE 142 Ca -0.01 -0.32 -0.30 0.00 0.00 0.00 0.00 60.65 60.02 2fse s ILE 142 Cb 0.00 -0.86 -0.08 0.00 0.01 0.00 0.00 42.46 41.53 2fse s ILE 142 CO 0.18 -0.04 0.93 -0.69 0.00 0.00 0.00 174.94 175.32 2fse s VAL 143 N 1.90 4.18 -0.05 2.92 1.01 -1.01 -4.95 120.40 124.40 2fse s VAL 143 Ca 0.01 2.05 0.00 0.00 0.00 0.00 0.00 61.98 64.05 2fse s VAL 143 Cb -0.15 -4.31 0.02 0.00 0.00 0.00 0.00 36.38 31.94 2fse s VAL 143 CO -0.07 0.47 -0.03 -0.55 0.00 0.00 0.00 175.10 174.91 2fse s SER 144 N -0.95 1.11 0.08 3.32 0.15 -1.26 -0.68 113.70 115.47 2fse s SER 144 Ca 0.42 -0.12 0.16 0.00 0.70 0.00 0.00 55.95 57.11 2fse s SER 144 Cb -0.25 -0.45 0.70 0.00 -1.71 0.00 0.00 66.02 64.31 2fse s SER 144 CO 0.31 -0.09 1.52 0.35 1.20 0.00 0.00 173.24 176.53 2fse n THR 145 N 4.33 1.00 -1.70 6.45 -2.24 -0.82 -4.99 114.28 116.30 2fse n THR 145 Ca -0.20 0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2fse n THR 145 Cb 0.51 -1.08 0.00 0.00 -2.10 0.00 0.00 70.33 67.66 2fse n THR 145 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fse n GLY 146 N -0.08 -1.99 3.87 3.38 0.00 -1.26 -4.93 105.19 104.16 2fse n GLY 146 Ca 0.03 -1.78 -0.32 0.00 0.00 0.00 0.00 46.02 43.95 2fse n GLY 146 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2fse s LEU 147 N 0.00 4.10 -0.08 0.99 2.96 -1.26 -4.29 118.68 121.09 2fse s LEU 147 Ca 0.00 1.06 -0.00 0.00 -0.22 0.00 0.00 54.13 54.97 2fse s LEU 147 Cb 0.00 -3.85 0.02 0.00 0.50 0.00 0.00 46.19 42.86 2fse s LEU 147 CO 0.00 -0.16 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.14 2fse s VAL 148 N -1.94 0.74 -0.28 1.68 1.01 -0.62 -5.00 120.40 115.99 2fse s VAL 148 Ca 0.50 -0.14 -0.20 0.00 0.00 0.00 0.00 61.98 62.15 2fse s VAL 148 Cb -0.11 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.46 2fse s VAL 148 CO 0.21 0.31 0.60 -0.60 0.00 0.00 0.00 175.10 175.62 2fse s ARG 149 N 1.60 3.98 0.12 2.72 3.52 -1.26 -2.17 118.95 127.45 2fse s ARG 149 Ca 0.01 0.35 0.26 0.00 -0.13 0.00 0.00 55.73 56.22 2fse s ARG 149 Cb -0.13 -3.69 0.97 0.00 -1.56 0.00 0.00 34.95 30.54 2fse s ARG 149 CO -0.05 -0.48 1.80 0.09 -0.81 0.00 0.00 175.30 175.85 2fse n ASN 150 N 5.76 0.43 0.00 -2.12 3.02 -0.79 -4.93 115.26 116.63 2fse n ASN 150 Ca -0.02 0.55 0.00 0.00 -0.03 0.00 0.00 54.58 55.08 2fse n ASN 150 Cb 0.49 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 39.00 2fse n ASN 150 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2fse n GLY 151 N 1.12 3.05 2.45 7.41 0.00 -1.26 -4.93 105.19 113.03 2fse n GLY 151 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 