#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cpt s SER 2 N 0.00 5.09 0.05 1.61 1.04 -1.26 -5.01 113.70 115.22 2cpt s SER 2 Ca 0.00 0.96 -0.34 0.00 0.48 0.00 0.00 55.95 57.05 2cpt s SER 2 Cb 0.00 -1.65 -0.19 0.00 0.10 0.00 0.00 66.02 64.28 2cpt s SER 2 CO 0.00 -1.54 1.44 -1.28 0.98 0.00 0.00 173.24 172.84 2cpt h SER 3 N -0.78 -1.05 0.00 7.02 0.87 -2.12 -3.48 113.55 114.02 2cpt h SER 3 Ca -0.45 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.14 2cpt h SER 3 Cb 1.28 0.27 0.00 0.00 -0.44 0.00 0.00 62.40 63.51 2cpt h SER 3 CO 0.64 -0.72 0.00 0.61 -0.53 0.00 0.00 176.83 176.84 2cpt n GLY 4 N -1.42 1.93 0.13 5.77 0.00 -1.26 -5.06 105.19 105.28 2cpt n GLY 4 Ca -0.15 -0.38 -0.22 0.00 0.00 0.00 0.00 46.02 45.26 2cpt n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2cpt n SER 5 N 0.00 1.99 -4.08 1.61 2.88 -1.26 -4.90 113.62 109.86 2cpt n SER 5 Ca 0.00 0.09 -0.32 0.00 -1.33 0.00 0.00 58.87 57.30 2cpt n SER 5 Cb 0.00 -0.63 -0.16 0.00 -0.75 0.00 0.00 64.21 62.67 2cpt n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2cpt s SER 6 N -6.89 3.64 0.19 -3.46 1.04 -1.26 -5.11 113.70 101.85 2cpt s SER 6 Ca -0.34 -0.96 0.01 0.00 0.48 0.00 0.00 55.95 55.14 2cpt s SER 6 Cb 0.10 -1.46 -0.05 0.00 0.10 0.00 0.00 66.02 64.72 2cpt s SER 6 CO 0.60 -0.10 0.05 -0.83 0.98 0.00 0.00 173.24 173.94 2cpt s GLY 7 N 1.24 1.33 -0.67 7.32 0.00 -1.26 -5.09 107.32 110.20 2cpt s GLY 7 Ca -0.01 -1.65 -0.26 0.00 0.00 0.00 0.00 44.72 42.79 2cpt s GLY 7 CO -0.09 -1.49 1.75 1.06 0.00 0.00 0.00 173.10 174.32 2cpt s MET 8 N -4.01 2.75 0.13 2.90 1.00 -1.26 -4.95 119.30 115.87 2cpt s MET 8 Ca 0.29 0.33 0.04 0.00 0.00 0.00 0.00 55.69 56.35 2cpt s MET 8 Cb 0.07 -4.43 -0.04 0.00 0.00 0.00 0.00 34.83 30.42 2cpt s MET 8 CO 0.07 -2.67 -0.10 -1.12 0.00 0.00 0.00 175.02 171.20 2cpt s SER 9 N 7.20 1.67 0.15 3.03 0.01 -1.26 -5.14 113.70 119.36 2cpt s SER 9 Ca 0.61 -0.97 -0.28 0.00 1.31 0.00 0.00 55.95 56.62 2cpt s SER 9 Cb -0.11 0.00 -0.07 0.00 0.21 0.00 0.00 66.02 66.05 2cpt s SER 9 CO 0.17 -0.33 0.88 -0.44 0.41 0.00 0.00 173.24 173.93 2cpt s SER 10 N -3.00 7.47 -0.09 2.44 0.01 -1.26 -5.06 113.70 114.22 2cpt s SER 10 Ca 0.14 1.75 0.01 0.00 1.31 0.00 0.00 55.95 59.15 2cpt s SER 10 Cb 0.02 -2.55 0.02 0.00 0.21 0.00 0.00 66.02 63.71 2cpt s SER 10 CO -0.00 0.08 -0.09 0.28 0.41 0.00 0.00 173.24 173.93 2cpt s THR 11 N -0.64 1.01 0.33 1.44 -1.32 -1.26 -5.11 115.64 110.09 2cpt s THR 11 Ca 0.41 -0.33 -0.17 0.00 -1.21 0.00 0.00 61.69 60.39 2cpt s THR 11 Cb -0.24 -1.00 -0.13 0.00 -1.51 0.00 0.00 72.50 69.63 2cpt s THR 11 CO 0.28 0.35 0.05 -1.20 -2.21 0.00 0.00 174.62 171.90 2cpt n SER 12 N 4.52 -2.40 0.17 8.08 7.64 -1.26 -4.67 113.62 125.71 2cpt n SER 12 Ca -0.17 0.64 0.02 0.00 1.01 0.00 0.00 58.87 60.37 2cpt n SER 12 Cb 0.51 -0.71 0.30 0.00 -1.01 0.00 0.00 64.21 63.29 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 0.23 0.00 -0.30 1.43 0.13 -2.00 -2.60 132.00 128.90 2cpt h PRO 13 Ca -0.30 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.70 2cpt h PRO 13 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2cpt h PRO 13 CO 0.37 0.46 -0.36 -0.91 -0.23 0.00 0.00 178.00 177.34 2cpt h ASN 14 N 0.00 0.70 0.36 1.44 2.35 -1.97 -2.93 115.58 115.54 2cpt h ASN 14 Ca -0.00 -0.30 -0.02 0.00 -0.55 0.00 0.00 56.30 55.43 2cpt h ASN 14 Cb 0.84 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 39.02 2cpt h ASN 14 CO 0.06 0.99 -0.17 0.25 -1.65 0.00 0.00 177.43 176.91 2cpt h LEU 15 N 0.56 -0.41 -0.98 1.61 5.85 -1.83 -3.06 115.31 117.05 2cpt h LEU 15 Ca 0.06 0.01 0.35 0.00 0.84 0.00 0.00 57.88 59.13 2cpt h LEU 15 Cb 0.87 0.11 -0.17 0.00 0.37 0.00 0.00 40.66 41.84 2cpt h LEU 15 CO 0.08 0.03 0.40 -0.61 -0.34 0.00 0.00 178.44 178.00 2cpt h GLN 16 N -1.13 0.09 -0.79 1.25 5.75 -1.56 1.13 115.11 119.86 2cpt h GLN 16 Ca -0.05 -0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.40 2cpt h GLN 16 Cb 0.38 