#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fse s ARG 6 N 0.00 3.73 -0.07 -0.52 1.81 -1.26 -5.09 118.95 117.55 2fse s ARG 6 Ca 0.00 0.27 0.01 0.00 -1.72 0.00 0.00 55.73 54.29 2fse s ARG 6 Cb 0.00 -2.52 0.02 0.00 -0.45 0.00 0.00 34.95 31.99 2fse s ARG 6 CO 0.00 0.11 -0.08 -0.06 -0.68 0.00 0.00 175.30 174.59 2fse s PHE 7 N -2.18 1.20 -0.06 -0.53 0.08 -1.26 -5.14 117.98 110.09 2fse s PHE 7 Ca 0.48 -0.46 0.04 0.00 0.12 0.00 0.00 56.93 57.11 2fse s PHE 7 Cb -0.11 -0.97 0.00 0.00 -0.57 0.00 0.00 43.02 41.38 2fse s PHE 7 CO 0.29 -0.31 -0.18 -1.17 -0.10 0.00 0.00 175.22 173.76 2fse s LEU 8 N 1.05 1.89 -0.19 -0.37 2.96 -1.26 -5.08 118.68 117.67 2fse s LEU 8 Ca -0.08 -0.40 0.01 0.00 -0.22 0.00 0.00 54.13 53.44 2fse s LEU 8 Cb -0.14 -1.06 0.04 0.00 0.50 0.00 0.00 46.19 45.52 2fse s LEU 8 CO -0.00 0.12 -0.13 0.86 -1.32 0.00 0.00 176.35 175.88 2fse s TRP 9 N 0.29 2.51 0.39 5.38 -0.00 -1.26 -1.85 118.94 124.39 2fse s TRP 9 Ca -0.11 -1.60 0.07 0.00 -0.00 0.00 0.00 56.10 54.47 2fse s TRP 9 Cb -0.15 -1.71 0.00 0.00 -0.00 0.00 0.00 33.47 31.62 2fse s TRP 9 CO 0.04 -0.75 0.54 -0.65 -0.00 0.00 0.00 176.95 176.13 2fse s GLN 10 N 1.37 2.94 -0.23 5.86 -0.21 0.23 -4.98 119.66 124.64 2fse s GLN 10 Ca 0.00 -1.10 -0.13 0.00 0.02 0.00 0.00 55.36 54.15 2fse s GLN 10 Cb -0.15 -2.77 0.07 0.00 1.00 0.00 0.00 33.01 31.16 2fse s GLN 10 CO -0.09 -0.15 0.57 -1.17 -2.12 0.00 0.00 175.29 172.33 2fse s LEU 11 N -4.30 -0.60 -0.04 2.90 2.96 -1.26 -1.41 118.68 116.93 2fse s LEU 11 Ca 0.51 1.26 -0.00 0.00 -0.22 0.00 0.00 54.13 55.67 2fse s LEU 11 Cb -0.10 1.95 0.03 0.00 0.50 0.00 0.00 46.19 48.57 2fse s LEU 11 CO 0.33 -0.22 0.02 -0.54 -1.32 0.00 0.00 176.35 174.61 2fse s LYS 12 N 1.56 0.25 -0.39 1.98 1.02 -0.36 -4.98 119.74 118.83 2fse s LYS 12 Ca -0.10 0.16 -0.04 0.00 0.02 0.00 0.00 55.97 56.01 2fse s LYS 12 Cb -0.07 -0.56 0.09 0.00 -0.52 0.00 0.00 37.83 36.77 2fse s LYS 12 CO -0.17 -0.21 0.18 -0.06 -0.92 0.00 0.00 175.35 174.17 2fse s PHE 13 N 1.46 3.46 -0.05 3.18 0.40 -1.26 -1.93 117.98 123.24 2fse s PHE 13 Ca -0.04 -2.09 0.01 0.00 -0.60 0.00 0.00 56.93 54.22 2fse s PHE 13 Cb -0.13 -2.95 -0.03 0.00 0.51 0.00 0.00 43.02 40.42 2fse s PHE 13 CO -0.03 -0.91 -0.07 -1.83 0.70 0.00 0.00 175.22 173.08 2fse s GLU 14 N 1.24 2.70 -0.18 0.44 -1.05 -0.72 -5.01 118.70 116.12 2fse s GLU 14 Ca 0.04 -0.59 0.00 0.00 -0.15 0.00 0.00 54.97 54.27 2fse s GLU 14 Cb -0.22 -2.57 0.01 0.00 -0.44 0.00 0.00 34.13 30.91 2fse s GLU 14 CO -0.02 0.65 -0.17 0.00 0.95 0.00 0.00 175.26 176.67 2fse s HIS 16 N 1.20 3.05 -0.01 0.00 3.76 -0.21 -4.97 115.29 118.11 2fse s HIS 16 Ca 0.02 -0.28 0.05 0.00 -0.15 0.00 0.00 55.06 54.71 2fse s HIS 16 Cb -0.14 -1.99 -0.03 0.00 1.11 0.00 0.00 32.58 31.53 2fse s HIS 16 CO -0.08 -0.04 -0.17 -0.06 -0.85 0.00 0.00 174.74 173.54 2fse s PHE 17 N 0.45 2.61 -0.04 1.40 0.08 -1.26 -1.16 117.98 120.06 2fse s PHE 17 Ca -0.02 -0.23 0.00 0.00 0.12 0.00 0.00 56.93 56.80 2fse s PHE 17 Cb -0.14 -1.56 0.03 0.00 -0.57 0.00 0.00 43.02 40.78 2fse s PHE 17 CO 0.02 0.18 -0.01 -0.06 -0.10 0.00 0.00 175.22 175.26 2fse s PHE 18 N -0.79 0.44 -0.82 0.36 0.40 -0.76 -4.89 117.98 111.92 2fse s PHE 18 Ca 0.12 -0.06 -0.02 0.00 -0.60 0.00 0.00 56.93 56.38 2fse s PHE 18 Cb -0.10 -0.51 -0.02 0.00 0.51 0.00 0.00 43.02 42.89 2fse s PHE 18 CO 0.02 -0.17 0.76 0.09 0.70 0.00 0.00 175.22 176.62 2fse n ASN 19 N 4.25 -7.31 0.00 1.36 5.03 -1.26 -3.02 115.26 114.31 2fse n ASN 19 Ca -0.23 -0.28 0.00 0.00 0.87 0.00 0.00 54.58 54.94 2fse n ASN 19 Cb 0.50 -5.19 0.00 0.00 -1.02 0.00 0.00 39.78 34.07 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 -1.58 1.04 1.94 7.41 0.00 -1.26 -2.15 105.19 110.58 2fse n GLY 20 Ca -0.02 0.36 -0.01 0.00 0.00 0.00 0.00 46.02 46.34 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 0.30 0.02 2.61 -2.24 -1.26 -4.87 114.28 108.84 2fse n THR 21 Ca 0.00 -1.20 -0.20 0.00 -2.27 0.00 0.00 64.05 60.39 2fse n THR 21 Cb 0.00 0.94 -0.14 0.00 -2.10 0.00 0.00 70.33 69.03 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 1.12 0.24 -5.12 -0.78 4.81 -1.51 -3.44 114.58 109.91 2fse h GLU 22 Ca -0.34 -0.42 -0.66 0.00 -0.13 0.00 0.00 59.36 57.81 2fse h GLU 22 Cb 1.50 0.16 -0.34 0.00 0.63 0.00 0.00 28.75 30.69 2fse h GLU 22 CO -0.04 1.20 -0.86 0.50 -0.73 0.00 0.00 179.01 179.07 2fse s ARG 23 N -2.42 2.87 -0.00 1.92 3.00 -1.17 -5.06 118.95 118.10 2fse s ARG 23 Ca -0.16 -0.80 0.02 0.00 -1.00 0.00 0.00 55.73 53.79 2fse s ARG 23 Cb 0.01 -2.34 -0.01 0.00 0.00 0.00 0.00 34.95 32.62 2fse s ARG 23 CO 0.79 -0.02 -0.06 0.08 0.00 0.00 0.00 175.30 176.08 2fse s VAL 24 N 0.85 0.50 -0.19 7.11 1.01 -1.26 -1.83 120.40 126.58 2fse s VAL 24 Ca -0.07 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 61.61 2fse s VAL 24 Cb -0.15 -0.43 0.03 0.00 0.00 0.00 0.00 36.38 35.83 2fse s VAL 24 CO -0.02 0.11 -0.17 -0.60 0.00 0.00 0.00 175.10 174.42 2fse s ARG 25 N -0.22 2.72 0.03 2.72 3.52 -0.31 -4.96 118.95 122.46 2fse s ARG 25 Ca 0.02 -0.91 -0.20 0.00 -0.13 0.00 0.00 55.73 54.51 2fse s ARG 25 Cb -0.03 -2.59 -0.06 0.00 -1.56 0.00 0.00 34.95 30.72 2fse s ARG 25 CO -0.00 -0.30 0.57 -1.17 -0.81 0.00 0.00 175.30 173.59 2fse s LEU 26 N 1.28 4.47 -0.21 -0.88 2.96 -1.26 -1.04 118.68 123.99 2fse s LEU 26 Ca 0.02 1.20 -0.04 0.00 -0.22 0.00 0.00 54.13 55.09 2fse s LEU 26 Cb -0.15 -2.89 0.07 0.00 0.50 0.00 0.00 46.19 43.73 2fse s LEU 26 CO -0.11 0.20 0.09 -0.22 -1.32 0.00 0.00 176.35 174.99 2fse s LEU 27 N -0.68 0.73 -0.32 -0.68 2.96 -0.21 -1.12 118.68 119.36 2fse s LEU 27 Ca 0.30 -0.89 -0.09 0.00 -0.22 0.00 0.00 54.13 53.22 2fse s LEU 27 Cb -0.19 -0.40 0.01 0.00 0.50 0.00 0.00 46.19 46.11 2fse s LEU 27 CO 0.18 -0.36 0.15 -0.70 -1.32 0.00 0.00 176.35 174.29 2fse s GLU 28 N 2.02 3.14 -0.05 1.98 2.12 0.28 -1.76 118.70 126.44 2fse s GLU 28 Ca 0.03 -0.85 0.03 0.00 0.36 0.00 0.00 54.97 54.54 2fse s GLU 28 Cb -0.16 -3.56 0.01 0.00 0.26 0.00 0.00 34.13 30.67 2fse s GLU 28 CO -0.16 -0.50 -0.12 -0.98 -0.54 0.00 0.00 175.26 172.95 2fse s ARG 29 N 1.57 1.55 -0.24 4.30 1.70 -0.81 0.98 118.95 127.99 2fse s ARG 29 Ca 0.03 -0.43 -0.08 0.00 -0.47 0.00 0.00 55.73 54.79 2fse s ARG 29 Cb -0.18 -1.32 -0.03 0.00 -0.57 0.00 0.00 34.95 32.85 2fse s ARG 29 CO 0.05 0.09 0.09 0.00 -1.08 0.00 0.00 175.30 174.46 2fse s ILE 31 N 1.41 3.66 0.00 0.00 1.01 -0.50 -2.00 121.20 124.78 2fse s ILE 31 Ca 0.06 -0.61 0.00 0.00 0.00 0.00 0.00 60.65 60.10 2fse s ILE 31 Cb -0.15 -2.53 0.00 0.00 0.01 0.00 0.00 42.46 39.79 2fse s ILE 31 CO 0.05 0.51 0.00 0.00 0.00 0.00 0.00 174.94 175.50 2fse n TYR 32 N 1.95 0.00 -0.38 3.97 9.36 0.11 0.75 117.16 132.91 2fse n TYR 32 Ca -0.17 0.00 -0.07 0.00 3.32 0.00 0.00 57.90 60.98 2fse n TYR 32 Cb 0.53 0.00 -0.05 0.00 -0.63 0.00 0.00 39.34 39.19 2fse n TYR 32 CO 0.00 0.00 0.00 -0.91 0.22 0.00 0.00 176.86 176.17 2fse h ASN 33 N 0.00 -1.84 0.00 2.98 2.35 -1.78 -3.30 115.58 113.98 2fse h ASN 33 Ca 0.00 0.31 0.00 0.00 -0.55 0.00 0.00 56.30 56.06 2fse h ASN 33 Cb 0.00 0.86 0.00 0.00 0.05 0.00 0.00 38.32 39.23 2fse h ASN 33 CO 0.00 -0.27 0.00 0.00 -1.65 0.00 0.00 177.43 175.51 2fse n GLN 34 N -5.35 0.00 -3.37 0.81 6.02 -1.26 -4.81 117.38 109.43 2fse n GLN 34 Ca 0.05 -0.02 -0.42 0.00 -0.01 0.00 0.00 57.00 56.60 2fse n GLN 34 Cb 0.32 -0.05 -0.09 0.00 1.02 0.00 0.00 30.24 31.44 2fse n GLN 34 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 2fse s GLU 35 N 0.00 3.38 -0.06 -1.09 2.12 -1.26 -5.05 118.70 116.75 2fse s GLU 35 Ca 0.00 -0.55 -0.30 0.00 0.36 0.00 0.00 54.97 54.49 2fse s GLU 35 Cb 0.00 -3.87 -0.05 0.00 0.26 0.00 0.00 34.13 30.47 2fse s GLU 35 CO 0.00 -0.65 1.55 -2.00 -0.54 0.00 0.00 175.26 173.62 2fse s GLU 36 N 2.06 4.20 -0.15 4.30 2.12 -1.26 0.03 118.70 130.01 2fse s GLU 36 Ca 0.12 2.08 -0.10 0.00 0.36 0.00 0.00 54.97 57.42 2fse s GLU 36 Cb -0.17 -3.88 -0.04 0.00 0.26 0.00 0.00 34.13 30.30 2fse s GLU 36 CO 0.12 -0.79 -0.15 -1.13 -0.54 0.00 0.00 175.26 172.77 2fse n SER 37 N 6.76 1.82 -4.46 -1.70 3.41 -0.85 -4.31 113.62 114.29 2fse n SER 37 Ca 0.16 0.61 -0.22 0.00 -0.26 0.00 0.00 58.87 59.16 2fse n SER 37 Cb 0.43 -0.88 -0.11 0.00 -0.26 0.00 0.00 64.21 63.40 2fse n SER 37 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2fse s VAL 38 N -2.27 1.49 -0.09 -3.33 -7.23 -1.20 0.58 120.40 108.34 2fse s VAL 38 Ca -0.16 -2.05 -0.30 0.00 -1.81 0.00 0.00 61.98 57.66 2fse s VAL 38 Cb 0.02 -2.67 0.11 0.00 0.56 0.00 0.00 36.38 34.40 2fse s VAL 38 CO 0.26 -0.13 0.91 0.00 -0.31 0.00 0.00 175.10 175.83 2fse s ARG 39 N -3.80 0.74 -0.21 4.82 1.70 -0.79 -1.99 118.95 119.42 2fse s ARG 39 Ca 0.33 0.00 0.01 0.00 -0.47 0.00 0.00 55.73 55.61 2fse s ARG 39 Cb 0.07 0.35 0.03 0.00 -0.57 0.00 0.00 34.95 34.82 2fse s ARG 39 CO 0.14 -0.27 -0.16 0.12 -1.08 0.00 0.00 175.30 174.05 2fse s PHE 40 N -1.83 2.94 -0.29 5.89 2.19 0.27 -0.57 117.98 126.58 2fse s PHE 40 Ca -0.01 -1.81 -0.07 0.00 0.33 0.00 0.00 56.93 55.37 2fse s PHE 40 Cb -0.01 -1.94 0.00 0.00 -1.31 0.00 0.00 43.02 39.77 2fse s PHE 40 CO -0.01 -0.82 0.08 0.34 1.83 0.00 0.00 175.22 176.65 2fse s ASP 41 N 1.24 5.16 0.56 6.13 -1.08 -1.26 -0.56 116.67 126.86 2fse s ASP 41 Ca 0.01 -0.60 0.29 0.00 -0.52 0.00 0.00 52.55 51.73 2fse s ASP 41 Cb -0.15 -1.90 1.46 0.00 -1.46 0.00 0.00 42.92 40.87 2fse s ASP 41 CO -0.10 -0.16 1.91 0.77 0.52 0.00 0.00 175.17 178.10 2fse h SER 42 N 8.25 0.00 0.00 -0.34 4.64 -1.50 0.31 113.55 124.92 2fse h SER 42 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 2fse h SER 42 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 2fse h SER 42 CO 0.60 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 177.03 2fse n ASP 43 N -4.07 0.00 0.00 4.97 9.92 -1.26 -3.15 116.55 122.96 2fse n ASP 43 Ca 0.13 -0.72 0.00 0.00 -0.53 0.00 0.00 54.79 53.67 2fse n ASP 43 Cb 0.79 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.27 2fse n ASP 43 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2fse n VAL 44 N -0.89 0.00 -1.32 2.53 0.31 0.96 -5.07 118.33 114.84 2fse n VAL 44 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 2fse n VAL 44 Cb 0.05 -0.27 0.00 0.00 -0.91 0.00 0.00 33.84 32.71 2fse n VAL 44 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2fse n GLY 45 N 2.56 0.68 3.61 2.92 0.00 -0.33 -5.06 105.19 109.57 2fse n GLY 45 Ca 0.00 -0.73 -0.06 0.00 0.00 0.00 0.00 46.02 45.22 2fse n GLY 45 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2fse s GLU 46 N -2.81 0.34 0.45 1.61 -1.05 -1.26 -4.94 118.70 111.04 2fse s GLU 46 Ca 0.00 0.10 -0.24 0.00 -0.15 0.00 0.00 54.97 54.68 2fse s GLU 46 Cb 0.00 0.16 -0.08 0.00 -0.44 0.00 0.00 34.13 33.77 2fse s GLU 46 CO 0.00 -0.10 1.29 0.71 0.95 0.00 0.00 175.26 178.11 2fse s TYR 47 N -0.96 2.70 0.11 4.83 2.02 -1.26 -4.26 117.35 120.53 2fse s TYR 47 Ca 0.03 1.42 0.05 0.00 -0.37 0.00 0.00 57.07 58.20 2fse s TYR 47 Cb -0.01 -3.65 -0.04 0.00 -0.40 0.00 0.00 41.96 37.86 2fse s TYR 47 CO -0.04 -2.18 -0.12 1.03 -1.57 0.00 0.00 175.55 172.67 2fse s ARG 48 N -2.49 0.94 -0.07 -0.62 1.81 0.26 -4.93 118.95 113.85 2fse s ARG 48 Ca 0.62 -1.18 -0.13 0.00 -1.72 0.00 0.00 55.73 53.32 2fse s ARG 48 Cb -0.37 -0.75 -0.05 0.00 -0.45 0.00 0.00 34.95 33.33 2fse s ARG 48 CO 0.46 0.14 0.32 0.00 -0.68 0.00 0.00 175.30 175.54 2fse s ALA 49 N -2.19 3.70 -0.15 2.13 0.00 -1.26 -1.89 121.76 122.10 2fse s ALA 49 Ca 0.07 -0.38 0.18 0.00 0.00 0.00 0.00 51.96 51.83 2fse s ALA 49 Cb -0.05 -2.30 -0.25 0.00 0.00 0.00 0.00 23.12 20.52 2fse s ALA 49 CO 0.02 0.39 0.26 0.28 0.00 0.00 0.00 175.76 176.71 2fse n VAL 50 N 2.39 1.21 -3.59 0.00 0.31 0.19 -4.96 118.33 113.89 2fse n VAL 50 Ca -0.15 -0.79 0.00 0.00 -0.01 0.00 0.00 64.34 63.40 2fse n VAL 50 Cb 0.53 -0.