#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lpk s VAL 17 N 0.00 5.12 0.00 1.39 1.01 0.80 -4.17 120.40 124.55 1lpk s VAL 17 Ca 0.00 0.77 0.00 0.00 0.00 0.00 0.00 61.98 62.75 1lpk s VAL 17 Cb 0.00 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.60 1lpk s VAL 17 CO 0.00 0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.84 1lpk n GLY 18 N 4.39 0.04 7.00 4.51 0.00 -1.26 -2.02 105.19 117.85 1lpk n GLY 18 Ca -0.06 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.92 1lpk n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lpk n GLY 19 N 0.00 0.10 3.12 -0.02 0.00 -1.26 -4.91 105.19 102.22 1lpk n GLY 19 Ca 0.00 -1.00 -0.08 0.00 0.00 0.00 0.00 46.02 44.95 1lpk n GLY 19 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1lpk s GLN 20 N 0.00 0.72 0.43 1.61 -1.52 0.31 -4.97 119.66 116.25 1lpk s GLN 20 Ca 0.00 -1.25 -0.24 0.00 -1.95 0.00 0.00 55.36 51.91 1lpk s GLN 20 Cb 0.00 0.23 -0.08 0.00 -0.22 0.00 0.00 33.01 32.95 1lpk s GLN 20 CO 0.00 -0.17 1.23 -1.21 -0.25 0.00 0.00 175.29 174.89 1lpk s GLU 21 N -3.95 3.84 -0.28 2.91 2.02 -1.26 0.00 118.70 121.99 1lpk s GLU 21 Ca 0.11 1.96 -0.28 0.00 0.02 0.00 0.00 54.97 56.78 1lpk s GLU 21 Cb 0.07 -2.58 0.01 0.00 0.10 0.00 0.00 34.13 31.74 1lpk s GLU 21 CO -0.07 -0.54 1.03 0.00 0.02 0.00 0.00 175.26 175.70 1lpk s LYS 23 N 3.37 1.60 -0.10 0.00 -0.14 -1.26 -4.87 119.74 118.33 1lpk s LYS 23 Ca 0.43 0.03 -0.38 0.00 -1.36 0.00 0.00 55.97 54.69 1lpk s LYS 23 Cb -0.14 -1.92 -0.16 0.00 -1.68 0.00 0.00 37.83 33.94 1lpk s LYS 23 CO 0.11 -1.84 1.59 -3.47 -0.76 0.00 0.00 175.35 170.98 1lpk n ASP 24 N -3.47 2.21 0.00 2.83 2.03 -1.26 -1.43 116.55 117.46 1lpk n ASP 24 Ca 0.09 1.09 0.00 0.00 0.52 0.00 0.00 54.79 56.49 1lpk n ASP 24 Cb 0.61 -1.19 0.00 0.00 -0.72 0.00 0.00 41.12 39.81 1lpk n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1lpk n GLY 25 N 3.51 1.33 0.15 0.27 0.00 -1.26 -4.91 105.19 104.28 1lpk n GLY 25 Ca 0.22 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.15 1lpk n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1lpk h GLU 26 N 2.24 0.30 -2.14 1.61 5.08 -1.60 -3.37 114.58 116.70 1lpk h GLU 26 Ca 0.00 -0.30 -0.53 0.00 -1.00 0.00 0.00 59.36 57.53 1lpk h GLU 26 Cb 0.00 0.08 -0.41 0.00 0.50 0.00 0.00 28.75 28.92 1lpk h GLU 26 CO 0.00 0.99 -0.92 0.00 -1.00 0.00 0.00 179.01 178.07 1lpk h PRO 28 N 2.99 0.00 -0.00 0.00 0.13 -1.80 -2.56 132.00 130.76 1lpk h PRO 28 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1lpk h PRO 28 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 1lpk h PRO 28 CO 0.66 0.05 -0.11 -2.67 -0.23 0.00 0.00 178.00 175.69 1lpk n TRP 29 N -3.31 0.00 -2.35 1.56 2.14 -1.00 -2.00 117.44 112.48 1lpk n TRP 29 Ca -0.01 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.14 1lpk n TRP 29 Cb 0.20 -0.22 -0.03 0.00 -0.81 0.00 0.00 31.31 30.45 1lpk n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1lpk s GLN 30 N -2.56 4.45 0.23 -2.67 2.00 -0.97 0.03 119.66 120.18 1lpk s GLN 30 Ca 0.27 1.89 0.10 0.00 -2.00 0.00 0.00 55.36 55.61 1lpk s GLN 30 Cb 0.20 -3.26 -0.05 0.00 0.80 0.00 0.00 33.01 30.70 1lpk s GLN 30 CO 0.49 -0.19 -0.18 0.00 -0.50 0.00 0.00 175.29 174.91 1lpk s ALA 31 N 0.39 2.36 -0.03 1.58 0.00 -0.54 -4.41 121.76 121.12 1lpk s ALA 31 Ca 0.56 -1.74 0.01 0.00 0.00 0.00 0.00 51.96 50.79 1lpk s ALA 31 Cb -0.33 -0.18 0.02 0.00 0.00 0.00 0.00 23.12 22.63 1lpk s ALA 31 CO 0.34 0.19 -0.04 -1.17 0.00 0.00 0.00 175.76 175.08 1lpk s LEU 32 N -3.31 1.42 -0.15 0.00 2.96 -0.53 -1.76 118.68 117.30 1lpk s LEU 32 Ca 0.25 -0.10 -0.18 0.00 -0.22 0.00 0.00 54.13 53.88 1lpk s LEU 32 Cb -0.03 -0.37 -0.04 0.00 0.50 0.00 0.00 46.19 46.25 1lpk s LEU 32 CO 0.11 -0.04 0.47 -0.76 -1.32 0.00 0.00 176.35 174.81 1lpk s LEU 33 N 0.74 4.22 -0.00 -0.68 1.43 0.44 -0.99 118.68 123.85 1lpk s LEU 33 Ca -0.09 0.73 0.07 0.00 -1.03 0.00 0.00 54.13 53.80 1lpk s LEU 33 Cb -0.12 -2.67 -0.03 0.00 0.03 0.00 0.00 46.19 43.40 1lpk s LEU 33 CO -0.00 -0.06 -0.21 0.27 0.23 0.00 0.00 176.35 176.58 1lpk s ILE 34 N 1.01 2.50 0.39 -0.59 -4.36 -0.40 -0.64 121.20 119.11 1lpk s ILE 34 Ca 0.24 -1.08 -0.04 0.00 -0.26 0.00 0.00 60.65 59.51 1lpk s ILE 34 Cb -0.15 -1.97 0.08 0.00 1.25 0.00 0.00 42.46 41.68 1lpk s ILE 34 CO 0.10 0.48 0.53 -0.46 0.24 0.00 0.00 174.94 175.83 1lpk n ASN 35 N 2.07 0.29 -0.34 4.36 0.23 0.12 -0.89 115.26 121.10 1lpk n ASN 35 Ca -0.16 -1.34 0.21 0.00 -0.53 0.00 0.00 54.58 52.76 1lpk n ASN 35 Cb 0.52 -0.38 0.44 0.00 -2.08 0.00 0.00 39.78 38.28 1lpk n ASN 35 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1lpk h GLU 36 N 0.00 0.42 -0.94 -3.83 4.39 -1.89 0.63 114.58 113.35 1lpk h GLU 36 Ca -0.17 -0.03 -0.29 0.00 0.34 0.00 0.00 59.36 59.22 1lpk h GLU 36 Cb 0.53 -0.09 -0.17 0.00 -0.10 0.00 0.00 28.75 28.92 1lpk h GLU 36 CO 0.15 0.28 0.36 -0.85 -1.16 0.00 0.00 179.01 177.79 1lpk n GLU 37 N -4.95 2.22 -3.98 2.33 0.00 -1.26 -4.89 120.64 110.11 1lpk n GLU 37 Ca 0.30 -2.09 -0.32 0.00 0.00 0.00 0.00 57.16 55.05 1lpk n GLU 37 Cb 0.89 -1.85 0.01 0.00 0.00 0.00 0.00 31.44 30.49 1lpk n GLU 37 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1lpk n ASN 38 N -0.43 -4.42 -4.69 -1.84 4.13 0.22 -4.97 115.26 103.25 1lpk n ASN 38 Ca 0.37 -0.82 -0.35 0.00 1.68 0.00 0.00 54.58 55.45 1lpk n ASN 38 Cb 1.23 -3.55 -0.09 0.00 -1.54 0.00 0.00 39.78 35.83 1lpk n ASN 38 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1lpk s GLU 39 N -6.69 3.60 -0.02 3.52 2.02 -1.25 -4.77 118.70 115.12 1lpk s GLU 39 Ca 0.68 -0.32 -0.30 0.00 0.02 0.00 0.00 54.97 55.05 1lpk s GLU 39 Cb -0.35 -3.09 -0.03 0.00 0.10 0.00 0.00 34.13 30.76 1lpk s GLU 39 CO 0.84 0.49 1.05 0.20 0.02 0.00 0.00 175.26 177.86 1lpk s GLY 40 N -0.25 2.61 0.00 -1.39 0.00 -1.26 0.14 107.32 107.17 1lpk s GLY 40 Ca 0.08 0.57 0.00 0.00 0.00 0.00 0.00 44.72 45.37 1lpk s GLY 40 CO 0.01 1.86 0.06 1.97 0.00 0.00 0.00 173.10 177.00 1lpk n PHE 41 N 4.29 0.00 -3.49 1.90 -1.74 0.18 -4.96 117.46 113.64 1lpk n PHE 41 Ca 0.08 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.86 1lpk n PHE 41 Cb 0.49 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.47 1lpk n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1lpk n GLY 43 N -0.36 2.50 3.78 0.00 0.00 0.22 -0.42 105.19 110.91 1lpk n GLY 43 Ca -0.14 -2.21 -0.03 0.00 0.00 0.00 0.00 46.02 43.65 1lpk n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1lpk s GLY 44 N -3.12 -0.15 -0.03 -0.02 0.00 -0.72 -3.66 107.32 99.63 1lpk s GLY 44 Ca 0.23 0.05 0.05 0.00 0.00 0.00 0.00 44.72 45.05 1lpk s GLY 44 CO 0.14 0.84 -0.17 -1.59 0.00 0.00 0.00 173.10 172.32 1lpk s THR 45 N -2.80 1.40 -0.21 0.90 2.01 0.17 -1.46 115.64 115.64 1lpk s THR 45 Ca 0.16 -0.73 -0.29 0.00 0.31 0.00 0.00 61.69 61.14 1lpk s THR 45 Cb -0.01 -1.18 0.00 0.00 0.01 0.00 0.00 72.50 71.32 1lpk s THR 45 CO 0.02 0.40 1.07 -0.63 -0.69 0.00 0.00 174.62 174.79 1lpk s ILE 46 N -0.18 4.63 -0.22 1.82 1.01 0.10 -0.68 121.20 127.69 1lpk s ILE 46 Ca 0.01 1.96 0.07 0.00 0.00 0.00 0.00 60.65 62.70 1lpk s ILE 46 Cb -0.09 -4.27 -0.21 0.00 0.01 0.00 0.00 42.46 37.91 1lpk s ILE 46 CO 0.01 -0.16 -0.05 0.18 0.00 0.00 0.00 174.94 174.92 1lpk n LEU 47 N 6.24 1.91 0.00 2.97 4.77 -0.27 -0.76 117.00 131.87 1lpk n LEU 47 Ca 0.12 -0.04 -0.03 0.00 -0.03 0.00 0.00 56.01 56.03 1lpk n LEU 47 Cb 0.46 -0.43 0.01 0.00 -2.33 0.00 0.00 43.42 41.13 1lpk n LEU 47 CO 0.53 0.77 0.19 -1.54 -1.33 0.00 0.00 177.39 176.01 1lpk n SER 48 N -3.11 -0.77 0.27 -1.43 3.41 -1.17 -4.66 113.62 106.16 1lpk n SER 48 Ca -0.39 -1.53 0.15 0.00 -0.26 0.00 0.00 58.87 56.84 1lpk n SER 48 Cb 1.05 1.29 0.76 0.00 -0.26 0.00 0.00 64.21 67.04 1lpk n SER 48 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 