#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gmo s TYR 8 N 0.00 0.89 -0.19 3.10 1.51 -0.96 -5.00 117.35 116.69 3gmo s TYR 8 Ca 0.00 -0.28 -0.09 0.00 -1.01 0.00 0.00 57.07 55.69 3gmo s TYR 8 Cb 0.00 -0.75 -0.05 0.00 -0.11 0.00 0.00 41.96 41.05 3gmo s TYR 8 CO 0.00 -0.22 0.10 0.99 -1.11 0.00 0.00 175.55 175.32 3gmo s THR 9 N 0.92 5.16 -0.24 -0.71 2.01 -1.26 -0.98 115.64 120.55 3gmo s THR 9 Ca -0.11 0.10 -0.08 0.00 0.31 0.00 0.00 61.69 61.92 3gmo s THR 9 Cb -0.14 -3.35 -0.03 0.00 0.01 0.00 0.00 72.50 68.99 3gmo s THR 9 CO 0.00 0.45 0.08 0.12 -0.69 0.00 0.00 174.62 174.58 3gmo s PHE 10 N 0.37 3.13 -0.20 4.92 5.36 0.09 -0.31 117.98 131.35 3gmo s PHE 10 Ca 0.06 -0.25 -0.02 0.00 -0.96 0.00 0.00 56.93 55.76 3gmo s PHE 10 Cb -0.12 -2.22 0.00 0.00 -0.34 0.00 0.00 43.02 40.35 3gmo s PHE 10 CO -0.01 -0.23 -0.12 1.03 -1.46 0.00 0.00 175.22 174.43 3gmo s ARG 11 N 1.37 3.20 -0.24 10.12 0.52 0.29 -1.50 118.95 132.72 3gmo s ARG 11 Ca 0.05 -0.72 -0.07 0.00 -0.52 0.00 0.00 55.73 54.47 3gmo s ARG 11 Cb -0.15 -2.80 -0.03 0.00 0.52 0.00 0.00 34.95 32.50 3gmo s ARG 11 CO 0.04 -0.19 0.07 0.00 0.02 0.00 0.00 175.30 175.24 3gmo s LEU 13 N 1.41 2.10 -0.11 0.00 1.43 0.26 -1.11 118.68 122.65 3gmo s LEU 13 Ca 0.05 -0.66 0.00 0.00 -1.03 0.00 0.00 54.13 52.49 3gmo s LEU 13 Cb -0.15 -1.40 -0.02 0.00 0.03 0.00 0.00 46.19 44.65 3gmo s LEU 13 CO 0.04 -0.03 -0.11 -1.58 0.23 0.00 0.00 176.35 174.89 3gmo s GLN 14 N 1.33 3.22 -0.16 1.70 0.74 0.02 -1.19 119.66 125.32 3gmo s GLN 14 Ca 0.04 -0.65 0.00 0.00 0.05 0.00 0.00 55.36 54.81 3gmo s GLN 14 Cb -0.13 -2.63 0.03 0.00 1.10 0.00 0.00 33.01 31.38 3gmo s GLN 14 CO -0.12 0.33 -0.12 0.00 -0.55 0.00 0.00 175.29 174.83 3gmo s MET 15 N 0.06 2.12 -0.09 1.67 0.23 0.63 -1.10 119.30 122.82 3gmo s MET 15 Ca -0.04 -0.63 0.04 0.00 -1.03 0.00 0.00 55.69 54.03 3gmo s MET 15 Cb -0.14 -2.17 -0.00 0.00 -1.53 0.00 0.00 34.83 30.98 3gmo s MET 15 CO 0.04 -0.31 -0.24 -1.12 -2.03 0.00 0.00 175.02 171.36 3gmo s SER 16 N 1.48 3.07 -0.13 -1.18 0.01 0.25 -1.18 113.70 116.02 3gmo s SER 16 Ca 0.03 -0.55 0.01 0.00 1.31 0.00 0.00 55.95 56.75 3gmo s SER 16 Cb -0.14 -1.32 -0.01 0.00 0.21 0.00 0.00 66.02 64.76 3gmo s SER 16 CO -0.10 0.17 -0.17 -0.44 0.41 0.00 0.00 173.24 173.12 3gmo s SER 17 N 0.27 3.65 -0.30 2.44 0.01 0.02 -1.01 113.70 118.79 3gmo s SER 17 Ca -0.17 -0.43 0.02 0.00 1.31 0.00 0.00 55.95 56.68 3gmo s SER 17 Cb -0.17 -1.54 0.07 0.00 0.21 0.00 0.00 66.02 64.59 3gmo s SER 17 CO 0.08 0.15 -0.02 -0.36 0.41 0.00 0.00 173.24 173.50 3gmo s PHE 18 N 0.45 3.43 0.01 2.43 0.40 0.46 -0.79 117.98 124.37 3gmo s PHE 18 Ca -0.12 -2.42 -0.05 0.00 -0.60 0.00 0.00 56.93 53.74 3gmo s PHE 18 Cb -0.16 -2.34 -0.29 0.00 0.51 0.00 0.00 43.02 40.74 3gmo s PHE 18 CO 0.05 -0.89 0.90 0.00 0.70 0.00 0.00 175.22 175.98 3gmo h ALA 19 N 7.80 0.20 -2.03 5.36 0.00 -1.61 0.78 119.26 129.76 3gmo h ALA 19 Ca -0.15 -1.06 0.11 0.00 0.00 0.00 0.00 54.91 53.81 3gmo h ALA 19 Cb 1.04 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 3gmo h ALA 19 CO 0.51 1.07 0.35 0.27 0.00 0.00 0.00 179.25 181.46 3gmo n ASN 20 N -3.49 -0.89 0.11 0.00 0.23 -1.21 -4.26 115.26 105.74 3gmo n ASN 20 Ca -0.16 -1.43 0.20 0.00 -0.53 0.00 0.00 54.58 52.66 3gmo n ASN 20 Cb 1.05 1.44 0.75 0.00 -2.08 0.00 0.00 39.78 40.94 3gmo n ASN 20 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 3gmo h ARG 21 N 0.00 0.00 -0.31 -3.83 3.08 -2.00 -2.71 114.38 108.61 3gmo h ARG 21 Ca -0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.91 3gmo h ARG 21 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.70 3gmo h ARG 21 CO 0.19 0.00 0.00 0.43 -1.07 0.00 0.00 179.97 179.52 3gmo n SER 22 N -3.70 2.81 -3.67 7.04 7.64 -1.26 -4.97 113.62 117.51 3gmo n SER 22 Ca 0.07 -1.91 -0.10 0.00 1.01 0.00 0.00 58.87 57.94 3gmo n SER 22 Cb 0.59 -0.20 -0.11 0.00 -1.01 0.00 0.00 64.21 63.48 3gmo n SER 22 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 3gmo s TRP 23 N -1.00 -0.67 0.14 1.43 -0.00 -1.02 -5.10 118.94 112.72 3gmo s TRP 23 Ca 0.23 1.34 -0.17 0.00 -0.00 0.00 0.00 56.10 57.50 3gmo s TRP 23 Cb 0.12 0.23 0.04 0.00 -0.00 0.00 0.00 33.47 33.86 3gmo s TRP 23 CO 0.16 -0.41 0.44 -1.54 -0.00 0.00 0.00 176.95 175.60 3gmo s SER 24 N 2.21 -0.29 0.03 5.86 1.04 -1.26 -1.74 113.70 119.55 3gmo s SER 24 Ca -0.04 -0.29 -0.09 0.00 0.48 0.00 0.00 55.95 56.02 3gmo s SER 24 Cb -0.11 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.52 3gmo s SER 24 CO -0.12 -0.89 0.18 0.00 0.98 0.00 0.00 173.24 173.39 3gmo s ARG 25 N -3.80 0.63 -0.04 4.02 1.70 0.03 -4.99 118.95 116.48 3gmo s ARG 25 Ca 0.03 -0.55 0.02 0.00 -0.47 0.00 0.00 55.73 54.76 3gmo s ARG 25 Cb 0.01 0.26 0.02 0.00 -0.57 0.00 0.00 34.95 34.67 3gmo s ARG 25 CO -0.11 -0.17 -0.07 0.99 -1.08 0.00 0.00 175.30 174.86 3gmo s THR 26 N -2.17 0.72 0.02 4.99 2.01 -1.26 -0.79 115.64 119.15 3gmo s THR 26 Ca -0.08 -0.25 0.01 0.00 0.31 0.00 0.00 61.69 61.68 3gmo s THR 26 Cb -0.03 -0.69 -0.01 0.00 0.01 0.00 0.00 72.50 71.77 3gmo s THR 26 CO -0.02 0.26 -0.04 -1.81 -0.69 0.00 0.00 174.62 172.32 3gmo s ASP 27 N 0.70 0.45 0.08 3.53 1.11 -0.32 -2.34 116.67 119.88 3gmo s ASP 27 Ca -0.11 -0.30 0.01 0.00 0.18 0.00 0.00 52.55 52.33 3gmo s ASP 27 Cb -0.14 0.02 -0.04 0.00 1.07 0.00 0.00 42.92 43.83 3gmo s ASP 27 CO 0.01 -0.12 -0.06 -0.94 1.18 0.00 0.00 175.17 175.25 3gmo s SER 28 N -0.83 0.94 0.06 0.27 1.04 -0.53 -0.27 113.70 114.38 3gmo s SER 28 Ca -0.06 -0.94 0.01 0.00 0.48 0.00 0.00 55.95 55.44 3gmo s SER 28 Cb -0.06 0.11 -0.03 0.00 0.10 0.00 0.00 66.02 66.14 3gmo s SER 28 CO -0.00 -0.46 -0.06 0.68 0.98 0.00 0.00 173.24 174.37 3gmo s VAL 29 N -3.39 0.49 -0.03 5.02 -7.23 -0.33 -0.70 120.40 114.22 3gmo s VAL 29 Ca 0.08 -1.44 0.02 0.00 -1.81 0.00 0.00 61.98 58.83 3gmo s VAL 29 Cb 0.04 -1.04 0.01 0.00 0.56 0.00 0.00 36.38 35.95 3gmo s VAL 29 CO -0.05 -0.64 -0.07 -0.69 -0.31 0.00 0.00 175.10 173.33 3gmo s VAL 30 N -2.46 0.69 -0.03 1.32 1.01 -0.70 -0.58 120.40 119.65 3gmo s VAL 30 Ca -0.01 -0.28 0.05 0.00 0.00 0.00 0.00 61.98 61.73 3gmo s VAL 30 Cb -0.03 -0.64 -0.01 0.00 0.00 0.00 0.00 36.38 35.71 3gmo s VAL 30 CO -0.03 0.23 -0.17 0.26 0.00 0.00 0.00 175.10 175.40 3gmo s TRP 31 N 0.38 1.56 -0.29 5.22 0.52 0.24 -0.70 118.94 125.87 3gmo s TRP 31 Ca -0.06 -0.37 -0.03 0.00 0.02 0.00 0.00 56.10 55.67 3gmo s TRP 31 Cb -0.10 -1.03 0.04 0.00 -1.15 0.00 0.00 33.47 31.23 3gmo s TRP 31 CO 0.01 -0.09 0.00 -1.17 0.02 0.00 0.00 176.95 175.72 3gmo s LEU 32 N -0.18 3.76 0.00 2.99 2.96 -0.01 -0.54 118.68 127.65 3gmo s LEU 32 Ca 0.02 -1.11 0.00 0.00 -0.22 0.00 0.00 54.13 52.82 3gmo s LEU 32 Cb -0.09 -1.73 0.00 0.00 0.50 0.00 0.00 46.19 44.87 3gmo s LEU 32 CO 0.01 -0.23 0.00 0.61 -1.32 0.00 0.00 176.35 175.42 3gmo n GLY 33 N 4.68 3.69 1.64 7.98 0.00 0.58 -1.70 105.19 122.06 3gmo n GLY 33 Ca -0.14 -0.01 0.07 0.00 0.00 0.00 0.00 46.02 45.95 3gmo n GLY 33 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3gmo n ASP 34 N 5.62 5.29 -4.45 1.61 5.68 -1.26 -4.92 116.55 124.11 3gmo n ASP 34 Ca 0.00 -2.95 -0.33 0.00 -0.50 0.00 0.00 54.79 51.00 3gmo n ASP 34 Cb 0.00 -0.65 -0.13 0.00 -1.14 0.00 0.00 41.12 39.20 3gmo n ASP 34 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 3gmo s LEU 35 N -2.78 3.03 0.12 -2.12 1.43 -0.69 -5.05 118.68 112.63 3gmo s LEU 35 Ca 0.52 -0.20 -0.30 0.00 -1.03 0.00 0.00 54.13 53.11 3gmo s LEU 35 Cb 0.40 -1.71 -0.06 0.00 0.03 0.00 0.00 46.19 44.85 3gmo s LEU 35 CO 0.14 0.18 1.07 -1.58 0.23 0.00 0.00 176.35 176.39 3gmo s GLN 36 N 0.31 4.59 -0.05 1.70 0.74 -1.26 -0.83 119.66 124.85 3gmo s GLN 36 Ca -0.06 1.62 0.06 0.00 0.05 0.00 0.00 55.36 57.03 3gmo s GLN 36 Cb -0.15 -3.34 -0.09 0.00 1.10 0.00 0.00 33.01 30.53 3gmo s GLN 36 CO 0.04 0.03 0.07 0.25 -0.55 0.00 0.00 175.29 175.13 3gmo n THR 37 N 2.97 0.30 -3.91 -0.34 -2.24 0.13 -4.59 114.28 106.60 3gmo n THR 37 Ca 0.04 -0.24 -0.09 0.00 -2.27 0.00 0.00 64.05 61.50 3gmo n THR 37 Cb 0.48 -0.44 -0.08 0.00 -2.10 0.00 0.00 70.33 68.19 3gmo n THR 37 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3gmo s HIS 38 N -2.27 0.25 -0.00 4.78 3.76 -1.18 -1.48 115.29 119.15 3gmo s HIS 38 Ca -0.03 -0.69 -0.04 0.00 -0.15 0.00 0.00 55.06 54.15 3gmo s HIS 38 Cb 0.03 -0.12 -0.00 0.00 1.11 0.00 0.00 32.58 33.59 3gmo s HIS 38 CO 0.27 -0.53 0.07 -0.98 -0.85 0.00 0.00 174.74 172.72 3gmo s ARG 39 N -3.88 0.30 -0.30 1.40 1.70 -0.68 -1.72 118.95 115.76 3gmo s ARG 39 Ca 0.07 -0.29 -0.03 0.00 -0.47 0.00 0.00 55.73 55.01 3gmo s ARG 39 Cb 0.05 0.12 0.10 0.00 -0.57 0.00 0.00 34.95 34.66 3gmo s ARG 39 CO -0.10 -0.06 0.13 -0.46 -1.08 0.00 0.00 175.30 173.73 3gmo s TRP 40 N -0.93 0.80 0.50 5.89 -0.00 0.12 -0.16 118.94 125.17 3gmo s TRP 40 Ca -0.10 -1.23 -0.20 0.00 -0.00 0.00 0.00 56.10 54.57 3gmo s TRP 40 Cb -0.06 -1.16 -0.07 0.00 -0.00 0.00 0.00 33.47 32.17 3gmo s TRP 40 CO 0.00 -0.84 1.08 0.45 -0.00 0.00 0.00 176.95 177.64 3gmo s SER 41 N 1.84 6.12 0.53 5.86 0.15 -1.26 -1.45 113.70 125.48 3gmo s SER 41 Ca 0.10 2.04 0.22 0.00 0.70 0.00 0.00 55.95 59.01 3gmo s SER 41 Cb -0.17 -2.57 1.37 0.00 -1.71 0.00 0.00 66.02 62.94 3gmo s SER 41 CO -0.30 -0.94 2.06 -1.13 