#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cpt n SER 2 N 0.00 2.08 -4.05 1.61 3.41 -1.26 -4.80 113.62 110.62 2cpt n SER 2 Ca 0.00 1.10 -0.38 0.00 -0.26 0.00 0.00 58.87 59.32 2cpt n SER 2 Cb 0.00 -1.11 0.00 0.00 -0.26 0.00 0.00 64.21 62.85 2cpt n SER 2 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2cpt n SER 3 N 4.74 -3.07 -1.06 4.04 3.41 -1.26 -4.52 113.62 115.90 2cpt n SER 3 Ca 0.26 0.70 0.00 0.00 -0.26 0.00 0.00 58.87 59.57 2cpt n SER 3 Cb 0.11 -0.82 0.00 0.00 -0.26 0.00 0.00 64.21 63.24 2cpt n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cpt n GLY 4 N 2.29 -1.82 3.29 5.00 0.00 -1.26 -5.01 105.19 107.68 2cpt n GLY 4 Ca 0.09 -0.38 -0.45 0.00 0.00 0.00 0.00 46.02 45.29 2cpt n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cpt s SER 5 N -0.10 6.58 -0.37 1.61 0.15 -1.26 -5.03 113.70 115.28 2cpt s SER 5 Ca 0.00 -2.86 -0.29 0.00 0.70 0.00 0.00 55.95 53.50 2cpt s SER 5 Cb 0.00 -2.15 -0.00 0.00 -1.71 0.00 0.00 66.02 62.16 2cpt s SER 5 CO 0.00 -0.50 1.52 -0.44 1.20 0.00 0.00 173.24 175.02 2cpt s SER 6 N 1.76 6.24 -0.29 5.45 0.01 -1.26 -4.98 113.70 120.63 2cpt s SER 6 Ca 0.20 1.03 -0.10 0.00 1.31 0.00 0.00 55.95 58.39 2cpt s SER 6 Cb -0.11 -2.54 -0.02 0.00 0.21 0.00 0.00 66.02 63.56 2cpt s SER 6 CO -0.08 -1.47 0.15 -0.83 0.41 0.00 0.00 173.24 171.42 2cpt s GLY 7 N 4.44 1.87 0.57 3.44 0.00 -1.26 -5.09 107.32 111.29 2cpt s GLY 7 Ca 0.67 -1.27 -0.03 0.00 0.00 0.00 0.00 44.72 44.09 2cpt s GLY 7 CO 0.32 0.66 0.84 1.06 0.00 0.00 0.00 173.10 175.98 2cpt s MET 8 N 1.65 2.69 -0.33 2.90 1.00 -1.26 -5.03 119.30 120.92 2cpt s MET 8 Ca 0.06 -0.40 0.06 0.00 0.00 0.00 0.00 55.69 55.41 2cpt s MET 8 Cb -0.16 -2.38 0.45 0.00 0.00 0.00 0.00 34.83 32.74 2cpt s MET 8 CO 0.07 -0.72 1.21 0.43 0.00 0.00 0.00 175.02 176.01 2cpt n SER 9 N -2.47 5.00 -3.92 3.03 7.64 -1.26 -5.03 113.62 116.61 2cpt n SER 9 Ca 0.06 -3.75 -0.09 0.00 1.01 0.00 0.00 58.87 56.10 2cpt n SER 9 Cb 0.59 -0.39 -0.05 0.00 -1.01 0.00 0.00 64.21 63.36 2cpt n SER 9 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2cpt s SER 10 N -3.52 -0.05 -0.22 6.43 1.04 -1.26 -5.18 113.70 110.94 2cpt s SER 10 Ca 0.51 -0.94 -0.27 0.00 0.48 0.00 0.00 55.95 55.73 2cpt s SER 10 Cb 0.41 0.61 0.12 0.00 0.10 0.00 0.00 66.02 67.26 2cpt s SER 10 CO -0.00 -1.18 0.99 0.28 0.98 0.00 0.00 173.24 174.30 2cpt s THR 11 N -3.91 0.00 0.88 2.02 -1.32 -1.26 -5.15 115.64 106.90 2cpt s THR 11 Ca 0.22 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 60.57 2cpt s THR 11 Cb -0.01 -1.00 0.07 0.00 -1.51 0.00 0.00 72.50 70.05 2cpt s THR 11 CO 0.10 0.00 0.83 -1.20 -2.21 0.00 0.00 174.62 172.14 2cpt n SER 12 N 1.60 -0.53 0.19 8.08 7.64 -1.26 -4.81 113.62 124.53 2cpt n SER 12 Ca -0.12 0.44 0.04 0.00 1.01 0.00 0.00 58.87 60.25 2cpt n SER 12 Cb 0.57 -1.36 0.36 0.00 -1.01 0.00 0.00 64.21 62.77 2cpt n SER 12 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2cpt h PRO 13 N -1.39 0.00 -0.08 1.43 0.13 -2.02 -2.46 132.00 127.61 2cpt h PRO 13 Ca -0.44 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.61 2cpt h PRO 13 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2cpt h PRO 13 CO 0.40 0.39 -0.25 -0.97 -0.23 0.00 0.00 178.00 177.34 2cpt h ASN 14 N 0.00 0.36 0.16 1.44 -0.73 -1.96 -2.97 115.58 111.88 2cpt h ASN 14 Ca -0.00 -0.60 -0.01 0.00 1.87 0.00 0.00 56.30 57.56 2cpt h ASN 14 Cb 0.78 -0.11 0.00 0.00 0.27 0.00 0.00 38.32 39.27 2cpt h ASN 14 CO 0.05 0.90 -0.08 0.25 -0.37 0.00 0.00 177.43 178.19 2cpt h LEU 15 N -0.16 -0.18 -0.94 0.34 5.85 -1.85 -2.38 115.31 116.00 2cpt h LEU 15 Ca -0.01 -0.16 0.22 0.00 0.84 0.00 0.00 57.88 58.78 2cpt h LEU 15 Cb 0.87 0.05 -0.12 0.00 0.37 0.00 0.00 40.66 41.82 2cpt h LEU 15 CO 0.05 0.05 0.48 -0.61 -0.34 0.00 0.00 178.44 178.08 2cpt h GLN 16 N -0.42 0.48 -0.31 1.25 5.75 -1.54 0.59 115.11 120.91 2cpt h GLN 16 Ca -0.02 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.41 2cpt h GLN 16 Cb 0.33 