1lpk h GLU 49 N 0.00 0.00 0.00 4.33 4.11 -1.98 -3.14 114.58 117.90 1lpk h GLU 49 Ca -0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.32 1lpk h GLU 49 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1lpk h GLU 49 CO 0.14 0.08 -0.54 1.19 0.07 0.00 0.00 179.01 179.96 1lpk n PHE 50 N -3.33 0.00 -5.11 2.06 3.72 -1.26 0.16 117.46 113.69 1lpk n PHE 50 Ca -0.01 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.07 1lpk n PHE 50 Cb 0.26 -0.03 -0.15 0.00 -0.94 0.00 0.00 39.48 38.62 1lpk n PHE 50 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1lpk s TYR 51 N -1.85 2.51 -0.09 1.38 2.02 -1.19 0.14 117.35 120.28 1lpk s TYR 51 Ca 0.02 -0.37 0.03 0.00 -0.37 0.00 0.00 57.07 56.38 1lpk s TYR 51 Cb 0.05 -1.58 0.01 0.00 -0.40 0.00 0.00 41.96 40.04 1lpk s TYR 51 CO 0.30 0.02 -0.17 0.42 -1.57 0.00 0.00 175.55 174.55 1lpk s ILE 52 N -0.57 1.56 -0.16 2.71 -1.09 -0.39 -1.11 121.20 122.15 1lpk s ILE 52 Ca 0.08 -0.72 -0.13 0.00 -2.23 0.00 0.00 60.65 57.65 1lpk s ILE 52 Cb -0.11 -1.39 -0.05 0.00 -1.58 0.00 0.00 42.46 39.34 1lpk s ILE 52 CO 0.00 0.45 0.27 -0.22 -1.23 0.00 0.00 174.94 174.21 1lpk s LEU 53 N 0.57 4.24 0.00 2.97 2.96 0.15 -0.49 118.68 129.08 1lpk s LEU 53 Ca -0.15 0.47 0.00 0.00 -0.22 0.00 0.00 54.13 54.23 1lpk s LEU 53 Cb -0.17 -2.33 -0.00 0.00 0.50 0.00 0.00 46.19 44.19 1lpk s LEU 53 CO 0.05 0.12 0.24 1.07 -1.32 0.00 0.00 176.35 176.51 1lpk n THR 54 N 3.51 0.00 -3.53 3.68 5.66 0.34 -0.66 114.28 123.28 1lpk n THR 54 Ca -0.13 -1.09 -0.38 0.00 -3.05 0.00 0.00 64.05 59.40 1lpk n THR 54 Cb 0.52 0.63 -0.06 0.00 -1.55 0.00 0.00 70.33 69.87 1lpk n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1lpk s ALA 55 N -2.38 3.69 0.48 1.79 0.00 -1.26 -0.78 121.76 123.30 1lpk s ALA 55 Ca 0.18 -0.29 0.17 0.00 0.00 0.00 0.00 51.96 52.02 1lpk s ALA 55 Cb -0.00 -2.36 1.19 0.00 0.00 0.00 0.00 23.12 21.95 1lpk s ALA 55 CO 0.13 0.42 2.07 0.00 0.00 0.00 0.00 175.76 178.38 1lpk h ALA 56 N 5.09 1.74 0.00 0.00 0.00 -1.70 -2.09 119.26 122.31 1lpk h ALA 56 Ca -0.50 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.28 1lpk h ALA 56 Cb 1.21 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1lpk h ALA 56 CO 0.64 0.13 -0.15 1.12 0.00 0.00 0.00 179.25 180.99 1lpk h HIS 57 N 0.00 0.00 -0.03 0.00 2.07 -1.92 -2.71 115.15 112.56 1lpk h HIS 57 Ca -0.00 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.41 1lpk h HIS 57 Cb 0.20 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.16 1lpk h HIS 57 CO 0.00 0.15 -0.49 0.00 -3.07 0.00 0.00 177.93 174.52 1lpk h LEU 59 N 0.07 0.00 0.00 0.00 3.38 -1.58 -1.19 115.31 115.98 1lpk h LEU 59 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1lpk h LEU 59 Cb 0.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1lpk h LEU 59 CO 0.07 0.00 -0.76 1.88 0.09 0.00 0.00 178.44 179.72 1lpk h TYR 60 N 0.00 0.00 -0.00 1.13 0.05 -1.67 -3.35 116.97 113.13 1lpk h TYR 60 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1lpk h TYR 60 Cb 0.03 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.77 1lpk h TYR 60 CO 0.00 0.00 -0.03 0.00 -1.05 0.00 0.00 178.16 177.08 1lpk n GLN 61 N -2.40 0.73 -3.66 4.88 0.00 -0.45 -4.74 117.38 111.74 1lpk n GLN 61 Ca 0.02 -0.10 -0.06 0.00 0.00 0.00 0.00 57.00 56.85 1lpk n GLN 61 Cb 0.49 -1.50 -0.08 0.00 0.00 0.00 0.00 30.24 29.16 1lpk n GLN 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1lpk s ALA 61 N -2.34 -1.54 0.41 2.61 0.00 -1.26 -5.02 121.76 114.63 1lpk s ALA 61 Ca 0.35 1.93 0.14 0.00 0.00 0.00 0.00 51.96 54.37 1lpk s ALA 61 Cb 0.21 -1.42 0.87 0.00 0.00 0.00 0.00 23.12 22.78 1lpk s ALA 61 CO 0.43 -0.67 1.92 1.57 0.00 0.00 0.00 175.76 179.01 1lpk h LYS 62 N 7.76 0.00 -3.34 0.00 2.10 -1.85 -3.42 116.57 117.82 1lpk h LYS 62 Ca -0.22 0.00 -0.23 0.00 -2.00 0.00 0.00 60.65 58.20 1lpk h LYS 62 Cb 1.14 0.00 -0.30 0.00 -0.90 0.00 0.00 32.23 32.17 1lpk h LYS 62 CO 0.15 0.27 -0.60 1.03 -2.00 0.00 0.00 179.45 178.29 1lpk s ARG 63 N -4.44 0.10 0.16 0.07 0.52 -1.26 -5.14 118.95 108.96 1lpk s ARG 63 Ca -0.03 0.28 -0.16 0.00 -0.52 0.00 0.00 55.73 55.30 1lpk s ARG 63 Cb 0.15 -0.10 0.03 0.00 0.52 0.00 0.00 34.95 35.55 1lpk s ARG 63 CO 0.71 -0.11 0.45 -0.59 0.02 0.00 0.00 175.30 175.78 1lpk s PHE 64 N 0.77 -0.10 0.42 -0.53 -0.71 -1.26 -3.29 117.98 113.29 1lpk s PHE 64 Ca -0.06 -0.24 0.03 0.00 -1.04 0.00 0.00 56.93 55.63 1lpk s PHE 64 Cb -0.08 0.29 -0.02 0.00 -1.21 0.00 0.00 43.02 42.00 1lpk s PHE 64 CO -0.04 -0.81 0.11 0.15 -1.34 0.00 0.00 175.22 173.29 1lpk s LYS 65 N -3.86 1.97 -0.15 1.99 1.02 -0.07 -4.54 119.74 116.11 1lpk s LYS 65 Ca 0.08 -2.21 0.01 0.00 0.02 0.00 0.00 55.97 53.86 1lpk s LYS 65 Cb 0.01 -0.77 0.02 0.00 -0.52 0.00 0.00 37.83 36.56 1lpk s LYS 65 CO -0.06 -0.45 -0.16 0.08 -0.92 0.00 0.00 175.35 173.84 1lpk s VAL 66 N -3.15 1.69 -0.11 3.17 1.01 -0.23 -1.27 120.40 121.52 1lpk s VAL 66 Ca 0.21 -0.72 -0.05 0.00 0.00 0.00 0.00 61.98 61.43 1lpk s VAL 66 Cb 0.02 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 1lpk s VAL 66 CO 0.13 0.48 0.07 -0.60 0.00 0.00 0.00 175.10 175.17 1lpk s ARG 67 N 1.36 3.31 0.15 2.72 3.52 -0.16 -0.29 118.95 129.57 1lpk s ARG 67 Ca 0.03 -0.28 0.07 0.00 -0.13 0.00 0.00 55.73 55.42 1lpk s ARG 67 Cb -0.13 -3.02 -0.04 0.00 -1.56 0.00 0.00 34.95 30.20 1lpk s ARG 67 CO -0.10 0.67 -0.14 0.14 -0.81 0.00 0.00 175.30 175.06 1lpk s VAL 68 N -0.77 1.49 0.00 7.11 -7.23 0.45 -1.46 120.40 119.99 1lpk s VAL 68 Ca 0.13 -1.89 0.00 0.00 -1.81 0.00 0.00 61.98 58.40 1lpk s VAL 68 Cb -0.12 -1.73 0.00 0.00 0.56 0.00 0.00 36.38 35.09 1lpk s VAL 68 CO 0.03 -0.47 0.00 0.61 -0.31 0.00 0.00 175.10 174.96 1lpk n GLY 69 N 0.22 0.59 3.84 2.32 0.00 -1.23 -0.56 105.19 110.38 1lpk n GLY 69 Ca -0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.52 1lpk n GLY 69 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1lpk s ASP 70 N -2.14 6.78 0.00 1.61 2.15 -1.26 -3.88 116.67 119.92 1lpk s ASP 70 Ca 0.00 0.94 0.00 0.00 0.43 0.00 0.00 52.55 53.92 1lpk s ASP 70 Cb 0.00 -2.24 0.00 0.00 -0.30 0.00 0.00 42.92 40.38 1lpk s ASP 70 CO 0.00 0.28 0.00 0.54 -0.17 0.00 0.00 175.17 175.82 1lpk n ARG 71 N 1.55 3.07 -3.62 4.34 1.74 -1.26 -4.90 116.66 117.58 1lpk n ARG 71 Ca -0.12 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.69 1lpk n ARG 71 Cb 0.52 -0.72 -0.16 0.00 -1.02 0.00 0.00 32.46 31.08 1lpk n ARG 71 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1lpk s ASN 72 N -1.06 2.74 0.23 0.55 3.04 -1.26 -1.10 114.94 118.09 1lpk s ASN 72 Ca 0.00 -0.82 -0.06 0.00 0.04 0.00 0.00 52.86 52.02 1lpk s ASN 72 Cb 0.00 -0.34 0.32 0.00 -1.54 0.00 0.00 41.25 39.69 1lpk s ASN 72 CO 0.00 -0.36 1.83 0.71 -3.04 0.00 0.00 177.10 176.23 1lpk h THR 73 N 6.43 0.99 -0.13 -5.21 1.35 -1.00 -2.52 112.91 112.83 1lpk h THR 73 Ca -0.16 -0.29 -0.01 0.00 -0.55 0.00 0.00 66.41 65.40 1lpk h THR 73 Cb 1.11 0.07 -0.01 0.00 -1.73 0.00 0.00 68.15 67.60 1lpk h THR 73 CO 0.33 0.15 0.02 -1.84 -0.25 0.00 0.00 175.52 173.93 1lpk n GLU 74 N -4.70 1.74 -4.23 4.72 0.28 -1.26 -4.84 120.64 112.36 1lpk n GLU 74 Ca 0.11 -0.65 -0.14 0.00 -0.16 0.00 0.00 57.16 56.33 1lpk n GLU 74 Cb 0.20 -1.61 -0.10 0.00 1.43 0.00 0.00 31.44 31.36 1lpk n GLU 74 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 177.13 175.83 1lpk s GLN 75 N -1.28 1.35 -0.53 3.44 2.00 -0.95 -5.12 119.66 118.56 1lpk s GLN 75 Ca 0.11 -1.73 0.04 0.00 -2.00 0.00 0.00 55.36 51.78 1lpk s GLN 75 Cb 0.09 0.25 0.15 0.00 0.80 0.00 0.00 33.01 34.30 1lpk s GLN 75 CO 0.03 -0.45 0.35 -1.21 -0.50 0.00 0.00 175.29 173.51 1lpk s GLU 76 N -3.98 1.68 0.00 1.67 0.41 -1.26 -4.87 118.70 112.34 1lpk s GLU 76 Ca 0.39 -2.54 0.01 0.00 -0.41 0.00 0.00 54.97 52.42 1lpk s GLU 76 