#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mnk h HIS 4 N 0.00 0.27 -4.21 -1.40 -0.00 -2.05 -3.45 115.15 104.31 3mnk h HIS 4 Ca 0.00 -0.05 -0.50 0.00 -0.00 0.00 0.00 60.37 59.82 3mnk h HIS 4 Cb 0.00 -0.07 0.07 0.00 -0.00 0.00 0.00 27.41 27.41 3mnk h HIS 4 CO 0.00 0.49 0.38 1.67 -0.00 0.00 0.00 177.93 180.46 3mnk s TRP 5 N -4.46 2.93 0.00 5.26 1.48 -1.26 -4.86 118.94 118.04 3mnk s TRP 5 Ca -0.05 1.51 0.00 0.00 -1.06 0.00 0.00 56.10 56.50 3mnk s TRP 5 Cb 0.14 -3.03 0.00 0.00 -1.16 0.00 0.00 33.47 29.43 3mnk s TRP 5 CO 0.75 -1.22 0.00 0.41 -4.06 0.00 0.00 176.95 172.83 3mnk n GLY 6 N -0.98 2.20 0.10 3.67 0.00 -0.31 -5.03 105.19 104.84 3mnk n GLY 6 Ca 0.09 -0.34 0.06 0.00 0.00 0.00 0.00 46.02 45.83 3mnk n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3mnk n TYR 7 N 0.00 0.00 -2.21 1.61 4.02 -1.26 -3.81 117.16 115.51 3mnk n TYR 7 Ca 0.00 -0.71 -0.22 0.00 -0.01 0.00 0.00 57.90 56.95 3mnk n TYR 7 Cb 0.00 -0.11 0.14 0.00 -0.02 0.00 0.00 39.34 39.35 3mnk n TYR 7 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3mnk n GLY 8 N -0.97 -0.31 0.35 2.72 0.00 -1.26 -4.74 105.19 100.98 3mnk n GLY 8 Ca 0.09 -1.87 0.05 0.00 0.00 0.00 0.00 46.02 44.29 3mnk n GLY 8 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3mnk h LYS 9 N 0.00 0.80 -0.00 1.61 3.64 -1.97 -0.24 116.57 120.41 3mnk h LYS 9 Ca -0.32 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 3mnk h LYS 9 Cb 1.04 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.68 3mnk h LYS 9 CO 0.29 0.53 -0.82 0.72 -2.27 0.00 0.00 179.45 177.89 3mnk n HIS 10 N -4.48 0.00 -1.49 1.91 8.25 -1.26 -4.48 115.22 113.68 3mnk n HIS 10 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 3mnk n HIS 10 Cb 0.20 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.31 3mnk n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3mnk n ASN 11 N -1.29 0.06 -3.03 0.41 6.94 -1.19 -4.96 115.26 112.21 3mnk n ASN 11 Ca 0.04 -1.54 -0.15 0.00 -0.02 0.00 0.00 54.58 52.91 3mnk n ASN 11 Cb 0.30 -0.11 0.10 0.00 -2.36 0.00 0.00 39.78 37.72 3mnk n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3mnk n GLY 12 N -0.03 -1.03 0.37 4.83 0.00 -0.11 -1.17 105.19 108.06 3mnk n GLY 12 Ca 0.00 -1.73 0.19 0.00 0.00 0.00 0.00 46.02 44.48 3mnk n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3mnk h PRO 13 N 0.00 0.00 0.00 1.61 0.11 -1.84 0.17 132.00 132.04 3mnk h PRO 13 Ca -0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 3mnk h PRO 13 Cb 0.61 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.72 3mnk h PRO 13 CO 0.16 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.10 3mnk n GLU 14 N -4.21 0.13 0.00 1.05 0.00 -1.26 -2.68 120.64 113.68 3mnk n GLU 14 Ca 0.07 0.11 0.11 0.00 0.00 0.00 0.00 57.16 57.45 3mnk n GLU 14 Cb 0.52 -1.50 -0.12 0.00 0.00 0.00 0.00 31.44 30.35 3mnk n GLU 14 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 3mnk n HIS 15 N -1.41 0.08 0.20 -1.84 8.25 0.57 -4.63 115.22 116.45 3mnk n HIS 15 Ca 0.07 0.02 0.12 0.00 -0.26 0.00 0.00 57.72 57.68 3mnk n HIS 15 Cb 0.22 -0.37 0.70 0.00 1.12 0.00 0.00 29.99 31.66 3mnk n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 3mnk h TRP 16 N 0.00 0.00 0.00 4.41 6.55 -1.46 -2.41 115.95 123.04 3mnk h TRP 16 Ca 0.00 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.83 3mnk h TRP 16 Cb 0.81 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 29.11 3mnk h TRP 16 CO 0.00 0.00 -0.07 1.12 -1.05 0.00 0.00 178.44 178.44 3mnk h HIS 17 N 0.00 0.00 -0.39 0.49 2.07 -1.80 -0.19 115.15 115.34 3mnk h HIS 17 Ca 0.07 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.47 3mnk h HIS 17 Cb 0.28 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.25 3mnk h HIS 17 CO 0.00 0.07 -0.22 0.87 -3.07 0.00 0.00 177.93 175.58 3mnk h LYS 18 N 0.00 0.76 0.00 5.12 1.57 -1.79 -3.03 116.57 119.21 3mnk h LYS 18 Ca -0.00 -0.30 -0.09 0.00 -1.87 0.00 0.00 60.65 58.39 3mnk h LYS 18 Cb 0.20 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 3mnk h LYS 18 CO 0.01 0.91 -1.26 -0.25 -0.57 0.00 0.00 179.45 178.28 3mnk n ASP 19 N -4.12 0.82 -3.51 0.86 8.00 -1.00 -4.73 116.55 112.87 3mnk n ASP 19 Ca 0.00 0.34 -0.27 0.00 0.71 0.00 0.00 54.79 55.57 3mnk n ASP 19 Cb 0.43 0.35 -0.11 0.00 -0.02 0.00 0.00 41.12 41.77 3mnk n ASP 19 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3mnk s PHE 20 N -3.13 1.62 0.60 1.24 0.08 -0.12 -4.99 117.98 113.28 3mnk s PHE 20 Ca -0.02 -2.53 0.42 0.00 0.12 0.00 0.00 56.93 54.93 3mnk s PHE 20 Cb 0.09 -1.31 2.27 0.00 -0.57 0.00 0.00 43.02 43.50 3mnk s PHE 20 CO 0.81 -0.77 2.32 -1.35 -0.10 0.00 0.00 175.22 176.13 3mnk h PRO 21 N 5.64 0.00 0.00 0.24 0.11 -1.78 0.76 132.00 136.97 3mnk h PRO 21 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 3mnk h PRO 21 Cb 0.88 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.99 3mnk h PRO 21 CO 0.44 0.00 0.00 1.51 -0.21 0.00 0.00 178.00 179.75 3mnk n ILE 22 N -3.15 1.25 0.14 4.15 3.06 -1.26 -2.30 119.36 121.24 3mnk n ILE 22 Ca -0.03 0.54 0.19 0.00 -2.50 0.00 0.00 62.75 60.96 3mnk n ILE 22 Cb 0.10 -1.51 0.77 0.00 0.54 0.00 0.00 39.64 39.54 3mnk n ILE 22 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3mnk h ALA 23 N 2.09 1.97 -0.54 1.51 0.00 -1.16 0.22 119.26 123.35 3mnk h ALA 23 Ca 0.00 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.64 3mnk h ALA 23 Cb 0.09 0.02 -0.15 0.00 0.00 0.00 0.00 17.79 17.75 3mnk h ALA 23 CO 0.00 -0.56 0.14 1.63 0.00 0.00 0.00 179.25 180.46 3mnk n LYS 24 N -3.63 2.14 -0.90 0.00 5.02 -0.97 -4.97 118.16 114.85 3mnk n LYS 24 Ca 0.05 -3.11 -0.18 0.00 -2.02 0.00 0.00 58.31 53.05 3mnk n LYS 24 Cb 0.55 -1.94 0.14 0.00 -0.02 0.00 0.00 35.03 33.76 3mnk n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3mnk n GLY 25 N -1.03 -1.99 0.02 0.72 0.00 0.77 -4.99 105.19 98.70 3mnk n GLY 25 Ca 0.40 -1.59 0.13 0.00 0.00 0.00 0.00 46.02 44.96 3mnk n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3mnk n GLU 26 N -3.13 0.11 -2.78 1.61 -0.58 -1.26 -4.26 120.64 110.35 3mnk n GLU 26 Ca 0.10 -0.04 -0.11 0.00 -0.42 0.00 0.00 57.16 56.69 3mnk n GLU 26 Cb 0.36 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 29.76 3mnk n GLU 26 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 3mnk n ARG 27 N -1.41 1.11 -2.94 3.49 1.85 -1.26 -4.65 116.66 112.86 3mnk n ARG 27 Ca 0.07 -3.04 -0.31 0.00 -1.00 0.00 0.00 57.85 53.57 3mnk n ARG 27 Cb 0.33 -1.18 -0.04 0.00 -1.05 0.00 0.00 32.46 30.52 3mnk n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 3mnk s GLN 28 N -2.41 3.86 0.24 2.89 -1.52 -1.26 -2.84 119.66 118.61 3mnk s GLN 28 Ca 0.29 0.55 0.09 0.00 -1.95 0.00 0.00 55.36 54.34 3mnk s GLN 28 Cb 0.42 -2.40 -0.05 0.00 -0.22 0.00 0.00 33.01 30.77 3mnk s GLN 28 CO -0.01 0.02 -0.16 -1.12 -0.25 0.00 0.00 175.29 173.78 3mnk s SER 29 N -2.86 2.97 0.98 5.90 0.01 -1.26 -4.67 113.70 114.77 3mnk s SER 29 Ca 0.52 -1.04 -0.16 0.00 1.31 0.00 0.00 55.95 56.58 3mnk s SER 29 Cb -0.10 -0.20 0.21 0.00 0.21 0.00 0.00 66.02 66.14 3mnk s SER 29 CO 0.27 -0.11 1.32 -2.16 0.41 0.00 0.00 173.24 172.96 3mnk s PRO 30 N -3.60 0.49 0.18 12.44 0.04 -1.26 -4.65 135.00 138.64 3mnk s PRO 30 Ca 0.26 -0.42 0.02 0.00 0.04 0.00 0.00 61.00 60.89 3mnk s PRO 30 Cb -0.02 -1.83 -0.05 0.00 0.04 0.00 0.00 34.50 32.65 3mnk s PRO 30 CO 0.10 -2.51 0.01 0.14 0.04 0.00 0.00 177.00 174.78 3mnk s VAL 31 N -3.87 0.64 0.00 -0.36 -7.23 -1.26 -0.92 120.40 107.41 3mnk s VAL 31 Ca 0.74 -1.98 -0.26 0.00 -1.81 0.00 0.00 61.98 58.67 3mnk s VAL 31 Cb -0.04 -2.18 -0.04 0.00 0.56 0.00 0.00 36.38 34.68 3mnk s VAL 31 CO 0.53 -0.42 0.82 -0.62 -0.31 0.00 0.00 175.10 175.10 3mnk s ASP 32 N -3.18 7.21 -0.44 4.85 2.15 -1.26 -3.07 116.67 122.92 3mnk s ASP 32 Ca 0.26 1.45 -0.18 0.00 0.43 0.00 0.00 52.55 54.50 3mnk s ASP 32 Cb 0.06 -2.49 0.03 0.00 -0.30 0.00 0.00 42.92 40.23 3mnk s ASP 32 CO 0.05 -0.10 0.50 -0.63 -0.17 0.00 0.00 175.17 174.81 3mnk s ILE 33 N 0.48 5.02 -0.46 4.11 1.01 0.08 -4.95 121.20 126.49 3mnk s ILE 33 Ca 0.42 -0.32 -0.22 0.00 0.00 0.00 0.00 60.65 60.53 3mnk s ILE 33 Cb -0.20 -4.11 0.03 0.00 0.01 0.00 0.00 42.46 38.19 3mnk s ILE 33 CO 0.23 -0.51 0.76 -0.62 0.00 0.00 0.00 174.94 174.80 3mnk s ASP 34 N 1.99 6.38 0.54 3.58 -1.08 -1.26 -0.07 116.67 126.75 3mnk s ASP 34 Ca 0.14 -0.23 0.33 0.00 -0.52 0.00 0.00 52.55 52.27 3mnk s ASP 34 Cb -0.17 -2.37 1.36 0.00 -1.46 0.00 0.00 42.92 40.27 3mnk s ASP 34 CO 0.14 -0.92 1.98 0.71 0.52 0.00 0.00 175.17 177.60 3mnk h THR 35 N 5.96 0.06 -0.00 1.71 1.35 -1.95 -2.24 112.91 117.79 3mnk h THR 35 Ca -0.25 -0.56 0.00 0.00 -0.55 0.00 0.00 66.41 65.05 3mnk h THR 35 Cb 1.09 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 3mnk h THR 35 CO 0.96 0.02 -0.56 1.41 -0.25 0.00 0.00 175.52 177.11 3mnk n HIS 36 N -3.13 0.00 0.51 4.73 8.25 -1.26 -3.87 115.22 120.46 