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 28.87 2cpt h GLN 16 CO 0.08 0.06 0.32 -0.22 -2.65 0.00 0.00 178.83 176.43 2cpt h LYS 17 N 0.10 1.18 -0.86 1.69 3.64 -1.57 -2.38 116.57 118.37 2cpt h LYS 17 Ca 0.74 -0.21 0.03 0.00 -1.27 0.00 0.00 60.65 59.94 2cpt h LYS 17 Cb 1.78 -0.19 -0.05 0.00 -0.41 0.00 0.00 32.23 33.36 2cpt h LYS 17 CO -0.75 0.94 0.55 0.00 -2.27 0.00 0.00 179.45 177.92 2cpt h ALA 18 N 1.20 1.12 0.75 5.00 0.00 0.14 -0.67 119.26 126.80 2cpt h ALA 18 Ca 0.27 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 2cpt h ALA 18 Cb 0.20 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.70 2cpt h ALA 18 CO -0.02 0.40 -0.36 0.82 0.00 0.00 0.00 179.25 180.09 2cpt h ILE 19 N 1.08 0.00 -0.58 0.00 5.03 -1.10 -1.80 117.51 120.15 2cpt h ILE 19 Ca 0.34 -0.25 0.12 0.00 -0.12 0.00 0.00 64.86 64.95 2cpt h ILE 19 Cb -0.01 0.00 -0.10 0.00 -3.03 0.00 0.00 36.82 33.68 2cpt h ILE 19 CO -0.11 0.00 -0.05 -0.78 -0.68 0.00 0.00 178.15 176.53 2cpt h ASP 20 N -1.25 -0.36 0.34 1.72 1.82 -1.37 -0.74 116.42 116.57 2cpt h ASP 20 Ca -0.10 0.15 -0.01 0.00 -0.39 0.00 0.00 57.03 56.68 2cpt h ASP 20 Cb 0.77 0.29 -0.01 0.00 0.68 0.00 0.00 39.33 41.06 2cpt h ASP 20 CO 0.17 -0.14 -0.32 -0.07 -1.61 0.00 0.00 179.24 177.27 2cpt h LEU 21 N 0.07 -0.88 -1.11 2.28 3.38 -1.13 -1.05 115.31 116.87 2cpt h LEU 21 Ca 0.29 0.07 0.31 0.00 0.09 0.00 0.00 57.88 58.64 2cpt h LEU 21 Cb 0.46 0.29 -0.13 0.00 0.09 0.00 0.00 40.66 41.37 2cpt h LEU 21 CO -0.53 -0.43 0.62 0.00 0.09 0.00 0.00 178.44 178.19 2cpt h ALA 22 N -1.24 2.04 -0.15 1.53 0.00 -0.94 0.16 119.26 120.67 2cpt h ALA 22 Ca -0.04 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2cpt h ALA 22 Cb 0.56 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2cpt h ALA 22 CO -0.03 -0.59 0.06 1.03 0.00 0.00 0.00 179.25 179.72 2cpt h SER 23 N 0.38 0.21 -0.56 0.00 0.87 -0.57 -2.99 113.55 110.89 2cpt h SER 23 Ca 0.70 -0.16 0.09 0.00 -1.23 0.00 0.00 61.79 61.19 2cpt h SER 23 Cb 1.63 -0.05 -0.07 0.00 -0.44 0.00 0.00 62.40 63.47 2cpt h SER 23 CO -0.50 0.31 0.18 0.50 -0.53 0.00 0.00 176.83 176.79 2cpt h LYS 24 N 0.09 0.34 -0.81 2.24 3.64 0.60 -2.65 116.57 120.02 2cpt h LYS 24 Ca 0.05 -0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.49 2cpt h LYS 24 Cb 0.17 -0.08 -0.11 0.00 -0.41 0.00 0.00 32.23 31.80 2cpt h LYS 24 CO -0.00 0.22 -0.56 0.00 -2.27 0.00 0.00 179.45 176.84 2cpt h ALA 25 N 1.40 -0.55 -0.25 5.00 0.00 -1.25 -0.75 119.26 122.86 2cpt h ALA 25 Ca 0.28 0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.35 2cpt h ALA 25 Cb 0.35 1.26 -0.08 0.00 0.00 0.00 0.00 17.79 19.33 2cpt h ALA 25 CO -0.31 -0.96 -0.40 0.00 0.00 0.00 0.00 179.25 177.58 2cpt h ALA 26 N 0.42 -0.47 -0.90 0.00 0.00 -1.51 -1.62 119.26 115.19 2cpt h ALA 26 Ca 0.15 0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.24 2cpt h ALA 26 Cb 0.48 0.79 -0.16 0.00 0.00 0.00 0.00 17.79 18.91 2cpt h ALA 26 CO -0.83 -0.87 -0.33 1.96 0.00 0.00 0.00 179.25 179.17 2cpt h GLN 27 N -0.40 -0.03 -0.19 0.00 1.08 -1.07 0.22 115.11 114.71 2cpt h GLN 27 Ca 0.11 0.00 0.03 0.00 -1.45 0.00 0.00 58.65 57.34 2cpt h GLN 27 Cb 0.59 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.00 2cpt h GLN 27 CO -0.46 -0.02 0.01 0.93 -0.95 0.00 0.00 178.83 178.34 2cpt h GLU 28 N -0.03 0.08 -0.18 1.46 4.39 -0.66 -1.79 114.58 117.85 2cpt h GLU 28 Ca 0.35 -0.00 0.03 0.00 0.34 0.00 0.00 59.36 60.08 2cpt h GLU 28 Cb 0.61 -0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 29.18 2cpt h GLU 28 CO -0.92 0.05 -0.48 0.22 -1.16 0.00 0.00 179.01 176.72 2cpt h ASP 29 N 0.08 -1.54 -0.66 1.42 1.82 0.25 0.45 116.42 118.23 2cpt h ASP 29 Ca 0.09 0.19 0.12 0.00 -0.39 0.00 0.00 57.03 57.04 2cpt h ASP 29 Cb 0.10 0.61 -0.09 0.00 0.68 0.00 0.00 39.33 40.63 2cpt h ASP 29 CO -0.14 -0.41 0.21 0.50 -1.61 0.00 0.00 179.24 177.79 2cpt h LYS 30 N -0.47 0.34 -0.11 0.28 3.11 -1.18 0.14 116.57 118.69 2cpt h LYS 