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.96 2fse n VAL 50 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2fse n THR 51 N -2.73 0.00 -0.03 2.52 -2.24 -1.18 -5.02 114.28 105.60 2fse n THR 51 Ca -0.25 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.39 2fse n THR 51 Cb 1.04 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 69.17 2fse n THR 51 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2fse h GLU 52 N 0.00 0.13 -1.10 -0.78 4.81 -1.95 -3.31 114.58 112.38 2fse h GLU 52 Ca 0.00 -0.10 0.30 0.00 -0.13 0.00 0.00 59.36 59.43 2fse h GLU 52 Cb 0.00 0.02 -0.09 0.00 0.63 0.00 0.00 28.75 29.31 2fse h GLU 52 CO 0.00 0.76 0.73 -0.07 -0.73 0.00 0.00 179.01 179.69 2fse h LEU 53 N -0.46 0.32 -0.28 1.64 3.38 -1.97 -2.59 115.31 115.35 2fse h LEU 53 Ca -0.01 0.07 -0.16 0.00 0.09 0.00 0.00 57.88 57.87 2fse h LEU 53 Cb 0.78 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.53 2fse h LEU 53 CO 0.03 0.04 -0.78 1.23 0.09 0.00 0.00 178.44 179.05 2fse h GLY 54 N 0.27 0.00 -0.74 0.83 0.00 -1.73 -3.37 103.07 98.33 2fse h GLY 54 Ca 0.61 0.00 0.15 0.00 0.00 0.00 0.00 47.33 48.09 2fse h GLY 54 CO -0.24 0.00 -0.18 0.54 0.00 0.00 0.00 176.54 176.66 2fse n ARG 55 N -3.46 -0.07 0.04 4.80 1.74 -0.98 -0.48 116.66 118.25 2fse n ARG 55 Ca -0.00 1.15 -0.12 0.00 -0.77 0.00 0.00 57.85 58.11 2fse n ARG 55 Cb 0.79 -1.72 -0.08 0.00 -1.02 0.00 0.00 32.46 30.43 2fse n ARG 55 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 2fse h PRO 56 N 0.00 -0.49 -0.58 5.56 0.11 -1.80 -0.94 132.00 133.86 2fse h PRO 56 Ca 0.36 0.03 0.07 0.00 0.11 0.00 0.00 66.00 66.57 2fse h PRO 56 Cb 0.55 0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.73 2fse h PRO 56 CO -0.76 -0.33 0.38 -0.44 -0.21 0.00 0.00 178.00 176.65 2fse h ASP 57 N -0.51 0.44 -0.18 -2.05 3.32 -1.05 0.10 116.42 116.49 2fse h ASP 57 Ca 0.01 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.08 2fse h ASP 57 Cb 0.55 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 2fse h ASP 57 CO -0.27 0.28 0.12 0.00 -1.72 0.00 0.00 179.24 177.65 2fse h ALA 58 N 1.69 1.98 0.00 3.45 0.00 0.17 -0.77 119.26 125.78 2fse h ALA 58 Ca 0.25 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.05 2fse h ALA 58 Cb 0.36 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2fse h ALA 58 CO -0.07 -0.01 -0.79 0.93 0.00 0.00 0.00 179.25 179.31 2fse h GLU 59 N 0.15 0.00 -1.00 0.00 4.39 0.28 -3.12 114.58 115.28 2fse h GLU 59 Ca 0.07 0.00 0.19 0.00 0.34 0.00 0.00 59.36 59.97 2fse h GLU 59 Cb 0.11 0.00 -0.11 0.00 -0.10 0.00 0.00 28.75 28.66 2fse h GLU 59 CO -0.01 0.48 0.61 -0.92 -1.16 0.00 0.00 179.01 178.01 2fse h TYR 60 N -1.00 1.06 0.13 4.33 3.20 -1.00 -1.94 116.97 121.74 2fse h TYR 60 Ca -0.15 0.03 -0.19 0.00 3.14 0.00 0.00 58.73 61.56 2fse h TYR 60 Cb 0.85 -0.32 0.02 0.00 1.54 0.00 0.00 36.73 38.82 2fse h TYR 60 CO -0.04 0.23 -0.81 -1.49 -1.64 0.00 0.00 178.16 174.41 2fse h TRP 61 N 0.76 0.57 0.00 -3.82 6.55 -1.33 -3.16 115.95 115.52 2fse h TRP 61 Ca 0.58 -0.40 0.00 0.00 0.95 0.00 0.00 58.89 60.02 2fse h TRP 61 Cb 0.91 -0.03 0.00 0.00 -0.86 0.00 0.00 29.16 29.18 2fse h TRP 61 CO -0.00 1.30 0.00 0.09 -1.05 0.00 0.00 178.44 178.77 2fse n ASN 62 N -4.12 0.00 0.02 -3.49 3.02 -0.92 -0.48 115.26 109.28 2fse n ASN 62 Ca -0.13 0.46 -0.02 0.00 -0.03 0.00 0.00 54.58 54.85 2fse n ASN 62 Cb 0.81 -0.46 -0.10 0.00 -0.61 0.00 0.00 39.78 39.42 2fse n ASN 62 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2fse h SER 63 N 0.00 0.00 -1.16 6.41 4.64 -1.33 -3.43 113.55 118.67 2fse h SER 63 Ca 0.00 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.71 2fse h SER 63 Cb 0.01 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.00 2fse h SER 63 CO 0.00 0.70 1.51 -1.10 -0.87 0.00 0.00 176.83 177.07 2fse s GLN 64 N -2.83 3.62 0.36 4.77 -0.21 0.37 -4.89 119.66 120.84 2fse s GLN 64 Ca -0.03 -1.22 0.07 0.00 0.02 0.00 0.00 55.36 54.20 2fse s GLN 64 Cb 0.08 -5.35 0.77 0.00 1.00 0.00 0.00 33.01 29.52 2fse s GLN 64 CO 0.81 -2.19 1.93 0.87 -2.12 0.00 0.00 175.29 174.59 2fse h LYS 65 N 9.59 0.71 -0.00 2.91 1.57 -1.84 0.14 116.57 129.65 2fse h LYS 65 Ca 0.22 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.92 2fse h LYS 65 Cb 1.00 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.15 2fse h LYS 65 CO 1.41 0.47 -0.16 -0.44 -0.57 0.00 0.00 179.45 180.16 2fse h ASP 66 N 0.73 0.01 0.15 0.86 3.45 -1.96 0.45 116.42 120.11 2fse h ASP 66 Ca 0.36 -0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.81 2fse h ASP 66 Cb 0.43 -0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.20 2fse h ASP 66 CO -0.14 0.17 -0.07 0.25 -1.57 0.00 0.00 179.24 177.88 2fse h LEU 67 N 0.01 -0.17 -0.24 1.55 5.85 -1.14 -2.60 115.31 118.58 2fse h LEU 67 Ca -0.00 -0.38 0.02 0.00 0.84 0.00 0.00 57.88 58.36 2fse h LEU 67 Cb 0.30 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 2fse h LEU 67 CO 0.02 0.40 0.11 -0.07 -0.34 0.00 0.00 178.44 178.56 2fse h LEU 68 N -0.84 0.16 -1.53 2.25 3.38 -0.98 0.97 115.31 118.72 2fse h LEU 68 Ca -0.02 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.97 2fse h LEU 68 Cb 0.53 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 2fse h LEU 68 CO 0.03 0.12 0.32 -0.33 0.09 0.00 0.00 178.44 178.68 2fse h GLU 69 N 0.24 0.63 -0.18 1.13 5.08 -1.02 0.29 114.58 120.74 2fse h GLU 69 Ca 0.10 -0.04 -0.18 0.00 -1.00 0.00 0.00 59.36 58.24 2fse h GLU 69 Cb 0.03 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.15 2fse h GLU 69 CO -0.07 0.42 -0.57 0.37 -1.00 0.00 0.00 179.01 178.15 2fse h GLN 70 N 0.65 0.71 -0.02 2.33 -0.00 -1.01 -2.93 115.11 114.85 2fse h GLN 70 Ca 0.18 -0.52 -0.00 0.00 -0.00 0.00 0.00 58.65 58.31 2fse h GLN 70 Cb -0.07 0.09 -0.00 0.00 0.00 0.00 0.00 27.48 27.50 2fse h GLN 70 CO -0.04 1.14 0.01 0.00 0.00 0.00 0.00 178.83 179.94 2fse h ARG 71 N 0.42 0.04 -0.76 1.69 2.47 0.19 -1.18 114.38 117.24 2fse h ARG 71 Ca -0.02 -0.01 0.08 0.00 -1.26 0.00 0.00 59.98 58.78 2fse h ARG 71 Cb 1.19 -0.01 -0.05 0.00 -1.65 0.00 0.00 29.97 29.46 2fse h ARG 71 CO 0.12 0.17 0.50 0.00 0.56 0.00 0.00 179.97 181.32 2fse h ARG 72 N -0.11 0.71 0.00 0.04 3.08 -0.52 -0.26 114.38 117.32 2fse h ARG 72 Ca 0.01 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2fse h ARG 72 Cb 0.15 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.04 2fse h ARG 72 CO -0.00 0.47 -0.10 0.00 -1.07 0.00 0.00 179.97 179.26 2fse h ALA 73 N 1.60 0.94 -0.23 0.04 0.00 -1.33 -3.31 119.26 116.98 2fse h ALA 73 Ca 0.34 0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.32 2fse h ALA 73 Cb 0.38 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2fse h ALA 73 CO -0.12 0.00 0.62 0.00 0.00 0.00 0.00 179.25 179.74 2fse h ALA 74 N 2.18 1.87 -0.18 0.00 0.00 0.25 -0.03 119.26 123.34 2fse h ALA 74 Ca 0.00 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.96 2fse h ALA 74 Cb 0.91 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 2fse h ALA 74 CO 0.00 -0.73 0.17 0.28 0.00 0.00 0.00 179.25 178.96 2fse h VAL 75 N 0.00 0.65 0.00 0.00 2.07 -1.72 -0.11 116.25 117.14 2fse h VAL 75 Ca 0.11 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.48 2fse h VAL 75 Cb 1.34 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.96 2fse h VAL 75 CO -0.00 0.00 -1.33 0.47 0.02 0.00 0.00 177.57 176.73 2fse n ASP 76 N -4.08 1.15 0.06 0.57 8.00 -0.05 -2.24 116.55 119.97 2fse n ASP 76 Ca 0.02 0.19 0.21 0.00 0.71 0.00 0.00 54.79 55.92 2fse n ASP 76 Cb 0.29 -0.45 0.74 0.00 -0.02 0.00 0.00 41.12 41.68 2fse n ASP 76 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 2fse h THR 77 N -0.49 0.43 0.00 -3.53 1.35 -1.54 -1.54 112.91 107.58 2fse h THR 77 Ca -0.23 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 2fse h THR 77 Cb 1.03 0.