Cb 0.06 -2.62 0.04 0.00 -1.78 0.00 0.00 34.13 29.83 1lpk s GLU 76 CO 0.16 -1.24 0.61 -1.91 -0.49 0.00 0.00 175.26 172.39 1lpk n GLU 77 N 2.83 0.58 0.00 1.61 2.13 -1.26 -4.83 120.64 121.70 1lpk n GLU 77 Ca 0.16 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.98 1lpk n GLU 77 Cb 0.37 -1.02 0.00 0.00 0.27 0.00 0.00 31.44 31.06 1lpk n GLU 77 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1lpk n GLY 78 N 0.08 1.18 0.14 8.31 0.00 -1.26 -4.66 105.19 108.99 1lpk n GLY 78 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.17 1lpk n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lpk n GLY 79 N -0.90 -0.85 3.78 -0.02 0.00 -1.26 -4.91 105.19 101.03 1lpk n GLY 79 Ca 0.00 -0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.40 1lpk n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1lpk s GLU 80 N -2.40 3.17 -0.19 1.61 8.01 -1.25 -4.41 118.70 123.24 1lpk s GLU 80 Ca 0.31 1.38 -0.13 0.00 0.01 0.00 0.00 54.97 56.54 1lpk s GLU 80 Cb 0.20 -2.00 0.06 0.00 -4.31 0.00 0.00 34.13 28.08 1lpk s GLU 80 CO 0.46 -0.95 0.48 0.00 0.01 0.00 0.00 175.26 175.26 1lpk s ALA 81 N -2.22 -1.24 -0.18 5.21 0.00 0.28 -4.96 121.76 118.66 1lpk s ALA 81 Ca 0.67 1.63 -0.09 0.00 0.00 0.00 0.00 51.96 54.17 1lpk s ALA 81 Cb -0.19 -0.97 -0.05 0.00 0.00 0.00 0.00 23.12 21.91 1lpk s ALA 81 CO 0.35 -0.27 0.14 0.08 0.00 0.00 0.00 175.76 176.05 1lpk s VAL 82 N 1.07 5.43 -0.06 0.00 1.01 -1.26 -0.41 120.40 126.18 1lpk s VAL 82 Ca -0.07 0.21 0.03 0.00 0.00 0.00 0.00 61.98 62.15 1lpk s VAL 82 Cb -0.06 -3.46 0.01 0.00 0.00 0.00 0.00 36.38 32.87 1lpk s VAL 82 CO -0.10 0.48 -0.13 -1.00 0.00 0.00 0.00 175.10 174.36 1lpk s HIS 83 N 0.01 1.43 0.33 5.22 3.76 0.61 -4.99 115.29 121.65 1lpk s HIS 83 Ca 0.10 -0.49 -0.18 0.00 -0.15 0.00 0.00 55.06 54.34 1lpk s HIS 83 Cb -0.11 -1.03 -0.09 0.00 1.11 0.00 0.00 32.58 32.45 1lpk s HIS 83 CO -0.00 -0.24 0.80 -1.21 -0.85 0.00 0.00 174.74 173.24 1lpk s GLU 84 N 0.50 4.14 -0.05 1.40 2.02 -1.26 -1.06 118.70 124.39 1lpk s GLU 84 Ca -0.11 0.85 -0.25 0.00 0.02 0.00 0.00 54.97 55.47 1lpk s GLU 84 Cb -0.14 -2.48 -0.03 0.00 0.10 0.00 0.00 34.13 31.58 1lpk s GLU 84 CO 0.03 0.16 0.78 0.08 0.02 0.00 0.00 175.26 176.34 1lpk s VAL 85 N -1.93 4.99 -0.21 2.63 1.01 -1.26 -1.94 120.40 123.69 1lpk s VAL 85 Ca 0.54 1.62 -0.21 0.00 0.00 0.00 0.00 61.98 63.93 1lpk s VAL 85 Cb -0.12 -4.12 -0.19 0.00 0.00 0.00 0.00 36.38 31.95 1lpk s VAL 85 CO 0.17 0.22 0.19 1.21 0.00 0.00 0.00 175.10 176.89 1lpk n GLU 86 N 3.86 0.57 -4.68 2.72 2.13 0.98 -4.76 120.64 121.46 1lpk n GLU 86 Ca 0.01 0.56 -0.24 0.00 0.66 0.00 0.00 57.16 58.15 1lpk n GLU 86 Cb 0.51 -1.74 -0.16 0.00 0.27 0.00 0.00 31.44 30.32 1lpk n GLU 86 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1lpk s VAL 87 N -2.37 1.21 -0.25 6.31 1.01 -0.71 -4.98 120.40 120.62 1lpk s VAL 87 Ca -0.29 -0.58 -0.06 0.00 0.00 0.00 0.00 61.98 61.04 1lpk s VAL 87 Cb 0.06 -1.06 -0.01 0.00 0.00 0.00 0.00 36.38 35.37 1lpk s VAL 87 CO 0.59 0.36 0.03 -0.69 0.00 0.00 0.00 175.10 175.39 1lpk s VAL 88 N 0.18 3.92 -0.46 2.92 1.01 -1.26 -0.48 120.40 126.24 1lpk s VAL 88 Ca -0.05 -0.38 0.02 0.00 0.00 0.00 0.00 61.98 61.56 1lpk s VAL 88 Cb -0.11 -2.86 0.12 0.00 0.00 0.00 0.00 36.38 33.53 1lpk s VAL 88 CO 0.02 0.32 0.21 -0.63 0.00 0.00 0.00 175.10 175.01 1lpk s ILE 89 N 1.55 2.79 -0.04 2.22 1.01 0.57 -5.01 121.20 124.28 1lpk s ILE 89 Ca 0.05 -2.73 -0.09 0.00 0.00 0.00 0.00 60.65 57.89 1lpk s ILE 89 Cb -0.15 -2.94 -0.05 0.00 0.01 0.00 0.00 42.46 39.33 1lpk s ILE 89 CO 0.01 -0.73 0.26 -0.75 0.00 0.00 0.00 174.94 173.73 1lpk s LYS 90 N 0.38 3.61 0.09 2.79 2.20 -1.26 -0.24 119.74 127.31 1lpk s LYS 90 Ca 0.13 0.02 -0.33 0.00 -0.36 0.00 0.00 55.97 55.43 1lpk s LYS 90 Cb -0.22 -3.15 -0.12 0.00 -1.51 0.00 0.00 37.83 32.83 1lpk s LYS 90 CO -0.04 0.70 1.75 1.58 -0.36 0.00 0.00 175.35 178.98 1lpk n HIS 91 N 1.57 2.42 -0.09 4.03 -0.00 -0.71 -4.87 115.22 117.57 1lpk n HIS 91 Ca -0.15 0.05 0.13 0.00 -0.00 0.00 0.00 57.72 57.75 1lpk n HIS 91 Cb 0.53 -2.64 0.51 0.00 -0.00 0.00 0.00 29.99 28.40 1lpk n HIS 91 CO 0.00 0.00 0.00 -2.95 -0.00 0.00 0.00 176.34 173.39 1lpk h ASN 92 N 7.66 0.35 -0.38 0.26 -1.07 -1.93 -1.33 115.58 119.12 1lpk h ASN 92 Ca -0.46 0.01 0.00 0.00 0.07 0.00 0.00 56.30 55.92 1lpk h ASN 92 Cb 1.25 -0.06 0.00 0.00 -2.07 0.00 0.00 38.32 37.43 1lpk h ASN 92 CO 0.93 0.21 0.00 0.54 0.07 0.00 0.00 177.43 179.17 1lpk n ARG 93 N -4.47 3.12 -2.23 4.14 1.74 -1.26 -4.94 116.66 112.76 1lpk n ARG 93 Ca 0.10 -1.90 -0.41 0.00 -0.77 0.00 0.00 57.85 54.88 1lpk n ARG 93 Cb 0.40 -1.83 -0.03 0.00 -1.02 0.00 0.00 32.46 29.98 1lpk n ARG 93 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1lpk s PHE 94 N -1.93 3.23 -0.09 -1.55 5.36 -0.50 -4.58 117.98 117.91 1lpk s PHE 94 Ca 0.33 1.44 -0.00 0.00 -0.96 0.00 0.00 56.93 57.74 1lpk s PHE 94 Cb 0.24 -3.56 0.02 0.00 -0.34 0.00 0.00 43.02 39.38 1lpk s PHE 94 CO 0.13 -1.53 -0.05 -0.08 -1.46 0.00 0.00 175.22 172.22 1lpk s THR 95 N -0.84 0.82 0.14 0.12 -1.32 -0.84 -4.98 115.64 108.74 1lpk s THR 95 Ca 0.50 -0.17 0.33 0.00 -1.21 0.00 0.00 61.69 61.14 1lpk s THR 95 Cb -0.37 -0.87 0.35 0.00 -1.51 0.00 0.00 72.50 70.09 1lpk s THR 95 CO 0.46 0.33 2.01 0.50 -2.21 0.00 0.00 174.62 175.71 1lpk h LYS 96 N 8.10 0.00 0.43 7.08 1.63 -1.95 0.48 116.57 132.34 1lpk h LYS 96 Ca -0.27 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.50 1lpk h LYS 96 Cb 1.13 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.77 1lpk h LYS 96 CO 0.37 0.00 -0.21 0.93 -3.45 0.00 0.00 179.45 177.09 1lpk h GLU 97 N 0.00 -0.56 0.00 1.90 4.39 -1.96 -3.36 114.58 114.98 1lpk h GLU 97 Ca 0.00 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.74 1lpk h GLU 97 Cb 0.18 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 1lpk h GLU 97 CO 0.00 -0.25 -1.42 0.25 -1.16 0.00 0.00 179.01 176.43 1lpk n THR 98 N -5.22 0.00 -1.19 1.13 -2.24 -1.15 -4.97 114.28 100.63 1lpk n THR 98 Ca -0.10 -0.28 -0.06 0.00 -2.27 0.00 0.00 64.05 61.34 1lpk n THR 98 Cb 0.29 0.46 -0.03 0.00 -2.10 0.00 0.00 70.33 68.96 1lpk n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1lpk n TYR 99 N -1.84 -0.00 -2.52 4.78 4.02 0.17 -4.98 117.16 116.79 1lpk n TYR 99 Ca -0.01 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.54 1lpk n TYR 99 Cb 0.39 -1.40 -0.03 0.00 -0.02 0.00 0.00 39.34 38.28 1lpk n TYR 99 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1lpk s ASP 100 N -2.93 6.39 -1.38 7.72 2.15 -1.21 -3.36 116.67 124.04 1lpk s ASP 100 Ca 0.00 1.98 -0.09 0.00 0.43 0.00 0.00 52.55 54.86 1lpk s ASP 100 Cb 0.00 -2.57 0.02 0.00 -0.30 0.00 0.00 42.92 40.07 1lpk s ASP 100 CO 0.00 -0.75 1.14 0.49 -0.17 0.00 0.00 175.17 175.89 1lpk n PHE 101 N -0.78 -2.76 -2.33 -5.34 3.01 -1.26 -1.98 117.46 106.02 1lpk n PHE 101 Ca 0.08 1.00 -0.42 0.00 1.01 0.00 0.00 57.45 59.12 1lpk n PHE 101 Cb 0.52 -4.86 -0.01 0.00 -0.01 0.00 0.00 39.48 35.12 1lpk n PHE 101 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1lpk n ASP 102 N -2.99 4.52 -3.73 4.37 2.03 -1.21 -4.25 116.55 115.29 1lpk n ASP 102 Ca 0.00 -2.88 -0.14 0.00 0.52 0.00 0.00 54.79 52.29 1lpk n ASP 102 Cb 0.56 -1.72 -0.09 0.00 -0.72 0.00 0.00 41.12 39.15 1lpk n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1lpk s ILE 103 N 4.53 0.02 -0.06 5.18 2.07 -1.26 -4.04 121.20 127.64 1lpk s ILE 103 Ca 0.54 -0.15 -0.16 0.00 -1.41 0.00 0.00 60.65 59.47 1lpk s ILE 103 Cb 0.06 -0.62 0.03 0.00 0.13 0.00 0.00 42.46 42.06 1lpk s ILE 103 CO 0.05 -0.08 0.36 0.00 -1.91 0.00 0.00 174.94 173.36 1lpk s ALA 104 N -0.35 -0.92 -0.05 1.50 0.00 0.04 -1.74 121.76 120.23 1lpk s ALA 104 Ca -0.05 0.65 0.06 0.00 0.00 0.00 0.00 51.96 52.62 1lpk s ALA 104 Cb -0.03 -0.16 -0.01 0.00 0.00 0.00 0.00 23.12 22.92 1lpk s ALA 104 CO 0.02 -0.24 -0.24 0.08 0.00 0.00 0.00 175.76 175.37 1lpk s VAL 105 N -0.83 1.99 -0.14 0.00 1.01 0.67 -0.51 120.40 122.60 1lpk s VAL 105 Ca -0.09 -1.04 -0.01 0.00 0.00 0.00 0.00 61.98 60.84 1lpk s VAL 105 Cb -0.04 -1.68 -0.01 0.00 0.00 0.00 0.00 36.38 34.64 1lpk s VAL 105 CO 0.04 0.56 -0.12 -0.76 0.00 0.00 0.00 175.10 174.81 1lpk s LEU 106 N -0.22 2.71 -0.18 3.92 1.43 0.36 -0.31 118.68 126.38 1lpk s LEU 106 Ca -0.01 -0.35 -0.13 0.00 -1.03 0.00 0.00 54.13 52.61 1lpk s LEU 106 Cb -0.13 -1.62 -0.05 0.00 0.03 0.00 0.00 46.19 44.42 1lpk s LEU 106 CO 0.03 0.13 0.25 -0.60 0.23 0.00 0.00 176.35 176.39 1lpk s ARG 107 N 0.54 4.22 0.35 1.70 3.52 0.37 -1.26 118.95 128.39 1lpk s ARG 107 Ca -0.08 -0.01 -0.08 0.00 -0.13 0.00 0.00 55.73 55.43 1lpk s ARG 107 Cb -0.16 -3.44 -0.06 0.00 -1.56 0.00 0.00 34.95 29.73 1lpk s ARG 107 CO 0.04 0.21 0.66 -0.51 -0.81 0.00 0.00 175.30 174.89 1lpk s LEU 108 N 0.57 3.94 0.13 -0.88 1.43 0.12 -0.01 118.68 123.98 1lpk s LEU 108 Ca 0.14 0.92 -0.12 0.00 -1.03 0.00 0.00 54.13 54.03 1lpk s LEU 108 Cb -0.13 -3.77 -0.06 0.00 0.03 0.00 0.00 46.19 42.26 1lpk s LEU 108 CO 0.03 -0.30 1.45 0.11 0.23 0.00 0.00 176.35 177.86 1lpk h LYS 109 N 1.45 0.86 -6.45 1.70 1.57 -1.69 -3.41 116.57 110.61 1lpk h LYS 109 Ca -0.47 -0.47 -0.64 0.00 -1.87 0.00 0.00 60.65 57.20 1lpk h LYS 109 Cb 1.19 0.02 -0.25 0.00 0.08 0.00 0.00 32.23 33.27 1lpk h LYS 109 CO 0.65 1.11 -0.86 0.95 -0.57 0.00 0.00 179.45 180.73 1lpk s THR 110 N -4.35 1.93 0.58 -0.16 -4.23 -1.26 -5.03 115.64 103.11 1lpk s THR 110 Ca -0.11 -1.37 -0.18 0.00 -1.18 0.00 0.00 61.69 58.84 1lpk s THR 110 Cb 0.10 -1.67 -0.04 0.00 1.34 0.00 0.00 72.50 72.23 1lpk s THR 110 CO 0.87 0.23 1.14 -2.16 -0.54 0.00 0.00 174.62 174.16 1lpk s PRO 111 N -1.37 3.16 0.11 3.99 0.04 -1.26 -4.85 135.00 134.82 1lpk s PRO 111 Ca 0.10 1.62 -0.27 0.00 0.04 0.00 0.00 61.00 62.48 1lpk s PRO 111 Cb -0.10 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.40 1lpk s PRO 111 CO 0.03 -1.00 0.85 0.42 0.04 0.00 0.00 177.00 177.33 1lpk s ILE 112 N -1.84 4.51 -0.30 0.56 1.01 0.12 -5.00 121.20 120.27 1lpk s ILE 112 Ca 0.73 1.84 -0.14 0.00 0.00 0.00 0.00 60.65 63.08 1lpk s ILE 112 Cb -0.25 -4.21 -0.03 0.00 0.01 0.00 0.00 42.46 37.98 1lpk s ILE 112 CO 0.31 0.39 0.31 -0.89 0.00 0.00 0.00 174.94 175.07 1lpk s THR 113 N -0.36 5.21 0.33 2.92 2.01 -1.26 -4.76 115.64 119.73 1lpk s THR 113 Ca 0.41 0.28 -0.27 0.00 0.31 0.00 0.00 61.69 62.42 1lpk s THR 113 Cb -0.23 -3.69 -0.09 0.00 0.01 0.00 0.00 72.50 68.50 1lpk s THR 113 CO 0.27 0.10 1.04 -0.36 -0.69 0.00 0.00 174.62 174.98 1lpk s PHE 114 N 1.96 3.52 0.02 4.92 0.08 -1.26 -4.91 117.98 122.31 1lpk s PHE 114 Ca 0.11 1.72 -0.04 0.00 0.12 0.00 0.00 56.93 58.84 1lpk s PHE 114 Cb -0.16 -3.13 0.01 0.00 -0.57 0.00 0.00 43.02 39.17 1lpk s PHE 114 CO 0.11 -0.34 0.18 2.89 -0.10 0.00 0.00 175.22 177.95 1lpk n ARG 115 N 0.64 0.09 -1.69 0.44 1.85 0.20 -5.00 116.66 113.19 1lpk n ARG 115 Ca 0.02 -0.22 -0.44 0.00 -1.00 0.00 0.00 57.85 56.21 1lpk n ARG 115 Cb 0.48 0.30 -0.03 0.00 -1.05 0.00 0.00 32.46 32.16 1lpk n ARG 115 CO 0.00 0.00 0.00 -0.12 -0.01 0.00 0.00 177.63 177.50 1lpk n MET 116 N -0.13 2.43 -0.95 2.89 0.00 -1.26 -0.37 117.12 119.74 1lpk n MET 116 Ca -0.00 0.88 0.00 0.00 -0.00 0.00 0.00 57.70 58.58 1lpk n MET 116 Cb 0.10 -2.67 0.00 0.00 0.00 0.00 0.00 33.22 30.64 1lpk n MET 116 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1lpk n ASN 117 N 3.46 -2.09 -3.51 6.12 3.02 -1.26 -4.96 115.26 116.04 1lpk n ASN 117 Ca 0.16 0.00 -0.27 0.00 -0.03 0.00 0.00 54.58 54.44 1lpk n ASN 117 Cb 0.32 -0.92 -0.14 0.00 -0.61 0.00 0.00 39.78 38.43 1lpk n ASN 117 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1lpk s VAL 118 N -2.44 -0.10 -0.08 2.41 1.01 0.51 -3.54 120.40 118.17 1lpk s VAL 118 Ca 0.00 -0.81 -0.23 0.00 0.00 0.00 0.00 61.98 60.93 1lpk s VAL 118 Cb 0.00 -0.99 0.05 0.00 0.00 0.00 0.00 36.38 35.44 1lpk s VAL 118 CO 0.00 -0.71 0.53 0.00 0.00 0.00 0.00 175.10 174.92 1lpk s ALA 119 N 2.03 -1.37 0.47 5.51 0.00 -0.85 -0.63 121.76 126.93 1lpk s ALA 119 Ca 0.10 1.06 -0.19 0.00 0.00 0.00 0.00 51.96 52.93 1lpk s ALA 119 Cb -0.16 -0.19 -0.09 0.00 0.00 0.00 0.00 23.12 22.67 1lpk s ALA 119 CO -0.32 -0.31 0.98 -1.25 0.00 0.00 0.00 175.76 174.86 1lpk s PRO 120 N -0.89 4.04 0.27 0.00 0.04 -1.26 -2.38 135.00 134.82 1lpk s PRO 120 Ca -0.09 1.12 -0.06 0.00 0.04 0.00 0.00 61.00 62.02 1lpk s PRO 120 Cb -0.03 -2.15 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 1lpk s PRO 120 CO 0.06 -0.20 0.54 0.00 0.04 0.00 0.00 177.00 177.44 1lpk s ALA 121 N -2.27 3.63 0.27 8.56 0.00 0.06 -4.87 121.76 127.13 1lpk s ALA 121 Ca 0.62 -0.52 -0.25 0.00 0.00 0.00 0.00 51.96 51.81 1lpk s ALA 121 Cb -0.11 -2.31 -0.09 0.00 0.00 0.00 0.00 23.12 20.61 1lpk s ALA 121 CO 0.20 0.30 0.88 0.00 0.00 0.00 0.00 175.76 177.14 1lpk s LEU 123 N -1.79 4.25 0.75 0.00 1.43 -1.26 -0.69 118.68 121.38 1lpk s LEU 123 Ca 0.46 0.74 -0.02 0.00 -1.03 0.00 0.00 54.13 54.27 1lpk s LEU 123 Cb -0.20 -2.64 0.14 0.00 0.03 0.00 0.00 46.19 43.52 1lpk s LEU 123 CO 0.25 -0.01 1.03 -2.16 0.23 0.00 0.00 176.35 175.69 1lpk s PRO 124 N 0.73 1.54 -0.07 1.29 0.04 -1.26 -4.98 135.00 132.29 1lpk s PRO 124 Ca 0.24 -1.08 -0.16 0.00 0.04 0.00 0.00 61.00 60.04 1lpk s PRO 124 Cb -0.15 -2.28 -0.05 0.00 0.04 0.00 0.00 34.50 32.06 1lpk s PRO 124 CO 0.09 -1.57 0.40 -1.21 0.04 0.00 0.00 177.00 174.76 1lpk s GLU 124 N -5.22 4.12 0.07 4.56 2.02 -1.26 -4.97 118.70 118.01 1lpk s GLU 124 Ca 0.67 0.35 -0.17 0.00 0.02 0.00 0.00 54.97 55.84 1lpk s GLU 124 Cb -0.05 -3.33 -0.06 0.00 0.10 0.00 0.00 34.13 30.79 1lpk s GLU 124 CO 0.45 0.43 1.29 -0.09 0.02 0.00 0.00 175.26 177.36 1lpk h ARG 125 N 5.77 -0.21 -0.38 1.61 2.43 -1.98 0.35 114.38 121.98 1lpk h ARG 125 Ca -0.46 0.01 0.07 0.00 -0.81 0.00 0.00 59.98 58.80 1lpk h ARG 125 Cb 1.20 0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 30.72 1lpk h ARG 125 CO 0.69 -0.14 -0.07 -0.44 -1.51 0.00 0.00 179.97 178.50 1lpk h ASP 126 N -0.22 -0.30 -0.60 -3.80 3.32 -1.95 0.11 116.42 112.98 1lpk h ASP 126 Ca 0.04 0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.12 1lpk h ASP 126 Cb 0.32 0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 1lpk h ASP 126 CO -0.31 -0.10 0.10 -0.25 -1.72 0.00 0.00 179.24 176.96 1lpk h TRP 127 N 0.03 1.06 -0.37 4.55 7.01 -1.95 -0.56 115.95 125.71 1lpk h TRP 127 Ca 0.18 -0.14 -0.00 0.00 2.11 0.00 0.00 58.89 61.04 1lpk h TRP 127 Cb 0.28 -0.29 -0.02 0.00 -2.10 0.00 0.00 29.16 27.03 1lpk h TRP 127 CO -0.32 0.91 0.23 0.00 -2.79 0.00 0.00 178.44 176.47 1lpk h ALA 128 N 1.02 0.48 -0.55 2.65 0.00 0.49 0.67 119.26 124.02 1lpk h ALA 128 Ca 0.18 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 1lpk h ALA 128 Cb 0.42 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1lpk h ALA 128 CO 0.01 -0.03 -0.10 0.93 0.00 0.00 0.00 179.25 180.06 1lpk h GLU 129 N 0.49 1.05 0.00 0.00 5.08 -0.65 0.16 114.58 120.71 1lpk h GLU 129 Ca 0.13 -0.38 -0.19 0.00 -1.00 0.00 0.00 59.36 57.93 1lpk h GLU 129 Cb -0.01 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1lpk h GLU 129 CO -0.03 1.08 -1.26 0.66 -1.00 0.00 0.00 179.01 178.46 1lpk h SER 130 N 0.93 0.00 0.00 1.42 4.64 -0.95 -3.37 113.55 116.22 1lpk h SER 130 Ca 0.14 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.25 1lpk h SER 130 Cb 0.67 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.72 1lpk h SER 130 CO 0.05 0.69 -1.80 0.41 -0.87 0.00 0.00 176.83 175.31 1lpk n THR 131 N -3.03 0.80 -0.07 2.95 -1.04 0.23 -4.48 114.28 109.64 1lpk n THR 131 Ca -0.08 -0.28 -0.13 0.00 -2.04 0.00 0.00 64.05 61.52 1lpk n THR 131 Cb 0.87 -1.19 -0.12 0.00 -1.82 0.00 0.00 70.33 68.07 1lpk n THR 131 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1lpk h LEU 131 N -0.15 -0.00 0.00 -4.42 3.38 -0.87 -3.31 115.31 109.94 1lpk h LEU 131 Ca -0.33 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 56.71 1lpk h LEU 131 Cb 1.