#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m1r h LYS 3 N 0.00 0.31 -2.95 0.11 3.64 -2.08 -3.40 116.57 112.21 3m1r h LYS 3 Ca 0.00 -0.52 -0.61 0.00 -1.27 0.00 0.00 60.65 58.24 3m1r h LYS 3 Cb 0.00 0.20 -0.41 0.00 -0.41 0.00 0.00 32.23 31.61 3m1r h LYS 3 CO 0.00 1.23 -0.70 0.71 -2.27 0.00 0.00 179.45 178.42 3m1r s TYR 4 N -2.64 2.65 0.40 1.91 1.51 -1.26 -4.99 117.35 114.94 3m1r s TYR 4 Ca -0.06 -2.91 0.07 0.00 -1.01 0.00 0.00 57.07 53.17 3m1r s TYR 4 Cb 0.07 -2.16 0.84 0.00 -0.11 0.00 0.00 41.96 40.59 3m1r s TYR 4 CO 0.89 -0.68 2.03 -1.35 -1.11 0.00 0.00 175.55 175.33 3m1r h PRO 5 N 5.87 0.58 -0.57 -1.71 0.11 -2.08 -2.26 132.00 131.94 3m1r h PRO 5 Ca 0.11 -0.04 -0.15 0.00 0.11 0.00 0.00 66.00 66.03 3m1r h PRO 5 Cb 0.84 -0.13 -0.09 0.00 0.11 0.00 0.00 31.00 31.73 3m1r h PRO 5 CO 0.59 0.39 0.15 1.19 -0.21 0.00 0.00 178.00 180.11 3m1r n PHE 6 N -4.47 1.92 -3.85 0.65 3.01 -1.26 -4.88 117.46 108.58 3m1r n PHE 6 Ca 0.06 -1.17 -0.36 0.00 1.01 0.00 0.00 57.45 56.99 3m1r n PHE 6 Cb 0.12 -0.57 -0.13 0.00 -0.01 0.00 0.00 39.48 38.89 3m1r n PHE 6 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 3m1r s LEU 7 N -2.99 3.14 0.31 4.37 2.96 -0.85 -5.10 118.68 120.52 3m1r s LEU 7 Ca 0.51 -0.31 0.03 0.00 -0.22 0.00 0.00 54.13 54.15 3m1r s LEU 7 Cb 0.41 -1.82 -0.06 0.00 0.50 0.00 0.00 46.19 45.22 3m1r s LEU 7 CO 0.11 -0.02 0.06 0.00 -1.32 0.00 0.00 176.35 175.17 3m1r s ARG 8 N 1.52 1.60 0.53 1.98 1.70 -1.26 -5.01 118.95 120.01 3m1r s ARG 8 Ca 0.06 -1.88 -0.21 0.00 -0.47 0.00 0.00 55.73 53.23 3m1r s ARG 8 Cb -0.15 -0.76 -0.07 0.00 -0.57 0.00 0.00 34.95 33.41 3m1r s ARG 8 CO -0.00 -0.20 1.03 0.39 -1.08 0.00 0.00 175.30 175.44 3m1r n GLU 9 N -0.64 1.20 -1.65 3.89 1.02 -1.26 -4.86 120.64 118.34 3m1r n GLU 9 Ca -0.02 0.44 -0.46 0.00 -0.02 0.00 0.00 57.16 57.11 3m1r n GLU 9 Cb 0.66 -2.18 -0.03 0.00 -0.02 0.00 0.00 31.44 29.87 3m1r n GLU 9 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3m1r n ALA 10 N -1.17 0.73 -1.00 0.62 0.00 -1.26 -2.12 120.51 116.31 3m1r n ALA 10 Ca 0.11 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.98 3m1r n ALA 10 Cb 0.44 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.66 3m1r n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m1r n GLY 11 N 2.22 0.79 3.75 0.00 0.00 -1.26 -5.00 105.19 105.68 3m1r n GLY 11 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 3m1r n GLY 11 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3m1r s SER 12 N -2.60 5.07 0.39 1.61 0.01 -0.90 -5.02 113.70 112.26 3m1r s SER 12 Ca 0.00 2.57 0.08 0.00 1.31 0.00 0.00 55.95 59.90 3m1r s SER 12 Cb 0.00 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.58 3m1r s SER 12 CO 0.00 -1.69 0.29 -0.44 0.41 0.00 0.00 173.24 171.82 3m1r s SER 13 N -1.34 4.96 -0.31 2.44 0.01 -1.26 -5.04 113.70 113.16 3m1r s SER 13 Ca 0.77 -0.74 -0.41 0.00 1.31 0.00 0.00 55.95 56.88 3m1r s SER 13 Cb -0.35 -0.67 -0.16 0.00 0.21 0.00 0.00 66.02 65.04 3m1r s SER 13 CO 0.39 -0.52 1.74 0.33 0.41 0.00 0.00 173.24 175.59 3m1r n PHE 14 N -1.40 2.03 -3.79 2.43 7.35 -1.26 -4.95 117.46 117.87 3m1r n PHE 14 Ca 0.01 0.60 -0.37 0.00 -0.76 0.00 0.00 57.45 56.93 3m1r n PHE 14 Cb 0.62 -2.44 -0.06 0.00 0.35 0.00 0.00 39.48 37.94 3m1r n PHE 14 CO 0.00 0.00 0.00 -1.59 -0.76 0.00 0.00 176.76 174.41 3m1r s LYS 15 N 3.54 3.69 -0.09 -4.13 0.00 -1.26 -5.09 119.74 116.40 3m1r s LYS 15 Ca 0.99 -0.08 0.03 0.00 0.00 0.00 0.00 55.97 56.91 3m1r s LYS 15 Cb -1.12 -3.26 0.00 0.00 0.00 0.00 0.00 37.83 33.46 3m1r s LYS 15 CO 0.68 0.64 -0.20 0.34 0.00 0.00 0.00 175.35 176.81 3m1r s ASP 16 N -0.65 2.64 0.39 0.03 -1.08 -1.26 -5.04 116.67 111.69 3m1r s ASP 16 Ca 0.14 -0.47 0.21 0.00 -0.52 0.00 0.00 52.55 51.92 3m1r s ASP 16 Cb -0.12 -1.21 0.62 0.00 -1.46 0.00 0.00 42.92 40.75 3m1r s ASP 16 CO 0.04 0.11 1.70 0.03 0.52 0.00 0.00 175.17 177.57 3m1r h ARG 17 N 6.82 0.00 -0.63 4.34 2.47 -2.05 -3.15 114.38 122.17 3m1r h ARG 17 Ca -0.23 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.49 3m1r h ARG 17 Cb 1.22 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.54 3m1r h ARG 17 CO 0.47 0.29 0.00 -0.25 0.56 0.00 0.00 179.97 181.05 3m1r n ASP 18 N -3.33 4.96 -3.90 7.04 10.43 -1.26 -4.85 116.55 125.64 3m1r n ASP 18 Ca 0.01 -2.64 -0.26 0.00 2.57 0.00 0.00 54.79 54.47 3m1r n ASP 18 Cb 0.53 -0.62 -0.17 0.00 1.84 0.00 0.00 41.12 42.70 3m1r n ASP 18 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 3m1r s VAL 19 N -2.23 0.95 -0.37 2.53 0.11 -1.19 -5.10 120.40 115.09 3m1r s VAL 19 Ca 0.49 -0.25 -0.10 0.00 -2.93 0.00 0.00 61.98 59.19 3m1r s VAL 19 Cb 0.35 -0.97 0.03 0.00 -1.53 0.00 0.00 36.38 34.26 3m1r s VAL 19 CO 0.19 0.35 0.18 0.42 -3.33 0.00 0.00 175.10 172.91 3m1r s THR 20 N 1.60 4.40 0.00 5.04 -4.23 -1.26 -4.83 115.64 116.36 3m1r s THR 20 Ca 0.02 -0.92 0.00 0.00 -1.18 0.00 0.00 61.69 59.62 3m1r s THR 20 Cb -0.13 -3.46 0.00 0.00 1.34 0.00 0.00 72.50 70.25 3m1r s THR 20 CO -0.06 -0.22 0.00 0.29 -0.54 0.00 0.00 174.62 174.09 3m1r n LYS 21 N 4.96 0.00 0.00 3.99 5.02 -1.26 -1.73 118.16 129.14 3m1r n LYS 21 Ca -0.12 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.17 3m1r n LYS 21 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.47 3m1r n LYS 21 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3m1r n SER 23 N 0.00 0.00 0.07 4.39 3.41 -0.75 -3.48 113.62 117.26 3m1r n SER 23 Ca 0.00 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.73 3m1r n SER 23 Cb 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.00 3m1r n SER 23 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3m1r n ASP 24 N 0.00 0.71 -0.11 4.04 8.00 -1.26 -4.44 116.55 123.49 3m1r n ASP 24 Ca 0.00 0.13 -0.14 0.00 0.71 0.00 0.00 54.79 55.49 3m1r n ASP 24 Cb 0.00 0.51 -0.12 0.00 -0.02 0.00 0.00 41.12 41.48 3m1r n ASP 24 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3m1r n LEU 25 N -2.32 1.81 -4.72 0.64 4.77 -1.23 -4.97 117.00 110.98 3m1r n LEU 25 Ca 0.01 -0.08 -0.42 0.00 -0.03 0.00 0.00 56.01 55.50 3m1r n LEU 25 Cb 0.49 -0.33 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 3m1r n LEU 25 CO 0.39 0.73 1.08 -0.63 -1.33 0.00 0.00 177.39 177.63 3m1r s ILE 26 N -2.47 3.16 -0.08 -0.08 1.01 -1.26 -1.88 121.20 119.61 3m1r s ILE 26 Ca -0.23 0.85 0.02 0.00 0.00 0.00 0.00 60.65 61.28 3m1r s ILE 26 Cb 0.07 -3.54 0.02 0.00 0.01 0.00 0.00 42.46 39.01 3m1r s ILE 26 CO 0.63 0.07 -0.11 0.00 0.00 0.00 0.00 174.94 175.54 3m1r s ALA 27 N 0.97 1.27 -0.14 9.38 0.00 -0.01 -4.89 121.76 128.34 3m1r s ALA 27 Ca 0.64 -0.45 -0.33 0.00 0.00 0.00 0.00 51.96 51.83 3m1r s ALA 27 Cb -0.38 -0.66 -0.10 0.00 0.00 0.00 0.00 23.12 21.98 3m1r s ALA 27 CO 0.32 -0.03 2.01 -2.37 0.00 0.00 0.00 175.76 175.69 3m1r n THR 28 N 4.12 0.50 -1.74 0.00 5.66 -1.26 -1.01 114.28 120.55 3m1r n THR 28 Ca -0.20 -0.20 -0.42 0.00 -3.05 0.00 0.00 64.05 60.17 3m1r n THR 28 Cb 0.51 -2.04 -0.01 0.00 -1.55 0.00 0.00 70.33 67.24 3m1r n THR 28 CO 0.00 0.00 0.00 1.87 -3.05 0.00 0.00 175.07 173.89 3m1r n TRP 29 N 8.27 2.78 -0.03 1.09 -0.00 -0.78 -4.87 117.44 123.90 3m1r n TRP 29 Ca 0.27 0.33 -0.00 0.00 -0.00 0.00 0.00 57.50 58.09 3m1r n TRP 29 Cb 0.33 -2.56 -0.14 0.00 -0.00 0.00 0.00 31.31 28.94 3m1r n TRP 29 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 177.69 177.29 3m1r n ASP 30 N 1.74 0.23 0.00 5.87 3.85 -1.26 -4.96 116.55 122.01 3m1r n ASP 30 Ca 0.07 0.10 0.00 0.00 -0.71 0.00 0.00 54.79 54.25 3m1r n ASP 30 Cb 0.37 1.11 0.00 0.00 -1.35 0.00 0.00 41.12 41.25 3m1r n ASP 30 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3m1r n GLY 31 N 1.49 1.59 3.63 6.12 0.00 -1.26 -5.11 105.19 111.64 3m1r n GLY 31 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 3m1r n GLY 31 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3m1r n GLN 32 N 0.00 -0.17 -1.65 1.61 -0.06 -1.26 -4.84 117.38 111.00 3m1r n GLN 32 Ca 0.00 0.02 -0.51 0.00 -2.00 0.00 0.00 57.00 54.50 3m1r n GLN 32 Cb 0.00 -2.29 -0.06 0.00 -4.06 0.00 0.00 30.24 23.84 3m1r n GLN 32 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 3m1r n ASP 33 N -3.24 2.46 -4.58 1.69 10.43 -1.26 -4.91 116.55 117.14 3m1r n ASP 33 Ca 0.12 1.08 -0.43 0.00 2.57 0.00 0.00 54.79 58.12 3m1r n ASP 33 Cb 0.52 -1.26 -0.03 0.00 1.84 0.00 0.00 41.12 42.18 3m1r n ASP 33 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 3m1r s ILE 34 N 1.92 4.36 -0.34 0.53 1.01 -1.26 -5.01 121.20 122.41 3m1r s ILE 34 Ca 0.88 0.95 -0.11 0.00 0.00 0.00 0.00 60.65 62.37 3m1r s ILE 34 Cb -0.88 -4.50 0.00 0.00 0.01 0.00 0.00 42.46 37.09 3m1r s ILE 34 CO 0.50 -0.90 0.20 -0.54 0.00 0.00 0.00 174.94 174.20 3m1r s LYS 35 N 4.04 3.19 1.72 2.79 -0.14 -1.26 -3.66 119.74 126.42 3m1r s LYS 35 Ca 0.42 -0.83 0.00 0.00 -1.36 0.00 0.00 55.97 54.19 3m1r s LYS 35 Cb -0.09 -3.70 0.00 0.00 -1.68 0.00 0.00 37.83 32.37 3m1r s LYS 35 CO 0.28 -0.53 0.00 0.41 -0.76 0.00 0.00 175.35 174.75 3m1r n GLY 36 N 5.03 -1.50 3.72 -3.33 0.00 -1.11 -4.92 105.19 103.08 3m1r n GLY 36 Ca -0.13 -1.41 -0.40 0.00 0.00 0.00 0.00 46.02 44.08 3m1r n GLY 36 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3m1r n PRO 37 N 0.00 1.96 -3.71 1.61 -0.02 -1.26 -2.09 135.00 131.49 3m1r n PRO 37 Ca 0.00 0.70 -0.14 0.00 -2.02 0.00 0.00 63.50 62.04 3m1r n PRO 37 Cb 0.00 -2.48 -0.09 0.00 -0.02 0.00 0.00 33.50 30.91 3m1r n PRO 37 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3m1r s ALA 38 N -1.22 -1.03 0.40 3.55 0.00 -0.98 -4.34 121.76 118.14 3m1r s ALA 38 Ca 0.63 0.79 -0.20 0.00 0.00 0.00 0.00 51.96 53.17 3m1r s ALA 38 Cb -0.47 -0.21 -0.11 0.00 0.00 0.00 0.00 23.12 22.33 3m1r s ALA 38 CO 0.56 -0.26 0.91 -0.51 0.00 0.00 0.00 175.76 176.46 3m1r s LEU 39 N -0.75 3.99 -0.17 0.00 1.43 0.06 -1.50 118.68 121.75 3m1r s LEU 39 Ca -0.08 1.62 -0.11 0.00 -1.03 0.00 0.00 54.13 54.53 3m1r s LEU 39 Cb -0.04 -4.41 0.05 0.00 0.03 0.00 0.00 46.19 41.83 3m1r s LEU 39 CO 0.04 -0.31 0.42 -0.51 0.23 0.00 0.00 176.35 176.22 3m1r s ILE 40 N -2.10 -0.02 0.03 -0.59 2.07 -0.91 0.57 121.20 120.26 3m1r s ILE 40 Ca 0.60 0.07 -0.06 0.00 -1.41 0.00 0.00 60.65 59.84 3m1r s ILE 40 Cb -0.10 -0.61 -0.05 0.00 0.13 0.00 0.00 42.46 41.83 3m1r s ILE 40 CO 0.15 0.03 0.29 -0.83 -1.91 0.00 0.00 174.94 172.66 3m1r s GLY 41 N 1.06 2.25 -0.46 1.50 0.00 0.62 -1.79 107.32 110.50 3m1r s GLY 41 Ca -0.07 -0.57 0.03 0.00 0.00 0.00 0.00 44.72 44.11 3m1r s GLY 41 CO -0.09 -0.41 0.32 0.14 0.00 0.00 0.00 173.10 173.06 3m1r s VAL 42 N -1.37 1.06 -1.42 1.40 1.01 0.34 0.20 120.40 121.63 3m1r s VAL 42 Ca 0.30 -2.79 -0.12 0.00 0.00 0.00 0.00 61.98 59.37 3m1r s VAL 42 Cb -0.13 -1.73 0.07 0.00 0.00 0.00 0.00 36.38 34.59 3m1r s VAL 42 CO 0.18 -1.07 2.19 -0.81 0.00 0.00 0.00 175.10 175.59 3m1r n PRO 43 N 3.04 3.18 -4.80 2.72 -0.04 -1.26 -3.08 135.00 