30 Ca 0.04 -0.02 -0.01 0.00 -2.81 0.00 0.00 60.65 57.84 2cpt h LYS 30 Cb 0.58 -0.08 -0.01 0.00 -1.00 0.00 0.00 32.23 31.72 2cpt h LYS 30 CO -0.42 0.23 0.01 0.00 -2.81 0.00 0.00 179.45 176.46 2cpt h ALA 31 N 1.50 1.82 0.00 5.00 0.00 -0.35 -3.46 119.26 123.77 2cpt h ALA 31 Ca 0.35 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2cpt h ALA 31 Cb 0.52 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2cpt h ALA 31 CO -0.39 0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.41 2cpt n GLY 32 N -1.35 0.81 3.51 0.00 0.00 0.86 -5.09 105.19 103.94 2cpt n GLY 32 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.43 6.32 -0.20 1.61 0.01 0.12 -4.86 114.94 117.51 2cpt s ASN 33 Ca 0.00 -0.43 -0.05 0.00 -0.71 0.00 0.00 52.86 51.67 2cpt s ASN 33 Cb 0.00 -2.42 -0.20 0.00 0.41 0.00 0.00 41.25 39.03 2cpt s ASN 33 CO 0.00 -1.21 0.02 -1.22 -1.51 0.00 0.00 177.10 173.18 2cpt n TYR 34 N 7.36 0.57 -0.24 2.20 4.02 -1.26 -2.73 117.16 127.08 2cpt n TYR 34 Ca 0.01 0.14 -0.03 0.00 -0.01 0.00 0.00 57.90 58.01 2cpt n TYR 34 Cb 0.47 -1.07 0.09 0.00 -0.02 0.00 0.00 39.34 38.81 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 -0.17 0.78 -0.09 -0.72 4.22 -1.94 0.05 114.58 116.70 2cpt h GLU 35 Ca -0.51 -0.05 -0.12 0.00 0.08 0.00 0.00 59.36 58.76 2cpt h GLU 35 Cb 1.87 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 30.95 2cpt h GLU 35 CO -0.07 0.51 -0.41 1.49 -2.18 0.00 0.00 179.01 178.36 2cpt h GLU 36 N 0.80 0.44 -0.96 1.92 4.57 -1.98 -3.17 114.58 116.21 2cpt h GLU 36 Ca 0.29 -0.35 0.08 0.00 -1.18 0.00 0.00 59.36 58.19 2cpt h GLU 36 Cb 0.08 0.07 -0.07 0.00 -0.16 0.00 0.00 28.75 28.67 2cpt h GLU 36 CO -0.13 0.98 0.62 0.00 -1.18 0.00 0.00 179.01 179.30 2cpt h ALA 37 N 0.46 1.49 0.77 2.92 0.00 -1.49 -2.44 119.26 120.97 2cpt h ALA 37 Ca -0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2cpt h ALA 37 Cb 1.05 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 2cpt h ALA 37 CO 0.09 0.35 -0.46 1.25 0.00 0.00 0.00 179.25 180.48 2cpt h LEU 38 N 1.07 -1.16 -0.54 0.00 5.85 -1.01 0.96 115.31 120.49 2cpt h LEU 38 Ca 0.42 0.06 0.11 0.00 0.84 0.00 0.00 57.88 59.31 2cpt h LEU 38 Cb 0.25 0.33 -0.11 0.00 0.37 0.00 0.00 40.66 41.50 2cpt h LEU 38 CO -0.17 -0.72 -0.18 1.56 -0.34 0.00 0.00 178.44 178.58 2cpt h GLN 39 N -1.15 -0.05 -0.88 1.25 1.08 -1.47 0.55 115.11 114.43 2cpt h GLN 39 Ca -0.10 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.11 2cpt h GLN 39 Cb 0.92 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.32 2cpt h GLN 39 CO 0.11 -0.03 0.58 -0.07 -0.95 0.00 0.00 178.83 178.47 2cpt h LEU 40 N -0.05 1.01 -1.31 1.46 3.38 -1.30 -1.45 115.31 117.05 2cpt h LEU 40 Ca 0.26 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.23 2cpt h LEU 40 Cb 0.45 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 2cpt h LEU 40 CO -0.59 0.73 0.48 1.88 0.09 0.00 0.00 178.44 181.04 2cpt h TYR 41 N 1.19 0.88 -0.15 1.13 0.05 0.13 -0.62 116.97 119.58 2cpt h TYR 41 Ca 0.33 0.02 -0.11 0.00 0.05 0.00 0.00 58.73 59.01 2cpt h TYR 41 Cb -0.13 -0.29 0.00 0.00 1.01 0.00 0.00 36.73 37.32 2cpt h TYR 41 CO -0.01 0.52 -0.35 1.96 -1.05 0.00 0.00 178.16 179.23 2cpt h GLN 42 N 0.92 0.50 0.87 4.88 4.20 -0.44 -3.28 115.11 122.77 2cpt h GLN 42 Ca 0.28 -0.34 -0.04 0.00 0.06 0.00 0.00 58.65 58.61 2cpt h GLN 42 Cb 0.01 0.05 0.01 0.00 0.30 0.00 0.00 27.48 27.84 2cpt h GLN 42 CO -0.08 0.95 -0.42 0.45 -0.67 0.00 0.00 178.83 179.07 2cpt h HIS 43 N 0.12 -1.08 -0.75 2.96 3.86 -0.85 -2.14 115.15 117.27 2cpt h HIS 43 Ca -0.00 -0.03 0.17 0.00 -1.16 0.00 0.00 60.37 59.35 2cpt h HIS 43 Cb 0.96 0.36 -0.14 0.00 1.06 0.00 0.00 27.41 29.65 2cpt h HIS 43 CO 0.10 -0.67 -0.12 0.00 0.86 0.00 0.00 177.93 178.10 2cpt n ALA 44 N -2.61 0.25 -0.02 2.45 0.00 -0.28 0.93 120.51 121.23 2cpt n ALA 44 Ca -0.15 0.82 -0.12 0.00 0.00 0.00 0.00 53.44 53.98 2cpt n ALA 44 Cb 0.47 -0.53 -0.08 0.00 0.00 0.00 0.00 19.45 19.31 2cpt n