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.19 1lpk h LEU 131 CO -0.10 0.96 0.00 0.23 0.09 0.00 0.00 178.44 179.62 1lpk n MET 131 N -4.62 0.54 0.00 1.13 2.81 0.34 -1.71 117.12 115.60 1lpk n MET 131 Ca -0.09 0.00 0.09 0.00 -1.81 0.00 0.00 57.70 55.89 1lpk n MET 131 Cb 0.45 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.45 1lpk n MET 131 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1lpk n THR 132 N -1.00 0.00 -1.05 2.03 -2.24 -1.25 -4.95 114.28 105.82 1lpk n THR 132 Ca 0.13 -0.28 -0.30 0.00 -2.27 0.00 0.00 64.05 61.34 1lpk n THR 132 Cb 0.06 1.21 0.16 0.00 -2.10 0.00 0.00 70.33 69.65 1lpk n THR 132 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1lpk s GLN 133 N -2.24 0.96 0.14 -0.78 -1.52 -0.69 -4.94 119.66 110.58 1lpk s GLN 133 Ca 0.15 0.93 -0.11 0.00 -1.95 0.00 0.00 55.36 54.38 1lpk s GLN 133 Cb 0.15 -1.77 -0.03 0.00 -0.22 0.00 0.00 33.01 31.15 1lpk s GLN 133 CO 0.51 -2.48 1.50 0.87 -0.25 0.00 0.00 175.29 175.45 1lpk h LYS 134 N -1.73 0.93 -4.91 2.91 1.57 -1.92 -3.42 116.57 110.01 1lpk h LYS 134 Ca -0.50 -0.44 -0.44 0.00 -1.87 0.00 0.00 60.65 57.40 1lpk h LYS 134 Cb 1.29 -0.01 -0.14 0.00 0.08 0.00 0.00 32.23 33.45 1lpk h LYS 134 CO 0.52 1.10 -0.55 0.95 -0.57 0.00 0.00 179.45 180.90 1lpk s THR 135 N -4.54 0.35 0.31 -0.16 -4.23 -1.26 -0.89 115.64 105.21 1lpk s THR 135 Ca -0.11 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.42 1lpk s THR 135 Cb 0.11 -2.49 -0.02 0.00 1.34 0.00 0.00 72.50 71.44 1lpk s THR 135 CO 0.87 0.00 0.32 -0.83 -0.54 0.00 0.00 174.62 174.44 1lpk s GLY 136 N -3.40 1.85 -0.05 3.99 0.00 -0.19 -4.74 107.32 104.77 1lpk s GLY 136 Ca 0.35 -1.79 0.03 0.00 0.00 0.00 0.00 44.72 43.30 1lpk s GLY 136 CO 0.18 -1.28 -0.12 -0.42 0.00 0.00 0.00 173.10 171.46 1lpk s ILE 137 N -3.47 1.09 0.06 0.90 1.01 0.12 -0.18 121.20 120.73 1lpk s ILE 137 Ca 0.37 -0.48 0.08 0.00 0.00 0.00 0.00 60.65 60.61 1lpk s ILE 137 Cb 0.02 -0.98 -0.03 0.00 0.01 0.00 0.00 42.46 41.48 1lpk s ILE 137 CO 0.22 0.34 -0.20 0.54 0.00 0.00 0.00 174.94 175.84 1lpk s VAL 138 N 0.47 2.69 0.14 2.92 0.11 0.28 -0.34 120.40 126.67 1lpk s VAL 138 Ca -0.10 -1.30 -0.07 0.00 -2.93 0.00 0.00 61.98 57.58 1lpk s VAL 138 Cb -0.14 -2.14 -0.02 0.00 -1.53 0.00 0.00 36.38 32.56 1lpk s VAL 138 CO 0.03 0.29 0.20 -0.94 -3.33 0.00 0.00 175.10 171.35 1lpk s SER 139 N -1.56 0.13 0.00 3.54 1.04 -1.15 0.04 113.70 115.75 1lpk s SER 139 Ca 0.15 -0.91 0.00 0.00 0.48 0.00 0.00 55.95 55.67 1lpk s SER 139 Cb -0.10 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.39 1lpk s SER 139 CO 0.06 -0.82 0.00 0.61 0.98 0.00 0.00 173.24 174.07 1lpk n GLY 140 N -0.15 0.34 1.73 7.32 0.00 -0.13 -4.32 105.19 109.98 1lpk n GLY 140 Ca -0.09 -1.20 -0.10 0.00 0.00 0.00 0.00 46.02 44.64 1lpk n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1lpk n PHE 141 N -0.91 2.13 -1.25 1.61 3.72 -1.26 -1.78 117.46 119.72 1lpk n PHE 141 Ca 0.00 -1.50 -0.14 0.00 -0.05 0.00 0.00 57.45 55.76 1lpk n PHE 141 Cb 0.00 -0.69 0.10 0.00 -0.94 0.00 0.00 39.48 37.96 1lpk n PHE 141 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1lpk n GLY 142 N -0.80 -1.67 3.72 1.37 0.00 -1.26 -1.87 105.19 104.68 1lpk n GLY 142 Ca 0.43 -1.63 -0.37 0.00 0.00 0.00 0.00 46.02 44.45 1lpk n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lpk n ARG 143 N -2.54 1.21 0.00 1.61 1.74 0.59 -2.18 116.66 117.09 1lpk n ARG 143 Ca 0.08 0.47 0.12 0.00 -0.77 0.00 0.00 57.85 57.74 1lpk n ARG 143 Cb 0.28 -2.52 0.08 0.00 -1.02 0.00 0.00 32.46 29.28 1lpk n ARG 143 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1lpk n THR 144 N -1.74 0.00 -3.60 0.55 -2.24 -1.24 -0.08 114.28 105.93 1lpk n THR 144 Ca 0.15 -0.32 -0.16 0.00 -2.27 0.00 0.00 64.05 61.45 1lpk n THR 144 Cb 0.47 1.22 -0.07 0.00 -2.10 0.00 0.00 70.33 69.85 1lpk n THR 144 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1lpk s HIS 145 N -2.32 -0.58 0.27 4.78 3.76 -1.26 -4.36 115.29 115.58 1lpk s HIS 145 Ca 0.23 1.11 -0.01 0.00 -0.15 0.00 0.00 55.06 56.23 1lpk s HIS 145 Cb 0.19 0.31 0.61 0.00 1.11 0.00 0.00 32.58 34.80 1lpk s HIS 145 CO 0.48 -0.50 1.64 1.49 -0.85 0.00 0.00 174.74 177.00 1lpk h GLU 147 N 3.69 0.16 0.00 1.40 4.81 -1.90 -1.79 114.58 120.95 1lpk h GLU 147 Ca -0.28 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1lpk h GLU 147 Cb 1.15 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1lpk h GLU 147 CO 0.32 0.11 -1.13 1.63 -0.73 0.00 0.00 179.01 179.21 1lpk n LYS 148 N -5.28 0.39 0.00 1.92 5.02 -1.26 -4.96 118.16 114.00 1lpk n LYS 148 Ca 0.18 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.47 1lpk n LYS 148 Cb 0.61 -1.63 0.00 0.00 -0.02 0.00 0.00 35.03 33.99 1lpk n LYS 148 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1lpk n GLY 149 N 1.32 -3.17 3.83 0.72 0.00 -0.67 -5.06 105.19 102.15 1lpk n GLY 149 Ca 0.01 -1.29 -0.25 0.00 0.00 0.00 0.00 46.02 44.49 1lpk n GLY 149 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1lpk s ARG 150 N -1.88 2.29 0.37 1.61 1.70 -1.26 -4.88 118.95 116.90 1lpk s ARG 150 Ca 0.00 -1.90 -0.27 0.00 -0.47 0.00 0.00 55.73 53.09 1lpk s ARG 150 Cb 0.00 -2.06 -0.11 0.00 -0.57 0.00 0.00 34.95 32.21 1lpk s ARG 150 CO 0.00 -0.33 1.25 0.94 -1.08 0.00 0.00 175.30 176.08 1lpk n GLN 151 N -1.49 1.98 -2.91 3.89 -0.06 -1.26 -3.68 117.38 113.85 1lpk n GLN 151 Ca -0.02 0.70 -0.40 0.00 -2.00 0.00 0.00 57.00 55.28 1lpk n GLN 151 Cb 0.64 -2.30 -0.06 0.00 -4.06 0.00 0.00 30.24 24.46 1lpk n GLN 151 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 1lpk s SER 152 N -0.42 7.44 0.19 1.69 0.15 -0.78 -4.91 113.70 117.06 1lpk s SER 152 Ca 0.58 1.70 0.16 0.00 0.70 0.00 0.00 55.95 59.09 1lpk s SER 152 Cb -0.55 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 61.21 1lpk s SER 152 CO 0.60 0.16 1.18 0.71 1.20 0.00 0.00 173.24 177.10 1lpk h THR 153 N 3.41 0.68 -2.76 6.45 1.35 -1.91 -3.44 112.91 116.69 1lpk h THR 153 Ca -0.46 -2.08 -0.58 0.00 -0.55 0.00 0.00 66.41 62.74 1lpk h THR 153 Cb 1.20 2.23 -0.05 0.00 -1.73 0.00 0.00 68.15 69.81 1lpk h THR 153 CO 0.67 0.39 -0.51 -0.13 -0.25 0.00 0.00 175.52 175.69 1lpk s ARG 154 N -2.96 3.28 -0.06 4.72 1.81 -1.26 -0.29 118.95 124.18 1lpk s ARG 154 Ca 0.01 -0.61 -0.24 0.00 -1.72 0.00 0.00 55.73 53.17 1lpk s ARG 154 Cb 0.08 -2.90 -0.04 0.00 -0.45 0.00 0.00 34.95 31.64 1lpk s ARG 154 CO 0.77 0.55 0.73 -1.17 -0.68 0.00 0.00 175.30 175.50 1lpk s LEU 155 N -2.89 4.32 0.26 2.53 2.96 -0.25 -4.61 118.68 120.99 1lpk s LEU 155 Ca 0.33 1.23 0.11 0.00 -0.22 0.00 0.00 54.13 55.59 1lpk s LEU 155 Cb -0.12 -3.13 -0.05 0.00 0.50 0.00 0.00 46.19 43.39 1lpk s LEU 155 CO 0.27 -0.14 -0.20 -0.54 -1.32 0.00 0.00 176.35 174.42 1lpk s LYS 156 N 0.86 1.62 0.06 1.98 1.02 -0.74 -0.41 119.74 124.14 1lpk s LYS 156 Ca 0.39 -1.71 0.01 0.00 0.02 0.00 0.00 55.97 54.68 1lpk s LYS 156 Cb -0.18 -1.72 -0.03 0.00 -0.52 0.00 0.00 37.83 35.38 1lpk s LYS 156 CO 0.19 0.33 -0.05 0.00 -0.92 0.00 0.00 175.35 174.89 1lpk s MET 157 N -3.37 0.62 -0.20 1.68 0.23 0.10 -0.96 119.30 117.41 1lpk s MET 157 Ca 0.28 -1.06 -0.11 0.00 -1.03 0.00 0.00 55.69 53.77 1lpk s MET 157 Cb -0.05 -0.07 0.07 0.00 -1.53 0.00 0.00 34.83 33.24 1lpk s MET 157 CO 0.13 -0.03 0.48 -1.17 -2.03 0.00 0.00 175.02 172.40 1lpk s LEU 158 N -2.42 -0.36 -0.22 0.18 2.96 0.11 -0.53 118.68 118.39 1lpk s LEU 158 Ca 0.01 1.06 -0.29 0.00 -0.22 0.00 0.00 54.13 54.69 