134.76 3m1r n PRO 43 Ca 0.20 -2.86 -0.30 0.00 -0.04 0.00 0.00 63.50 60.50 3m1r n PRO 43 Cb 0.40 -3.13 -0.17 0.00 -0.04 0.00 0.00 33.50 30.56 3m1r n PRO 43 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3m1r s LEU 44 N 1.27 1.93 0.00 1.53 2.96 -1.26 -4.71 118.68 120.40 3m1r s LEU 44 Ca 0.47 -0.50 0.00 0.00 -0.22 0.00 0.00 54.13 53.88 3m1r s LEU 44 Cb 0.13 -1.25 0.00 0.00 0.50 0.00 0.00 46.19 45.57 3m1r s LEU 44 CO -0.06 0.08 0.11 -1.54 -1.32 0.00 0.00 176.35 173.62 3m1r n SER 45 N 3.87 0.00 0.00 3.68 3.41 -1.26 -0.84 113.62 122.48 3m1r n SER 45 Ca -0.20 -1.00 0.11 0.00 -0.26 0.00 0.00 58.87 57.52 3m1r n SER 45 Cb 0.52 0.00 0.52 0.00 -0.26 0.00 0.00 64.21 64.98 3m1r n SER 45 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3m1r n LYS 46 N 0.00 0.12 0.00 4.33 5.02 -1.26 -2.01 118.16 124.35 3m1r n LYS 46 Ca 0.00 0.10 0.15 0.00 -2.02 0.00 0.00 58.31 56.53 3m1r n LYS 46 Cb 0.35 -1.50 0.69 0.00 -0.02 0.00 0.00 35.03 34.55 3m1r n LYS 46 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3m1r n SER 47 N -1.43 0.31 -4.81 4.39 3.41 -1.26 -4.88 113.62 109.35 3m1r n SER 47 Ca 0.07 -0.52 -0.34 0.00 -0.26 0.00 0.00 58.87 57.82 3m1r n SER 47 Cb 0.24 -0.12 -0.06 0.00 -0.26 0.00 0.00 64.21 64.00 3m1r n SER 47 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3m1r s SER 48 N -2.44 6.89 0.01 4.04 0.01 -0.85 -1.57 113.70 119.79 3m1r s SER 48 Ca 0.31 1.77 -0.25 0.00 1.31 0.00 0.00 55.95 59.09 3m1r s SER 48 Cb 0.20 -2.55 -0.17 0.00 0.21 0.00 0.00 66.02 63.71 3m1r s SER 48 CO 0.46 -0.39 1.31 0.40 0.41 0.00 0.00 173.24 175.43 3m1r h ILE 49 N 1.98 0.83 -4.05 1.44 2.04 -1.90 -3.44 117.51 114.41 3m1r h ILE 49 Ca -0.49 -0.60 -0.49 0.00 1.00 0.00 0.00 64.86 64.29 3m1r h ILE 49 Cb 1.19 1.17 0.04 0.00 -0.74 0.00 0.00 36.82 38.48 3m1r h ILE 49 CO 0.61 0.13 0.42 -0.44 0.00 0.00 0.00 178.15 178.87 3m1r s SER 50 N -5.17 6.22 0.11 1.72 0.01 -1.26 -4.96 113.70 110.37 3m1r s SER 50 Ca -0.14 2.07 -0.33 0.00 1.31 0.00 0.00 55.95 58.86 3m1r s SER 50 Cb 0.03 -2.58 -0.12 0.00 0.21 0.00 0.00 66.02 63.56 3m1r s SER 50 CO 0.58 -0.87 1.76 1.57 0.41 0.00 0.00 173.24 176.69 3m1r n HIS 51 N -0.84 2.48 -3.82 2.43 -0.00 -1.26 -4.95 115.22 109.26 3m1r n HIS 51 Ca 0.09 0.02 -0.13 0.00 0.46 0.00 0.00 57.72 58.16 3m1r n HIS 51 Cb 0.51 -2.66 -0.14 0.00 -0.12 0.00 0.00 29.99 27.58 3m1r n HIS 51 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 3m1r s SER 52 N 2.29 -0.07 -0.28 0.26 0.15 -1.26 -4.99 113.70 109.79 3m1r s SER 52 Ca 0.82 0.17 0.12 0.00 0.70 0.00 0.00 55.95 57.76 3m1r s SER 52 Cb -0.58 0.14 0.75 0.00 -1.71 0.00 0.00 66.02 64.61 3m1r s SER 52 CO 0.39 -0.06 1.74 0.61 1.20 0.00 0.00 173.24 177.12 3m1r n GLY 53 N 3.38 3.52 0.17 9.45 0.00 -1.26 -4.61 105.19 115.84 3m1r n GLY 53 Ca -0.17 -0.99 0.10 0.00 0.00 0.00 0.00 46.02 44.97 3m1r n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1r n ALA 54 N 0.04 0.95 0.30 4.61 0.00 -1.26 -0.79 120.51 124.37 3m1r n ALA 54 Ca 0.34 0.19 0.18 0.00 0.00 0.00 0.00 53.44 54.15 3m1r n ALA 54 Cb 1.26 -1.21 0.85 0.00 0.00 0.00 0.00 19.45 20.36 3m1r n ALA 54 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3m1r h SER 55 N 0.00 0.00 0.84 0.00 4.64 -1.82 -0.92 113.55 116.29 3m1r h SER 55 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3m1r h SER 55 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 3m1r h SER 55 CO 0.00 0.00 -0.26 0.49 -0.87 0.00 0.00 176.83 176.19 3m1r n PHE 56 N -2.93 0.15 0.13 4.77 3.01 0.03 -4.33 117.46 118.30 3m1r n PHE 56 Ca -0.01 0.04 0.02 0.00 1.01 0.00 0.00 57.45 58.52 3m1r n PHE 56 Cb 0.19 -0.47 0.37 0.00 -0.01 0.00 0.00 39.48 39.57 3m1r n PHE 56 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3m1r h ALA 57 N 2.90 1.45 -0.49 4.37 0.00 -1.53 -2.51 119.26 123.45 3m1r h ALA 57 Ca 0.00 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 3m1r h ALA 57 Cb 0.55 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3m1r h ALA 57 CO 0.00 0.39 0.07 -1.35 0.00 0.00 0.00 179.25 178.36 3m1r h PRO 58 N 0.17 0.78 -0.02 0.00 0.11 -1.75 0.12 132.00 131.42 3m1r h PRO 58 Ca 0.03 -0.17 -0.00 0.00 0.11 0.00 0.00 66.00 65.96 3m1r h PRO 58 Cb 0.47 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.47 3m1r h PRO 58 CO 0.03 0.74 0.00 0.78 -0.21 0.00 0.00 178.00 179.34 3m1r h GLY 59 N 0.95 0.03 1.36 -0.55 0.00 -1.79 -1.58 103.07 101.49 3m1r h GLY 59 Ca 0.16 -0.02 -0.09 0.00 0.00 0.00 0.00 47.33 47.38 3m1r h GLY 59 CO 0.01 0.02 -0.09 -0.91 0.00 0.00 0.00 176.54 175.57 3m1r h THR 60 N -0.23 1.25 -0.35 4.70 1.35 -1.23 0.74 112.91 119.14 3m1r h THR 60 Ca 0.01 -1.12 -0.10 0.00 -0.55 0.00 0.00 66.41 64.64 3m1r h THR 60 Cb 0.27 1.01 -0.01 0.00 -1.73 0.00 0.00 68.15 67.70 3m1r h THR 60 CO 0.00 0.39 -0.17 0.40 -0.25 0.00 0.00 175.52 175.89 3m1r h ILE 61 N 0.70 1.29 -0.20 6.82 2.04 -0.82 -0.05 117.51 127.27 3m1r h ILE 61 Ca 0.12 -1.29 0.05 0.00 1.00 0.00 0.00 64.86 64.75 3m1r h ILE 61 Cb 0.55 1.38 -0.05 0.00 -0.74 0.00 0.00 36.82 37.95 3m1r h ILE 61 CO 0.03 0.42 -0.14 0.03 0.00 0.00 0.00 178.15 178.49 3m1r h ARG 62 N 0.51 -0.14 -0.23 2.37 3.08 -1.05 0.21 114.38 119.13 3m1r h ARG 62 Ca 0.08 0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.18 3m1r h ARG 62 Cb 0.71 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.75 3m1r h ARG 62 CO 0.05 -0.09 -0.01 0.37 -1.07 0.00 0.00 179.97 179.21 3m1r h GLN 63 N -0.14 0.05 -0.69 0.04 4.15 -0.55 0.15 115.11 118.12 3m1r h GLN 63 Ca 0.12 -0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.55 3m1r h GLN 63 Cb 0.32 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 27.96 3m1r h GLN 63 CO -0.29 0.03 0.45 0.00 -1.93 0.00 0.00 178.83 177.10 3m1r h ALA 64 N 1.21 0.88 -0.57 3.38 0.00 -0.83 -2.73 119.26 120.60 3m1r h ALA 64 Ca 0.11 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3m1r h ALA 64 Cb 0.15 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3m1r h ALA 64 CO -0.20 0.28 0.20 1.25 0.00 0.00 0.00 179.25 180.79 3m1r h LEU 65 N 0.92 0.82 -1.48 0.00 5.85 0.31 -2.97 115.31 118.75 3m1r h LEU 65 Ca 0.26 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.74 3m1r h LEU 65 Cb -0.08 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 3m1r h LEU 65 CO -0.07 0.79 -0.15 0.11 -0.34 0.00 0.00 178.44 178.78 3m1r h LYS 66 N 0.80 0.15 -0.11 1.25 1.57 -0.44 -1.53 116.57 118.26 3m1r h LYS 66 Ca 0.19 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3m1r h LYS 66 Cb 0.25 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.54 3m1r h LYS 66 CO -0.01 0.31 0.00 0.72 -0.57 0.00 0.00 179.45 179.90 3m1r n HIS 67 N -4.29 0.13 -3.33 -1.35 8.25 -1.06 -1.81 115.22 111.77 3m1r n HIS 67 Ca -0.01 -0.07 -0.34 0.00 -0.26 0.00 0.00 57.72 57.04 3m1r n HIS 67 Cb 0.26 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.31 3m1r n HIS 67 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 3m1r s SER 68 N -1.71 6.77 0.44 0.41 0.01 -0.58 -5.03 113.70 114.01 3m1r s SER 68 Ca 0.34 1.08 -0.25 0.00 1.31 0.00 0.00 55.95 58.44 3m1r s SER 68 Cb 0.18 -2.29 -0.08 0.00 0.21 0.00 0.00 66.02 64.05 3m1r s SER 68 CO 0.29 -0.01 1.26 -0.55 0.41 0.00 0.00 173.24 174.64 3m1r s SER 69 N -2.01 6.15 0.00 2.44 0.15 -1.26 -4.46 113.70 114.71 3m1r s SER 69 Ca 0.44 2.55 0.27 0.00 0.70 0.00 0.00 55.95 59.90 3m1r s SER 69 Cb -0.13 -2.63 0.80 0.00 -1.71 0.00 0.00 66.02 62.35 3m1r s SER 69 CO 0.20 -0.95 1.60 0.00 1.20 0.00 0.00 173.24 175.29 3m1r n ALA 70 N -0.20 3.12 -2.65 5.45 0.00 -0.70 -4.89 120.51 120.64 3m1r n ALA 70 Ca 0.06 -0.33 -0.40 0.00 0.00 0.00 0.00 53.44 52.76 3m1r n ALA 70 Cb 0.45 -1.20 -0.06 0.00 0.00 0.00 0.00 19.45 18.64 3m1r n ALA 70 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3m1r s TYR 71 N -2.72 3.35 -0.37 0.00 5.04 -1.26 -1.06 117.35 120.32 3m1r s TYR 71 Ca 0.19 0.91 -0.15 0.00 -2.44 0.00 0.00 57.07 55.58 3m1r s TYR 71 Cb 0.19 -2.82 0.00 0.00 0.35 0.00 0.00 41.96 39.67 3m1r s TYR 71 CO 0.58 -0.23 0.35 0.45 -1.34 0.00 0.00 175.55 175.36 3m1r s SER 72 N 1.28 6.15 0.15 4.32 0.15 -0.82 -4.96 113.70 119.98 3m1r s SER 72 Ca 0.28 -0.48 -0.17 0.00 0.70 0.00 0.00 55.95 56.28 3m1r s SER 72 Cb -0.16 -2.19 0.04 0.00 -1.71 0.00 0.00 66.02 62.00 3m1r s SER 72 CO 0.10 -0.40 1.75 0.00 1.20 0.00 0.00 173.24 175.88 3m1r h ALA 73 N 8.56 0.37 0.00 5.45 0.00 -1.96 0.35 119.26 132.03 3m1r h ALA 73 Ca -0.29 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3m1r h ALA 73 Cb 1.13 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3m1r h ALA 73 CO 0.72 -0.28 0.00 -1.91 0.00 0.00 0.00 179.25 177.77 3m1r n GLU 74 N -5.02 0.15 -0.06 0.00 2.13 -1.26 -1.33 120.64 115.25 3m1r n GLU 74 Ca 0.00 0.57 -0.02 0.00 0.66 0.00 0.00 57.16 58.37 3m1r n GLU 74 Cb 0.11 -1.91 -0.14 0.00 0.27 0.00 0.00 31.44 29.77 3m1r n GLU 74 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 3m1r n LEU 75 N -2.21 0.00 0.00 4.31 7.94 -0.66 -4.97 117.00 121.42 3m1r n LEU 75 Ca -0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3m1r n LEU 75 Cb 0.09 0.27 0.00 0.00 0.53 0.00 0.00 43.42 44.31 3m1r n LEU 75 CO 0.12 0.27 0.00 0.61 -1.11 0.00 0.00 177.39 177.28 3m1r n GLY 76 N 1.73 0.37 3.39 -3.96 0.00 0.02 -4.96 105.19 101.79 3m1r n GLY 76 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 3m1r n GLY 76 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3m1r s GLU 77 N -0.71 1.33 0.37 1.61 -1.05 -1.21 -5.00 118.70 114.03 3m1r s GLU 77 Ca 0.00 -1.36 -0.26 0.00 -0.15 0.00 0.00 54.97 53.20 3m1r s GLU 77 Cb 0.00 0.38 -0.09 0.00 -0.44 0.00 0.00 34.13 33.98 3m1r s GLU 77 CO 0.00 -0.50 1.16 -1.01 0.95 0.00 0.00 175.26 175.86 3m1r s HIS 78 N -4.05 3.17 0.18 4.83 3.76 -1.26 -1.94 115.29 119.98 3m1r s HIS 78 Ca 0.27 1.57 0.29 0.00 -0.15 0.00 0.00 55.06 57.04 3m1r s HIS 78 Cb 0.03 -3.39 1.23 0.00 1.11 0.00 0.00 32.58 31.56 3m1r s HIS 78 CO 0.08 -1.19 1.94 -0.39 -0.85 0.00 0.00 174.74 174.33 3m1r h VAL 79 N 2.52 0.31 -3.50 -0.90 -1.51 -1.47 -3.41 116.25 108.30 3m1r h VAL 79 Ca -0.48 -0.75 -0.67 0.00 -1.23 0.00 0.00 66.70 63.57 3m1r h VAL 79 Cb 1.23 1.58 -0.26 0.00 -2.13 0.00 0.00 31.29 31.70 3m1r h VAL 79 CO 0.64 0.11 -0.78 -0.69 -1.23 0.00 0.00 177.57 175.62 3m1r s VAL 80 N -3.75 2.97 -0.09 7.19 1.01 -1.26 -4.71 120.40 121.77 3m1r s VAL 80 Ca 0.00 -0.71 -0.06 0.00 0.00 0.00 0.00 61.98 61.21 3m1r s VAL 80 Cb 0.10 -2.22 -0.02 0.00 0.00 0.00 0.00 36.38 34.24 3m1r s VAL 80 CO 0.58 0.54 -0.12 -1.54 0.00 0.00 0.00 175.10 174.56 3m1r n SER 81 N 3.24 1.10 0.00 3.32 3.41 -1.26 -4.93 113.62 118.49 3m1r n SER 81 Ca -0.18 0.44 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 3m1r n SER 81 Cb 0.53 -0.71 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 3m1r n SER 81 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3m1r n GLU 82 N -3.68 0.00 -4.04 4.33 