1.20 0.00 0.00 173.24 174.13 3gmo h ASN 42 N 1.46 0.00 0.61 5.45 -1.24 -1.86 -2.15 115.58 117.85 3gmo h ASN 42 Ca -0.50 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.51 3gmo h ASN 42 Cb 1.24 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.29 3gmo h ASN 42 CO 0.58 0.00 0.00 0.47 -1.29 0.00 0.00 177.43 177.19 3gmo n ASP 43 N -4.39 0.00 -4.63 1.15 10.43 -1.26 -4.78 116.55 113.07 3gmo n ASP 43 Ca 0.04 0.10 -0.35 0.00 2.57 0.00 0.00 54.79 57.16 3gmo n ASP 43 Cb 0.39 -0.35 -0.10 0.00 1.84 0.00 0.00 41.12 42.90 3gmo n ASP 43 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 3gmo s SER 44 N -2.71 5.14 0.29 -2.24 0.15 -0.81 -5.01 113.70 108.52 3gmo s SER 44 Ca 0.21 0.07 0.13 0.00 0.70 0.00 0.00 55.95 57.05 3gmo s SER 44 Cb 0.17 -1.57 0.40 0.00 -1.71 0.00 0.00 66.02 63.31 3gmo s SER 44 CO 0.42 0.31 1.62 0.00 1.20 0.00 0.00 173.24 176.79 3gmo h ALA 45 N 5.66 0.92 -2.46 5.45 0.00 -1.86 -3.45 119.26 123.52 3gmo h ALA 45 Ca -0.45 -0.51 -0.50 0.00 0.00 0.00 0.00 54.91 53.45 3gmo h ALA 45 Cb 1.19 -0.09 -0.15 0.00 0.00 0.00 0.00 17.79 18.73 3gmo h ALA 45 CO 0.58 0.71 -0.75 0.95 0.00 0.00 0.00 179.25 180.73 3gmo s THR 46 N -3.51 1.87 0.06 0.00 -4.23 -1.26 -4.97 115.64 103.60 3gmo s THR 46 Ca -0.00 -2.14 -0.30 0.00 -1.18 0.00 0.00 61.69 58.07 3gmo s THR 46 Cb 0.12 -2.01 -0.05 0.00 1.34 0.00 0.00 72.50 71.90 3gmo s THR 46 CO 0.74 -0.47 1.03 -0.63 -0.54 0.00 0.00 174.62 174.75 3gmo s ILE 47 N -2.58 4.51 -0.00 2.99 1.01 -1.26 -4.77 121.20 121.09 3gmo s ILE 47 Ca 0.21 1.89 -0.11 0.00 0.00 0.00 0.00 60.65 62.65 3gmo s ILE 47 Cb -0.03 -4.21 -0.05 0.00 0.01 0.00 0.00 42.46 38.18 3gmo s ILE 47 CO 0.08 0.20 0.33 -0.44 0.00 0.00 0.00 174.94 175.11 3gmo s SER 48 N 0.67 6.64 -0.02 3.58 0.01 0.78 -4.98 113.70 120.38 3gmo s SER 48 Ca 0.52 0.77 -0.23 0.00 1.31 0.00 0.00 55.95 58.32 3gmo s SER 48 Cb -0.24 -2.17 -0.05 0.00 0.21 0.00 0.00 66.02 63.77 3gmo s SER 48 CO 0.29 0.30 0.67 -0.36 0.41 0.00 0.00 173.24 174.55 3gmo s PHE 49 N -1.18 3.65 -1.23 2.43 0.08 -1.26 -1.69 117.98 118.78 3gmo s PHE 49 Ca 0.25 1.27 0.11 0.00 0.12 0.00 0.00 56.93 58.68 3gmo s PHE 49 Cb -0.15 -2.73 0.17 0.00 -0.57 0.00 0.00 43.02 39.74 3gmo s PHE 49 CO 0.13 0.23 1.00 0.25 -0.10 0.00 0.00 175.22 176.73 3gmo n THR 50 N 3.18 0.37 -4.18 0.64 -2.24 -0.55 -4.92 114.28 106.58 3gmo n THR 50 Ca -0.04 -0.68 -0.11 0.00 -2.27 0.00 0.00 64.05 60.95 3gmo n THR 50 Cb 0.51 0.96 -0.10 0.00 -2.10 0.00 0.00 70.33 69.60 3gmo n THR 50 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3gmo s LYS 51 N -0.96 0.86 0.31 -0.78 -0.14 -1.25 -4.92 119.74 112.86 3gmo s LYS 51 Ca 0.17 -1.35 0.25 0.00 -1.36 0.00 0.00 55.97 53.68 3gmo s LYS 51 Cb 0.10 -0.25 1.07 0.00 -1.68 0.00 0.00 37.83 37.08 3gmo s LYS 51 CO 0.15 -0.01 1.75 -1.00 -0.76 0.00 0.00 175.35 175.47 3gmo h PRO 52 N 2.94 0.00 -0.39 -1.68 0.13 -1.96 -2.79 132.00 128.25 3gmo h PRO 52 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 3gmo h PRO 52 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3gmo h PRO 52 CO 0.65 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.75 3gmo n TRP 53 N -2.35 0.98 0.34 1.56 4.27 -1.26 -4.68 117.44 116.30 3gmo n TRP 53 Ca 0.01 -0.69 0.11 0.00 -3.89 0.00 0.00 57.50 53.05 3gmo n TRP 53 Cb 0.21 -0.22 0.51 0.00 -1.36 0.00 0.00 31.31 30.45 3gmo n TRP 53 CO 0.00 0.00 0.00 0.43 -2.29 0.00 0.00 177.69 175.83 3gmo n SER 54 N 0.24 0.63 -0.21 -0.67 7.64 -1.05 -1.20 113.62 118.99 3gmo n SER 54 Ca 0.20 0.68 0.14 0.00 1.01 0.00 0.00 58.87 60.90 3gmo n SER 54 Cb 0.77 -0.81 0.57 0.00 -1.01 0.00 0.00 64.21 63.73 3gmo n SER 54 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 3gmo n GLN 55 N -2.22 0.95 0.00 1.43 7.27 -1.26 -5.01 117.38 118.53 3gmo n GLN 55 Ca 0.01 -0.42 0.00 0.00 0.07 0.00 0.00 57.00 56.67 3gmo n GLN 55 Cb 0.18 -1.49 0.00 0.00 2.41 0.00 0.00 30.24 31.34 3gmo n GLN 55 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3gmo n GLY 56 N 1.24 3.14 1.43 1.69 0.00 -0.34 -2.19 105.19 110.16 3gmo n GLY 56 Ca 0.16 -0.31 0.11 0.00 0.00 0.00 0.00 46.02 45.98 3gmo n GLY 56 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gmo n LYS 57 N 14.00 3.02 -2.59 1.61 5.02 -1.26 -4.90 118.16 133.06 3gmo n LYS 57 Ca 0.00 -2.70 -0.40 0.00 -2.02 0.00 0.00 58.31 53.19 3gmo n LYS 57 Cb 0.00 -1.67 -0.05 0.00 -0.02 0.00 0.00 35.03 33.29 3gmo n LYS 57 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3gmo s LEU 58 N -1.26 4.58 0.92 -0.35 1.43 -0.93 -5.05 118.68 118.03 3gmo s LEU 58 Ca 0.50 2.11 -0.11 0.00 -1.03 0.00 0.00 54.13 55.59 3gmo s LEU 58 Cb 0.28 -3.62 0.15 0.00 0.03 0.00 0.00 46.19 43.03 3gmo s LEU 58 CO 0.30 -0.04 1.09 -0.94 0.23 0.00 0.00 176.35 177.00 3gmo s SER 59 N -0.85 3.14 0.25 2.29 1.04 -1.26 -4.77 113.70 113.54 3gmo s SER 59 Ca 0.44 1.64 -0.04 0.00 0.48 0.00 0.00 55.95 58.47 3gmo s SER 59 Cb -0.29 -2.29 0.37 0.00 0.10 0.00 0.00 66.02 63.91 3gmo s SER 59 CO 0.36 -2.87 1.84 0.78 0.98 0.00 0.00 173.24 174.34 3gmo h ASN 60 N -1.71 0.81 -0.80 7.02 4.21 -1.98 0.12 115.58 123.25 3gmo h ASN 60 Ca -0.49 0.03 -0.03 0.00 1.21 0.00 0.00 56.30 57.01 3gmo h ASN 60 Cb 1.28 -0.14 -0.04 0.00 -1.12 0.00 0.00 38.32 38.31 3gmo h ASN 60 CO 0.52 0.49 0.36 -0.61 -1.29 0.00 0.00 177.43 176.90 3gmo h GLN 61 N 0.93 1.16 -0.22 0.81 4.15 -1.99 -1.01 115.11 118.93 3gmo h GLN 61 Ca 0.39 -0.18 -0.12 0.00 0.77 0.00 0.00 58.65 59.51 3gmo h GLN 61 Cb 0.25 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.73 3gmo h GLN 61 CO -0.20 0.91 -0.38 1.96 -1.93 0.00 0.00 178.83 179.19 3gmo h GLN 62 N 1.14 0.50 -0.34 1.69 4.20 -1.59 -2.20 115.11 118.51 3gmo h GLN 62 Ca 0.27 -0.24 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 3gmo h GLN 62 Cb 0.15 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 3gmo h GLN 62 CO -0.03 0.80 0.08 2.35 -0.67 0.00 0.00 178.83 181.36 3gmo h TRP 63 N 0.42 0.58 -0.87 2.96 2.91 -0.85 -1.86 115.95 119.23 3gmo h TRP 63 Ca 0.04 -0.07 0.06 0.00 1.13 0.00 0.00 58.89 60.05 3gmo h TRP 63 Cb 0.85 -0.16 -0.06 0.00 -0.51 0.00 0.00 29.16 29.28 3gmo h TRP 63 CO 0.03 0.59 0.54 0.93 -1.03 0.00 0.00 178.44 179.50 3gmo h GLU 64 N 0.40 0.96 -0.35 2.65 4.39 -0.98 0.43 114.58 122.07 3gmo h GLU 64 Ca 0.11 -0.06 -0.09 0.00 0.34 0.00 0.00 59.36 59.66 3gmo h GLU 64 Cb 0.31 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 3gmo h GLU 64 CO 0.00 0.64 -0.13 0.87 -1.16 0.00 0.00 179.01 179.23 3gmo h LYS 65 N 0.99 0.71 -0.03 2.33 1.57 -1.18 0.25 116.57 121.21 3gmo h LYS 65 Ca 0.38 -0.29 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3gmo h LYS 65 Cb 0.17 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.45 3gmo h LYS 65 CO -0.17 0.89 0.01 1.25 -0.57 0.00 0.00 179.45 180.86 3gmo h LEU 66 N 0.50 0.05 -0.56 2.94 5.85 -0.72 -2.30 115.31 121.07 3gmo h LEU 66 Ca 0.08 -0.22 0.07 0.00 0.84 0.00 0.00 57.88 58.65 3gmo h LEU 66 Cb 0.65 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.61 3gmo h LEU 66 CO 0.04 0.26 0.25 -0.61 -0.34 0.00 0.00 178.44 178.04 3gmo h GLN 67 N -0.17 0.45 -0.51 1.25 4.15 -0.11 -2.67 115.11 117.51 3gmo h GLN 67 Ca 0.01 -0.03 0.09 0.00 0.77 0.00 0.00 58.65 59.50 3gmo h GLN 67 Cb 0.23 -0.10 -0.08 0.00 0.21 0.00 0.00 27.48 27.74 3gmo h GLN 67 CO -0.00 0.30 0.07 1.25 -1.93 0.00 0.00 178.83 178.52 3gmo h HIS 68 N 0.47 0.10 -0.78 3.99 2.76 -0.37 0.29 115.15 121.61 3gmo h HIS 68 Ca 0.26 0.03 0.14 0.00 -2.20 0.00 0.00 60.37 58.60 3gmo h HIS 68 Cb 0.24 0.03 -0.09 0.00 1.55 0.00 0.00 27.41 29.15 3gmo h HIS 68 CO -0.13 -0.05 0.35 1.98 -1.30 0.00 0.00 177.93 178.78 3gmo h MET 69 N 0.19 0.50 -0.02 5.26 1.85 -1.08 -0.45 114.93 121.18 3gmo h MET 69 Ca 0.26 -0.03 -0.18 0.00 -0.61 0.00 0.00 59.70 59.14 3gmo h MET 69 Cb 0.37 -0.11 -0.01 0.00 0.43 0.00 0.00 31.60 32.27 3gmo h MET 69 CO -0.37 0.33 -0.78 0.74 -0.40 0.00 0.00 176.91 176.43 3gmo h PHE 70 N 0.51 0.24 -0.50 1.39 0.04 -1.04 -0.16 116.94 117.42 3gmo h PHE 70 Ca 0.42 -0.12 -0.01 0.00 2.80 0.00 0.00 57.97 61.06 3gmo h PHE 70 Cb 0.61 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.70 3gmo h PHE 70 CO -0.14 0.88 0.27 1.96 -0.60 0.00 0.00 178.31 180.68 3gmo h GLN 71 N 0.10 0.69 -0.61 1.51 4.20 -0.45 0.27 115.11 120.82 3gmo h GLN 71 Ca -0.03 -0.09 -0.08 0.00 0.06 0.00 0.00 58.65 58.52 3gmo h GLN 71 Cb 1.37 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.99 3gmo h GLN 71 CO 0.12 0.55 0.07 0.28 -0.67 0.00 0.00 178.83 179.17 3gmo h VAL 72 N 0.66 1.26 -0.42 -0.54 2.07 -0.76 -3.01 116.25 115.52 3gmo h VAL 72 Ca 0.17 -1.06 0.01 0.00 0.82 0.00 0.00 66.70 66.64 3gmo h VAL 72 Cb 0.06 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 3gmo h VAL 72 CO -0.03 0.39 0.27 0.22 0.02 0.00 0.00 177.57 178.44 3gmo h TYR 73 N 0.94 0.52 -0.63 1.57 3.20 -0.67 0.88 116.97 122.77 3gmo h TYR 73 Ca 0.18 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.03 3gmo h TYR 73 Cb 0.47 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.54 3gmo h TYR 73 CO 0.03 0.32 0.25 -0.09 -1.64 0.00 0.00 178.16 177.04 3gmo h ARG 74 N 0.56 0.94 -0.47 1.82 2.43 -0.34 0.38 114.38 119.70 3gmo h ARG 74 Ca 0.15 -0.17 -0.06 0.00 -0.81 0.00 0.00 59.98 59.09 3gmo h ARG 74 