3mnk n HIS 36 Ca 0.00 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.55 3mnk n HIS 36 Cb 0.31 -0.12 -0.12 0.00 1.12 0.00 0.00 29.99 31.18 3mnk n HIS 36 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 3mnk n THR 37 N -1.08 0.00 -2.26 1.59 -1.04 -0.92 -4.97 114.28 105.59 3mnk n THR 37 Ca 0.07 -0.21 -0.41 0.00 -2.04 0.00 0.00 64.05 61.46 3mnk n THR 37 Cb 0.36 0.64 -0.03 0.00 -1.82 0.00 0.00 70.33 69.48 3mnk n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3mnk s ALA 38 N -2.91 3.50 -0.24 2.41 0.00 -0.89 -4.84 121.76 118.80 3mnk s ALA 38 Ca 0.02 1.06 -0.16 0.00 0.00 0.00 0.00 51.96 52.87 3mnk s ALA 38 Cb 0.13 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.74 3mnk s ALA 38 CO 0.74 -0.50 0.43 0.21 0.00 0.00 0.00 175.76 176.63 3mnk s LYS 39 N 0.05 4.10 0.13 0.00 2.47 -0.63 -4.83 119.74 121.03 3mnk s LYS 39 Ca 0.57 0.19 -0.31 0.00 -1.56 0.00 0.00 55.97 54.86 3mnk s LYS 39 Cb -0.35 -3.60 -0.10 0.00 -1.46 0.00 0.00 37.83 32.32 3mnk s LYS 39 CO 0.37 -0.20 1.63 -0.47 0.16 0.00 0.00 175.35 176.84 3mnk s TYR 40 N 1.82 2.77 -0.32 4.03 5.04 -1.26 -0.41 117.35 129.02 3mnk s TYR 40 Ca 0.18 0.45 0.03 0.00 -2.44 0.00 0.00 57.07 55.30 3mnk s TYR 40 Cb -0.15 -3.98 0.09 0.00 0.35 0.00 0.00 41.96 38.27 3mnk s TYR 40 CO 0.09 -3.76 0.02 0.34 -1.34 0.00 0.00 175.55 170.90 3mnk s ASP 41 N 1.69 4.59 0.00 4.32 -1.08 -0.54 -4.87 116.67 120.77 3mnk s ASP 41 Ca 0.73 -1.92 0.14 0.00 -0.52 0.00 0.00 52.55 50.97 3mnk s ASP 41 Cb -0.43 -1.52 0.59 0.00 -1.46 0.00 0.00 42.92 40.10 3mnk s ASP 41 CO 0.32 -0.34 1.44 -0.81 0.52 0.00 0.00 175.17 176.30 3mnk n PRO 42 N 4.36 0.00 0.00 4.34 -0.04 -1.26 -1.60 135.00 140.80 3mnk n PRO 42 Ca -0.01 0.26 0.15 0.00 -0.04 0.00 0.00 63.50 63.86 3mnk n PRO 42 Cb 0.42 -1.50 0.70 0.00 -0.04 0.00 0.00 33.50 33.08 3mnk n PRO 42 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3mnk n SER 43 N -1.50 0.52 -4.71 3.54 3.41 -1.26 -4.83 113.62 108.78 3mnk n SER 43 Ca 0.03 -0.86 -0.42 0.00 -0.26 0.00 0.00 58.87 57.36 3mnk n SER 43 Cb 0.16 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.03 3mnk n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3mnk s LEU 44 N -2.25 4.35 0.69 1.04 1.43 -0.63 -5.04 118.68 118.27 3mnk s LEU 44 Ca 0.36 1.60 -0.11 0.00 -1.03 0.00 0.00 54.13 54.95 3mnk s LEU 44 Cb 0.21 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.90 3mnk s LEU 44 CO 0.42 -0.27 1.06 -0.54 0.23 0.00 0.00 176.35 177.24 3mnk s LYS 45 N 1.12 3.02 0.63 1.70 1.02 -1.25 -4.98 119.74 120.99 3mnk s LYS 45 Ca 0.50 0.82 -0.19 0.00 0.02 0.00 0.00 55.97 57.13 3mnk s LYS 45 Cb -0.20 -2.01 -0.02 0.00 -0.52 0.00 0.00 37.83 35.07 3mnk s LYS 45 CO 0.26 -1.01 1.25 -2.30 -0.92 0.00 0.00 175.35 172.63 3mnk n PRO 46 N -3.05 1.17 -2.03 -1.68 -0.02 -1.26 -2.97 135.00 125.16 3mnk n PRO 46 Ca 0.07 0.45 -0.35 0.00 -2.02 0.00 0.00 63.50 61.65 3mnk n PRO 46 Cb 0.54 -2.48 0.03 0.00 -0.02 0.00 0.00 33.50 31.57 3mnk n PRO 46 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3mnk s LEU 47 N -3.83 3.65 -0.26 2.45 1.43 -1.26 -1.40 118.68 119.47 3mnk s LEU 47 Ca 0.80 2.31 0.02 0.00 -1.03 0.00 0.00 54.13 56.23 3mnk s LEU 47 Cb -0.39 -4.59 0.06 0.00 0.03 0.00 0.00 46.19 41.30 3mnk s LEU 47 CO 0.43 -1.53 -0.09 -0.55 0.23 0.00 0.00 176.35 174.84 3mnk s SER 48 N -1.73 4.29 -0.29 2.29 0.15 -0.35 -4.83 113.70 113.23 3mnk s SER 48 Ca 0.75 -1.36 -0.06 0.00 0.70 0.00 0.00 55.95 55.98 3mnk s SER 48 Cb -0.28 -1.44 0.01 0.00 -1.71 0.00 0.00 66.02 62.60 3mnk s SER 48 CO 0.32 -0.21 0.07 -0.69 1.20 0.00 0.00 173.24 173.93 3mnk s VAL 49 N 1.18 3.89 -0.48 4.45 1.01 -1.26 -1.33 120.40 127.85 3mnk s VAL 49 Ca -0.07 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 3mnk s VAL 49 Cb -0.20 -3.00 0.13 0.00 0.00 0.00 0.00 36.38 33.31 3mnk s VAL 49 CO -0.06 0.09 0.27 -0.44 0.00 0.00 0.00 175.10 174.96 3mnk s SER 50 N 1.49 5.07 0.00 3.32 0.01 -0.21 -4.90 113.70 118.48 3mnk s SER 50 Ca 0.02 -2.44 0.02 0.00 1.31 0.00 0.00 55.95 54.87 3mnk s SER 50 Cb -0.17 -1.79 0.04 0.00 0.21 0.00 0.00 66.02 64.31 3mnk s SER 50 CO 0.02 -0.43 0.94 -1.22 0.41 0.00 0.00 173.24 172.96 3mnk n TYR 51 N 4.01 0.06 0.27 2.43 4.01 -1.26 -1.25 117.16 125.43 3mnk n TYR 51 Ca 0.03 -0.39 0.11 0.00 -0.16 0.00 0.00 57.90 57.49 3mnk n TYR 51 Cb 0.39 -0.04 0.76 0.00 -0.31 0.00 0.00 39.34 40.14 3mnk n TYR 51 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 3mnk h ASP 52 N 0.34 0.00 -0.48 7.72 2.03 -1.91 -1.81 116.42 122.31 3mnk h ASP 52 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3mnk h ASP 52 Cb 0.44 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.94 3mnk h ASP 52 CO 0.00 0.02 0.00 0.00 -1.03 0.00 0.00 179.24 178.23 3mnk n GLN 53 N -4.17 3.43 -1.71 4.15 1.13 -1.22 -5.02 117.38 113.97 3mnk n GLN 53 Ca -0.03 -2.72 -0.43 0.00 -1.94 0.00 0.00 57.00 51.88 3mnk n GLN 53 Cb 0.11 -1.77 -0.01 0.00 0.11 0.00 0.00 30.24 28.67 3mnk n GLN 53 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3mnk n ALA 54 N 0.54 1.67 -3.95 -1.58 0.00 -0.68 -4.65 120.51 111.85 3mnk n ALA 54 Ca 0.22 0.38 -0.32 0.00 0.00 0.00 0.00 53.44 53.71 3mnk n ALA 54 Cb 0.81 -2.33 -0.14 0.00 0.00 0.00 0.00 19.45 17.79 3mnk n ALA 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3mnk s THR 55 N -0.47 2.55 0.39 0.00 2.01 -1.26 -4.93 115.64 113.92 3mnk s THR 55 Ca 0.62 -2.23 -0.23 0.00 0.31 0.00 0.00 61.69 60.15 3mnk s THR 55 Cb -0.57 -2.83 -0.10 0.00 0.01 0.00 0.00 72.50 69.02 3mnk s THR 55 CO 0.55 -0.60 0.97 -0.94 -0.69 0.00 0.00 174.62 173.91 3mnk s SER 56 N 1.15 7.03 -0.08 3.53 1.04 -1.26 -0.87 113.70 124.25 3mnk s SER 56 Ca 0.09 1.82 -0.03 0.00 0.48 0.00 0.00 55.95 58.31 3mnk s SER 56 Cb -0.20 -2.56 -0.04 0.00 0.10 0.00 0.00 66.02 63.32 3mnk s SER 56 CO -0.07 -0.29 -0.09 0.18 0.98 0.00 0.00 173.24 173.95 3mnk n LEU 57 N -0.10 1.38 -3.58 2.42 4.77 0.62 -4.21 117.00 118.30 3mnk n LEU 57 Ca 0.05 0.05 -0.17 0.00 -0.03 0.00 0.00 56.01 55.91 3mnk n LEU 57 Cb 0.52 -0.25 -0.07 0.00 -2.33 0.00 0.00 43.42 41.29 3mnk n LEU 57 CO 0.41 0.32 0.33 -0.60 -1.33 0.00 0.00 177.39 176.52 3mnk s ARG 58 N -2.15 0.96 -0.01 3.23 3.52 -1.20 -0.98 118.95 122.32 3mnk s ARG 58 Ca -0.11 0.11 0.07 0.00 -0.13 0.00 0.00 55.73 55.67 3mnk s ARG 58 Cb 0.04 0.45 -0.02 0.00 -1.56 0.00 0.00 34.95 33.86 3mnk s ARG 58 CO 0.15 -0.30 -0.23 -1.50 -0.81 0.00 0.00 175.30 172.61 3mnk s ILE 59 N -1.32 1.83 -0.04 4.11 2.07 -0.08 -0.56 121.20 127.21 3mnk s ILE 59 Ca -0.11 -1.04 -0.03 0.00 -1.41 0.00 0.00 60.65 58.05 3mnk s ILE 59 Cb -0.01 -1.53 0.01 0.00 0.13 0.00 0.00 42.46 41.06 3mnk s ILE 59 CO 0.08 0.47 0.10 -0.22 -1.91 0.00 0.00 174.94 173.46 3mnk s LEU 60 N -0.66 1.54 -0.39 8.50 2.96 -0.23 -0.68 118.68 129.71 3mnk s LEU 60 Ca 0.09 0.20 -0.21 0.00 -0.22 0.00 0.00 54.13 53.99 3mnk s LEU 60 Cb -0.09 0.33 0.01 0.00 0.50 0.00 0.00 46.19 46.94 3mnk s LEU 60 CO -0.00 -0.05 0.67 0.21 -1.32 0.00 0.00 176.35 175.86 3mnk s ASN 61 N 0.17 6.40 -0.09 3.68 3.84 -0.28 -0.68 114.94 127.98 3mnk s ASN 61 Ca -0.01 -0.01 0.18 0.00 0.21 0.00 0.00 52.86 53.23 3mnk s ASN 61 Cb -0.02 -2.34 0.63 0.00 -0.55 0.00 0.00 41.25 38.98 3mnk s ASN 61 CO -0.00 -0.70 1.55 -0.46 -2.79 0.00 0.00 177.10 174.69 3mnk n ASN 62 N 6.22 4.31 0.00 -4.21 0.23 -0.94 -0.49 115.26 120.38 3mnk n ASN 62 Ca -0.01 -2.37 0.00 0.00 -0.53 0.00 0.00 54.58 51.68 3mnk n ASN 62 Cb 0.48 -0.51 0.00 0.00 -2.08 0.00 0.00 39.78 37.67 3mnk n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3mnk n GLY 63 N 0.97 1.64 0.00 4.83 0.00 -1.26 -4.75 105.19 106.61 3mnk n GLY 63 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 3mnk n GLY 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3mnk n HIS 64 N -2.00 0.00 -3.40 1.61 1.44 -1.26 -4.71 115.22 106.90 3mnk n HIS 64 Ca 0.00 0.00 -0.03 0.00 -2.01 0.00 0.00 57.72 55.68 3mnk n HIS 64 Cb 0.00 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.12 3mnk n HIS 64 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3mnk n ALA 65 N -0.61 -0.78 -2.79 1.59 0.00 -1.26 -4.89 120.51 111.76 3mnk n ALA 65 Ca 0.00 -0.44 -0.32 0.00 0.00 0.00 0.00 53.44 52.68 3mnk n ALA 65 Cb 0.00 0.32 -0.15 0.00 0.00 0.00 0.00 19.45 19.62 3mnk n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3mnk s PHE 66 N -5.79 2.63 -0.09 0.00 -0.12 -1.26 -2.21 117.98 111.13 3mnk s PHE 66 Ca 0.07 -0.57 -0.03 0.00 -0.05 0.00 0.00 56.93 56.35 3mnk s PHE 66 Cb -0.02 -1.68 -0.03 0.00 -0.63 0.00 0.00 43.02 40.66 3mnk s PHE 66 CO 0.04 -0.12 0.02 -0.80 -0.05 0.00 0.00 175.22 174.31 3mnk s ASN 67 N -0.14 5.38 -0.23 1.98 -0.87 0.15 -4.31 114.94 116.90 3mnk s ASN 67 Ca -0.03 0.18 -0.12 0.00 -1.57 0.00 0.00 52.86 51.32 3mnk s ASN 67 Cb -0.14 -1.57 -0.05 0.00 -0.02 0.00 0.00 41.25 39.48 3mnk s ASN 67 CO 0.04 0.37 0.22 -0.69 -2.57 0.00 0.00 177.10 174.47 3mnk s VAL 