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 2cpt h GLN 16 CO 0.04 0.32 0.06 -0.22 -2.65 0.00 0.00 178.83 176.37 2cpt h LYS 17 N 0.50 0.51 -0.94 1.69 3.64 -1.35 -2.73 116.57 117.89 2cpt h LYS 17 Ca 0.59 -0.13 0.10 0.00 -1.27 0.00 0.00 60.65 59.94 2cpt h LYS 17 Cb 1.09 -0.06 -0.08 0.00 -0.41 0.00 0.00 32.23 32.77 2cpt h LYS 17 CO -0.49 0.60 0.57 0.00 -2.27 0.00 0.00 179.45 177.86 2cpt h ALA 18 N 0.89 1.37 0.63 5.00 0.00 -0.39 -1.25 119.26 125.51 2cpt h ALA 18 Ca 0.09 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2cpt h ALA 18 Cb 0.33 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.93 2cpt h ALA 18 CO 0.00 0.21 -0.30 0.82 0.00 0.00 0.00 179.25 179.98 2cpt h ILE 19 N 0.94 0.36 -0.17 0.00 2.04 -1.13 -1.30 117.51 118.25 2cpt h ILE 19 Ca 0.45 -0.10 0.05 0.00 1.00 0.00 0.00 64.86 66.26 2cpt h ILE 19 Cb 0.39 0.40 -0.06 0.00 -0.74 0.00 0.00 36.82 36.81 2cpt h ILE 19 CO -0.24 0.01 -0.25 -0.78 0.00 0.00 0.00 178.15 176.89 2cpt h ASP 20 N -0.91 -0.80 0.06 1.72 3.58 -1.18 -0.29 116.42 118.61 2cpt h ASP 20 Ca -0.09 0.13 0.02 0.00 0.42 0.00 0.00 57.03 57.52 2cpt h ASP 20 Cb 0.67 0.36 -0.05 0.00 1.72 0.00 0.00 39.33 42.02 2cpt h ASP 20 CO 0.14 -0.30 -0.44 -0.07 -2.88 0.00 0.00 179.24 175.69 2cpt h LEU 21 N -0.30 -1.33 -0.93 2.28 3.38 -1.21 0.25 115.31 117.45 2cpt h LEU 21 Ca 0.11 0.15 0.18 0.00 0.09 0.00 0.00 57.88 58.41 2cpt h LEU 21 Cb 0.47 0.51 -0.10 0.00 0.09 0.00 0.00 40.66 41.62 2cpt h LEU 21 CO -0.34 -0.49 0.51 0.00 0.09 0.00 0.00 178.44 178.21 2cpt h ALA 22 N -0.19 1.48 -0.36 1.53 0.00 -0.89 0.74 119.26 121.57 2cpt h ALA 22 Ca 0.03 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 2cpt h ALA 22 Cb 0.69 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2cpt h ALA 22 CO -0.29 -0.11 -0.04 1.03 0.00 0.00 0.00 179.25 179.85 2cpt h SER 23 N 0.66 0.66 -0.49 0.00 0.87 0.01 -3.12 113.55 112.14 2cpt h SER 23 Ca 0.53 -0.33 -0.01 0.00 -1.23 0.00 0.00 61.79 60.75 2cpt h SER 23 Cb 0.82 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.58 2cpt h SER 23 CO -0.39 0.83 0.26 0.50 -0.53 0.00 0.00 176.83 177.50 2cpt h LYS 24 N 0.47 0.69 -0.82 2.24 3.64 0.99 -2.94 116.57 120.84 2cpt h LYS 24 Ca 0.10 -0.09 0.13 0.00 -1.27 0.00 0.00 60.65 59.52 2cpt h LYS 24 Cb 0.52 -0.13 -0.14 0.00 -0.41 0.00 0.00 32.23 32.07 2cpt h LYS 24 CO 0.03 0.55 -0.37 0.00 -2.27 0.00 0.00 179.45 177.38 2cpt h ALA 25 N 1.10 0.05 -0.61 5.00 0.00 -0.86 0.24 119.26 124.18 2cpt h ALA 25 Ca 0.17 0.22 0.01 0.00 0.00 0.00 0.00 54.91 55.31 2cpt h ALA 25 Cb 0.07 0.93 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 2cpt h ALA 25 CO -0.03 -0.66 0.40 0.00 0.00 0.00 0.00 179.25 178.97 2cpt h ALA 26 N 1.18 0.78 -0.56 0.00 0.00 -1.56 -2.50 119.26 116.60 2cpt h ALA 26 Ca 0.29 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.28 2cpt h ALA 26 Cb 0.57 -0.24 -0.10 0.00 0.00 0.00 0.00 17.79 18.03 2cpt h ALA 26 CO -0.86 0.19 -0.04 1.96 0.00 0.00 0.00 179.25 180.51 2cpt h GLN 27 N 0.82 0.08 0.59 0.00 4.20 -0.40 0.27 115.11 120.67 2cpt h GLN 27 Ca 0.23 -0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.90 2cpt h GLN 27 Cb -0.08 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 27.69 2cpt h GLN 27 CO -0.06 0.05 -0.28 0.93 -0.67 0.00 0.00 178.83 178.80 2cpt h GLU 28 N 0.08 -0.76 -0.35 1.46 4.39 -0.97 -2.24 114.58 116.19 2cpt h GLU 28 Ca 0.28 0.05 0.07 0.00 0.34 0.00 0.00 59.36 60.10 2cpt h GLU 28 Cb 0.44 0.17 -0.09 0.00 -0.10 0.00 0.00 28.75 29.18 2cpt h GLU 28 CO -0.50 -0.49 -0.37 0.22 -1.16 0.00 0.00 179.01 176.72 2cpt h ASP 29 N -0.84 -1.20 -0.89 1.42 3.58 -0.91 0.17 116.42 117.74 2cpt h ASP 29 Ca -0.08 0.19 0.18 0.00 0.42 0.00 0.00 57.03 57.74 2cpt h ASP 29 Cb 0.62 0.54 -0.11 0.00 1.72 0.00 0.00 39.33 42.11 2cpt h ASP 29 CO 0.13 -0.35 0.46 0.50 -2.88 0.00 0.00 179.24 177.10 2cpt h LYS 30 N -0.31 0.56 -0.03 0.28 3.11 -0.92 0.25 116.57 119.50 2cpt h LYS 30 Ca 0.14 -0.03 -0.10 0.00 -2.81 0.00 0.00 60.65 