Cb -0.06 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.32 3gmo h ARG 74 CO -0.04 0.80 0.06 0.28 -1.51 0.00 0.00 179.97 179.56 3gmo h VAL 75 N 0.88 1.25 -0.03 0.20 2.07 -1.43 -2.04 116.25 117.15 3gmo h VAL 75 Ca 0.21 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.79 3gmo h VAL 75 Cb 0.21 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 30.93 3gmo h VAL 75 CO -0.02 0.33 0.01 0.28 0.02 0.00 0.00 177.57 178.20 3gmo h SER 76 N 0.65 0.02 -0.18 0.57 0.02 -0.10 -1.52 113.55 113.01 3gmo h SER 76 Ca 0.14 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 61.13 3gmo h SER 76 Cb 0.41 -0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.92 3gmo h SER 76 CO 0.01 0.01 -0.05 0.15 -1.14 0.00 0.00 176.83 175.81 3gmo h PHE 77 N 0.03 -0.12 -0.52 3.45 3.04 -0.28 0.31 116.94 122.86 3gmo h PHE 77 Ca 0.01 0.02 0.01 0.00 3.98 0.00 0.00 57.97 61.98 3gmo h PHE 77 Cb 0.00 0.08 -0.03 0.00 2.56 0.00 0.00 35.95 38.56 3gmo h PHE 77 CO -0.08 -0.09 0.34 1.15 -2.02 0.00 0.00 178.31 177.61 3gmo h THR 78 N -0.01 1.13 -0.50 4.41 2.02 -1.12 -1.69 112.91 117.14 3gmo h THR 78 Ca 0.09 -0.24 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 3gmo h THR 78 Cb 0.15 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 66.90 3gmo h THR 78 CO -0.19 0.13 0.31 -0.09 0.37 0.00 0.00 175.52 176.04 3gmo h ARG 79 N 0.70 0.67 -0.16 6.66 2.43 -1.08 -1.91 114.38 121.68 3gmo h ARG 79 Ca 0.19 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.33 3gmo h ARG 79 Cb -0.07 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 3gmo h ARG 79 CO -0.05 0.48 0.01 -0.44 -1.51 0.00 0.00 179.97 178.46 3gmo h ASP 80 N 0.67 -0.05 -0.22 -3.80 3.32 -0.56 0.49 116.42 116.27 3gmo h ASP 80 Ca 0.18 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.25 3gmo h ASP 80 Cb -0.02 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 3gmo h ASP 80 CO -0.03 -0.00 0.09 0.40 -1.72 0.00 0.00 179.24 177.97 3gmo h ILE 81 N 0.06 1.17 -0.65 0.35 1.08 -1.23 -0.55 117.51 117.73 3gmo h ILE 81 Ca 0.07 -0.51 -0.01 0.00 -0.39 0.00 0.00 64.86 64.03 3gmo h ILE 81 Cb 0.08 1.10 -0.03 0.00 -3.07 0.00 0.00 36.82 34.90 3gmo h ILE 81 CO -0.12 0.17 0.38 1.56 -0.69 0.00 0.00 178.15 179.44 3gmo h GLN 82 N 0.20 0.89 -0.36 2.37 4.20 -0.96 0.43 115.11 121.88 3gmo h GLN 82 Ca 0.07 -0.08 -0.14 0.00 0.06 0.00 0.00 58.65 58.56 3gmo h GLN 82 Cb 0.18 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 3gmo h GLN 82 CO -0.01 0.64 -0.33 0.93 -0.67 0.00 0.00 178.83 179.39 3gmo h GLU 83 N 0.90 0.80 -0.42 1.46 4.39 0.28 -1.97 114.58 120.03 3gmo h GLU 83 Ca 0.23 -0.38 -0.06 0.00 0.34 0.00 0.00 59.36 59.49 3gmo h GLU 83 Cb -0.01 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.62 3gmo h GLU 83 CO -0.04 1.01 0.01 1.25 -1.16 0.00 0.00 179.01 180.08 3gmo h LEU 84 N 0.67 0.72 -0.88 1.33 5.85 -0.55 -1.27 115.31 121.18 3gmo h LEU 84 Ca 0.07 -0.30 -0.07 0.00 0.84 0.00 0.00 57.88 58.42 3gmo h LEU 84 Cb 0.88 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.69 3gmo h LEU 84 CO 0.08 0.84 0.04 0.58 -0.34 0.00 0.00 178.44 179.64 3gmo h VAL 85 N 0.57 1.25 -0.98 1.05 2.07 -0.78 -1.47 116.25 117.95 3gmo h VAL 85 Ca 0.12 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.65 3gmo h VAL 85 Cb 0.47 0.80 -0.05 0.00 -1.52 0.00 0.00 31.29 30.99 3gmo h VAL 85 CO 0.02 0.36 0.63 0.11 0.02 0.00 0.00 177.57 178.71 3gmo h LYS 86 N 0.82 1.30 -0.00 1.57 1.57 -1.04 -1.29 116.57 119.50 3gmo h LYS 86 Ca 0.16 -0.09 -0.16 0.00 -1.87 0.00 0.00 60.65 58.69 3gmo h LYS 86 Cb 0.43 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 3gmo h LYS 86 CO 0.02 0.88 -0.76 1.98 -0.57 0.00 0.00 179.45 181.00 3gmo h MET 87 N 1.34 0.01 0.00 3.15 4.05 -0.59 -3.06 114.93 119.82 3gmo h MET 87 Ca 0.36 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.77 3gmo h MET 87 Cb -0.12 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.68 3gmo h MET 87 CO -0.07 0.76 -0.65 -1.33 0.23 0.00 0.00 176.91 175.85 3gmo n MET 88 N -3.65 0.25 -1.57 0.39 2.81 -0.61 -4.95 117.12 109.79 3gmo n MET 88 Ca -0.01 0.06 -0.50 0.00 -1.81 0.00 0.00 57.70 55.45 3gmo n MET 88 Cb 0.73 -1.65 -0.04 0.00 -0.71 0.00 0.00 33.22 31.55 3gmo n MET 88 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3gmo n SER 89 N -2.00 1.19 -1.83 7.83 2.88 -0.52 -0.71 113.62 120.45 3gmo n SER 89 Ca 0.03 1.14 -0.16 0.00 -1.33 0.00 0.00 58.87 58.56 3gmo n SER 89 Cb 0.42 -1.19 0.19 0.00 -0.75 0.00 0.00 64.21 62.89 3gmo n SER 89 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3gmo n PRO 90 N 1.77 2.18 0.23 -1.46 -0.04 -1.26 -4.97 135.00 131.46 3gmo n PRO 90 Ca 0.16 -3.08 0.12 0.00 -0.04 0.00 0.00 63.50 60.66 3gmo n PRO 90 Cb 0.23 -2.05 0.39 0.00 -0.04 0.00 0.00 33.50 32.03 3gmo n PRO 90 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3gmo h LYS 91 N 1.09 0.00 -3.48 0.54 1.57 -1.29 -3.38 116.57 111.62 3gmo h LYS 91 Ca 0.47 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 58.60 3gmo h LYS 91 Cb 2.41 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 34.32 3gmo h LYS 91 CO 0.83 0.11 -0.61 -1.21 -0.57 0.00 0.00 179.45 178.01 3gmo s GLU 92 N -3.43 2.01 0.70 3.15 0.41 -1.26 -5.10 118.70 115.18 3gmo s GLU 92 Ca 0.03 -2.57 -0.14 0.00 -0.41 0.00 0.00 54.97 51.88 3gmo s GLU 92 Cb 0.08 -3.36 0.02 0.00 -1.78 0.00 0.00 34.13 29.09 3gmo s GLU 92 CO 0.63 -1.11 1.11 -0.51 -0.49 0.00 0.00 175.26 174.90 3gmo s ASP 93 N -0.12 4.82 0.41 -0.19 1.11 -1.26 -4.88 116.67 116.55 3gmo s ASP 93 Ca 0.17 1.99 -0.12 0.00 0.18 0.00 0.00 52.55 54.77 3gmo s ASP 93 Cb -0.25 -2.55 -0.07 0.00 1.07 0.00 0.00 42.92 41.12 3gmo s ASP 93 CO -0.01 -1.83 0.80 -0.31 1.18 0.00 0.00 175.17 175.00 3gmo s TYR 94 N -2.45 3.46 0.48 4.23 4.12 -1.26 -4.62 117.35 121.30 3gmo s TYR 94 Ca 0.66 1.12 -0.20 0.00 0.02 0.00 0.00 57.07 58.67 3gmo s TYR 94 Cb -0.20 -2.50 -0.09 0.00 -1.52 0.00 0.00 41.96 37.65 3gmo s TYR 94 CO 0.46 -0.12 1.03 -1.25 0.02 0.00 0.00 175.55 175.69 3gmo s PRO 95 N -3.79 3.84 -0.03 -1.71 0.05 -1.26 -5.04 135.00 127.06 3gmo s PRO 95 Ca 0.53 1.35 0.04 0.00 0.05 0.00 0.00 61.00 62.96 3gmo s PRO 95 Cb -0.10 -2.11 -0.00 0.00 0.05 0.00 0.00 34.50 32.33 3gmo s PRO 95 CO 0.30 -0.39 -0.15 0.42 0.05 0.00 0.00 177.00 177.23 3gmo s ILE 96 N -1.99 1.21 -0.11 0.56 1.01 0.27 -4.99 121.20 117.17 3gmo s ILE 96 Ca 0.67 -0.61 0.02 0.00 0.00 0.00 0.00 60.65 60.73 3gmo s ILE 96 Cb -0.16 -1.04 -0.01 0.00 0.01 0.00 0.00 42.46 41.26 3gmo s ILE 96 CO 0.19 0.35 -0.19 -0.70 0.00 0.00 0.00 174.94 174.60 3gmo s GLU 97 N 0.00 3.13 -0.06 2.79 2.56 -1.26 -0.40 118.70 125.46 3gmo s GLU 97 Ca -0.02 -0.79 0.04 0.00 0.00 0.00 0.00 54.97 54.21 3gmo s GLU 97 Cb -0.10 -2.43 -0.00 0.00 2.00 0.00 0.00 34.13 33.60 3gmo s GLU 97 CO 0.01 0.23 -0.18 0.42 -0.56 0.00 0.00 175.26 175.18 3gmo s ILE 98 N 0.25 1.56 0.08 -3.70 1.01 -0.18 -0.71 121.20 119.51 3gmo s ILE 98 Ca -0.13 -0.77 0.08 0.00 0.00 0.00 0.00 60.65 59.83 3gmo s ILE 98 Cb -0.16 -1.35 -0.03 0.00 0.01 0.00 0.00 42.46 40.93 3gmo s ILE 98 CO 0.07 0.45 -0.22 -1.10 0.00 0.00 0.00 174.94 174.13 3gmo s GLN 99 N 0.13 1.32 0.01 2.79 -0.21 -0.47 -0.58 119.66 122.66 3gmo s GLN 99 Ca -0.07 -1.09 0.04 0.00 0.02 0.00 0.00 55.36 54.26 3gmo s GLN 99 Cb -0.13 -1.55 -0.01 0.00 1.00 0.00 0.00 33.01 32.31 3gmo s GLN 99 CO 0.03 0.38 -0.13 -0.51 -2.12 0.00 0.00 175.29 172.94 3gmo s LEU 100 N -1.58 2.07 -0.16 2.90 1.02 -0.26 -0.47 118.68 122.21 3gmo s LEU 100 Ca 0.08 -0.30 -0.00 0.00 0.02 0.00 0.00 54.13 53.92 3gmo s LEU 100 Cb -0.10 -0.63 0.04 0.00 0.02 0.00 0.00 46.19 45.53 3gmo s LEU 100 CO 0.03 0.11 -0.06 -0.55 0.02 0.00 0.00 176.35 175.91 3gmo s SER 101 N -0.58 2.81 0.02 2.29 0.15 0.01 -0.80 113.70 117.60 3gmo s SER 101 Ca 0.04 -0.64 -0.06 0.00 0.70 0.00 0.00 55.95 55.98 3gmo s SER 101 Cb -0.06 -0.93 -0.00 0.00 -1.71 0.00 0.00 66.02 63.32 3gmo s SER 101 CO 0.00 -0.17 0.12 0.00 1.20 0.00 0.00 173.24 174.39 3gmo s ALA 102 N 1.62 -0.21 0.00 5.45 0.00 -0.26 -0.71 121.76 127.65 3gmo s ALA 102 Ca 0.01 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.64 3gmo s ALA 102 Cb -0.15 0.18 0.00 0.00 0.00 0.00 0.00 23.12 23.15 3gmo s ALA 102 CO -0.08 -0.26 0.00 0.41 0.00 0.00 0.00 175.76 175.83 3gmo n GLY 103 N 1.11 -0.20 3.39 0.00 0.00 -0.58 0.47 105.19 109.38 3gmo n GLY 103 Ca -0.21 -1.07 -0.15 0.00 0.00 0.00 0.00 46.02 44.59 3gmo n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gmo s GLU 105 N -1.12 4.05 -0.13 0.00 2.12 0.22 -0.73 118.70 123.10 3gmo s GLU 105 Ca -0.11 -0.19 -0.16 0.00 0.36 0.00 0.00 54.97 54.87 3gmo s GLU 105 Cb -0.03 -3.58 -0.04 0.00 0.26 0.00 0.00 34.13 30.73 3gmo s GLU 105 CO 0.07 -0.06 0.39 -1.64 -0.54 0.00 0.00 175.26 173.48 3gmo s MET 106 N 1.40 4.28 0.40 4.30 -1.94 -0.15 -1.85 119.30 125.75 3gmo s MET 106 Ca 0.10 0.29 0.04 0.00 -1.71 0.00 0.00 55.69 54.41 3gmo s MET 106 Cb -0.15 -3.42 -0.04 0.00 2.01 0.00 0.00 34.83 33.23 3gmo s MET 106 CO 0.07 0.22 0.07 0.71 -0.01 0.00 0.00 175.02 176.07 3gmo s TYR 107 N 0.48 1.95 0.27 -0.03 2.02 -0.49 -2.26 117.35 119.28 3gmo s TYR 107 Ca 0.22 -1.04 -0.18 0.00 -0.37 0.00 0.00 57.07 55.70 3gmo s TYR 107 Cb -0.14 -1.37 -0.12 0.00 -0.40 0.00 0.00 41.96 