#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 -0.22 0.15 1.61 0.15 -1.26 -5.16 113.70 108.97 2cpt s SER 2 Ca 0.00 0.80 -0.19 0.00 0.70 0.00 0.00 55.95 57.26 2cpt s SER 2 Cb 0.00 0.85 0.05 0.00 -1.71 0.00 0.00 66.02 65.21 2cpt s SER 2 CO 0.00 -0.21 0.49 -0.55 1.20 0.00 0.00 173.24 174.17 2cpt s SER 3 N 1.92 -0.36 0.00 5.45 0.15 -1.26 -5.13 113.70 114.48 2cpt s SER 3 Ca -0.05 -0.24 0.00 0.00 0.70 0.00 0.00 55.95 56.36 2cpt s SER 3 Cb -0.10 0.54 0.00 0.00 -1.71 0.00 0.00 66.02 64.74 2cpt s SER 3 CO -0.11 -0.93 0.00 0.61 1.20 0.00 0.00 173.24 174.01 2cpt n GLY 4 N -0.30 -0.42 3.77 9.45 0.00 -1.26 -5.16 105.19 111.27 2cpt n GLY 4 Ca -0.15 0.54 -0.34 0.00 0.00 0.00 0.00 46.02 46.06 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 0.00 5.71 -0.30 1.61 0.15 -1.26 -5.09 113.70 114.52 2cpt s SER 5 Ca 0.00 0.22 -0.17 0.00 0.70 0.00 0.00 55.95 56.70 2cpt s SER 5 Cb 0.00 -1.68 0.18 0.00 -1.71 0.00 0.00 66.02 62.80 2cpt s SER 5 CO 0.00 0.34 1.13 -0.94 1.20 0.00 0.00 173.24 174.96 2cpt s SER 6 N -1.31 -0.33 -0.66 5.45 1.04 -1.26 -5.12 113.70 111.52 2cpt s SER 6 Ca 0.18 0.46 -0.27 0.00 0.48 0.00 0.00 55.95 56.80 2cpt s SER 6 Cb -0.12 1.33 0.03 0.00 0.10 0.00 0.00 66.02 67.36 2cpt s SER 6 CO 0.08 -0.07 1.21 -0.83 0.98 0.00 0.00 173.24 174.62 2cpt s GLY 7 N 2.02 1.03 -0.22 7.32 0.00 -1.26 -4.96 107.32 111.26 2cpt s GLY 7 Ca -0.03 -1.13 -0.15 0.00 0.00 0.00 0.00 44.72 43.40 2cpt s GLY 7 CO -0.16 2.54 0.56 1.06 0.00 0.00 0.00 173.10 177.10 2cpt s MET 8 N 5.25 0.60 -0.43 2.90 -1.94 -1.26 -5.04 119.30 119.38 2cpt s MET 8 Ca 0.38 0.94 -0.02 0.00 -1.71 0.00 0.00 55.69 55.28 2cpt s MET 8 Cb -0.08 0.16 0.24 0.00 2.01 0.00 0.00 34.83 37.15 2cpt s MET 8 CO 0.20 -0.13 2.17 0.43 -0.01 0.00 0.00 175.02 177.68 2cpt n SER 9 N 3.73 6.75 -4.37 3.03 7.64 -1.26 -4.87 113.62 124.28 2cpt n SER 9 Ca -0.19 -3.26 -0.45 0.00 1.01 0.00 0.00 58.87 55.99 2cpt n SER 9 Cb 0.57 -1.08 -0.07 0.00 -1.01 0.00 0.00 64.21 62.62 2cpt n SER 9 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2cpt s SER 10 N -0.22 6.13 -0.28 6.43 0.15 -1.26 -5.01 113.70 119.64 2cpt s SER 10 Ca 0.44 -1.41 -0.24 0.00 0.70 0.00 0.00 55.95 55.44 2cpt s SER 10 Cb 0.33 -2.18 0.12 0.00 -1.71 0.00 0.00 66.02 62.58 2cpt s SER 10 CO -0.06 -0.68 1.00 0.28 1.20 0.00 0.00 173.24 174.98 2cpt s THR 11 N 1.62 0.00 0.79 6.45 -1.32 -1.26 -5.16 115.64 116.77 2cpt s THR 11 Ca 0.04 0.00 -0.17 0.00 -1.21 0.00 0.00 61.69 60.35 2cpt s THR 11 Cb -0.25 -1.00 -0.14 0.00 -1.51 0.00 0.00 72.50 69.60 2cpt s THR 11 CO 0.06 0.00 -0.45 -1.20 -2.21 0.00 0.00 174.62 170.82 2cpt n SER 12 N 2.48 -4.80 -0.01 8.08 7.64 -1.26 -4.67 113.62 121.07 2cpt n SER 12 Ca -0.13 0.39 -0.13 0.00 1.01 0.00 0.00 58.87 60.01 2cpt n SER 12 Cb 0.56 -0.83 -0.10 0.00 -1.01 0.00 0.00 64.21 62.84 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 -0.59 -0.00 -0.77 1.43 0.13 -2.01 -1.83 132.00 128.35 2cpt h PRO 13 Ca -0.43 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.74 2cpt h PRO 13 Cb 1.36 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.44 2cpt h PRO 13 CO 0.32 0.48 0.48 -0.97 -0.23 0.00 0.00 178.00 178.08 2cpt h ASN 14 N -0.49 0.79 -0.17 1.44 -0.73 -1.95 -2.06 115.58 112.41 2cpt h ASN 14 Ca -0.00 0.00 -0.02 0.00 1.87 0.00 0.00 56.30 58.15 2cpt h ASN 14 Cb 0.49 -0.17 -0.01 0.00 0.27 0.00 0.00 38.32 38.90 2cpt h ASN 14 CO 0.00 0.54 0.03 0.25 -0.37 0.00 0.00 177.43 177.88 2cpt h LEU 15 N 0.94 0.28 -0.58 0.34 5.85 -1.84 -2.74 115.31 117.56 2cpt h LEU 15 Ca 0.31 -0.27 0.11 0.00 0.84 0.00 0.00 57.88 58.87 2cpt h LEU 15 Cb 0.04 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 40.91 2cpt h LEU 15 CO -0.12 0.47 0.13 -0.61 -0.34 0.00 0.00 178.44 177.97 2cpt h GLN 16 N 0.07 0.26 -0.93 1.25 5.75 -0.97 -0.55 115.11 120.00 2cpt h GLN 16 Ca 0.05 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.57 2cpt h GLN 16 Cb 0.32 