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.09 2fse h THR 77 CO -0.14 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.13 2fse n TYR 78 N -3.83 0.00 0.00 4.73 9.36 -0.09 -4.56 117.16 122.77 2fse n TYR 78 Ca 0.08 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.30 2fse n TYR 78 Cb 0.65 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.36 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 0.00 0.00 0.24 0.00 3.08 -1.43 -1.72 114.38 114.55 2fse h ARG 80 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2fse h ARG 80 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2fse h ARG 80 CO 0.00 0.00 -0.12 1.25 -1.07 0.00 0.00 179.97 180.03 2fse h HIS 81 N 0.00 -0.30 -0.29 3.04 2.76 -0.32 -3.21 115.15 116.83 2fse h HIS 81 Ca 0.00 -0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 58.06 2fse h HIS 81 Cb 0.67 0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.72 2fse h HIS 81 CO 0.00 -0.06 -0.25 -0.91 -1.30 0.00 0.00 177.93 175.41 2fse h ASN 82 N -1.04 0.56 -0.68 3.26 2.35 -0.58 -2.84 115.58 116.62 2fse h ASN 82 Ca -0.03 -0.19 0.13 0.00 -0.55 0.00 0.00 56.30 55.65 2fse h ASN 82 Cb 0.38 -0.15 -0.09 0.00 0.05 0.00 0.00 38.32 38.50 2fse h ASN 82 CO 0.06 0.80 0.22 0.22 -1.65 0.00 0.00 177.43 177.08 2fse h TYR 83 N 0.49 0.37 0.00 1.19 5.03 -1.46 0.35 116.97 122.95 2fse h TYR 83 Ca 0.07 0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.42 2fse h TYR 83 Cb 0.69 -0.06 0.00 0.00 1.55 0.00 0.00 36.73 38.91 2fse h TYR 83 CO 0.03 0.03 0.00 0.78 -1.32 0.00 0.00 178.16 177.67 2fse h GLY 84 N 0.36 0.00 0.95 1.82 0.00 -1.50 -0.82 103.07 103.88 2fse h GLY 84 Ca 0.36 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.41 2fse h GLY 84 CO -0.40 0.00 -1.31 -2.08 0.00 0.00 0.00 176.54 172.76 2fse h VAL 85 N 0.00 1.27 -0.42 4.60 2.07 -0.77 -3.36 116.25 119.65 2fse h VAL 85 Ca 0.00 -2.59 0.00 0.00 0.82 0.00 0.00 66.70 64.93 2fse h VAL 85 Cb 0.70 3.02 0.00 0.00 -1.52 0.00 0.00 31.29 33.49 2fse h VAL 85 CO 0.00 0.78 0.00 0.61 0.02 0.00 0.00 177.57 178.98 2fse n GLY 86 N 1.73 1.81 0.35 2.17 0.00 -0.30 -4.68 105.19 106.27 2fse n GLY 86 Ca -0.18 -0.71 -0.12 0.00 0.00 0.00 0.00 46.02 45.01 2fse n GLY 86 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2fse h GLU 87 N 4.25 -0.51 -1.12 1.61 4.81 -1.30 -1.30 114.58 121.02 2fse h GLU 87 Ca 0.00 0.04 0.38 0.00 -0.13 0.00 0.00 59.36 59.65 2fse h GLU 87 Cb 0.96 0.12 -0.14 0.00 0.63 0.00 0.00 28.75 30.31 2fse h GLU 87 CO 0.00 -0.34 0.68 0.66 -0.73 0.00 0.00 179.01 179.27 2fse h SER 88 N -0.53 0.37 -0.01 1.04 4.64 -1.87 -0.18 113.55 117.01 2fse h SER 88 Ca -0.00 0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 2fse h SER 88 Cb 0.54 0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2fse h SER 88 CO -0.22 -0.20 -0.45 2.22 -0.87 0.00 0.00 176.83 177.31 2fse n PHE 89 N -4.93 0.00 0.00 4.77 -1.74 -1.11 -4.28 117.46 110.17 2fse n PHE 89 Ca 0.35 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.24 2fse n PHE 89 Cb 1.21 0.00 0.00 0.00 1.52 0.00 0.00 39.48 42.21 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 -0.30 0.00 -0.24 1.97 -2.24 -0.36 -4.35 114.28 108.76 2fse n THR 90 Ca 0.07 0.15 0.13 0.00 -2.27 0.00 0.00 64.05 62.13 2fse n THR 90 Cb 0.36 -1.11 0.42 0.00 -2.10 0.00 0.00 70.33 67.90 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 0.82 -0.31 2.28 2.07 -1.24 -2.63 116.25 117.23 2fse h VAL 91 Ca 0.00 -0.21 -0.14 0.00 0.82 0.00 0.00 66.70 67.17 2fse h VAL 91 Cb 0.00 0.16 -0.08 0.00 -1.52 0.00 0.00 31.29 29.84 2fse h VAL 91 CO 0.00 0.11 -0.09 0.00 0.02 0.00 0.00 177.57 177.61 2fse n GLN 92 N -4.54 1.94 -2.44 1.57 3.00 -1.04 -5.02 117.38 110.85 2fse n GLN 92 Ca 0.17 -3.13 -0.42 0.00 -0.01 0.00 0.00 57.00 53.61 2fse n GLN 92 Cb 0.50 -1.80 -0.03 0.00 0.00 0.00 0.00 30.24 28.91 2fse n GLN 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.06 177.56 2fse s ARG 93 N -3.18 4.48 -0.04 -1.09 3.52 -0.99 -4.90 118.95 116.74 2fse s ARG 93 Ca 0.44 1.77 0.00 0.00 -0.13 0.00 0.00 55.73 57.80 2fse s ARG 93 Cb 0.39 -3.31 0.02 0.00 -1.56 0.00 0.00 34.95 30.49 2fse s ARG 93 CO 0.01 -0.14 -0.02 1.03 -0.81 0.00 0.00 175.30 175.37 2fse s ARG 94 N 0.49 0.58 -0.14 5.12 0.52 -1.26 -3.93 118.95 120.33 2fse s ARG 94 Ca 0.55 0.01 -0.02 0.00 -0.52 0.00 0.00 55.73 55.75 2fse s ARG 94 Cb -0.30 -0.73 0.05 0.00 0.52 0.00 0.00 34.95 34.49 2fse s ARG 94 CO 0.32 -0.15 0.03 0.08 0.02 0.00 0.00 175.30 175.60 2fse s VAL 95 N 1.18 0.39 0.47 3.52 1.01 0.83 -4.97 120.40 122.85 2fse s VAL 95 Ca -0.07 -0.22 -0.24 0.00 0.00 0.00 0.00 61.98 61.45 2fse s VAL 95 Cb -0.14 -0.77 -0.08 0.00 0.00 0.00 0.00 36.38 35.40 2fse s VAL 95 CO -0.02 -0.01 1.41 -0.62 0.00 0.00 0.00 175.10 175.86 2fse n GLU 96 N 5.12 2.11 -3.19 2.72 1.02 -1.26 -2.42 120.64 124.73 2fse n GLU 96 Ca -0.08 0.76 -0.39 0.00 -0.02 0.00 0.00 57.16 57.43 2fse n GLU 96 Cb 0.49 -2.61 -0.05 0.00 -0.02 0.00 0.00 31.44 29.25 2fse n GLU 96 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2fse s PRO 97 N -2.54 4.37 -0.16 3.49 0.04 -1.26 -4.46 135.00 134.49 2fse s PRO 97 Ca 0.64 0.67 -0.18 0.00 0.04 0.00 0.00 61.00 62.16 2fse s PRO 97 Cb -0.44 -3.42 -0.04 0.00 0.04 0.00 0.00 34.50 30.64 2fse s PRO 97 CO 0.56 0.17 0.47 0.95 0.04 0.00 0.00 