39.92 3gmo s TYR 107 CO 0.08 0.00 0.17 -2.30 -1.57 0.00 0.00 175.55 171.92 3gmo n PRO 108 N -0.92 0.00 0.00 -1.71 -0.02 -1.26 -3.87 135.00 127.22 3gmo n PRO 108 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 3gmo n PRO 108 Cb 0.66 -0.78 0.00 0.00 -0.02 0.00 0.00 33.50 33.36 3gmo n PRO 108 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gmo n GLY 109 N 1.74 -1.05 0.66 -1.23 0.00 -1.26 -3.58 105.19 100.48 3gmo n GLY 109 Ca 0.10 -1.31 0.12 0.00 0.00 0.00 0.00 46.02 44.93 3gmo n GLY 109 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3gmo n ASN 110 N 0.37 2.04 -4.75 1.61 3.02 -1.26 -5.03 115.26 111.26 3gmo n ASN 110 Ca 0.00 -1.71 -0.36 0.00 -0.03 0.00 0.00 54.58 52.48 3gmo n ASN 110 Cb 0.00 -0.06 0.05 0.00 -0.61 0.00 0.00 39.78 39.16 3gmo n ASN 110 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gmo s ALA 111 N -1.88 2.49 0.16 5.41 0.00 -1.23 -4.89 121.76 121.82 3gmo s ALA 111 Ca 0.35 1.10 -0.23 0.00 0.00 0.00 0.00 51.96 53.17 3gmo s ALA 111 Cb 0.20 -3.49 0.06 0.00 0.00 0.00 0.00 23.12 19.89 3gmo s ALA 111 CO 0.30 -1.33 0.68 -1.54 0.00 0.00 0.00 175.76 173.88 3gmo s SER 112 N -1.50 -0.45 0.00 0.00 1.04 -1.26 -1.40 113.70 110.13 3gmo s SER 112 Ca 0.79 -0.15 0.02 0.00 0.48 0.00 0.00 55.95 57.08 3gmo s SER 112 Cb -0.33 0.59 -0.01 0.00 0.10 0.00 0.00 66.02 66.37 3gmo s SER 112 CO 0.36 -1.00 -0.05 -0.70 0.98 0.00 0.00 173.24 172.82 3gmo s GLU 113 N -3.68 0.41 0.38 4.02 2.56 -0.77 -4.99 118.70 116.63 3gmo s GLU 113 Ca 0.04 -0.27 0.08 0.00 0.00 0.00 0.00 54.97 54.83 3gmo s GLU 113 Cb -0.02 -0.36 -0.06 0.00 2.00 0.00 0.00 34.13 35.69 3gmo s GLU 113 CO -0.07 0.09 0.05 -1.12 -0.56 0.00 0.00 175.26 173.65 3gmo s SER 114 N -0.36 4.15 0.02 -1.70 0.01 -1.26 -0.61 113.70 113.96 3gmo s SER 114 Ca -0.00 -1.12 -0.21 0.00 1.31 0.00 0.00 55.95 55.93 3gmo s SER 114 Cb -0.03 -0.48 0.05 0.00 0.21 0.00 0.00 66.02 65.77 3gmo s SER 114 CO -0.00 -0.37 0.48 0.72 0.41 0.00 0.00 173.24 174.48 3gmo s PHE 115 N -2.59 -0.38 -0.27 2.43 -0.71 -0.50 -4.98 117.98 110.99 3gmo s PHE 115 Ca 0.36 0.46 -0.01 0.00 -1.04 0.00 0.00 56.93 56.71 3gmo s PHE 115 Cb 0.04 0.28 0.14 0.00 -1.21 0.00 0.00 43.02 42.27 3gmo s PHE 115 CO 0.20 -0.58 0.35 -1.17 -1.34 0.00 0.00 175.22 172.67 3gmo s LEU 116 N -1.78 -0.52 0.09 -1.99 0.20 -1.26 -1.52 118.68 111.89 3gmo s LEU 116 Ca -0.07 -0.30 0.08 0.00 0.69 0.00 0.00 54.13 54.53 3gmo s LEU 116 Cb -0.01 0.87 -0.04 0.00 -0.43 0.00 0.00 46.19 46.58 3gmo s LEU 116 CO 0.01 -0.35 -0.16 -1.00 -0.29 0.00 0.00 176.35 174.56 3gmo s HIS 117 N 2.47 2.59 -0.05 5.38 3.76 0.11 -1.11 115.29 128.44 3gmo s HIS 117 Ca 0.10 -0.24 0.03 0.00 -0.15 0.00 0.00 55.06 54.80 3gmo s HIS 117 Cb -0.14 -1.40 0.01 0.00 1.11 0.00 0.00 32.58 32.16 3gmo s HIS 117 CO -0.25 0.35 -0.12 0.08 -0.85 0.00 0.00 174.74 173.96 3gmo s VAL 118 N -1.09 1.04 0.04 -0.90 1.01 0.48 -0.81 120.40 120.17 3gmo s VAL 118 Ca 0.17 -0.47 0.07 0.00 0.00 0.00 0.00 61.98 61.76 3gmo s VAL 118 Cb -0.11 -0.94 -0.03 0.00 0.00 0.00 0.00 36.38 35.30 3gmo s VAL 118 CO 0.09 0.32 -0.17 0.00 0.00 0.00 0.00 175.10 175.35 3gmo s ALA 119 N 0.41 2.64 -0.10 5.51 0.00 0.38 -1.05 121.76 129.55 3gmo s ALA 119 Ca -0.09 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 50.72 3gmo s ALA 119 Cb -0.13 -0.78 0.01 0.00 0.00 0.00 0.00 23.12 22.23 3gmo s ALA 119 CO 0.02 0.58 -0.17 0.12 0.00 0.00 0.00 175.76 176.31 3gmo s PHE 120 N -0.94 2.02 -1.67 0.00 5.36 0.34 -1.36 117.98 121.73 3gmo s PHE 120 Ca 0.15 -0.88 -0.17 0.00 -0.96 0.00 0.00 56.93 55.07 3gmo s PHE 120 Cb -0.11 -1.42 0.14 0.00 -0.34 0.00 0.00 43.02 41.29 3gmo s PHE 120 CO 0.06 -0.42 0.80 1.04 -1.46 0.00 0.00 175.22 175.24 3gmo n GLN 121 N 3.93 -3.50 -0.54 10.12 1.13 0.11 -1.93 117.38 126.72 3gmo n GLN 121 Ca -0.20 0.40 0.00 0.00 -1.94 0.00 0.00 57.00 55.26 3gmo n GLN 121 Cb 0.52 -5.13 0.00 0.00 0.11 0.00 0.00 30.24 25.74 3gmo n GLN 121 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3gmo n GLY 122 N -1.47 0.75 3.06 1.08 0.00 -1.26 -5.03 105.19 102.32 3gmo n GLY 122 Ca 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 3gmo n GLY 122 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3gmo s LYS 123 N -0.46 1.66 0.09 1.61 2.20 -0.81 -5.06 119.74 118.96 3gmo s LYS 123 Ca 0.00 -0.48 -0.31 0.00 -0.36 0.00 0.00 55.97 54.83 3gmo s LYS 123 Cb 0.00 -1.41 -0.10 0.00 -1.51 0.00 0.00 37.83 34.81 3gmo s LYS 123 CO 0.00 0.12 1.90 -0.47 -0.36 0.00 0.00 175.35 176.54 3gmo s TYR 124 N 0.37 1.78 0.00 4.03 5.04 -1.26 -0.50 117.35 126.80 3gmo s TYR 124 Ca -0.09 -0.22 0.00 0.00 -2.44 0.00 0.00 57.07 54.31 3gmo s TYR 124 Cb -0.13 -4.22 0.00 0.00 0.35 0.00 0.00 41.96 37.96 3gmo s TYR 124 CO 0.03 -5.22 0.00 1.33 -1.34 0.00 0.00 175.55 170.35 3gmo n VAL 125 N 5.06 0.00 -4.03 3.14 0.24 -0.22 -4.84 118.33 117.68 3gmo n VAL 125 Ca 0.19 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.37 3gmo n VAL 125 Cb 0.39 -0.54 -0.11 0.00 -1.47 0.00 0.00 33.84 32.11 3gmo n VAL 125 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3gmo s VAL 126 N -1.65 0.37 0.11 3.34 1.01 -1.05 -0.37 120.40 122.15 3gmo s VAL 126 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 60.99 3gmo s VAL 126 Cb 0.00 -0.47 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 3gmo s VAL 126 CO 0.00 -0.41 -0.00 0.00 0.00 0.00 0.00 175.10 174.69 3gmo s ARG 127 N -1.49 0.86 -0.15 2.72 1.70 -0.42 -0.39 118.95 121.78 3gmo s ARG 127 Ca -0.12 -1.38 -0.09 0.00 -0.47 0.00 0.00 55.73 53.67 3gmo s ARG 127 Cb -0.10 0.05 -0.05 0.00 -0.57 0.00 0.00 34.95 34.28 3gmo s ARG 127 CO -0.00 -0.15 0.15 0.12 -1.08 0.00 0.00 175.30 174.34 3gmo s PHE 128 N -3.86 3.51 -0.16 5.89 5.36 -0.27 0.25 117.98 128.71 3gmo s PHE 128 Ca 0.17 0.46 -0.07 0.00 -0.96 0.00 0.00 56.93 56.53 3gmo s PHE 128 Cb 0.07 -2.07 0.07 0.00 -0.34 0.00 0.00 43.02 40.75 3gmo s PHE 128 CO -0.02 0.51 0.36 -0.46 -1.46 0.00 0.00 175.22 174.15 3gmo s TRP 129 N -0.32 -0.59 0.00 10.12 -0.11 0.17 -4.34 118.94 123.88 3gmo s TRP 129 Ca 0.12 1.23 0.00 0.00 1.22 0.00 0.00 56.10 58.67 3gmo s TRP 129 Cb -0.12 0.19 0.00 0.00 -1.50 0.00 0.00 33.47 32.04 3gmo s TRP 129 CO 0.02 -0.37 0.00 0.41 -4.62 0.00 0.00 176.95 172.38 3gmo n GLY 130 N 4.81 1.61 0.00 5.86 0.00 -1.26 -2.36 105.19 113.84 3gmo n GLY 130 Ca -0.16 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.90 3gmo n GLY 130 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3gmo n THR 131 N 0.00 0.76 -3.98 2.61 -2.24 -1.26 -4.90 114.28 105.27 3gmo n THR 131 Ca 0.00 -0.85 -0.09 0.00 -2.27 0.00 0.00 64.05 60.84 3gmo n THR 131 Cb 0.00 0.63 -0.08 0.00 -2.10 0.00 0.00 70.33 68.78 3gmo n THR 131 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3gmo s SER 132 N -0.76 0.17 0.17 3.42 1.04 -1.00 -4.95 113.70 111.80 3gmo s SER 132 Ca 0.00 -0.89 -0.25 0.00 0.48 0.00 0.00 55.95 55.29 3gmo s SER 132 Cb 0.00 0.35 -0.08 0.00 0.10 0.00 0.00 66.02 66.39 3gmo s SER 132 CO 0.00 -0.78 0.78 0.26 0.98 0.00 0.00 173.24 174.48 3gmo s TRP 133 N -3.95 3.90 -0.08 5.02 0.52 -1.26 -0.65 118.94 122.44 3gmo s TRP 133 Ca 0.14 1.64 -0.00 0.00 0.02 0.00 0.00 56.10 57.89 3gmo s TRP 133 Cb 0.05 -2.77 0.02 0.00 -1.15 0.00 0.00 33.47 29.62 3gmo s TRP 133 CO -0.04 0.51 -0.05 -1.14 0.02 0.00 0.00 176.95 176.25 3gmo s GLN 134 N -1.18 1.12 0.51 4.98 0.74 0.14 -4.94 119.66 121.03 3gmo s GLN 134 Ca 0.36 -0.12 -0.21 0.00 0.05 0.00 0.00 55.36 55.44 3gmo s GLN 134 Cb -0.23 -1.24 -0.06 0.00 1.10 0.00 0.00 33.01 32.58 3gmo s GLN 134 CO 0.26 -0.22 1.17 0.95 -0.55 0.00 0.00 175.29 176.90 3gmo s THR 135 N 1.58 2.98 0.24 -0.34 -4.23 -1.26 -1.30 115.64 113.30 3gmo s THR 135 Ca 0.01 0.67 -0.06 0.00 -1.18 0.00 0.00 61.69 61.13 3gmo s THR 135 Cb -0.13 -3.31 -0.06 0.00 1.34 0.00 0.00 72.50 70.34 3gmo s THR 135 CO -0.05 -0.07 0.51 0.68 -0.54 0.00 0.00 174.62 175.15 3gmo s VAL 136 N -1.61 5.04 0.33 2.29 -7.23 0.49 -4.90 120.40 114.82 3gmo s VAL 136 Ca 0.69 0.14 -0.29 0.00 -1.81 0.00 0.00 61.98 60.71 3gmo s VAL 136 Cb -0.28 -3.68 -0.11 0.00 0.56 0.00 0.00 36.38 32.87 3gmo s VAL 136 CO 0.33 -0.18 1.56 -2.84 -0.31 0.00 0.00 175.10 173.66 3gmo s PRO 137 N -3.17 4.10 0.00 4.82 0.02 -1.26 -1.29 135.00 138.23 3gmo s PRO 137 Ca 0.44 2.60 0.00 0.00 0.02 0.00 0.00 61.00 64.06 3gmo s PRO 137 Cb -0.11 -2.99 0.00 0.00 0.02 0.00 0.00 34.50 31.42 3gmo s PRO 137 CO 0.26 -0.61 0.00 0.41 -0.33 0.00 0.00 177.00 176.74 3gmo n GLY 138 N 1.37 3.06 3.75 0.52 0.00 -1.26 -5.07 105.19 107.56 3gmo n GLY 138 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 3gmo n GLY 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gmo s ALA 139 N -2.74 2.34 0.47 4.61 0.00 -0.41 -4.95 121.76 121.08 3gmo s ALA 139 Ca 0.00 0.72 -0.25 0.00 0.00 0.00 0.00 51.96 52.44 3gmo s ALA 139 Cb 0.00 -3.39 -0.08 0.00 0.00 0.00 0.00 23.12 19.66 3gmo s ALA 139 CO 0.00 -1.48 1.39 -2.14 0.00 0.00 0.00 175.76 173.53 3gmo s PRO 140 N -3.92 3.61 0.53 0.00 0.02 -1.26 -4.87 135.00 129.10 3gmo s PRO 140 Ca 0.71 2.33 0.31 0.00 0.02 0.00 0.00 61.00 64.37 3gmo s PRO 140 Cb -0.25 -2.58 1.40 0.00 0.02 0.00 0.00 34.50 33.09 3gmo s PRO 140 CO 0.42 -0.85 2.01 0.66 -0.33 0.00 0.00 177.00 178.91 3gmo