2fse n GLY 151 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2fse n ASP 152 N 0.00 4.73 -3.96 1.61 5.68 -1.26 -4.93 116.55 118.42 2fse n ASP 152 Ca 0.00 -3.72 -0.31 0.00 -0.50 0.00 0.00 54.79 50.26 2fse n ASP 152 Cb 0.00 -0.45 0.01 0.00 -1.14 0.00 0.00 41.12 39.54 2fse n ASP 152 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 2fse n TRP 153 N -0.50 -2.13 -3.83 2.11 7.02 -1.26 -4.97 117.44 113.88 2fse n TRP 153 Ca 0.39 0.87 -0.12 0.00 -1.02 0.00 0.00 57.50 57.63 2fse n TRP 153 Cb 0.68 -3.80 -0.12 0.00 -2.42 0.00 0.00 31.31 25.66 2fse n TRP 153 CO 0.00 0.00 0.00 -0.08 -2.02 0.00 0.00 177.69 175.59 2fse s THR 154 N -3.36 0.02 0.08 -0.99 -1.32 -1.26 -4.69 115.64 104.12 2fse s THR 154 Ca 0.59 -0.17 0.00 0.00 -1.21 0.00 0.00 61.69 60.90 2fse s THR 154 Cb -0.30 -0.27 0.00 0.00 -1.51 0.00 0.00 72.50 70.42 2fse s THR 154 CO 0.85 -0.10 0.04 0.49 -2.21 0.00 0.00 174.62 173.69 2fse n PHE 155 N 2.61 -0.77 0.00 9.09 3.01 0.23 -1.89 117.46 129.74 2fse n PHE 155 Ca -0.15 -0.37 0.00 0.00 1.01 0.00 0.00 57.45 57.94 2fse n PHE 155 Cb 0.58 -0.06 0.00 0.00 -0.01 0.00 0.00 39.48 39.99 2fse n PHE 155 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2fse n GLN 156 N -0.51 0.00 -3.99 -1.08 10.64 -0.92 -2.43 117.38 119.09 2fse n GLN 156 Ca -0.01 0.00 -0.08 0.00 -1.83 0.00 0.00 57.00 55.07 2fse n GLN 156 Cb 0.10 0.00 -0.10 0.00 -0.86 0.00 0.00 30.24 29.38 2fse n GLN 156 CO 0.00 0.00 0.00 -0.08 -1.83 0.00 0.00 177.06 175.15 2fse s THR 157 N -0.79 0.16 -0.13 -0.39 -1.32 0.39 -1.59 115.64 111.96 2fse s THR 157 Ca 0.00 -1.35 0.01 0.00 -1.21 0.00 0.00 61.69 59.14 2fse s THR 157 Cb 0.00 -1.10 0.02 0.00 -1.51 0.00 0.00 72.50 69.91 2fse s THR 157 CO 0.00 -0.75 -0.17 -0.76 -2.21 0.00 0.00 174.62 170.74 2fse s LEU 158 N -2.43 1.83 -0.38 9.08 1.43 -1.26 -0.99 118.68 125.96 2fse s LEU 158 Ca -0.01 -0.50 -0.03 0.00 -1.03 0.00 0.00 54.13 52.56 2fse s LEU 158 Cb 0.02 -1.23 0.09 0.00 0.03 0.00 0.00 46.19 45.11 2fse s LEU 158 CO -0.07 0.01 0.15 -0.69 0.23 0.00 0.00 176.35 175.98 2fse s VAL 159 N 1.10 3.25 0.07 -1.59 1.01 -1.11 -1.95 120.40 121.18 2fse s VAL 159 Ca -0.03 -1.85 -0.18 0.00 0.00 0.00 0.00 61.98 59.92 2fse s VAL 159 Cb -0.14 -3.13 -0.07 0.00 0.00 0.00 0.00 36.38 33.04 2fse s VAL 159 CO -0.05 -0.53 0.54 -0.04 0.00 0.00 0.00 175.10 175.02 2fse s MET 160 N 1.18 4.13 0.07 2.72 1.00 0.15 -1.73 119.30 126.81 2fse s MET 160 Ca 0.05 0.66 0.05 0.00 0.00 0.00 0.00 55.69 56.45 2fse s MET 160 Cb -0.22 -3.20 -0.03 0.00 0.00 0.00 0.00 34.83 