ALA 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2cpt h VAL 45 N 0.00 1.27 -0.85 0.00 2.07 -1.58 -1.62 116.25 115.55 2cpt h VAL 45 Ca 0.39 -0.83 0.22 0.00 0.82 0.00 0.00 66.70 67.30 2cpt h VAL 45 Cb 0.68 1.72 -0.14 0.00 -1.52 0.00 0.00 31.29 32.03 2cpt h VAL 45 CO -0.75 0.23 0.18 1.56 0.02 0.00 0.00 177.57 178.80 2cpt h GLN 46 N -0.22 0.18 -0.05 1.57 1.08 0.12 0.92 115.11 118.72 2cpt h GLN 46 Ca 0.01 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 2cpt h GLN 46 Cb 0.36 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.75 2cpt h GLN 46 CO 0.00 0.12 -0.13 1.88 -0.95 0.00 0.00 178.83 179.76 2cpt h TYR 47 N 0.19 0.22 -0.69 2.96 0.05 -1.19 -2.39 116.97 116.13 2cpt h TYR 47 Ca 0.51 -0.09 0.14 0.00 0.05 0.00 0.00 58.73 59.35 2cpt h TYR 47 Cb 1.00 -0.04 -0.10 0.00 1.01 0.00 0.00 36.73 38.60 2cpt h TYR 47 CO -0.30 0.73 0.14 0.74 -1.05 0.00 0.00 178.16 178.42 2cpt h PHE 48 N -0.35 0.22 0.41 4.88 0.04 -0.10 -1.60 116.94 120.43 2cpt h PHE 48 Ca -0.00 0.04 -0.02 0.00 2.80 0.00 0.00 57.97 60.79 2cpt h PHE 48 Cb 0.73 0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.89 2cpt h PHE 48 CO 0.12 -0.08 -0.19 -0.07 -0.60 0.00 0.00 178.31 177.49 2cpt h LEU 49 N 0.25 -0.46 -1.39 1.54 3.38 -0.93 -2.55 115.31 115.15 2cpt h LEU 49 Ca 0.38 0.02 0.45 0.00 0.09 0.00 0.00 57.88 58.81 2cpt h LEU 49 Cb 0.62 0.12 -0.11 0.00 0.09 0.00 0.00 40.66 41.38 2cpt h LEU 49 CO -0.48 -0.23 0.93 1.57 0.09 0.00 0.00 178.44 180.31 2cpt n HIS 50 N -4.00 0.45 -0.03 1.13 -0.00 -0.90 0.20 115.22 112.07 2cpt n HIS 50 Ca -0.07 0.45 -0.15 0.00 0.46 0.00 0.00 57.72 58.41 2cpt n HIS 50 Cb 0.21 -0.88 -0.09 0.00 -0.12 0.00 0.00 29.99 29.12 2cpt n HIS 50 CO 0.00 0.00 0.00 0.28 0.46 0.00 0.00 176.34 177.08 2cpt h VAL 51 N 0.00 1.39 0.00 3.57 2.07 -1.20 -2.44 116.25 119.64 2cpt h VAL 51 Ca 0.80 -1.78 0.00 0.00 0.82 0.00 0.00 66.70 66.55 2cpt h VAL 51 Cb 2.78 2.25 0.00 0.00 -1.52 0.00 0.00 31.29 34.80 2cpt h VAL 51 CO -0.30 0.52 0.00 0.52 0.02 0.00 0.00 177.57 178.33 2cpt n VAL 52 N -4.32 0.39 -0.06 2.57 0.31 0.53 0.15 118.33 117.89 2cpt n VAL 52 Ca -0.08 0.10 -0.22 0.00 -0.01 0.00 0.00 64.34 64.12 2cpt n VAL 52 Cb 0.55 -0.74 -0.12 0.00 -0.91 0.00 0.00 33.84 32.62 2cpt n VAL 52 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2cpt n LYS 53 N -1.34 0.66 0.02 5.55 4.81 0.28 -4.55 118.16 123.59 2cpt n LYS 53 Ca 0.09 0.35 -0.02 0.00 -0.87 0.00 0.00 58.31 57.86 2cpt n LYS 53 Cb 0.19 -1.67 -0.01 0.00 0.02 0.00 0.00 35.03 33.56 2cpt n LYS 53 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2cpt n TYR 54 N -3.86 0.00 -0.67 5.64 4.02 -0.93 -4.73 117.16 116.63 2cpt n TYR 54 Ca -0.36 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.48 2cpt n TYR 54 Cb 0.90 -0.10 -0.05 0.00 -0.02 0.00 0.00 39.34 40.07 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 -3.54 1.34 -0.55 -0.72 -0.58 0.18 -4.93 120.64 111.84 2cpt n GLU 55 Ca -0.04 -0.37 -0.30 0.00 -0.42 0.00 0.00 57.16 56.04 2cpt n GLU 55 Cb 0.20 -1.33 0.21 0.00 -0.57 0.00 0.00 31.44 29.95 2cpt n GLU 55 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2cpt n ALA 56 N 1.76 -3.67 0.09 0.62 0.00 0.12 -4.52 120.51 114.92 2cpt n ALA 56 Ca 0.14 -1.32 0.00 0.00 0.00 0.00 0.00 53.44 52.26 2cpt n ALA 56 Cb 0.63 -1.62 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 -3.33 0.00 -3.81 0.00 10.64 -1.26 -4.99 117.38 114.63 2cpt n GLN 57 Ca 0.02 0.00 -0.01 0.00 -1.83 0.00 0.00 57.00 55.19 2cpt n GLN 57 Cb 0.58 -0.14 0.00 0.00 -0.86 0.00 0.00 30.24 29.82 2cpt n GLN 57 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 2cpt s GLY 58 N -4.80 -0.16 0.01 2.61 0.00 -1.26 -5.02 107.32 98.71 2cpt s GLY 58 Ca 0.00 0.13 -0.22 0.00 0.00 0.00 0.00 44.72 44.63 2cpt s GLY 58 CO 0.00 2.02 1.04 -1.80 0.00 0.00 0.00 173.10 174.36 2cpt h ASP 59 N 2.00 -0.67 -1.00 1.64 1.82 -2.02 0.23 116.42 118.42 2cpt h ASP 59 Ca -0.27 0.02 0.27 0.00 -0.39 0.00 0.00 57.03 