177.00 179.18 2fse s THR 98 N 0.53 5.17 -0.12 1.26 -4.23 -0.57 -4.91 115.64 112.77 2fse s THR 98 Ca 0.31 0.89 -0.03 0.00 -1.18 0.00 0.00 61.69 61.69 2fse s THR 98 Cb -0.17 -3.80 -0.03 0.00 1.34 0.00 0.00 72.50 69.84 2fse s THR 98 CO 0.15 0.28 -0.01 -0.69 -0.54 0.00 0.00 174.62 173.80 2fse s VAL 99 N 0.99 4.13 -0.01 2.29 1.01 -1.26 -2.10 120.40 125.45 2fse s VAL 99 Ca 0.24 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 61.95 2fse s VAL 99 Cb -0.15 -2.78 -0.00 0.00 0.00 0.00 0.00 36.38 33.45 2fse s VAL 99 CO 0.09 0.54 -0.08 -0.89 0.00 0.00 0.00 175.10 174.77 2fse s THR 100 N -0.23 0.65 0.05 3.92 2.01 -0.15 -5.00 115.64 116.89 2fse s THR 100 Ca 0.05 -0.32 0.08 0.00 0.31 0.00 0.00 61.69 61.81 2fse s THR 100 Cb -0.13 -0.57 -0.03 0.00 0.01 0.00 0.00 72.50 71.79 2fse s THR 100 CO 0.02 0.20 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.22 2fse s VAL 101 N 0.01 1.91 -0.23 3.82 1.01 -1.26 0.20 120.40 125.86 2fse s VAL 101 Ca 0.00 -1.31 -0.26 0.00 0.00 0.00 0.00 61.98 60.41 2fse s VAL 101 Cb -0.06 -1.65 0.08 0.00 0.00 0.00 0.00 36.38 34.76 2fse s VAL 101 CO -0.00 0.27 0.77 -0.72 0.00 0.00 0.00 175.10 175.42 2fse s TYR 102 N -0.81 -0.70 0.17 5.22 -0.85 -0.46 -4.98 117.35 114.93 2fse s TYR 102 Ca 0.10 1.62 -0.30 0.00 -0.52 0.00 0.00 57.07 57.96 2fse s TYR 102 Cb -0.09 0.32 -0.08 0.00 0.38 0.00 0.00 41.96 42.48 2fse s TYR 102 CO 0.02 -0.40 1.33 -2.14 -1.52 0.00 0.00 175.55 172.84 2fse s PRO 103 N 0.02 4.37 -0.01 -3.49 0.02 -1.26 -1.02 135.00 133.63 2fse s PRO 103 Ca -0.02 2.06 -0.02 0.00 0.02 0.00 0.00 61.00 63.04 2fse s PRO 103 Cb -0.04 -3.21 -0.01 0.00 0.02 0.00 0.00 34.50 31.26 2fse s PRO 103 CO 0.02 -0.31 0.39 1.15 -0.33 0.00 0.00 177.00 177.92 2fse h THR 104 N 3.90 0.00 -4.23 0.99 2.02 0.47 -3.47 112.91 112.58 2fse h THR 104 Ca -0.44 -0.08 -0.48 0.00 0.77 0.00 0.00 66.41 66.18 2fse h THR 104 Cb 1.21 0.00 0.12 0.00 -1.74 0.00 0.00 68.15 67.75 2fse h THR 104 CO 0.80 0.00 0.31 -0.54 0.37 0.00 0.00 175.52 176.46 2fse s LYS 105 N -1.92 1.68 -0.33 6.66 1.02 -1.26 -4.98 119.74 120.61 2fse s LYS 105 Ca -0.01 0.58 -0.00 0.00 0.02 0.00 0.00 55.97 56.55 2fse s LYS 105 Cb 0.00 -1.88 0.08 0.00 -0.52 0.00 0.00 37.83 35.51 2fse s LYS 105 CO 0.03 -1.89 0.05 0.99 -0.92 0.00 0.00 175.35 173.62 2fse s THR 106 N -3.15 2.82 -0.25 2.17 2.01 -1.26 -4.98 115.64 113.00 2fse s THR 106 Ca 0.62 -1.81 -0.17 0.00 0.31 0.00 0.00 61.69 60.64 2fse s THR 106 Cb -0.15 -2.81 0.07 0.00 0.01 0.00 0.00 72.50 69.62 2fse s THR 106 CO 0.54 -0.36 0.64 -1.58 -0.69 0.00 0.00 174.62 173.17 2fse s GLN 107 N 1.13 0.68 1.09 4.92 0.74 -1.26 -5.16 119.66 121.80 2fse s GLN 107 Ca 0.01 1.07 -0.16 0.00 0.05 0.00 0.00 55.36 56.34 2fse s GLN 107 Cb -0.20 0.18 0.13 0.00 1.10 0.00 0.00 33.01 34.22 2fse s GLN 107 CO -0.04 -0.13 0.31 -2.30 -0.55 0.00 0.00 175.29 172.58 2fse n PRO 108 N 3.86 -1.50 -1.15 1.67 -0.02 -1.26 -4.83 135.00 131.76 2fse n PRO 108 Ca -0.19 -0.41 -0.37 0.00 -2.02 0.00 0.00 63.50 60.51 2fse n PRO 108 Cb 0.57 -1.84 0.05 0.00 -0.02 0.00 0.00 33.50 32.26 2fse n PRO 108 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2fse n LEU 109 N -2.34 -2.58 -2.08 2.45 4.32 -1.26 -3.64 117.00 111.86 2fse n LEU 109 Ca 0.03 0.48 -0.13 0.00 -0.02 0.00 0.00 56.01 56.37 2fse n LEU 109 Cb 0.59 -0.97 0.04 0.00 -1.62 0.00 0.00 43.42 41.45 2fse n LEU 109 CO 0.53 -4.50 0.10 0.00 -1.22 0.00 0.00 177.39 172.30 2fse n GLN 110 N 0.82 -3.93 0.00 3.23 1.13 -1.10 -4.99 117.38 112.52 2fse n GLN 110 Ca 0.06 0.47 0.00 0.00 -1.94 0.00 0.00 57.00 55.59 2fse n GLN 110 Cb 0.51 -4.40 0.00 0.00 0.11 0.00 0.00 30.24 26.46 2fse n GLN 110 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2fse n HIS 111 N -3.90 0.00 -1.70 1.08 8.25 -1.24 -5.06 115.22 112.65 2fse n HIS 111 Ca -0.01 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2fse n HIS 111 Cb 0.54 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.65 2fse n HIS 111 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2fse n HIS 112 N -0.01 -0.75 -3.96 4.41 8.25 -1.23 -5.04 115.22 116.89 2fse n HIS 112 Ca 0.00 0.39 -0.09 0.00 -0.26 0.00 0.00 57.72 57.75 2fse n HIS 112 Cb 0.19 -1.94 -0.08 0.00 1.12 0.00 0.00 29.99 29.29 2fse n HIS 112 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2fse s ASN 113 N -0.21 0.14 0.40 0.41 2.20 -0.58 -4.93 114.94 112.38 2fse s ASN 113 Ca -0.02 -0.86 -0.23 0.00 -0.94 0.00 0.00 52.86 50.80 2fse s ASN 113 Cb 0.00 0.37 -0.10 0.00 -2.00 0.00 0.00 41.25 39.53 2fse s ASN 113 CO 0.14 -0.80 1.00 -0.76 -2.94 0.00 0.00 177.10 173.75 2fse s LEU 114 N -2.94 4.09 -0.16 3.54 1.43 -1.26 -2.48 118.68 120.89 2fse s LEU 114 Ca 0.14 1.90 0.01 0.00 -1.03 0.00 0.00 54.13 55.15 2fse s LEU 114 Cb 0.05 -4.29 0.02 0.00 0.03 0.00 0.00 46.19 42.00 2fse s LEU 114 CO -0.04 -0.42 -0.18 -0.76 0.23 0.00 0.00 176.35 175.18 2fse s LEU 115 N -2.77 1.95 -0.15 1.79 1.43 0.31 0.11 118.68 121.35 2fse s LEU 115 Ca 0.59 -0.58 -0.04 0.00 -1.03 0.00 0.00 54.13 53.07 2fse s LEU 115 Cb -0.18 -1.35 -0.03 0.00 0.03 0.00 0.00 46.19 44.66 2fse s LEU 115 CO 0.22 -0.01 -0.02 -0.69 0.23 0.00 0.00 176.35 176.09 2fse s VAL 116 N 1.30 4.10 -0.40 -1.59 1.01 -0.19 -0.05 120.40 124.57 2fse s VAL 116 Ca 0.03 -0.29 -0.04 0.00 0.00 0.00 0.00 61.98 61.69 2fse s VAL 116 Cb -0.13 -2.79 0.10 0.00 0.00 0.00 0.00 36.38 33.56 2fse s VAL 116 CO -0.11 0.50 0.20 0.00 0.00 0.00 0.00 175.10 175.70 2fse s SER 118 N 1.84 6.77 -0.41 0.00 0.15 0.13 -2.44 113.70 119.73 2fse s SER 118 Ca 0.07 0.89 -0.02 0.00 0.70 0.00 0.00 55.95 57.58 2fse s SER 118 Cb -0.23 -2.43 0.11 0.00 -1.71 0.00 0.00 66.02 61.76 2fse s SER 118 CO -0.03 -0.58 0.21 -0.69 1.20 0.00 0.00 173.24 173.34 2fse s VAL 119 N 2.94 3.24 0.43 4.45 1.01 -0.71 -0.97 120.40 130.78 2fse s VAL 119 Ca 0.34 -2.12 0.04 0.00 0.00 0.00 0.00 61.98 60.24 2fse s VAL 119 Cb -0.15 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 2fse s VAL 119 CO 0.10 -0.70 0.04 -0.94 0.00 0.00 0.00 175.10 173.60 2fse s SER 120 N 1.71 3.45 -1.28 3.32 1.04 -0.89 -1.17 113.70 119.88 2fse s SER 120 Ca 0.09 -1.52 -0.02 0.00 0.48 0.00 0.00 55.95 54.97 2fse s SER 120 Cb -0.22 0.14 0.01 0.00 0.10 0.00 0.00 