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 28.75 2cpt h GLN 16 CO 0.00 0.17 0.60 -0.22 -2.65 0.00 0.00 178.83 176.74 2cpt h LYS 17 N 0.27 1.14 -0.53 1.69 3.64 -1.29 -2.28 116.57 119.21 2cpt h LYS 17 Ca 0.30 -0.07 0.01 0.00 -1.27 0.00 0.00 60.65 59.62 2cpt h LYS 17 Cb 0.44 -0.26 -0.03 0.00 -0.41 0.00 0.00 32.23 31.97 2cpt h LYS 17 CO -0.38 0.76 0.35 0.00 -2.27 0.00 0.00 179.45 177.90 2cpt h ALA 18 N 1.38 0.67 0.61 5.00 0.00 -0.82 -0.95 119.26 125.15 2cpt h ALA 18 Ca 0.37 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 2cpt h ALA 18 Cb -0.02 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 2cpt h ALA 18 CO -0.11 0.10 -0.35 0.82 0.00 0.00 0.00 179.25 179.71 2cpt h ILE 19 N 0.71 0.29 -0.53 0.00 2.04 -0.81 -0.82 117.51 118.40 2cpt h ILE 19 Ca 0.20 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.14 2cpt h ILE 19 Cb -0.07 0.29 -0.07 0.00 -0.74 0.00 0.00 36.82 36.23 2cpt h ILE 19 CO -0.05 0.00 0.14 -0.78 0.00 0.00 0.00 178.15 177.46 2cpt h ASP 20 N -0.89 0.07 0.05 1.72 3.58 -1.34 -0.52 116.42 119.09 2cpt h ASP 20 Ca -0.08 0.08 0.02 0.00 0.42 0.00 0.00 57.03 57.48 2cpt h ASP 20 Cb 0.71 0.10 -0.03 0.00 1.72 0.00 0.00 39.33 41.83 2cpt h ASP 20 CO 0.09 0.06 -0.20 -0.07 -2.88 0.00 0.00 179.24 176.25 2cpt h LEU 21 N 0.29 -0.56 -1.00 2.28 3.38 -1.00 0.52 115.31 119.23 2cpt h LEU 21 Ca 0.27 0.07 0.08 0.00 0.09 0.00 0.00 57.88 58.38 2cpt h LEU 21 Cb 0.34 0.22 -0.07 0.00 0.09 0.00 0.00 40.66 41.25 2cpt h LEU 21 CO -0.32 -0.27 0.64 0.00 0.09 0.00 0.00 178.44 178.58 2cpt h ALA 22 N 0.51 1.40 -0.06 1.53 0.00 -0.62 -1.73 119.26 120.30 2cpt h ALA 22 Ca 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2cpt h ALA 22 Cb 0.39 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2cpt h ALA 22 CO -0.15 0.39 0.02 1.03 0.00 0.00 0.00 179.25 180.54 2cpt h SER 23 N 1.13 0.10 -0.32 0.00 0.87 -0.46 -3.13 113.55 111.74 2cpt h SER 23 Ca 0.44 -0.22 0.06 0.00 -1.23 0.00 0.00 61.79 60.84 2cpt h SER 23 Cb 0.23 -0.03 -0.05 0.00 -0.44 0.00 0.00 62.40 62.11 2cpt h SER 23 CO -0.19 0.29 -0.02 0.50 -0.53 0.00 0.00 176.83 176.88 2cpt h LYS 24 N -0.10 0.07 -0.98 2.24 3.64 -0.44 -2.03 116.57 118.97 2cpt h LYS 24 Ca 0.02 -0.00 0.28 0.00 -1.27 0.00 0.00 60.65 59.67 2cpt h LYS 24 Cb 0.23 -0.02 -0.18 0.00 -0.41 0.00 0.00 32.23 31.86 2cpt h LYS 24 CO -0.00 0.05 0.06 0.00 -2.27 0.00 0.00 179.45 177.29 2cpt h ALA 25 N 1.28 1.22 -0.39 5.00 0.00 -1.27 0.60 119.26 125.70 2cpt h ALA 25 Ca 0.15 0.33 -0.03 0.00 0.00 0.00 0.00 54.91 55.36 2cpt h ALA 25 Cb 0.21 0.57 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2cpt h ALA 25 CO -0.27 -0.59 0.12 0.00 0.00 0.00 0.00 179.25 178.52 2cpt h ALA 26 N 1.97 0.51 -0.53 0.00 0.00 -1.40 -1.96 119.26 117.85 2cpt h ALA 26 Ca 0.61 -0.17 0.10 0.00 0.00 0.00 0.00 54.91 55.45 2cpt h ALA 26 Cb 1.27 -0.15 -0.09 0.00 0.00 0.00 0.00 17.79 18.82 2cpt h ALA 26 CO -0.90 0.16 0.02 1.96 0.00 0.00 0.00 179.25 180.49 2cpt h GLN 27 N 0.49 0.13 0.70 0.00 1.08 0.37 -0.80 115.11 117.08 2cpt h GLN 27 Ca 0.13 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.28 2cpt h GLN 27 Cb 0.26 -0.03 0.01 0.00 -0.05 0.00 0.00 27.48 27.66 2cpt h GLN 27 CO -0.00 0.09 -0.33 0.93 -0.95 0.00 0.00 178.83 178.56 2cpt h GLU 28 N 0.13 -0.90 -0.93 1.46 4.39 -1.23 -2.26 114.58 115.24 2cpt h GLU 28 Ca 0.27 0.06 0.25 0.00 0.34 0.00 0.00 59.36 60.28 2cpt h GLU 28 Cb 0.41 0.20 -0.17 0.00 -0.10 0.00 0.00 28.75 29.10 2cpt h GLU 28 CO -0.43 -0.58 0.03 0.22 -1.16 0.00 0.00 179.01 177.09 2cpt h ASP 29 N -1.18 -0.42 0.05 1.42 1.82 -0.87 0.30 116.42 117.54 2cpt h ASP 29 Ca -0.10 0.26 -0.00 0.00 -0.39 0.00 0.00 57.03 56.80 2cpt h ASP 29 Cb 0.74 0.44 0.00 0.00 0.68 0.00 0.00 39.33 41.19 2cpt h ASP 29 CO 0.16 -0.30 -0.02 0.50 -1.61 0.00 0.00 179.24 177.96 2cpt h LYS 30 N 0.05 -0.07 -0.11 0.28 3.64 -1.11 -2.47 116.57 116.79 2cpt h LYS 30 Ca 0.55 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.97 