h SER 141 N 2.18 0.00 0.37 2.53 4.64 -2.00 -2.31 113.55 118.96 3gmo h SER 141 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3gmo h SER 141 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 3gmo h SER 141 CO 0.60 0.09 0.00 -2.67 -0.87 0.00 0.00 176.83 173.98 3gmo n TRP 142 N -3.30 0.66 0.43 4.77 4.27 -1.26 -1.74 117.44 121.27 3gmo n TRP 142 Ca -0.01 0.30 0.13 0.00 -3.89 0.00 0.00 57.50 54.03 3gmo n TRP 142 Cb 0.29 -0.97 0.29 0.00 -1.36 0.00 0.00 31.31 29.56 3gmo n TRP 142 CO 0.00 0.00 0.00 -0.07 -2.29 0.00 0.00 177.69 175.33 3gmo h LEU 143 N 0.00 0.00 -0.62 5.67 3.38 -1.78 -3.36 115.31 118.60 3gmo h LEU 143 Ca 0.00 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 3gmo h LEU 143 Cb 0.19 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 3gmo h LEU 143 CO 0.00 0.00 0.18 0.44 0.09 0.00 0.00 178.44 179.15 3gmo h ASP 144 N 0.00 0.91 -0.11 -0.43 3.32 -1.53 -2.14 116.42 116.43 3gmo h ASP 144 Ca 0.00 -0.21 -0.08 0.00 0.02 0.00 0.00 57.03 56.75 3gmo h ASP 144 Cb 0.86 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.18 3gmo h ASP 144 CO 0.00 0.88 -0.25 0.25 -1.72 0.00 0.00 179.24 178.41 3gmo h LEU 145 N 0.89 0.41 -1.58 1.55 5.85 -1.79 -0.66 115.31 119.99 3gmo h LEU 145 Ca 0.20 -0.57 0.02 0.00 0.84 0.00 0.00 57.88 58.37 3gmo h LEU 145 Cb 0.31 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.20 3gmo h LEU 145 CO -0.00 0.90 0.32 -0.65 -0.34 0.00 0.00 178.44 178.67 3gmo h PRO 146 N -0.07 0.55 -0.12 5.25 0.10 -1.75 -0.55 132.00 135.40 3gmo h PRO 146 Ca 0.00 -0.03 -0.21 0.00 0.10 0.00 0.00 66.00 65.86 3gmo h PRO 146 Cb 0.84 -0.12 0.00 0.00 0.10 0.00 0.00 31.00 31.82 3gmo h PRO 146 CO 0.05 0.36 -0.76 0.82 0.10 0.00 0.00 178.00 178.58 3gmo h ILE 147 N 0.56 1.32 -0.47 4.15 1.08 -1.12 -0.76 117.51 122.27 3gmo h ILE 147 Ca 0.19 -2.04 -0.01 0.00 -0.39 0.00 0.00 64.86 62.62 3gmo h ILE 147 Cb 0.06 2.03 -0.02 0.00 -3.07 0.00 0.00 36.82 35.82 3gmo h ILE 147 CO -0.05 0.63 0.27 0.50 -0.69 0.00 0.00 178.15 178.82 3gmo h LYS 148 N 0.44 0.65 -0.64 2.37 3.11 -0.07 -0.05 116.57 122.37 3gmo h LYS 148 Ca -0.04 -0.07 -0.02 0.00 -2.81 0.00 0.00 60.65 57.71 3gmo h LYS 148 Cb 1.36 -0.13 -0.03 0.00 -1.00 0.00 0.00 32.23 32.43 3gmo h LYS 148 CO 0.15 0.49 0.33 0.28 -2.81 0.00 0.00 179.45 177.89 3gmo h VAL 149 N 0.62 1.21 -0.98 2.00 2.07 -1.02 -2.30 116.25 117.86 3gmo h VAL 149 Ca 0.17 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 67.12 3gmo h VAL 149 Cb 0.02 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 30.15 3gmo h VAL 149 CO -0.03 0.24 0.62 0.25 0.02 0.00 0.00 177.57 178.67 3gmo h LEU 150 N 0.88 1.15 -1.28 2.57 5.85 -0.84 -1.81 115.31 121.83 3gmo h LEU 150 Ca 0.22 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3gmo h LEU 150 Cb 0.08 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 40.82 3gmo h LEU 150 CO -0.03 0.85 0.00 0.78 -0.34 0.00 0.00 178.44 179.70 3gmo h ASN 151 N 1.33 0.00 1.28 1.25 2.35 -0.45 -1.37 115.58 119.97 3gmo h ASN 151 Ca 0.35 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.10 3gmo h ASN 151 Cb -0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.26 3gmo h ASN 151 CO -0.07 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.71 3gmo n ALA 152 N -1.85 2.17 -2.87 -0.83 0.00 -0.68 -4.50 120.51 111.94 3gmo n ALA 152 Ca 0.00 -0.01 -0.43 0.00 0.00 0.00 0.00 53.44 52.99 3gmo n ALA 152 Cb 0.16 -1.45 -0.02 0.00 0.00 0.00 0.00 19.45 18.13 3gmo n ALA 152 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3gmo s ASP 153 N -4.29 6.64 0.27 0.00 -1.08 -0.52 -4.82 116.67 112.87 3gmo s ASP 153 Ca 0.10 -2.01 -0.03 0.00 -0.52 0.00 0.00 52.55 50.09 3gmo s ASP 153 Cb 0.12 -2.43 0.37 0.00 -1.46 0.00 0.00 42.92 39.53 3gmo s ASP 153 CO 0.55 -1.11 1.86 1.56 0.52 0.00 0.00 175.17 178.54 3gmo h GLN 154 N 8.87 0.96 -0.54 4.34 4.20 -1.85 -1.22 115.11 129.88 3gmo h GLN 154 Ca 0.18 -0.15 0.01 0.00 0.06 0.00 0.00 58.65 58.74 3gmo h GLN 154 Cb 1.01 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.60 3gmo h GLN 154 CO 1.17 0.78 0.35 0.78 -0.67 0.00 0.00 178.83 181.24 3gmo h GLY 155 N 1.03 0.75 1.04 3.46 0.00 -1.97 -0.14 103.07 107.25 3gmo h GLY 155 Ca 0.23 -0.28 -0.08 0.00 0.00 0.00 0.00 47.33 47.20 3gmo h GLY 155 CO -0.02 0.27 0.08 -0.84 0.00 0.00 0.00 176.54 176.03 3gmo h THR 156 N 0.73 1.26 -0.77 4.70 2.02 -1.83 -0.40 112.91 118.61 3gmo h THR 156 Ca 0.20 -1.03 0.03 0.00 0.77 0.00 0.00 66.41 66.38 3gmo h THR 156 Cb -0.08 0.74 -0.05 0.00 -1.74 0.00 0.00 68.15 67.02 3gmo h THR 156 CO -0.04 0.38 0.49 -1.28 0.37 0.00 0.00 175.52 175.44 3gmo h SER 157 N 0.92 0.82 -0.47 4.18 0.87 -0.96 0.42 113.55 119.33 3gmo h SER 157 Ca 0.18 -0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.64 3gmo h SER 157 Cb 0.45 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 3gmo h SER 157 CO 0.01 0.56 -0.10 0.00 -0.53 0.00 0.00 176.83 176.78 3gmo h ALA 158 N 1.32 0.64 -0.44 6.23 0.00 -0.75 -0.57 119.26 125.69 3gmo h ALA 158 Ca 0.31 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3gmo h ALA 158 Cb 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3gmo h ALA 158 CO -0.11 0.53 0.29 1.15 0.00 0.00 0.00 179.25 181.11 3gmo h THR 159 N 0.73 1.12 -0.47 0.00 2.02 -0.69 -1.40 112.91 114.22 3gmo h THR 159 Ca 0.12 -0.24 -0.06 0.00 0.77 0.00 0.00 66.41 66.99 3gmo h THR 159 Cb 0.64 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 3gmo h THR 159 CO 0.04 0.12 0.05 0.58 0.37 0.00 0.00 175.52 176.69 3gmo h VAL 160 N 0.60 1.25 -0.64 3.16 2.07 -0.78 0.33 116.25 122.24 3gmo h VAL 160 Ca 0.16 -0.96 0.04 0.00 0.82 0.00 0.00 66.70 66.76 3gmo h VAL 160 Cb -0.05 0.95 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 3gmo h VAL 160 CO -0.03 0.34 0.37 1.56 0.02 0.00 0.00 177.57 179.82 3gmo h GLN 161 N 0.67 0.69 0.01 1.57 4.20 -1.03 0.55 115.11 121.76 3gmo h GLN 161 Ca 0.14 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.81 3gmo h GLN 161 Cb 0.43 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.05 3gmo h GLN 161 CO 0.01 0.45 -0.00 1.98 -0.67 0.00 0.00 178.83 180.60 3gmo h MET 162 N 0.71 -0.01 -0.49 1.46 4.05 -0.97 0.43 114.93 120.10 3gmo h MET 162 Ca 0.27 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.69 3gmo h MET 162 Cb 0.10 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.88 3gmo h MET 162 CO -0.14 0.03 0.31 -0.07 0.23 0.00 0.00 176.91 177.27 3gmo h LEU 163 N -0.05 0.57 0.01 3.39 3.38 -0.33 0.11 115.31 122.38 3gmo h LEU 163 Ca -0.00 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 3gmo h LEU 163 Cb 0.05 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.65 3gmo h LEU 163 CO 0.00 0.43 -0.00 -0.07 0.09 0.00 0.00 178.44 178.89 3gmo h LEU 164 N 0.66 -0.01 0.00 1.67 3.38 -0.87 0.09 115.31 120.23 3gmo h LEU 164 Ca 0.18 -0.56 -0.19 0.00 0.09 0.00 0.00 57.88 57.39 3gmo h LEU 164 Cb -0.05 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 3gmo h LEU 164 CO -0.04 0.56 -1.15 0.78 0.09 0.00 0.00 178.44 178.69 3gmo h ASN 165 N -0.58 0.00 0.00 -0.43 4.21 -0.86 -3.40 115.58 114.52 3gmo h ASN 165 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 3gmo h ASN 165 Cb 0.57 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.77 3gmo h ASN 165 CO 0.00 0.77 -0.07 0.47 -1.29 0.00 0.00 177.43 177.31 3gmo n ASP 166 N -3.13 0.77 -0.31 5.81 8.00 0.19 -4.71 116.55 123.18 3gmo n ASP 166 Ca -0.06 0.20 -0.02 0.00 0.71 0.00 0.00 54.79 55.61 3gmo n ASP 166 Cb 0.89 -0.17 0.10 0.00 -0.02 0.00 0.00 41.12 41.92 3gmo n ASP 166 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 3gmo h THR 167 N 0.00 1.17 0.98 -3.53 2.02 -0.98 -2.64 112.91 109.92 3gmo h THR 167 Ca 0.00 -0.37 -0.05 0.00 0.77 0.00 0.00 66.41 66.76 3gmo h THR 167 Cb 0.07 -0.02 0.01 0.00 -1.74 0.00 0.00 68.15 66.47 3gmo h THR 167 CO 0.00 0.20 -0.47 0.00 0.37 0.00 0.00 175.52 175.62 3gmo h PRO 169 N -1.33 0.32 -0.39 0.00 0.13 -1.79 -0.73 132.00 128.20 3gmo h PRO 169 Ca -0.13 -0.10 -0.02 0.00 -0.87 0.00 0.00 66.00 64.88 3gmo h PRO 169 Cb 1.00 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.09 3gmo h PRO 169 CO 0.22 0.52 0.17 1.25 -0.23 0.00 0.00 178.00 179.93 3gmo h LEU 170 N 0.29 0.52 -0.25 1.56 5.85 -1.35 -1.21 115.31 120.72 3gmo h LEU 170 Ca 0.05 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 3gmo h LEU 170 Cb 0.53 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 3gmo h LEU 170 CO 0.04 0.53 0.13 0.15 -0.34 0.00 0.00 178.44 178.94 3gmo h PHE 171 N 0.48 0.34 -0.83 1.25 3.57 -0.33 -2.61 116.94 118.80 3gmo h PHE 171 Ca 0.13 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.59 3gmo h PHE 171 Cb 0.16 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.75 3gmo h PHE 171 CO -0.01 0.31 0.40 0.28 -2.23 0.00 0.00 178.31 177.06 3gmo h VAL 172 N 0.28 1.26 -0.95 1.41 2.07 -1.04 -0.94 116.25 118.33 3gmo h VAL 172 Ca 0.09 -0.73 0.15 0.00 0.82 0.00 0.00 66.70 67.03 3gmo h VAL 172 Cb 0.09 0.19 -0.08 0.00 -1.52 0.00 0.00 31.29 29.96 3gmo h VAL 172 CO -0.01 0.31 0.60 0.03 0.02 0.00 0.00 177.57 178.52 3gmo h ARG 173 N 1.19 0.77 -0.06 1.57 3.08 -1.04 0.14 114.38 120.03 3gmo h ARG 173 Ca 0.29 -0.05 -0.17 0.00 0.07 0.00 0.00 59.98 60.12 3gmo h ARG 