#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 5.23 -0.17 1.61 1.04 -1.26 -5.03 113.70 115.12 2cpt s SER 2 Ca 0.00 -3.38 -0.08 0.00 0.48 0.00 0.00 55.95 52.97 2cpt s SER 2 Cb 0.00 -1.79 0.07 0.00 0.10 0.00 0.00 66.02 64.40 2cpt s SER 2 CO 0.00 -0.22 0.38 -0.44 0.98 0.00 0.00 173.24 173.94 2cpt s SER 3 N -0.22 -0.32 -0.16 7.02 0.01 -1.26 -5.04 113.70 113.73 2cpt s SER 3 Ca 0.22 0.86 -0.01 0.00 1.31 0.00 0.00 55.95 58.32 2cpt s SER 3 Cb -0.14 0.90 0.05 0.00 0.21 0.00 0.00 66.02 67.05 2cpt s SER 3 CO -0.09 -0.21 2.28 0.61 0.41 0.00 0.00 173.24 176.25 2cpt n GLY 4 N 4.71 3.31 3.50 3.44 0.00 -1.26 -4.82 105.19 114.07 2cpt n GLY 4 Ca -0.17 -0.72 -0.12 0.00 0.00 0.00 0.00 46.02 45.01 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 1.20 -0.49 0.12 1.61 0.15 -1.26 -5.19 113.70 109.83 2cpt s SER 5 Ca 0.25 0.25 -0.26 0.00 0.70 0.00 0.00 55.95 56.89 2cpt s SER 5 Cb 0.16 0.47 0.08 0.00 -1.71 0.00 0.00 66.02 65.02 2cpt s SER 5 CO -0.02 -0.66 1.05 -0.94 1.20 0.00 0.00 173.24 173.87 2cpt s SER 6 N -1.99 -0.12 0.00 5.45 1.04 -1.26 -5.11 113.70 111.71 2cpt s SER 6 Ca -0.01 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.03 2cpt s SER 6 Cb -0.01 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.53 2cpt s SER 6 CO -0.04 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 174.02 2cpt n GLY 7 N -0.52 -0.67 2.91 7.32 0.00 -1.26 -5.15 105.19 107.82 2cpt n GLY 7 Ca -0.06 -0.47 -0.13 0.00 0.00 0.00 0.00 46.02 45.36 2cpt n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2cpt s MET 8 N -0.99 0.07 0.01 1.61 0.00 -1.26 -5.16 119.30 113.58 2cpt s MET 8 Ca 0.00 0.20 -0.15 0.00 0.00 0.00 0.00 55.69 55.74 2cpt s MET 8 Cb 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 34.83 34.78 2cpt s MET 8 CO 0.00 -0.08 0.32 -1.12 0.00 0.00 0.00 175.02 174.14 2cpt s SER 9 N 0.56 -0.18 0.58 -1.18 0.01 -1.26 -5.15 113.70 107.08 2cpt s SER 9 Ca -0.04 -0.02 -0.21 0.00 1.31 0.00 0.00 55.95 56.99 2cpt s SER 9 Cb -0.06 0.34 -0.04 0.00 0.21 0.00 0.00 66.02 66.48 2cpt s SER 9 CO -0.02 -0.53 1.34 -1.54 0.41 0.00 0.00 173.24 172.90 2cpt n SER 10 N 0.94 2.51 -3.63 2.44 3.41 -1.26 -5.02 113.62 113.01 2cpt n SER 10 Ca -0.20 0.93 -0.08 0.00 -0.26 0.00 0.00 58.87 59.26 2cpt n SER 10 Cb 0.58 -1.57 -0.07 0.00 -0.26 0.00 0.00 64.21 62.88 2cpt n SER 10 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2cpt s THR 11 N -1.32 0.00 0.52 6.66 -1.32 -1.26 -5.15 115.64 113.77 2cpt s THR 11 Ca 0.75 0.00 -0.19 0.00 -1.21 0.00 0.00 61.69 61.04 2cpt s THR 11 Cb -0.40 -1.00 -0.11 0.00 -1.51 0.00 0.00 72.50 69.47 2cpt s THR 11 CO 0.46 0.00 0.33 -1.20 -2.21 0.00 0.00 174.62 172.00 2cpt n SER 12 N 1.87 -1.82 0.02 8.08 7.64 -1.26 -4.74 113.62 123.41 2cpt n SER 12 Ca -0.11 0.75 -0.06 0.00 1.01 0.00 0.00 58.87 60.45 2cpt n SER 12 Cb 0.56 -1.06 0.12 0.00 -1.01 0.00 0.00 64.21 62.82 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 0.28 0.49 -0.17 1.43 0.13 -2.01 -1.73 132.00 130.42 2cpt h PRO 13 Ca -0.43 -0.26 -0.09 0.00 -0.87 0.00 0.00 66.00 64.35 2cpt h PRO 13 Cb 1.42 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.54 2cpt h PRO 13 CO 0.46 0.83 -0.30 -0.91 -0.23 0.00 0.00 178.00 177.85 2cpt h ASN 14 N 0.40 0.33 0.04 1.44 4.21 -1.97 -2.65 115.58 117.38 2cpt h ASN 14 Ca 0.03 -0.11 -0.08 0.00 1.21 0.00 0.00 56.30 57.35 2cpt h ASN 14 Cb 0.92 -0.09 0.01 0.00 -1.12 0.00 0.00 38.32 38.04 2cpt h ASN 14 CO 0.08 0.63 -0.33 0.25 -1.29 0.00 0.00 177.43 176.77 2cpt h LEU 15 N 0.29 0.22 -1.21 1.61 5.85 -1.84 -3.19 115.31 117.04 2cpt h LEU 15 Ca 0.04 -0.90 0.17 0.00 0.84 0.00 0.00 57.88 58.03 2cpt h LEU 15 Cb 0.68 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.56 2cpt h LEU 15 CO 0.05 1.10 0.60 -0.61 -0.34 0.00 0.00 178.44 179.25 2cpt h GLN 16 N -0.62 0.67 -0.19 1.25 5.75 -1.30 0.17 115.11 120.84 2cpt h GLN 16 Ca -0.05 -0.04 -0.09 0.00 -0.15 0.00 0.00 58.65 58.32 2cpt h GLN 16 Cb 1.19 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.57 2cpt h GLN 16 CO 0.06 0.44 -0.27 -0.22 -2.65 0.00 0.00 178.83 176.20 2cpt h LYS 17 N 0.69 0.36 -0.25 1.69 3.64 -1.55 -2.28 116.57 118.87 2cpt h LYS 17 Ca 0.51 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 59.72 2cpt h LYS 17 Cb 0.87 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.65 2cpt h LYS 17 CO -0.27 0.60 0.02 0.00 -2.27 0.00 0.00 179.45 177.53 2cpt h ALA 18 N 1.40 0.34 0.37 5.00 0.00 -0.66 -1.06 119.26 124.65 2cpt h ALA 18 Ca 0.05 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2cpt h ALA 18 Cb 0.64 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2cpt h ALA 18 CO 0.05 0.06 -0.18 0.82 0.00 0.00 0.00 179.25 179.99 2cpt h ILE 19 N 0.23 0.64 -0.39 0.00 5.03 -1.30 -0.15 117.51 121.57 2cpt h ILE 19 Ca 0.07 -0.28 0.06 0.00 -0.12 0.00 0.00 64.86 64.60 2cpt h ILE 19 Cb 0.38 0.78 -0.05 0.00 -3.03 0.00 0.00 36.82 34.90 2cpt h ILE 19 CO 0.01 0.05 0.05 -0.78 -0.68 0.00 0.00 178.15 176.81 2cpt h ASP 20 N -0.65 -0.04 0.42 1.72 1.82 -1.45 0.17 116.42 118.41 2cpt h ASP 20 Ca -0.05 0.07 -0.02 0.00 -0.39 0.00 0.00 57.03 56.64 2cpt h ASP 20 Cb 0.47 0.11 -0.00 0.00 0.68 0.00 0.00 39.33 40.59 2cpt h ASP 20 CO 0.08 0.02 -0.23 -0.07 -1.61 0.00 0.00 179.24 177.43 2cpt h LEU 21 N 0.17 -0.56 -1.48 2.28 3.38 -1.14 -0.76 115.31 117.20 2cpt h LEU 21 Ca 0.19 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.27 2cpt h LEU 21 Cb 0.23 0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.10 2cpt h LEU 21 CO -0.26 -0.38 0.45 0.00 0.09 0.00 0.00 178.44 178.34 2cpt h ALA 22 N -0.05 1.84 -0.36 1.53 0.00 -0.72 -1.70 119.26 119.80 2cpt h ALA 22 Ca -0.05 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 2cpt h ALA 22 Cb 0.49 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2cpt h ALA 22 CO 0.07 0.03 -0.06 1.03 0.00 0.00 0.00 179.25 180.32 2cpt h SER 23 N 0.61 0.68 -0.48 0.00 0.87 -0.22 -3.13 113.55 111.88 2cpt h SER 23 Ca 0.31 -0.35 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 2cpt h SER 23 Cb 0.40 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.15 2cpt h SER 23 CO -0.10 0.87 0.32 0.50 -0.53 0.00 0.00 176.83 177.88 2cpt h LYS 24 N 0.48 0.63 -0.65 2.24 3.64 -0.27 -3.02 116.57 119.61 2cpt h LYS 24 Ca 0.09 -0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.50 2cpt h LYS 24 Cb 0.56 -0.14 -0.09 0.00 -0.41 0.00 0.00 32.23 32.15 2cpt h LYS 24 CO 0.03 0.42 -0.49 0.00 -2.27 0.00 0.00 179.45 177.14 2cpt h ALA 25 N 1.17 -0.55 -0.02 5.00 0.00 -1.34 -1.11 119.26 122.41 2cpt h ALA 25 Ca 0.17 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.17 2cpt h ALA 25 Cb -0.07 1.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.88 2cpt h ALA 25 CO -0.04 -0.86 -0.48 0.00 0.00 0.00 0.00 179.25 177.87 2cpt h ALA 26 N 0.07 -0.81 -0.99 0.00 0.00 -1.59 -0.80 119.26 115.15 2cpt h ALA 26 Ca 0.11 -0.06 0.35 0.00 0.00 0.00 0.00 54.91 55.31 2cpt h ALA 26 Cb 0.40 0.86 -0.17 0.00 0.00 0.00 0.00 17.79 18.88 2cpt h ALA 26 CO -0.68 -1.04 0.40 1.96 0.00 0.00 0.00 179.25 179.90 2cpt h GLN 27 N -0.62 0.08 0.22 0.00 1.08 -1.19 0.21 115.11 114.89 2cpt h GLN 27 Ca 0.03 -0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.22 2cpt h GLN 27 Cb 0.69 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.10 2cpt h GLN 27 CO -0.35 0.05 -0.10 0.93 -0.95 0.00 0.00 178.83 178.41 2cpt h GLU 28 N 0.09 -0.28 -0.62 1.46 4.39 0.01 -2.26 114.58 117.36 2cpt h GLU 28 Ca 0.74 0.02 0.08 0.00 0.34 0.00 0.00 59.36 60.54 2cpt h GLU 28 Cb 1.81 0.06 -0.10 0.00 -0.10 0.00 0.00 28.75 30.42 2cpt h GLU 28 CO -0.76 0.04 -0.50 0.22 -1.16 0.00 0.00 179.01 176.85 2cpt h ASP 29 N -0.63 -1.74 -0.60 1.42 3.58 0.35 0.40 116.42 119.20 2cpt h ASP 29 Ca -0.03 0.26 0.06 0.00 0.42 0.00 0.00 57.03 57.75 2cpt h ASP 29 Cb 0.45 0.76 -0.05 0.00 1.72 0.00 0.00 39.33 42.21 2cpt h ASP 29 CO 0.05 -0.34 0.30 0.50 -2.88 0.00 0.00 179.24 176.87 2cpt h LYS 30 N -0.23 0.54 -0.26 0.28 3.64 -1.43 -1.02 116.57 118.09 2cpt h LYS 30 Ca 0.15 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.49 2cpt h LYS 30 Cb 0.55 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 2cpt h LYS 30 CO -0.72 0.36 0.15 0.00 -2.27 0.00 0.00 179.45 176.97 2cpt h ALA 31 N 1.34 1.79 0.00 5.00 0.00 -0.30 -3.45 119.26 123.63 2cpt h ALA 31 Ca 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2cpt h ALA 31 Cb 0.21 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2cpt h ALA 31 CO -0.20 0.19 0.00 0.41 0.00 0.00 0.00 179.25 179.65 2cpt n GLY 32 N -1.45 0.44 3.53 0.00 0.00 0.11 -5.09 105.19 102.74 2cpt n GLY 32 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 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 6.34 -0.27 1.61 0.01 0.30 -4.90 114.94 117.94 2cpt s ASN 33 Ca 0.00 -0.21 -0.13 0.00 -0.71 0.00 0.00 52.86 51.81 2cpt s ASN 33 Cb 0.00 -2.31 -0.13 0.00 0.41 0.00 0.00 41.25 39.22 2cpt s ASN 33 CO 0.00 -0.71 -0.31 -1.22 -1.51 