56.67 2cpt h ASP 59 Cb 1.21 0.17 -0.06 0.00 0.68 0.00 0.00 39.33 41.33 2cpt h ASP 59 CO 0.31 -0.36 0.69 0.11 -1.61 0.00 0.00 179.24 178.37 2cpt h LYS 60 N -1.03 0.17 0.14 0.28 1.57 -2.01 -2.30 116.57 113.40 2cpt h LYS 60 Ca -0.08 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2cpt h LYS 60 Cb 0.61 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.88 2cpt h LYS 60 CO 0.13 0.11 -0.07 0.00 -0.57 0.00 0.00 179.45 179.06 2cpt h ALA 61 N 1.55 -0.21 -0.82 3.86 0.00 -1.93 -3.16 119.26 118.55 2cpt h ALA 61 Ca 0.51 -0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.55 2cpt h ALA 61 Cb 1.68 0.07 -0.16 0.00 0.00 0.00 0.00 17.79 19.38 2cpt h ALA 61 CO -0.11 -0.19 -0.18 1.63 0.00 0.00 0.00 179.25 180.39 2cpt n LYS 62 N -4.58 -0.07 -0.11 0.00 5.02 0.79 0.14 118.16 119.34 2cpt n LYS 62 Ca -0.02 1.28 -0.07 0.00 -2.02 0.00 0.00 58.31 57.47 2cpt n LYS 62 Cb 0.07 -1.92 0.01 0.00 -0.02 0.00 0.00 35.03 33.17 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 0.39 0.18 1.97 4.20 -1.56 -0.75 115.11 119.53 2cpt h GLN 63 Ca 0.41 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 59.10 2cpt h GLN 63 Cb 0.65 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.31 2cpt h GLN 63 CO -0.84 0.26 -0.41 0.77 -0.67 0.00 0.00 178.83 177.94 2cpt h SER 64 N 0.40 -1.21 -0.72 1.46 0.02 0.13 -0.17 113.55 113.46 2cpt h SER 64 Ca 0.15 0.12 0.10 0.00 -0.84 0.00 0.00 61.79 61.32 2cpt h SER 64 Cb 0.03 0.43 -0.08 0.00 0.14 0.00 0.00 62.40 62.93 2cpt h SER 64 CO -0.08 -0.46 0.34 0.40 -1.14 0.00 0.00 176.83 175.88 2cpt h ILE 65 N -0.65 0.80 -0.66 3.27 2.04 -1.30 -1.46 117.51 119.56 2cpt h ILE 65 Ca -0.02 -0.19 0.09 0.00 1.00 0.00 0.00 64.86 65.74 2cpt h ILE 65 Cb 0.62 0.19 -0.07 0.00 -0.74 0.00 0.00 36.82 36.83 2cpt h ILE 65 CO -0.18 0.10 0.30 0.03 0.00 0.00 0.00 178.15 178.40 2cpt h ARG 66 N 0.56 0.51 -0.86 2.37 3.08 -0.61 -0.42 114.38 119.00 2cpt h ARG 66 Ca 0.36 -0.03 0.13 0.00 0.07 0.00 0.00 59.98 60.52 2cpt h ARG 66 Cb 0.43 -0.11 -0.07 0.00 0.08 0.00 0.00 29.97 30.30 2cpt h ARG 66 CO -0.30 0.33 0.56 0.00 -1.07 0.00 0.00 179.97 179.49 2cpt h ALA 67 N 1.42 1.85 -0.06 0.04 0.00 0.07 -0.45 119.26 122.12 2cpt h ALA 67 Ca 0.33 0.01 -0.21 0.00 0.00 0.00 0.00 54.91 55.04 2cpt h ALA 67 Cb 0.36 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2cpt h ALA 67 CO -0.28 -0.07 -0.82 0.87 0.00 0.00 0.00 179.25 178.96 2cpt h LYS 68 N 0.67 0.46 -0.34 0.00 1.79 -0.98 -2.78 116.57 115.39 2cpt h LYS 68 Ca 0.42 -0.42 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 2cpt h LYS 68 Cb 0.68 0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 31.41 2cpt h LYS 68 CO -0.18 1.06 0.16 0.00 -1.08 0.00 0.00 179.45 179.41 2cpt h THR 70 N 0.42 1.26 0.72 0.00 2.02 -1.31 -1.38 112.91 114.64 2cpt h THR 70 Ca 0.12 -1.00 -0.04 0.00 0.77 0.00 0.00 66.41 66.26 2cpt h THR 70 Cb 0.13 0.65 0.01 0.00 -1.74 0.00 0.00 68.15 67.20 2cpt h THR 70 CO -0.01 0.38 -0.35 -0.08 0.37 0.00 0.00 175.52 175.82 2cpt h GLU 71 N 0.98 -0.93 -0.96 6.66 4.57 -1.26 -1.25 114.58 122.38 2cpt h GLU 71 Ca 0.20 0.06 0.15 0.00 -1.18 0.00 0.00 59.36 58.59 2cpt h GLU 71 Cb 0.42 0.21 -0.08 0.00 -0.16 0.00 0.00 28.75 29.14 2cpt h GLU 71 CO 0.01 -0.62 0.61 1.88 -1.18 0.00 0.00 179.01 179.70 2cpt h TYR 72 N -1.09 0.98 -0.31 0.92 0.05 -1.29 -1.09 116.97 115.15 2cpt h TYR 72 Ca -0.10 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.70 2cpt h TYR 72 Cb 0.74 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 38.16 2cpt h TYR 72 CO 0.03 0.34 0.17 -0.07 -1.05 0.00 0.00 178.16 177.58 2cpt h LEU 73 N 0.81 0.38 -0.19 3.88 3.38 -1.16 -1.63 115.31 120.79 2cpt h LEU 73 Ca 0.50 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.39 2cpt h LEU 73 Cb 0.70 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 2cpt h LEU 73 CO -0.26 0.36 0.12 -0.78 0.09 0.00 0.00 178.44 177.96 2cpt h ASP 74 N 0.38 0.21 0.55 -0.43 1.82 -0.01 -2.35 116.42 