57.85 2cpt h LYS 30 Cb 0.56 -0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 31.65 2cpt h LYS 30 CO -0.52 0.37 -0.45 0.00 -2.81 0.00 0.00 179.45 176.04 2cpt h ALA 31 N 1.63 1.19 0.00 5.00 0.00 -0.36 -3.46 119.26 123.25 2cpt h ALA 31 Ca 0.52 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2cpt h ALA 31 Cb 0.84 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2cpt h ALA 31 CO -0.42 0.58 0.00 0.41 0.00 0.00 0.00 179.25 179.82 2cpt n GLY 32 N -0.19 0.19 3.48 0.00 0.00 0.89 -5.10 105.19 104.46 2cpt n GLY 32 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 2cpt n GLY 32 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2cpt s ASN 33 N -0.08 6.28 -0.15 1.61 0.01 0.32 -4.88 114.94 118.05 2cpt s ASN 33 Ca 0.00 -0.65 -0.09 0.00 -0.71 0.00 0.00 52.86 51.40 2cpt s ASN 33 Cb 0.00 -2.35 -0.24 0.00 0.41 0.00 0.00 41.25 39.07 2cpt s ASN 33 CO 0.00 -1.02 0.30 -1.22 -1.51 0.00 0.00 177.10 173.65 2cpt n TYR 34 N 6.68 1.14 -0.29 2.20 4.02 -1.26 -2.17 117.16 127.48 2cpt n TYR 34 Ca -0.03 0.28 -0.05 0.00 -0.01 0.00 0.00 57.90 58.10 2cpt n TYR 34 Cb 0.46 -1.14 0.07 0.00 -0.02 0.00 0.00 39.34 38.71 2cpt n TYR 34 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 176.86 177.34 2cpt h GLU 35 N -0.16 1.08 -0.04 -0.72 4.81 -1.92 -0.92 114.58 116.71 2cpt h GLU 35 Ca -0.42 -0.10 -0.22 0.00 -0.13 0.00 0.00 59.36 58.49 2cpt h GLU 35 Cb 1.88 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 31.04 2cpt h GLU 35 CO 0.01 0.76 -0.88 1.49 -0.73 0.00 0.00 179.01 179.67 2cpt h GLU 36 N 1.09 0.47 0.00 1.92 4.57 -1.98 -3.12 114.58 117.53 2cpt h GLU 36 Ca 0.29 -0.46 -0.04 0.00 -1.18 0.00 0.00 59.36 57.96 2cpt h GLU 36 Cb -0.04 0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 2cpt h GLU 36 CO -0.05 1.10 -0.19 0.00 -1.18 0.00 0.00 179.01 178.69 2cpt h ALA 37 N 0.75 1.29 0.21 2.92 0.00 -1.35 -2.96 119.26 120.11 2cpt h ALA 37 Ca -0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2cpt h ALA 37 Cb 1.50 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.26 2cpt h ALA 37 CO 0.16 0.24 -0.10 1.25 0.00 0.00 0.00 179.25 180.80 2cpt h LEU 38 N 0.00 -0.24 -1.04 0.00 5.85 -1.12 -1.46 115.31 117.32 2cpt h LEU 38 Ca -0.00 0.01 0.34 0.00 0.84 0.00 0.00 57.88 59.06 2cpt h LEU 38 Cb 0.46 0.06 -0.15 0.00 0.37 0.00 0.00 40.66 41.40 2cpt h LEU 38 CO 0.02 -0.07 0.59 0.06 -0.34 0.00 0.00 178.44 178.70 2cpt h GLN 39 N -0.47 0.27 -0.24 1.25 3.07 -1.59 0.45 115.11 117.84 2cpt h GLN 39 Ca -0.03 -0.02 -0.07 0.00 0.09 0.00 0.00 58.65 58.63 2cpt h GLN 39 Cb 0.21 -0.06 -0.01 0.00 0.08 0.00 0.00 27.48 27.71 2cpt h GLN 39 CO 0.05 0.18 -0.11 -0.07 0.09 0.00 0.00 178.83 178.96 2cpt h LEU 40 N 0.28 0.52 -1.59 0.06 3.38 -1.56 -0.49 115.31 115.91 2cpt h LEU 40 Ca 0.75 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 58.30 2cpt h LEU 40 Cb 1.79 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.38 2cpt h LEU 40 CO -0.61 0.81 0.08 1.88 0.09 0.00 0.00 178.44 180.70 2cpt h TYR 41 N 0.23 0.34 0.01 1.13 0.05 0.93 -1.30 116.97 118.36 2cpt h TYR 41 Ca 0.06 -0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.78 2cpt h TYR 41 Cb 0.61 -0.11 0.00 0.00 1.01 0.00 0.00 36.73 38.25 2cpt h TYR 41 CO 0.06 0.29 -0.18 1.96 -1.05 0.00 0.00 178.16 179.25 2cpt h GLN 42 N 0.35 0.10 -0.04 4.88 4.20 -0.85 -3.28 115.11 120.47 2cpt h GLN 42 Ca 0.09 -0.12 0.03 0.00 0.06 0.00 0.00 58.65 58.71 2cpt h GLN 42 Cb 0.11 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.89 2cpt h GLN 42 CO -0.01 0.93 -0.16 0.45 -0.67 0.00 0.00 178.83 179.37 2cpt h HIS 43 N -0.67 -0.43 -0.85 2.96 3.86 -0.88 -1.96 115.15 117.18 2cpt h HIS 43 Ca -0.02 0.02 0.20 0.00 -1.16 0.00 0.00 60.37 59.40 2cpt h HIS 43 Cb 1.00 0.20 -0.15 0.00 1.06 0.00 0.00 27.41 29.51 2cpt h HIS 43 CO 0.21 -0.24 -0.03 0.00 0.86 0.00 0.00 177.93 178.73 2cpt h ALA 44 N 0.71 0.86 -0.39 2.45 0.00 -1.37 0.23 119.26 121.75 2cpt h ALA 44 Ca 0.07 0.29 -0.03 0.00 0.00 0.00 0.00 54.91 