31.38 2fse s MET 160 CO -0.03 0.63 -0.15 -1.17 0.00 0.00 0.00 175.02 174.30 2fse s LEU 161 N -1.20 2.25 -0.06 -0.03 2.96 0.11 -2.39 118.68 120.32 2fse s LEU 161 Ca 0.29 -0.58 0.04 0.00 -0.22 0.00 0.00 54.13 53.66 2fse s LEU 161 Cb -0.19 -0.57 0.00 0.00 0.50 0.00 0.00 46.19 45.94 2fse s LEU 161 CO 0.18 -0.04 -0.18 -0.70 -1.32 0.00 0.00 176.35 174.29 2fse s GLU 162 N -1.61 2.09 0.09 1.98 2.12 -1.26 0.11 118.70 122.21 2fse s GLU 162 Ca -0.00 -0.65 -0.02 0.00 0.36 0.00 0.00 54.97 54.65 2fse s GLU 162 Cb -0.09 -1.73 0.01 0.00 0.26 0.00 0.00 34.13 32.58 2fse s GLU 162 CO 0.02 0.20 0.15 0.25 -0.54 0.00 0.00 175.26 175.34 2fse n THR 163 N 3.33 0.00 -3.81 -1.70 -2.24 -1.24 -5.01 114.28 103.61 2fse n THR 163 Ca -0.19 -0.32 -0.33 0.00 -2.27 0.00 0.00 64.05 60.94 2fse n THR 163 Cb 0.53 0.24 -0.11 0.00 -2.10 0.00 0.00 70.33 68.89 2fse n THR 163 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2fse s VAL 164 N -2.66 3.29 -0.79 2.28 1.01 -1.26 -2.07 120.40 120.20 2fse s VAL 164 Ca 0.05 -3.42 -0.23 0.00 0.00 0.00 0.00 61.98 58.38 2fse s VAL 164 Cb -0.01 -3.17 -0.18 0.00 0.00 0.00 0.00 36.38 33.02 2fse s VAL 164 CO 0.04 -0.90 2.39 -0.81 0.00 0.00 0.00 175.10 175.82 2fse n PRO 165 N 2.95 0.48 -3.07 2.72 -0.04 -1.26 -4.88 135.00 131.89 2fse n PRO 165 Ca 0.11 -0.38 -0.38 0.00 -0.04 0.00 0.00 63.50 62.81 2fse n PRO 165 Cb 0.35 -2.79 -0.06 0.00 -0.04 0.00 0.00 33.50 30.96 2fse n PRO 165 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2fse s GLN 166 N 8.37 4.38 0.23 0.54 -0.21 -1.26 -4.69 119.66 127.02 2fse s GLN 166 Ca 1.08 0.98 -0.31 0.00 0.02 0.00 0.00 55.36 57.13 2fse s GLN 166 Cb -0.43 -3.08 -0.14 0.00 1.00 0.00 0.00 33.01 30.35 2fse s GLN 166 CO 0.28 0.50 1.18 -1.13 -2.12 0.00 0.00 175.29 174.00 2fse n SER 167 N 1.21 1.75 0.00 5.90 3.41 -1.26 -1.55 113.62 123.08 2fse n SER 167 Ca -0.05 1.16 0.00 0.00 -0.26 0.00 0.00 58.87 59.72 2fse n SER 167 Cb 0.50 -1.30 0.00 0.00 -0.26 0.00 0.00 64.21 63.15 2fse n SER 167 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fse n GLY 168 N 1.73 3.21 3.69 5.00 0.00 -1.26 -5.03 105.19 112.54 2fse n GLY 168 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2fse n GLY 168 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2fse n GLU 169 N -1.34 1.92 -3.68 1.61 4.07 -0.59 -5.00 120.64 117.63 2fse n GLU 169 Ca 0.00 0.68 -0.29 0.00 -0.06 0.00 0.00 57.16 57.49 2fse n GLU 169 Cb 0.00 -2.35 -0.15 0.00 -0.06 0.00 0.00 31.44 28.88 2fse n GLU 169 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 2fse s