66.02 66.04 2fse s SER 120 CO -0.04 -0.71 0.93 -0.67 0.98 0.00 0.00 173.24 173.73 2fse n ASP 121 N -1.07 -2.56 -4.27 7.02 2.03 -1.03 -1.51 116.55 115.15 2fse n ASP 121 Ca -0.09 -0.68 -0.16 0.00 0.52 0.00 0.00 54.79 54.38 2fse n ASP 121 Cb 0.67 -4.71 -0.10 0.00 -0.72 0.00 0.00 41.12 36.26 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 -3.44 1.39 -0.27 -0.67 -0.71 -1.01 -4.32 117.98 108.94 2fse s PHE 122 Ca 0.13 -0.67 -0.24 0.00 -1.04 0.00 0.00 56.93 55.11 2fse s PHE 122 Cb -0.06 -0.69 0.09 0.00 -1.21 0.00 0.00 43.02 41.14 2fse s PHE 122 CO 0.76 0.16 0.81 -0.47 -1.34 0.00 0.00 175.22 175.14 2fse s TYR 123 N -2.96 -0.72 0.65 3.49 5.04 -1.02 0.15 117.35 121.99 2fse s TYR 123 Ca 0.16 1.72 -0.11 0.00 -2.44 0.00 0.00 57.07 56.40 2fse s TYR 123 Cb -0.00 0.32 0.17 0.00 0.35 0.00 0.00 41.96 42.80 2fse s TYR 123 CO 0.03 -0.35 0.37 -2.30 -1.34 0.00 0.00 175.55 171.96 2fse n PRO 124 N 2.71 -3.02 0.04 4.97 -0.02 -1.25 -0.12 135.00 138.31 2fse n PRO 124 Ca -0.14 -0.63 -0.08 0.00 -2.02 0.00 0.00 63.50 60.63 2fse n PRO 124 Cb 0.56 -0.85 -0.13 0.00 -0.02 0.00 0.00 33.50 33.06 2fse n PRO 124 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2fse h GLY 125 N -2.14 0.03 -6.45 -1.23 0.00 -1.98 -3.46 103.07 87.84 2fse h GLY 125 Ca -0.17 -0.07 -0.68 0.00 0.00 0.00 0.00 47.33 46.41 2fse h GLY 125 CO 0.10 0.06 1.16 0.70 0.00 0.00 0.00 176.54 178.57 2fse n ASN 126 N -3.28 2.58 -3.50 0.19 3.02 -1.26 -4.94 115.26 108.06 2fse n ASN 126 Ca -0.06 0.78 -0.15 0.00 -0.03 0.00 0.00 54.58 55.13 2fse n ASN 126 Cb 0.98 -1.25 -0.04 0.00 -0.61 0.00 0.00 39.78 38.85 2fse n ASN 126 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2fse s ILE 127 N 5.21 0.01 -0.06 2.41 2.07 -1.26 -4.39 121.20 125.20 2fse s ILE 127 Ca 1.01 -0.08 0.04 0.00 -1.41 0.00 0.00 60.65 60.22 2fse s ILE 127 Cb -0.88 -0.99 -0.00 0.00 0.13 0.00 0.00 42.46 40.71 2fse s ILE 127 CO 0.55 -0.04 -0.18 -1.61 -1.91 0.00 0.00 174.94 171.75 2fse s GLU 128 N -2.41 2.01 -0.05 3.50 2.02 -0.66 -5.03 118.70 118.08 2fse s GLU 128 Ca -0.05 -0.64 0.04 0.00 0.02 0.00 0.00 54.97 54.33 2fse s GLU 128 Cb -0.01 -1.69 -0.00 0.00 0.10 0.00 0.00 34.13 32.54 2fse s GLU 128 CO -0.01 0.22 -0.17 0.08 0.02 0.00 0.00 175.26 175.40 2fse s VAL 129 N 0.15 1.43 0.01 2.63 1.01 -1.26 -1.43 120.40 122.94 2fse s VAL 129 Ca -0.07 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.23 2fse s VAL 129 Cb -0.13 -1.24 -0.01 0.00 0.00 0.00 0.00 36.38 35.00 2fse s VAL 129 CO 0.03 0.41 -0.09 -0.13 0.00 0.00 0.00 175.10 175.33 2fse s ARG 130 N 0.13 0.67 -0.15 2.72 0.52 0.38 -5.00 118.95 118.22 2fse s ARG 130 Ca -0.06 -0.48 -0.06 0.00 -0.52 0.00 0.00 55.73 54.61 2fse s ARG 130 Cb -0.12 -0.62 -0.04 0.00 0.52 0.00 0.00 34.95 34.69 2fse s ARG 130 CO 0.03 0.16 0.06 -1.58 0.02 0.00 0.00 175.30 173.98 2fse s TRP 131 N -0.57 3.28 -0.01 -0.53 0.23 -1.26 0.38 118.94 120.46 2fse s TRP 131 Ca 0.00 0.15 0.04 0.00 -2.03 0.00 0.00 56.10 54.26 2fse s TRP 131 Cb -0.05 -1.99 -0.01 0.00 0.03 0.00 0.00 33.47 31.45 2fse s TRP 131 CO 0.00 0.30 -0.12 -0.06 0.96 0.00 0.00 176.95 178.03 2fse s PHE 132 N -0.12 1.13 -0.22 -1.98 0.40 0.89 -0.12 117.98 117.96 2fse s PHE 132 Ca 0.07 -0.22 0.00 0.00 -0.60 0.00 0.00 56.93 56.18 2fse s PHE 132 Cb -0.12 -0.73 0.06 0.00 0.51 0.00 0.00 43.02 42.73 2fse s PHE 132 CO 0.01 -0.03 -0.04 0.50 0.70 0.00 0.00 175.22 176.36 2fse s ARG 133 N -0.25 1.50 -1.37 0.44 3.52 -0.94 0.63 118.95 122.49 2fse s ARG 133 Ca 0.04 -0.87 -0.03 0.00 -0.13 0.00 0.00 55.73 54.74 2fse s ARG 133 Cb -0.05 -2.47 0.02 0.00 -1.56 0.00 0.00 34.95 30.88 2fse s ARG 133 CO -0.00 -0.58 0.70 0.09 -0.81 0.00 0.00 175.30 174.70 2fse n ASN 134 N 4.74 -1.69 0.00 -2.12 3.02 -0.51 -2.17 115.26 116.53 2fse n ASN 134 Ca -0.12 -0.85 0.00 0.00 -0.03 0.00 0.00 54.58 53.58 2fse n ASN 134 Cb 0.45 -3.83 0.00 0.00 -0.61 0.00 0.00 39.78 35.79 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 -1.66 2.43 3.42 7.41 0.00 -1.26 -4.99 105.19 110.54 2fse n GLY 135 Ca -0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.01 3.20 0.37 1.61 1.02 -0.92 -5.06 119.74 119.94 2fse s LYS 136 Ca 0.00 -0.81 -0.28 0.00 0.02 0.00 0.00 55.97 54.90 2fse s LYS 136 Cb 0.00 -3.60 -0.11 0.00 -0.52 0.00 0.00 37.83 33.60 2fse s LYS 136 CO 0.00 -0.49 1.47 -1.91 -0.92 0.00 0.00 175.35 173.50 2fse n GLU 137 N 4.98 2.61 -3.63 1.68 2.13 -1.26 -2.22 120.64 124.93 2fse n GLU 137 Ca -0.13 0.91 -0.35 0.00 0.66 0.00 0.00 57.16 58.25 2fse n GLU 137 Cb 0.48 -2.63 -0.05 0.00 0.27 0.00 0.00 31.44 29.51 2fse n GLU 137 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2fse s GLU 138 N -2.01 3.71 0.00 5.31 0.41 0.84 -4.93 118.70 122.02 2fse s GLU 138 Ca 0.54 0.11 0.00 0.00 -0.41 0.00 0.00 54.97 55.21 2fse s GLU 138 Cb -0.49 -3.04 0.00 0.00 -1.78 0.00 0.00 34.13 28.82 2fse s GLU 138 CO 0.63 0.60 0.00 0.39 -0.49 0.00 0.00 175.26 176.39 2fse n GLU 139 N 1.05 0.00 -2.02 1.61 1.02 -1.26 -4.53 120.64 116.51 2fse n GLU 139 Ca -0.10 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.73 2fse n GLU 139 Cb 0.52 -0.59 0.00 0.00 -0.02 0.00 0.00 31.44 31.35 2fse n GLU 139 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2fse s THR 140 N -1.31 4.40 -1.17 2.62 2.01 -1.26 -4.19 115.64 116.75 2fse s THR 140 Ca 0.00 0.95 -0.07 0.00 0.31 0.00 0.00 61.69 62.88 2fse s THR 140 Cb 0.00 -3.67 0.06 0.00 0.01 0.00 0.00 72.50 68.90 2fse s THR 140 CO 0.00 -0.85 0.36 0.61 -0.69 0.00 0.00 174.62 174.05 2fse n GLY 141 N -1.97 -0.49 3.44 4.40 0.00 -1.26 -4.95 105.19 104.36 2fse n GLY 141 Ca 0.07 0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.81 5.10 -0.02 -0.61 1.01 -1.26 -4.47 121.20 118.13 2fse s ILE 142 Ca 0.30 -0.73 -0.14 0.00 0.00 0.00 0.00 60.65 60.07 2fse s ILE 142 Cb -0.16 -3.85 -0.05 0.00 0.01 0.00 0.00 42.46 38.40 2fse s ILE 142 CO 0.37 -0.31 0.39 -0.69 0.00 0.00 0.00 174.94 174.70 2fse s VAL 143 N 1.65 5.08 -0.04 2.92 1.01 -1.08 -4.96 120.40 124.97 2fse s VAL 143 Ca 0.04 0.80 0.04 0.00 0.00 0.00 0.00 61.98 62.86 2fse s VAL 143 Cb -0.19 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.49 2fse s VAL 143 CO 0.09 0.55 -0.15 -0.55 0.00 0.00 0.00 175.10 175.05 2fse s