55.24 2cpt h ALA 44 Cb 0.34 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 2cpt h ALA 44 CO -0.18 -0.46 0.14 0.28 0.00 0.00 0.00 179.25 179.02 2cpt h VAL 45 N 0.06 1.20 -0.44 0.00 2.07 -1.48 0.48 116.25 118.14 2cpt h VAL 45 Ca 0.47 -0.65 0.08 0.00 0.82 0.00 0.00 66.70 67.42 2cpt h VAL 45 Cb 0.85 0.91 -0.07 0.00 -1.52 0.00 0.00 31.29 31.47 2cpt h VAL 45 CO -0.78 0.23 0.04 1.56 0.02 0.00 0.00 177.57 178.63 2cpt h GLN 46 N 0.48 0.15 -0.06 1.57 1.08 0.12 0.13 115.11 118.58 2cpt h GLN 46 Ca 0.13 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.29 2cpt h GLN 46 Cb 0.23 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 27.62 2cpt h GLN 46 CO -0.01 0.10 -0.06 1.88 -0.95 0.00 0.00 178.83 179.80 2cpt h TYR 47 N 0.15 0.16 -0.35 2.96 0.05 -1.06 -2.42 116.97 116.47 2cpt h TYR 47 Ca 0.22 -0.05 0.07 0.00 0.05 0.00 0.00 58.73 59.02 2cpt h TYR 47 Cb 0.31 -0.03 -0.07 0.00 1.01 0.00 0.00 36.73 37.94 2cpt h TYR 47 CO -0.26 0.59 -0.14 0.74 -1.05 0.00 0.00 178.16 178.04 2cpt h PHE 48 N -0.31 -0.35 0.64 4.88 0.04 -0.54 -2.15 116.94 119.15 2cpt h PHE 48 Ca 0.01 0.04 -0.03 0.00 2.80 0.00 0.00 57.97 60.79 2cpt h PHE 48 Cb 0.56 0.21 -0.00 0.00 2.20 0.00 0.00 35.95 38.92 2cpt h PHE 48 CO 0.09 -0.22 -0.37 -0.07 -0.60 0.00 0.00 178.31 177.15 2cpt h LEU 49 N -0.08 -0.91 -1.22 1.54 3.38 -0.80 -2.27 115.31 114.95 2cpt h LEU 49 Ca 0.18 0.05 0.41 0.00 0.09 0.00 0.00 57.88 58.60 2cpt h LEU 49 Cb 0.35 0.26 -0.15 0.00 0.09 0.00 0.00 40.66 41.21 2cpt h LEU 49 CO -0.40 -0.58 0.71 -0.74 0.09 0.00 0.00 178.44 177.51 2cpt h HIS 50 N -0.94 0.69 0.56 1.13 2.76 -1.09 0.91 115.15 119.16 2cpt h HIS 50 Ca -0.08 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.09 2cpt h HIS 50 Cb 0.75 -0.17 0.01 0.00 1.55 0.00 0.00 27.41 29.55 2cpt h HIS 50 CO -0.08 -0.28 -0.27 0.28 -1.30 0.00 0.00 177.93 176.28 2cpt h VAL 51 N 0.10 0.05 -0.21 5.26 2.07 -0.88 -1.84 116.25 120.80 2cpt h VAL 51 Ca 0.82 -0.45 0.06 0.00 0.82 0.00 0.00 66.70 67.95 2cpt h VAL 51 Cb 2.33 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 2cpt h VAL 51 CO -0.55 0.01 0.38 0.58 0.02 0.00 0.00 177.57 178.00 2cpt h VAL 52 N -1.18 0.22 0.04 2.57 2.07 -0.43 1.09 116.25 120.62 2cpt h VAL 52 Ca -0.08 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 2cpt h VAL 52 Cb 0.59 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2cpt h VAL 52 CO 0.13 0.00 -0.02 0.50 0.02 0.00 0.00 177.57 178.20 2cpt h LYS 53 N 0.00 -0.05 0.00 1.57 3.11 -0.82 -3.35 116.57 117.03 2cpt h LYS 53 Ca 0.10 0.00 -0.07 0.00 -2.81 0.00 0.00 60.65 57.88 2cpt h LYS 53 Cb 0.86 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 32.09 2cpt h LYS 53 CO -0.00 -0.03 -0.91 0.66 -2.81 0.00 0.00 179.45 176.35 2cpt n TYR 54 N -3.32 0.61 -0.57 1.91 4.02 -0.70 -4.37 117.16 114.73 2cpt n TYR 54 Ca -0.01 0.27 -0.04 0.00 -0.01 0.00 0.00 57.90 58.11 2cpt n TYR 54 Cb 0.02 -0.76 0.01 0.00 -0.02 0.00 0.00 39.34 38.59 2cpt n TYR 54 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 2cpt n GLU 55 N -4.52 1.18 -0.45 -0.72 1.02 0.23 -4.93 120.64 112.45 2cpt n GLU 55 Ca -0.16 -0.35 -0.27 0.00 -0.02 0.00 0.00 57.16 56.35 2cpt n GLU 55 Cb 0.44 -1.14 0.23 0.00 -0.02 0.00 0.00 31.44 30.95 2cpt n GLU 55 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2cpt n ALA 56 N 1.23 -3.47 -3.74 0.62 0.00 0.31 -4.35 120.51 111.11 2cpt n ALA 56 Ca 0.07 -1.44 -0.05 0.00 0.00 0.00 0.00 53.44 52.02 2cpt n ALA 56 Cb 0.52 -1.51 0.00 0.00 0.00 0.00 0.00 19.45 18.46 2cpt n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cpt n GLN 57 N -3.90 0.79 -0.94 0.00 10.64 -1.26 -4.94 117.38 117.77 2cpt n GLN 57 Ca 0.06 -2.03 -0.32 0.00 -1.83 0.00 0.00 57.00 52.88 2cpt n GLN 57 Cb 0.54 2.26 0.02 0.00 -0.86 0.00 0.00 30.24 32.20 2cpt n GLN 57 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2cpt n GLY 58 N -0.46 -3.49 0.23 2.61 0.00 -1.26 -4.34 105.19 98.48 2cpt n GLY 58 Ca -0.04 -0.47 0.03 0.00 0.00 0.00 0.00 