68 N -0.84 5.32 -0.02 1.60 1.01 -0.01 -1.07 120.40 126.40 3mnk s VAL 68 Ca 0.13 0.32 0.01 0.00 0.00 0.00 0.00 61.98 62.44 3mnk s VAL 68 Cb -0.11 -3.56 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 3mnk s VAL 68 CO 0.02 0.33 -0.02 -1.61 0.00 0.00 0.00 175.10 173.83 3mnk s GLU 69 N 1.06 2.77 0.22 2.72 2.02 0.28 -1.32 118.70 126.45 3mnk s GLU 69 Ca 0.11 -0.59 0.11 0.00 0.02 0.00 0.00 54.97 54.61 3mnk s GLU 69 Cb -0.14 -2.65 -0.05 0.00 0.10 0.00 0.00 34.13 31.39 3mnk s GLU 69 CO 0.05 0.64 -0.16 -0.06 0.02 0.00 0.00 175.26 175.74 3mnk s PHE 70 N -1.02 2.43 -0.26 1.61 0.40 -0.29 -0.28 117.98 120.58 3mnk s PHE 70 Ca 0.18 -0.30 -0.29 0.00 -0.60 0.00 0.00 56.93 55.92 3mnk s PHE 70 Cb -0.11 -1.14 -0.00 0.00 0.51 0.00 0.00 43.02 42.27 3mnk s PHE 70 CO 0.08 0.58 1.26 0.34 0.70 0.00 0.00 175.22 178.18 3mnk s ASP 71 N -3.07 6.79 -0.26 1.36 2.15 -0.05 -4.83 116.67 118.76 3mnk s ASP 71 Ca 0.26 1.33 0.09 0.00 0.43 0.00 0.00 52.55 54.65 3mnk s ASP 71 Cb -0.07 -2.54 0.44 0.00 -0.30 0.00 0.00 42.92 40.45 3mnk s ASP 71 CO 0.14 -0.96 1.22 -0.90 -0.17 0.00 0.00 175.17 174.50 3mnk n ASP 72 N 7.23 3.35 -0.36 -0.34 5.75 -1.26 -4.64 116.55 126.28 3mnk n ASP 72 Ca 0.14 -3.83 0.13 0.00 -0.01 0.00 0.00 54.79 51.22 3mnk n ASP 72 Cb 0.46 -0.44 0.37 0.00 -1.03 0.00 0.00 41.12 40.48 3mnk n ASP 72 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3mnk n SER 73 N -0.92 1.32 -4.00 -1.12 3.41 -1.26 -4.91 113.62 106.13 3mnk n SER 73 Ca 0.32 -1.15 -0.09 0.00 -0.26 0.00 0.00 58.87 57.69 3mnk n SER 73 Cb 0.84 0.12 -0.06 0.00 -0.26 0.00 0.00 64.21 64.85 3mnk n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3mnk s GLN 74 N -2.35 1.51 -0.99 4.33 -0.21 -1.26 -5.08 119.66 115.62 3mnk s GLN 74 Ca 0.28 -1.26 -0.12 0.00 0.02 0.00 0.00 55.36 54.28 3mnk s GLN 74 Cb 0.20 0.46 -0.08 0.00 1.00 0.00 0.00 33.01 34.58 3mnk s GLN 74 CO 0.47 -0.62 2.15 -0.25 -2.12 0.00 0.00 175.29 174.91 3mnk n ASP 75 N -0.37 4.49 -0.06 5.90 8.00 -1.26 -4.62 116.55 128.63 3mnk n ASP 75 Ca -0.02 -2.50 -0.17 0.00 0.71 0.00 0.00 54.79 52.82 3mnk n ASP 75 Cb 0.62 -1.19 -0.14 0.00 -0.02 0.00 0.00 41.12 40.39 3mnk n ASP 75 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3mnk n LYS 76 N 5.15 0.69 -3.78 -1.24 5.02 -1.26 -4.73 118.16 118.03 3mnk n LYS 76 Ca 0.50 0.19 -0.29 0.00 -2.02 0.00 0.00 58.31 56.70 3mnk n LYS 76 Cb 0.25 -1.63 -0.16 0.00 -0.02 0.00 0.00 35.03 33.46 3mnk n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3mnk s ALA 77 N -2.54 1.30 0.11 7.82 0.00 -1.26 -3.33 121.76 123.86 3mnk s ALA 77 Ca -0.22 -1.02 0.04 0.00 0.00 0.00 0.00 51.96 50.76 3mnk s ALA 77 Cb 0.08 -1.32 -0.04 0.00 0.00 0.00 0.00 23.12 21.84 3mnk s ALA 77 CO 0.73 -1.28 -0.10 0.14 0.00 0.00 0.00 175.76 175.26 3mnk s VAL 78 N 1.72 0.96 -0.09 0.00 -7.23 -0.38 -1.50 120.40 113.88 3mnk s VAL 78 Ca 0.00 -1.74 0.04 0.00 -1.81 0.00 0.00 61.98 58.47 3mnk s VAL 78 Cb -0.17 -1.48 -0.01 0.00 0.56 0.00 0.00 36.38 35.28 3mnk s VAL 78 CO -0.11 -0.62 -0.23 -0.22 -0.31 0.00 0.00 175.10 173.61 3mnk s LEU 79 N -2.63 2.18 0.24 1.32 2.96 0.24 -1.05 118.68 121.95 3mnk s LEU 79 Ca 0.08 -0.51 0.01 0.00 -0.22 0.00 0.00 54.13 53.49 3mnk s LEU 79 Cb -0.01 -1.43 -0.04 0.00 0.50 0.00 0.00 46.19 45.21 3mnk s LEU 79 CO -0.00 0.19 0.14 -0.54 -1.32 0.00 0.00 176.35 174.82 3mnk s LYS 80 N 0.17 1.34 2.19 1.98 1.02 -0.44 -1.55 119.74 124.45 3mnk s LYS 80 Ca -0.13 -1.73 0.00 0.00 0.02 0.00 0.00 55.97 54.14 3mnk s LYS 80 Cb -0.16 0.12 0.00 0.00 -0.52 0.00 0.00 37.83 37.26 3mnk s LYS 80 CO 0.07 -0.40 0.00 0.41 -0.92 0.00 0.00 175.35 174.51 3mnk n GLY 81 N -0.38 -0.94 7.00 -3.33 0.00 -1.26 -1.21 105.19 105.07 3mnk n GLY 81 Ca 0.02 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.74 3mnk n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mnk n GLY 82 N 0.00 2.80 0.40 -0.02 0.00 -0.49 -1.07 105.19 106.80 3mnk n GLY 82 Ca 0.00 -0.21 0.07 0.00 0.00 0.00 0.00 46.02 45.87 3mnk n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3mnk n PRO 83 N 14.00 1.51 -3.32 1.61 -0.04 -1.26 -3.74 135.00 143.76 3mnk n PRO 83 Ca 0.00 -0.79 -0.33 0.00 -0.04 0.00 0.00 63.50 62.34 3mnk n PRO 83 Cb 0.00 -1.26 -0.06 0.00 -0.04 0.00 0.00 33.50 32.14 3mnk n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3mnk s LEU 84 N -1.26 4.20 -0.19 1.53 1.43 -0.24 -5.07 118.68 119.08 3mnk s LEU 84 Ca 0.23 1.07 -0.05 0.00 -1.03 0.00 0.00 54.13 54.34 3mnk s LEU 84 Cb 0.12 -3.66 -0.02 0.00 0.03 0.00 0.00 46.19 42.65 3mnk s LEU 84 CO 0.17 -0.05 -0.00 -1.81 0.23 0.00 0.00 176.35 174.88 3mnk s ASP 85 N -2.14 4.84 0.00 2.29 1.01 -1.26 -4.34 116.67 117.07 3mnk s ASP 85 Ca 0.46 -0.19 0.00 0.00 0.71 0.00 0.00 52.55 53.54 3mnk s ASP 85 Cb -0.12 -1.82 0.00 0.00 1.01 0.00 0.00 42.92 41.99 3mnk s ASP 85 CO 0.20 0.08 0.00 0.61 0.21 0.00 0.00 175.17 176.27 3mnk n GLY 86 N 4.15 -3.41 3.42 0.21 0.00 -1.26 -4.94 105.19 103.35 3mnk n GLY 86 Ca -0.17 -1.93 -0.33 0.00 0.00 0.00 0.00 46.02 43.59 3mnk n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mnk s THR 87 N -0.82 3.38 -0.12 2.61 2.01 -1.26 -4.58 115.64 116.86 3mnk s THR 87 Ca 0.00 -0.54 0.01 0.00 0.31 0.00 0.00 61.69 61.46 3mnk s THR 87 Cb 0.00 -2.45 -0.01 0.00 0.01 0.00 0.00 72.50 70.05 3mnk s THR 87 CO 0.00 0.51 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.99 3mnk s TYR 88 N 0.38 2.78 -0.13 4.92 1.51 -0.60 -1.52 117.35 124.68 3mnk s TYR 88 Ca -0.08 -0.65 -0.10 0.00 -1.01 0.00 0.00 57.07 55.23 3mnk s TYR 88 Cb -0.15 -1.81 -0.05 0.00 -0.11 0.00 0.00 41.96 39.84 3mnk s TYR 88 CO 0.04 -0.20 0.20 1.03 -1.11 0.00 0.00 175.55 175.51 3mnk s ARG 89 N 0.26 3.83 0.06 -0.62 0.52 0.15 -0.59 118.95 122.57 3mnk s ARG 89 Ca -0.10 -0.04 -0.31 0.00 -0.52 0.00 0.00 55.73 54.76 3mnk s ARG 89 Cb -0.16 -3.29 -0.07 0.00 0.52 0.00 0.00 34.95 31.96 3mnk s ARG 89 CO 0.06 0.56 1.38 -1.17 0.02 0.00 0.00 175.30 176.15 3mnk s LEU 90 N -0.45 4.35 -0.13 2.53 2.96 -0.56 -0.89 118.68 126.49 3mnk s LEU 90 Ca 0.15 2.21 -0.01 0.00 -0.22 0.00 0.00 54.13 56.26 3mnk s LEU 90 Cb -0.13 -3.57 -0.08 0.00 0.50 0.00 0.00 46.19 42.91 3mnk s LEU 90 CO 0.04 -0.66 -0.13 0.00 -1.32 0.00 0.00 176.35 174.27 3mnk n ILE 91 N 4.24 0.75 -3.44 6.68 3.06 -0.53 -4.54 119.36 125.58 3mnk n ILE 91 Ca 0.12 -0.26 -0.12 0.00 -2.50 0.00 0.00 62.75 59.99 3mnk n ILE 91 Cb 0.43 -1.17 -0.02 0.00 0.54 0.00 0.00 39.64 39.42 3mnk n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3mnk s GLN 92 N -2.26 1.26 0.16 9.51 1.03 -1.22 -1.13 119.66 127.01 3mnk s GLN 92 Ca -0.18 -0.46 0.07 0.00 0.04 0.00 0.00 55.36 54.83 3mnk s GLN 92 Cb 0.05 0.58 -0.04 0.00 0.03 0.00 0.00 33.01 33.63 3mnk s GLN 92 CO 0.28 -0.54 -0.14 -0.59 -2.54 0.00 0.00 175.29 171.76 3mnk s PHE 93 N -3.65 1.54 0.29 9.60 -0.12 -0.44 -0.84 117.98 124.37 3mnk s PHE 93 Ca 0.01 -0.59 -0.14 0.00 -0.05 0.00 0.00 56.93 56.16 3mnk s PHE 93 Cb -0.01 -0.76 0.01 0.00 -0.63 0.00 0.00 43.02 41.63 3mnk s PHE 93 CO -0.12 0.24 0.59 -3.38 -0.05 0.00 0.00 175.22 172.49 3mnk s HIS 94 N -2.66 0.28 0.30 3.49 -3.43 -0.66 -0.83 115.29 111.78 3mnk s HIS 94 Ca 0.16 -0.69 0.07 0.00 -0.80 0.00 0.00 55.06 53.80 3mnk s HIS 94 Cb -0.02 0.39 -0.06 0.00 -1.43 0.00 0.00 32.58 31.46 3mnk s HIS 94 CO 0.04 -1.17 -0.06 -0.06 -2.00 0.00 0.00 174.74 171.50 3mnk s PHE 95 N -3.60 2.09 -0.02 0.38 0.40 -1.26 -0.75 117.98 115.22 3mnk s PHE 95 Ca 0.19 -0.66 0.04 0.00 -0.60 0.00 0.00 56.93 55.91 3mnk s PHE 95 Cb -0.03 -1.22 -0.01 0.00 0.51 0.00 0.00 43.02 42.27 3mnk s PHE 95 CO 0.10 0.35 -0.16 -1.01 0.70 0.00 0.00 175.22 175.21 3mnk s HIS 96 N -2.92 1.46 0.27 0.36 3.76 -0.45 -4.75 115.29 113.03 3mnk s HIS 96 Ca 0.31 -0.33 -0.07 0.00 -0.15 0.00 0.00 55.06 54.82 3mnk s HIS 96 Cb 0.04 -0.96 -0.01 0.00 1.11 0.00 0.00 32.58 32.76 3mnk s HIS 96 CO 0.14 -0.07 0.42 1.67 -0.85 0.00 0.00 174.74 176.05 3mnk s TRP 97 N -0.20 0.74 0.48 1.40 -2.14 -1.23 -0.89 118.94 117.10 3mnk s TRP 97 Ca 0.03 -1.04 0.06 0.00 2.66 0.00 0.00 56.10 57.81 3mnk s TRP 97 Cb -0.08 -0.02 0.00 0.00 -3.10 0.00 0.00 33.47 30.27 3mnk s TRP 97 CO 0.00 -0.99 0.34 0.20 -2.66 0.00 0.00 176.95 173.84 3mnk s GLY 98 N -3.12 2.31 0.30 3.67 0.00 -1.17 -0.98 107.32 108.32 3mnk s GLY 98 Ca 0.28 -1.61 0.24 0.00 0.00 0.00 0.00 44.72 43.64 3mnk s GLY 98 CO 0.13 -1.87 1.59 1.48 0.00 0.00 0.00 173.10 174.43 3mnk h SER 99 N 0.98 0.00 -4.64 1.64 4.64 -1.89 -3.39 113.55 110.89 3mnk h SER 99 Ca -0.39 -0.02 -0.24 0.00 -0.47 0.00 0.00 61.79 60.66 3mnk h SER 99 Cb 1.28 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.21 3mnk h SER 99 CO 0.60 0.01 -0.71 -0.76 -0.87 0.00 0.00 176.83 175.11 3mnk s LEU 100 N -5.27 2.44 0.47 5.97 1.43 -1.26 -5.06 118.68 117.40 3mnk s LEU 100 Ca 0.08 -0.88 0.32 0.00 -1.03 0.00 0.00 54.13 52.61 3mnk s LEU 100 Cb 0.09 -0.10 1.46 0.00 0.03 0.00 0.00 46.19 47.67 