4.71 -1.26 -5.07 120.64 115.63 3m1r n GLU 82 Ca -0.05 0.00 -0.08 0.00 -0.01 0.00 0.00 57.16 57.02 3m1r n GLU 82 Cb 0.18 0.00 -0.10 0.00 -1.01 0.00 0.00 31.44 30.51 3m1r n GLU 82 CO 0.00 0.00 0.00 -0.48 0.09 0.00 0.00 177.13 176.74 3m1r s LEU 83 N 0.00 2.38 -0.27 -4.62 0.05 -1.26 -4.88 118.68 110.07 3m1r s LEU 83 Ca 0.00 -0.77 -0.03 0.00 0.05 0.00 0.00 54.13 53.38 3m1r s LEU 83 Cb 0.00 0.15 0.03 0.00 -2.05 0.00 0.00 46.19 44.32 3m1r s LEU 83 CO 0.00 -0.46 -0.01 -0.22 -0.55 0.00 0.00 176.35 175.10 3m1r s LEU 84 N -2.26 3.49 0.45 1.48 2.96 -0.79 -4.97 118.68 119.04 3m1r s LEU 84 Ca -0.03 -0.92 -0.24 0.00 -0.22 0.00 0.00 54.13 52.72 3m1r s LEU 84 Cb -0.00 -1.73 -0.08 0.00 0.50 0.00 0.00 46.19 44.89 3m1r s LEU 84 CO -0.06 -0.17 1.26 -0.31 -1.32 0.00 0.00 176.35 175.75 3m1r s TYR 85 N 1.35 2.75 -0.38 5.38 2.02 -1.26 -0.83 117.35 126.38 3m1r s TYR 85 Ca -0.00 1.45 -0.06 0.00 -0.37 0.00 0.00 57.07 58.09 3m1r s TYR 85 Cb -0.17 -3.59 0.07 0.00 -0.40 0.00 0.00 41.96 37.87 3m1r s TYR 85 CO -0.02 -2.02 0.17 0.34 -1.57 0.00 0.00 175.55 172.45 3m1r s ASP 86 N -0.99 5.37 0.56 2.29 -1.08 -0.18 -0.76 116.67 121.88 3m1r s ASP 86 Ca 0.62 -1.50 0.34 0.00 -0.52 0.00 0.00 52.55 51.48 3m1r s ASP 86 Cb -0.35 -1.88 1.50 0.00 -1.46 0.00 0.00 42.92 40.72 3m1r s ASP 86 CO 0.44 -0.45 2.04 -0.07 0.52 0.00 0.00 175.17 177.65 3m1r h LEU 87 N 8.22 0.00 0.00 -1.34 4.07 -0.18 -2.06 115.31 124.02 3m1r h LEU 87 Ca -0.20 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.76 3m1r h LEU 87 Cb 1.07 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.81 3m1r h LEU 87 CO 0.67 0.03 0.00 0.61 -1.08 0.00 0.00 178.44 178.68 3m1r n GLY 88 N -0.19 -0.43 3.61 0.83 0.00 -1.26 -4.81 105.19 102.94 3m1r n GLY 88 Ca -0.00 -2.19 -0.31 0.00 0.00 0.00 0.00 46.02 43.51 3m1r n GLY 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3m1r s ASP 89 N -4.00 4.67 0.09 1.61 1.01 -1.26 -0.28 116.67 118.51 3m1r s ASP 89 Ca 0.00 -0.20 -0.30 0.00 0.71 0.00 0.00 52.55 52.76 3m1r s ASP 89 Cb 0.00 -1.06 -0.06 0.00 1.01 0.00 0.00 42.92 42.81 3m1r s ASP 89 CO 0.00 0.24 1.15 -0.63 0.21 0.00 0.00 175.17 176.14 3m1r s ILE 90 N -1.11 4.06 0.07 0.77 1.01 0.13 -4.91 121.20 121.23 3m1r s ILE 90 Ca 0.20 1.56 -0.30 0.00 0.00 0.00 0.00 60.65 62.10 3m1r s ILE 90 Cb -0.11 -4.00 -0.09 0.00 0.01 0.00 0.00 42.46 38.27 3m1r s ILE 90 CO 0.11 0.16 1.88 -0.62 0.00 0.00 0.00 174.94 176.48 3m1r s ASP 91 N 0.72 6.45 -0.17 3.58 3.68 -1.26 -4.54 116.67 125.14 3m1r s ASP 91 Ca 0.55 2.68 -0.03 0.00 2.13 0.00 0.00 52.55 57.88 3m1r s ASP 91 Cb -0.29 -2.55 -0.02 0.00 -1.45 0.00 0.00 42.92 38.61 3m1r s ASP 91 CO 0.31 -1.02 -0.05 -0.63 0.13 0.00 0.00 175.17 173.91 3m1r s ILE 92 N 3.62 3.66 0.36 4.11 -1.09 -1.26 -4.81 121.20 125.79 3m1r s ILE 92 Ca 0.84 -0.43 -0.27 0.00 -2.23 0.00 0.00 60.65 58.56 3m1r s ILE 92 Cb -0.44 -2.61 -0.10 0.00 -1.58 0.00 0.00 42.46 37.74 3m1r s ILE 92 CO 0.38 0.48 1.30 -2.28 -1.23 0.00 0.00 174.94 173.59 3m1r s HIS 93 N 0.64 2.96 0.34 3.97 2.46 -1.26 -4.91 115.29 119.50 3m1r s HIS 93 Ca -0.03 1.42 0.04 0.00 0.47 0.00 0.00 55.06 56.96 3m1r s HIS 93 Cb -0.15 -3.66 0.66 0.00 -0.13 0.00 0.00 32.58 29.30 3m1r s HIS 93 CO 0.02 -1.91 1.94 0.28 -2.47 0.00 0.00 174.74 172.60 3m1r h VAL 94 N 2.78 1.03 0.00 0.89 2.07 -2.01 -3.38 116.25 117.62 3m1r h VAL 94 Ca -0.49 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 66.73 3m1r h VAL 94 Cb 1.23 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 3m1r h VAL 94 CO 0.64 0.16 -0.80 0.41 0.02 0.00 0.00 177.57 178.00 3m1r n THR 95 N -4.49 0.00 -3.25 2.57 -1.04 -1.26 -4.99 114.28 101.82 3m1r n THR 95 Ca 0.12 0.00 -0.45 0.00 -2.04 0.00 0.00 64.05 61.68 3m1r n THR 95 Cb 0.22 -0.56 -0.05 0.00 -1.82 0.00 0.00 70.33 68.12 3m1r n THR 95 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3m1r s ASP 96 N -3.31 6.18 0.23 8.00 -1.08 -1.26 -4.95 116.67 120.49 3m1r s ASP 96 Ca 0.00 -1.51 -0.01 0.00 -0.52 0.00 0.00 52.55 50.51 3m1r s ASP 96 Cb 0.00 -2.24 0.25 0.00 -1.46 0.00 0.00 42.92 39.47 3m1r s ASP 96 CO 0.00 -0.90 1.61 0.40 0.52 0.00 0.00 175.17 176.80 3m1r h ILE 97 N 5.87 1.30 0.18 4.11 5.03 -1.94 -2.44 117.51 129.62 3m1r h ILE 97 Ca -0.29 -1.53 -0.01 0.00 -0.12 0.00 0.00 64.86 62.90 3m1r h ILE 97 Cb 1.10 1.54 0.00 0.00 -3.03 0.00 0.00 36.82 36.42 3m1r h ILE 97 CO 1.02 0.48 -0.09 0.58 -0.68 0.00 0.00 178.15 179.47 3m1r h VAL 98 N 0.45 0.90 -0.99 1.67 2.07 -1.97 -2.54 116.25 115.84 3m1r h VAL 98 Ca 0.04 -0.37 0.20 0.00 0.82 0.00 0.00 66.70 67.39 3m1r h VAL 98 Cb 0.87 1.12 -0.10 0.00 -1.52 0.00 0.00 31.29 31.67 3m1r h VAL 98 CO 0.07 0.09 0.62 0.50 0.02 0.00 0.00 177.57 178.87 3m1r h LYS 99 N -0.42 0.63 -0.61 1.57 3.64 -1.96 -1.00 116.57 118.43 3m1r h LYS 99 Ca -0.02 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 3m1r h LYS 99 Cb 0.33 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.98 3m1r h LYS 99 CO 0.04 0.42 0.31 0.77 -2.27 0.00 0.00 179.45 178.72 3m1r h SER 100 N 0.65 0.78 -0.50 4.20 0.02 -1.18 -0.26 113.55 117.27 3m1r h SER 100 Ca 0.57 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 61.40 3m1r h SER 100 Cb 1.03 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.35 3m1r h SER 100 CO -0.34 0.67 0.31 0.45 -1.14 0.00 0.00 176.83 176.78 3m1r h HIS 101 N 0.83 0.64 -0.83 3.45 3.86 -0.80 -0.69 115.15 121.62 3m1r h HIS 101 Ca 0.21 0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.49 3m1r h HIS 101 Cb 0.09 -0.21 -0.06 0.00 1.06 0.00 0.00 27.41 28.28 3m1r h HIS 101 CO -0.00 0.43 0.51 0.45 0.86 0.00 0.00 177.93 180.18 3m1r h HIS 102 N 0.67 0.93 -0.71 2.45 -0.00 -0.81 -0.06 115.15 117.63 3m1r h HIS 102 Ca 0.18 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.58 3m1r h HIS 102 Cb -0.03 -0.30 -0.04 0.00 -0.00 0.00 0.00 27.41 27.04 3m1r h HIS 102 CO -0.03 0.47 0.47 0.45 -0.00 0.00 0.00 177.93 179.28 3m1r h HIS 103 N 0.92 0.90 0.56 2.45 3.86 -0.51 -0.00 115.15 123.32 3m1r h HIS 103 Ca 0.36 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.57 3m1r h HIS 103 Cb 0.18 -0.30 0.01 0.00 1.06 0.00 0.00 27.41 28.36 3m1r h HIS 103 CO -0.04 0.57 -0.27 0.82 0.86 0.00 0.00 177.93 179.86 3m1r h ILE 104 N 0.96 0.42 -0.69 2.45 2.04 -0.46 -0.76 117.51 121.49 3m1r h ILE 104 Ca 0.26 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 66.00 3m1r h ILE 104 Cb -0.11 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 36.41 3m1r h ILE 104 CO -0.06 0.02 0.44 0.15 0.00 0.00 0.00 178.15 178.70 3m1r h PHE 105 N -0.85 0.82 -0.18 1.37 3.04 -0.77 -3.03 116.94 117.34 3m1r h PHE 105 Ca -0.08 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 61.86 3m1r h PHE 105 Cb 0.62 -0.27 -0.01 0.00 2.56 0.00 0.00 35.95 38.85 3m1r h PHE 105 CO -0.02 0.48 -0.03 0.37 -2.02 0.00 0.00 178.31 177.09 3m1r h GLN 106 N 0.86 0.34 -0.02 1.11 4.15 -0.98 0.44 115.11 121.02 3m1r h GLN 106 Ca 0.27 -0.12 0.00 0.00 0.77 0.00 0.00 58.65 59.57 3m1r h GLN 106 Cb -0.01 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.65 3m1r h GLN 106 CO -0.09 0.59 0.00 2.41 -1.93 0.00 0.00 178.83 179.80 3m1r n THR 107 N -4.67 0.00 0.00 2.39 -1.04 -0.29 -1.73 114.28 108.93 3m1r n THR 107 Ca -0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 3m1r n THR 107 Cb 0.26 -0.18 0.00 0.00 -1.82 0.00 0.00 70.33 68.59 3m1r n THR 107 CO 0.00 0.00 0.00 1.57 -0.64 0.00 0.00 175.07 176.00 3m1r n HIS 109 N 0.14 0.00 -0.15 -1.42 -0.00 0.15 -1.77 115.22 112.18 3m1r n HIS 109 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.63 3m1r n HIS 109 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.00 3m1r n HIS 109 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3m1r h ALA 110 N 0.00 0.58 -0.57 1.57 0.00 -1.56 -2.45 119.26 116.82 3m1r h ALA 110 Ca 0.00 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 3m1r h ALA 110 Cb 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3m1r h ALA 110 CO 0.00 0.19 0.07 -0.07 0.00 0.00 0.00 179.25 179.43 3m1r h LEU 111 N 0.58 0.93 -1.01 0.00 3.38 -1.61 -0.62 115.31 116.97 3m1r h LEU 111 Ca 0.15 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3m1r h LEU 111 Cb 0.19 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.69 3m1r h LEU 111 CO -0.01 0.97 0.00 -0.07 0.09 0.00 0.00 178.44 179.42 3m1r h LEU 112 N 0.86 0.00 0.08 1.67 3.38 -1.79 -0.28 115.31 119.23 3m1r h LEU 112 Ca 0.17 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.83 3m1r h LEU 112 Cb 0.45 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 3m1r h LEU 112 CO 0.02 0.00 -1.67 0.28 0.09 0.00 0.00 178.44 177.15 3m1r h SER 113 N 0.00 0.28 1.15 -0.43 0.02 -0.93 -3.30 113.55 110.35 3m1r h SER 113 Ca 0.00 -0.48 -0.07 0.00 -0.84 0.00 0.00 61.79 60.40 3m1r h SER 113 Cb 0.59 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 3m1r h SER 113 CO 0.00 1.42 -0.88 0.44 -1.14 0.00 0.00 176.83 176.67 3m1r h ASP 114 N 0.05 0.00 -2.61 3.07 3.32 -1.06 -3.40 116.42 115.79 3m1r h ASP 114 Ca -0.29 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.16 3m1r h ASP 114 Cb 2.01 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 41.17 3m1r h ASP 114 CO 0.12 0.25 -0.86 -1.00 -1.72 0.00 0.00 179.24 176.03 3m1r s HIS 115 N -3.15 1.72 -0.29 4.55 3.76 -0.12 -4.95 115.29 116.81 3m1r s HIS 115 Ca 0.01 -2.54 0.20 0.00 -0.15 0.00 0.00 55.06 52.58 3m1r s HIS 115 Cb 0.08 -1.40 1.07 0.00 1.11 0.00 0.00 32.58 33.44 3m1r s HIS 115 CO 0.77 -0.76 1.62 -2.30 -0.85 0.00 0.00 174.74 173.23 3m1r n PRO 116 N 2.73 0.14 0.00 8.40 -0.02 -1.24 -1.28 135.00 143.72 3m1r n PRO 116 Ca 0.25 0.60 0.11 0.00 -2.02 0.00 0.00 63.50 62.45 3m1r n PRO 116 Cb 0.43 -1.92 0.07 0.00 -0.02 0.00 0.00 33.50 32.07 3m1r n PRO 116 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3m1r n ASP 117 N -2.20 1.29 -4.69 2.55 8.00 -1.26 -4.95 116.55 115.29 3m1r n ASP 117 Ca -0.01 -1.04 -0.42 0.00 0.71 0.00 0.00 54.79 54.02 3m1r n ASP 117 Cb 0.06 0.54 -0.03 0.00 -0.02 0.00 0.00 41.12 41.67 3m1r n ASP 117 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 3m1r s TRP 118 N -2.73 2.63 -0.41 1.24 -0.00 -0.41 -2.74 118.94 116.52 3m1r s TRP 118 Ca 0.15 0.54 -0.09 0.00 -0.00 0.00 0.00 56.10 56.70 3m1r s TRP 118 Cb 0.18 -3.84 0.08 0.00 -0.00 0.00 0.00 33.47 29.88 3m1r s TRP 118 CO 0.68 -3.27 0.25 0.08 -0.00 0.00 0.00 176.95 174.69 3m1r s VAL 119 N 2.47 4.18 0.09 5.86 1.01 -0.89 -4.96 120.40 128.17 3m1r s VAL 119 Ca 0.70 -1.39 -0.32 0.00 0.00 0.00 0.00 61.98 60.96 3m1r s VAL 119 Cb -0.37 -3.55 -0.12 0.00 0.00 0.00 0.00 36.38 32.35 3m1r s VAL 119 CO 0.30 -0.49 1.80 -2.65 0.00 0.00 0.00 175.10 174.06 3m1r n PRO 120 N 4.90 2.55 -3.59 2.72 -0.02 -1.25 -2.32 135.00 138.00 3m1r n PRO 120 Ca -0.10 0.93 -0.40 0.00 -2.02 0.00 0.00 63.50 61.91 3m1r n PRO 120 Cb 0.43 -2.79 -0.09 0.00 -0.02 0.00 0.00 