46.02 45.54 2cpt n GLY 58 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2cpt h ASP 59 N -0.51 0.17 0.86 1.61 2.03 -2.01 -1.44 116.42 117.13 2cpt h ASP 59 Ca -0.37 -0.04 0.00 0.00 -0.73 0.00 0.00 57.03 55.90 2cpt h ASP 59 Cb 1.16 -0.05 0.00 0.00 -0.83 0.00 0.00 39.33 39.61 2cpt h ASP 59 CO 0.26 0.36 0.00 0.11 -1.03 0.00 0.00 179.24 178.94 2cpt h LYS 60 N 0.17 0.00 0.00 4.15 6.56 -2.02 -3.14 116.57 122.30 2cpt h LYS 60 Ca 0.03 0.00 -0.05 0.00 -1.06 0.00 0.00 60.65 59.57 2cpt h LYS 60 Cb 0.39 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.05 2cpt h LYS 60 CO 0.02 0.00 -0.78 0.00 -2.06 0.00 0.00 179.45 176.64 2cpt n ALA 61 N -2.07 0.60 -0.33 3.86 0.00 -0.63 -3.98 120.51 117.95 2cpt n ALA 61 Ca 0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 53.44 52.90 2cpt n ALA 61 Cb 0.27 -0.06 0.01 0.00 0.00 0.00 0.00 19.45 19.67 2cpt n ALA 61 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2cpt n LYS 62 N -4.55 -0.23 -0.13 0.00 5.02 -0.68 0.78 118.16 118.37 2cpt n LYS 62 Ca -0.14 1.31 -0.04 0.00 -2.02 0.00 0.00 58.31 57.43 2cpt n LYS 62 Cb 0.39 -1.94 0.04 0.00 -0.02 0.00 0.00 35.03 33.49 2cpt n LYS 62 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 2cpt h GLN 63 N 0.00 0.11 -0.19 1.97 1.08 -1.76 -0.52 115.11 115.80 2cpt h GLN 63 Ca 0.27 -0.01 0.04 0.00 -1.45 0.00 0.00 58.65 57.50 2cpt h GLN 63 Cb 0.48 -0.02 -0.07 0.00 -0.05 0.00 0.00 27.48 27.82 2cpt h GLN 63 CO -0.84 0.07 -0.50 1.03 -0.95 0.00 0.00 178.83 177.64 2cpt h SER 64 N 0.11 -1.60 0.21 1.46 0.87 0.24 -0.16 113.55 114.68 2cpt h SER 64 Ca 0.22 0.20 0.01 0.00 -1.23 0.00 0.00 61.79 60.98 2cpt h SER 64 Cb 0.31 0.64 -0.02 0.00 -0.44 0.00 0.00 62.40 62.89 2cpt h SER 64 CO -0.36 -0.45 -0.24 0.40 -0.53 0.00 0.00 176.83 175.65 2cpt h ILE 65 N -0.52 0.49 -0.61 2.23 2.04 -1.00 -2.96 117.51 117.18 2cpt h ILE 65 Ca 0.06 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.00 2cpt h ILE 65 Cb 0.65 0.49 -0.10 0.00 -0.74 0.00 0.00 36.82 37.11 2cpt h ILE 65 CO -0.46 0.00 -0.48 0.03 0.00 0.00 0.00 178.15 177.24 2cpt h ARG 66 N -0.49 -0.22 -0.91 2.37 3.08 -0.65 0.99 114.38 118.55 2cpt h ARG 66 Ca 0.00 0.02 0.22 0.00 0.07 0.00 0.00 59.98 60.29 2cpt h ARG 66 Cb 0.47 0.05 -0.17 0.00 0.08 0.00 0.00 29.97 30.40 2cpt h ARG 66 CO -0.07 -0.15 -0.03 0.00 -1.07 0.00 0.00 179.97 178.65 2cpt h ALA 67 N 0.48 0.94 -0.15 0.04 0.00 -0.87 0.26 119.26 119.97 2cpt h ALA 67 Ca 0.16 0.32 -0.00 0.00 0.00 0.00 0.00 54.91 55.38 2cpt h ALA 67 Cb 0.55 0.57 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2cpt h ALA 67 CO -0.71 -0.49 0.08 0.87 0.00 0.00 0.00 179.25 179.00 2cpt h LYS 68 N 0.04 0.20 -0.73 0.00 6.56 -0.74 -2.11 116.57 119.79 2cpt h LYS 68 Ca 0.51 -0.03 0.16 0.00 -1.06 0.00 0.00 60.65 60.24 2cpt h LYS 68 Cb 0.97 -0.04 -0.12 0.00 -0.57 0.00 0.00 32.23 32.47 2cpt h LYS 68 CO -0.86 0.22 0.06 0.00 -2.06 0.00 0.00 179.45 176.82 2cpt h THR 70 N 0.15 1.26 0.73 0.00 2.02 -1.15 -0.23 112.91 115.69 2cpt h THR 70 Ca 0.41 -1.05 -0.04 0.00 0.77 0.00 0.00 66.41 66.49 2cpt h THR 70 Cb 0.71 0.81 0.01 0.00 -1.74 0.00 0.00 68.15 67.94 2cpt h THR 70 CO -0.60 0.38 -0.35 -0.08 0.37 0.00 0.00 175.52 175.24 2cpt h GLU 71 N 0.87 -0.95 -0.99 6.66 4.57 -0.19 -1.73 114.58 122.82 2cpt h GLU 71 Ca 0.17 0.06 0.04 0.00 -1.18 0.00 0.00 59.36 58.45 2cpt h GLU 71 Cb 0.48 0.21 -0.06 0.00 -0.16 0.00 0.00 28.75 29.23 2cpt h GLU 71 CO 0.02 -0.61 0.65 1.88 -1.18 0.00 0.00 179.01 179.77 2cpt h TYR 72 N -1.10 1.22 -0.76 0.92 0.05 -0.70 -1.41 116.97 115.19 2cpt h TYR 72 Ca -0.10 0.03 0.05 0.00 0.05 0.00 0.00 58.73 58.76 2cpt h TYR 72 Cb 0.77 -0.41 -0.05 0.00 1.01 0.00 0.00 36.73 38.06 2cpt h TYR 72 CO -0.01 0.70 0.46 -0.07 -1.05 0.00 0.00 178.16 178.19 2cpt h LEU 73 N 1.25 0.73 -0.41 3.88 3.38 -0.94 0.12 115.31 123.32 2cpt h LEU 73 Ca 0.40 0.01 -0.12 0.00 0.09 0.00 0.00 57.88 58.25 2cpt h LEU 73 Cb 0.01 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2cpt h