VAL 170 N -1.19 0.50 -0.16 6.31 1.01 -1.26 -4.71 120.40 120.90 2fse s VAL 170 Ca 0.60 -0.98 -0.18 0.00 0.00 0.00 0.00 61.98 61.42 2fse s VAL 170 Cb -0.52 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 2fse s VAL 170 CO 0.59 -0.56 0.49 -0.31 0.00 0.00 0.00 175.10 175.31 2fse s TYR 171 N 1.83 3.44 -0.01 5.22 2.02 -1.16 -0.32 117.35 128.36 2fse s TYR 171 Ca 0.07 0.82 0.08 0.00 -0.37 0.00 0.00 57.07 57.66 2fse s TYR 171 Cb -0.17 -2.61 -0.02 0.00 -0.40 0.00 0.00 41.96 38.76 2fse s TYR 171 CO -0.24 0.03 -0.24 0.99 -1.57 0.00 0.00 175.55 174.51 2fse s THR 172 N 1.16 1.94 -0.19 -0.71 2.01 0.65 -1.86 115.64 118.63 2fse s THR 172 Ca 0.25 -1.09 -0.06 0.00 0.31 0.00 0.00 61.69 61.09 2fse s THR 172 Cb -0.15 -1.62 -0.03 0.00 0.01 0.00 0.00 72.50 70.71 2fse s THR 172 CO 0.10 0.51 0.04 0.00 -0.69 0.00 0.00 174.62 174.58 2fse s GLN 174 N 0.69 1.86 -0.02 0.00 -0.44 0.09 -2.01 119.66 119.83 2fse s GLN 174 Ca 0.02 -1.80 -0.13 0.00 -2.50 0.00 0.00 55.36 50.95 2fse s GLN 174 Cb -0.14 -3.43 -0.05 0.00 -1.64 0.00 0.00 33.01 27.75 2fse s GLN 174 CO 0.02 -1.00 0.35 0.08 0.50 0.00 0.00 175.29 175.24 2fse s VAL 175 N 1.07 5.14 -0.05 1.34 1.01 -0.54 -2.54 120.40 125.82 2fse s VAL 175 Ca 0.08 0.67 0.03 0.00 0.00 0.00 0.00 61.98 62.76 2fse s VAL 175 Cb -0.21 -3.64 0.01 0.00 0.00 0.00 0.00 36.38 32.54 2fse s VAL 175 CO -0.05 0.57 -0.12 -1.61 0.00 0.00 0.00 175.10 173.88 2fse s GLU 176 N -1.13 1.53 -0.03 2.72 2.02 -0.75 -1.94 118.70 121.12 2fse s GLU 176 Ca 0.22 -0.42 -0.22 0.00 0.02 0.00 0.00 54.97 54.57 2fse s GLU 176 Cb -0.15 -1.31 0.05 0.00 0.10 0.00 0.00 34.13 32.81 2fse s GLU 176 CO 0.12 0.09 0.48 -1.58 0.02 0.00 0.00 175.26 174.39 2fse s HIS 177 N 0.43 -0.41 0.48 1.61 2.46 -1.26 -2.23 115.29 116.37 2fse s HIS 177 Ca -0.10 0.68 0.25 0.00 0.47 0.00 0.00 55.06 56.36 2fse s HIS 177 Cb -0.13 0.24 1.28 0.00 -0.13 0.00 0.00 32.58 33.84 2fse s HIS 177 CO 0.03 -0.49 1.86 -1.35 -2.47 0.00 0.00 174.74 172.32 2fse h PRO 178 N 3.50 0.20 -0.86 2.88 0.11 -1.95 -0.02 132.00 135.87 2fse h PRO 178 Ca -0.28 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2fse h PRO 178 Cb 1.16 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2fse h PRO 178 CO 0.39 0.13 0.00 -1.13 -0.21 0.00 0.00 178.00 177.18 2fse n SER 179 N -4.40 2.33 -3.95 -2.05 3.41 -1.26 -4.75 113.62 102.95 2fse n SER 179 Ca 0.19 -2.26 -0.24 0.00 -0.26 0.00 0.00 58.87 56.30 2fse n SER 179 Cb 0.85 -0.54 -0.17 0.00 -0.26 0.00 0.00 64.21 64.09 2fse n SER 179 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2fse