33.50 31.03 3m1r n PRO 120 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3m1r s LEU 121 N 2.64 5.65 -0.21 2.45 1.02 -0.56 -1.73 118.68 127.94 3m1r s LEU 121 Ca 0.83 -2.06 -0.14 0.00 0.02 0.00 0.00 54.13 52.79 3m1r s LEU 121 Cb -0.56 -1.98 -0.04 0.00 0.02 0.00 0.00 46.19 43.63 3m1r s LEU 121 CO 0.40 -0.64 0.31 -0.63 0.02 0.00 0.00 176.35 175.82 3m1r s ILE 122 N 1.14 5.26 -0.44 -0.59 1.01 0.77 -2.14 121.20 126.21 3m1r s ILE 122 Ca 0.08 0.52 -0.09 0.00 0.00 0.00 0.00 60.65 61.16 3m1r s ILE 122 Cb -0.24 -3.65 0.09 0.00 0.01 0.00 0.00 42.46 38.68 3m1r s ILE 122 CO -0.02 0.29 0.29 -0.76 0.00 0.00 0.00 174.94 174.74 3m1r s LEU 123 N 1.15 5.35 0.00 2.97 1.02 -0.74 -0.97 118.68 127.46 3m1r s LEU 123 Ca 0.15 -1.68 -0.10 0.00 0.02 0.00 0.00 54.13 52.52 3m1r s LEU 123 Cb -0.14 -1.99 0.14 0.00 0.02 0.00 0.00 46.19 44.22 3m1r s LEU 123 CO 0.06 -0.60 0.85 0.61 0.02 0.00 0.00 176.35 177.30 3m1r n GLY 124 N 4.90 -1.32 0.00 -3.19 0.00 -0.40 -0.50 105.19 104.68 3m1r n GLY 124 Ca -0.09 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.23 3m1r n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m1r n GLY 125 N -0.56 0.66 3.97 -0.02 0.00 -0.42 -3.48 105.19 105.35 3m1r n GLY 125 Ca 0.11 -1.66 -0.27 0.00 0.00 0.00 0.00 46.02 44.20 3m1r n GLY 125 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3m1r s ASP 126 N -1.06 3.58 0.52 1.61 1.47 -0.02 -1.43 116.67 121.34 3m1r s ASP 126 Ca 0.00 -0.21 0.34 0.00 1.18 0.00 0.00 52.55 53.86 3m1r s ASP 126 Cb 0.00 0.08 1.52 0.00 -0.34 0.00 0.00 42.92 44.18 3m1r s ASP 126 CO 0.00 -2.40 2.01 -1.13 0.68 0.00 0.00 175.17 174.33 3m1r h ASN 127 N -1.12 0.00 -0.09 2.11 -0.00 -1.91 -3.05 115.58 111.53 3m1r h ASN 127 Ca -0.39 0.00 0.02 0.00 -0.00 0.00 0.00 56.30 55.94 3m1r h ASN 127 Cb 1.24 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 39.56 3m1r h ASN 127 CO 0.35 0.00 0.11 0.77 -0.00 0.00 0.00 177.43 178.66 3m1r h SER 128 N 0.00 0.00 0.85 1.15 4.64 -1.79 -1.60 113.55 116.81 3m1r h SER 128 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3m1r h SER 128 Cb 0.36 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.45 3m1r h SER 128 CO 0.00 0.00 -0.02 0.16 -0.87 0.00 0.00 176.83 176.10 3m1r h ILE 129 N 0.00 0.05 0.00 0.95 3.07 -1.90 -3.26 117.51 116.41 3m1r h ILE 129 Ca 0.04 -0.47 -0.00 0.00 1.55 0.00 0.00 64.86 65.98 3m1r h ILE 129 Cb 0.27 1.45 -0.00 0.00 -0.27 0.00 0.00 36.82 38.27 3m1r h ILE 129 CO -0.00 0.02 -0.01 0.28 -1.05 0.00 0.00 178.15 177.39 3m1r h SER 130 N 0.00 0.00 0.66 2.16 0.02 -1.54 -0.56 113.55 114.29 3m1r h SER 130 Ca -0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 3m1r h SER 130 Cb 0.45 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.99 3m1r h SER 130 CO 0.00 0.01 -0.32 0.22 -1.14 0.00 0.00 176.83 175.60 3m1r h TYR 131 N 0.00 -0.83 -0.82 3.45 3.20 -1.80 -1.50 116.97 118.68 3m1r h TYR 131 Ca -0.00 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 3m1r h TYR 131 Cb 0.01 0.27 -0.04 0.00 1.54 0.00 0.00 36.73 38.52 3m1r h TYR 131 CO 0.00 -0.48 0.38 0.77 -1.64 0.00 0.00 178.16 177.19 3m1r h SER 132 N -1.03 1.08 0.02 -2.11 0.02 -1.54 -0.09 113.55 109.91 3m1r h SER 132 Ca -0.09 -0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 60.72 3m1r h SER 132 Cb 0.72 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.98 3m1r h SER 132 CO 0.15 0.93 -0.01 0.71 -1.14 0.00 0.00 176.83 177.46 3m1r h THR 133 N 1.17 1.28 -0.06 -2.27 1.35 -1.20 -2.43 112.91 110.76 3m1r h THR 133 Ca 0.28 -0.96 -0.01 0.00 -0.55 0.00 0.00 66.41 65.17 3m1r h THR 133 Cb 0.14 1.92 -0.00 0.00 -1.73 0.00 0.00 68.15 68.48 3m1r h THR 133 CO -0.03 0.25 -0.01 0.40 -0.25 0.00 0.00 175.52 175.88 3m1r h ILE 134 N -0.45 1.27 -0.81 6.82 2.04 -1.23 -1.66 117.51 123.50 3m1r h ILE 134 Ca -0.00 -0.85 0.18 0.00 1.00 0.00 0.00 64.86 65.19 3m1r h ILE 134 Cb 0.43 1.73 -0.11 0.00 -0.74 0.00 0.00 36.82 38.12 3m1r h ILE 134 CO 0.01 0.23 0.28 0.50 0.00 0.00 0.00 178.15 179.17 3m1r h LYS 135 N -0.21 0.34 -0.70 2.37 3.64 -1.11 0.33 116.57 121.23 3m1r h LYS 135 Ca 0.02 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 3m1r h LYS 135 Cb 0.37 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.09 3m1r h LYS 135 CO 0.00 0.23 0.33 0.00 -2.27 0.00 0.00 179.45 177.74 3m1r h ALA 136 N 1.64 0.91 -0.10 5.00 0.00 -1.11 0.22 119.26 125.82 3m1r h ALA 136 Ca 0.48 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 3m1r h ALA 136 Cb 0.84 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 3m1r h ALA 136 CO -0.50 0.49 0.05 0.82 0.00 0.00 0.00 179.25 180.10 3m1r h ILE 137 N 0.99 1.10 -0.64 0.00 1.08 0.12 -2.75 117.51 117.40 3m1r h ILE 137 Ca 0.24 -0.30 -0.07 0.00 -0.39 0.00 0.00 64.86 64.34 3m1r h ILE 137 Cb 0.14 1.13 -0.03 0.00 -3.07 0.00 0.00 36.82 34.99 3m1r h ILE 137 CO -0.03 0.09 0.11 0.00 -0.69 0.00 0.00 178.15 177.63 3m1r h ALA 138 N 0.93 0.98 -0.38 1.87 0.00 -0.02 0.22 119.26 122.88 3m1r h ALA 138 Ca 0.03 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3m1r h ALA 138 Cb 0.10 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3m1r h ALA 138 CO -0.00 0.64 0.00 1.04 0.00 0.00 0.00 179.25 180.93 3m1r n GLN 139 N -4.22 2.30 0.00 0.00 6.02 0.73 -3.11 117.38 119.10 3m1r n GLN 139 Ca 0.04 -1.54 0.00 0.00 -0.01 0.00 0.00 57.00 55.49 3m1r n GLN 139 Cb 0.28 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.04 3m1r n GLN 139 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 3m1r n THR 140 N 0.59 0.00 -0.01 5.09 5.66 -1.04 -4.95 114.28 119.62 3m1r n THR 140 Ca 0.14 -0.05 -0.02 0.00 -3.05 0.00 0.00 64.05 61.08 3m1r n THR 140 Cb 0.47 0.50 -0.01 0.00 -1.55 0.00 0.00 70.33 69.75 3m1r n THR 140 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 3m1r n LYS 141 N -0.27 0.04 -0.64 1.09 3.00 0.77 -4.95 118.16 117.20 3m1r n LYS 141 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 3m1r n LYS 141 Cb 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 35.03 34.32 3m1r n LYS 141 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3m1r n GLY 142 N 3.05 0.56 3.68 3.14 0.00 -1.18 -5.00 105.19 109.44 3m1r n GLY 142 Ca -0.03 -1.82 -0.45 0.00 0.00 0.00 0.00 46.02 43.72 3m1r n GLY 142 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3m1r n THR 143 N 5.94 0.44 -4.89 2.61 -1.04 -1.26 -4.48 114.28 111.59 3m1r n THR 143 Ca 0.00 -0.08 -0.33 0.00 -2.04 0.00 0.00 64.05 61.61 3m1r n THR 143 Cb 0.00 -1.97 -0.16 0.00 -1.82 0.00 0.00 70.33 66.38 3m1r n THR 143 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 3m1r s THR 144 N 3.14 2.41 0.04 12.58 2.01 -1.26 -1.38 115.64 133.18 3m1r s THR 144 Ca 0.86 -0.88 -0.18 0.00 0.31 0.00 0.00 61.69 61.80 3m1r s THR 144 Cb -0.58 -1.97 -0.06 0.00 0.01 0.00 0.00 72.50 69.90 3m1r s THR 144 CO 0.43 0.54 0.52 0.00 -0.69 0.00 0.00 174.62 175.42 3m1r s ALA 145 N 0.51 3.61 -0.10 7.40 0.00 0.19 -4.77 121.76 128.61 3m1r s ALA 145 Ca -0.13 -0.05 0.03 0.00 0.00 0.00 0.00 51.96 51.82 3m1r s ALA 145 Cb -0.17 -2.57 0.01 0.00 0.00 0.00 0.00 23.12 20.39 3m1r s ALA 145 CO 0.05 0.39 -0.20 0.08 0.00 0.00 0.00 175.76 176.08 3m1r s VAL 146 N -0.98 1.76 -0.44 0.00 1.01 -0.83 -0.02 120.40 120.90 3m1r s VAL 146 Ca 0.27 -0.83 -0.12 0.00 0.00 0.00 0.00 61.98 61.30 3m1r s VAL 146 Cb -0.18 -1.55 0.07 0.00 0.00 0.00 0.00 36.38 34.72 3m1r s VAL 146 CO 0.17 0.49 0.32 -0.63 0.00 0.00 0.00 175.10 175.45 3m1r s ILE 147 N 0.56 4.71 -0.49 2.22 1.01 -0.42 -0.77 121.20 128.03 3m1r s ILE 147 Ca -0.15 -1.21 -0.17 0.00 0.00 0.00 0.00 60.65 59.12 3m1r s ILE 147 Cb -0.17 -3.83 0.07 0.00 0.01 0.00 0.00 42.46 38.54 3m1r s ILE 147 CO 0.05 -0.52 0.51 -1.58 0.00 0.00 0.00 174.94 173.39 3m1r s GLN 148 N 1.53 3.04 -0.31 2.79 0.74 0.11 -0.26 119.66 127.30 3m1r s GLN 148 Ca 0.03 -1.16 -0.29 0.00 0.05 0.00 0.00 55.36 53.99 3m1r s GLN 148 Cb -0.23 -4.13 0.02 0.00 1.10 0.00 0.00 33.01 29.77 3m1r s GLN 148 CO 0.04 -1.14 1.07 -0.06 -0.55 0.00 0.00 175.29 174.65 3m1r s PHE 149 N 2.10 3.16 -0.19 1.67 0.08 0.92 -0.80 117.98 124.92 3m1r s PHE 149 Ca 0.09 1.20 -0.28 0.00 0.12 0.00 0.00 56.93 58.06 3m1r s PHE 149 Cb -0.22 -3.66 0.11 0.00 -0.57 0.00 0.00 43.02 38.68 3m1r s PHE 149 CO 0.09 -0.75 0.94 0.34 -0.10 0.00 0.00 175.22 175.74 3m1r s ASP 150 N 1.63 -0.47 0.31 1.36 -1.08 -0.14 -1.04 116.67 117.24 3m1r s ASP 150 Ca 0.45 0.68 0.23 0.00 -0.52 0.00 0.00 52.55 53.40 3m1r s ASP 150 Cb -0.12 0.61 0.29 0.00 -1.46 0.00 0.00 42.92 42.24 3m1r s ASP 150 CO 0.15 -0.32 1.42 0.00 0.52 0.00 0.00 175.17 176.94 3m1r h ALA 151 N 3.34 0.80 -3.83 3.66 0.00 -1.77 -2.65 119.26 118.81 3m1r h ALA 151 Ca -0.24 0.00 -0.68 0.00 0.00 0.00 0.00 54.91 53.99 3m1r h ALA 151 Cb 1.16 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.75 3m1r h ALA 151 CO 0.24 0.00 -0.83 -1.01 0.00 0.00 0.00 179.25 177.65 3m1r s HIS 152 N -3.24 2.44 0.24 0.00 3.76 -1.26 -1.72 115.29 115.52 3m1r s HIS 152 Ca 0.05 -0.31 -0.02 0.00 -0.15 0.00 0.00 55.06 54.63 3m1r s HIS 152 Cb 0.08 -1.32 0.28 0.00 1.11 0.00 0.00 32.58 32.74 3m1r s HIS 152 CO 0.70 0.35 1.68 0.45 -0.85 0.00 0.00 174.74 177.07 3m1r h HIS 153 N 3.87 0.75 -5.83 1.40 3.86 -1.91 -3.48 115.15 113.81 3m1r h HIS 153 Ca -0.50 -0.16 -0.37 0.00 -1.16 0.00 0.00 60.37 58.18 3m1r h HIS 153 Cb 1.17 -0.18 0.12 0.00 1.06 0.00 0.00 27.41 29.58 3m1r h HIS 153 CO 0.59 0.82 -0.77 -0.25 0.86 0.00 0.00 177.93 179.19 3m1r n ASP 154 N -4.13 -2.68 -1.87 2.45 8.00 -1.26 -4.80 116.55 112.25 3m1r n ASP 154 Ca 0.00 -0.67 -0.17 0.00 0.71 0.00 0.00 54.79 54.66 3m1r n ASP 154 Cb 0.41 -4.78 0.05 0.00 -0.02 0.00 0.00 41.12 36.78 3m1r n ASP 154 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 3m1r n VAL 155 N -4.34 2.34 -1.74 2.53 0.24 -1.12 -1.75 118.33 114.48 3m1r n VAL 155 Ca -0.22 -3.92 -0.40 0.00 -2.04 0.00 0.00 64.34 57.76 3m1r n VAL 155 Cb 0.65 -0.77 0.03 0.00 -1.47 0.00 0.00 33.84 32.27 3m1r n VAL 155 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3m1r n ARG 156 N -0.74 1.99 -1.73 7.34 1.74 -0.17 -4.70 116.66 120.40 3m1r n ARG 156 Ca 0.37 0.72 -0.38 0.00 -0.77 0.00 0.00 57.85 57.78 3m1r n ARG 156 Cb 0.92 -2.57 0.05 0.00 -1.02 0.00 0.00 32.46 29.84 3m1r n ARG 156 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3m1r n ASN 157 N -0.41 2.41 -0.16 0.55 0.23 -1.26 -4.53 115.26 112.08 3m1r n ASN 157 Ca 0.07 0.94 0.12 0.00 -0.53 0.00 0.00 54.58 55.19 3m1r n ASN 157 Cb 0.42 -1.55 0.25 0.00 -2.08 0.00 0.00 39.78 36.82 3m1r n ASN 157 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 3m1r n THR 158 N -1.23 0.00 0.01 5.53 -2.24 -1.26 -4.28 114.28 110.80 3m1r n THR 158 Ca 0.12 -0.09 -0.18 0.00 -2.27 0.00 0.00 64.05 61.63 3m1r n THR 158 Cb 0.45 0.49 -0.09 0.00 -2.10 0.00 0.00 70.33 69.07 3m1r n THR 158 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3m1r h