LEU 73 CO -0.13 0.49 -0.23 -0.78 0.09 0.00 0.00 178.44 177.88 2cpt h ASP 74 N 0.87 0.91 0.41 -0.43 1.82 -0.62 -2.55 116.42 116.83 2cpt h ASP 74 Ca 0.32 -0.42 -0.02 0.00 -0.39 0.00 0.00 57.03 56.52 2cpt h ASP 74 Cb 0.10 -0.25 0.00 0.00 0.68 0.00 0.00 39.33 39.87 2cpt h ASP 74 CO -0.15 1.13 -0.20 -0.09 -1.61 0.00 0.00 179.24 178.32 2cpt h ARG 75 N 0.69 -0.54 -0.21 0.28 9.65 -0.72 -3.10 114.38 120.43 2cpt h ARG 75 Ca 0.09 0.04 0.06 0.00 -1.10 0.00 0.00 59.98 59.06 2cpt h ARG 75 Cb 0.80 0.12 -0.06 0.00 -1.39 0.00 0.00 29.97 29.44 2cpt h ARG 75 CO 0.07 -0.32 -0.20 0.00 2.80 0.00 0.00 179.97 182.32 2cpt h ALA 76 N -0.07 -0.09 -0.97 2.80 0.00 -1.03 -2.29 119.26 117.61 2cpt h ALA 76 Ca -0.06 0.07 0.16 0.00 0.00 0.00 0.00 54.91 55.09 2cpt h ALA 76 Cb 0.47 0.42 -0.16 0.00 0.00 0.00 0.00 17.79 18.52 2cpt h ALA 76 CO 0.09 -0.63 -0.35 0.39 0.00 0.00 0.00 179.25 178.75 2cpt n GLU 77 N -5.35 -0.20 0.22 0.00 -0.58 -0.96 -0.72 120.64 113.05 2cpt n GLU 77 Ca -0.01 1.50 -0.17 0.00 -0.42 0.00 0.00 57.16 58.06 2cpt n GLU 77 Cb 0.26 -2.23 -0.09 0.00 -0.57 0.00 0.00 31.44 28.81 2cpt n GLU 77 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2cpt h LYS 78 N 0.00 -0.82 -0.87 3.49 1.79 -1.35 -2.14 116.57 116.67 2cpt h LYS 78 Ca 0.37 0.06 0.28 0.00 -2.18 0.00 0.00 60.65 59.18 2cpt h LYS 78 Cb 0.61 0.19 -0.16 0.00 -1.58 0.00 0.00 32.23 31.29 2cpt h LYS 78 CO -0.97 -0.55 0.17 1.28 -1.08 0.00 0.00 179.45 178.30 2cpt n LEU 79 N -5.52 0.03 0.12 2.94 4.77 0.10 -0.64 117.00 118.80 2cpt n LEU 79 Ca -0.10 1.47 -0.08 0.00 -0.03 0.00 0.00 56.01 57.27 2cpt n LEU 79 Cb 0.42 -0.60 -0.04 0.00 -2.33 0.00 0.00 43.42 40.88 2cpt n LEU 79 CO 0.24 -1.54 0.51 0.11 -1.33 0.00 0.00 177.39 175.38 2cpt h LYS 80 N 0.00 -0.41 -1.29 3.23 1.57 -0.94 0.68 116.57 119.40 2cpt h LYS 80 Ca 0.60 0.03 0.37 0.00 -1.87 0.00 0.00 60.65 59.78 2cpt h LYS 80 Cb 1.38 0.09 -0.07 0.00 0.08 0.00 0.00 32.23 33.71 2cpt h LYS 80 CO -0.77 -0.28 0.90 0.93 -0.57 0.00 0.00 179.45 179.66 2cpt h GLU 81 N -0.43 0.09 0.05 3.15 4.39 -0.82 0.97 114.58 121.99 2cpt h GLU 81 Ca -0.02 -0.01 -0.24 0.00 0.34 0.00 0.00 59.36 59.43 2cpt h GLU 81 Cb 0.38 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.99 2cpt h GLU 81 CO -0.04 0.06 -1.17 -0.92 -1.16 0.00 0.00 179.01 175.78 2cpt h TYR 82 N 0.09 0.21 -0.20 4.33 5.03 -0.50 -2.97 116.97 122.96 2cpt h TYR 82 Ca 0.66 -0.15 -0.17 0.00 2.58 0.00 0.00 58.73 61.65 2cpt h TYR 82 Cb 2.37 -0.01 -0.00 0.00 1.55 0.00 0.00 36.73 40.64 2cpt h TYR 82 CO -0.00 1.13 -0.56 -0.07 -1.32 0.00 0.00 178.16 177.34 2cpt h LEU 83 N 0.03 0.69 -0.61 2.82 3.38 0.70 -3.08 115.31 119.25 2cpt h LEU 83 Ca -0.09 -0.37 -0.15 0.00 0.09 0.00 0.00 57.88 57.36 2cpt h LEU 83 Cb 1.87 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.42 2cpt h LEU 83 CO 0.16 1.11 -0.58 0.07 0.09 0.00 0.00 178.44 179.28 2cpt h LYS 84 N 0.47 0.36 -0.63 1.13 2.10 -1.00 -0.25 116.57 118.76 2cpt h LYS 84 Ca 0.01 -0.24 -0.01 0.00 -2.00 0.00 0.00 60.65 58.41 2cpt h LYS 84 Cb 1.12 0.03 -0.03 0.00 -0.90 0.00 0.00 32.23 32.45 2cpt h LYS 84 CO 0.11 0.84 0.34 -0.91 -2.00 0.00 0.00 179.45 177.83 2cpt h ASN 85 N 0.27 0.77 0.17 7.07 4.21 -1.45 -2.99 115.58 123.63 2cpt h ASN 85 Ca -0.00 -0.06 -0.33 0.00 1.21 0.00 0.00 56.30 57.12 2cpt h ASN 85 Cb 1.10 -0.20 0.01 0.00 -1.12 0.00 0.00 38.32 38.11 2cpt h ASN 85 CO 0.10 0.63 -1.66 0.07 -1.29 0.00 0.00 177.43 175.27 2cpt h LYS 86 N 0.87 0.37 -6.57 0.81 2.10 -1.45 -3.47 116.57 109.23 2cpt h LYS 86 Ca 0.22 -0.63 -0.50 0.00 -2.00 0.00 0.00 60.65 57.74 2cpt h LYS 86 Cb 0.03 0.24 0.23 0.00 -0.90 0.00 0.00 32.23 31.83 2cpt h LYS 86 CO -0.04 1.30 -1.16 0.39 -2.00 0.00 0.00 179.45 177.94 2cpt n GLU 87 N -3.67 -0.78 -4.68 0.07 -0.58 -0.12 -4.89 120.64 106.00 2cpt n GLU 87 Ca -0.24 -0.21 -0.24 0.00 -0.42 0.00 0.00 57.16 56.05 2cpt n GLU 87 Cb 1.04 -1.61 -0.15 0.00 -0.57 0.00 0.00 31.44 30.16 2cpt n GLU 87 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 