3mnk s LEU 100 CO 0.66 -0.39 1.95 0.44 0.23 0.00 0.00 176.35 179.24 3mnk h ASP 101 N 3.38 0.00 -0.25 2.29 3.32 -1.93 -2.72 116.42 120.52 3mnk h ASP 101 Ca -0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.70 3mnk h ASP 101 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3mnk h ASP 101 CO 0.58 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.71 3mnk n GLY 102 N -0.37 0.19 3.46 2.75 0.00 -1.26 -3.57 105.19 106.40 3mnk n GLY 102 Ca 0.00 -0.29 -0.09 0.00 0.00 0.00 0.00 46.02 45.64 3mnk n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3mnk s GLN 103 N -1.67 1.32 0.00 1.61 -2.07 -1.03 -4.69 119.66 113.14 3mnk s GLN 103 Ca 0.19 -1.04 0.00 0.00 -1.82 0.00 0.00 55.36 52.69 3mnk s GLN 103 Cb 0.10 0.46 0.00 0.00 -1.09 0.00 0.00 33.01 32.48 3mnk s GLN 103 CO 0.13 -0.53 0.00 0.41 -1.32 0.00 0.00 175.29 173.98 3mnk n GLY 104 N -0.30 1.62 3.84 2.60 0.00 -1.08 -3.30 105.19 108.56 3mnk n GLY 104 Ca -0.08 -0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 3mnk n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3mnk s SER 105 N 0.00 5.93 -0.21 1.61 1.04 -0.36 -3.53 113.70 118.18 3mnk s SER 105 Ca 0.00 1.54 -0.17 0.00 0.48 0.00 0.00 55.95 57.80 3mnk s SER 105 Cb 0.00 -2.49 -0.13 0.00 0.10 0.00 0.00 66.02 63.51 3mnk s SER 105 CO 0.00 -1.07 -0.05 -0.62 0.98 0.00 0.00 173.24 172.47 3mnk n GLU 106 N -2.71 0.54 -2.05 4.02 1.02 -1.26 -4.86 120.64 115.35 3mnk n GLU 106 Ca 0.07 0.47 -0.34 0.00 -0.02 0.00 0.00 57.16 57.33 3mnk n GLU 106 Cb 0.54 -1.65 0.02 0.00 -0.02 0.00 0.00 31.44 30.33 3mnk n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3mnk s HIS 107 N -2.42 2.66 0.15 -0.32 3.76 -1.26 -4.38 115.29 113.47 3mnk s HIS 107 Ca -0.28 1.55 0.05 0.00 -0.15 0.00 0.00 55.06 56.23 3mnk s HIS 107 Cb 0.07 -3.23 -0.04 0.00 1.11 0.00 0.00 32.58 30.48 3mnk s HIS 107 CO 0.47 -1.61 -0.12 0.95 -0.85 0.00 0.00 174.74 173.58 3mnk s THR 108 N -2.02 1.31 -0.19 1.30 -4.23 -1.18 -4.71 115.64 105.92 3mnk s THR 108 Ca 0.70 -1.96 0.01 0.00 -1.18 0.00 0.00 61.69 59.26 3mnk s THR 108 Cb -0.22 -1.76 0.04 0.00 1.34 0.00 0.00 72.50 71.90 3mnk s THR 108 CO 0.33 -0.61 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.01 3mnk s VAL 109 N -2.84 1.56 -1.45 2.29 1.01 -0.84 -0.74 120.40 119.39 3mnk s VAL 109 Ca 0.15 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.17 3mnk s VAL 109 Cb -0.01 -1.63 0.00 0.00 0.00 0.00 0.00 36.38 34.75 3mnk s VAL 109 CO 0.02 0.20 0.24 0.47 0.00 0.00 0.00 175.10 176.03 3mnk n ASP 110 N 4.72 -0.22 0.00 3.32 8.00 0.91 -0.98 116.55 132.29 3mnk n ASP 110 Ca -0.15 -1.18 0.00 0.00 0.71 0.00 0.00 54.79 54.18 3mnk n ASP 110 Cb 0.47 -2.17 0.00 0.00 -0.02 0.00 0.00 41.12 39.40 3mnk n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3mnk n LYS 111 N -4.56 -1.24 -2.67 -1.24 4.76 -1.26 -5.00 118.16 106.95 3mnk n LYS 111 Ca -0.29 0.31 -0.42 0.00 -2.87 0.00 0.00 58.31 55.03 3mnk n LYS 111 Cb 0.68 -4.60 -0.03 0.00 -1.84 0.00 0.00 35.03 29.24 3mnk n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 3mnk s LYS 112 N -1.49 4.45 0.04 1.97 2.20 -0.16 -5.01 119.74 121.73 3mnk s LYS 112 Ca 0.00 1.43 -0.06 0.00 -0.36 0.00 0.00 55.97 56.97 3mnk s LYS 112 Cb 0.00 -3.52 -0.05 0.00 -1.51 0.00 0.00 37.83 32.75 3mnk s LYS 112 CO 0.00 -0.27 0.30 0.15 -0.36 0.00 0.00 175.35 175.17 3mnk s LYS 113 N 1.80 3.61 0.40 4.03 1.02 -1.26 -1.98 119.74 127.35 3mnk s LYS 113 Ca 0.50 -0.06 0.08 0.00 0.02 0.00 0.00 55.97 56.51 3mnk s LYS 113 Cb -0.20 -3.04 -0.02 0.00 -0.52 0.00 0.00 37.83 34.06 3mnk s LYS 113 CO 0.21 0.61 0.40 0.71 -0.92 0.00 0.00 175.35 176.35 3mnk s TYR 114 N -1.37 2.76 0.31 3.18 2.02 -1.26 -4.75 117.35 118.23 3mnk s TYR 114 Ca 0.30 -0.45 0.18 0.00 -0.37 0.00 0.00 57.07 56.74 3mnk s TYR 114 Cb -0.13 -2.15 0.86 0.00 -0.40 0.00 0.00 41.96 40.14 3mnk s TYR 114 CO 0.18 -0.12 1.84 0.00 -1.57 0.00 0.00 175.55 175.88 3mnk h ALA 115 N 0.99 1.21 -2.56 3.71 0.00 -1.43 -0.90 119.26 120.28 3mnk h ALA 115 Ca -0.42 -0.29 0.14 0.00 0.00 0.00 0.00 54.91 54.34 3mnk h ALA 115 Cb 1.27 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.93 3mnk h ALA 115 CO 0.55 0.40 0.40 0.00 0.00 0.00 0.00 179.25 180.61 3mnk s ALA 116 N -3.97 -1.53 -0.07 0.00 0.00 -1.18 -3.06 121.76 111.94 3mnk s ALA 116 Ca -0.02 0.05 -0.03 0.00 0.00 0.00 0.00 51.96 51.96 3mnk s ALA 116 Cb 0.13 0.70 0.04 0.00 0.00 0.00 0.00 23.12 23.99 3mnk s ALA 116 CO 0.68 -1.02 0.16 -2.00 0.00 0.00 0.00 175.76 173.59 3mnk s GLU 117 N -3.48 0.09 -0.09 0.00 2.12 -0.07 -1.36 118.70 115.91 3mnk s GLU 117 Ca 0.11 0.43 -0.15 0.00 0.36 0.00 0.00 54.97 55.72 3mnk s GLU 117 Cb -0.03 -0.19 -0.05 0.00 0.26 0.00 0.00 34.13 34.13 3mnk s GLU 117 CO 0.03 -0.20 0.37 -1.17 -0.54 0.00 0.00 175.26 173.75 3mnk s LEU 118 N 1.42 4.34 -0.20 2.70 2.96 0.59 -1.34 118.68 129.16 3mnk s LEU 118 Ca -0.07 0.74 0.01 0.00 -0.22 0.00 0.00 54.13 54.60 3mnk s LEU 118 Cb -0.12 -2.51 0.03 0.00 0.50 0.00 0.00 46.19 44.09 3mnk s LEU 118 CO -0.06 0.16 -0.17 -1.00 -1.32 0.00 0.00 176.35 173.96 3mnk s HIS 119 N -0.07 2.82 -0.28 5.38 3.76 0.07 -1.13 115.29 125.84 3mnk s HIS 119 Ca 0.21 -1.77 -0.11 0.00 -0.15 0.00 0.00 55.06 53.24 3mnk s HIS 119 Cb -0.15 -1.88 -0.05 0.00 1.11 0.00 0.00 32.58 31.62 3mnk s HIS 119 CO 0.09 -0.81 0.20 -0.51 -0.85 0.00 0.00 174.74 172.86 3mnk s LEU 120 N 1.27 4.03 -0.17 0.89 1.43 -0.25 -1.66 118.68 124.22 3mnk s LEU 120 Ca 0.01 -0.00 -0.06 0.00 -1.03 0.00 0.00 54.13 53.05 3mnk s LEU 120 Cb -0.15 -2.14 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 3mnk s LEU 120 CO -0.11 -0.06 0.03 -0.69 0.23 0.00 0.00 176.35 175.75 3mnk s VAL 121 N 1.78 4.48 0.03 -1.59 1.01 -0.02 -1.48 120.40 124.60 3mnk s VAL 121 Ca 0.07 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 61.94 3mnk s VAL 121 Cb -0.16 -3.00 -0.02 0.00 0.00 0.00 0.00 36.38 33.20 3mnk s VAL 121 CO 0.11 0.47 -0.09 -1.00 0.00 0.00 0.00 175.10 174.59 3mnk s HIS 122 N 0.36 0.79 0.11 5.22 3.76 -0.37 -1.45 115.29 123.70 3mnk s HIS 122 Ca 0.00 -0.37 0.10 0.00 -0.15 0.00 0.00 55.06 54.65 3mnk s HIS 122 Cb -0.13 -0.47 -0.04 0.00 1.11 0.00 0.00 32.58 33.05 3mnk s HIS 122 CO 0.01 -0.03 -0.25 1.67 -0.85 0.00 0.00 174.74 175.29 3mnk s TRP 123 N -0.96 2.14 -0.14 1.40 1.48 -0.07 -1.27 118.94 121.53 3mnk s TRP 123 Ca -0.04 -0.39 -0.29 0.00 -1.06 0.00 0.00 56.10 54.31 3mnk s TRP 123 Cb -0.08 -1.18 -0.04 0.00 -1.16 0.00 0.00 33.47 31.02 3mnk s TRP 123 CO 0.01 0.27 1.56 1.21 -4.06 0.00 0.00 176.95 175.93 3mnk s ASN 124 N -1.91 6.62 0.35 -2.66 3.84 0.27 -0.67 114.94 120.78 3mnk s ASN 124 Ca 0.11 1.89 0.27 0.00 0.21 0.00 0.00 52.86 55.35 3mnk s ASN 124 Cb -0.10 -2.53 1.12 0.00 -0.55 0.00 0.00 41.25 39.19 3mnk s ASN 124 CO 0.05 -1.01 1.80 0.71 -2.79 0.00 0.00 177.10 175.86 3mnk h THR 125 N 5.77 0.00 0.00 -5.21 1.35 -1.62 -1.85 112.91 111.35 3mnk h THR 125 Ca -0.34 -0.31 -0.00 0.00 -0.55 0.00 0.00 66.41 65.20 3mnk h THR 125 Cb 1.15 1.12 -0.00 0.00 -1.73 0.00 0.00 68.15 68.69 3mnk h THR 125 CO 0.98 0.00 -0.02 0.07 -0.25 0.00 0.00 175.52 176.30 3mnk h LYS 127 N 0.00 0.00 -0.02 4.72 2.10 -1.91 -2.29 116.57 119.17 3mnk h LYS 127 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3mnk h LYS 127 Cb 0.40 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.73 3mnk h LYS 127 CO 0.00 0.02 -0.13 0.66 -2.00 0.00 0.00 179.45 178.00 3mnk n TYR 128 N -3.18 0.00 0.00 0.07 4.01 -0.69 -4.98 117.16 112.38 3mnk n TYR 128 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 3mnk n TYR 128 Cb 0.18 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.18 3mnk n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3mnk n GLY 129 N 1.29 2.08 3.60 2.72 0.00 -0.86 -4.53 105.19 109.48 3mnk n GLY 129 Ca 0.15 -0.14 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 3mnk n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3mnk s ASP 130 N 0.13 -0.24 0.17 1.61 1.47 -1.26 -5.06 116.67 113.49 3mnk s ASP 130 Ca 0.00 -0.57 -0.11 0.00 1.18 0.00 0.00 52.55 53.05 3mnk s ASP 130 Cb 0.00 0.61 0.05 0.00 -0.34 0.00 0.00 42.92 43.24 3mnk s ASP 130 CO 0.00 -1.13 1.64 0.15 0.68 0.00 0.00 175.17 176.52 3mnk h PHE 131 N 2.16 1.04 -0.03 2.11 3.57 -1.95 -1.68 116.94 122.16 3mnk h PHE 131 Ca -0.26 -0.16 -0.03 0.00 3.53 0.00 0.00 57.97 61.05 3mnk h PHE 131 Cb 1.26 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.72 3mnk h PHE 131 CO 0.37 0.92 -0.11 0.78 -2.23 0.00 0.00 178.31 178.04 3mnk h GLY 132 N 0.86 0.05 1.30 2.40 0.00 -1.97 -1.92 103.07 103.79 3mnk h GLY 132 Ca 0.17 -0.02 -0.30 0.00 0.00 0.00 0.00 47.33 47.17 3mnk h GLY 132 CO 0.02 0.02 -1.29 0.50 0.00 0.00 0.00 176.54 175.79 3mnk h LYS 133 N 0.04 0.56 -0.91 4.80 1.79 -1.76 -3.33 116.57 117.76 3mnk h LYS 133 Ca 0.01 -0.80 0.07 0.00 -2.18 0.00 0.00 60.65 57.75 3mnk h LYS 133 Cb 0.23 0.27 -0.06 0.00 -1.58 