SER 144 N -0.88 1.90 0.19 3.32 0.15 -1.26 -0.42 113.70 116.70 2fse s SER 144 Ca 0.23 -0.31 0.23 0.00 0.70 0.00 0.00 55.95 56.80 2fse s SER 144 Cb -0.16 -0.57 0.91 0.00 -1.71 0.00 0.00 66.02 64.49 2fse s SER 144 CO 0.12 0.12 1.71 1.07 1.20 0.00 0.00 173.24 177.46 2fse n THR 145 N 3.26 0.74 -0.75 6.45 5.66 -0.30 -5.01 114.28 124.33 2fse n THR 145 Ca -0.19 0.09 0.00 0.00 -3.05 0.00 0.00 64.05 60.91 2fse n THR 145 Cb 0.53 -0.96 0.00 0.00 -1.55 0.00 0.00 70.33 68.36 2fse n THR 145 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2fse n GLY 146 N 0.41 -2.78 3.82 1.09 0.00 -1.26 -4.92 105.19 101.55 2fse n GLY 146 Ca 0.03 -1.76 -0.38 0.00 0.00 0.00 0.00 46.02 43.91 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 4.49 -0.06 0.99 2.96 -1.26 -4.28 118.68 121.51 2fse s LEU 147 Ca 0.00 1.23 0.03 0.00 -0.22 0.00 0.00 54.13 55.17 2fse s LEU 147 Cb 0.00 -2.98 -0.02 0.00 0.50 0.00 0.00 46.19 43.69 2fse s LEU 147 CO 0.00 0.24 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.43 2fse s VAL 148 N -1.19 2.97 -0.46 1.68 1.01 0.24 -4.95 120.40 119.71 2fse s VAL 148 Ca 0.31 -0.75 -0.09 0.00 0.00 0.00 0.00 61.98 61.45 2fse s VAL 148 Cb -0.18 -2.17 0.11 0.00 0.00 0.00 0.00 36.38 34.14 2fse s VAL 148 CO 0.19 0.58 0.32 -0.60 0.00 0.00 0.00 175.10 175.59 2fse s ARG 149 N -0.52 2.47 0.17 2.72 3.52 -1.26 -1.39 118.95 124.66 2fse s ARG 149 Ca 0.07 -1.71 0.18 0.00 -0.13 0.00 0.00 55.73 54.14 2fse s ARG 149 Cb -0.12 -3.88 0.80 0.00 -1.56 0.00 0.00 34.95 30.19 2fse s ARG 149 CO 0.01 -1.14 1.55 0.09 -0.81 0.00 0.00 175.30 175.00 2fse n ASN 150 N 4.89 0.39 0.00 -2.12 3.02 -0.53 -4.88 115.26 116.02 2fse n ASN 150 Ca -0.08 0.62 0.00 0.00 -0.03 0.00 0.00 54.58 55.09 2fse n ASN 150 Cb 0.41 -0.69 0.00 0.00 -0.61 0.00 0.00 39.78 38.89 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 -0.40 2.39 1.79 7.41 0.00 -1.26 -4.87 105.19 110.24 2fse n GLY 151 Ca 0.02 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.84 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 4.61 -3.17 1.61 5.68 -1.26 -4.91 116.55 119.12 2fse n ASP 152 Ca 0.00 -3.77 -0.10 0.00 -0.50 0.00 0.00 54.79 50.42 2fse n ASP 152 Cb 0.00 -0.64 0.05 0.00 -1.14 0.00 0.00 41.12 39.39 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 -0.94 -2.62 -3.64 2.11 7.02 -1.26 -5.03 117.44 113.07 2fse n TRP 153 Ca 0.46 0.95 -0.08 0.00 -1.02 0.00 0.00 57.50 57.80 2fse n TRP 153 Cb 0.96 -4.11 -0.07 0.00 -2.42 0.00 0.00 31.31 25.67 2fse n TRP 153 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 2fse s THR 154 N -3.25 0.00 0.40 -0.99 2.01 -1.26 -4.83 115.64 107.72 2fse s THR 154 Ca 0.30 0.00 0.08 0.00 0.31 0.00 0.00 61.69 62.37 2fse s THR 154 Cb -0.04 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.43 2fse s THR 154 CO 0.74 0.00 0.21 -0.36 -0.69 0.00 0.00 174.62 174.51 2fse s PHE 155 N 0.68 2.64 -0.07 4.92 0.40 0.40 -1.45 117.98 125.50 2fse s PHE 155 Ca -0.02 -0.54 -0.31 0.00 -0.60 0.00 0.00 56.93 55.46 2fse s PHE 155 Cb -0.05 -1.95 0.08 0.00 0.51 0.00 0.00 43.02 41.61 2fse s PHE 155 CO -0.09 0.15 0.75 1.14 0.70 0.00 0.00 175.22 177.87 2fse s GLN 156 N -3.93 0.96 0.13 0.44 -2.07 -0.48 -2.41 119.66 112.29 2fse s GLN 156 Ca 0.42 0.23 -0.10 0.00 -1.82 0.00 0.00 55.36 54.09 2fse s GLN 156 Cb 0.02 0.46 0.00 0.00 -1.09 0.00 0.00 33.01 32.39 2fse s GLN 156 CO 0.23 -0.30 0.26 -0.08 -1.32 0.00 0.00 175.29 174.08 2fse s THR 157 N -1.20 0.10 -0.04 3.63 -1.32 -0.32 0.82 115.64 117.32 2fse s THR 157 Ca -0.09 -1.19 0.02 0.00 -1.21 0.00 0.00 61.69 59.22 2fse s THR 157 Cb -0.00 -1.53 0.01 0.00 -1.51 0.00 0.00 72.50 69.47 2fse s THR 157 CO 0.08 -0.46 -0.08 -0.76 -2.21 0.00 0.00 174.62 171.19 2fse s LEU 158 N -2.90 1.65 -0.25 9.08 1.43 -1.26 -1.74 118.68 124.69 2fse s LEU 158 Ca 0.10 -0.19 -0.00 0.00 -1.03 0.00 0.00 54.13 53.01 2fse s LEU 158 Cb 0.04 -0.56 0.07 0.00 0.03 0.00 0.00 46.19 45.77 2fse s LEU 158 CO -0.06 0.03 0.01 -0.69 0.23 0.00 0.00 176.35 175.86 2fse s VAL 159 N 0.45 1.25 0.25 -1.59 1.01 -1.02 -1.15 120.40 119.59 2fse s VAL 159 Ca -0.07 -1.23 -0.07 0.00 0.00 0.00 0.00 61.98 60.61 2fse s VAL 159 Cb -0.11 -1.70 -0.06 0.00 0.00 0.00 0.00 36.38 34.51 2fse s VAL 159 CO 0.01 -0.30 0.54 -0.04 0.00 0.00 0.00 175.10 175.31 2fse s MET 160 N 1.49 3.70 -0.04 2.72 -1.94 0.44 -1.98 119.30 123.70 2fse s MET 160 Ca 0.00 0.11 -0.01 0.00 -1.71 0.00 0.00 55.69 54.09 2fse s MET 160 Cb -0.18 -2.66 0.03 0.00 2.01 0.00 0.00 34.83 34.03 2fse s MET 160 CO -0.11 0.28 0.07 -1.17 -0.01 0.00 0.00 175.02 174.08 2fse s LEU 161 N -3.16 0.85 0.01 -0.03 2.96 0.92 -2.63 118.68 117.59 2fse s LEU 161 Ca 0.45 0.13 -0.01 0.00 -0.22 0.00 0.00 54.13 54.49 2fse s LEU 161 Cb -0.11 0.07 -0.04 0.00 0.50 0.00 0.00 46.19 46.61 2fse s LEU 161 CO 0.26 -0.15 0.13 -0.70 -1.32 0.00 0.00 176.35 174.56 2fse s GLU 162 N 1.24 3.20 0.00 1.98 2.12 -1.26 0.12 118.70 126.10 2fse s GLU 162 Ca -0.08 -0.45 0.00 0.00 0.36 0.00 0.00 54.97 54.81 2fse s GLU 162 Cb -0.12 -2.94 0.00 0.00 0.26 0.00 0.00 34.13 31.32 2fse s GLU 162 CO -0.04 0.65 0.00 0.25 -0.54 0.00 0.00 175.26 175.58 2fse n THR 163 N 0.96 0.00 -3.31 -1.70 -2.24 -1.04 -4.99 114.28 101.97 2fse n THR 163 Ca -0.11 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.41 2fse n THR 163 Cb 0.52 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.67 2fse n THR 163 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2fse n VAL 164 N 0.00 -0.21 -1.21 2.28 0.31 -1.26 -1.52 118.33 116.72 2fse n VAL 164 Ca 0.00 -4.12 -0.53 0.00 -0.01 0.00 0.00 64.34 59.68 2fse n VAL 164 Cb 0.00 -1.93 -0.10 0.00 -0.91 0.00 0.00 33.84 30.91 2fse n VAL 164 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2fse n PRO 165 N 1.67 0.00 -4.14 5.55 -0.02 -1.26 -4.58 135.00 132.21 2fse n PRO 165 Ca 0.24 0.00 -0.25 0.00 -2.02 0.00 0.00 63.50 61.47 2fse n PRO 165 Cb 0.49 -1.27 -0.06 0.00 -0.02 0.00 0.00 33.50 32.64 2fse n PRO 165 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2fse s GLN 166 N 4.17 2.71 0.27 -0.52 -0.21 -1.26 -2.73 119.66 122.10 2fse s GLN 166 Ca 0.97 -1.01 -0.30 0.00 0.02 0.00 0.00 55.36 55.03 2fse s GLN 166 Cb -1.27 -2.51 -0.12 0.00 1.00 0.00 0.00 33.01 30.11 