2cpt s LYS 88 N -3.20 1.27 0.42 3.49 -2.85 -1.26 -4.93 119.74 112.69 2cpt s LYS 88 Ca 0.52 -0.69 0.02 0.00 -1.00 0.00 0.00 55.97 54.82 2cpt s LYS 88 Cb -0.13 -1.27 0.02 0.00 -2.06 0.00 0.00 37.83 34.38 2cpt s LYS 88 CO 0.68 0.34 0.17 1.63 0.10 0.00 0.00 175.35 178.28 2cpt n LYS 89 N 2.37 0.92 -0.27 1.78 4.76 -1.26 -5.03 118.16 121.43 2cpt n LYS 89 Ca -0.16 -2.84 -0.01 0.00 -2.87 0.00 0.00 58.31 52.43 2cpt n LYS 89 Cb 0.54 0.53 0.10 0.00 -1.84 0.00 0.00 35.03 34.36 2cpt n LYS 89 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2cpt h ALA 90 N 0.93 1.00 -2.95 7.82 0.00 -2.06 -3.36 119.26 120.65 2cpt h ALA 90 Ca -0.31 -0.01 -0.59 0.00 0.00 0.00 0.00 54.91 54.00 2cpt h ALA 90 Cb 1.02 -0.20 -0.40 0.00 0.00 0.00 0.00 17.79 18.21 2cpt h ALA 90 CO 0.49 0.19 -0.77 -0.65 0.00 0.00 0.00 179.25 178.52 2cpt s GLN 91 N -6.09 0.94 -0.29 0.00 -0.21 -1.26 -5.09 119.66 107.67 2cpt s GLN 91 Ca -0.13 -1.56 -0.25 0.00 0.02 0.00 0.00 55.36 53.44 2cpt s GLN 91 Cb 0.17 -2.00 0.16 0.00 1.00 0.00 0.00 33.01 32.34 2cpt s GLN 91 CO 0.77 -1.12 1.27 0.21 -2.12 0.00 0.00 175.29 174.31 2cpt s LYS 92 N 0.91 0.25 -0.16 2.91 2.20 -1.26 -5.13 119.74 119.46 2cpt s LYS 92 Ca 0.15 0.27 -0.29 0.00 -0.36 0.00 0.00 55.97 55.74 2cpt s LYS 92 Cb -0.22 0.12 -0.03 0.00 -1.51 0.00 0.00 37.83 36.19 2cpt s LYS 92 CO -0.08 -0.03 1.57 -1.25 -0.36 0.00 0.00 175.35 175.20 2cpt s PRO 93 N 0.03 3.98 -0.04 4.03 0.04 -1.26 -4.67 135.00 137.10 2cpt s PRO 93 Ca 0.06 1.81 -0.02 0.00 0.04 0.00 0.00 61.00 62.89 2cpt s PRO 93 Cb -0.05 -3.98 0.03 0.00 0.04 0.00 0.00 34.50 30.55 2cpt s PRO 93 CO -0.11 -1.07 0.07 0.08 0.04 0.00 0.00 177.00 176.00 2cpt s VAL 94 N 4.59 -0.11 0.44 -0.36 1.01 -1.26 -5.05 120.40 119.66 2cpt s VAL 94 Ca 0.69 0.33 -0.18 0.00 0.00 0.00 0.00 61.98 62.83 2cpt s VAL 94 Cb -0.27 -0.15 -0.14 0.00 0.00 0.00 0.00 36.38 35.82 2cpt s VAL 94 CO 0.27 0.14 -0.06 0.29 0.00 0.00 0.00 175.10 175.74 2cpt n LYS 95 N 4.84 0.00 -0.31 2.72 4.76 -1.26 -4.71 118.16 124.19 2cpt n LYS 95 Ca -0.14 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.44 2cpt n LYS 95 Cb 0.50 -0.93 0.26 0.00 -1.84 0.00 0.00 35.03 33.02 2cpt n LYS 95 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 2cpt n GLU 96 N 1.35 -0.07 0.00 1.97 0.28 -1.26 -4.68 120.64 118.23 2cpt n GLU 96 Ca 0.08 1.35 0.00 0.00 -0.16 0.00 0.00 57.16 58.44 2cpt n GLU 96 Cb 0.42 -2.15 0.00 0.00 1.43 0.00 0.00 31.44 31.14 2cpt n GLU 96 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2cpt n GLY 97 N -1.46 1.03 3.08 -1.84 0.00 -1.26 -4.67 105.19 100.06 2cpt n GLY 97 Ca 0.21 -0.17 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 2cpt n GLY 97 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2cpt s GLN 98 N 0.00 0.59 0.81 1.61 -0.21 -1.26 -5.15 119.66 116.05 2cpt s GLN 98 Ca 0.00 -0.75 -0.11 0.00 0.02 0.00 0.00 55.36 54.52 2cpt s GLN 98 Cb 0.00 -0.43 0.08 0.00 1.00 0.00 0.00 33.01 33.66 2cpt s GLN 98 CO 0.00 0.09 1.09 -1.25 -2.12 0.00 0.00 175.29 173.10 2cpt s PRO 99 N -1.48 1.96 0.11 2.91 0.04 -1.26 -5.08 135.00 132.21 2cpt s PRO 99 Ca -0.07 1.07 -0.19 0.00 0.04 0.00 0.00 61.00 61.85 2cpt s PRO 99 Cb -0.09 -1.87 0.05 0.00 0.04 0.00 0.00 34.50 32.62 2cpt s PRO 99 CO 0.01 -1.82 0.48 -1.12 0.04 0.00 0.00 177.00 174.59 2cpt s SER 100 N -3.40 -0.37 0.94 6.66 0.01 -1.26 -5.17 113.70 111.11 2cpt s SER 100 Ca 0.62 -0.09 -0.12 0.00 1.31 0.00 0.00 55.95 57.67 2cpt s SER 100 Cb -0.17 0.51 0.15 0.00 0.21 0.00 0.00 66.02 66.72 2cpt s SER 100 CO 0.56 -0.83 1.09 -2.16 0.41 0.00 0.00 173.24 172.31 2cpt s PRO 101 N -3.35 0.90 -0.31 12.44 0.04 -1.26 -4.98 135.00 138.48 2cpt s PRO 101 Ca -0.00 0.70 -0.28 0.00 0.04 0.00 0.00 61.00 61.45 2cpt s PRO 101 Cb 0.00 -1.78 0.01 0.00 0.04 0.00 0.00 34.50 32.78 2cpt s PRO 101 CO -0.09 -2.45 1.03 0.00 0.04 0.00 0.00 177.00 175.53 2cpt s ALA 102 N -2.94 3.51 -0.30 8.56 0.00 -1.26 -4.96 121.76 124.36 2cpt s ALA 102 Ca 0.64 -0.11 -0.09 0.00 0.00 0.00 0.00 51.96 52.41 2cpt s ALA 102 Cb -0.18 -3.61 0.18 0.00 0.00 0.00 0.00 23.12 19.51 2cpt s ALA 102 CO 0.57 -1.43 0.92 0.34 0.00 0.00 0.00 175.76 176.16 2cpt s ASP 103 N 1.63 -0.74 0.21 0.00 -1.08 -1.26 -5.18 116.67 110.26 2cpt s ASP 103 Ca 0.43 0.36 0.04 0.00 -0.52 0.00 0.00 52.55 52.87 2cpt s ASP 103 Cb -0.13 1.58 -0.05 0.00 -1.46 0.00 0.00 42.92 42.86 2cpt s ASP 103 CO 0.15 -0.14 -0.04 -0.70 0.52 0.00 0.00 175.17 174.96 2cpt s GLU 104 N 2.93 1.28 -0.28 4.34 -6.30 -1.26 -5.16 118.70 114.24 2cpt s GLU 104 Ca 0.09 -1.62 -0.21 0.00 -2.50 0.00 0.00 54.97 50.73 2cpt s GLU 104 Cb -0.10 -0.69 0.10 0.00 0.00 0.00 0.00 34.13 33.44 2cpt s GLU 104 CO -0.16 -0.02 0.87 0.21 0.02 0.00 0.00 175.26 176.17 2cpt s LYS 105 N -3.81 0.61 -0.19 4.30 2.20 -1.26 -5.15 119.74 116.44 2cpt s LYS 105 Ca 0.25 0.85 0.01 0.00 -0.36 0.00 0.00 55.97 56.72 2cpt s LYS 105 Cb 0.04 0.23 0.02 0.00 -1.51 0.00 0.00 37.83 36.61 2cpt s LYS 105 CO 0.07 -0.09 -0.19 0.20 -0.36 0.00 0.00 175.35 174.97 2cpt s GLY 106 N 0.81 1.41 -0.06 5.54 0.00 -1.26 -5.08 107.32 108.67 2cpt s GLY 106 Ca -0.03 -1.24 -0.29 0.00 0.00 0.00 0.00 44.72 43.15 2cpt s GLY 106 CO -0.09 0.30 1.97 0.21 0.00 0.00 0.00 173.10 175.49 2cpt s ASN 107 N 1.29 6.20 -0.25 1.64 2.47 -1.26 -4.88 114.94 120.15 2cpt s ASN 107 Ca 0.04 2.32 -0.28 0.00 0.42 0.00 0.00 52.86 55.37 2cpt s ASN 107 Cb -0.13 -2.53 -0.05 0.00 -1.45 0.00 0.00 41.25 37.09 2cpt s ASN 107 CO -0.12 -1.31 2.18 1.51 -3.72 0.00 0.00 177.10 175.64 2cpt s ASP 108 N 5.35 5.44 0.21 -4.21 -4.77 -1.26 -4.88 116.67 112.55 2cpt s ASP 108 Ca 0.89 1.77 -0.29 0.00 -3.30 0.00 0.00 52.55 51.62 2cpt s ASP 108 Cb -0.38 -2.51 -0.17 0.00 -1.09 0.00 0.00 42.92 38.78 2cpt s ASP 108 CO 0.38 -1.99 0.63 -1.20 0.70 0.00 0.00 175.17 173.69 2cpt n SER 109 N 11.79 -0.74 -0.06 2.11 7.64 -1.26 -4.86 113.62 128.24 2cpt n SER 109 Ca 0.29 1.14 -0.10 0.00 1.01 0.00 0.00 58.87 61.21 2cpt n SER 109 Cb 0.46 -1.01 -0.03 0.00 -1.01 0.00 0.00 64.21 62.62 2cpt n SER 109 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2cpt h ASP 110 N 1.28 0.28 0.00 6.43 3.32 -2.05 -3.46 116.42 122.23 2cpt h ASP 110 Ca -0.31 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.68 2cpt h ASP 110 Cb 1.42 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.90 2cpt h ASP 110 CO 0.58 0.26 0.00 0.61 -1.72 0.00 0.00 179.24 178.97 2cpt n GLY 111 N -1.00 2.11 3.76 2.75 0.00 -1.26 -4.96 105.19 106.59 2cpt n GLY 111 Ca -0.03 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.32 2cpt n GLY 111 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cpt s SER 112 N -1.15 6.58 -0.39 1.61 1.04 -1.26 -4.96 113.70 115.17 2cpt s SER 112 Ca 0.00 2.78 -0.02 0.00 0.48 0.00 0.00 55.95 59.19 2cpt s SER 112 Cb 0.00 -2.64 0.22 0.00 0.10 0.00 0.00 66.02 63.71 2cpt s SER 112 CO 0.00 -0.73 1.04 0.61 0.98 0.00 0.00 173.24 175.13 2cpt n GLY 113 N 1.67 -1.32 3.70 7.32 0.00 -1.26 -5.14 105.19 110.16 2cpt n GLY 113 Ca 0.05 0.95 -0.42 0.00 0.00 0.00 0.00 46.02 46.60 2cpt n GLY 113 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cpt s PRO 114 N 0.74 4.29 -0.14 1.61 0.04 -1.26 -5.02 135.00 135.27 2cpt s PRO 114 Ca 0.26 2.02 -0.05 0.00 0.04 0.00 0.00 61.00 63.28 2cpt s PRO 114 Cb 0.13 -3.47 -0.04 0.00 0.04 0.00 0.00 34.50 31.16 2cpt s PRO 114 CO -0.10 -0.54 0.04 -1.54 0.04 0.00 0.00 177.00 174.89 2cpt s SER 115 N 1.68 5.47 0.29 6.66 1.04 -1.26 -5.08 113.70 122.49 2cpt s SER 115 Ca 0.65 0.12 -0.29 0.00 0.48 0.00 0.00 55.95 56.91 2cpt s SER 115 Cb -0.34 -1.78 -0.10 0.00 0.10 0.00 0.00 66.02 63.90 2cpt s SER 115 CO 0.28 0.27 1.30 -0.55 0.98 0.00 0.00 173.24 175.53 2cpt s SER 116 N -0.23 6.83 0.00 7.02 0.15 -1.26 -5.37 113.70 120.83 2cpt s SER 116 Ca 0.07 2.60 0.00 0.00 0.70 0.00 0.00 55.95 59.31 2cpt s SER 116 Cb -0.12 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.55 2cpt s SER 116 CO 0.02 -0.52 0.00 0.61 1.20 0.00 0.00 173.24 174.55