116.58 2cpt h ASP 74 Ca 0.11 -0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 56.73 2cpt h ASP 74 Cb 0.06 -0.05 -0.01 0.00 0.68 0.00 0.00 39.33 40.01 2cpt h ASP 74 CO -0.02 0.15 -0.45 -0.09 -1.61 0.00 0.00 179.24 177.22 2cpt h ARG 75 N 0.25 -0.93 -0.81 0.28 9.65 -1.16 -2.81 114.38 118.84 2cpt h ARG 75 Ca 0.07 0.06 0.17 0.00 -1.10 0.00 0.00 59.98 59.18 2cpt h ARG 75 Cb -0.02 0.21 -0.15 0.00 -1.39 0.00 0.00 29.97 28.62 2cpt h ARG 75 CO -0.02 -0.62 -0.19 0.00 2.80 0.00 0.00 179.97 181.94 2cpt h ALA 76 N -1.10 0.56 -1.17 2.80 0.00 -1.27 0.52 119.26 119.60 2cpt h ALA 76 Ca -0.07 0.31 0.38 0.00 0.00 0.00 0.00 54.91 55.53 2cpt h ALA 76 Cb 0.81 0.61 -0.13 0.00 0.00 0.00 0.00 17.79 19.08 2cpt h ALA 76 CO -0.00 -0.41 0.73 0.93 0.00 0.00 0.00 179.25 180.50 2cpt h GLU 77 N 0.01 0.18 0.02 0.00 4.39 -1.15 0.23 114.58 118.25 2cpt h GLU 77 Ca 0.40 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 60.08 2cpt h GLU 77 Cb 0.62 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 2cpt h GLU 77 CO -0.83 0.12 -0.01 0.87 -1.16 0.00 0.00 179.01 178.00 2cpt h LYS 78 N 0.19 -0.02 -1.04 2.33 1.79 0.08 -3.13 116.57 116.76 2cpt h LYS 78 Ca 0.76 0.00 0.27 0.00 -2.18 0.00 0.00 60.65 59.51 2cpt h LYS 78 Cb 2.16 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 32.73 2cpt h LYS 78 CO -0.47 0.52 0.69 -0.07 -1.08 0.00 0.00 179.45 179.05 2cpt h LEU 79 N -0.58 0.36 0.36 2.94 3.38 -0.33 -0.59 115.31 120.85 2cpt h LEU 79 Ca -0.00 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2cpt h LEU 79 Cb 0.55 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2cpt h LEU 79 CO 0.00 0.07 -0.17 0.11 0.09 0.00 0.00 178.44 178.54 2cpt h LYS 80 N 0.32 -0.47 -0.03 1.13 1.57 -1.31 0.73 116.57 118.51 2cpt h LYS 80 Ca 0.57 0.03 0.01 0.00 -1.87 0.00 0.00 60.65 59.39 2cpt h LYS 80 Cb 1.60 0.11 -0.00 0.00 0.08 0.00 0.00 32.23 34.01 2cpt h LYS 80 CO -0.23 -0.20 0.06 0.93 -0.57 0.00 0.00 179.45 179.45 2cpt h GLU 81 N -0.69 0.00 0.12 3.15 4.39 -1.10 -0.41 114.58 120.03 2cpt h GLU 81 Ca -0.05 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.34 2cpt h GLU 81 Cb 0.49 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 2cpt h GLU 81 CO 0.08 0.00 -1.60 -0.92 -1.16 0.00 0.00 179.01 175.41 2cpt h TYR 82 N 0.00 0.45 -0.14 4.33 5.03 -0.91 -2.97 116.97 122.75 2cpt h TYR 82 Ca 0.01 -0.33 -0.08 0.00 2.58 0.00 0.00 58.73 60.92 2cpt h TYR 82 Cb 0.14 -0.02 -0.00 0.00 1.55 0.00 0.00 36.73 38.40 2cpt h TYR 82 CO 0.00 1.42 -0.23 -0.07 -1.32 0.00 0.00 178.16 177.96 2cpt h LEU 83 N 0.07 0.44 -0.41 2.82 3.38 0.42 -2.55 115.31 119.48 2cpt h LEU 83 Ca -0.27 -0.54 -0.04 0.00 0.09 0.00 0.00 57.88 57.12 2cpt h LEU 83 Cb 2.02 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 42.63 2cpt h LEU 83 CO 0.15 0.89 0.09 0.07 0.09 0.00 0.00 178.44 179.73 2cpt h LYS 84 N 0.00 0.66 -0.96 1.13 2.10 -1.29 -2.44 116.57 115.77 2cpt h LYS 84 Ca 0.01 -0.16 0.04 0.00 -2.00 0.00 0.00 60.65 58.54 2cpt h LYS 84 Cb 0.80 -0.08 -0.06 0.00 -0.90 0.00 0.00 32.23 31.99 2cpt h LYS 84 CO 0.05 0.69 0.62 -0.91 -2.00 0.00 0.00 179.45 177.90 2cpt h ASN 85 N 0.52 1.03 0.00 7.07 2.35 -1.56 -3.22 115.58 121.77 2cpt h ASN 85 Ca 0.13 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 2cpt h ASN 85 Cb 0.33 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.47 2cpt h ASN 85 CO 0.00 0.70 0.00 1.17 -1.65 0.00 0.00 177.43 177.65 2cpt n LYS 86 N -4.48 0.00 -1.51 0.81 4.81 -0.96 -4.54 118.16 112.28 2cpt n LYS 86 Ca 0.13 0.47 -0.45 0.00 -0.87 0.00 0.00 58.31 57.59 2cpt n LYS 86 Cb 0.11 -1.38 -0.06 0.00 0.02 0.00 0.00 35.03 33.72 2cpt n LYS 86 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2cpt n GLU 87 N -1.91 1.21 -1.00 1.64 -0.58 -0.94 -4.81 120.64 114.25 2cpt n GLU 87 Ca 0.00 0.27 -0.35 0.00 -0.42 0.00 0.00 57.16 56.66 2cpt n GLU 87 Cb 0.00 -2.79 -0.02 0.00 -0.57 0.00 0.00 31.44 28.05 2cpt n GLU 87 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2cpt