GLU 159 N 0.80 0.66 0.00 -0.78 3.07 -1.91 -1.12 114.58 115.31 3m1r h GLU 159 Ca 0.00 -0.63 -0.03 0.00 -0.50 0.00 0.00 59.36 58.20 3m1r h GLU 159 Cb 0.53 0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 28.59 3m1r h GLU 159 CO 0.00 1.24 -0.13 -0.44 -1.40 0.00 0.00 179.01 178.28 3m1r h ASP 160 N 0.33 0.00 0.00 1.42 3.45 -1.99 -3.37 116.42 116.26 3m1r h ASP 160 Ca -0.09 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.37 3m1r h ASP 160 Cb 1.48 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.25 3m1r h ASP 160 CO 0.16 0.13 -0.10 0.61 -1.57 0.00 0.00 179.24 178.48 3m1r n GLY 161 N -0.47 0.55 7.00 2.75 0.00 -1.25 -5.15 105.19 108.62 3m1r n GLY 161 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3m1r n GLY 161 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m1r n GLY 162 N 0.00 -0.62 2.52 -0.02 0.00 -0.42 -4.24 105.19 102.41 3m1r n GLY 162 Ca 0.00 -1.13 -0.36 0.00 0.00 0.00 0.00 46.02 44.53 3m1r n GLY 162 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3m1r n PRO 163 N -0.06 3.02 -1.67 1.61 -0.04 -1.26 -4.66 135.00 131.92 3m1r n PRO 163 Ca 0.00 -2.09 -0.30 0.00 -0.04 0.00 0.00 63.50 61.07 3m1r n PRO 163 Cb 0.00 -2.83 0.21 0.00 -0.04 0.00 0.00 33.50 30.84 3m1r n PRO 163 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3m1r s THR 164 N 2.86 1.86 0.36 0.52 -4.23 -1.26 -4.88 115.64 110.86 3m1r s THR 164 Ca 0.58 0.00 0.38 0.00 -1.18 0.00 0.00 61.69 61.46 3m1r s THR 164 Cb 0.15 -2.84 0.41 0.00 1.34 0.00 0.00 72.50 71.55 3m1r s THR 164 CO -0.05 0.00 2.15 -0.55 -0.54 0.00 0.00 174.62 175.63 3m1r h ASN 165 N -2.02 0.00 -0.07 3.99 -1.07 -1.63 -2.28 115.58 112.50 3m1r h ASN 165 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.93 3m1r h ASN 165 Cb 1.24 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.49 3m1r h ASN 165 CO 0.33 0.01 0.00 0.61 0.07 0.00 0.00 177.43 178.45 3m1r n GLY 166 N -0.47 -0.28 0.00 9.14 0.00 -1.26 -3.79 105.19 108.52 3m1r n GLY 166 Ca -0.01 -0.32 0.06 0.00 0.00 0.00 0.00 46.02 45.76 3m1r n GLY 166 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3m1r n THR 167 N -0.18 0.00 -0.23 2.61 -2.24 -0.86 -1.00 114.28 112.38 3m1r n THR 167 Ca 0.17 -0.20 0.08 0.00 -2.27 0.00 0.00 64.05 61.84 3m1r n THR 167 Cb 0.24 0.90 0.34 0.00 -2.10 0.00 0.00 70.33 69.71 3m1r n THR 167 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3m1r h PRO 168 N 0.00 0.76 0.00 -0.78 0.13 -1.74 -0.47 132.00 129.90 3m1r h PRO 168 Ca 0.00 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 3m1r h PRO 168 Cb 0.36 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.32 3m1r h PRO 168 CO 0.00 0.50 -0.10 0.74 -0.23 0.00 0.00 178.00 178.91 3m1r h PHE 169 N 0.78 0.00 -0.10 1.56 -1.00 -1.65 -0.99 116.94 115.54 3m1r h PHE 169 Ca 0.37 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 61.12 3m1r h PHE 169 Cb 0.41 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.97 3m1r h PHE 169 CO -0.00 0.00 -0.06 -0.09 -1.61 0.00 0.00 178.31 176.54 3m1r h ARG 170 N 0.00 0.22 -0.61 1.51 2.43 -1.12 -1.31 114.38 115.50 3m1r h ARG 170 Ca 0.00 -0.10 0.01 0.00 -0.81 0.00 0.00 59.98 59.07 3m1r h ARG 170 Cb 0.83 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.35 3m1r h ARG 170 CO 0.00 0.60 0.40 0.00 -1.51 0.00 0.00 179.97 179.46 3m1r h ARG 171 N -0.16 0.80 -0.41 0.20 3.08 -1.24 0.28 114.38 116.93 3m1r h ARG 171 Ca 0.02 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 3m1r h ARG 171 Cb 0.54 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 3m1r h ARG 171 CO 0.02 0.53 0.15 -0.07 -1.07 0.00 0.00 179.97 179.52 3m1r h LEU 172 N 0.82 0.58 -0.01 3.04 4.07 -1.23 -2.63 115.31 119.95 3m1r h LEU 172 Ca 0.23 -0.18 -0.04 0.00 0.08 0.00 0.00 57.88 57.96 3m1r h LEU 172 Cb -0.08 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 41.51 3m1r h LEU 172 CO -0.06 0.61 -0.16 -0.07 -1.08 0.00 0.00 178.44 177.69 3m1r h LEU 173 N 0.52 0.16 -1.33 1.67 4.07 -0.94 -1.44 115.31 118.02 3m1r h LEU 173 Ca 0.14 -0.73 0.17 0.00 0.08 0.00 0.00 57.88 57.53 3m1r h LEU 173 Cb 0.22 -0.05 -0.07 0.00 1.08 0.00 0.00 40.66 41.84 3m1r h LEU 173 CO -0.01 0.87 0.58 0.44 -1.08 0.00 0.00 178.44 179.24 3m1r h ASP 174 N -0.54 0.59 -0.06 -0.43 3.32 -0.50 -0.25 116.42 118.55 3m1r h ASP 174 Ca -0.02 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3m1r h ASP 174 Cb 0.88 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.37 3m1r h ASP 174 CO 0.03 0.27 0.00 -0.62 -1.72 0.00 0.00 179.24 177.20 3m1r n GLU 175 N -4.57 1.85 -2.53 3.56 1.02 -0.99 -4.92 120.64 114.06 3m1r n GLU 175 Ca 0.19 -1.25 -0.21 0.00 -0.02 0.00 0.00 57.16 55.87 3m1r n GLU 175 Cb 0.55 -1.47 -0.00 0.00 -0.02 0.00 0.00 31.44 30.51 3m1r n GLU 175 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3m1r n GLU 176 N 0.50 -2.34 -0.11 3.49 1.02 -0.11 -4.88 120.64 118.21 3m1r n GLU 176 Ca 0.18 0.98 -0.06 0.00 -0.02 0.00 0.00 57.16 58.24 3m1r n GLU 176 Cb 0.41 -5.69 0.13 0.00 -0.02 0.00 0.00 31.44 26.28 3m1r n GLU 176 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3m1r h ILE 177 N -0.28 1.25 -3.71 -3.67 1.08 -1.52 -3.44 117.51 107.23 3m1r h ILE 177 Ca -0.50 -1.10 -0.26 0.00 -0.39 0.00 0.00 64.86 62.62 3m1r h ILE 177 Cb 1.36 0.95 -0.15 0.00 -3.07 0.00 0.00 36.82 35.91 3m1r h ILE 177 CO 0.58 0.38 -0.69 0.27 -0.69 0.00 0.00 178.15 177.99 3m1r s ILE 178 N -4.90 0.80 0.03 -0.67 -4.36 -1.23 -4.83 121.20 106.03 3m1r s ILE 178 Ca -0.10 -1.97 -0.11 0.00 -0.26 0.00 0.00 60.65 58.22 3m1r s ILE 178 Cb 0.14 -1.79 -0.05 0.00 1.25 0.00 0.00 42.46 42.00 3m1r s ILE 178 CO 0.82 -0.78 0.37 -1.61 0.24 0.00 0.00 174.94 173.98 3m1r s GLU 179 N -3.83 3.76 0.26 0.37 0.41 -1.26 -4.60 118.70 113.81 3m1r s GLU 179 Ca 0.15 0.19 -0.02 0.00 -0.41 0.00 0.00 54.97 54.88 3m1r s GLU 179 Cb 0.05 -3.09 0.46 0.00 -1.78 0.00 0.00 34.13 29.76 3m1r s GLU 179 CO -0.02 0.63 1.82 0.78 -0.49 0.00 0.00 175.26 177.98 3m1r h GLY 180 N 4.16 1.43 1.12 -1.39 0.00 -1.88 -0.02 103.07 106.49 3m1r h GLY 180 Ca -0.50 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.47 3m1r h GLY 180 CO 0.64 0.14 0.00 0.61 0.00 0.00 0.00 176.54 177.93 3m1r n GLN 181 N -4.69 0.66 0.00 4.80 0.00 -1.18 0.18 117.38 117.14 3m1r n GLN 181 Ca 0.16 0.01 0.11 0.00 0.00 0.00 0.00 57.00 57.29 3m1r n GLN 181 Cb 0.31 -1.50 0.09 0.00 0.00 0.00 0.00 30.24 29.13 3m1r n GLN 181 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 3m1r n HIS 182 N -1.06 0.00 -3.32 2.61 8.25 -0.03 -4.83 115.22 116.84 3m1r n HIS 182 Ca 0.16 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.23 3m1r n HIS 182 Cb 0.10 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.13 3m1r n HIS 182 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3m1r s LEU 183 N -1.97 4.12 -0.35 2.41 2.96 0.13 -1.97 118.68 124.01 3m1r s LEU 183 Ca 0.26 0.27 -0.08 0.00 -0.22 0.00 0.00 54.13 54.36 3m1r s LEU 183 Cb 0.19 -2.51 0.03 0.00 0.50 0.00 0.00 46.19 44.41 3m1r s LEU 183 CO 0.31 -0.27 0.13 -0.63 -1.32 0.00 0.00 176.35 174.58 3m1r s ILE 184 N 2.18 4.02 -0.40 6.68 1.01 0.05 -1.33 121.20 133.42 3m1r s ILE 184 Ca 0.17 -1.04 -0.16 0.00 0.00 0.00 0.00 60.65 59.63 3m1r s ILE 184 Cb -0.16 -3.26 0.01 0.00 0.01 0.00 0.00 42.46 39.07 3m1r s ILE 184 CO 0.10 -0.19 0.34 -1.10 0.00 0.00 0.00 174.94 174.10 3m1r s GLN 185 N 1.45 3.10 -0.26 2.79 -0.21 -0.11 0.04 119.66 126.46 3m1r s GLN 185 Ca -0.00 -0.86 -0.09 0.00 0.02 0.00 0.00 55.36 54.43 3m1r s GLN 185 Cb -0.19 -3.95 -0.03 0.00 1.00 0.00 0.00 33.01 29.84 3m1r s GLN 185 CO 0.04 -0.74 0.11 -0.51 -2.12 0.00 0.00 175.29 172.08 3m1r s LEU 186 N 1.85 3.67 0.00 2.90 1.43 0.02 -0.90 118.68 127.65 3m1r s LEU 186 Ca 0.08 -0.16 0.00 0.00 -1.03 0.00 0.00 54.13 53.02 3m1r s LEU 186 Cb -0.18 -1.99 0.00 0.00 0.03 0.00 0.00 46.19 44.05 3m1r s LEU 186 CO 0.11 -0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.25 3m1r n GLY 187 N 4.97 1.18 3.63 -3.19 0.00 -0.55 -0.96 105.19 110.28 3m1r n GLY 187 Ca -0.15 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.35 3m1r n GLY 187 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3m1r n ILE 188 N -1.08 0.09 -4.62 -0.61 2.08 -1.00 -4.16 119.36 110.07 3m1r n ILE 188 Ca 0.00 -0.02 -0.33 0.00 0.56 0.00 0.00 62.75 62.96 3m1r n ILE 188 Cb 0.00 -1.07 -0.14 0.00 -0.75 0.00 0.00 39.64 37.69 3m1r n ILE 188 CO 0.00 0.00 0.00 -0.60 0.56 0.00 0.00 176.55 176.51 3m1r s ARG 189 N 1.35 3.49 -0.16 0.38 3.52 -0.70 -4.33 118.95 122.50 3m1r s ARG 189 Ca 0.87 -0.62 -0.38 0.00 -0.13 0.00 0.00 55.73 55.46 3m1r s ARG 189 Cb -0.92 -2.74 -0.15 0.00 -1.56 0.00 0.00 34.95 29.58 3m1r s ARG 189 CO 0.49 0.21 1.71 -1.91 -0.81 0.00 0.00 175.30 175.00 3m1r n GLU 190 N 3.57 1.44 -0.85 5.12 4.07 -1.26 -0.69 120.64 132.03 3m1r n GLU 190 Ca -0.18 0.53 0.00 0.00 -0.06 0.00 0.00 57.16 57.45 3m1r n GLU 190 Cb 0.53 -2.25 0.00 0.00 -0.06 0.00 0.00 31.44 29.66 3m1r n GLU 190 CO 0.00 0.00 0.00 1.19 -0.06 0.00 0.00 177.13 178.26 3m1r n PHE 191 N 5.19 0.00 1.06 4.31 0.99 -1.26 -4.91 117.46 122.84 3m1r n PHE 191 Ca 0.24 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.81 3m1r n PHE 191 Cb 0.18 0.00 0.15 0.00 -1.00 0.00 0.00 39.48 38.81 3m1r n PHE 191 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 3m1r n SER 192 N 0.00 2.73 -4.26 4.37 7.64 0.13 -5.03 113.62 119.21 3m1r n SER 192 Ca 0.00 -1.89 -0.17 0.00 1.01 0.00 0.00 58.87 57.81 3m1r n SER 192 Cb 0.00 0.04 -0.10 0.00 -1.01 0.00 0.00 64.21 63.13 3m1r n SER 192 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3m1r s ASN 193 N -2.04 1.30 0.10 6.43 0.01 -1.26 -4.78 114.94 114.71 3m1r s ASN 193 Ca 0.28 -1.42 0.05 0.00 -0.71 0.00 0.00 52.86 51.07 3m1r s ASN 193 Cb 0.20 0.20 -0.04 0.00 0.41 0.00 0.00 41.25 42.02 3m1r s ASN 193 CO 0.33 -0.76 0.01 -0.44 -1.51 0.00 0.00 177.10 174.72 3m1r s SER 194 N -3.33 5.03 0.13 -1.22 0.01 -1.26 -5.04 113.70 108.01 3m1r s SER 194 Ca 0.37 -0.20 -0.27 0.00 1.31 0.00 0.00 55.95 57.17 3m1r s SER 194 Cb 0.07 -1.19 -0.03 0.00 0.21 0.00 0.00 66.02 65.08 3m1r s SER 194 CO 0.14 0.16 1.61 -0.61 0.41 0.00 0.00 173.24 174.95 3m1r h GLN 195 N 3.31 -0.41 0.00 12.44 4.15 -2.02 -1.21 115.11 131.37 3m1r h GLN 195 Ca -0.48 0.03 -0.03 0.00 0.77 0.00 0.00 58.65 58.94 3m1r h GLN 195 Cb 1.17 0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.95 3m1r h GLN 195 CO 0.60 -0.27 -0.15 0.00 -1.93 0.00 0.00 178.83 177.08 3m1r h ALA 196 N 0.34 1.56 0.02 3.38 0.00 -1.99 -1.08 119.26 121.49 3m1r h ALA 196 Ca 0.08 -0.13 -0.23 0.00 0.00 0.00 0.00 54.91 54.63 3m1r h ALA 196 Cb 0.56 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 3m1r h ALA 196 CO -0.33 0.18 -1.12 1.88 0.00 0.00 0.00 179.25 179.86 3m1r h TYR 197 N 0.00 0.07 -0.12 0.00 0.05 -1.81 -2.00 116.97 113.15 3m1r h TYR 197 Ca -0.00 -0.05 -0.14 0.00 0.05 0.00 0.00 58.73 