2cpt h LYS 30 Cb 1.10 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.93 2cpt h LYS 30 CO -0.85 0.03 0.08 0.00 -2.27 0.00 0.00 179.45 176.44 2cpt h ALA 31 N 0.79 2.09 0.00 5.00 0.00 0.06 -3.45 119.26 123.75 2cpt h ALA 31 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2cpt h ALA 31 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2cpt h ALA 31 CO 0.01 -0.12 0.00 0.41 0.00 0.00 0.00 179.25 179.56 2cpt n GLY 32 N -1.56 0.78 3.47 0.00 0.00 0.51 -5.10 105.19 103.29 2cpt n GLY 32 Ca -0.00 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 -1.16 6.21 -0.21 1.61 0.01 -0.22 -4.90 114.94 116.28 2cpt s ASN 33 Ca 0.00 -0.79 -0.11 0.00 -0.71 0.00 0.00 52.86 51.26 2cpt s ASN 33 Cb 0.00 -2.24 -0.19 0.00 0.41 0.00 0.00 41.25 39.22 2cpt s ASN 33 CO 0.00 -0.68 0.06 -1.22 -1.51 0.00 0.00 177.10 173.75 2cpt n TYR 34 N 5.74 0.69 -0.35 2.20 4.02 -1.26 -2.21 117.16 126.00 2cpt n TYR 34 Ca -0.07 0.21 -0.03 0.00 -0.01 0.00 0.00 57.90 57.99 2cpt n TYR 34 Cb 0.46 -1.08 0.09 0.00 -0.02 0.00 0.00 39.34 38.80 2cpt n TYR 34 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 176.86 176.90 2cpt h GLU 35 N -0.47 1.28 -0.06 -0.72 4.11 -1.90 0.16 114.58 116.97 2cpt h GLU 35 Ca -0.49 -0.13 -0.20 0.00 0.07 0.00 0.00 59.36 58.61 2cpt h GLU 35 Cb 1.72 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 30.70 2cpt h GLU 35 CO -0.14 0.91 -0.80 1.49 0.07 0.00 0.00 179.01 180.54 2cpt h GLU 36 N 1.29 0.45 -0.04 1.06 4.57 -1.98 -3.17 114.58 116.76 2cpt h GLU 36 Ca 0.33 -0.40 -0.13 0.00 -1.18 0.00 0.00 59.36 57.98 2cpt h GLU 36 Cb -0.02 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 2cpt h GLU 36 CO -0.06 1.04 -0.58 0.00 -1.18 0.00 0.00 179.01 178.23 2cpt h ALA 37 N 0.84 0.96 0.32 2.92 0.00 -1.44 -3.16 119.26 119.69 2cpt h ALA 37 Ca -0.05 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 2cpt h ALA 37 Cb 1.40 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 2cpt h ALA 37 CO 0.14 0.72 -0.22 1.25 0.00 0.00 0.00 179.25 181.15 2cpt h LEU 38 N 0.09 -0.56 -0.75 0.00 5.85 -0.68 0.10 115.31 119.37 2cpt h LEU 38 Ca -0.00 0.03 0.17 0.00 0.84 0.00 0.00 57.88 58.92 2cpt h LEU 38 Cb 1.05 0.17 -0.13 0.00 0.37 0.00 0.00 40.66 42.13 2cpt h LEU 38 CO 0.08 -0.32 0.05 1.56 -0.34 0.00 0.00 178.44 179.47 2cpt h GLN 39 N -0.51 0.13 -0.86 1.25 1.08 -1.65 0.23 115.11 114.78 2cpt h GLN 39 Ca -0.04 -0.01 0.02 0.00 -1.45 0.00 0.00 58.65 57.17 2cpt h GLN 39 Cb 0.41 -0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.77 2cpt h GLN 39 CO 0.03 0.09 0.56 -0.07 -0.95 0.00 0.00 178.83 178.49 2cpt h LEU 40 N 0.13 0.95 -1.18 1.46 3.38 -1.48 0.97 115.31 119.53 2cpt h LEU 40 Ca 0.41 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.34 2cpt h LEU 40 Cb 0.73 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 2cpt h LEU 40 CO -0.63 0.67 0.20 1.88 0.09 0.00 0.00 178.44 180.65 2cpt h TYR 41 N 1.12 0.77 0.15 1.13 0.05 0.21 -1.83 116.97 118.57 2cpt h TYR 41 Ca 0.33 -0.04 -0.01 0.00 0.05 0.00 0.00 58.73 59.06 2cpt h TYR 41 Cb -0.06 -0.24 0.00 0.00 1.01 0.00 0.00 36.73 37.45 2cpt h TYR 41 CO -0.02 0.61 -0.07 1.96 -1.05 0.00 0.00 178.16 179.59 2cpt h GLN 42 N 0.76 -0.19 -0.63 4.88 4.20 -0.40 -3.29 115.11 120.44 2cpt h GLN 42 Ca 0.18 0.01 0.13 0.00 0.06 0.00 0.00 58.65 59.03 2cpt h GLN 42 Cb 0.17 0.04 -0.12 0.00 0.30 0.00 0.00 27.48 27.88 2cpt h GLN 42 CO -0.01 0.21 -0.09 0.45 -0.67 0.00 0.00 178.83 178.71 2cpt h HIS 43 N -0.93 -0.21 -0.81 2.96 3.86 -0.81 0.09 115.15 119.31 2cpt h HIS 43 Ca -0.02 0.05 0.19 0.00 -1.16 0.00 0.00 60.37 59.43 2cpt h HIS 43 Cb 0.49 0.19 -0.14 0.00 1.06 0.00 0.00 27.41 29.01 2cpt h HIS 43 CO 0.08 -0.23 -0.01 0.00 0.86 0.00 0.00 177.93 178.63 2cpt h ALA 44 N 1.61 0.83 -0.02 2.45 0.00 -1.44 -0.58 119.26 122.11 2cpt h ALA 44 Ca 0.32 0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.49 2cpt h ALA 44 Cb 0.51 0.47 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 