0.00 0.00 32.23 31.09 3mnk h LYS 133 CO 0.02 1.37 0.59 0.00 -1.08 0.00 0.00 179.45 180.34 3mnk h ALA 134 N 0.31 1.54 0.00 3.86 0.00 -0.87 -2.25 119.26 121.86 3mnk h ALA 134 Ca -0.19 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3mnk h ALA 134 Cb 1.97 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.51 3mnk h ALA 134 CO 0.24 0.31 0.00 -0.39 0.00 0.00 0.00 179.25 179.41 3mnk h VAL 135 N 1.00 0.00 -0.27 0.00 -1.51 -1.47 -2.16 116.25 111.83 3mnk h VAL 135 Ca 0.40 -0.20 0.00 0.00 -1.23 0.00 0.00 66.70 65.67 3mnk h VAL 135 Cb 0.25 0.92 0.00 0.00 -2.13 0.00 0.00 31.29 30.33 3mnk h VAL 135 CO -0.16 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.18 3mnk n GLN 136 N -2.38 1.83 -4.61 5.19 6.02 -0.84 -4.66 117.38 117.93 3mnk n GLN 136 Ca 0.01 -1.26 -0.30 0.00 -0.01 0.00 0.00 57.00 55.44 3mnk n GLN 136 Cb 0.19 -1.36 -0.13 0.00 1.02 0.00 0.00 30.24 29.96 3mnk n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3mnk s GLN 137 N -1.65 1.95 0.53 -1.09 -1.52 -0.81 -5.03 119.66 112.04 3mnk s GLN 137 Ca 0.30 -1.05 0.30 0.00 -1.95 0.00 0.00 55.36 52.95 3mnk s GLN 137 Cb 0.16 -2.13 1.45 0.00 -0.22 0.00 0.00 33.01 32.26 3mnk s GLN 137 CO 0.23 0.52 2.04 -1.00 -0.25 0.00 0.00 175.29 176.83 3mnk h PRO 138 N 4.38 0.00 -0.48 2.91 0.13 -1.86 -2.54 132.00 134.54 3mnk h PRO 138 Ca -0.48 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.34 3mnk h PRO 138 Cb 1.16 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.08 3mnk h PRO 138 CO 0.46 0.10 -0.27 -0.40 -0.23 0.00 0.00 178.00 177.66 3mnk n ASP 139 N -3.41 3.59 0.09 1.44 5.75 -1.26 -4.23 116.55 118.52 3mnk n ASP 139 Ca -0.01 -3.80 -0.16 0.00 -0.01 0.00 0.00 54.79 50.81 3mnk n ASP 139 Cb 0.27 -0.57 -0.14 0.00 -1.03 0.00 0.00 41.12 39.65 3mnk n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3mnk h GLY 140 N 1.45 0.30 -3.99 6.12 0.00 -1.28 -3.43 103.07 102.23 3mnk h GLY 140 Ca 0.27 -0.75 -0.67 0.00 0.00 0.00 0.00 47.33 46.18 3mnk h GLY 140 CO 0.56 0.66 -0.86 1.08 0.00 0.00 0.00 176.54 177.98 3mnk s LEU 141 N -7.09 2.30 -0.11 3.11 1.43 0.20 -0.57 118.68 117.96 3mnk s LEU 141 Ca -0.05 -0.73 0.01 0.00 -1.03 0.00 0.00 54.13 52.34 3mnk s LEU 141 Cb 0.07 -1.17 0.02 0.00 0.03 0.00 0.00 46.19 45.14 3mnk s LEU 141 CO 0.88 0.17 -0.14 0.00 0.23 0.00 0.00 176.35 177.48 3mnk s ALA 142 N -1.05 1.64 -0.15 4.21 0.00 -0.39 -1.04 121.76 124.98 3mnk s ALA 142 Ca 0.13 -0.71 0.01 0.00 0.00 0.00 0.00 51.96 51.39 3mnk s ALA 142 Cb -0.10 -0.84 0.00 0.00 0.00 0.00 0.00 23.12 22.19 3mnk s ALA 142 CO 0.05 -0.12 -0.18 0.08 0.00 0.00 0.00 175.76 175.60 3mnk s VAL 143 N 1.06 2.41 -0.20 0.00 1.01 -0.86 -1.24 120.40 122.58 3mnk s VAL 143 Ca -0.05 -0.86 -0.19 0.00 0.00 0.00 0.00 61.98 60.88 3mnk s VAL 143 Cb -0.15 -1.99 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 3mnk s VAL 143 CO -0.02 0.53 0.53 -0.22 0.00 0.00 0.00 175.10 175.92 3mnk s LEU 144 N 0.78 4.15 -0.13 3.92 2.96 -0.55 -1.24 118.68 128.57 3mnk s LEU 144 Ca -0.07 0.70 -0.01 0.00 -0.22 0.00 0.00 54.13 54.54 3mnk s LEU 144 Cb -0.16 -2.74 -0.02 0.00 0.50 0.00 0.00 46.19 43.78 3mnk s LEU 144 CO -0.00 -0.19 -0.10 -0.83 -1.32 0.00 0.00 176.35 173.91 3mnk s GLY 145 N 1.14 1.60 -0.07 7.98 0.00 0.42 -1.09 107.32 117.30 3mnk s GLY 145 Ca 0.25 -0.87 0.01 0.00 0.00 0.00 0.00 44.72 44.11 3mnk s GLY 145 CO 0.10 -0.23 -0.09 -0.42 0.00 0.00 0.00 173.10 172.45 3mnk s ILE 146 N 0.19 0.96 0.35 0.90 1.01 -0.28 -0.75 121.20 123.58 3mnk s ILE 146 Ca -0.06 -0.35 -0.23 0.00 0.00 0.00 0.00 60.65 60.01 3mnk s ILE 146 Cb -0.15 -0.92 -0.10 0.00 0.01 0.00 0.00 42.46 41.31 3mnk s ILE 146 CO 0.04 0.32 0.91 -0.36 0.00 0.00 0.00 174.94 175.86 3mnk s PHE 147 N 0.91 3.55 -0.15 3.97 0.08 -1.26 -0.30 117.98 124.77 3mnk s PHE 147 Ca -0.10 1.65 -0.01 0.00 0.12 0.00 0.00 56.93 58.59 3mnk s PHE 147 Cb -0.15 -2.84 -0.01 0.00 -0.57 0.00 0.00 43.02 39.45 3mnk s PHE 147 CO 0.01 0.11 -0.11 -0.51 -0.10 0.00 0.00 175.22 174.62 3mnk s LEU 148 N -2.46 2.74 0.26 -0.37 1.02 -0.46 -0.93 118.68 118.47 3mnk s LEU 148 Ca 0.53 -0.35 0.09 0.00 0.02 0.00 0.00 54.13 54.43 3mnk s LEU 148 Cb -0.15 -1.63 -0.04 0.00 0.02 0.00 0.00 46.19 44.39 3mnk s LEU 148 CO 0.20 0.12 0.00 -1.59 0.02 0.00 0.00 176.35 175.10 3mnk s LYS 149 N 0.60 2.32 -0.16 1.70 -2.85 -0.24 -1.91 119.74 119.19 3mnk s LYS 149 Ca -0.07 -1.38 -0.16 0.00 -1.00 0.00 0.00 55.97 53.35 3mnk s LYS 149 Cb -0.15 -2.19 -0.04 0.00 -2.06 0.00 0.00 37.83 33.39 3mnk s LYS 149 CO 0.03 0.37 0.41 0.08 0.10 0.00 0.00 175.35 176.34 3mnk s VAL 150 N -2.27 5.22 0.00 1.79 1.01 -1.26 -1.14 120.40 123.75 3mnk s VAL 150 Ca 0.31 0.78 0.00 0.00 0.00 0.00 0.00 61.98 63.07 3mnk s VAL 150 Cb -0.07 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.57 3mnk s VAL 150 CO 0.20 0.31 0.00 0.61 0.00 0.00 0.00 175.10 176.22 3mnk n GLY 151 N 3.54 0.57 3.82 4.51 0.00 0.58 -4.89 105.19 113.32 3mnk n GLY 151 Ca -0.08 0.47 -0.33 0.00 0.00 0.00 0.00 46.02 46.08 3mnk n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mnk s SER 152 N 2.00 6.41 0.57 1.61 0.01 -1.26 -4.08 113.70 118.96 3mnk s SER 152 Ca 0.00 1.70 -0.20 0.00 1.31 0.00 0.00 55.95 58.76 3mnk s SER 152 Cb 0.00 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.66 3mnk s SER 152 CO 0.00 -0.73 1.24 0.00 0.41 0.00 0.00 173.24 174.16 3mnk s ALA 153 N -2.43 2.63 -0.41 1.44 0.00 -1.26 -2.66 121.76 119.07 3mnk s ALA 153 Ca 0.62 1.09 -0.12 0.00 0.00 0.00 0.00 51.96 53.55 3mnk s ALA 153 Cb -0.12 -3.48 0.04 0.00 0.00 0.00 0.00 23.12 19.56 3mnk s ALA 153 CO 0.28 -1.20 0.27 0.21 0.00 0.00 0.00 175.76 175.33 3mnk s LYS 154 N -3.17 2.83 0.28 0.00 2.47 -1.23 -4.82 119.74 116.09 3mnk s LYS 154 Ca 0.75 -1.20 0.01 0.00 -1.56 0.00 0.00 55.97 53.97 3mnk s LYS 154 Cb -0.33 -3.86 0.54 0.00 -1.46 0.00 0.00 37.83 32.72 3mnk s LYS 154 CO 0.37 -0.82 1.82 -1.35 0.16 0.00 0.00 175.35 175.53 3mnk h PRO 155 N 8.53 0.89 0.00 4.03 0.11 -1.92 -2.16 132.00 141.47 3mnk h PRO 155 Ca -0.26 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3mnk h PRO 155 Cb 1.10 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.01 3mnk h PRO 155 CO 0.74 0.59 0.00 0.41 -0.21 0.00 0.00 178.00 179.52 3mnk n GLY 156 N -1.34 -1.08 0.07 -0.55 0.00 -1.26 -1.70 105.19 99.33 3mnk n GLY 156 Ca 0.18 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.36 3mnk n GLY 156 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3mnk h LEU 157 N 0.00 0.00 -1.34 0.99 5.85 -1.64 -3.41 115.31 115.77 3mnk h LEU 157 Ca 0.00 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 3mnk h LEU 157 Cb 0.26 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 3mnk h LEU 157 CO 0.00 0.09 0.26 -0.61 -0.34 0.00 0.00 178.44 177.84 3mnk h GLN 158 N 0.00 0.71 -0.84 1.25 5.75 -1.37 -2.01 115.11 118.59 3mnk h GLN 158 Ca 0.00 -0.08 0.04 0.00 -0.15 0.00 0.00 58.65 58.46 3mnk h GLN 158 Cb 0.82 -0.14 -0.05 0.00 1.07 0.00 0.00 27.48 29.18 3mnk h GLN 158 CO 0.00 0.54 0.55 -0.22 -2.65 0.00 0.00 178.83 177.06 3mnk h LYS 159 N 0.72 0.99 -0.10 1.69 3.64 -1.78 -0.03 116.57 121.70 3mnk h LYS 159 Ca 0.18 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 3mnk h LYS 159 Cb 0.06 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 31.65 3mnk h LYS 159 CO -0.03 0.66 0.02 0.28 -2.27 0.00 0.00 179.45 178.11 3mnk h VAL 160 N 1.02 1.19 -0.95 2.00 2.07 -1.67 -3.18 116.25 116.74 3mnk h VAL 160 Ca 0.34 -0.59 0.05 0.00 0.82 0.00 0.00 66.70 67.31 3mnk h VAL 160 Cb 0.07 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 31.19 3mnk h VAL 160 CO -0.11 0.17 0.61 0.58 0.02 0.00 0.00 177.57 178.85 3mnk h VAL 161 N -0.05 1.12 0.00 2.57 2.07 -0.88 -2.74 116.25 118.34 3mnk h VAL 161 Ca 0.03 -0.40 -0.07 0.00 0.82 0.00 0.00 66.70 67.08 3mnk h VAL 161 Cb 0.25 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 29.87 3mnk h VAL 161 CO 0.00 0.21 -0.33 0.44 0.02 0.00 0.00 177.57 177.91 3mnk h ASP 162 N 1.16 0.00 0.52 0.57 3.32 -1.01 -2.94 116.42 118.03 3mnk h ASP 162 Ca 0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 3mnk h ASP 162 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3mnk h ASP 162 CO -0.14 0.33 -0.41 0.55 -1.72 0.00 0.00 179.24 177.85 3mnk n VAL 163 N -3.90 0.00 0.03 -1.35 3.14 -1.04 -4.26 118.33 110.95 3mnk n VAL 163 Ca -0.02 -0.02 0.05 0.00 -2.96 0.00 0.00 64.34 61.40 3mnk n VAL 163 Cb 0.40 0.17 0.46 0.00 -1.06 0.00 0.00 33.84 33.81 3mnk n VAL 163 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 3mnk h LEU 164 N 0.15 0.40 -1.00 6.55 3.38 -1.51 -0.32 115.31 122.96 3mnk h LEU 164 Ca 0.00 -0.01 0.25 0.00 0.09 0.00 0.00 57.88 58.21 3mnk h LEU 164 Cb 0.50 -0.10 -0.13 0.00 0.09 0.00 0.00 40.66 41.02 3mnk h LEU 164 CO 0.00 0.28 0.58 -0.78 0.09 0.00 0.00 178.44 178.61 3mnk h ASP 165 N 0.47 0.64 0.38 -0.43 3.58 -1.80 -1.86 116.42 117.40 3mnk h ASP 165 Ca 