n LYS 88 N 8.54 0.00 -1.56 3.49 4.76 -1.26 -4.77 118.16 127.37 2cpt n LYS 88 Ca 0.39 0.00 -0.39 0.00 -2.87 0.00 0.00 58.31 55.45 2cpt n LYS 88 Cb 0.34 -0.74 0.03 0.00 -1.84 0.00 0.00 35.03 32.82 2cpt n LYS 88 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 2cpt n LYS 89 N 0.74 0.86 -4.49 1.97 2.85 -1.26 -5.01 118.16 113.81 2cpt n LYS 89 Ca 0.13 0.32 -0.23 0.00 -1.05 0.00 0.00 58.31 57.48 2cpt n LYS 89 Cb 0.17 -1.95 -0.10 0.00 -0.65 0.00 0.00 35.03 32.50 2cpt n LYS 89 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2cpt s ALA 90 N -1.52 2.63 0.29 0.58 0.00 -1.26 -5.12 121.76 117.35 2cpt s ALA 90 Ca 0.70 -1.84 -0.29 0.00 0.00 0.00 0.00 51.96 50.52 2cpt s ALA 90 Cb -0.47 0.60 -0.10 0.00 0.00 0.00 0.00 23.12 23.15 2cpt s ALA 90 CO 0.52 -0.28 1.24 -0.65 0.00 0.00 0.00 175.76 176.59 2cpt s GLN 91 N -3.85 4.45 0.63 0.00 -0.21 -1.26 -4.99 119.66 114.44 2cpt s GLN 91 Ca 0.32 2.05 -0.18 0.00 0.02 0.00 0.00 55.36 57.58 2cpt s GLN 91 Cb 0.07 -3.13 -0.02 0.00 1.00 0.00 0.00 33.01 30.94 2cpt s GLN 91 CO 0.15 -0.07 1.22 0.15 -2.12 0.00 0.00 175.29 174.62 2cpt s LYS 92 N -1.38 2.73 0.00 2.91 -0.14 -1.26 -5.03 119.74 117.57 2cpt s LYS 92 Ca 0.49 1.85 0.00 0.00 -1.36 0.00 0.00 55.97 56.94 2cpt s LYS 92 Cb -0.37 -1.90 0.00 0.00 -1.68 0.00 0.00 37.83 33.89 2cpt s LYS 92 CO 0.46 -1.40 0.00 -0.35 -0.76 0.00 0.00 175.35 173.31 2cpt n PRO 93 N -1.89 -0.84 -2.01 -1.68 -0.04 -1.26 -5.02 135.00 122.26 2cpt n PRO 93 Ca 0.14 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.31 2cpt n PRO 93 Cb 0.49 0.00 0.05 0.00 -0.04 0.00 0.00 33.50 34.01 2cpt n PRO 93 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2cpt s VAL 94 N -0.91 3.22 -1.41 0.52 0.11 -1.26 -4.05 120.40 116.62 2cpt s VAL 94 Ca 0.00 0.27 -0.10 0.00 -2.93 0.00 0.00 61.98 59.22 2cpt s VAL 94 Cb 0.00 -3.37 0.10 0.00 -1.53 0.00 0.00 36.38 31.58 2cpt s VAL 94 CO 0.00 -0.46 0.25 0.29 -3.33 0.00 0.00 175.10 171.85 2cpt n LYS 95 N -2.96 -0.85 -3.66 1.54 5.02 -1.26 -4.87 118.16 111.11 2cpt n LYS 95 Ca 0.07 0.09 -0.14 0.00 -2.02 0.00 0.00 58.31 56.32 2cpt n LYS 95 Cb 0.58 -3.40 -0.07 0.00 -0.02 0.00 0.00 35.03 32.12 2cpt n LYS 95 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2cpt s GLU 96 N -6.34 0.89 0.00 1.97 0.41 -1.26 -5.08 118.70 109.29 2cpt s GLU 96 Ca 0.35 -0.25 0.00 0.00 -0.41 0.00 0.00 54.97 54.67 2cpt s GLU 96 Cb -0.21 0.40 0.00 0.00 -1.78 0.00 0.00 34.13 32.55 2cpt s GLU 96 CO 0.83 -0.29 0.00 0.41 -0.49 0.00 0.00 175.26 175.72 2cpt n GLY 97 N 0.71 -1.85 3.02 -1.39 0.00 -1.26 -4.78 105.19 99.63 2cpt n GLY 97 Ca -0.19 0.63 -0.35 0.00 0.00 0.00 0.00 46.02 46.11 2cpt n GLY 97 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2cpt n GLN 98 N 0.00 2.77 0.10 1.61 3.00 -1.26 -4.87 117.38 118.74 2cpt n GLN 98 Ca 0.00 -4.51 0.11 0.00 -0.01 0.00 0.00 57.00 52.59 2cpt n GLN 98 Cb 0.00 -2.40 0.45 0.00 0.00 0.00 0.00 30.24 28.29 2cpt n GLN 98 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 2cpt n PRO 99 N 2.03 0.15 -3.52 -1.09 -0.04 -1.26 -4.80 135.00 126.47 2cpt n PRO 99 Ca 0.23 0.39 -0.13 0.00 -0.04 0.00 0.00 63.50 63.95 2cpt n PRO 99 Cb 0.37 -1.79 -0.04 0.00 -0.04 0.00 0.00 33.50 31.99 2cpt n PRO 99 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2cpt s SER 100 N -3.98 -0.51 0.20 3.54 1.04 -1.26 -5.15 113.70 107.58 2cpt s SER 100 Ca 0.05 0.40 -0.30 0.00 0.48 0.00 0.00 55.95 56.58 2cpt s SER 100 Cb 0.09 0.45 -0.09 0.00 0.10 0.00 0.00 66.02 66.58 2cpt s SER 100 CO 0.36 -0.58 1.30 -2.16 0.98 0.00 0.00 173.24 173.14 2cpt s PRO 101 N -1.86 4.39 0.01 4.02 0.04 -1.26 -5.03 135.00 135.31 2cpt s PRO 101 Ca -0.04 2.05 0.01 0.00 0.04 0.00 0.00 61.00 63.05 2cpt s PRO 101 Cb -0.00 -3.20 -0.04 0.00 0.04 0.00 0.00 34.50 31.30 2cpt s PRO 101 CO 0.01 -0.24 0.06 0.00 0.04 0.00 0.00 177.00 176.87 2cpt s ALA 102 N 0.10 3.52 -0.14 8.56 0.00 -1.26 -5.11 121.76 127.43 2cpt s ALA 102 Ca 