2cpt h ALA 44 CO -0.61 -0.44 -0.01 0.28 0.00 0.00 0.00 179.25 178.47 2cpt h VAL 45 N 0.08 1.33 -0.87 0.00 2.07 -1.09 -1.76 116.25 116.01 2cpt h VAL 45 Ca 0.44 -0.99 0.22 0.00 0.82 0.00 0.00 66.70 67.19 2cpt h VAL 45 Cb 0.80 1.96 -0.15 0.00 -1.52 0.00 0.00 31.29 32.37 2cpt h VAL 45 CO -0.73 0.26 0.09 1.56 0.02 0.00 0.00 177.57 178.78 2cpt h GLN 46 N -0.36 0.11 -0.15 1.57 4.20 -0.01 0.20 115.11 120.68 2cpt h GLN 46 Ca 0.00 -0.01 -0.19 0.00 0.06 0.00 0.00 58.65 58.52 2cpt h GLN 46 Cb 0.43 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.20 2cpt h GLN 46 CO 0.00 0.07 -0.64 1.88 -0.67 0.00 0.00 178.83 179.47 2cpt h TYR 47 N 0.11 0.92 -0.13 2.96 0.05 -1.26 -3.10 116.97 116.54 2cpt h TYR 47 Ca 0.51 -0.40 0.05 0.00 0.05 0.00 0.00 58.73 58.94 2cpt h TYR 47 Cb 1.01 -0.15 -0.06 0.00 1.01 0.00 0.00 36.73 38.54 2cpt h TYR 47 CO -0.39 1.21 -0.24 0.74 -1.05 0.00 0.00 178.16 178.43 2cpt h PHE 48 N 0.38 -0.64 0.31 4.88 0.04 0.23 -2.57 116.94 119.58 2cpt h PHE 48 Ca -0.04 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.76 2cpt h PHE 48 Cb 1.27 0.30 -0.03 0.00 2.20 0.00 0.00 35.95 39.69 2cpt h PHE 48 CO 0.10 -0.32 -0.46 -0.07 -0.60 0.00 0.00 178.31 176.95 2cpt h LEU 49 N -0.31 -1.31 -1.00 1.54 3.38 -1.05 -1.60 115.31 114.97 2cpt h LEU 49 Ca 0.10 0.12 0.42 0.00 0.09 0.00 0.00 57.88 58.61 2cpt h LEU 49 Cb 0.45 0.46 -0.18 0.00 0.09 0.00 0.00 40.66 41.48 2cpt h LEU 49 CO -0.30 -0.58 0.55 1.57 0.09 0.00 0.00 178.44 179.77 2cpt n HIS 50 N -5.51 1.15 0.08 1.13 -0.00 -1.07 0.33 115.22 111.32 2cpt n HIS 50 Ca -0.10 1.16 -0.13 0.00 0.46 0.00 0.00 57.72 59.11 2cpt n HIS 50 Cb 0.42 -1.56 -0.08 0.00 -0.12 0.00 0.00 29.99 28.64 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 0.99 0.00 3.57 2.07 -0.91 -0.91 116.25 121.05 2cpt h VAL 51 Ca 0.84 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 67.67 2cpt h VAL 51 Cb 2.25 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 33.43 2cpt h VAL 51 CO -0.76 0.16 0.00 0.52 0.02 0.00 0.00 177.57 177.51 2cpt n VAL 52 N -5.03 1.23 -0.10 2.57 0.31 0.15 0.19 118.33 117.65 2cpt n VAL 52 Ca -0.09 0.55 -0.22 0.00 -0.01 0.00 0.00 64.34 64.57 2cpt n VAL 52 Cb 0.22 -1.51 -0.12 0.00 -0.91 0.00 0.00 33.84 31.52 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 -2.01 0.57 -0.05 5.55 4.81 0.02 -4.32 118.16 122.74 2cpt n LYS 53 Ca -0.00 0.56 -0.10 0.00 -0.87 0.00 0.00 58.31 57.90 2cpt n LYS 53 Cb 0.07 -1.74 -0.03 0.00 0.02 0.00 0.00 35.03 33.35 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 -4.40 0.00 -0.11 5.64 4.02 -0.38 -4.61 117.16 117.33 2cpt n TYR 54 Ca -0.33 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.50 2cpt n TYR 54 Cb 0.70 -0.40 0.03 0.00 -0.02 0.00 0.00 39.34 39.64 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 -3.99 1.30 -1.75 -0.72 -0.58 0.23 -4.94 120.64 110.19 2cpt n GLU 55 Ca -0.16 -0.63 -0.39 0.00 -0.42 0.00 0.00 57.16 55.55 2cpt n GLU 55 Cb 0.45 -1.25 0.03 0.00 -0.57 0.00 0.00 31.44 30.10 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 0.63 1.70 -0.20 0.62 0.00 0.49 -4.51 120.51 119.25 2cpt n ALA 56 Ca 0.12 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.74 2cpt n ALA 56 Cb 0.62 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.72 2cpt n ALA 56 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2cpt n GLN 57 N -0.66 0.00 -3.54 0.00 6.02 -1.26 -5.00 117.38 112.94 2cpt n GLN 57 Ca 0.08 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 57.01 2cpt n GLN 57 Cb 0.43 -0.38 -0.02 0.00 1.02 0.00 0.00 30.24 31.29 2cpt n GLN 57 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2cpt s GLY 58 N -2.60 -0.40 0.22 1.08 0.00 -1.26 -5.00 107.32 99.35 2cpt s GLY 58 Ca 0.00 1.21 -0.14 0.00 0.00 0.00 0.00 44.72 45.79 2cpt s GLY 58 CO 0.00 0.40 1.39 1.22 0.00 0.00 0.00 173.10 176.11 2cpt n ASP 59 N -0.19 -0.52 0.22 1.64 9.92 -1.26 -0.05 116.55 126.30 