173 Cb 0.12 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 3gmo h ARG 173 CO -0.04 0.51 -0.71 0.78 -1.07 0.00 0.00 179.97 179.45 3gmo h GLY 174 N 0.80 0.35 0.95 0.04 0.00 -1.00 -2.58 103.07 101.63 3gmo h GLY 174 Ca 0.49 -0.49 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 3gmo h GLY 174 CO -0.25 0.43 0.15 1.41 0.00 0.00 0.00 176.54 178.28 3gmo h LEU 175 N 0.22 0.64 -1.66 3.11 3.38 0.15 -0.81 115.31 120.34 3gmo h LEU 175 Ca -0.02 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 3gmo h LEU 175 Cb 1.27 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 3gmo h LEU 175 CO 0.12 0.67 0.02 -0.07 0.09 0.00 0.00 178.44 179.27 3gmo h LEU 176 N 0.58 0.21 0.01 1.67 3.38 -0.69 0.12 115.31 120.60 3gmo h LEU 176 Ca 0.15 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.94 3gmo h LEU 176 Cb 0.25 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 40.96 3gmo h LEU 176 CO -0.01 0.24 -0.61 -0.08 0.09 0.00 0.00 178.44 178.08 3gmo h GLU 177 N 0.24 0.40 0.00 1.13 4.81 -1.23 -3.02 114.58 116.91 3gmo h GLU 177 Ca 0.06 -0.44 -0.10 0.00 -0.13 0.00 0.00 59.36 58.75 3gmo h GLU 177 Cb 0.13 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 3gmo h GLU 177 CO -0.00 1.11 -0.46 0.00 -0.73 0.00 0.00 179.01 178.93 3gmo h ALA 178 N 0.31 0.91 -0.41 2.92 0.00 -0.85 -3.14 119.26 119.00 3gmo h ALA 178 Ca -0.08 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3gmo h ALA 178 Cb 1.33 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3gmo h ALA 178 CO 0.12 0.57 0.00 0.41 0.00 0.00 0.00 179.25 180.35 3gmo n GLY 179 N 0.43 3.41 0.15 0.00 0.00 0.40 -4.75 105.19 104.83 3gmo n GLY 179 Ca -0.00 -0.88 -0.05 0.00 0.00 0.00 0.00 46.02 45.08 3gmo n GLY 179 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3gmo h LYS 180 N 2.68 0.10 0.00 1.61 3.64 -1.47 0.93 116.57 124.06 3gmo h LYS 180 Ca 0.00 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 3gmo h LYS 180 Cb 1.44 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.24 3gmo h LYS 180 CO 0.24 0.06 -0.21 0.66 -2.27 0.00 0.00 179.45 177.94 3gmo h SER 181 N 0.10 0.00 0.02 4.20 4.64 -1.87 -0.52 113.55 120.12 3gmo h SER 181 Ca 0.17 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.32 3gmo h SER 181 Cb 0.24 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.34 3gmo h SER 181 CO -0.29 0.21 -0.68 0.44 -0.87 0.00 0.00 176.83 175.64 3gmo h ASP 182 N 0.00 0.56 0.32 4.97 3.32 -1.38 -3.08 116.42 121.14 3gmo h ASP 182 Ca -0.00 -0.78 -0.05 0.00 0.02 0.00 0.00 57.03 56.22 3gmo h ASP 182 Cb 0.48 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 3gmo h ASP 182 CO 0.03 1.28 -0.22 -0.07 -1.72 0.00 0.00 179.24 178.53 3gmo h LEU 183 N -0.09 0.00 -2.73 1.55 3.38 -0.66 -2.48 115.31 114.27 3gmo h LEU 183 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3gmo h LEU 183 Cb 1.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.15 3gmo h LEU 183 CO 0.13 0.22 0.00 -0.62 0.09 0.00 0.00 178.44 178.27 3gmo n GLU 184 N -4.02 2.83 -1.74 1.13 1.02 -0.22 -5.00 120.64 114.64 3gmo n GLU 184 Ca -0.02 -2.65 -0.37 0.00 -0.02 0.00 0.00 57.16 54.10 3gmo n GLU 184 Cb 0.30 -1.61 0.06 0.00 -0.02 0.00 0.00 31.44 30.17 3gmo n GLU 184 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 3gmo s LYS 185 N -1.14 2.69 -0.12 3.49 -2.85 -0.94 -5.02 119.74 115.86 3gmo s LYS 185 Ca 0.49 2.13 0.02 0.00 -1.00 0.00 0.00 55.97 57.62 3gmo s LYS 185 Cb 0.26 -1.96 0.01 0.00 -2.06 0.00 0.00 37.83 34.09 3gmo s LYS 185 CO 0.32 -1.51 -0.20 -0.65 0.10 0.00 0.00 175.35 173.41 3gmo s GLN 186 N -3.25 2.73 -0.04 1.78 -1.52 -1.26 -4.00 119.66 114.10 3gmo s GLN 186 Ca 0.80 -0.75 0.04 0.00 -1.95 0.00 0.00 55.36 53.50 3gmo s GLN 186 Cb -0.39 -2.21 -0.00 0.00 -0.22 0.00 0.00 33.01 30.19 3gmo s GLN 186 CO 0.42 0.00 -0.16 -1.21 -0.25 0.00 0.00 175.29 174.10 3gmo s GLU 187 N 0.78 1.71 0.04 2.91 0.41 0.47 -4.95 118.70 120.06 3gmo s GLU 187 Ca -0.09 -0.57 -0.25 0.00 -0.41 0.00 0.00 54.97 53.65 3gmo s GLU 187 Cb -0.16 -1.49 -0.05 0.00 -1.78 0.00 0.00 34.13 30.65 3gmo s GLU 187 CO 0.00 0.22 0.75 0.15 -0.49 0.00 0.00 175.26 175.89 3gmo s LYS 188 N 0.07 4.48 0.71 1.61 1.02 -1.26 -1.77 119.74 124.61 3gmo s LYS 188 Ca -0.04 1.03 -0.15 0.00 0.02 0.00 0.00 55.97 56.83 3gmo s LYS 188 Cb -0.11 -3.36 0.03 0.00 -0.52 0.00 0.00 37.83 33.87 3gmo s LYS 188 CO 0.02 0.29 1.17 -1.25 -0.92 0.00 0.00 175.35 174.67 3gmo s PRO 189 N -0.07 2.31 0.07 -1.68 0.04 -1.26 -4.28 135.00 130.13 3gmo s PRO 189 Ca 0.38 1.64 0.09 0.00 0.04 0.00 0.00 61.00 63.15 3gmo s PRO 189 Cb -0.20 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.44 3gmo s PRO 189 CO 0.22 -1.68 -0.25 0.08 0.04 0.00 0.00 177.00 175.42 3gmo s VAL 190 N -2.11 2.04 0.15 -0.36 1.01 -0.21 -4.94 120.40 115.98 3gmo s VAL 190 Ca 0.72 -1.46 0.08 0.00 0.00 0.00 0.00 61.98 61.33 3gmo s VAL 190 Cb -0.26 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.30 3gmo s VAL 190 CO 0.44 0.24 -0.19 0.00 0.00 0.00 0.00 175.10 175.59 3gmo s ALA 191 N -0.89 1.97 0.08 5.51 0.00 -1.26 -0.89 121.76 126.27 3gmo s ALA 191 Ca 0.11 -1.45 -0.16 0.00 0.00 0.00 0.00 51.96 50.46 3gmo s ALA 191 Cb -0.10 -0.19 0.03 0.00 0.00 0.00 0.00 23.12 22.86 3gmo s ALA 191 CO 0.03 0.26 0.37 1.67 0.00 0.00 0.00 175.76 178.08 3gmo s TRP 192 N -1.90 -0.17 0.07 0.00 -2.14 -0.46 -4.99 118.94 109.34 3gmo s TRP 192 Ca 0.14 -0.02 0.04 0.00 2.66 0.00 0.00 56.10 58.92 3gmo s TRP 192 Cb -0.06 0.18 -0.04 0.00 -3.10 0.00 0.00 33.47 30.45 3gmo s TRP 192 CO 0.06 -0.60 0.01 -0.51 -2.66 0.00 0.00 176.95 173.25 3gmo s LEU 193 N -2.39 3.54 0.28 -4.66 1.43 -1.26 -0.82 118.68 114.80 3gmo s LEU 193 Ca -0.01 -0.11 -0.06 0.00 -1.03 0.00 0.00 54.13 52.92 3gmo s LEU 193 Cb 0.01 -2.22 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 3gmo s LEU 193 CO -0.07 0.19 0.41 -0.94 0.23 0.00 0.00 176.35 176.17 3gmo s SER 194 N -2.18 0.42 0.00 2.29 1.04 -0.36 -4.99 113.70 109.91 3gmo s SER 194 Ca 0.25 -1.27 0.00 0.00 0.48 0.00 0.00 55.95 55.41 3gmo s SER 194 Cb -0.12 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.58 3gmo s SER 194 CO 0.17 -1.15 0.00 -1.54 0.98 0.00 0.00 173.24 171.70 3gmo n SER 195 N -0.83 0.00 0.00 7.02 3.41 -1.26 -0.03 113.62 121.93 3gmo n SER 195 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3gmo n SER 195 Cb 0.63 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.58 3gmo n SER 195 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gmo n HIS 203 N 0.00 0.00 -4.10 7.33 -0.00 -1.26 -5.03 115.22 112.16 3gmo n HIS 203 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 57.57 3gmo n HIS 203 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 29.94 3gmo n HIS 203 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.34 175.36 3gmo s ARG 204 N 0.00 1.88 -0.27 -1.40 1.70 0.18 -4.83 118.95 116.21 3gmo s ARG 204 Ca 0.00 -1.76 -0.04 0.00 -0.47 0.00 0.00 55.73 53.46 3gmo s ARG 204 Cb 0.00 0.43 0.01 0.00 -0.57 0.00 0.00 34.95 34.83 3gmo s ARG 204 CO 0.00 -0.77 0.01 -1.14 -1.08 0.00 0.00 175.30 172.32 3gmo s GLN 205 N -3.13 3.00 0.12 3.89 0.74 -1.26 0.10 119.66 123.12 3gmo s GLN 205 Ca 0.31 -0.89 -0.18 0.00 0.05 0.00 0.00 55.36 54.66 3gmo s GLN 205 Cb -0.00 -3.17 -0.07 0.00 1.10 0.00 0.00 33.01 30.87 3gmo s GLN 205 CO 0.20 -0.40 0.58 -0.51 -0.55 0.00 0.00 175.29 174.61 3gmo s LEU 206 N 1.42 4.44 -0.10 3.68 1.43 0.15 -4.50 118.68 125.20 3gmo s LEU 206 Ca 0.02 1.21 0.03 0.00 -1.03 0.00 0.00 54.13 54.36 3gmo s LEU 206 Cb -0.17 -3.11 0.01 0.00 0.03 0.00 0.00 46.19 42.95 3gmo s LEU 206 CO -0.01 0.19 -0.18 -0.69 0.23 0.00 0.00 176.35 175.88 3gmo s VAL 207 N -1.29 1.69 -0.23 -1.59 1.01 0.95 -1.18 120.40 119.76 3gmo s VAL 207 Ca 0.34 -0.78 -0.07 0.00 0.00 0.00 0.00 61.98 61.47 3gmo s VAL 207 Cb -0.18 -1.50 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 3gmo s VAL 207 CO 0.19 0.48 0.06 0.00 0.00 0.00 0.00 175.10 175.83 3gmo s HIS 209 N 1.35 3.27 -0.09 0.00 3.76 0.00 -0.44 115.29 123.14 3gmo s HIS 209 Ca 0.05 0.13 -0.01 0.00 -0.15 0.00 0.00 55.06 55.09 3gmo s HIS 209 Cb -0.15 -2.01 0.03 0.00 1.11 0.00 0.00 32.58 31.56 3gmo s HIS 209 CO 0.03 0.27 -0.04 0.08 -0.85 0.00 0.00 174.74 174.23 3gmo s VAL 210 N 0.01 0.70 0.02 -0.90 1.01 0.91 -1.36 120.40 120.79 3gmo s VAL 210 Ca 0.06 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 61.96 3gmo s VAL 210 Cb -0.12 -0.78 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 3gmo s VAL 210 CO 0.01 0.31 -0.05 -0.55 0.00 0.00 0.00 175.10 174.82 3gmo s SER 211 N 1.74 0.55 0.00 3.32 0.15 -0.07 -0.61 113.70 118.77 3gmo s SER 211 Ca 0.03 -0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.31 3gmo s SER 211 Cb -0.13 0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.21 3gmo s SER 211 CO -0.06 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 174.85 3gmo n GLY 212 N 2.01 0.91 3.87 9.45 0.00 0.47 -1.05 105.19 120.85 3gmo n GLY 212 Ca -0.20 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 3gmo n GLY 212 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3gmo s PHE 213 N -2.00 3.43 -0.25 1.61 -0.71 -1.18 -3.99 117.98 114.88 3gmo s PHE 213 Ca 0.00 0.99 -0.23 0.00 -1.04 0.00 0.00 56.93 56.65 