s LEU 180 N -0.80 1.40 0.05 1.04 1.43 -0.02 -4.75 118.68 117.04 2fse s LEU 180 Ca 0.16 -0.26 -0.15 0.00 -1.03 0.00 0.00 54.13 52.85 2fse s LEU 180 Cb 0.12 -0.74 -0.26 0.00 0.03 0.00 0.00 46.19 45.34 2fse s LEU 180 CO 0.05 -0.04 1.14 0.71 0.23 0.00 0.00 176.35 178.44 2fse h THR 181 N 6.08 1.31 -3.93 5.49 1.35 -1.85 -3.44 112.91 117.91 2fse h THR 181 Ca -0.31 -2.30 -0.50 0.00 -0.55 0.00 0.00 66.41 62.74 2fse h THR 181 Cb 1.16 2.54 -0.31 0.00 -1.73 0.00 0.00 68.15 69.82 2fse h THR 181 CO 0.44 0.70 -0.82 -1.81 -0.25 0.00 0.00 175.52 173.79 2fse s ASP 182 N -7.26 1.75 0.22 5.36 1.01 -1.26 -5.12 116.67 111.37 2fse s ASP 182 Ca -0.10 -0.28 -0.32 0.00 0.71 0.00 0.00 52.55 52.56 2fse s ASP 182 Cb 0.06 -0.43 -0.14 0.00 1.01 0.00 0.00 42.92 43.42 2fse s ASP 182 CO 0.91 0.13 1.34 -0.81 0.21 0.00 0.00 175.17 176.95 2fse n PRO 183 N 3.12 1.82 -2.76 8.23 -0.04 -1.26 -4.99 135.00 139.12 2fse n PRO 183 Ca -0.17 0.65 -0.40 0.00 -0.04 0.00 0.00 63.50 63.54 2fse n PRO 183 Cb 0.54 -2.26 -0.06 0.00 -0.04 0.00 0.00 33.50 31.67 2fse n PRO 183 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2fse s VAL 184 N -0.10 4.10 -0.02 0.52 1.01 -0.82 -4.91 120.40 120.18 2fse s VAL 184 Ca 0.69 2.04 0.01 0.00 0.00 0.00 0.00 61.98 64.71 2fse s VAL 184 Cb -0.70 -4.28 0.02 0.00 0.00 0.00 0.00 36.38 31.43 2fse s VAL 184 CO 0.50 0.45 -0.01 0.42 0.00 0.00 0.00 175.10 176.46 2fse s THR 185 N -1.25 0.17 -0.00 3.92 -4.23 -1.26 -1.47 115.64 111.53 2fse s THR 185 Ca 0.42 0.03 0.08 0.00 -1.18 0.00 0.00 61.69 61.05 2fse s THR 185 Cb -0.25 -0.24 -0.02 0.00 1.34 0.00 0.00 72.50 73.34 2fse s THR 185 CO 0.31 0.12 -0.25 -0.69 -0.54 0.00 0.00 174.62 173.56 2fse s VAL 186 N 0.70 1.98 0.26 2.29 1.01 -0.85 -4.96 120.40 120.83 2fse s VAL 186 Ca -0.07 -1.13 0.10 0.00 0.00 0.00 0.00 61.98 60.88 2fse s VAL 186 Cb -0.10 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.58 2fse s VAL 186 CO -0.01 0.50 -0.06 -1.61 0.00 0.00 0.00 175.10 173.92 2fse s GLU 187 N -0.73 2.12 -0.07 2.72 2.02 -1.26 -1.13 118.70 122.37 2fse s GLU 187 Ca 0.10 -1.47 -0.06 0.00 0.02 0.00 0.00 54.97 53.55 2fse s GLU 187 Cb -0.10 -2.08 0.02 0.00 0.10 0.00 0.00 34.13 32.08 2fse s GLU 187 CO -0.00 0.37 0.19 -0.46 0.02 0.00 0.00 175.26 175.38 2fse s TRP 188 N -2.27 -0.22 0.00 1.61 -0.00 -0.78 -4.88 118.94 112.41 2fse s TRP 188 Ca 0.30 0.54 0.00 0.00 -0.00 0.00 0.00 56.10 56.94 2fse s TRP 188 Cb -0.06 0.06 0.00 0.00 -0.00 0.00 0.00 33.47 33.47 2fse s TRP 188 CO 0.18 -0.12 0.00 1.17 -0.00 0.00 0.00 176.95 178.19