2fse s GLN 166 CO 0.61 0.45 1.51 0.45 -2.12 0.00 0.00 175.29 176.19 2fse n SER 167 N -0.46 3.40 0.00 5.90 2.88 -1.26 -2.29 113.62 121.79 2fse n SER 167 Ca -0.08 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.60 2fse n SER 167 Cb 0.56 -1.53 0.00 0.00 -0.75 0.00 0.00 64.21 62.49 2fse n SER 167 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2fse n GLY 168 N 2.12 1.34 3.78 0.46 0.00 -1.26 -5.00 105.19 106.63 2fse n GLY 168 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 2fse n GLY 168 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fse s GLU 169 N -0.48 2.69 -0.34 1.61 2.02 -0.97 -4.88 118.70 118.35 2fse s GLU 169 Ca 0.00 1.20 -0.01 0.00 0.02 0.00 0.00 54.97 56.18 2fse s GLU 169 Cb 0.00 -1.95 0.12 0.00 0.10 0.00 0.00 34.13 32.41 2fse s GLU 169 CO 0.00 -1.31 0.18 0.08 0.02 0.00 0.00 175.26 174.22 2fse s VAL 170 N -2.71 0.25 0.11 2.63 1.01 -1.25 -3.32 120.40 117.12 2fse s VAL 170 Ca 0.63 -1.45 -0.29 0.00 0.00 0.00 0.00 61.98 60.86 2fse s VAL 170 Cb -0.17 -1.20 -0.06 0.00 0.00 0.00 0.00 36.38 34.95 2fse s VAL 170 CO 0.49 -0.87 0.91 -0.31 0.00 0.00 0.00 175.10 175.32 2fse s TYR 171 N 1.38 3.81 -0.04 5.22 2.02 0.22 -1.42 117.35 128.54 2fse s TYR 171 Ca 0.14 1.73 0.01 0.00 -0.37 0.00 0.00 57.07 58.58 2fse s TYR 171 Cb -0.20 -2.99 0.02 0.00 -0.40 0.00 0.00 41.96 38.39 2fse s TYR 171 CO -0.13 0.25 -0.02 0.99 -1.57 0.00 0.00 175.55 175.06 2fse s THR 172 N -0.14 0.38 -0.28 -0.71 2.01 0.21 0.93 115.64 118.02 2fse s THR 172 Ca 0.44 -0.03 -0.14 0.00 0.31 0.00 0.00 61.69 62.27 2fse s THR 172 Cb -0.23 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 71.81 2fse s THR 172 CO 0.28 0.19 0.33 0.00 -0.69 0.00 0.00 174.62 174.74 2fse s GLN 174 N 2.00 3.65 0.03 0.00 0.74 0.16 -1.93 119.66 124.31 2fse s GLN 174 Ca 0.13 -0.50 0.07 0.00 0.05 0.00 0.00 55.36 55.11 2fse s GLN 174 Cb -0.16 -3.12 -0.03 0.00 1.10 0.00 0.00 33.01 30.80 2fse s GLN 174 CO 0.10 0.01 -0.20 0.08 -0.55 0.00 0.00 175.29 174.73 2fse s VAL 175 N 1.02 2.61 -0.05 1.34 1.01 -0.26 -0.47 120.40 125.59 2fse s VAL 175 Ca 0.02 -1.17 0.03 0.00 0.00 0.00 0.00 61.98 60.85 2fse s VAL 175 Cb -0.14 -2.06 0.01 0.00 0.00 0.00 0.00 36.38 34.19 2fse s VAL 175 CO 0.02 0.39 -0.12 -1.61 0.00 0.00 0.00 175.10 173.78 2fse s GLU 176 N -1.24 1.49 -0.12 2.72 2.02 -0.52 -1.42 118.70 121.64 2fse s GLU 176 Ca 0.13 -0.40 -0.17 0.00 0.02 0.00 0.00 54.97 54.54 2fse s GLU 176 Cb -0.10 -1.28 0.04 0.00 0.10 0.00 0.00 34.13 32.89 2fse s GLU 176 CO 0.03 0.08 0.44 -1.58 0.02 0.00 0.00 175.26 174.26 2fse s HIS 177 N 0.46 -0.44 0.57 1.61 2.46 -1.26 -1.66 115.29 117.03 2fse s HIS 177 Ca -0.10 0.96 0.37 0.00 0.47 0.00 0.00 55.06 56.77 2fse s HIS 177 Cb -0.13 0.18 1.48 0.00 -0.13 0.00 0.00 32.58 33.97 2fse s HIS 177 CO 0.03 -0.32 1.68 -1.35 -2.47 0.00 0.00 174.74 172.30 2fse h PRO 178 N 4.74 0.00 0.00 2.88 0.11 -1.95 0.62 132.00 138.40 2fse h PRO 178 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2fse h PRO 178 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2fse h PRO 178 CO 0.29 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.95 2fse n SER 179 N -3.88 0.00 -4.20 -2.05 3.41 -1.26 -4.74 113.62 100.89 2fse n SER 179 Ca 0.27 -0.91 -0.28 0.00 -0.26 0.00 0.00 58.87 57.69 2fse n SER 179 Cb 1.40 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 65.19 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 -2.00 2.00 0.17 1.04 1.43 0.22 -4.66 118.68 116.89 2fse s LEU 180 Ca 0.43 -0.40 0.19 0.00 -1.03 0.00 0.00 54.13 53.32 2fse s LEU 180 Cb 0.20 -1.11 -0.02 0.00 0.03 0.00 0.00 46.19 45.29 2fse s LEU 180 CO 0.33 0.22 1.07 0.71 0.23 0.00 0.00 176.35 178.91 2fse h THR 181 N 4.93 0.38 -3.70 5.49 1.35 -1.85 -3.43 112.91 116.09 2fse h THR 181 Ca -0.35 -1.67 -0.25 0.00 -0.55 0.00 0.00 66.41 63.58 2fse h THR 181 Cb 1.16 1.95 -0.29 0.00 -1.73 0.00 0.00 68.15 69.24 2fse h THR 181 CO 0.48 0.22 -0.72 -1.81 -0.25 0.00 0.00 175.52 173.43 2fse s ASP 182 N -5.83 0.06 0.55 5.36 1.01 -1.26 -5.14 116.67 111.43 2fse s ASP 182 Ca -0.00 -0.00 -0.20 0.00 0.71 0.00 0.00 52.55 53.06 2fse s ASP 182 Cb 0.08 -0.02 -0.07 0.00 1.01 0.00 0.00 42.92 43.93 2fse s ASP 182 CO 0.78 -0.02 0.95 -0.81 0.21 0.00 0.00 175.17 176.28 2fse n PRO 183 N 3.28 1.02 -3.66 8.23 -0.04 -1.26 -4.96 135.00 137.60 2fse n PRO 183 Ca -0.15 0.38 -0.36 0.00 -0.04 0.00 0.00 63.50 63.34 2fse n PRO 183 Cb 0.58 -2.11 -0.08 0.00 -0.04 0.00 0.00 33.50 31.85 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 -1.47 5.37 0.05 0.52 1.01 -0.51 -4.93 120.40 120.45 2fse s VAL 184 Ca 0.72 0.32 0.09 0.00 0.00 0.00 0.00 61.98 63.11 2fse s VAL 184 Cb -0.45 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.37 2fse s VAL 184 CO 0.50 0.43 -0.25 0.42 0.00 0.00 0.00 175.10 176.20 2fse s THR 185 N 0.36 2.06 -0.05 3.92 -4.23 -1.26 -1.11 115.64 115.33 2fse s THR 185 Ca 0.11 -1.36 -0.01 0.00 -1.18 0.00 0.00 61.69 59.25 2fse s THR 185 Cb -0.12 -1.77 0.03 0.00 1.34 0.00 0.00 72.50 71.98 2fse s THR 185 CO 0.00 0.34 0.02 -0.69 -0.54 0.00 0.00 174.62 173.75 2fse s VAL 186 N -0.81 0.17 0.57 2.29 1.01 -0.81 -4.97 120.40 117.86 2fse s VAL 186 Ca 0.11 0.23 0.06 0.00 0.00 0.00 0.00 61.98 62.38 2fse s VAL 186 Cb -0.10 -0.36 0.08 0.00 0.00 0.00 0.00 36.38 36.00 2fse s VAL 186 CO 0.02 0.22 0.79 -1.61 0.00 0.00 0.00 175.10 174.52 2fse s GLU 187 N 1.90 2.29 -0.28 2.72 2.02 -1.26 -0.08 118.70 126.03 2fse s GLU 187 Ca 0.03 -1.38 -0.24 0.00 0.02 0.00 0.00 54.97 53.39 2fse s GLU 187 Cb -0.12 -2.59 0.10 0.00 0.10 0.00 0.00 34.13 31.61 2fse s GLU 187 CO -0.04 -0.86 0.87 -0.46 0.02 0.00 0.00 175.26 174.79 2fse s TRP 188 N -2.71 -0.65 0.34 1.61 -0.00 0.26 -4.89 118.94 112.89 2fse s TRP 188 Ca 0.61 1.57 0.02 0.00 -0.00 0.00 0.00 56.10 58.30 2fse s TRP 188 Cb -0.07 0.33 -0.01 0.00 -0.00 0.00 0.00 33.47 33.72 2fse s TRP 188 CO 0.39 -0.31 0.08 0.36 -0.00 0.00 0.00 176.95 177.47 2fse n LYS 189 N 2.56 0.77 0.00 5.86 2.85 -1.26 0.70 118.16 129.64 2fse n LYS 189 Ca -0.14 -2.73 0.15 0.00 -1.05 0.00 0.00 58.31 54.54 2fse n LYS 189 Cb 0.56 1.27 0.76 0.00 -0.65 0.00 0.00 35.03 36.96 2fse n LYS 189 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35