2cpt n ASP 59 Ca -0.05 1.56 -0.16 0.00 -0.53 0.00 0.00 54.79 55.60 2cpt n ASP 59 Cb 0.60 -0.38 -0.09 0.00 -0.64 0.00 0.00 41.12 40.61 2cpt n ASP 59 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 2cpt h LYS 60 N 0.00 -0.84 0.28 -1.24 1.79 -2.00 -1.54 116.57 113.02 2cpt h LYS 60 Ca 0.34 0.06 -0.00 0.00 -2.18 0.00 0.00 60.65 58.87 2cpt h LYS 60 Cb 0.56 0.19 -0.03 0.00 -1.58 0.00 0.00 32.23 31.37 2cpt h LYS 60 CO -0.90 -0.56 -0.45 0.00 -1.08 0.00 0.00 179.45 176.47 2cpt h ALA 61 N -0.85 -1.02 -0.31 3.86 0.00 -1.28 -2.94 119.26 116.72 2cpt h ALA 61 Ca -0.04 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.76 2cpt h ALA 61 Cb 0.78 0.75 -0.04 0.00 0.00 0.00 0.00 17.79 19.29 2cpt h ALA 61 CO -0.13 -1.09 -0.18 1.63 0.00 0.00 0.00 179.25 179.48 2cpt n LYS 62 N -5.06 -0.13 -0.38 0.00 5.02 0.92 0.92 118.16 119.44 2cpt n LYS 62 Ca -0.09 1.12 0.34 0.00 -2.02 0.00 0.00 58.31 57.66 2cpt n LYS 62 Cb 0.38 -1.67 0.58 0.00 -0.02 0.00 0.00 35.03 34.31 2cpt n LYS 62 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2cpt n GLN 63 N -3.68 -0.04 0.32 1.97 6.02 -0.59 0.05 117.38 121.44 2cpt n GLN 63 Ca 0.01 1.15 -0.14 0.00 -0.01 0.00 0.00 57.00 58.01 2cpt n GLN 63 Cb 0.08 -2.21 -0.07 0.00 1.02 0.00 0.00 30.24 29.06 2cpt n GLN 63 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2cpt h SER 64 N 0.00 -0.73 -0.53 1.08 0.87 0.72 -2.06 113.55 112.90 2cpt h SER 64 Ca 0.78 0.01 0.07 0.00 -1.23 0.00 0.00 61.79 61.41 2cpt h SER 64 Cb 2.39 0.19 -0.06 0.00 -0.44 0.00 0.00 62.40 64.48 2cpt h SER 64 CO -0.49 -0.35 0.21 0.40 -0.53 0.00 0.00 176.83 176.07 2cpt h ILE 65 N -1.20 0.86 -0.00 2.23 2.04 0.27 -2.60 117.51 119.10 2cpt h ILE 65 Ca -0.09 -0.14 0.03 0.00 1.00 0.00 0.00 64.86 65.66 2cpt h ILE 65 Cb 0.68 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 37.12 2cpt h ILE 65 CO 0.14 0.08 -0.26 0.03 0.00 0.00 0.00 178.15 178.14 2cpt h ARG 66 N 0.41 -0.39 -0.82 2.37 3.08 -0.83 -1.24 114.38 116.96 2cpt h ARG 66 Ca 0.25 0.03 0.20 0.00 0.07 0.00 0.00 59.98 60.53 2cpt h ARG 66 Cb 0.24 0.09 -0.14 0.00 0.08 0.00 0.00 29.97 30.24 2cpt h ARG 66 CO -0.23 -0.26 0.10 0.00 -1.07 0.00 0.00 179.97 178.52 2cpt h ALA 67 N 0.42 1.01 -0.59 0.04 0.00 -0.99 0.23 119.26 119.38 2cpt h ALA 67 Ca 0.06 0.24 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 2cpt h ALA 67 Cb 0.49 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 2cpt h ALA 67 CO -0.23 -0.44 0.16 0.87 0.00 0.00 0.00 179.25 179.61 2cpt h LYS 68 N 0.15 0.93 -0.53 0.00 6.56 -1.16 -2.36 116.57 120.16 2cpt h LYS 68 Ca 0.48 -0.21 0.08 0.00 -1.06 0.00 0.00 60.65 59.94 2cpt h LYS 68 Cb 0.90 -0.13 -0.06 0.00 -0.57 0.00 0.00 32.23 32.37 2cpt h LYS 68 CO -0.67 0.85 0.17 0.00 -2.06 0.00 0.00 179.45 177.74 2cpt h THR 70 N 0.34 1.25 0.68 0.00 2.02 -1.14 -0.43 112.91 115.63 2cpt h THR 70 Ca 0.26 -0.90 -0.03 0.00 0.77 0.00 0.00 66.41 66.51 2cpt h THR 70 Cb 0.31 0.66 0.01 0.00 -1.74 0.00 0.00 68.15 67.39 2cpt h THR 70 CO -0.28 0.34 -0.33 -0.08 0.37 0.00 0.00 175.52 175.54 2cpt h GLU 71 N 0.89 -0.88 -0.71 6.66 4.57 -0.80 -1.22 114.58 123.09 2cpt h GLU 71 Ca 0.19 0.06 0.14 0.00 -1.18 0.00 0.00 59.36 58.57 2cpt h GLU 71 Cb 0.34 0.20 -0.05 0.00 -0.16 0.00 0.00 28.75 29.08 2cpt h GLU 71 CO -0.00 -0.58 0.48 1.88 -1.18 0.00 0.00 179.01 179.60 2cpt h TYR 72 N -1.11 0.44 -0.29 0.92 0.05 -0.74 -0.34 116.97 115.91 2cpt h TYR 72 Ca -0.09 0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.65 2cpt h TYR 72 Cb 0.70 -0.14 -0.01 0.00 1.01 0.00 0.00 36.73 38.29 2cpt h TYR 72 CO 0.02 0.18 -0.03 -0.07 -1.05 0.00 0.00 178.16 177.21 2cpt h LEU 73 N 0.38 0.53 -0.19 3.88 3.38 -0.98 -1.92 115.31 120.38 2cpt h LEU 73 Ca 0.34 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2cpt h LEU 73 Cb 0.81 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 2cpt h LEU 73 CO -0.10 0.74 0.02 -0.78 0.09 0.00 0.00 178.44 178.40 2cpt h ASP 74 N 0.30 0.32 -0.53 -0.43 1.82 0.06 -2.16 116.42 115.80 2cpt h ASP 74 Ca 0.08 -0.28 0.06 0.00 -0.39 0.00 0.00 57.03 56.49 2cpt h ASP 74 Cb 0.49 -0.09 -0.05 0.00 0.68 0.00 0.00 39.33 40.36 2cpt h ASP 74 CO 0.02 0.53 0.24 -0.09 -1.61 0.00 0.00 179.24 178.32 2cpt h ARG 75 N 0.11 0.44 0.42 0.28 9.65 -1.11 -2.78 114.38 121.38 2cpt h ARG 75 Ca 0.06 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 58.89 2cpt h ARG 75 Cb 0.35 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 28.84 2cpt h ARG 75 CO 0.01 0.29 -0.20 0.00 2.80 0.00 0.00 179.97 182.87 2cpt h ALA 76 N 1.32 -0.56 -0.86 2.80 0.00 -1.27 -2.80 119.26 117.88 2cpt h ALA 76 Ca 0.25 -0.12 0.24 0.00 0.00 0.00 0.00 54.91 55.27 2cpt h ALA 76 Cb 0.21 0.22 -0.16 0.00 0.00 0.00 0.00 17.79 18.06 2cpt h ALA 76 CO -0.21 -0.81 0.02 0.39 0.00 0.00 0.00 179.25 178.64 2cpt n GLU 77 N -5.33 -0.07 0.28 0.00 -0.58 -0.82 0.01 120.64 114.13 2cpt n GLU 77 Ca -0.11 1.29 -0.15 0.00 -0.42 0.00 0.00 57.16 57.77 2cpt n GLU 77 Cb 0.24 -2.05 -0.08 0.00 -0.57 0.00 0.00 31.44 28.98 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 -0.68 -1.58 3.49 1.79 -1.42 -2.82 116.57 115.36 2cpt h LYS 78 Ca 0.52 0.05 0.49 0.00 -2.18 0.00 0.00 60.65 59.53 2cpt h LYS 78 Cb 1.07 0.15 -0.10 0.00 -1.58 0.00 0.00 32.23 31.78 2cpt h LYS 78 CO -0.81 -0.38 1.09 1.28 -1.08 0.00 0.00 179.45 179.55 2cpt n LEU 79 N -5.32 0.08 -0.05 2.94 4.77 0.10 0.23 117.00 119.76 2cpt n LEU 79 Ca -0.11 1.06 -0.15 0.00 -0.03 0.00 0.00 56.01 56.77 2cpt n LEU 79 Cb 0.32 -0.52 -0.07 0.00 -2.33 0.00 0.00 43.42 40.81 2cpt n LEU 79 CO 0.33 -1.10 0.45 0.11 -1.33 0.00 0.00 177.39 175.84 2cpt h LYS 80 N 0.00 0.54 -0.00 3.23 1.57 -1.19 -1.70 116.57 119.02 2cpt h LYS 80 Ca 0.84 -0.38 -0.12 0.00 -1.87 0.00 0.00 60.65 59.11 2cpt h LYS 80 Cb 3.09 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 35.44 2cpt h LYS 80 CO -0.19 0.99 -0.59 1.05 -0.57 0.00 0.00 179.45 180.15 2cpt h GLU 81 N 0.18 0.00 -0.07 3.15 4.11 0.29 -2.73 114.58 119.51 2cpt h GLU 81 Ca -0.01 -0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.36 2cpt h GLU 81 Cb 1.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.26 2cpt h GLU 81 CO 0.09 0.59 -0.22 -0.92 0.07 0.00 0.00 179.01 178.62 2cpt h TYR 82 N 0.00 0.35 -0.07 2.06 5.03 -0.75 -2.14 116.97 121.45 2cpt h TYR 82 Ca -0.01 -0.14 0.01 0.00 2.58 0.00 0.00 58.73 61.18 2cpt h TYR 82 Cb 1.05 -0.06 -0.01 0.00 1.55 0.00 0.00 36.73 39.26 2cpt h TYR 82 CO 0.00 0.83 -0.01 -0.07 -1.32 0.00 0.00 178.16 177.60 2cpt h LEU 83 N -0.23 -0.04 -1.57 2.82 3.38 -1.31 -1.98 115.31 116.37 2cpt h LEU 83 Ca -0.01 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2cpt h LEU 83 Cb 0.84 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 2cpt h LEU 83 CO 0.05 -0.01 -0.05 0.07 0.09 0.00 0.00 178.44 178.59 2cpt h LYS 84 N 0.02 0.21 0.71 1.13 2.10 -1.56 0.34 116.57 119.51 2cpt h LYS 84 Ca 0.03 -0.03 -0.03 0.00 -2.00 0.00 0.00 60.65 58.61 2cpt h LYS 84 Cb 0.04 -0.04 0.01 0.00 -0.90 0.00 0.00 32.23 31.34 2cpt h LYS 84 CO -0.06 0.28 -0.34 -0.97 -2.00 0.00 0.00 179.45 176.36 2cpt h ASN 85 N 0.21 -0.81 -0.22 7.07 -0.73 -0.68 -3.21 115.58 117.21 2cpt h ASN 85 Ca 0.05 0.00 -0.17 0.00 1.87 0.00 0.00 56.30 58.05 2cpt h ASN 85 Cb 0.23 0.21 -0.00 0.00 0.27 0.00 0.00 38.32 39.02 2cpt h ASN 85 CO 0.01 -0.51 -0.48 0.07 -0.37 0.00 0.00 177.43 176.15 2cpt h LYS 86 N -1.07 0.79 -6.01 6.67 2.10 -1.28 -3.44 116.57 114.33 2cpt h LYS 86 Ca -0.10 -0.46 -0.76 0.00 -2.00 0.00 0.00 60.65 57.32 2cpt h LYS 86 Cb 0.75 0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 32.10 2cpt h LYS 86 CO 0.16 1.10 1.21 -1.91 -2.00 0.00 0.00 179.45 178.00 2cpt n GLU 87 N -4.01 0.32 -1.53 0.07 4.07 0.12 -4.67 120.64 114.99 2cpt n GLU 87 Ca -0.03 0.10 -0.25 0.00 -0.06 0.00 0.00 57.16 56.91 2cpt n GLU 87 Cb 0.59 -1.75 -0.11 0.00 -0.06 0.00 0.00 31.44 30.11 2cpt n GLU 87 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 