0.13 0.14 0.00 0.00 0.42 0.00 0.00 57.03 57.73 3mnk h ASP 165 Cb -0.02 0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.08 3mnk h ASP 165 CO -0.03 0.07 -0.11 -1.54 -2.88 0.00 0.00 179.24 174.75 3mnk n SER 166 N -4.92 0.44 -2.54 2.28 3.41 -0.13 -3.86 113.62 108.29 3mnk n SER 166 Ca 0.27 -0.53 -0.16 0.00 -0.26 0.00 0.00 58.87 58.19 3mnk n SER 166 Cb 0.77 -0.09 0.02 0.00 -0.26 0.00 0.00 64.21 64.66 3mnk n SER 166 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3mnk n ILE 167 N -0.99 1.70 0.19 -1.33 -5.35 -0.70 -4.70 119.36 108.18 3mnk n ILE 167 Ca 0.14 -3.86 0.03 0.00 -0.27 0.00 0.00 62.75 58.79 3mnk n ILE 167 Cb 0.28 -0.17 0.36 0.00 -1.74 0.00 0.00 39.64 38.36 3mnk n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 3mnk h LYS 168 N 2.71 0.00 -6.19 6.28 3.64 -1.66 -3.42 116.57 117.93 3mnk h LYS 168 Ca 0.10 0.00 -0.59 0.00 -1.27 0.00 0.00 60.65 58.89 3mnk h LYS 168 Cb 1.13 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 32.80 3mnk h LYS 168 CO 0.62 0.38 -0.78 0.95 -2.27 0.00 0.00 179.45 178.35 3mnk s THR 169 N -4.10 2.25 0.06 1.00 -4.23 -1.26 -0.56 115.64 108.80 3mnk s THR 169 Ca -0.02 -2.21 -0.36 0.00 -1.18 0.00 0.00 61.69 57.92 3mnk s THR 169 Cb 0.14 -2.15 -0.15 0.00 1.34 0.00 0.00 72.50 71.68 3mnk s THR 169 CO 0.72 -0.34 1.50 1.57 -0.54 0.00 0.00 174.62 177.54 3mnk n HIS 170 N -0.21 1.89 0.00 3.99 -0.00 -0.23 -2.18 115.22 118.47 3mnk n HIS 170 Ca -0.09 0.45 0.00 0.00 0.46 0.00 0.00 57.72 58.55 3mnk n HIS 170 Cb 0.58 -2.44 0.00 0.00 -0.12 0.00 0.00 29.99 28.01 3mnk n HIS 170 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3mnk n GLY 171 N 3.14 2.70 3.76 1.57 0.00 0.36 -4.55 105.19 112.17 3mnk n GLY 171 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 3mnk n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mnk s LYS 172 N -0.83 4.60 0.07 1.61 -0.14 -0.93 -4.87 119.74 119.25 3mnk s LYS 172 Ca 0.00 1.86 0.00 0.00 -1.36 0.00 0.00 55.97 56.47 3mnk s LYS 172 Cb 0.00 -3.18 -0.04 0.00 -1.68 0.00 0.00 37.83 32.93 3mnk s LYS 172 CO 0.00 0.15 -0.05 -1.54 -0.76 0.00 0.00 175.35 173.16 3mnk s SER 173 N -0.78 0.75 -0.01 2.83 1.04 -1.26 -1.13 113.70 115.13 3mnk s SER 173 Ca 0.45 -0.94 -0.06 0.00 0.48 0.00 0.00 55.95 55.88 3mnk s SER 173 Cb -0.33 0.14 0.00 0.00 0.10 0.00 0.00 66.02 65.94 3mnk s SER 173 CO 0.42 -0.50 0.14 0.00 0.98 0.00 0.00 173.24 174.28 3mnk s ALA 174 N -3.48 -0.33 0.28 5.32 0.00 0.14 -4.95 121.76 118.75 3mnk s ALA 174 Ca 0.06 0.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.74 3mnk s ALA 174 Cb 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 23.12 23.04 3mnk s ALA 174 CO -0.07 -0.17 1.41 -3.47 0.00 0.00 0.00 175.76 173.46 3mnk n ASP 175 N 1.91 2.96 -3.13 0.00 2.03 -1.26 -0.91 116.55 118.16 3mnk n ASP 175 Ca -0.20 1.16 -0.18 0.00 0.52 0.00 0.00 54.79 56.10 3mnk n ASP 175 Cb 0.56 -1.48 -0.05 0.00 -0.72 0.00 0.00 41.12 39.43 3mnk n ASP 175 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 3mnk n PHE 176 N 1.47 -2.07 -4.01 -0.67 7.35 -0.15 -4.73 117.46 114.65 3mnk n PHE 176 Ca 0.09 -2.55 -0.22 0.00 -0.76 0.00 0.00 57.45 54.01 3mnk n PHE 176 Cb 0.34 0.74 -0.03 0.00 0.35 0.00 0.00 39.48 40.87 3mnk n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 3mnk s THR 177 N 0.34 5.04 -1.17 -2.13 -4.23 -1.26 -3.31 115.64 108.92 3mnk s THR 177 Ca 0.32 -1.03 -0.04 0.00 -1.18 0.00 0.00 61.69 59.75 3mnk s THR 177 Cb 0.03 -3.70 0.00 0.00 1.34 0.00 0.00 72.50 70.18 3mnk s THR 177 CO -0.14 -0.28 0.59 0.59 -0.54 0.00 0.00 174.62 174.84 3mnk n ASN 178 N -1.14 -5.20 -4.74 3.99 4.13 -1.26 -4.98 115.26 106.06 3mnk n ASN 178 Ca -0.08 -0.27 -0.36 0.00 1.68 0.00 0.00 54.58 55.54 3mnk n ASN 178 Cb 0.57 -3.98 -0.07 0.00 -1.54 0.00 0.00 39.78 34.75 3mnk n ASN 178 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 3mnk s PHE 179 N -3.09 3.46 -0.39 3.10 5.36 -1.26 -5.02 117.98 120.14 3mnk s PHE 179 Ca 0.29 0.55 -0.13 0.00 -0.96 0.00 0.00 56.93 56.69 3mnk s PHE 179 Cb -0.13 -2.29 0.02 0.00 -0.34 0.00 0.00 43.02 40.28 3mnk s PHE 179 CO 0.36 0.28 0.26 0.34 -1.46 0.00 0.00 175.22 175.00 3mnk s ASP 180 N 0.35 5.96 0.00 6.13 -1.08 -1.26 -4.45 116.67 122.32 3mnk s ASP 180 Ca 0.15 -0.87 0.21 0.00 -0.52 0.00 0.00 52.55 51.52 3mnk s ASP 180 Cb -0.13 -2.11 1.16 0.00 -1.46 0.00 0.00 42.92 40.39 3mnk s ASP 180 CO 0.03 -0.40 1.67 -0.81 0.52 0.00 0.00 175.17 176.18 3mnk n PRO 181 N 5.10 0.47 0.29 4.34 -0.04 -1.26 -2.57 135.00 141.32 3mnk n PRO 181 Ca -0.11 0.05 0.16 0.00 -0.04 0.00 0.00 63.50 63.56 3mnk n PRO 181 Cb 0.47 -1.50 0.84 0.00 -0.04 0.00 0.00 33.50 33.27 3mnk n PRO 181 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3mnk h ARG 182 N 0.00 0.00 0.00 0.54 3.08 -1.92 -1.38 114.38 114.70 3mnk h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3mnk h ARG 182 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 3mnk h ARG 182 CO 0.00 0.06 0.00 0.41 -1.07 0.00 0.00 179.97 179.37 3mnk n GLY 183 N -0.61 -0.91 0.85 0.04 0.00 -1.06 -2.93 105.19 100.56 3mnk n GLY 183 Ca -0.02 -0.12 0.10 0.00 0.00 0.00 0.00 46.02 45.99 3mnk n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mnk n LEU 184 N -1.18 2.78 -4.83 0.99 4.77 -0.52 -4.44 117.00 114.56 3mnk n LEU 184 Ca 0.13 -1.07 -0.37 0.00 -0.03 0.00 0.00 56.01 54.67 3mnk n LEU 184 Cb 0.14 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.14 3mnk n LEU 184 CO 0.16 0.49 0.17 -0.76 -1.33 0.00 0.00 177.39 176.12 3mnk s LEU 185 N -1.66 4.46 1.03 2.23 1.43 -1.15 -4.94 118.68 120.07 3mnk s LEU 185 Ca 0.25 1.05 -0.15 0.00 -1.03 0.00 0.00 54.13 54.25 3mnk s LEU 185 Cb 0.17 -2.82 0.21 0.00 0.03 0.00 0.00 46.19 43.78 3mnk s LEU 185 CO 0.26 0.26 1.15 -2.16 0.23 0.00 0.00 176.35 176.09 3mnk s PRO 186 N -1.31 0.14 0.13 1.29 0.04 -1.26 -4.98 135.00 129.05 3mnk s PRO 186 Ca 0.28 0.10 -0.18 0.00 0.04 0.00 0.00 61.00 61.25 3mnk s PRO 186 Cb -0.17 -1.74 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 3mnk s PRO 186 CO 0.16 -2.84 1.75 0.93 0.04 0.00 0.00 177.00 177.05 3mnk h GLU 187 N -1.96 0.43 -5.90 4.56 5.08 -1.93 -3.44 114.58 111.43 3mnk h GLU 187 Ca -0.49 -0.04 -0.63 0.00 -1.00 0.00 0.00 59.36 57.21 3mnk h GLU 187 Cb 1.31 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 30.42 3mnk h GLU 187 CO 0.49 0.33 -0.39 0.45 -1.00 0.00 0.00 179.01 178.89 3mnk s SER 188 N -5.56 6.49 -0.24 1.42 0.15 -1.26 -5.00 113.70 109.70 3mnk s SER 188 Ca -0.13 0.55 0.14 0.00 0.70 0.00 0.00 55.95 57.21 3mnk s SER 188 Cb 0.09 -2.09 0.65 0.00 -1.71 0.00 0.00 66.02 62.97 3mnk s SER 188 CO 0.72 0.25 1.59 0.18 1.20 0.00 0.00 173.24 177.18 3mnk n LEU 189 N 1.11 4.85 -4.77 3.45 4.77 -1.26 -4.72 117.00 120.43 3mnk n LEU 189 Ca -0.11 -3.12 -0.37 0.00 -0.03 0.00 0.00 56.01 52.38 3mnk n LEU 189 Cb 0.53 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 3mnk n LEU 189 CO 0.41 0.75 0.86 -1.81 -1.33 0.00 0.00 177.39 176.27 3mnk s ASP 190 N -1.52 5.92 0.10 -1.43 1.01 -1.26 -4.76 116.67 114.73 3mnk s ASP 190 Ca 0.48 2.40 -0.15 0.00 0.71 0.00 0.00 52.55 55.99 3mnk s ASP 190 Cb 0.39 -2.61 0.03 0.00 1.01 0.00 0.00 42.92 41.74 3mnk s ASP 190 CO 0.11 -1.09 0.37 -0.72 0.21 0.00 0.00 175.17 174.04 3mnk s TYR 191 N -1.51 -0.16 0.11 4.23 -0.85 -1.26 -1.45 117.35 116.46 3mnk s TYR 191 Ca 0.66 -0.12 0.04 0.00 -0.52 0.00 0.00 57.07 57.13 3mnk s TYR 191 Cb -0.31 0.20 -0.04 0.00 0.38 0.00 0.00 41.96 42.19 3mnk s TYR 191 CO 0.37 -0.65 0.10 -1.58 -1.52 0.00 0.00 175.55 172.27 3mnk s TRP 192 N -3.52 3.18 0.00 -3.49 0.51 -0.05 -0.48 118.94 115.08 3mnk s TRP 192 Ca 0.01 0.04 -0.01 0.00 -2.12 0.00 0.00 56.10 54.03 3mnk s TRP 192 Cb 0.02 -1.58 -0.01 0.00 -0.81 0.00 0.00 33.47 31.09 3mnk s TRP 192 CO -0.10 0.52 0.01 -0.08 -0.51 0.00 0.00 176.95 176.79 3mnk s THR 193 N -1.51 0.05 0.20 2.01 -1.32 -0.02 -0.52 115.64 114.52 3mnk s THR 193 Ca 0.30 -0.39 -0.19 0.00 -1.21 0.00 0.00 61.69 60.20 3mnk s THR 193 Cb -0.11 -0.15 0.03 0.00 -1.51 0.00 0.00 72.50 70.76 3mnk s THR 193 CO 0.22 -0.22 0.56 -0.72 -2.21 0.00 0.00 174.62 172.26 3mnk s TYR 194 N -0.64 -0.20 -0.06 9.09 1.13 -1.04 -1.28 117.35 124.35 3mnk s TYR 194 Ca -0.07 -0.14 -0.21 0.00 -1.41 0.00 0.00 57.07 55.24 3mnk s TYR 194 Cb -0.04 0.46 -0.04 0.00 -1.10 0.00 0.00 41.96 41.23 3mnk s TYR 194 CO -0.00 -0.95 0.61 -1.25 -2.51 0.00 0.00 175.55 171.45 3mnk s PRO 195 N -3.86 4.38 0.00 -3.49 0.04 -1.26 -1.25 135.00 129.56 3mnk s PRO 195 Ca 0.08 0.72 0.00 0.00 0.04 0.00 0.00 61.00 61.84 3mnk s PRO 195 Cb -0.02 -3.41 0.00 0.00 0.04 0.00 0.00 34.50 31.11 3mnk s PRO 195 CO -0.03 0.18 0.00 0.41 0.04 0.00 0.00 177.00 177.60 3mnk n GLY 196 N 2.95 4.04 3.25 0.56 0.00 0.63 -4.86 105.19 111.76 3mnk n GLY 196 Ca -0.04 -0.64 -0.14 0.00 0.00 0.00 0.00 46.02 45.19 3mnk n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3mnk s SER 197 N 1.69 0.59 