0.56 -0.91 -0.08 0.00 0.00 0.00 0.00 51.96 51.53 2cpt s ALA 102 Cb -0.36 -1.50 -0.04 0.00 0.00 0.00 0.00 23.12 21.21 2cpt s ALA 102 CO 0.38 0.69 0.13 0.34 0.00 0.00 0.00 175.76 177.31 2cpt s ASP 103 N -1.82 6.32 -0.01 0.00 2.15 -1.26 -5.09 116.67 116.97 2cpt s ASP 103 Ca 0.23 0.41 -0.17 0.00 0.43 0.00 0.00 52.55 53.45 2cpt s ASP 103 Cb -0.12 -2.06 -0.06 0.00 -0.30 0.00 0.00 42.92 40.38 2cpt s ASP 103 CO 0.15 0.35 0.47 -0.70 -0.17 0.00 0.00 175.17 175.27 2cpt s GLU 104 N -0.69 4.12 -0.05 4.34 2.56 -1.26 -5.07 118.70 122.64 2cpt s GLU 104 Ca 0.13 0.52 -0.02 0.00 0.00 0.00 0.00 54.97 55.60 2cpt s GLU 104 Cb -0.12 -3.29 0.03 0.00 2.00 0.00 0.00 34.13 32.76 2cpt s GLU 104 CO 0.03 0.53 0.07 0.21 -0.56 0.00 0.00 175.26 175.54 2cpt s LYS 105 N -0.61 -0.05 -0.32 4.30 2.36 -1.26 -5.10 119.74 119.05 2cpt s LYS 105 Ca 0.26 0.39 -0.28 0.00 -2.55 0.00 0.00 55.97 53.78 2cpt s LYS 105 Cb -0.17 -0.44 -0.03 0.00 -1.05 0.00 0.00 37.83 36.15 2cpt s LYS 105 CO 0.14 -0.30 1.92 0.20 1.55 0.00 0.00 175.35 178.86 2cpt s GLY 106 N 2.04 0.66 0.34 5.54 0.00 -1.26 -4.97 107.32 109.67 2cpt s GLY 106 Ca 0.03 0.34 -0.15 0.00 0.00 0.00 0.00 44.72 44.94 2cpt s GLY 106 CO -0.03 3.43 0.75 -1.31 0.00 0.00 0.00 173.10 175.94 2cpt s ASN 107 N 6.88 6.75 -0.26 1.64 0.02 -1.26 -5.02 114.94 123.69 2cpt s ASN 107 Ca 0.85 1.28 -0.15 0.00 -1.02 0.00 0.00 52.86 53.82 2cpt s ASN 107 Cb -0.24 -2.38 -0.12 0.00 0.02 0.00 0.00 41.25 38.53 2cpt s ASN 107 CO 0.33 -0.24 -0.31 -0.90 0.02 0.00 0.00 177.10 176.00 2cpt n ASP 108 N -0.51 1.95 -3.75 -1.22 5.75 -1.26 -5.01 116.55 112.49 2cpt n ASP 108 Ca 0.04 0.35 -0.25 0.00 -0.01 0.00 0.00 54.79 54.92 2cpt n ASP 108 Cb 0.53 -0.82 0.04 0.00 -1.03 0.00 0.00 41.12 39.84 2cpt n ASP 108 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2cpt n SER 109 N -4.30 -3.05 -4.28 -1.12 7.64 -1.26 -4.93 113.62 102.32 2cpt n SER 109 Ca -0.48 -0.77 -0.45 0.00 1.01 0.00 0.00 58.87 58.19 2cpt n SER 109 Cb 0.82 -4.16 -0.05 0.00 -1.01 0.00 0.00 64.21 59.81 2cpt n SER 109 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2cpt s ASP 110 N -3.88 6.18 0.00 6.43 1.11 -1.26 -4.98 116.67 120.26 2cpt s ASP 110 Ca 0.30 -2.13 0.00 0.00 0.18 0.00 0.00 52.55 50.90 2cpt s ASP 110 Cb -0.15 -2.14 0.00 0.00 1.07 0.00 0.00 42.92 41.70 2cpt s ASP 110 CO 0.81 -0.71 0.00 0.61 1.18 0.00 0.00 175.17 177.05 2cpt n GLY 111 N 4.72 0.54 3.57 0.21 0.00 -1.26 -5.13 105.19 107.83 2cpt n GLY 111 Ca -0.04 -0.73 -0.55 0.00 0.00 0.00 0.00 46.02 44.70 2cpt n GLY 111 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2cpt n SER 112 N -0.01 1.06 -4.76 1.61 7.64 -1.26 -4.86 113.62 113.04 2cpt n SER 112 Ca 0.00 1.13 -0.38 0.00 1.01 0.00 0.00 58.87 60.64 2cpt n SER 112 Cb 0.00 -1.08 0.03 0.00 -1.01 0.00 0.00 64.21 62.14 2cpt n SER 112 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2cpt s GLY 113 N 0.47 2.85 0.12 0.23 0.00 -1.26 -4.95 107.32 104.78 2cpt s GLY 113 Ca 0.88 1.20 -0.31 0.00 0.00 0.00 0.00 44.72 46.49 2cpt s GLY 113 CO 0.52 1.70 1.36 2.56 0.00 0.00 0.00 173.10 179.23 2cpt s PRO 114 N -2.88 4.34 0.31 2.90 0.04 -1.26 -5.03 135.00 133.41 2cpt s PRO 114 Ca 0.70 2.04 0.11 0.00 0.04 0.00 0.00 61.00 63.88 2cpt s PRO 114 Cb -0.36 -3.25 -0.05 0.00 0.04 0.00 0.00 34.50 30.87 2cpt s PRO 114 CO 0.43 -0.40 -0.13 -1.12 0.04 0.00 0.00 177.00 175.83 2cpt s SER 115 N 1.03 3.78 0.03 6.66 0.01 -1.26 -5.16 113.70 118.80 2cpt s SER 115 Ca 0.63 -1.05 -0.05 0.00 1.31 0.00 0.00 55.95 56.79 2cpt s SER 115 Cb -0.36 -0.39 -0.01 0.00 0.21 0.00 0.00 66.02 65.47 2cpt s SER 115 CO 0.31 -0.08 0.09 -0.55 0.41 0.00 0.00 173.24 173.42 2cpt s SER 116 N -3.58 0.18 0.00 2.44 0.15 -1.26 -5.33 113.70 106.30 2cpt s SER 116 Ca 0.31 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.45 2cpt s SER 116 Cb -0.02 0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 2cpt s SER 116 CO 0.16 -0.49 0.00 0.61 1.20 0.00 0.00 173.24 174.72