58.59 3m1r h TYR 197 Cb 0.30 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.02 3m1r h TYR 197 CO 0.00 1.04 -0.54 1.49 -1.05 0.00 0.00 178.16 179.10 3m1r h GLU 198 N 0.01 0.35 0.01 4.88 4.81 -0.67 -2.38 114.58 121.59 3m1r h GLU 198 Ca -0.06 -0.22 -0.00 0.00 -0.13 0.00 0.00 59.36 58.95 3m1r h GLU 198 Cb 1.83 0.02 0.00 0.00 0.63 0.00 0.00 28.75 31.23 3m1r h GLU 198 CO 0.13 0.81 -0.00 0.00 -0.73 0.00 0.00 179.01 179.22 3m1r h ALA 199 N 1.15 -0.01 -0.85 2.92 0.00 -1.18 -0.95 119.26 120.34 3m1r h ALA 199 Ca 0.01 -0.20 0.19 0.00 0.00 0.00 0.00 54.91 54.90 3m1r h ALA 199 Cb 1.04 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.72 3m1r h ALA 199 CO 0.09 -0.30 0.37 -0.92 0.00 0.00 0.00 179.25 178.49 3m1r h TYR 200 N -0.41 0.62 -0.67 0.00 3.20 -1.31 0.43 116.97 118.82 3m1r h TYR 200 Ca -0.00 0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 3m1r h TYR 200 Cb 0.41 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.51 3m1r h TYR 200 CO 0.07 0.02 0.18 0.00 -1.64 0.00 0.00 178.16 176.78 3m1r h ALA 201 N 1.64 0.89 -0.16 1.82 0.00 -1.26 -2.85 119.26 119.34 3m1r h ALA 201 Ca 0.50 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 3m1r h ALA 201 Cb 0.87 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3m1r h ALA 201 CO -0.47 0.60 -0.33 0.87 0.00 0.00 0.00 179.25 179.91 3m1r h LYS 202 N 1.00 0.51 -0.99 0.00 1.57 0.48 -1.42 116.57 117.72 3m1r h LYS 202 Ca 0.21 -0.33 0.28 0.00 -1.87 0.00 0.00 60.65 58.94 3m1r h LYS 202 Cb 0.35 0.04 -0.14 0.00 0.08 0.00 0.00 32.23 32.57 3m1r h LYS 202 CO 0.00 0.94 0.56 -0.22 -0.57 0.00 0.00 179.45 180.16 3m1r h LYS 203 N 0.14 0.42 -0.18 3.15 1.63 -0.22 0.35 116.57 121.86 3m1r h LYS 203 Ca 0.00 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 3m1r h LYS 203 Cb 0.93 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.47 3m1r h LYS 203 CO 0.07 0.28 0.00 0.72 -3.45 0.00 0.00 179.45 177.07 3m1r n HIS 204 N -4.99 0.23 -2.47 1.91 8.25 -1.08 -4.92 115.22 112.15 3m1r n HIS 204 Ca 0.29 -0.11 -0.20 0.00 -0.26 0.00 0.00 57.72 57.43 3m1r n HIS 204 Cb 0.85 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.96 3m1r n HIS 204 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3m1r n ASN 205 N 0.12 -5.67 -4.77 0.41 3.02 0.12 -3.63 115.26 104.86 3m1r n ASN 205 Ca 0.13 -0.06 -0.40 0.00 -0.03 0.00 0.00 54.58 54.22 3m1r n ASN 205 Cb 0.24 -4.67 -0.01 0.00 -0.61 0.00 0.00 39.78 34.74 3m1r n ASN 205 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3m1r s VAL 206 N -3.01 2.47 -0.66 2.41 1.01 -0.55 -3.10 120.40 118.97 3m1r s VAL 206 Ca 0.05 0.45 -0.27 0.00 0.00 0.00 0.00 61.98 62.21 3m1r s VAL 206 Cb -0.02 -3.28 0.04 0.00 0.00 0.00 0.00 36.38 33.12 3m1r s VAL 206 CO 0.06 0.09 1.18 0.20 0.00 0.00 0.00 175.10 176.63 3m1r s ASN 207 N -0.48 6.28 -0.28 3.32 0.01 -0.44 -4.83 114.94 118.52 3m1r s ASN 207 Ca 0.53 -0.31 -0.09 0.00 -0.71 0.00 0.00 52.86 52.28 3m1r s ASN 207 Cb -0.41 -2.53 -0.03 0.00 0.41 0.00 0.00 41.25 38.69 3m1r s ASN 207 CO 0.55 -1.61 0.13 -0.63 -1.51 0.00 0.00 177.10 174.03 3m1r s ILE 208 N 5.10 4.74 -0.25 0.60 1.01 -1.26 -0.94 121.20 130.21 3m1r s ILE 208 Ca 0.36 -0.12 0.02 0.00 0.00 0.00 0.00 60.65 60.91 3m1r s ILE 208 Cb -0.09 -3.29 0.05 0.00 0.01 0.00 0.00 42.46 39.14 3m1r s ILE 208 CO 0.18 0.23 -0.11 -1.00 0.00 0.00 0.00 174.94 174.25 3m1r s HIS 209 N 1.67 3.17 0.00 3.97 3.76 -0.07 -4.99 115.29 122.80 3m1r s HIS 209 Ca 0.06 -2.11 0.00 0.00 -0.15 0.00 0.00 55.06 52.86 3m1r s HIS 209 Cb -0.16 -1.96 0.00 0.00 1.11 0.00 0.00 32.58 31.57 3m1r s HIS 209 CO 0.07 -0.85 0.00 0.25 -0.85 0.00 0.00 174.74 173.36 3m1r n THR 210 N 4.50 0.00 -0.40 1.30 -2.24 -1.26 -1.48 114.28 114.70 3m1r n THR 210 Ca -0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 3m1r n THR 210 Cb 0.44 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 3m1r n THR 210 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3m1r n ASP 212 N 0.00 0.00 0.00 3.42 9.92 -1.26 -4.56 116.55 124.06 3m1r n ASP 212 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 3m1r n ASP 212 Cb 0.00 -0.31 0.00 0.00 -0.64 0.00 0.00 41.12 40.17 3m1r n ASP 212 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 3m1r n ILE 214 N -0.40 0.00 0.24 0.53 5.41 -1.26 -2.26 119.36 121.61 3m1r n ILE 214 Ca 0.00 0.00 0.09 0.00 1.00 0.00 0.00 62.75 63.84 3m1r n ILE 214 Cb 0.00 0.00 0.59 0.00 -0.71 0.00 0.00 39.64 39.52 3m1r n ILE 214 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 3m1r h ARG 215 N 0.00 0.00 0.06 0.38 2.47 -1.89 0.30 114.38 115.70 3m1r h ARG 215 Ca 0.00 0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 58.61 3m1r h ARG 215 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 3m1r h ARG 215 CO 0.00 0.19 -0.52 0.93 0.56 0.00 0.00 179.97 181.13 3m1r h GLU 216 N 0.00 0.12 0.00 0.04 5.08 -1.85 -3.40 114.58 114.57 3m1r h GLU 216 Ca -0.00 -0.21 -0.20 0.00 -1.00 0.00 0.00 59.36 57.94 3m1r h GLU 216 Cb 0.46 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.75 3m1r h GLU 216 CO 0.03 1.10 -1.80 1.17 -1.00 0.00 0.00 179.01 178.50 3m1r n LYS 217 N -4.36 0.65 0.00 2.33 4.81 -1.19 -5.09 118.16 115.31 3m1r n LYS 217 Ca -0.15 0.09 0.00 0.00 -0.87 0.00 0.00 58.31 57.38 3m1r n LYS 217 Cb 0.65 -1.68 0.00 0.00 0.02 0.00 0.00 35.03 34.03 3m1r n LYS 217 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3m1r n GLY 218 N 1.48 2.49 0.11 3.14 0.00 0.11 -4.53 105.19 107.99 3m1r n GLY 218 Ca -0.16 -1.83 -0.19 0.00 0.00 0.00 0.00 46.02 43.84 3m1r n GLY 218 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3m1r h LEU 219 N 0.00 0.43 -0.20 0.99 5.85 -1.98 -2.24 115.31 118.16 3m1r h LEU 219 Ca 0.00 -0.92 -0.06 0.00 0.84 0.00 0.00 57.88 57.74 3m1r h LEU 219 Cb 0.00 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 3m1r h LEU 219 CO 0.00 1.31 -0.11 0.40 -0.34 0.00 0.00 178.44 179.70 3m1r h ILE 220 N -0.39 1.31 -0.16 4.05 1.08 -1.94 -1.96 117.51 119.50 3m1r h ILE 220 Ca -0.11 -1.19 0.03 0.00 -0.39 0.00 0.00 64.86 63.20 3m1r h ILE 220 Cb 1.50 1.65 -0.03 0.00 -3.07 0.00 0.00 36.82 36.87 3m1r h ILE 220 CO 0.13 0.36 -0.05 -0.65 -0.69 0.00 0.00 178.15 177.25 3m1r h PRO 221 N 0.13 -0.01 -0.98 2.37 0.11 -1.80 0.17 132.00 131.99 3m1r h PRO 221 Ca 0.04 0.00 0.22 0.00 0.11 0.00 0.00 66.00 66.37 3m1r h PRO 221 Cb 0.61 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 31.63 3m1r h PRO 221 CO 0.03 -0.01 0.62 1.15 -0.21 0.00 0.00 178.00 179.59 3m1r h THR 222 N -0.01 0.65 0.02 -1.15 2.02 -1.32 -2.51 112.91 110.61 3m1r h THR 222 Ca 0.08 -0.19 -0.00 0.00 0.77 0.00 0.00 66.41 67.07 3m1r h THR 222 Cb 0.13 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.60 3m1r h THR 222 CO -0.17 0.10 -0.01 0.40 0.37 0.00 0.00 175.52 176.20 3m1r h ILE 223 N 0.54 1.45 0.00 3.11 2.04 -0.59 -3.12 117.51 120.94 3m1r h ILE 223 Ca 0.55 -1.79 0.00 0.00 1.00 0.00 0.00 64.86 64.62 3m1r h ILE 223 Cb 1.16 2.59 0.00 0.00 -0.74 0.00 0.00 36.82 39.83 3m1r h ILE 223 CO -0.29 0.44 0.50 0.11 0.00 0.00 0.00 178.15 178.91 3m1r h LYS 224 N -0.85 0.00 0.00 2.37 1.57 -0.57 -0.98 116.57 118.11 3m1r h LYS 224 Ca -0.00 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.42 3m1r h LYS 224 Cb 0.74 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.99 3m1r h LYS 224 CO 0.01 0.00 -2.26 -1.91 -0.57 0.00 0.00 179.45 174.71 3m1r n GLU 225 N -2.73 0.68 -0.06 3.15 2.13 -1.02 -4.49 120.64 118.30 3m1r n GLU 225 Ca -0.01 0.07 -0.03 0.00 0.66 0.00 0.00 57.16 57.85 3m1r n GLU 225 Cb 0.53 -1.58 -0.13 0.00 0.27 0.00 0.00 31.44 30.54 3m1r n GLU 225 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 3m1r n ILE 226 N -2.89 0.78 -0.03 6.31 2.08 -0.69 -4.66 119.36 120.27 3m1r n ILE 226 Ca -0.31 -0.61 -0.13 0.00 0.56 0.00 0.00 62.75 62.26 3m1r n ILE 226 Cb 1.12 -0.36 -0.08 0.00 -0.75 0.00 0.00 39.64 39.56 3m1r n ILE 226 CO 0.00 0.00 0.00 0.25 0.56 0.00 0.00 176.55 177.36 3m1r h LEU 227 N 0.00 0.14 -0.87 1.39 5.85 -1.45 -3.08 115.31 117.29 3m1r h LEU 227 Ca -0.31 -0.39 0.14 0.00 0.84 0.00 0.00 57.88 58.16 3m1r h LEU 227 Cb 1.65 -0.04 -0.09 0.00 0.37 0.00 0.00 40.66 42.55 3m1r h LEU 227 CO 0.02 0.50 0.47 -0.65 -0.34 0.00 0.00 178.44 178.44 3m1r h PRO 228 N -0.21 0.67 -0.31 5.25 0.11 -1.80 -0.28 132.00 135.43 3m1r h PRO 228 Ca 0.02 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 66.13 3m1r h PRO 228 Cb 0.44 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 31.36 3m1r h PRO 228 CO 0.01 0.45 0.07 0.28 -0.21 0.00 0.00 178.00 178.59 3m1r h VAL 229 N 0.70 0.86 -0.01 3.15 2.07 -1.82 -2.77 116.25 118.43 3m1r h VAL 229 Ca 0.46 -0.06 -0.13 0.00 0.82 0.00 0.00 66.70 67.79 3m1r h VAL 229 Cb 0.61 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 3m1r h VAL 229 CO -0.33 0.03 -0.59 0.58 0.02 0.00 0.00 177.57 177.27 3m1r h VAL 230 N 0.18 1.42 0.00 2.57 2.07 -1.12 -2.95 116.25 118.43 3m1r h VAL 230 Ca 0.14 -2.03 -0.05 0.00 0.82 0.00 0.00 66.70 65.59 3m1r h VAL 230 Cb 0.15 2.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.00 3m1r h VAL 230 CO -0.18 0.58 -0.21 -0.61 0.02 0.00 0.00 177.57 177.17 3m1r h GLN 231 N 0.02 0.00 -0.66 1.57 4.15 -0.86 -2.07 115.11 117.25 3m1r h GLN 231 Ca -0.01 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.37 3m1r h GLN 231 Cb 1.06 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.72 3m1r h GLN 231 CO 0.08 0.21 0.25 -0.44 -1.93 0.00 0.00 178.83 177.01 3m1r h ASP 232 N 0.00 0.90 -0.12 -0.69 3.45 -1.31 -2.96 116.42 115.69 3m1r h ASP 232 Ca -0.00 -0.13 0.00 0.00 0.43 0.00 0.00 57.03 57.33 3m1r h ASP 232 Cb 0.50 -0.23 0.00 0.00 -0.56 0.00 0.00 39.33 39.03 3m1r h ASP 232 CO 0.03 0.82 0.00 0.29 -1.57 0.00 0.00 179.24 178.80 3m1r n LYS 233 N -4.30 1.98 -4.14 3.56 5.02 -0.80 -4.95 118.16 114.53 3m1r n LYS 233 Ca 0.06 -1.44 -0.10 0.00 -2.02 0.00 0.00 58.31 54.80 3m1r n LYS 233 Cb 0.18 -1.46 -0.10 0.00 -0.02 0.00 0.00 35.03 33.64 3m1r n LYS 233 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3m1r s THR 234 N -1.86 0.09 -0.09 -0.18 -4.23 -1.09 -4.96 115.64 103.31 3m1r s THR 234 Ca 0.34 -1.87 0.19 0.00 -1.18 0.00 0.00 61.69 59.17 3m1r s THR 234 Cb 0.20 -2.09 -0.29 0.00 1.34 0.00 0.00 72.50 71.67 3m1r s THR 234 CO 0.30 -0.39 0.31 0.47 -0.54 0.00 0.00 174.62 174.78 3m1r n ASP 235 N -0.13 0.29 -3.81 3.99 8.00 -0.48 -4.85 116.55 119.56 3m1r n ASP 235 Ca -0.05 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.33 3m1r n ASP 235 Cb 0.64 1.59 -0.09 0.00 -0.02 0.00 0.00 41.12 43.23 3m1r n ASP 235 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3m1r s PHE 236 N -3.08 -0.09 -0.06 1.24 0.40 -0.87 -4.86 117.98 110.66 3m1r s PHE 236 Ca -0.08 0.12 0.03 0.00 -0.60 0.00 0.00 56.93 56.40 3m1r s PHE 236 Cb 0.10 0.04 -0.03 0.00 0.51 0.00 0.00 43.02 43.65 3m1r s PHE 236 CO 0.83 -0.34 -0.13 