0.56 1.61 1.04 -1.13 -2.32 113.70 115.74 3mnk s SER 197 Ca 0.00 -1.38 -0.20 0.00 0.48 0.00 0.00 55.95 54.85 3mnk s SER 197 Cb 0.00 0.29 -0.05 0.00 0.10 0.00 0.00 66.02 66.36 3mnk s SER 197 CO 0.00 -0.79 1.24 -0.76 0.98 0.00 0.00 173.24 173.91 3mnk s LEU 198 N -3.22 3.78 0.00 2.42 1.43 -0.59 -4.52 118.68 117.99 3mnk s LEU 198 Ca 0.38 2.47 0.22 0.00 -1.03 0.00 0.00 54.13 56.18 3mnk s LEU 198 Cb 0.07 -4.45 0.42 0.00 0.03 0.00 0.00 46.19 42.26 3mnk s LEU 198 CO 0.12 -1.46 1.38 0.35 0.23 0.00 0.00 176.35 176.97 3mnk n THR 199 N -1.24 0.53 -4.42 5.49 -2.24 -1.26 -4.43 114.28 106.71 3mnk n THR 199 Ca 0.12 -0.77 -0.22 0.00 -2.27 0.00 0.00 64.05 60.91 3mnk n THR 199 Cb 0.48 0.96 -0.10 0.00 -2.10 0.00 0.00 70.33 69.57 3mnk n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3mnk s THR 200 N -1.42 2.17 0.28 4.28 -4.23 -1.26 -4.73 115.64 110.73 3mnk s THR 200 Ca 0.38 -2.32 -0.29 0.00 -1.18 0.00 0.00 61.69 58.28 3mnk s THR 200 Cb 0.22 -2.22 -0.14 0.00 1.34 0.00 0.00 72.50 71.70 3mnk s THR 200 CO 0.31 -0.46 1.12 -2.65 -0.54 0.00 0.00 174.62 172.40 3mnk n PRO 201 N -0.54 1.57 -0.13 3.99 -0.02 -1.26 -0.58 135.00 138.03 3mnk n PRO 201 Ca -0.06 0.55 0.04 0.00 -2.02 0.00 0.00 63.50 62.01 3mnk n PRO 201 Cb 0.60 -2.01 0.10 0.00 -0.02 0.00 0.00 33.50 32.18 3mnk n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3mnk n PRO 202 N 0.92 1.57 -2.01 0.52 -0.04 -1.26 -5.01 135.00 129.69 3mnk n PRO 202 Ca 0.09 -0.85 -0.19 0.00 -0.04 0.00 0.00 63.50 62.51 3mnk n PRO 202 Cb 0.32 -1.20 -0.04 0.00 -0.04 0.00 0.00 33.50 32.54 3mnk n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3mnk n LEU 203 N 0.19 -1.64 -4.76 1.53 4.77 0.25 -4.91 117.00 112.42 3mnk n LEU 203 Ca 0.08 0.19 -0.39 0.00 -0.03 0.00 0.00 56.01 55.86 3mnk n LEU 203 Cb 0.21 -2.66 0.01 0.00 -2.33 0.00 0.00 43.42 38.65 3mnk n LEU 203 CO 0.06 -0.53 0.95 -0.76 -1.33 0.00 0.00 177.39 175.77 3mnk s LEU 204 N -4.89 4.07 -1.26 2.23 1.43 -1.26 -4.43 118.68 114.57 3mnk s LEU 204 Ca 0.00 2.64 -0.08 0.00 -1.03 0.00 0.00 54.13 55.65 3mnk s LEU 204 Cb 0.00 -4.07 0.18 0.00 0.03 0.00 0.00 46.19 42.33 3mnk s LEU 204 CO 0.00 -1.07 1.89 -0.62 0.23 0.00 0.00 176.35 176.78 3mnk n GLU 205 N -0.31 3.80 -0.19 1.70 1.02 -1.26 -1.54 120.64 123.87 3mnk n GLU 205 Ca 0.06 -3.62 0.04 0.00 -0.02 0.00 0.00 57.16 53.62 3mnk n GLU 205 Cb 0.45 -2.86 0.05 0.00 -0.02 0.00 0.00 31.44 29.06 3mnk n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3mnk s VAL 207 N -1.27 2.92 -0.35 0.00 1.01 -0.98 -0.63 120.40 121.10 3mnk s VAL 207 Ca 0.12 -0.70 -0.18 0.00 0.00 0.00 0.00 61.98 61.22 3mnk s VAL 207 Cb 0.11 -2.22 -0.00 0.00 0.00 0.00 0.00 36.38 34.26 3mnk s VAL 207 CO 0.01 0.52 0.50 -0.89 0.00 0.00 0.00 175.10 175.24 3mnk s THR 208 N 0.48 5.03 0.12 3.92 2.01 -0.21 -0.27 115.64 126.73 3mnk s THR 208 Ca -0.10 0.33 -0.24 0.00 0.31 0.00 0.00 61.69 62.00 3mnk s THR 208 Cb -0.16 -3.95 -0.07 0.00 0.01 0.00 0.00 72.50 68.33 3mnk s THR 208 CO 0.04 -0.20 0.72 0.26 -0.69 0.00 0.00 174.62 174.76 3mnk s TRP 209 N 2.36 3.86 -0.27 4.92 0.52 -0.38 -2.03 118.94 127.92 3mnk s TRP 209 Ca 0.18 1.52 -0.01 0.00 0.02 0.00 0.00 56.10 57.81 3mnk s TRP 209 Cb -0.16 -2.71 0.09 0.00 -1.15 0.00 0.00 33.47 29.54 3mnk s TRP 209 CO 0.13 0.49 0.07 0.42 0.02 0.00 0.00 176.95 178.08 3mnk s ILE 210 N -0.95 0.86 -0.23 2.03 1.01 -0.38 -2.50 121.20 121.05 3mnk s ILE 210 Ca 0.34 -1.17 -0.05 0.00 0.00 0.00 0.00 60.65 59.77 3mnk s ILE 210 Cb -0.22 -1.53 -0.02 0.00 0.01 0.00 0.00 42.46 40.71 3mnk s ILE 210 CO 0.24 -0.49 0.01 -0.69 0.00 0.00 0.00 174.94 174.00 3mnk s VAL 211 N 1.65 3.80 0.32 2.92 1.01 0.32 -0.44 120.40 129.98 3mnk s VAL 211 Ca 0.05 -0.35 -0.28 0.00 0.00 0.00 0.00 61.98 61.41 3mnk s VAL 211 Cb -0.17 -2.75 -0.09 0.00 0.00 0.00 0.00 36.38 33.36 3mnk s VAL 211 CO -0.19 0.39 1.07 -0.76 0.00 0.00 0.00 175.10 175.61 3mnk s LEU 212 N 1.49 4.43 0.17 3.92 1.43 0.07 -0.87 118.68 129.32 3mnk s LEU 212 Ca 0.06 2.17 -0.08 0.00 -1.03 0.00 0.00 54.13 55.25 3mnk s LEU 212 Cb -0.15 -3.80 0.05 0.00 0.03 0.00 0.00 46.19 42.32 3mnk s LEU 212 CO 0.00 -0.23 1.55 0.50 0.23 0.00 0.00 176.35 178.40 3mnk h LYS 213 N 3.42 0.89 -5.46 1.70 3.64 -1.59 -3.43 116.57 115.73 3mnk h LYS 213 Ca -0.47 -0.41 -0.61 0.00 -1.27 0.00 0.00 60.65 57.89 3mnk h LYS 213 Cb 1.21 -0.01 -0.12 0.00 -0.41 0.00 0.00 32.23 32.90 3mnk h LYS 213 CO 0.65 1.06 0.11 -2.00 -2.27 0.00 0.00 179.45 177.00 3mnk s GLU 214 N -4.53 4.03 0.78 1.90 2.12 -1.26 -5.02 118.70 116.71 3mnk s GLU 214 Ca -0.10 0.40 -0.11 0.00 0.36 0.00 0.00 54.97 55.52 3mnk s GLU 214 Cb 0.12 -3.68 0.06 0.00 0.26 0.00 0.00 34.13 30.90 3mnk s GLU 214 CO 0.86 -0.45 1.09 -1.25 -0.54 0.00 0.00 175.26 174.97 3mnk s PRO 215 N 2.49 2.19 0.17 4.30 0.05 -1.26 -4.67 135.00 138.26 3mnk s PRO 215 Ca 0.24 1.08 0.04 0.00 0.05 0.00 0.00 61.00 62.41 3mnk s PRO 215 Cb -0.15 -1.90 -0.04 0.00 0.05 0.00 0.00 34.50 32.47 3mnk s PRO 215 CO 0.10 -1.66 0.25 0.96 0.05 0.00 0.00 177.00 176.69 3mnk s ILE 216 N -2.93 5.06 -0.08 0.56 -4.36 -0.11 -4.88 121.20 114.46 3mnk s ILE 216 Ca 0.61 -0.85 -0.05 0.00 -0.26 0.00 0.00 60.65 60.10 3mnk s ILE 216 Cb -0.17 -3.62 -0.04 0.00 1.25 0.00 0.00 42.46 39.88 3mnk s ILE 216 CO 0.56 -0.13 0.12 -0.44 0.24 0.00 0.00 174.94 175.29 3mnk s SER 217 N -3.30 6.15 0.21 4.36 0.01 -1.26 -1.08 113.70 118.79 3mnk s SER 217 Ca 0.33 0.36 0.06 0.00 1.31 0.00 0.00 55.95 58.02 3mnk s SER 217 Cb -0.10 -1.92 -0.05 0.00 0.21 0.00 0.00 66.02 64.15 3mnk s SER 217 CO 0.27 0.36 -0.09 0.68 0.41 0.00 0.00 173.24 174.87 3mnk s VAL 218 N -1.09 1.47 0.45 3.43 -7.23 -0.29 -3.55 120.40 113.59 3mnk s VAL 218 Ca 0.18 -2.13 -0.04 0.00 -1.81 0.00 0.00 61.98 58.18 3mnk s VAL 218 Cb -0.12 -2.15 -0.04 0.00 0.56 0.00 0.00 36.38 34.64 3mnk s VAL 218 CO 0.08 -0.51 0.73 -0.94 -0.31 0.00 0.00 175.10 174.15 3mnk s SER 219 N -3.31 6.28 0.29 4.85 1.04 -1.20 -0.31 113.70 121.34 3mnk s SER 219 Ca 0.24 0.83 0.04 0.00 0.48 0.00 0.00 55.95 57.54 3mnk s SER 219 Cb 0.02 -2.20 0.72 0.00 0.10 0.00 0.00 66.02 64.65 3mnk s SER 219 CO 0.07 -0.51 1.72 -1.28 0.98 0.00 0.00 173.24 174.21 3mnk h SER 220 N 0.36 0.44 -0.08 7.02 0.87 -1.93 -2.13 113.55 118.10 3mnk h SER 220 Ca -0.48 0.14 -0.12 0.00 -1.23 0.00 0.00 61.79 60.10 3mnk h SER 220 Cb 1.21 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 63.24 3mnk h SER 220 CO 0.62 0.07 -0.34 -0.33 -0.53 0.00 0.00 176.83 176.31 3mnk h GLU 221 N 0.49 0.58 -0.09 2.24 3.07 -1.95 -0.21 114.58 118.70 3mnk h GLU 221 Ca 0.55 -0.27 -0.01 0.00 -0.50 0.00 0.00 59.36 59.14 3mnk h GLU 221 Cb 1.00 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.90 3mnk h GLU 221 CO -0.48 0.84 0.03 1.96 -1.40 0.00 0.00 179.01 179.97 3mnk h GLN 222 N 0.49 0.13 0.00 2.33 4.20 -1.78 -2.95 115.11 117.53 3mnk h GLN 222 Ca 0.05 -0.03 -0.10 0.00 0.06 0.00 0.00 58.65 58.64 3mnk h GLN 222 Cb 0.83 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.57 3mnk h GLN 222 CO 0.07 0.26 -0.46 -0.24 -0.67 0.00 0.00 178.83 177.79 3mnk h VAL 223 N -0.02 1.07 -0.97 -0.54 3.04 -1.31 -2.62 116.25 114.90 3mnk h VAL 223 Ca 0.03 -1.72 0.07 0.00 -1.01 0.00 0.00 66.70 64.07 3mnk h VAL 223 Cb 0.18 2.00 -0.07 0.00 -2.01 0.00 0.00 31.29 31.39 3mnk h VAL 223 CO -0.00 0.45 0.63 -0.07 -1.01 0.00 0.00 177.57 177.56 3mnk h LEU 224 N 0.00 0.98 -1.12 3.16 -0.00 -0.97 -1.85 115.31 115.51 3mnk h LEU 224 Ca -0.00 0.01 -0.07 0.00 -0.00 0.00 0.00 57.88 57.82 3mnk h LEU 224 Cb 0.97 -0.19 -0.02 0.00 -0.00 0.00 0.00 40.66 41.42 3mnk h LEU 224 CO 0.06 0.61 -0.10 0.11 -0.00 0.00 0.00 178.44 179.12 3mnk h LYS 225 N 1.10 0.50 -0.94 1.13 1.57 -1.29 -2.05 116.57 116.58 3mnk h LYS 225 Ca 0.43 -0.14 0.06 0.00 -1.87 0.00 0.00 60.65 59.13 3mnk h LYS 225 Cb 0.23 -0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.43 3mnk h LYS 225 CO -0.18 0.60 0.61 0.74 -0.57 0.00 0.00 179.45 180.66 3mnk h PHE 226 N 0.46 1.12 0.00 -1.35 -1.00 -1.33 -2.51 116.94 112.33 3mnk h PHE 226 Ca 0.09 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.90 3mnk h PHE 226 Cb 0.46 -0.37 0.00 0.00 3.61 0.00 0.00 35.95 39.65 3mnk h PHE 226 CO 0.02 0.60 0.00 0.54 -1.61 0.00 0.00 178.31 177.85 3mnk n ARG 227 N -4.48 0.46 0.00 1.51 1.74 -0.77 -2.65 116.66 112.47 3mnk n ARG 227 Ca 0.14 0.05 0.11 0.00 -0.77 0.00 0.00 57.85 57.38 3mnk n ARG 227 Cb 0.17 -1.50 0.11 0.00 -1.02 0.00 0.00 32.46 30.22 3mnk n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3mnk n LYS 228 N -1.14 0.63 -1.34 5.56 5.02 -0.95 -4.52 118.16 121.42 3mnk n LYS 228 Ca 0.12 -0.47 -0.30 0.00 -2.02 0.00 0.00 58.31 55.65 3mnk n LYS 228 Cb 0.11 -1.49 0.12 0.00 -0.02 0.00 0.00 35.03 33.76 3mnk n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3mnk s LEU 229 N -2.69 2.30 0.06 -0.35 1.43 -1.08 -4.88 118.68 113.46 3mnk s LEU 229 Ca 0.16 1.36 0.08 