1lpk s LEU 158 Cb -0.00 1.61 -0.01 0.00 0.50 0.00 0.00 46.19 48.29 1lpk s LEU 158 CO -0.04 -0.21 1.29 -0.70 -1.32 0.00 0.00 176.35 175.37 1lpk s GLU 159 N 1.59 4.09 -0.18 1.98 2.12 -1.26 -0.55 118.70 126.48 1lpk s GLU 159 Ca -0.09 1.50 -0.01 0.00 0.36 0.00 0.00 54.97 56.73 1lpk s GLU 159 Cb -0.08 -3.82 0.01 0.00 0.26 0.00 0.00 34.13 30.50 1lpk s GLU 159 CO -0.15 -0.89 -0.14 0.14 -0.54 0.00 0.00 175.26 173.69 1lpk s VAL 160 N 3.90 2.62 0.50 3.70 -7.23 0.75 -4.93 120.40 119.70 1lpk s VAL 160 Ca 0.56 -0.76 -0.22 0.00 -1.81 0.00 0.00 61.98 59.75 1lpk s VAL 160 Cb -0.20 -2.13 -0.06 0.00 0.56 0.00 0.00 36.38 34.55 1lpk s VAL 160 CO 0.18 0.50 1.26 -2.84 -0.31 0.00 0.00 175.10 173.89 1lpk s PRO 161 N 1.21 3.44 0.25 4.82 0.02 -1.26 -1.02 135.00 142.47 1lpk s PRO 161 Ca 0.02 2.00 -0.30 0.00 0.02 0.00 0.00 61.00 62.74 1lpk s PRO 161 Cb -0.14 -2.32 -0.09 0.00 0.02 0.00 0.00 34.50 31.96 1lpk s PRO 161 CO -0.06 -0.87 1.27 0.71 -0.33 0.00 0.00 177.00 177.71 1lpk s TYR 162 N -1.43 3.26 -0.15 6.54 2.02 -0.07 -1.82 117.35 125.70 1lpk s TYR 162 Ca 0.68 1.37 -0.05 0.00 -0.37 0.00 0.00 57.07 58.70 1lpk s TYR 162 Cb -0.34 -3.56 -0.03 0.00 -0.40 0.00 0.00 41.96 37.62 1lpk s TYR 162 CO 0.41 -1.62 0.00 0.08 -1.57 0.00 0.00 175.55 172.86 1lpk s VAL 163 N -0.50 4.29 0.07 0.71 1.01 -0.88 -4.87 120.40 120.22 1lpk s VAL 163 Ca 0.52 -0.22 -0.37 0.00 0.00 0.00 0.00 61.98 61.90 1lpk s VAL 163 Cb -0.37 -2.88 -0.18 0.00 0.00 0.00 0.00 36.38 32.96 1lpk s VAL 163 CO 0.43 0.51 1.21 -0.67 0.00 0.00 0.00 175.10 176.58 1lpk n ASP 164 N 3.23 0.98 -0.28 3.32 2.03 -1.26 -4.55 116.55 120.02 1lpk n ASP 164 Ca -0.17 1.14 0.03 0.00 0.52 0.00 0.00 54.79 56.31 1lpk n ASP 164 Cb 0.53 -1.10 0.17 0.00 -0.72 0.00 0.00 41.12 40.00 1lpk n ASP 164 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 1lpk h ARG 165 N 3.82 0.66 -0.08 -0.67 2.43 -1.97 0.12 114.38 118.70 1lpk h ARG 165 Ca -0.48 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 58.64 1lpk h ARG 165 Cb 1.37 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 30.77 1lpk h ARG 165 CO 0.72 0.44 0.01 -0.97 -1.51 0.00 0.00 179.97 178.66 1lpk h ASN 166 N 0.68 0.13 -0.75 -3.80 -0.00 -2.00 -1.39 115.58 108.45 1lpk h ASN 166 Ca 0.40 -0.28 0.04 0.00 -0.00 0.00 0.00 56.30 56.46 1lpk h ASN 166 Cb 0.43 -0.03 -0.05 0.00 -0.00 0.00 0.00 38.32 38.67 1lpk h ASN 166 CO -0.28 0.38 0.46 0.28 -0.00 0.00 0.00 177.43 178.27 1lpk h SER 167 N -0.13 0.75 -0.05 1.15 0.02 -1.84 -0.90 113.55 112.55 1lpk h SER 167 Ca 0.02 0.01 0.04 0.00 -0.84 0.00 0.00 61.79 61.02 1lpk h SER 167 Cb 0.31 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 62.65 1lpk h SER 167 CO 0.00 0.50 -0.25 0.00 -1.14 0.00 0.00 176.83 175.95 1lpk h LYS 169 N -0.36 1.06 -0.28 0.00 1.57 -0.68 -2.36 116.57 115.53 1lpk h LYS 169 Ca 0.08 -0.09 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 1lpk h LYS 169 Cb 0.46 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 1lpk h LYS 169 CO -0.25 0.75 -0.08 -0.07 -0.57 0.00 0.00 179.45 179.22 1lpk h LEU 170 N 1.07 0.43 -0.67 2.94 3.38 -0.73 -2.90 115.31 118.84 1lpk h LEU 170 Ca 0.28 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 1lpk h LEU 170 Cb -0.04 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 1lpk h LEU 170 CO -0.05 0.56 -0.11 0.77 0.09 0.00 0.00 178.44 179.70 1lpk h SER 171 N 0.43 0.00 -3.39 -0.43 4.64 -0.75 -3.46 113.55 110.59 1lpk h SER 171 Ca 0.09 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.85 1lpk h SER 171 Cb 0.41 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.46 1lpk h SER 171 CO 0.02 0.11 0.12 -0.55 -0.87 0.00 0.00 176.83 175.66 1lpk s SER 172 N -6.08 7.13 0.20 4.97 0.15 -1.04 -4.84 113.70 114.19 1lpk s SER 172 Ca 0.04 1.35 0.25 0.00 0.70 0.00 0.00 55.95 58.28 1lpk s SER 172 Cb 0.08 -2.44 0.47 0.00 -1.71 0.00 0.00 66.02 62.42 1lpk s SER 172 CO 0.63 0.00 1.49 0.28 1.20 0.00 0.00 173.24 176.84 1lpk h SER 173 N 5.89 0.00 -2.97 5.45 0.02 -1.89 -3.45 113.55 116.59 1lpk h SER 173 Ca -0.44 -0.09 -0.63 0.00 -0.84 0.00 0.00 61.79 59.79 1lpk h SER 173 Cb 1.20 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.59 1lpk h SER 173 CO 0.72 0.05 -0.76 -0.36 -1.14 0.00 0.00 176.83 175.33 1lpk s PHE 174 N -3.17 2.47 0.27 3.45 0.08 -1.26 -5.10 117.98 114.72 1lpk s PHE 174 Ca 0.07 -0.29 -0.30 0.00 0.12 0.00 0.00 56.93 56.54 1lpk s PHE 174 Cb 0.12 -1.20 -0.10 0.00 -0.57 0.00 0.00 43.02 41.27 1lpk s PHE 174 CO 0.68 0.53 1.44 -1.50 -0.10 0.00 0.00 175.22 176.27 1lpk s ILE 175 N -1.79 2.55 -0.51 0.64 2.07 -1.26 -4.98 121.20 117.91 1lpk s ILE 175 Ca 0.24 0.48 -0.14 0.00 -1.41 0.00 0.00 60.65 59.82 1lpk s ILE 175 Cb -0.08 -3.31 0.12 0.00 0.13 0.00 0.00 42.46 39.33 1lpk s ILE 175 CO 0.13 0.08 0.44 -0.63 -1.91 0.00 0.00 174.94 173.06 1lpk s ILE 176 N -0.24 4.89 1.00 2.00 -1.09 -1.26 -5.06 121.20 121.44 1lpk s ILE 176 Ca 0.58 -1.56 -0.16 0.00 -2.23 0.00 0.00 60.65 57.28 1lpk s ILE 176 Cb -0.43 -4.14 0.20 0.00 -1.58 0.00 0.00 42.46 36.51 1lpk s ILE 176 CO 0.47 -0.82 1.21 0.42 -1.23 0.00 0.00 174.94 174.98 1lpk s THR 177 N 1.53 1.90 -0.64 2.92 -4.23 -1.26 -4.94 115.64 110.91 1lpk s THR 177 Ca 0.04 0.00 0.21 0.00 -1.18 0.00 0.00 61.69 60.76 1lpk s THR 177 Cb -0.28 -2.80 0.21 0.00 1.34 0.00 0.00 72.50 70.97 1lpk s THR 177 CO 0.02 0.00 1.65 0.00 -0.54 0.00 0.00 174.62 175.75 1lpk n GLN 178 N -3.99 0.14 -0.25 3.99 10.64 -1.26 -1.86 117.38 124.79 1lpk n GLN 178 Ca 0.12 0.36 0.07 0.00 -1.83 0.00 0.00 57.00 55.72 1lpk n GLN 178 Cb 0.59 -1.76 0.21 0.00 -0.86 0.00 0.00 30.24 28.42 1lpk n GLN 178 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 1lpk n ASN 179 N -2.02 2.53 -4.26 2.61 3.02 -1.26 -4.85 115.26 111.03 1lpk n ASN 179 Ca 0.03 -2.03 -0.14 0.00 -0.03 0.00 0.00 54.58 52.40 1lpk n ASN 179 Cb 0.22 -0.32 -0.10 0.00 -0.61 0.00 0.00 39.78 38.97 1lpk n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1lpk s MET 180 N -1.42 1.10 0.05 3.52 -1.94 -0.78 -0.46 119.30 119.38 1lpk s MET 180 Ca 0.31 -1.49 -0.15 0.00 -1.71 0.00 0.00 55.69 52.64 1lpk s MET 180 Cb 0.16 -0.56 0.03 0.00 2.01 0.00 0.00 34.83 36.47 1lpk s MET 180 CO 0.20 0.02 0.34 -0.59 -0.01 0.00 0.00 175.02 174.98 1lpk s PHE 181 N -3.39 -0.15 0.05 -0.03 -0.12 -0.16 -4.71 117.98 109.46 1lpk s PHE 181 Ca 0.19 0.01 -0.00 0.00 -0.05 0.00 0.00 56.93 57.08 1lpk s PHE 181 Cb 0.04 0.14 -0.04 0.00 -0.63 0.00 0.00 43.02 42.53 1lpk s PHE 181 CO 0.02 -0.55 0.20 0.00 -0.05 0.00 0.00 175.22 174.84 1lpk s ALA 183 N -1.47 -1.46 0.00 0.00 0.00 -0.41 -2.08 121.76 116.34 1lpk s ALA 183 Ca 0.33 1.60 0.00 0.00 0.00 0.00 0.00 51.96 53.90 1lpk s ALA 183 Cb -0.13 -0.88 0.00 0.00 0.00 0.00 0.00 23.12 22.11 1lpk s ALA 183 CO 0.26 -0.28 0.00 0.41 0.00 0.00 0.00 175.76 176.15 1lpk n GLY 184 N 2.61 0.80 3.28 0.00 0.00 -0.75 -0.57 105.19 110.55 1lpk n GLY 184 Ca -0.14 -1.73 -0.23 0.00 0.00 0.00 0.00 46.02 43.92 1lpk n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1lpk s TYR 185 N -3.42 1.71 0.14 1.61 2.02 -1.26 -4.19 117.35 113.96 1lpk s TYR 185 Ca 0.00 -0.43 -0.05 0.00 -0.37 0.00 0.00 57.07 56.22 1lpk s TYR 185 Cb 0.00 -0.93 -0.06 0.00 -0.40 0.00 0.00 41.96 40.58 1lpk s TYR 185 CO 0.00 0.20 1.34 0.22 -1.57 0.00 0.00 175.55 175.74 1lpk h ASP 185 N 3.99 0.59 0.00 2.29 3.58 -1.93 -3.42 116.42 121.52 1lpk h ASP 185 Ca -0.45 -0.43 0.00 0.00 0.42 0.00 0.00 57.03 56.57 1lpk h ASP 185 Cb 1.18 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 42.06 1lpk h ASP 185 CO 0.41 1.21 -0.46 0.35 -2.88 0.00 0.00 179.24 177.87 1lpk n THR 185 N -3.81 0.00 -1.67 2.25 -2.24 -1.26 0.22 114.28 107.77 1lpk n THR 185 Ca -0.06 0.00 -0.45 0.00 -2.27 0.00 0.00 64.05 61.26 1lpk n THR 185 Cb 0.78 -0.46 -0.04 0.00 -2.10 0.00 0.00 70.33 68.52 1lpk n THR 185 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1lpk n LYS 186 N -1.22 2.15 -1.28 -0.78 4.81 -1.26 -4.83 118.16 115.76 1lpk n LYS 186 Ca 0.00 0.77 -0.37 0.00 -0.87 0.00 0.00 58.31 57.84 1lpk n LYS 186 Cb 0.23 -2.52 -0.02 0.00 0.02 0.00 0.00 35.03 32.74 1lpk n LYS 186 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1lpk n GLN 187 N 3.05 2.77 -3.80 1.64 1.13 -1.26 -4.67 117.38 116.24 1lpk n GLN 187 Ca 0.15 -2.10 -0.14 0.00 -1.94 0.00 0.00 57.00 52.98 1lpk n GLN 187 Cb 0.30 -2.88 -0.15 0.00 0.11 0.00 0.00 30.24 27.62 1lpk n GLN 187 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1lpk s GLU 188 N 3.17 0.01 0.00 -1.09 2.02 -1.26 -4.17 118.70 117.38 1lpk s GLU 188 Ca 0.55 0.16 0.00 0.00 0.02 0.00 0.00 54.97 55.70 1lpk s GLU 188 Cb 0.15 -0.13 0.00 0.00 0.10 0.00 0.00 34.13 34.25 1lpk s GLU 188 CO -0.03 -0.10 0.00 -3.47 0.02 0.00 0.00 175.26 171.67 1lpk n ASP 189 N 3.74 0.00 -4.16 -0.19 2.03 -0.86 -4.32 116.55 112.79 1lpk n ASP 189 Ca -0.21 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 54.80 1lpk n ASP 189 Cb 0.54 0.00 0.19 0.00 -0.72 0.00 0.00 41.12 41.13 1lpk n ASP 189 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1lpk s ALA 190 N -2.00 1.81 0.36 -1.67 0.00 -1.26 -0.14 121.76 118.86 1lpk s ALA 190 Ca 0.00 -1.04 -0.16 0.00 0.00 0.00 0.00 51.96 50.76 1lpk s ALA 190 Cb 0.00 -2.84 0.04 0.00 0.00 0.00 0.00 23.12 20.33 1lpk s ALA 190 CO 0.00 -2.67 0.76 0.00 0.00 0.00 0.00 175.76 173.85 1lpk n GLN 192 N -0.51 1.01 0.00 0.00 -0.06 -1.26 -0.90 117.38 115.65 1lpk n GLN 192 Ca -0.07 0.36 0.00 0.00 -2.00 0.00 0.00 57.00 55.29 1lpk n GLN 192 Cb 0.60 -1.75 0.00 0.00 -4.06 0.00 0.00 30.24 25.03 1lpk n GLN 192 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1lpk n GLY 193 N 1.75 2.89 0.08 1.69 0.00 -1.26 -0.30 105.19 110.04 1lpk n GLY 193 Ca 0.14 -0.20 0.13 0.00 0.00 0.00 0.00 46.02 46.09 1lpk n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1lpk n ASP 194 N 0.21 0.60 -4.59 1.61 8.00 -0.08 -3.75 116.55 118.54 1lpk n ASP 194 Ca 0.00 0.56 -0.48 0.00 0.71 0.00 0.00 54.79 55.57 1lpk n ASP 194 Cb 0.00 -0.72 -0.04 0.00 -0.02 0.00 0.00 41.12 40.34 1lpk n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1lpk n SER 195 N -2.06 1.55 0.00 -2.24 7.64 -1.25 -0.80 113.62 116.46 1lpk n SER 195 Ca 0.06 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.08 1lpk n SER 195 Cb 0.40 -1.24 0.00 0.00 -1.01 0.00 0.00 64.21 62.36 1lpk n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1lpk n GLY 196 N 2.08 2.53 2.59 0.23 0.00 0.12 -0.61 105.19 112.14 1lpk n GLY 196 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 1lpk n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lpk n GLY 197 N -2.00 -2.43 3.79 -0.02 0.00 0.02 -3.23 105.19 101.31 1lpk n GLY 197 Ca 0.00 -1.53 -0.38 0.00 0.00 0.00 0.00 46.02 44.12 1lpk n GLY 197 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1lpk s PRO 198 N -4.86 4.52 -0.17 1.61 0.02 -1.26 -1.60 135.00 133.26 1lpk s PRO 198 Ca 0.52 1.17 0.00 0.00 0.02 0.00 0.00 61.00 62.71 1lpk s PRO 198 Cb -0.04 -3.03 0.04 0.00 0.02 0.00 0.00 34.50 31.49 1lpk s PRO 198 CO 0.39 0.43 -0.08 -1.58 -0.33 0.00 0.00 177.00 175.84 1lpk s HIS 199 N -1.39 1.95 0.15 6.54 2.46 -0.64 -2.91 115.29 121.46 1lpk s HIS 199 Ca 0.42 -1.22 0.08 0.00 0.47 0.00 0.00 55.06 54.82 1lpk s HIS 199 Cb -0.20 -1.44 -0.04 0.00 -0.13 0.00 0.00 32.58 30.77 1lpk s HIS 199 CO 0.25 -0.65 -0.19 0.14 -2.47 0.00 0.00 174.74 171.82 1lpk s VAL 200 N 1.55 1.78 -0.15 0.89 -7.23 0.54 -0.72 120.40 117.06 1lpk s VAL 200 Ca 0.01 -1.83 0.01 0.00 -1.81 0.00 0.00 61.98 58.37 1lpk s VAL 200 Cb -0.15 -1.77 0.02 0.00 0.56 0.00 0.00 36.38 35.04 1lpk s VAL 200 CO -0.08 -0.26 -0.19 -0.89 -0.31 0.00 0.00 175.10 173.37 1lpk s THR 201 N -1.85 1.88 0.22 5.32 2.01 0.30 0.11 115.64 123.64 1lpk s THR 201 Ca 0.13 -0.84 -0.30 0.00 0.31 0.00 0.00 61.69 60.99 1lpk s THR 201 Cb -0.07 -1.70 -0.08 0.00 0.01 0.00 0.00 72.50 70.66 1lpk s THR 201 CO 0.06 0.51 0.98 -0.60 -0.69 0.00 0.00 174.62 174.89 1lpk s ARG 202 N 1.18 4.78 -0.25 4.92 3.52 -1.26 -1.59 118.95 130.24 1lpk s ARG 202 Ca 0.01 1.56 -0.02 0.00 -0.13 0.00 0.00 55.73 57.14 1lpk s ARG 202 Cb -0.14 -3.28 0.12 0.00 -1.56 0.00 0.00 34.95 30.10 1lpk s ARG 202 CO -0.08 0.38 0.31 0.12 -0.81 0.00 0.00 175.30 175.22 1lpk s PHE 203 N -0.92 -0.58 -1.20 5.12 5.36 0.07 -4.91 117.98 120.91 1lpk s PHE 203 Ca 0.43 0.34 -0.02 0.00 -0.96 0.00 0.00 56.93 56.72 1lpk s PHE 203 Cb -0.27 -0.24 0.00 0.00 -0.34 0.00 0.00 43.02 42.18 1lpk s PHE 203 CO 0.33 -0.76 1.01 1.63 -1.46 0.00 0.00 175.22 175.98 1lpk n LYS 204 N 5.34 -6.74 -1.30 10.12 5.02 -1.26 -2.45 118.16 126.89 1lpk n LYS 204 Ca -0.03 0.82 -0.10 0.00 -2.02 0.00 0.00 58.31 56.98 1lpk n LYS 204 Cb 0.49 -5.79 -0.04 0.00 -0.02 0.00 0.00 35.03 29.67 1lpk n LYS 204 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1lpk n ASP 205 N -3.04 -4.96 -3.98 4.39 8.00 -1.26 -4.97 116.55 110.73 1lpk n ASP 205 Ca -0.22 0.26 -0.27 0.00 0.71 0.00 0.00 54.79 55.26 1lpk n ASP 205 Cb 0.64 -3.38 -0.17 0.00 -0.02 0.00 0.00 41.12 38.20 1lpk n ASP 205 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1lpk s THR 206 N -2.15 1.26 -0.19 -3.53 2.01 -1.02 -5.12 115.64 106.89 1lpk s THR 206 Ca 0.00 -0.47 -0.17 0.00 0.31 0.00 0.00 61.69 61.36 1lpk s THR 206 Cb 0.00 -1.20 -0.04 0.00 0.01 0.00 0.00 72.50 71.27 1lpk s THR 206 CO 0.00 0.40 0.47 -0.31 -0.69 0.00 0.00 174.62 174.49 1lpk s TYR 207 N 1.34 3.39 -0.06 4.92 1.51 -1.26 -0.75 117.35 126.43 1lpk s TYR 207 Ca -0.01 0.73 0.02 0.00 -1.01 0.00 0.00 57.07 56.80 1lpk s TYR 207 Cb -0.14 -2.61 -0.03 0.00 -0.11 0.00 0.00 41.96 39.08 1lpk s TYR 207 CO -0.05 -0.04 -0.11 -0.06 -1.11 0.00 0.00 175.55 174.17 1lpk s PHE 208 N 1.43 2.80 0.04 2.71 0.08 -0.62 -2.07 117.98 122.35 1lpk s PHE 208 Ca 0.22 -0.09 -0.30 0.00 0.12 0.00 0.00 56.93 56.88 1lpk s PHE 208 Cb -0.15 -1.66 -0.07 0.00 -0.57 0.00 0.00 43.02 40.56 1lpk s PHE 208 CO 0.09 0.24 1.55 0.08 -0.10 0.00 0.00 175.22 177.09 1lpk s VAL 209 N -0.75 3.29 0.00 -0.44 1.01 0.14 -0.54 120.40 123.11 1lpk s VAL 209 Ca 0.12 0.72 0.00 0.00 0.00 0.00 0.00 61.98 62.82 1lpk s VAL 209 Cb -0.11 -3.46 0.00 0.00 0.00 0.00 0.00 36.38 32.81 1lpk s VAL 209 CO 0.01 -0.00 0.00 0.35 0.00 0.00 0.00 175.10 175.46 1lpk n THR 210 N 4.69 0.00 -3.78 3.92 -2.24 0.10 -4.61 114.28 112.37 1lpk n THR 210 Ca 0.15 -0.32 -0.04 0.00 -2.27 0.00 0.00 64.05 61.57 1lpk n THR 210 Cb 0.42 0.83 -0.01 0.00 -2.10 0.00 0.00 70.33 69.47 1lpk n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1lpk s GLY 211 N -1.26 -0.14 -0.08 3.38 0.00 -0.83 -3.20 107.32 105.19 1lpk s GLY 211 Ca 0.00 -0.00 0.01 0.00 0.00 0.00 0.00 44.72 44.73 1lpk s GLY 211 CO 0.00 0.38 -0.11 -0.42 0.00 0.00 0.00 173.10 172.95 1lpk s ILE 212 N -3.07 1.08 -0.16 0.90 1.01 -1.18 -1.61 121.20 118.16 1lpk s ILE 212 Ca 0.14 -0.41 -0.32 0.00 0.00 0.00 0.00 60.65 60.05 1lpk s ILE 212 Cb -0.02 -1.02 -0.10 0.00 0.01 0.00 0.00 42.46 41.33 1lpk s ILE 212 CO 0.03 0.35 2.04 0.52 0.00 0.00 0.00 174.94 177.88 1lpk n VAL 213 N 4.14 0.47 0.00 2.92 0.31 -0.63 -1.07 118.33 124.47 1lpk n VAL 213 Ca -0.20 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 1lpk n VAL 213 Cb 0.51 -2.05 0.00 0.00 -0.91 0.00 0.00 33.84 31.40 1lpk n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1lpk n SER 214 N 8.60 0.00 -1.56 4.52 2.88 -0.78 0.11 113.62 127.39 1lpk n SER 214 Ca 0.28 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.79 1lpk n SER 214 Cb 0.33 -0.46 0.01 0.00 -0.75 0.00 0.00 64.21 63.34 1lpk n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1lpk n TRP 