2cpt n LYS 88 N 6.92 0.47 -3.64 5.31 4.81 -1.26 -4.81 118.16 125.97 2cpt n LYS 88 Ca 0.46 -0.31 -0.06 0.00 -0.87 0.00 0.00 58.31 57.53 2cpt n LYS 88 Cb 0.03 -2.70 -0.07 0.00 0.02 0.00 0.00 35.03 32.31 2cpt n LYS 88 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 2cpt s LYS 89 N 8.36 0.54 -0.50 1.64 2.36 -1.26 -5.10 119.74 125.78 2cpt s LYS 89 Ca 1.10 0.86 -0.32 0.00 -2.55 0.00 0.00 55.97 55.06 2cpt s LYS 89 Cb -0.48 0.14 -0.12 0.00 -1.05 0.00 0.00 37.83 36.33 2cpt s LYS 89 CO 0.30 -0.10 2.33 0.00 1.55 0.00 0.00 175.35 179.43 2cpt n ALA 90 N 3.62 0.88 -2.74 3.13 0.00 -1.26 -4.89 120.51 119.26 2cpt n ALA 90 Ca -0.18 -0.30 -0.09 0.00 0.00 0.00 0.00 53.44 52.87 2cpt n ALA 90 Cb 0.58 -2.65 -0.07 0.00 0.00 0.00 0.00 19.45 17.31 2cpt n ALA 90 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2cpt s GLN 91 N 7.19 1.10 0.11 0.00 1.03 -1.26 -5.16 119.66 122.66 2cpt s GLN 91 Ca 1.12 -1.08 -0.08 0.00 0.04 0.00 0.00 55.36 55.35 2cpt s GLN 91 Cb -0.77 0.39 -0.06 0.00 0.03 0.00 0.00 33.01 32.60 2cpt s GLN 91 CO 0.44 -0.40 0.40 -1.59 -2.54 0.00 0.00 175.29 171.60 2cpt s LYS 92 N -3.93 3.72 0.40 9.60 -2.85 -1.26 -5.07 119.74 120.34 2cpt s LYS 92 Ca 0.13 0.10 -0.26 0.00 -1.00 0.00 0.00 55.97 54.95 2cpt s LYS 92 Cb 0.03 -2.93 -0.09 0.00 -2.06 0.00 0.00 37.83 32.79 2cpt s LYS 92 CO -0.03 0.52 1.19 -1.25 0.10 0.00 0.00 175.35 175.87 2cpt s PRO 93 N -2.20 4.06 -0.81 1.78 0.04 -1.26 -5.00 135.00 131.62 2cpt s PRO 93 Ca 0.36 1.89 0.01 0.00 0.04 0.00 0.00 61.00 63.31 2cpt s PRO 93 Cb -0.13 -2.71 0.22 0.00 0.04 0.00 0.00 34.50 31.92 2cpt s PRO 93 CO 0.20 -0.33 0.78 1.55 0.04 0.00 0.00 177.00 179.24 2cpt n VAL 94 N 0.13 2.77 -1.49 -0.36 3.14 -1.26 -5.07 118.33 116.19 2cpt n VAL 94 Ca 0.04 -5.16 -0.51 0.00 -2.96 0.00 0.00 64.34 55.75 2cpt n VAL 94 Cb 0.46 -2.24 -0.04 0.00 -1.06 0.00 0.00 33.84 30.95 2cpt n VAL 94 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66 2cpt n LYS 95 N 1.79 0.42 -3.82 1.45 2.85 -1.26 -4.93 118.16 114.66 2cpt n LYS 95 Ca 0.24 0.15 -0.37 0.00 -1.05 0.00 0.00 58.31 57.28 2cpt n LYS 95 Cb 0.37 -1.43 -0.06 0.00 -0.65 0.00 0.00 35.03 33.26 2cpt n LYS 95 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 2cpt s GLU 96 N -0.66 3.60 0.00 -1.58 0.41 -1.26 -4.98 118.70 114.22 2cpt s GLU 96 Ca 0.72 -0.09 0.00 0.00 -0.41 0.00 0.00 54.97 55.20 2cpt s GLU 96 Cb -0.97 -3.23 0.00 0.00 -1.78 0.00 0.00 34.13 28.15 2cpt s GLU 96 CO 0.56 0.70 0.00 0.41 -0.49 0.00 0.00 175.26 176.43 2cpt n GLY 97 N 2.20 0.00 3.38 -1.39 0.00 -1.26 -5.07 105.19 103.04 2cpt n GLY 97 Ca -0.19 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.39 2cpt n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cpt n GLN 98 N -2.84 0.21 0.00 1.61 10.64 -1.26 -4.96 117.38 120.78 2cpt n GLN 98 Ca 0.00 0.07 0.00 0.00 -1.83 0.00 0.00 57.00 55.24 2cpt n GLN 98 Cb 0.36 -1.16 0.00 0.00 -0.86 0.00 0.00 30.24 28.58 2cpt n GLN 98 CO 0.00 0.00 0.00 -0.35 -1.83 0.00 0.00 177.06 174.88 2cpt n PRO 99 N 1.03 -0.39 -3.66 2.61 -0.04 -1.26 -5.11 135.00 128.18 2cpt n PRO 99 Ca 0.13 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.44 2cpt n PRO 99 Cb 0.35 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.73 2cpt n PRO 99 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2cpt s SER 100 N -1.51 -0.44 0.00 3.54 0.01 -1.26 -5.03 113.70 109.02 2cpt s SER 100 Ca 0.00 0.52 0.14 0.00 1.31 0.00 0.00 55.95 57.92 2cpt s SER 100 Cb 0.00 0.55 0.65 0.00 0.21 0.00 0.00 66.02 67.43 2cpt s SER 100 CO 0.00 -0.45 1.44 -0.81 0.41 0.00 0.00 173.24 173.83 2cpt n PRO 101 N 1.46 0.07 -1.48 12.44 -0.04 -1.26 -4.77 135.00 141.42 2cpt n PRO 101 Ca -0.19 0.22 -0.45 0.00 -0.04 0.00 0.00 63.50 63.04 2cpt n PRO 101 Cb 0.56 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.45 2cpt n PRO 101 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cpt n ALA 102 N -1.43 0.84 -2.70 0.55 0.00 -1.26 -4.91 120.51 111.60 2cpt n ALA 102 Ca 0.05 -0.32 -0.31 0.00 0.00 0.00 0.00 53.44 52.85 2cpt n ALA 102 Cb 0.15 -2.65 -0.09 0.00 0.00 0.00 0.00 19.45 16.86 2cpt n ALA 102 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2cpt s ASP 103 N 8.90 3.91 -0.02 0.00 1.01 -1.26 -5.06 116.67 124.15 2cpt s ASP 103 Ca 1.12 -1.58 0.18 0.00 0.71 0.00 0.00 52.55 52.98 2cpt s ASP 103 Cb -0.78 0.29 -0.27 0.00 1.01 0.00 0.00 42.92 43.18 2cpt s ASP 103 CO 0.43 -0.76 0.45 1.21 0.21 0.00 0.00 175.17 176.71 2cpt n GLU 104 N -1.15 0.64 -1.00 8.23 2.13 -1.26 -5.00 120.64 123.24 2cpt n GLU 104 Ca -0.14 -0.14 -0.28 0.00 0.66 0.00 0.00 57.16 57.25 2cpt n GLU 104 Cb 0.67 -1.41 0.20 0.00 0.27 0.00 0.00 31.44 31.16 2cpt n GLU 104 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 2cpt s LYS 105 N -3.17 0.03 0.30 5.31 -2.85 -1.26 -4.61 119.74 113.49 2cpt s LYS 105 Ca -0.05 0.59 0.00 0.00 -1.00 0.00 0.00 55.97 55.51 2cpt s LYS 105 Cb 0.12 -1.68 0.00 0.00 -2.06 0.00 0.00 37.83 34.20 2cpt s LYS 105 CO 0.75 -3.02 0.00 0.41 0.10 0.00 0.00 175.35 173.59 2cpt n GLY 106 N -0.59 0.96 3.84 0.59 0.00 -1.26 -4.95 105.19 103.78 2cpt n GLY 106 Ca 0.05 -0.86 -0.35 0.00 0.00 0.00 0.00 46.02 44.86 2cpt n GLY 106 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2cpt s ASN 107 N -4.00 6.86 -0.19 1.61 2.47 -1.26 -5.08 114.94 115.34 2cpt s ASN 107 Ca 0.00 1.14 -0.16 0.00 0.42 0.00 0.00 52.86 54.26 2cpt s ASN 107 Cb 0.00 -2.31 0.05 0.00 -1.45 0.00 0.00 41.25 37.54 2cpt s ASN 107 CO 0.00 0.07 0.49 -0.62 -3.72 0.00 0.00 177.10 173.32 2cpt s ASP 108 N -1.76 -0.53 -0.18 -4.21 2.15 -1.26 -5.04 116.67 105.83 2cpt s ASP 108 Ca 0.40 1.00 -0.29 0.00 0.43 0.00 0.00 52.55 54.09 2cpt s ASP 108 Cb -0.15 0.99 0.13 0.00 -0.30 0.00 0.00 42.92 43.60 2cpt s ASP 108 CO 0.20 -0.18 1.03 -0.55 -0.17 0.00 0.00 175.17 175.50 2cpt s SER 109 N 0.43 -0.35 -0.07 -0.34 0.15 -1.26 -5.18 113.70 107.08 2cpt s SER 109 Ca -0.01 0.42 -0.25 0.00 0.70 0.00 0.00 55.95 56.81 2cpt s SER 109 Cb -0.04 0.34 0.05 0.00 -1.71 0.00 0.00 66.02 64.67 2cpt s SER 109 CO -0.01 -0.29 0.56 1.51 1.20 0.00 0.00 173.24 176.20 2cpt s ASP 110 N -0.93 -0.51 0.00 5.45 -4.77 -1.26 -5.16 116.67 109.49 2cpt s ASP 110 Ca -0.00 0.61 0.00 0.00 -3.30 0.00 0.00 52.55 49.85 2cpt s ASP 110 Cb -0.01 0.58 0.00 0.00 -1.09 0.00 0.00 42.92 42.40 2cpt s ASP 110 CO -0.00 -0.50 0.00 0.61 0.70 0.00 0.00 175.17 175.98 2cpt n GLY 111 N 1.32 2.50 3.36 2.12 0.00 -1.26 -5.13 105.19 108.09 2cpt n GLY 111 Ca -0.19 -2.04 -0.09 0.00 0.00 0.00 0.00 46.02 43.70 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 0.00 -0.01 -0.38 1.61 1.04 -1.26 -5.13 113.70 109.57 2cpt s SER 112 Ca 0.00 -0.78 -0.04 0.00 0.48 0.00 0.00 55.95 55.62 2cpt s SER 112 Cb 0.00 0.46 0.21 0.00 0.10 0.00 0.00 66.02 66.78 2cpt s SER 112 CO 0.00 -0.91 1.00 -0.83 0.98 0.00 0.00 173.24 173.48 2cpt s GLY 113 N -2.94 -1.73 1.06 7.32 0.00 -1.26 -5.17 107.32 104.60 2cpt s GLY 113 Ca 0.15 0.43 -0.18 0.00 0.00 0.00 0.00 44.72 45.12 2cpt s GLY 113 CO -0.01 4.15 0.93 -1.55 0.00 0.00 0.00 173.10 176.62 2cpt n PRO 114 N 2.83 -2.86 -1.83 2.90 -0.04 -1.26 -5.05 135.00 129.69 2cpt n PRO 114 Ca 0.12 -1.50 -0.29 0.00 -0.04 0.00 0.00 63.50 61.79 2cpt n PRO 114 Cb 0.63 -1.40 0.13 0.00 -0.04 0.00 0.00 33.50 32.81 2cpt n PRO 114 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2cpt s SER 115 N -4.02 3.77 -0.05 3.54 1.04 -1.26 -5.09 113.70 111.64 2cpt s SER 115 Ca 0.61 0.63 -0.02 0.00 0.48 0.00 0.00 55.95 57.65 2cpt s SER 115 Cb -0.06 -0.98 0.03 0.00 0.10 0.00 0.00 66.02 65.11 2cpt s SER 115 CO 0.47 -2.35 0.04 -0.55 0.98 0.00 0.00 173.24 171.82 2cpt s SER 116 N -4.58 1.27 0.00 7.02 0.15 -1.26 -5.34 113.70 110.97 2cpt s SER 116 Ca 0.66 0.03 0.27 0.00 0.70 0.00 0.00 55.95 57.62 2cpt s SER 116 Cb -0.09 -0.23 0.92 0.00 -1.71 0.00 0.00 66.02 64.91 2cpt s SER 116 CO 0.51 -0.23 1.67 0.61 1.20 0.00 0.00 173.24 177.00