0.00 -1.03 0.00 0.00 54.13 54.71 3mnk s LEU 229 Cb 0.18 -3.82 -0.03 0.00 0.03 0.00 0.00 46.19 42.55 3mnk s LEU 229 CO 0.65 -2.45 -0.23 0.20 0.23 0.00 0.00 176.35 174.75 3mnk s ASN 230 N -3.63 2.73 0.23 2.29 0.02 0.27 -0.38 114.94 116.46 3mnk s ASN 230 Ca 0.63 -0.59 0.04 0.00 -1.02 0.00 0.00 52.86 51.92 3mnk s ASN 230 Cb -0.17 -0.21 0.22 0.00 0.02 0.00 0.00 41.25 41.11 3mnk s ASN 230 CO 0.56 0.17 1.54 -0.26 0.02 0.00 0.00 177.10 179.13 3mnk h PHE 231 N 4.62 0.33 -4.35 2.20 0.04 -1.52 -3.35 116.94 114.90 3mnk h PHE 231 Ca -0.45 -0.13 -0.50 0.00 2.80 0.00 0.00 57.97 59.69 3mnk h PHE 231 Cb 1.16 -0.06 0.07 0.00 2.20 0.00 0.00 35.95 39.32 3mnk h PHE 231 CO 0.53 0.81 0.39 0.54 -0.60 0.00 0.00 178.31 179.98 3mnk s ASN 232 N -6.90 5.81 0.60 2.17 4.22 -1.26 -4.31 114.94 115.27 3mnk s ASN 232 Ca -0.04 1.22 -0.08 0.00 -2.14 0.00 0.00 52.86 51.82 3mnk s ASN 232 Cb 0.12 -2.15 -0.01 0.00 1.28 0.00 0.00 41.25 40.48 3mnk s ASN 232 CO 0.80 -1.10 0.95 -0.83 -2.04 0.00 0.00 177.10 174.88 3mnk s GLY 233 N -4.27 1.60 0.30 0.45 0.00 -1.26 -1.07 107.32 103.07 3mnk s GLY 233 Ca 0.56 -0.43 -0.29 0.00 0.00 0.00 0.00 44.72 44.56 3mnk s GLY 233 CO 0.52 -0.16 1.31 -2.21 0.00 0.00 0.00 173.10 172.56 3mnk n GLU 234 N -2.64 2.04 -0.91 2.90 2.13 -1.26 -1.58 120.64 121.31 3mnk n GLU 234 Ca 0.04 0.72 0.00 0.00 0.66 0.00 0.00 57.16 58.58 3mnk n GLU 234 Cb 0.56 -2.31 0.00 0.00 0.27 0.00 0.00 31.44 29.96 3mnk n GLU 234 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3mnk n GLY 235 N 1.29 0.71 3.97 8.31 0.00 -1.26 -5.01 105.19 113.19 3mnk n GLY 235 Ca 0.07 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.88 3mnk n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mnk s GLU 236 N -0.26 3.20 0.30 1.61 2.02 -0.61 -5.06 118.70 119.90 3mnk s GLU 236 Ca 0.00 -0.72 -0.29 0.00 0.02 0.00 0.00 54.97 53.98 3mnk s GLU 236 Cb 0.00 -2.73 -0.13 0.00 0.10 0.00 0.00 34.13 31.37 3mnk s GLU 236 CO 0.00 0.03 1.23 -2.30 0.02 0.00 0.00 175.26 174.23 3mnk n PRO 237 N -1.76 1.86 -2.31 0.39 -0.02 -1.26 -4.90 135.00 126.99 3mnk n PRO 237 Ca -0.02 0.66 -0.42 0.00 -2.02 0.00 0.00 63.50 61.69 3mnk n PRO 237 Cb 0.58 -2.19 -0.03 0.00 -0.02 0.00 0.00 33.50 31.84 3mnk n PRO 237 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3mnk s GLU 238 N -1.49 4.28 -0.18 -0.52 2.12 -1.26 -4.80 118.70 116.85 3mnk s GLU 238 Ca 0.59 1.84 -0.00 0.00 0.36 0.00 0.00 54.97 57.76 3mnk s GLU 238 Cb -0.63 -3.64 0.04 0.00 0.26 0.00 0.00 34.13 30.17 3mnk s GLU 238 CO 0.59 -0.59 -0.06 -2.00 -0.54 0.00 0.00 175.26 172.67 3mnk s GLU 239 N 2.69 1.50 0.40 4.30 2.12 -1.26 -5.08 118.70 123.38 3mnk s GLU 239 Ca 0.61 -0.60 -0.26 0.00 0.36 0.00 0.00 54.97 55.08 3mnk s GLU 239 Cb -0.28 -2.12 -0.09 0.00 0.26 0.00 0.00 34.13 31.91 3mnk s GLU 239 CO 0.23 -0.45 1.20 -0.51 -0.54 0.00 0.00 175.26 175.19 3mnk s LEU 240 N 1.59 4.21 -0.86 2.70 1.43 -1.26 -1.50 118.68 124.99 3mnk s LEU 240 Ca -0.00 2.43 -0.21 0.00 -1.03 0.00 0.00 54.13 55.32 3mnk s LEU 240 Cb -0.16 -3.97 0.10 0.00 0.03 0.00 0.00 46.19 42.19 3mnk s LEU 240 CO -0.08 -0.71 1.14 -0.32 0.23 0.00 0.00 176.35 176.62 3mnk s MET 241 N -2.25 3.44 0.05 1.70 -2.45 0.49 -4.63 119.30 115.67 3mnk s MET 241 Ca 0.57 -1.34 -0.02 0.00 -1.25 0.00 0.00 55.69 53.64 3mnk s MET 241 Cb -0.33 -4.77 -0.03 0.00 1.25 0.00 0.00 34.83 30.95 3mnk s MET 241 CO 0.41 -1.87 0.01 0.14 1.05 0.00 0.00 175.02 174.77 3mnk s VAL 242 N 3.55 0.20 -1.33 10.11 -7.23 -1.26 -4.50 120.40 119.94 3mnk s VAL 242 Ca 0.32 -1.63 -0.02 0.00 -1.81 0.00 0.00 61.98 58.84 3mnk s VAL 242 Cb -0.08 -1.41 0.01 0.00 0.56 0.00 0.00 36.38 35.47 3mnk s VAL 242 CO -0.03 -0.90 0.78 0.47 -0.31 0.00 0.00 175.10 175.10 3mnk n ASP 243 N 0.18 -1.87 -2.98 4.85 8.00 -0.15 -4.86 116.55 119.71 3mnk n ASP 243 Ca -0.15 -0.79 -0.37 0.00 0.71 0.00 0.00 54.79 54.19 3mnk n ASP 243 Cb 0.61 -4.15 0.01 0.00 -0.02 0.00 0.00 41.12 37.57 3mnk n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3mnk n ASN 244 N -3.03 7.32 -4.31 -2.24 6.94 -1.07 -4.90 115.26 113.97 3mnk n ASN 244 Ca -0.24 -3.64 -0.27 0.00 -0.02 0.00 0.00 54.58 50.40 3mnk n ASN 244 Cb 0.65 -1.14 -0.14 0.00 -2.36 0.00 0.00 39.78 36.80 3mnk n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 3mnk s TRP 245 N -3.45 2.04 -0.08 -2.53 1.48 -1.26 -4.62 118.94 110.52 3mnk s TRP 245 Ca 0.51 -0.39 -0.12 0.00 -1.06 0.00 0.00 56.10 55.04 3mnk s TRP 245 Cb 0.37 -1.18 -0.05 0.00 -1.16 0.00 0.00 33.47 31.45 3mnk s TRP 245 CO -0.31 0.16 0.29 0.50 -4.06 0.00 0.00 176.95 173.54 3mnk s ARG 246 N -1.47 3.85 0.78 3.25 3.52 -1.26 -4.97 118.95 122.65 3mnk s ARG 246 Ca 0.10 0.16 -0.11 0.00 -0.13 0.00 0.00 55.73 55.75 3mnk s ARG 246 Cb -0.10 -3.26 0.06 0.00 -1.56 0.00 0.00 34.95 30.09 3mnk s ARG 246 CO 0.03 0.61 1.10 -2.14 -0.81 0.00 0.00 175.30 174.09 3mnk s PRO 247 N -0.68 2.17 0.36 5.12 0.02 -1.26 -4.67 135.00 136.06 3mnk s PRO 247 Ca 0.19 1.23 -0.28 0.00 0.02 0.00 0.00 61.00 62.16 3mnk s PRO 247 Cb -0.14 -1.88 -0.12 0.00 0.02 0.00 0.00 34.50 32.38 3mnk s PRO 247 CO 0.08 -1.72 1.32 0.00 -0.33 0.00 0.00 177.00 176.35 3mnk n ALA 248 N -3.51 1.46 -2.70 -1.55 0.00 -1.26 -4.38 120.51 108.58 3mnk n ALA 248 Ca 0.09 0.34 -0.24 0.00 0.00 0.00 0.00 53.44 53.64 3mnk n ALA 248 Cb 0.53 -2.28 -0.07 0.00 0.00 0.00 0.00 19.45 17.63 3mnk n ALA 248 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3mnk s GLN 249 N -1.96 2.51 0.37 0.00 -1.52 -0.10 -4.97 119.66 113.99 3mnk s GLN 249 Ca 0.56 -1.22 -0.28 0.00 -1.95 0.00 0.00 55.36 52.47 3mnk s GLN 249 Cb -0.55 -2.34 -0.11 0.00 -0.22 0.00 0.00 33.01 29.80 3mnk s GLN 249 CO 0.62 0.40 1.45 -2.14 -0.25 0.00 0.00 175.29 175.38 3mnk s PRO 250 N -3.49 4.14 0.26 2.91 0.02 -1.26 -4.58 135.00 133.00 3mnk s PRO 250 Ca 0.31 2.51 0.05 0.00 0.02 0.00 0.00 61.00 63.88 3mnk s PRO 250 Cb -0.08 -2.98 0.34 0.00 0.02 0.00 0.00 34.50 31.81 3mnk s PRO 250 CO 0.21 -0.48 1.63 1.25 -0.33 0.00 0.00 177.00 179.27 3mnk h LEU 251 N 3.04 0.30 0.00 -5.54 5.85 -1.95 -3.44 115.31 113.58 3mnk h LEU 251 Ca -0.51 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.07 3mnk h LEU 251 Cb 1.24 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.18 3mnk h LEU 251 CO 0.64 0.75 0.00 0.29 -0.34 0.00 0.00 178.44 179.78 3mnk n LYS 252 N -3.96 0.00 -1.60 1.25 5.02 -1.26 -3.20 118.16 114.41 3mnk n LYS 252 Ca -0.02 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.97 3mnk n LYS 252 Cb 0.54 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.51 3mnk n LYS 252 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3mnk n ASN 253 N 2.62 6.74 -4.23 4.39 4.13 -1.26 -4.91 115.26 122.75 3mnk n ASN 253 Ca 0.00 -3.27 -0.23 0.00 1.68 0.00 0.00 54.58 52.76 3mnk n ASN 253 Cb 0.00 -1.23 -0.13 0.00 -1.54 0.00 0.00 39.78 36.88 3mnk n ASN 253 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 3mnk s ARG 254 N -1.92 1.14 -0.11 3.52 0.52 -1.19 -5.14 118.95 115.76 3mnk s ARG 254 Ca 0.58 -0.96 -0.00 0.00 -0.52 0.00 0.00 55.73 54.82 3mnk s ARG 254 Cb 0.37 -1.26 -0.02 0.00 0.52 0.00 0.00 34.95 34.55 3mnk s ARG 254 CO -0.23 0.31 -0.10 -1.14 0.02 0.00 0.00 175.30 174.16 3mnk s GLN 255 N -1.44 3.21 -0.07 3.54 0.74 -1.26 -5.03 119.66 119.35 3mnk s GLN 255 Ca 0.05 -0.62 -0.21 0.00 0.05 0.00 0.00 55.36 54.63 3mnk s GLN 255 Cb -0.09 -2.66 -0.04 0.00 1.10 0.00 0.00 33.01 31.32 3mnk s GLN 255 CO 0.02 0.37 0.62 0.42 -0.55 0.00 0.00 175.29 176.17 3mnk s ILE 256 N -0.03 5.06 0.05 -2.34 1.01 -1.26 -4.72 121.20 118.97 3mnk s ILE 256 Ca -0.01 1.27 0.03 0.00 0.00 0.00 0.00 60.65 61.94 3mnk s ILE 256 Cb -0.14 -3.96 -0.04 0.00 0.01 0.00 0.00 42.46 38.33 3mnk s ILE 256 CO 0.03 0.30 0.03 -0.54 0.00 0.00 0.00 174.94 174.76 3mnk s LYS 257 N 0.58 2.74 0.03 2.79 1.02 -0.41 -1.61 119.74 124.89 3mnk s LYS 257 Ca 0.33 -0.71 0.07 0.00 0.02 0.00 0.00 55.97 55.68 3mnk s LYS 257 Cb -0.17 -2.65 -0.03 0.00 -0.52 0.00 0.00 37.83 34.46 3mnk s LYS 257 CO 0.16 0.58 -0.18 0.00 -0.92 0.00 0.00 175.35 174.98 3mnk s ALA 258 N -1.26 2.58 -2.29 5.17 0.00 0.46 -0.84 121.76 125.57 3mnk s ALA 258 Ca 0.25 -1.18 0.29 0.00 0.00 0.00 0.00 51.96 51.32 3mnk s ALA 258 Cb -0.12 -0.74 1.34 0.00 0.00 0.00 0.00 23.12 23.60 3mnk s ALA 258 CO 0.17 0.57 1.91 -1.13 0.00 0.00 0.00 175.76 177.27 3mnk n SER 259 N 1.61 0.96 -4.11 0.00 3.41 0.37 -1.47 113.62 114.39 3mnk n SER 259 Ca -0.16 -1.29 -0.11 0.00 -0.26 0.00 0.00 58.87 57.05 3mnk n SER 259 Cb 0.52 -0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.38 3mnk n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3mnk s PHE 260 N -2.02 0.83 0.00 7.33 -0.71 -1.26 -4.90 117.98 117.24 3mnk s PHE 260 Ca 0.41 -1.13 0.00 0.00 -1.04 0.00 0.00 56.93 55.17 3mnk s PHE 260 Cb 0.21 -0.32 0.00 0.00 -1.21 0.00 0.00 43.02 41.70 3mnk s PHE 260 CO 0.35 -0.69 0.37 0.36 -1.34 0.00 0.00 175.22 174.27