3gmo s PHE 213 Cb 0.00 -2.37 0.06 0.00 -1.21 0.00 0.00 43.02 39.51 3gmo s PHE 213 CO 0.00 0.11 0.66 -0.47 -1.34 0.00 0.00 175.22 174.19 3gmo s TYR 214 N -2.04 -0.73 0.78 3.49 6.14 -0.73 -1.25 117.35 123.01 3gmo s TYR 214 Ca 0.50 1.78 -0.13 0.00 0.64 0.00 0.00 57.07 59.86 3gmo s TYR 214 Cb -0.11 0.25 0.19 0.00 0.42 0.00 0.00 41.96 42.71 3gmo s TYR 214 CO 0.24 -0.35 0.81 -0.35 0.64 0.00 0.00 175.55 176.54 3gmo n PRO 215 N 2.74 -1.85 -0.06 4.97 -0.04 -1.26 -0.40 135.00 139.10 3gmo n PRO 215 Ca -0.14 -1.28 -0.05 0.00 -0.04 0.00 0.00 63.50 61.99 3gmo n PRO 215 Cb 0.55 -1.05 0.16 0.00 -0.04 0.00 0.00 33.50 33.12 3gmo n PRO 215 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 3gmo h LYS 216 N 0.00 0.69 -6.79 0.54 3.64 -1.99 -3.44 116.57 109.22 3gmo h LYS 216 Ca -0.29 -0.23 -0.53 0.00 -1.27 0.00 0.00 60.65 58.33 3gmo h LYS 216 Cb 0.84 -0.06 0.07 0.00 -0.41 0.00 0.00 32.23 32.67 3gmo h LYS 216 CO 0.19 0.80 0.75 -2.14 -2.27 0.00 0.00 179.45 176.79 3gmo s PRO 217 N -4.72 4.25 0.02 1.90 0.02 -1.26 -4.96 135.00 130.25 3gmo s PRO 217 Ca -0.09 2.34 -0.28 0.00 0.02 0.00 0.00 61.00 62.99 3gmo s PRO 217 Cb 0.14 -3.08 0.08 0.00 0.02 0.00 0.00 34.50 31.65 3gmo s PRO 217 CO 0.81 -0.41 0.68 0.54 -0.33 0.00 0.00 177.00 178.29 3gmo s VAL 218 N -0.29 0.00 -0.07 3.83 0.11 -1.26 -4.63 120.40 118.09 3gmo s VAL 218 Ca 0.57 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.65 3gmo s VAL 218 Cb -0.42 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.44 3gmo s VAL 218 CO 0.47 0.00 -0.14 0.86 -3.33 0.00 0.00 175.10 172.96 3gmo s TRP 219 N -2.18 1.66 -0.07 1.54 -0.00 -0.81 -5.03 118.94 114.06 3gmo s TRP 219 Ca -0.05 -0.64 -0.01 0.00 -0.00 0.00 0.00 56.10 55.40 3gmo s TRP 219 Cb -0.00 -1.19 0.03 0.00 -0.00 0.00 0.00 33.47 32.30 3gmo s TRP 219 CO 0.00 -0.31 -0.01 0.08 -0.00 0.00 0.00 176.95 176.71 3gmo s VAL 220 N 0.65 0.43 -0.06 5.86 1.01 -1.26 -1.16 120.40 125.86 3gmo s VAL 220 Ca -0.15 0.05 -0.09 0.00 0.00 0.00 0.00 61.98 61.80 3gmo s VAL 220 Cb -0.16 -0.55 0.02 0.00 0.00 0.00 0.00 36.38 35.69 3gmo s VAL 220 CO 0.04 0.25 0.22 -0.32 0.00 0.00 0.00 175.10 175.30 3gmo s MET 221 N 1.68 0.35 0.21 2.72 0.00 -0.52 -4.96 119.30 118.78 3gmo s MET 221 Ca 0.01 0.14 -0.30 0.00 0.00 0.00 0.00 55.69 55.54 3gmo s MET 221 Cb -0.13 0.16 -0.08 0.00 0.00 0.00 0.00 34.83 34.78 3gmo s MET 221 CO -0.04 -0.06 1.01 -1.58 0.00 0.00 0.00 175.02 174.34 3gmo s TRP 222 N -0.31 3.79 0.03 4.11 0.52 -1.26 -0.24 118.94 125.59 3gmo s TRP 222 Ca -0.04 1.79 0.04 0.00 0.02 0.00 0.00 56.10 57.91 3gmo s TRP 222 Cb -0.03 -3.12 -0.02 0.00 -1.15 0.00 0.00 33.47 29.15 3gmo s TRP 222 CO 0.01 -0.01 -0.13 -1.64 0.02 0.00 0.00 176.95 175.21 3gmo s MET 223 N -0.84 0.86 -0.37 4.98 -1.94 0.11 -0.65 119.30 121.45 3gmo s MET 223 Ca 0.45 -0.68 -0.01 0.00 -1.71 0.00 0.00 55.69 53.73 3gmo s MET 223 Cb -0.27 -0.84 0.10 0.00 2.01 0.00 0.00 34.83 35.83 3gmo s MET 223 CO 0.34 0.21 0.13 0.50 -0.01 0.00 0.00 175.02 176.18 3gmo s ARG 224 N -1.02 1.93 7.11 2.03 3.52 -0.13 -0.63 118.95 131.75 3gmo s ARG 224 Ca 0.01 -1.75 0.00 0.00 -0.13 0.00 0.00 55.73 53.86 3gmo s ARG 224 Cb -0.07 -3.41 0.00 0.00 -1.56 0.00 0.00 34.95 29.91 3gmo s ARG 224 CO 0.01 -0.96 0.00 0.41 -0.81 0.00 0.00 175.30 173.95 3gmo n GLY 225 N 4.50 2.38 0.10 8.12 0.00 -1.26 -1.59 105.19 117.44 3gmo n GLY 225 Ca -0.02 -0.34 0.14 0.00 0.00 0.00 0.00 46.02 45.80 3gmo n GLY 225 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3gmo n ASP 226 N 5.41 0.39 -4.53 1.61 8.00 -1.26 -4.81 116.55 121.36 3gmo n ASP 226 Ca 0.00 -0.55 -0.43 0.00 0.71 0.00 0.00 54.79 54.52 3gmo n ASP 226 Cb 0.00 -0.10 -0.06 0.00 -0.02 0.00 0.00 41.12 40.94 3gmo n ASP 226 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 3gmo s GLN 227 N -2.45 3.39 0.18 -1.24 0.74 -0.62 -5.03 119.66 114.63 3gmo s GLN 227 Ca 0.30 -0.22 -0.32 0.00 0.05 0.00 0.00 55.36 55.18 3gmo s GLN 227 Cb 0.20 -3.92 -0.11 0.00 1.10 0.00 0.00 33.01 30.28 3gmo s GLN 227 CO 0.46 -0.99 1.69 -1.21 -0.55 0.00 0.00 175.29 174.69 3gmo s GLU 228 N 2.93 4.16 -0.33 1.67 2.02 -1.26 -0.95 118.70 126.94 3gmo s GLU 228 Ca 0.25 2.52 -0.27 0.00 0.02 0.00 0.00 54.97 57.49 3gmo s GLU 228 Cb -0.14 -3.19 0.01 0.00 0.10 0.00 0.00 34.13 30.92 3gmo s GLU 228 CO 0.19 -0.72 0.99 -0.65 0.02 0.00 0.00 175.26 175.09 3gmo s GLN 229 N 1.43 4.00 0.49 1.61 -1.52 0.18 -4.93 119.66 120.92 3gmo s GLN 229 Ca 0.74 0.88 0.19 0.00 -1.95 0.00 0.00 55.36 55.22 3gmo s GLN 229 Cb -0.47 -3.75 1.22 0.00 -0.22 0.00 0.00 33.01 29.79 3gmo s GLN 229 CO 0.32 -0.86 2.06 1.96 -0.25 0.00 0.00 175.29 178.52 3gmo h GLN 230 N 8.17 0.00 0.00 2.91 1.08 -1.92 -2.48 115.11 122.87 3gmo h GLN 230 Ca -0.22 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.98 3gmo h GLN 230 Cb 1.07 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.50 3gmo h GLN 230 CO 0.99 0.12 0.00 0.41 -0.95 0.00 0.00 178.83 179.41 3gmo n GLY 231 N -1.06 -0.78 3.69 3.46 0.00 -1.26 -4.84 105.19 104.40 3gmo n GLY 231 Ca -0.02 -0.13 -0.44 0.00 0.00 0.00 0.00 46.02 45.43 3gmo n GLY 231 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3gmo n THR 232 N -1.08 0.15 -4.01 2.61 -1.04 -0.93 -4.60 114.28 105.37 3gmo n THR 232 Ca 0.15 -0.03 -0.31 0.00 -2.04 0.00 0.00 64.05 61.82 3gmo n THR 232 Cb 0.10 -1.89 -0.16 0.00 -1.82 0.00 0.00 70.33 66.57 3gmo n THR 232 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 3gmo s HIS 233 N 1.74 2.66 0.10 -1.42 3.76 0.23 -4.94 115.29 117.43 3gmo s HIS 233 Ca 0.79 -1.82 -0.31 0.00 -0.15 0.00 0.00 55.06 53.58 3gmo s HIS 233 Cb -0.56 -1.72 -0.07 0.00 1.11 0.00 0.00 32.58 31.34 3gmo s HIS 233 CO 0.37 -0.79 1.23 0.50 -0.85 0.00 0.00 174.74 175.19 3gmo s ARG 234 N 1.31 4.43 0.15 1.40 3.52 -1.26 -1.56 118.95 126.94 3gmo s ARG 234 Ca -0.04 1.84 -0.02 0.00 -0.13 0.00 0.00 55.73 57.38 3gmo s ARG 234 Cb -0.18 -3.31 0.03 0.00 -1.56 0.00 0.00 34.95 29.94 3gmo s ARG 234 CO -0.07 -0.24 0.18 0.41 -0.81 0.00 0.00 175.30 174.76 3gmo n GLY 235 N 3.02 -1.55 3.82 8.12 0.00 -0.01 -4.99 105.19 113.59 3gmo n GLY 235 Ca 0.08 -1.61 -0.33 0.00 0.00 0.00 0.00 46.02 44.16 3gmo n GLY 235 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3gmo s ASP 236 N -1.74 6.75 -0.04 1.61 1.01 -1.26 -4.85 116.67 118.15 3gmo s ASP 236 Ca 0.10 1.74 -0.30 0.00 0.71 0.00 0.00 52.55 54.81 3gmo s ASP 236 Cb -0.00 -2.54 -0.02 0.00 1.01 0.00 0.00 42.92 41.36 3gmo s ASP 236 CO 0.07 -0.49 1.03 -0.36 0.21 0.00 0.00 175.17 175.63 3gmo s PHE 237 N -2.16 3.54 0.00 4.23 0.08 -1.26 -4.55 117.98 117.86 3gmo s PHE 237 Ca 0.63 1.58 0.06 0.00 0.12 0.00 0.00 56.93 59.33 3gmo s PHE 237 Cb -0.11 -3.20 -0.03 0.00 -0.57 0.00 0.00 43.02 39.11 3gmo s PHE 237 CO 0.16 -0.32 -0.20 -0.51 -0.10 0.00 0.00 175.22 174.26 3gmo s LEU 238 N 1.53 2.47 0.17 -0.37 1.43 0.21 -4.97 118.68 119.15 3gmo s LEU 238 Ca 0.51 -0.38 -0.26 0.00 -1.03 0.00 0.00 54.13 52.97 3gmo s LEU 238 Cb -0.21 -1.46 -0.08 0.00 0.03 0.00 0.00 46.19 44.47 3gmo s LEU 238 CO 0.23 0.30 0.81 -2.16 0.23 0.00 0.00 176.35 175.77 3gmo s PRO 239 N -1.01 4.62 0.69 1.29 0.04 -1.26 -0.73 135.00 138.64 3gmo s PRO 239 Ca 0.12 1.22 -0.10 0.00 0.04 0.00 0.00 61.00 62.29 3gmo s PRO 239 Cb -0.10 -3.28 0.03 0.00 0.04 0.00 0.00 34.50 31.18 3gmo s PRO 239 CO 0.02 0.52 1.05 -0.80 0.04 0.00 0.00 177.00 177.83 3gmo s ASN 240 N -1.01 5.30 0.00 6.66 0.01 -0.22 -4.88 114.94 120.80 3gmo s ASN 240 Ca 0.37 0.92 0.16 0.00 -0.71 0.00 0.00 52.86 53.60 3gmo s ASN 240 Cb -0.23 -1.71 0.72 0.00 0.41 0.00 0.00 41.25 40.43 3gmo s ASN 240 CO 0.27 -1.37 1.49 0.00 -1.51 0.00 0.00 177.10 175.98 3gmo n ALA 241 N -2.94 2.54 -1.93 0.60 0.00 -1.26 -3.88 120.51 113.64 3gmo n ALA 241 Ca 0.07 -0.32 -0.12 0.00 0.00 0.00 0.00 53.44 53.07 3gmo n ALA 241 Cb 0.58 -1.14 0.09 0.00 0.00 0.00 0.00 19.45 18.98 3gmo n ALA 241 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3gmo n ASP 242 N -0.16 3.58 -3.78 0.00 5.75 -1.26 -4.95 116.55 115.73 3gmo n ASP 242 Ca 0.13 -3.68 -0.25 0.00 -0.01 0.00 0.00 54.79 50.98 3gmo n ASP 242 Cb 0.19 -0.41 0.03 0.00 -1.03 0.00 0.00 41.12 39.89 3gmo n ASP 242 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3gmo n GLU 243 N -0.81 -5.12 -4.21 0.11 1.02 -1.25 -5.00 120.64 105.37 3gmo n GLU 243 Ca 0.33 0.61 -0.14 0.00 -0.02 0.00 0.00 57.16 57.94 3gmo n GLU 243 Cb 0.87 -5.27 -0.09 0.00 -0.02 0.00 0.00 31.44 26.92 3gmo n GLU 243 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3gmo s THR 244 N -3.55 0.00 0.28 2.62 -4.23 -1.26 -4.84 115.64 104.66 3gmo s THR 244 Ca 0.24 -1.99 0.10 0.00 -1.18 0.00 0.00 61.69 58.87 3gmo s THR 244 Cb -0.12 -2.50 -0.05 0.00 1.34 0.00 0.00 72.50 71.18 3gmo s THR 244 CO 0.82 0.00 -0.03 0.26 -0.54 0.00 0.00 174.62 175.13 3gmo s TRP 245 N -3.99 2.60 -0.03 3.99 0.52 -0.38 -1.06 118.94 120.59 3gmo s TRP 245 Ca 0.39 -0.28 0.02 0.00 0.02 0.00 0.00 56.10 56.25 3gmo s TRP 245 Cb 0.06 -1.21 0.01 0.00 -1.15 0.00 0.00 33.47 31.17 3gmo s TRP 245 CO 0.16 0.61 -0.07 -0.47 0.02 0.00 0.00 176.95 177.19 3gmo s TYR 246 N -2.39 0.81 -0.10 -1.98 5.04 0.09 -0.39 117.35 118.42 3gmo s TYR 246 Ca 0.32 -0.20 -0.11 0.00 -2.44 0.00 0.00 57.07 54.64 3gmo s TYR 246 Cb -0.05 -0.60 0.03 0.00 0.35 0.00 0.00 41.96 41.69 3gmo s TYR 246 CO 0.19 -0.10 0.29 -1.17 -1.34 0.00 0.00 175.55 173.42 3gmo s LEU 247 N 0.30 0.89 0.08 6.97 2.96 0.22 -0.62 118.68 129.47 3gmo s LEU 247 Ca -0.04 0.52 0.08 0.00 -0.22 0.00 0.00 54.13 54.46 3gmo s LEU 247 Cb -0.09 1.04 -0.04 0.00 0.50 0.00 0.00 46.19 47.60 3gmo s LEU 247 CO 0.00 -0.15 -0.16 -1.10 -1.32 0.00 0.00 176.35 173.63 3gmo s GLN 248 N -0.06 2.00 -0.03 1.98 -0.21 -1.26 -0.06 119.66 122.02 3gmo s GLN 248 Ca -0.02 -1.05 0.06 0.00 0.02 0.00 0.00 55.36 54.37 3gmo s GLN 248 Cb -0.03 -2.20 -0.01 0.00 1.00 0.00 0.00 33.01 31.77 3gmo s GLN 248 CO 0.01 0.51 -0.20 0.00 -2.12 0.00 0.00 175.29 173.50 3gmo s ALA 249 N -1.07 1.67 0.22 6.09 0.00 0.41 -0.83 121.76 128.26 3gmo s ALA 249 Ca 0.17 -0.83 0.11 0.00 0.00 0.00 0.00 51.96 51.42 3gmo s ALA 249 Cb -0.11 -0.47 -0.05 0.00 0.00 0.00 0.00 23.12 22.49 3gmo s ALA 249 CO 0.09 0.37 -0.21 0.95 0.00 0.00 0.00 175.76 176.95 3gmo s THR 250 N -0.29 2.46 -0.08 0.00 -4.23 -0.60 -0.54 115.64 112.37 3gmo s THR 250 Ca 0.03 -2.14 -0.03 0.00 -1.18 0.00 0.00 61.69 58.37 3gmo s THR 250 Cb -0.09 -2.22 0.04 0.00 1.34 0.00 0.00 72.50 71.57 3gmo s THR 250 CO 0.01 -0.22 0.16 -0.22 -0.54 0.00 0.00 174.62 173.80 3gmo s LEU 251 N -2.99 0.20 -0.03 4.79 2.96 -0.33 -0.60 118.68 122.68 3gmo s LEU 251 Ca 0.24 0.33 -0.30 0.00 -0.22 0.00 0.00 54.13 54.18 3gmo s LEU 251 Cb -0.07 0.31 -0.03 0.00 0.50 0.00 0.00 46.19 46.91 3gmo s LEU 251 CO 0.12 -0.21 1.03 -1.81 -1.32 0.00 0.00 176.35 174.16 3gmo s ASP 252 N 1.90 7.28 -0.02 3.68 1.01 -1.26 0.33 116.67 129.58 3gmo s ASP 252 Ca -0.01 1.67 0.02 0.00 0.71 0.00 0.00 52.55 54.94 3gmo s ASP 252 Cb -0.12 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.25 3gmo s ASP 252 CO -0.06 -0.36 -0.07 0.68 0.21 0.00 0.00 175.17 175.57 3gmo s VAL 253 N 1.41 0.59 0.17 -1.27 -7.23 0.29 -4.96 120.40 109.40 3gmo s VAL 253 Ca 0.52 -0.26 -0.32 0.00 -1.81 0.00 0.00 61.98 60.11 3gmo s VAL 253 Cb -0.21 -0.54 -0.11 0.00 0.56 0.00 0.00 36.38 36.08 3gmo s VAL 253 CO 0.25 0.19 1.69 -0.70 -0.31 0.00 0.00 175.10 176.22 3gmo s GLU 254 N 0.20 4.16 0.26 4.82 2.12 -1.26 -0.64 118.70 128.35 3gmo s GLU 254 Ca -0.02 2.51 -0.28 0.00 0.36 0.00 0.00 54.97 57.54 3gmo s GLU 254 Cb -0.07 -3.21 -0.15 0.00 0.26 0.00 0.00 34.13 30.95 3gmo s GLU 254 CO 0.00 -0.72 0.78 0.00 -0.54 0.00 0.00 175.26 174.78 3gmo n ALA 255 N 4.35 -1.39 0.00 6.30 0.00 -1.26 -1.21 120.51 127.30 3gmo n ALA 255 Ca 0.16 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.99 3gmo n ALA 255 Cb 0.37 -1.84 0.00 0.00 0.00 0.00 0.00 19.45 17.98 3gmo n ALA 255 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gmo n GLY 256 N 1.57 2.54 1.14 0.00 0.00 -1.26 -4.89 105.19 104.30 3gmo n GLY 256 Ca 0.13 -0.56 -0.03 0.00 0.00 0.00 0.00 46.02 45.56 3gmo n GLY 256 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3gmo n GLU 257 N 0.00 1.32 0.03 1.61 0.28 -0.35 -3.76 120.64 119.76 3gmo n GLU 257 Ca 0.00 -0.55 -0.10 0.00 -0.16 0.00 0.00 57.16 56.34 3gmo n GLU 257 Cb 0.00 -1.29 -0.13 0.00 1.43 0.00 0.00 31.44 31.45 3gmo n GLU 257 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 3gmo h GLU 258 N 0.28 0.07 -6.68 3.44 5.08 -1.90 -3.45 114.58 111.41 3gmo h GLU 258 Ca 0.10 -0.12 -0.56 0.00 -1.00 0.00 0.00 59.36 57.78 3gmo h GLU 258 Cb 1.24 0.04 0.08 0.00 0.50 0.00 0.00 28.75 30.62 3gmo h GLU 258 CO 0.18 0.86 0.76 0.00 -1.00 0.00 0.00 179.01 179.82 3gmo n ALA 259 N -2.51 1.87 0.00 3.43 0.00 -1.25 -1.99 120.51 120.07 3gmo n ALA 259 Ca -0.10 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.73 3gmo n ALA 259 Cb 1.01 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 18.08 3gmo n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gmo n GLY 260 N 2.30 1.69 3.81 0.00 0.00 -1.26 -5.05 105.19 106.67 3gmo n GLY 260 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 3gmo n GLY 260 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gmo s LEU 261 N 0.00 4.13 0.02 0.99 1.43 -0.84 -4.19 118.68 120.22 3gmo s LEU 261 Ca 0.00 1.70 -0.05 0.00 -1.03 0.00 0.00 54.13 54.75 3gmo s LEU 261 Cb 0.00 -4.24 -0.01 0.00 0.03 0.00 0.00 46.19 41.98 3gmo s LEU 261 CO 0.00 -0.21 0.08 0.00 0.23 0.00 0.00 176.35 176.45 3gmo s ALA 262 N -1.90 -0.14 -0.11 4.21 0.00 0.20 -0.78 121.76 123.23 3gmo s ALA 262 Ca 0.55 -0.37 -0.18 0.00 0.00 0.00 0.00 51.96 51.97 3gmo s ALA 262 Cb -0.13 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 3gmo s ALA 262 CO 0.18 -0.22 0.46 0.00 0.00 0.00 0.00 175.76 176.17 3gmo s ARG 264 N 0.50 2.45 -0.12 0.00 3.52 0.67 -1.33 118.95 124.63 3gmo s ARG 264 Ca 0.25 -0.81 0.01 0.00 -0.13 0.00 0.00 55.73 55.05 3gmo s ARG 264 Cb -0.15 -2.25 0.02 0.00 -1.56 0.00 0.00 34.95 31.01 3gmo s ARG 264 CO 0.10 0.53 -0.13 0.08 -0.81 0.00 0.00 175.30 175.07 3gmo s VAL 265 N -0.51 1.39 -0.14 7.11 1.01 -0.04 -1.44 120.40 127.78 3gmo s VAL 265 Ca 0.07 -0.54 -0.04 0.00 0.00 0.00 0.00 61.98 61.46 3gmo s VAL 265 Cb -0.11 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.92 3gmo s VAL 265 CO 0.01 0.42 0.01 -0.54 0.00 0.00 0.00 175.10 175.00 3gmo s LYS 266 N 1.33 3.51 -0.15 2.72 1.02 -0.31 -1.71 119.74 126.16 3gmo s LYS 266 Ca 0.00 -0.42 -0.24 0.00 0.02 0.00 0.00 55.97 55.33 3gmo s LYS 266 Cb -0.14 -2.96 0.06 0.00 -0.52 0.00 0.00 37.83 34.27 3gmo s LYS 266 CO -0.06 0.43 0.61 -1.58 -0.92 0.00 0.00 175.35 173.83 3gmo s HIS 267 N -0.13 -0.62 0.57 3.18 2.46 -1.26 -1.92 115.29 117.57 3gmo s HIS 267 Ca 0.05 1.34 0.26 0.00 0.47 0.00 0.00 55.06 57.18 3gmo s HIS 267 Cb -0.13 0.28 1.62 0.00 -0.13 0.00 0.00 32.58 34.23 3gmo s HIS 267 CO 0.02 -0.43 2.16 0.66 -2.47 0.00 0.00 174.74 174.67 3gmo h SER 268 N 4.27 0.00 1.12 9.88 4.64 -1.86 -1.45 113.55 130.15 3gmo h SER 268 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 3gmo h SER 268 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3gmo h SER 268 CO 0.24 0.00 0.00 0.77 -0.87 0.00 0.00 176.83 176.97 3gmo h SER 269 N 0.00 0.00 0.23 4.97 4.64 -1.86 -3.16 113.55 118.37 3gmo h SER 269 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 3gmo h SER 269 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3gmo h SER 269 CO -0.00 0.00 -0.31 0.18 -0.87 0.00 0.00 176.83 175.83 3gmo n LEU 270 N -2.75 1.08 0.00 5.97 4.77 -0.54 -4.89 117.00 120.64 3gmo n LEU 270 Ca 0.02 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.71 3gmo n LEU 270 Cb 0.33 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 3gmo n LEU 270 CO 0.26 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 3gmo n GLY 271 N 1.36 0.88 1.05 -0.72 0.00 -1.20 -2.09 105.19 104.48 3gmo n GLY 271 Ca 0.11 -0.72 0.06 0.00 0.00 0.00 0.00 46.02 45.48 3gmo n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gmo n GLY 272 N 0.00 4.04 3.39 -0.02 0.00 -1.26 -4.72 105.19 106.61 3gmo n GLY 272 Ca 0.00 -1.05 -0.45 0.00 0.00 0.00 0.00 46.02 44.52 3gmo n GLY 272 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gmo s GLN 273 N -2.88 3.92 0.73 1.61 -0.21 -0.89 -5.03 119.66 116.91 3gmo s GLN 273 Ca 0.44 -2.62 -0.15 0.00 0.02 0.00 0.00 55.36 53.05 3gmo s GLN 273 Cb 0.36 -4.71 0.04 0.00 1.00 0.00 0.00 33.01 29.69 3gmo s GLN 273 CO 0.09 -1.47 1.23 -0.51 -2.12 0.00 0.00 175.29 172.50 3gmo s ASP 274 N 2.30 4.17 -0.02 5.90 1.01 -1.26 -4.86 116.67 123.91 3gmo s ASP 274 Ca 0.31 2.43 -0.29 0.00 0.71 0.00 0.00 52.55 55.71 3gmo s ASP 274 Cb -0.07 -2.60 -0.03 0.00 1.01 0.00 0.00 42.92 41.23 3gmo s ASP 274 CO -0.07 -2.28 0.92 -0.63 0.21 0.00 0.00 175.17 173.32 3gmo s ILE 275 N -1.87 4.90 -0.12 0.77 1.01 -0.69 -4.93 121.20 120.27 3gmo s ILE 275 Ca 0.76 1.93 -0.00 0.00 0.00 0.00 0.00 60.65 63.34 3gmo s ILE 275 Cb -0.31 -4.26 0.02 0.00 0.01 0.00 0.00 42.46 37.92 3gmo s ILE 275 CO 0.45 0.17 -0.10 -0.63 0.00 0.00 0.00 174.94 174.83 3gmo s ILE 276 N 1.01 1.23 -0.25 2.92 1.01 -1.26 -0.86 121.20 125.00 3gmo s ILE 276 Ca 0.49 -0.42 0.01 0.00 0.00 0.00 0.00 60.65 60.73 3gmo s ILE 276 Cb -0.20 -1.21 0.04 0.00 0.01 0.00 0.00 42.46 41.10 3gmo s ILE 276 CO 0.26 0.40 -0.10 -0.76 0.00 0.00 0.00 174.94 174.73 3gmo s LEU 277 N 1.59 3.18 -0.00 2.97 1.43 -0.44 -4.97 118.68 122.43 3gmo s LEU 277 Ca 0.04 -1.12 -0.24 0.00 -1.03 0.00 0.00 54.13 51.78 3gmo s LEU 277 Cb -0.13 -1.58 -0.05 0.00 0.03 0.00 0.00 46.19 44.47 3gmo s LEU 277 CO -0.09 -0.15 0.74 -0.31 0.23 0.00 0.00 176.35 176.78 3gmo s TYR 278 N 1.20 3.67 0.32 0.29 1.51 -1.26 -0.52 117.35 122.56 3gmo s TYR 278 Ca -0.04 1.38 -0.29 0.00 -1.01 0.00 0.00 57.07 57.11 3gmo s TYR 278 Cb -0.18 -2.81 -0.10 0.00 -0.11 0.00 0.00 41.96 38.75 3gmo s TYR 278 CO -0.06 0.19 1.40 -0.46 -1.11 0.00 0.00 175.55 175.51 3gmo s TRP 279 N 0.32 2.91 -0.14 2.71 -0.11 0.04 -4.29 118.94 120.38 3gmo s TRP 279 Ca 0.38 1.22 -0.00 0.00 1.22 0.00 0.00 56.10 58.92 3gmo s TRP 279 Cb -0.19 -3.82 -0.00 0.00 -1.50 0.00 0.00 33.47 27.95 3gmo s TRP 279 CO 0.21 -2.44 0.12 0.41 -4.62 0.00 0.00 176.95 170.62 3gmo n GLY 280 N 1.16 0.36 0.00 5.86 0.00 -1.26 -4.64 105.19 106.66 3gmo n GLY 280 Ca 0.02 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.64 3gmo n GLY 280 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06