0.96 0.70 0.00 0.00 175.22 177.25 3m1r s ILE 237 N -1.28 3.20 -0.06 0.64 -4.36 -0.50 0.57 121.20 119.41 3m1r s ILE 237 Ca -0.13 -0.67 0.04 0.00 -0.26 0.00 0.00 60.65 59.63 3m1r s ILE 237 Cb -0.06 -2.27 -0.00 0.00 1.25 0.00 0.00 42.46 41.38 3m1r s ILE 237 CO 0.03 0.59 -0.20 0.12 0.24 0.00 0.00 174.94 175.72 3m1r s PHE 238 N -0.67 2.06 -0.30 1.37 5.36 0.97 -0.53 117.98 126.24 3m1r s PHE 238 Ca 0.10 -0.68 -0.10 0.00 -0.96 0.00 0.00 56.93 55.29 3m1r s PHE 238 Cb -0.11 -1.38 -0.02 0.00 -0.34 0.00 0.00 43.02 41.16 3m1r s PHE 238 CO 0.01 -0.25 0.16 0.42 -1.46 0.00 0.00 175.22 174.10 3m1r s ILE 239 N 0.13 4.86 -0.40 3.12 1.01 -0.38 -1.30 121.20 128.24 3m1r s ILE 239 Ca -0.08 -0.18 -0.09 0.00 0.00 0.00 0.00 60.65 60.31 3m1r s ILE 239 Cb -0.14 -3.40 0.06 0.00 0.01 0.00 0.00 42.46 38.99 3m1r s ILE 239 CO 0.04 0.16 0.22 -0.55 0.00 0.00 0.00 174.94 174.81 3m1r s SER 240 N 1.67 5.57 -0.46 3.58 0.15 0.64 -1.27 113.70 123.58 3m1r s SER 240 Ca 0.06 -1.38 -0.13 0.00 0.70 0.00 0.00 55.95 55.20 3m1r s SER 240 Cb -0.16 -1.96 0.08 0.00 -1.71 0.00 0.00 66.02 62.27 3m1r s SER 240 CO 0.08 -0.47 0.36 -0.69 1.20 0.00 0.00 173.24 173.72 3m1r s VAL 241 N 1.43 4.84 0.00 4.45 1.01 0.15 -0.05 120.40 132.22 3m1r s VAL 241 Ca 0.02 -1.27 0.00 0.00 0.00 0.00 0.00 61.98 60.73 3m1r s VAL 241 Cb -0.22 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.20 3m1r s VAL 241 CO 0.03 -0.61 0.00 -0.67 0.00 0.00 0.00 175.10 173.85 3m1r n ASP 242 N 5.10 0.00 0.00 3.32 -0.08 -0.21 -1.12 116.55 123.55 3m1r n ASP 242 Ca -0.12 -0.64 0.00 0.00 -1.51 0.00 0.00 54.79 52.52 3m1r n ASP 242 Cb 0.43 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.89 3m1r n ASP 242 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 3m1r n ASP 244 N -1.93 0.00 0.27 1.67 5.68 -1.26 -4.46 116.55 116.51 3m1r n ASP 244 Ca 0.00 0.00 0.15 0.00 -0.50 0.00 0.00 54.79 54.44 3m1r n ASP 244 Cb 0.00 -0.12 0.71 0.00 -1.14 0.00 0.00 41.12 40.57 3m1r n ASP 244 CO 0.00 0.00 0.00 1.62 -1.33 0.00 0.00 177.20 177.49 3m1r h VAL 245 N 0.00 0.31 -3.92 2.12 3.04 -1.89 -3.40 116.25 112.52 3m1r h VAL 245 Ca 0.00 -0.61 -0.47 0.00 -1.01 0.00 0.00 66.70 64.62 3m1r h VAL 245 Cb 0.00 1.46 -0.01 0.00 -2.01 0.00 0.00 31.29 30.72 3m1r h VAL 245 CO 0.00 0.09 0.36 -0.76 -1.01 0.00 0.00 177.57 176.25 3m1r s LEU 246 N -6.67 4.26 0.49 3.16 1.43 -1.26 -1.14 118.68 118.96 3m1r s LEU 246 Ca -0.01 1.85 -0.21 0.00 -1.03 0.00 0.00 54.13 54.72 3m1r s LEU 246 Cb 0.11 -4.10 -0.09 0.00 0.03 0.00 0.00 46.19 42.14 3m1r s LEU 246 CO 0.56 -0.16 0.84 -0.67 0.23 0.00 0.00 176.35 177.15 3m1r n ASP 247 N 0.32 0.40 0.21 2.29 2.03 0.69 -4.65 116.55 117.85 3m1r n ASP 247 Ca 0.03 0.90 0.12 0.00 0.52 0.00 0.00 54.79 56.36 3m1r n ASP 247 Cb 0.50 -1.29 0.70 0.00 -0.72 0.00 0.00 41.12 40.31 3m1r n ASP 247 CO 0.00 0.00 0.00 0.06 -1.92 0.00 0.00 177.20 175.34 3m1r h GLN 248 N 0.93 0.00 0.00 -0.67 3.07 -1.53 -0.53 115.11 116.39 3m1r h GLN 248 Ca -0.45 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.29 3m1r h GLN 248 Cb 1.36 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.92 3m1r h GLN 248 CO 0.53 0.00 -0.01 0.66 0.09 0.00 0.00 178.83 180.10 3m1r h SER 249 N 0.00 0.00 0.37 0.06 4.64 -1.89 -2.86 113.55 113.88 3m1r h SER 249 Ca 0.05 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.20 3m1r h SER 249 Cb 0.21 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.27 3m1r h SER 249 CO -0.00 0.01 -1.78 1.41 -0.87 0.00 0.00 176.83 175.60 3m1r n HIS 250 N -3.10 0.50 -3.33 4.77 8.25 -0.29 -4.67 115.22 117.33 3m1r n HIS 250 Ca 0.02 0.16 -0.26 0.00 -0.26 0.00 0.00 57.72 57.38 3m1r n HIS 250 Cb 0.41 -0.92 -0.09 0.00 1.12 0.00 0.00 29.99 30.51 3m1r n HIS 250 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3m1r n ALA 251 N -2.44 2.74 0.27 -1.41 0.00 -0.67 -4.75 120.51 114.24 3m1r n ALA 251 Ca -0.14 -3.23 0.15 0.00 0.00 0.00 0.00 53.44 50.23 3m1r n ALA 251 Cb 0.84 -0.77 0.67 0.00 0.00 0.00 0.00 19.45 20.19 3m1r n ALA 251 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3m1r h PRO 252 N 5.10 0.00 -0.94 0.00 0.14 -1.78 -3.24 132.00 131.28 3m1r h PRO 252 Ca 0.20 0.00 -0.02 0.00 0.14 0.00 0.00 66.00 66.33 3m1r h PRO 252 Cb 0.90 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.03 3m1r h PRO 252 CO 0.41 0.07 0.02 0.41 0.14 0.00 0.00 178.00 179.05 3m1r n GLY 253 N -0.08 1.89 3.89 1.56 0.00 -1.26 -4.67 105.19 106.51 3m1r n GLY 253 Ca -0.00 -0.18 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 3m1r n GLY 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1r h PRO 255 N 4.57 0.30 -4.39 0.00 0.11 -1.89 -3.31 132.00 127.38 3m1r h PRO 255 Ca -0.53 -0.02 -0.75 0.00 0.11 0.00 0.00 66.00 64.82 3m1r h PRO 255 Cb 1.21 -0.07 -0.22 0.00 0.11 0.00 0.00 31.00 32.04 3m1r h PRO 255 CO 0.62 0.20 0.70 0.00 -0.21 0.00 0.00 178.00 179.31 3m1r s ALA 256 N -6.15 3.95 0.05 -0.75 0.00 -1.26 -5.01 121.76 112.60 3m1r s ALA 256 Ca -0.13 -3.25 -0.02 0.00 0.00 0.00 0.00 51.96 48.56 3m1r s ALA 256 Cb 0.13 -3.85 -0.04 0.00 0.00 0.00 0.00 23.12 19.36 3m1r s ALA 256 CO 0.72 -2.61 0.24 0.96 0.00 0.00 0.00 175.76 175.07 3m1r s ILE 257 N 1.06 5.35 0.14 0.00 -4.36 -1.25 -4.87 121.20 117.27 3m1r s ILE 257 Ca 0.31 -0.20 -0.25 0.00 -0.26 0.00 0.00 60.65 60.26 3m1r s ILE 257 Cb -0.07 -3.60 0.08 0.00 1.25 0.00 0.00 42.46 40.12 3m1r s ILE 257 CO -0.07 0.19 1.04 -0.83 0.24 0.00 0.00 174.94 175.52 3m1r s GLY 258 N -2.27 -0.13 0.61 6.27 0.00 -1.26 -5.00 107.32 105.54 3m1r s GLY 258 Ca 0.33 0.03 -0.10 0.00 0.00 0.00 0.00 44.72 44.99 3m1r s GLY 258 CO 0.24 1.05 0.99 2.56 0.00 0.00 0.00 173.10 177.93 3m1r s PRO 259 N -2.72 3.41 0.00 2.90 0.04 -1.26 -1.46 135.00 135.90 3m1r s PRO 259 Ca 0.16 0.54 0.00 0.00 0.04 0.00 0.00 61.00 61.75 3m1r s PRO 259 Cb -0.01 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.39 3m1r s PRO 259 CO 0.02 -0.59 0.00 0.41 0.04 0.00 0.00 177.00 176.88 3m1r n GLY 260 N -2.69 0.97 2.10 0.56 0.00 -1.26 -4.92 105.19 99.94 3m1r n GLY 260 Ca 0.05 -0.56 -0.11 0.00 0.00 0.00 0.00 46.02 45.41 3m1r n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m1r n GLY 261 N -1.15 2.02 3.73 -0.02 0.00 -1.26 -4.91 105.19 103.60 3m1r n GLY 261 Ca 0.00 -2.19 -0.31 0.00 0.00 0.00 0.00 46.02 43.53 3m1r n GLY 261 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m1r s LEU 262 N 0.00 2.79 0.06 0.99 1.43 -0.29 -4.12 118.68 119.54 3m1r s LEU 262 Ca 0.32 1.85 -0.01 0.00 -1.03 0.00 0.00 54.13 55.26 3m1r s LEU 262 Cb -0.03 -4.40 -0.04 0.00 0.03 0.00 0.00 46.19 41.75 3m1r s LEU 262 CO 0.20 -2.47 0.22 -0.31 0.23 0.00 0.00 176.35 174.22 3m1r s TYR 263 N -2.83 3.52 0.32 0.29 1.51 -1.26 -0.22 117.35 118.68 3m1r s TYR 263 Ca 0.63 0.29 0.01 0.00 -1.01 0.00 0.00 57.07 56.99 3m1r s TYR 263 Cb -0.19 -1.79 0.56 0.00 -0.11 0.00 0.00 41.96 40.43 3m1r s TYR 263 CO 0.57 0.58 1.95 1.15 -1.11 0.00 0.00 175.55 178.69 3m1r h THR 264 N 2.17 1.11 -0.43 -0.71 2.02 -1.97 -2.14 112.91 112.95 3m1r h THR 264 Ca -0.46 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.38 3m1r h THR 264 Cb 1.16 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 3m1r h THR 264 CO 0.75 0.18 0.23 -2.24 0.37 0.00 0.00 175.52 174.81 3m1r h ASP 265 N 0.99 0.55 -0.22 4.18 2.03 -1.99 -0.22 116.42 121.72 3m1r h ASP 265 Ca 0.33 -0.10 0.06 0.00 -0.73 0.00 0.00 57.03 56.59 3m1r h ASP 265 Cb 0.08 -0.14 -0.07 0.00 -0.83 0.00 0.00 39.33 38.37 3m1r h ASP 265 CO -0.10 0.48 -0.30 -0.33 -1.03 0.00 0.00 179.24 177.96 3m1r h GLU 266 N 0.56 -0.31 -0.38 4.15 5.08 -1.82 -1.35 114.58 120.51 3m1r h GLU 266 Ca 0.15 0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.56 3m1r h GLU 266 Cb 0.06 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 3m1r h GLU 266 CO -0.02 -0.21 0.20 1.25 -1.00 0.00 0.00 179.01 179.23 3m1r h LEU 267 N -0.32 0.30 -0.47 1.33 5.85 -0.96 -1.20 115.31 119.84 3m1r h LEU 267 Ca 0.12 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.86 3m1r h LEU 267 Cb 0.52 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 3m1r h LEU 267 CO -0.41 0.22 0.30 -0.07 -0.34 0.00 0.00 178.44 178.14 3m1r h LEU 268 N 0.41 0.54 -0.38 2.25 3.38 -0.85 0.55 115.31 121.20 3m1r h LEU 268 Ca 0.16 -0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.15 3m1r h LEU 268 Cb 0.05 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 3m1r h LEU 268 CO -0.10 0.41 0.13 -0.08 0.09 0.00 0.00 178.44 178.89 3m1r h GLU 269 N 0.63 0.28 -0.70 1.13 4.81 -0.93 -1.86 114.58 117.94 3m1r h GLU 269 Ca 0.17 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.32 3m1r h GLU 269 Cb -0.05 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.24 3m1r h GLU 269 CO -0.04 0.18 0.17 0.00 -0.73 0.00 0.00 179.01 178.60 3m1r h ALA 270 N 1.25 0.92 -0.57 2.92 0.00 -0.55 -1.12 119.26 122.11 3m1r h ALA 270 Ca 0.17 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 3m1r h ALA 270 Cb 0.16 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3m1r h ALA 270 CO -0.18 0.64 0.11 0.28 0.00 0.00 0.00 179.25 180.10 3m1r h VAL 271 N 1.05 1.24 -0.21 0.00 2.07 -0.64 -1.71 116.25 118.06 3m1r h VAL 271 Ca 0.22 -0.89 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 3m1r h VAL 271 Cb 0.37 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 3m1r h VAL 271 CO 0.00 0.33 0.08 0.50 0.02 0.00 0.00 177.57 178.50 3m1r h LYS 272 N 0.85 0.32 0.35 1.57 3.64 -0.94 -1.67 116.57 120.69 3m1r h LYS 272 Ca 0.18 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.50 3m1r h LYS 272 Cb 0.35 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 3m1r h LYS 272 CO 0.00 0.39 -0.32 -0.92 -2.27 0.00 0.00 179.45 176.34 3m1r h TYR 273 N 0.18 -0.85 -0.79 1.91 3.20 -0.75 -2.42 116.97 117.46 3m1r h TYR 273 Ca 0.07 0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.00 3m1r h TYR 273 Cb 0.20 0.32 -0.05 0.00 1.54 0.00 0.00 36.73 38.74 3m1r h TYR 273 CO -0.01 -0.46 0.52 0.82 -1.64 0.00 0.00 178.16 177.39 3m1r h ILE 274 N -0.69 1.05 0.00 1.81 2.04 -1.33 -2.09 117.51 118.30 3m1r h ILE 274 Ca -0.02 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.54 3m1r h ILE 274 Cb 0.61 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 3m1r h ILE 274 CO -0.04 0.16 0.00 0.00 0.00 0.00 0.00 178.15 178.27 3m1r n ALA 275 N -2.43 1.86 0.08 1.87 0.00 -0.63 -1.94 120.51 119.33 3m1r n ALA 275 Ca 0.11 -0.07 -0.11 0.00 0.00 0.00 0.00 53.44 53.37 3m1r n ALA 275 Cb 0.20 -1.30 -0.04 0.00 0.00 0.00 0.00 19.45 18.30 3m1r n ALA 275 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3m1r h GLN 276 N 0.00 0.29 -6.79 0.00 4.20 -1.03 -3.45 115.11 108.33 3m1r h GLN 276 Ca 0.00 -0.33 -0.55 0.00 0.06 0.00 0.00 58.65 57.83 3m1r h GLN 276 Cb 0.32 0.10 0.19 0.00 0.30 0.00 0.00 27.48 28.39 3m1r h GLN 276 CO 0.00 1.05 -0.29 1.04 -0.67 0.00 0.00 178.83 179.96 