215 N -2.48 -1.32 0.00 0.66 4.27 -0.92 -4.83 117.44 112.82 1lpk n TRP 215 Ca 0.00 -0.60 0.00 0.00 -3.89 0.00 0.00 57.50 53.01 1lpk n TRP 215 Cb 0.00 0.27 0.00 0.00 -1.36 0.00 0.00 31.31 30.22 1lpk n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1lpk n GLY 216 N -0.17 0.50 3.36 -1.67 0.00 -1.26 -1.26 105.19 104.69 1lpk n GLY 216 Ca -0.02 -0.74 -0.45 0.00 0.00 0.00 0.00 46.02 44.80 1lpk n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1lpk s GLU 217 N -2.00 3.19 2.40 1.61 2.02 -1.26 -4.93 118.70 119.73 1lpk s GLU 217 Ca 0.00 -1.64 0.00 0.00 0.02 0.00 0.00 54.97 53.35 1lpk s GLU 217 Cb 0.00 -4.37 0.00 0.00 0.10 0.00 0.00 34.13 29.86 1lpk s GLU 217 CO 0.00 -1.48 0.00 0.41 0.02 0.00 0.00 175.26 174.21 1lpk n GLY 219 N 5.07 -0.74 2.74 -1.39 0.00 -1.26 -4.51 105.19 105.10 1lpk n GLY 219 Ca -0.03 -1.16 -0.20 0.00 0.00 0.00 0.00 46.02 44.63 1lpk n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lpk n ALA 221 N 4.96 -0.41 -1.92 0.00 0.00 -1.26 -4.65 120.51 117.23 1lpk n ALA 221 Ca -0.10 0.24 -0.41 0.00 0.00 0.00 0.00 53.44 53.17 1lpk n ALA 221 Cb 0.50 -1.98 -0.03 0.00 0.00 0.00 0.00 19.45 17.94 1lpk n ALA 221 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1lpk s ARG 222 N -4.20 4.46 0.19 0.00 0.52 -1.26 -4.70 118.95 113.95 1lpk s ARG 222 Ca 0.00 1.99 -0.31 0.00 -0.52 0.00 0.00 55.73 56.89 1lpk s ARG 222 Cb 0.00 -3.18 -0.10 0.00 0.52 0.00 0.00 34.95 32.19 1lpk s ARG 222 CO 0.00 -0.11 1.56 0.15 0.02 0.00 0.00 175.30 176.92 1lpk s LYS 223 N -0.74 4.21 0.00 3.54 1.02 -1.26 -1.74 119.74 124.78 1lpk s LYS 223 Ca 0.52 2.38 0.00 0.00 0.02 0.00 0.00 55.97 58.89 1lpk s LYS 223 Cb -0.35 -3.13 0.00 0.00 -0.52 0.00 0.00 37.83 33.83 1lpk s LYS 223 CO 0.41 -0.59 0.00 0.41 -0.92 0.00 0.00 175.35 174.67 1lpk n GLY 223 N 3.39 0.76 3.31 -3.33 0.00 0.13 -5.02 105.19 104.44 1lpk n GLY 223 Ca 0.12 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.96 1lpk n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lpk s LYS 224 N -0.35 1.23 0.34 1.61 -0.14 -0.71 -4.79 119.74 116.93 1lpk s LYS 224 Ca 0.00 -1.46 0.03 0.00 -1.36 0.00 0.00 55.97 53.19 1lpk s LYS 224 Cb 0.00 -1.09 -0.05 0.00 -1.68 0.00 0.00 37.83 35.01 1lpk s LYS 224 CO 0.00 0.20 0.09 0.71 -0.76 0.00 0.00 175.35 175.58 1lpk s TYR 225 N -2.58 1.83 0.16 3.18 2.02 -1.26 -4.53 117.35 116.17 1lpk s TYR 225 Ca 0.17 -1.10 -0.23 0.00 -0.37 0.00 0.00 57.07 55.54 1lpk s TYR 225 Cb -0.03 -1.17 -0.08 0.00 -0.40 0.00 0.00 41.96 40.28 1lpk s TYR 225 CO 0.05 -0.15 0.72 0.20 -1.57 0.00 0.00 175.55 174.80 1lpk s GLY 226 N -3.49 2.79 -0.16 0.71 0.00 0.26 -4.51 107.32 102.93 1lpk s GLY 226 Ca 0.33 0.25 -0.04 0.00 0.00 0.00 0.00 44.72 45.25 1lpk s GLY 226 CO 0.15 0.70 -0.02 -0.42 0.00 0.00 0.00 173.10 173.50 1lpk s ILE 227 N -1.24 4.02 0.16 0.90 -1.09 -0.39 -1.29 121.20 122.27 1lpk s ILE 227 Ca 0.36 -0.31 0.10 0.00 -2.23 0.00 0.00 60.65 58.57 1lpk s ILE 227 Cb -0.21 -2.77 -0.04 0.00 -1.58 0.00 0.00 42.46 37.86 1lpk s ILE 227 CO 0.23 0.49 -0.22 -0.31 -1.23 0.00 0.00 174.94 173.91 1lpk s TYR 228 N 0.35 2.03 0.05 3.97 1.51 0.34 -1.87 117.35 123.72 1lpk s TYR 228 Ca -0.03 -0.41 -0.30 0.00 -1.01 0.00 0.00 57.07 55.31 1lpk s TYR 228 Cb -0.14 -1.04 -0.05 0.00 -0.11 0.00 0.00 41.96 40.62 1lpk s TYR 228 CO 0.03 0.36 1.16 0.99 -1.11 0.00 0.00 175.55 176.98 1lpk s THR 229 N -1.63 4.18 -0.75 -0.71 2.01 -0.24 -0.99 115.64 117.52 1lpk s THR 229 Ca 0.15 1.56 -0.26 0.00 0.31 0.00 0.00 61.69 63.45 1lpk s THR 229 Cb -0.08 -4.00 -0.00 0.00 0.01 0.00 0.00 72.50 68.43 1lpk s THR 229 CO 0.07 0.12 1.65 -0.75 -0.69 0.00 0.00 174.62 175.01 1lpk s LYS 230 N 1.11 2.90 0.26 4.92 2.20 0.40 -3.12 119.74 128.40 1lpk s LYS 230 Ca 0.58 0.00 -0.04 0.00 -0.36 0.00 0.00 55.97 56.15 1lpk s LYS 230 Cb -0.28 -4.54 0.38 0.00 -1.51 0.00 0.00 37.83 31.87 1lpk s LYS 230 CO 0.29 -2.59 1.87 0.28 -0.36 0.00 0.00 175.35 174.83 1lpk h VAL 231 N 6.67 1.07 -0.36 4.02 2.07 -1.87 -2.17 116.25 125.68 1lpk h VAL 231 Ca -0.16 -0.38 0.10 0.00 0.82 0.00 0.00 66.70 67.09 1lpk h VAL 231 Cb 1.09 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 1lpk h VAL 231 CO 1.26 0.20 0.26 0.71 0.02 0.00 0.00 177.57 180.02 1lpk h THR 232 N 1.10 0.81 0.00 2.57 1.35 -1.90 0.72 112.91 117.56 1lpk h THR 232 Ca 0.41 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.27 1lpk h THR 232 Cb 0.17 0.82 0.00 0.00 -1.73 0.00 0.00 68.15 67.40 1lpk h THR 232 CO -0.17 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.10 1lpk h ALA 233 N 1.82 1.00 -0.01 6.62 0.00 -1.76 -3.06 119.26 123.87 1lpk h ALA 233 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1lpk h ALA 233 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1lpk h ALA 233 CO -0.00 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.44 1lpk n PHE 234 N -2.49 0.02 -0.17 0.00 3.72 0.22 -4.80 117.46 113.96 1lpk n PHE 234 Ca 0.02 -0.71 -0.02 0.00 -0.05 0.00 0.00 57.45 56.70 1lpk n PHE 234 Cb 0.28 -0.09 0.08 0.00 -0.94 0.00 0.00 39.48 38.80 1lpk n PHE 234 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1lpk h LEU 235 N 0.05 0.05 -0.15 4.37 3.38 -1.38 0.37 115.31 121.99 1lpk h LEU 235 Ca 0.00 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1lpk h LEU 235 Cb 0.72 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1lpk h LEU 235 CO 0.00 0.05 0.07 0.11 0.09 0.00 0.00 178.44 178.76 1lpk h LYS 236 N 0.27 0.23 -0.49 1.13 1.57 -1.87 0.68 116.57 118.10 1lpk h LYS 236 Ca 0.27 -0.04 0.08 0.00 -1.87 0.00 0.00 60.65 59.09 1lpk h LYS 236 Cb 0.35 -0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.56 1lpk h LYS 236 CO -0.33 0.29 0.11 2.35 -0.57 0.00 0.00 179.45 181.31 1lpk h TRP 237 N 0.11 0.18 -0.68 -1.35 7.01 -1.64 0.29 115.95 119.86 1lpk h TRP 237 Ca 0.05 0.03 0.01 0.00 2.11 0.00 0.00 58.89 61.09 1lpk h TRP 237 Cb 0.15 -0.01 -0.03 0.00 -2.10 0.00 0.00 29.16 27.16 1lpk h TRP 237 CO -0.02 0.01 0.45 0.82 -2.79 0.00 0.00 178.44 176.91 1lpk h ILE 238 N 0.25 1.16 -0.79 2.65 2.04 0.06 0.11 117.51 123.00 1lpk h ILE 238 Ca 0.24 -0.31 -0.05 0.00 1.00 0.00 0.00 64.86 65.74 1lpk h ILE 238 Cb 0.31 0.17 -0.03 0.00 -0.74 0.00 0.00 36.82 36.53 1lpk h ILE 238 CO -0.31 0.17 0.31 0.44 0.00 0.00 0.00 178.15 178.76 1lpk h ASP 239 N 0.91 1.09 -0.58 1.72 5.19 0.46 -0.97 116.42 124.23 1lpk h ASP 239 Ca 0.25 -0.17 -0.10 0.00 -0.62 0.00 0.00 57.03 56.39 1lpk h ASP 239 Cb -0.09 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.12 1lpk h ASP 239 CO -0.06 0.97 -0.04 0.03 -3.12 0.00 0.00 179.24 177.02 1lpk h ARG 240 N 1.15 1.05 -0.19 3.56 3.08 0.46 -1.47 114.38 122.02 1lpk h ARG 240 Ca 0.26 -0.35 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 1lpk h ARG 240 Cb 0.22 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1lpk h ARG 240 CO -0.02 1.05 0.04 0.77 -1.07 0.00 0.00 179.97 180.74 1lpk h SER 241 N 0.95 0.30 -0.15 7.04 0.02 -0.35 -2.43 113.55 118.94 1lpk h SER 241 Ca 0.16 -0.24 -0.10 0.00 -0.84 0.00 0.00 61.79 60.77 1lpk h SER 241 Cb 0.60 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 1lpk h SER 241 CO 0.04 0.46 -0.23 0.24 -1.14 0.00 0.00 176.83 176.21 1lpk h MET 242 N 0.12 0.59 0.00 3.45 2.86 -1.15 -1.54 114.93 119.26 1lpk h MET 242 Ca 0.06 -0.22 0.00 0.00 -2.06 0.00 0.00 59.70 57.48 1lpk h MET 242 Cb 0.29 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1lpk h MET 242 CO 0.00 0.77 0.00 -0.22 1.06 0.00 0.00 176.91 178.52 1lpk h LYS 243 N 0.52 0.00 0.00 1.72 1.63 -1.18 -3.52 116.57 115.74 1lpk h LYS 243 Ca 0.08 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 1lpk h LYS 243 Cb 0.67 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.30 1lpk h LYS 243 CO 0.05 0.00 0.00 2.41 -3.45 0.00 0.00 179.45 178.46