3m1r n GLN 277 N -3.67 0.17 -2.57 1.46 1.13 -0.82 -4.67 117.38 108.41 3m1r n GLN 277 Ca -0.05 0.11 -0.39 0.00 -1.94 0.00 0.00 57.00 54.72 3m1r n GLN 277 Cb 0.85 -1.96 -0.05 0.00 0.11 0.00 0.00 30.24 29.19 3m1r n GLN 277 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 3m1r s PRO 278 N -3.21 4.59 -0.25 -1.09 0.02 -1.26 -4.09 135.00 129.71 3m1r s PRO 278 Ca 0.65 1.64 0.00 0.00 0.02 0.00 0.00 61.00 63.31 3m1r s PRO 278 Cb -0.31 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.17 3m1r s PRO 278 CO 0.59 0.21 0.00 0.09 -0.33 0.00 0.00 177.00 177.56 3m1r n ASN 279 N 0.95 -1.93 -4.59 2.53 5.03 -1.26 -4.74 115.26 111.25 3m1r n ASN 279 Ca 0.00 0.01 -0.42 0.00 0.87 0.00 0.00 54.58 55.04 3m1r n ASN 279 Cb 0.47 -1.08 -0.03 0.00 -1.02 0.00 0.00 39.78 38.12 3m1r n ASN 279 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3m1r s VAL 280 N -2.13 3.42 -0.77 2.41 1.01 -1.26 -1.41 120.40 121.67 3m1r s VAL 280 Ca 0.00 0.41 0.26 0.00 0.00 0.00 0.00 61.98 62.65 3m1r s VAL 280 Cb 0.00 -3.64 0.23 0.00 0.00 0.00 0.00 36.38 32.97 3m1r s VAL 280 CO 0.00 -0.45 1.71 0.00 0.00 0.00 0.00 175.10 176.35 3m1r n ALA 281 N 10.91 2.45 0.00 5.51 0.00 0.31 -4.93 120.51 134.75 3m1r n ALA 281 Ca 0.23 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.59 3m1r n ALA 281 Cb 0.48 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.52 3m1r n ALA 281 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m1r n GLY 282 N 1.35 -0.31 3.09 0.00 0.00 -1.25 -3.79 105.19 104.28 3m1r n GLY 282 Ca 0.05 -1.23 -0.12 0.00 0.00 0.00 0.00 46.02 44.72 3m1r n GLY 282 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3m1r s ILE 283 N -2.00 0.02 0.03 -0.61 2.07 -0.70 -1.25 121.20 118.75 3m1r s ILE 283 Ca 0.00 -0.18 0.04 0.00 -1.41 0.00 0.00 60.65 59.09 3m1r s ILE 283 Cb 0.00 -0.33 -0.02 0.00 0.13 0.00 0.00 42.46 42.24 3m1r s ILE 283 CO 0.00 -0.10 -0.11 -1.83 -1.91 0.00 0.00 174.94 170.99 3m1r s GLU 284 N -0.31 0.78 -0.17 3.50 -1.05 -0.40 -0.17 118.70 120.88 3m1r s GLU 284 Ca -0.04 -0.65 0.01 0.00 -0.15 0.00 0.00 54.97 54.14 3m1r s GLU 284 Cb -0.03 -0.74 0.02 0.00 -0.44 0.00 0.00 34.13 32.94 3m1r s GLU 284 CO 0.01 0.18 -0.19 0.42 0.95 0.00 0.00 175.26 176.63 3m1r s ILE 285 N -0.80 1.97 0.22 1.83 1.01 -0.15 -0.67 121.20 124.61 3m1r s ILE 285 Ca -0.00 -0.89 0.06 0.00 0.00 0.00 0.00 60.65 59.82 3m1r s ILE 285 Cb -0.07 -1.79 -0.05 0.00 0.01 0.00 0.00 42.46 40.56 3m1r s ILE 285 CO 0.01 0.53 -0.09 0.68 0.00 0.00 0.00 174.94 176.06 3m1r s VAL 286 N 1.30 1.53 -0.08 2.92 -7.23 -0.28 -1.27 120.40 117.29 3m1r s VAL 286 Ca 0.04 -2.14 0.00 0.00 -1.81 0.00 0.00 61.98 58.07 3m1r s VAL 286 Cb -0.13 -2.17 0.00 0.00 0.56 0.00 0.00 36.38 34.64 3m1r s VAL 286 CO -0.12 -0.50 0.00 -0.62 -0.31 0.00 0.00 175.10 173.55 3m1r n GLU 287 N -0.41 -0.09 -2.69 4.82 -0.58 -0.51 -4.43 120.64 116.74 3m1r n GLU 287 Ca -0.07 0.36 -0.43 0.00 -0.42 0.00 0.00 57.16 56.60 3m1r n GLU 287 Cb 0.62 -3.74 -0.02 0.00 -0.57 0.00 0.00 31.44 27.72 3m1r n GLU 287 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3m1r s VAL 288 N -2.01 4.75 -0.43 2.62 1.01 -1.26 -4.28 120.40 120.81 3m1r s VAL 288 Ca 0.00 2.02 0.01 0.00 0.00 0.00 0.00 61.98 64.01 3m1r s VAL 288 Cb 0.00 -4.30 0.12 0.00 0.00 0.00 0.00 36.38 32.19 3m1r s VAL 288 CO 0.00 -0.06 0.18 -0.62 0.00 0.00 0.00 175.10 174.61 3m1r s ASP 289 N 1.13 4.93 0.55 3.32 -1.08 0.15 -4.15 116.67 121.52 3m1r s ASP 289 Ca 0.46 -2.33 0.30 0.00 -0.52 0.00 0.00 52.55 50.47 3m1r s ASP 289 Cb -0.17 -1.73 1.60 0.00 -1.46 0.00 0.00 42.92 41.16 3m1r s ASP 289 CO 0.14 -0.41 2.12 -0.65 0.52 0.00 0.00 175.17 176.88 3m1r h PRO 290 N 7.53 0.00 0.00 4.34 0.11 -1.78 -0.42 132.00 141.78 3m1r h PRO 290 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 3m1r h PRO 290 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 3m1r h PRO 290 CO 0.63 0.08 0.00 0.25 -0.21 0.00 0.00 178.00 178.75 3m1r n THR 291 N -3.53 0.49 0.69 -1.15 -2.24 -1.26 -2.62 114.28 104.66 3m1r n THR 291 Ca -0.02 0.12 0.08 0.00 -2.27 0.00 0.00 64.05 61.96 3m1r n THR 291 Cb 0.21 -0.74 0.07 0.00 -2.10 0.00 0.00 70.33 67.76 3m1r n THR 291 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3m1r n LEU 292 N -1.52 2.34 -4.88 3.22 4.77 -0.18 -5.05 117.00 115.70 3m1r n LEU 292 Ca 0.05 -0.99 -0.30 0.00 -0.03 0.00 0.00 56.01 54.74 3m1r n LEU 292 Cb 0.26 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.37 3m1r n LEU 292 CO 0.21 0.42 0.67 -0.62 -1.33 0.00 0.00 177.39 176.74 3m1r s ASP 293 N -1.39 5.95 -0.27 -1.43 -1.08 -1.08 -4.28 116.67 113.09 3m1r s ASP 293 Ca 0.19 1.20 -0.18 0.00 -0.52 0.00 0.00 52.55 53.24 3m1r s ASP 293 Cb 0.14 -2.21 -0.02 0.00 -1.46 0.00 0.00 42.92 39.36 3m1r s ASP 293 CO 0.21 -0.98 0.54 0.12 0.52 0.00 0.00 175.17 175.58 3m1r s PHE 294 N -3.15 3.25 0.00 -5.34 2.19 -1.26 -4.89 117.98 108.78 3m1r s PHE 294 Ca 0.55 0.59 0.00 0.00 0.33 0.00 0.00 56.93 58.40 3m1r s PHE 294 Cb -0.11 -2.78 0.00 0.00 -1.31 0.00 0.00 43.02 38.82 3m1r s PHE 294 CO 0.51 -0.33 0.00 0.54 1.83 0.00 0.00 175.22 177.77 3m1r n ARG 295 N 5.61 0.00 -3.93 10.12 1.74 -1.26 -4.64 116.66 124.30 3m1r n ARG 295 Ca -0.04 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.75 3m1r n ARG 295 Cb 0.49 0.00 -0.16 0.00 -1.02 0.00 0.00 32.46 31.78 3m1r n ARG 295 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 3m1r s ASP 296 N -4.00 3.43 0.00 0.55 -4.77 -1.26 -5.00 116.67 105.62 3m1r s ASP 296 Ca 0.00 -0.96 0.00 0.00 -3.30 0.00 0.00 52.55 48.29 3m1r s ASP 296 Cb 0.00 -1.09 0.00 0.00 -1.09 0.00 0.00 42.92 40.74 3m1r s ASP 296 CO 0.00 -0.21 0.00 0.41 0.70 0.00 0.00 175.17 176.07 3m1r n THR 298 N 4.75 0.00 0.12 2.11 -1.04 -1.26 -0.70 114.28 118.26 3m1r n THR 298 Ca -0.12 0.00 -0.00 0.00 -2.04 0.00 0.00 64.05 61.88 3m1r n THR 298 Cb 0.46 0.00 0.27 0.00 -1.82 0.00 0.00 70.33 69.24 3m1r n THR 298 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3m1r h SER 299 N 0.00 0.17 -0.14 8.00 0.02 -1.94 -0.03 113.55 119.63 3m1r h SER 299 Ca 0.00 -0.06 -0.19 0.00 -0.84 0.00 0.00 61.79 60.70 3m1r h SER 299 Cb 0.00 -0.05 0.01 0.00 0.14 0.00 0.00 62.40 62.50 3m1r h SER 299 CO 0.00 0.54 -0.65 0.03 -1.14 0.00 0.00 176.83 175.62 3m1r h ARG 300 N 0.14 0.69 -0.80 3.45 3.08 -1.24 0.55 114.38 120.24 3m1r h ARG 300 Ca 0.01 -0.55 0.06 0.00 0.07 0.00 0.00 59.98 59.57 3m1r h ARG 300 Cb 0.75 0.11 -0.06 0.00 0.08 0.00 0.00 29.97 30.85 3m1r h ARG 300 CO 0.06 1.17 0.48 0.00 -1.07 0.00 0.00 179.97 180.61 3m1r h ALA 301 N 0.52 1.09 -0.32 0.04 0.00 -1.75 -0.90 119.26 117.95 3m1r h ALA 301 Ca -0.04 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.70 3m1r h ALA 301 Cb 1.28 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 3m1r h ALA 301 CO 0.13 0.21 -0.45 0.00 0.00 0.00 0.00 179.25 179.14 3m1r h ALA 302 N 1.39 0.59 -0.85 0.00 0.00 -0.80 -1.88 119.26 117.71 3m1r h ALA 302 Ca 0.35 -0.48 0.08 0.00 0.00 0.00 0.00 54.91 54.87 3m1r h ALA 302 Cb 0.17 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.79 3m1r h ALA 302 CO -0.17 0.68 0.51 0.00 0.00 0.00 0.00 179.25 180.26 3m1r h ALA 303 N 0.82 1.21 -0.25 0.00 0.00 -0.36 -2.42 119.26 118.27 3m1r h ALA 303 Ca 0.04 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 3m1r h ALA 303 Cb 1.04 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 3m1r h ALA 303 CO 0.10 0.18 -0.42 0.45 0.00 0.00 0.00 179.25 179.56 3m1r h HIS 304 N 0.88 0.72 -0.45 0.00 3.86 -0.70 -2.08 115.15 117.37 3m1r h HIS 304 Ca 0.40 -0.21 0.08 0.00 -1.16 0.00 0.00 60.37 59.47 3m1r h HIS 304 Cb 0.30 -0.15 -0.06 0.00 1.06 0.00 0.00 27.41 28.56 3m1r h HIS 304 CO -0.04 0.92 0.08 0.28 0.86 0.00 0.00 177.93 180.02 3m1r h VAL 305 N 0.49 0.74 -1.01 2.45 2.07 -0.89 0.59 116.25 120.69 3m1r h VAL 305 Ca 0.04 -0.07 0.08 0.00 0.82 0.00 0.00 66.70 67.57 3m1r h VAL 305 Cb 0.93 0.51 -0.07 0.00 -1.52 0.00 0.00 31.29 31.14 3m1r h VAL 305 CO 0.08 0.04 0.64 -0.07 0.02 0.00 0.00 177.57 178.29 3m1r h LEU 306 N 0.21 1.00 -0.31 2.57 4.07 -1.12 -0.88 115.31 120.85 3m1r h LEU 306 Ca 0.22 0.02 -0.19 0.00 0.08 0.00 0.00 57.88 58.02 3m1r h LEU 306 Cb 0.29 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 41.85 3m1r h LEU 306 CO -0.31 0.61 -0.59 -0.07 -1.08 0.00 0.00 178.44 177.00 3m1r h LEU 307 N 1.12 0.92 -0.90 1.67 3.38 -0.52 -0.21 115.31 120.76 3m1r h LEU 307 Ca 0.46 -0.51 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 3m1r h LEU 307 Cb 0.28 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3m1r h LEU 307 CO -0.21 1.30 -0.29 0.45 0.09 0.00 0.00 178.44 179.78 3m1r h HIS 308 N 0.61 0.00 0.05 1.13 3.86 -0.66 0.14 115.15 120.28 3m1r h HIS 308 Ca 0.00 0.00 -0.27 0.00 -1.16 0.00 0.00 60.37 58.94 3m1r h HIS 308 Cb 1.19 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.68 3m1r h HIS 308 CO 0.07 0.29 -1.11 0.00 0.86 0.00 0.00 177.93 178.04 3m1r h ALA 309 N 1.71 0.12 0.18 2.45 0.00 -1.04 -1.13 119.26 121.55 3m1r h ALA 309 Ca -0.00 -0.73 -0.00 0.00 0.00 0.00 0.00 54.91 54.17 3m1r h ALA 309 Cb 0.87 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 3m1r h ALA 309 CO 0.04 0.72 -0.12 -0.07 0.00 0.00 0.00 179.25 179.82 3m1r h LEU 310 N 0.32 -0.29 -0.58 0.00 4.07 -0.83 -2.69 115.31 115.31 3m1r h LEU 310 Ca -0.14 0.02 0.12 0.00 0.08 0.00 0.00 57.88 57.96 3m1r h LEU 310 Cb 1.77 0.09 -0.10 0.00 1.08 0.00 0.00 40.66 43.50 3m1r h LEU 310 CO 0.21 -0.19 -0.01 0.50 -1.08 0.00 0.00 178.44 177.87 3m1r h LYS 311 N -0.29 0.11 -1.15 1.13 3.64 -0.78 -1.61 116.57 117.61 3m1r h LYS 311 Ca -0.02 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3m1r h LYS 311 Cb 0.25 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 3m1r h LYS 311 CO 0.01 0.07 0.00 0.41 -2.27 0.00 0.00 179.45 177.67 3m1r n GLY 312 N -1.36 0.21 0.94 5.01 0.00 -0.43 -2.43 105.19 107.14 3m1r n GLY 312 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3m1r n GLY 312 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3m1r n LYS 314 N 0.73 0.00 -1.78 1.61 4.81 -0.61 -3.62 118.16 119.30 3m1r n LYS 314 Ca 0.00 0.00 -0.36 0.00 -0.87 0.00 0.00 58.31 57.08 3m1r n LYS 314 Cb 0.05 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.10 3m1r n LYS 314 CO 0.00 0.00 0.00 1.47 1.17 0.00 0.00 177.40 180.04 3m1r n LEU 315 N 0.00 7.18 -3.69 3.14 -0.00 -1.02 -4.84 117.00 117.77 3m1r n LEU 315 Ca 0.00 -4.58 -0.13 0.00 -0.00 0.00 0.00 56.01 51.30 3m1r n LEU 315 Cb 0.00 -1.13 -0.09 0.00 -0.00 0.00 0.00 43.42 42.20 3m1r n LEU 315 CO 0.00 1.76 0.20 -0.94 -0.00 0.00 0.00 177.39 178.41 3m1r s SER 316 N -0.59 -0.58 0.00 1.45 1.04 -1.25 -4.92 113.70 108.85 3m1r s SER 316 Ca 0.54 1.08 0.28 0.00 0.48 0.00 0.00 55.95 58.33 3m1r s SER 316 Cb 0.42 1.07 1.00 0.00 0.10 0.00 0.00 66.02 68.60 3m1r s SER 316 CO -0.35 -0.19 1.72 -2.65 0.98 0.00 0.00 173.24 172.75