0.00 0.00 177.10 173.35 2cpt n TYR 34 N 6.15 0.06 -0.34 2.20 4.02 -1.26 -2.51 117.16 125.48 2cpt n TYR 34 Ca -0.02 0.02 0.07 0.00 -0.01 0.00 0.00 57.90 57.96 2cpt n TYR 34 Cb 0.48 -1.01 0.25 0.00 -0.02 0.00 0.00 39.34 39.04 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 -0.89 0.96 -0.00 -0.72 4.81 -1.90 0.76 114.58 117.59 2cpt h GLU 35 Ca -0.68 -0.06 -0.24 0.00 -0.13 0.00 0.00 59.36 58.25 2cpt h GLU 35 Cb 1.64 -0.22 0.01 0.00 0.63 0.00 0.00 28.75 30.81 2cpt h GLU 35 CO -0.38 0.64 -0.98 1.49 -0.73 0.00 0.00 179.01 179.04 2cpt h GLU 36 N 0.99 0.55 -0.16 1.92 4.57 -1.98 -3.21 114.58 117.27 2cpt h GLU 36 Ca 0.46 -0.59 -0.06 0.00 -1.18 0.00 0.00 59.36 57.99 2cpt h GLU 36 Cb 0.42 0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.16 2cpt h GLU 36 CO -0.22 1.21 -0.18 0.00 -1.18 0.00 0.00 179.01 178.64 2cpt h ALA 37 N 0.59 1.40 0.22 2.92 0.00 -1.36 -2.79 119.26 120.24 2cpt h ALA 37 Ca -0.10 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 2cpt h ALA 37 Cb 1.63 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.33 2cpt h ALA 37 CO 0.18 0.41 -0.11 1.25 0.00 0.00 0.00 179.25 180.99 2cpt h LEU 38 N 0.24 -0.25 -1.09 0.00 5.85 -0.89 0.29 115.31 119.46 2cpt h LEU 38 Ca 0.04 0.01 0.31 0.00 0.84 0.00 0.00 57.88 59.08 2cpt h LEU 38 Cb 0.47 0.07 -0.13 0.00 0.37 0.00 0.00 40.66 41.43 2cpt h LEU 38 CO 0.03 -0.16 0.62 0.06 -0.34 0.00 0.00 178.44 178.65 2cpt h GLN 39 N -0.33 0.36 -0.30 1.25 3.07 -1.60 0.32 115.11 117.88 2cpt h GLN 39 Ca -0.03 -0.02 -0.06 0.00 0.09 0.00 0.00 58.65 58.63 2cpt h GLN 39 Cb 0.23 -0.08 -0.01 0.00 0.08 0.00 0.00 27.48 27.70 2cpt h GLN 39 CO 0.05 0.24 -0.04 -0.07 0.09 0.00 0.00 178.83 179.10 2cpt h LEU 40 N 0.37 0.54 -1.28 0.06 3.38 -1.41 -1.09 115.31 115.88 2cpt h LEU 40 Ca 0.70 -0.34 -0.00 0.00 0.09 0.00 0.00 57.88 58.33 2cpt h LEU 40 Cb 1.64 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 42.21 2cpt h LEU 40 CO -0.52 0.75 0.39 1.88 0.09 0.00 0.00 178.44 181.04 2cpt h TYR 41 N 0.32 0.85 -0.03 1.13 0.05 0.18 -0.40 116.97 119.07 2cpt h TYR 41 Ca 0.08 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.84 2cpt h TYR 41 Cb 0.50 -0.28 0.00 0.00 1.01 0.00 0.00 36.73 37.95 2cpt h TYR 41 CO 0.04 0.57 -0.06 1.96 -1.05 0.00 0.00 178.16 179.62 2cpt h GLN 42 N 0.90 0.10 0.79 4.88 4.20 -0.99 -3.20 115.11 121.78 2cpt h GLN 42 Ca 0.24 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.85 2cpt h GLN 42 Cb -0.04 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.75 2cpt h GLN 42 CO -0.04 0.64 -0.42 0.45 -0.67 0.00 0.00 178.83 178.79 2cpt h HIS 43 N -0.44 -1.11 -0.77 2.96 3.86 -0.97 -1.70 115.15 116.99 2cpt h HIS 43 Ca 0.00 -0.02 0.13 0.00 -1.16 0.00 0.00 60.37 59.32 2cpt h HIS 43 Cb 0.64 0.38 -0.13 0.00 1.06 0.00 0.00 27.41 29.36 2cpt h HIS 43 CO 0.12 -0.66 -0.27 0.00 0.86 0.00 0.00 177.93 177.98 2cpt n ALA 44 N -2.61 -0.02 -0.05 2.45 0.00 -0.18 0.91 120.51 121.01 2cpt n ALA 44 Ca -0.14 0.78 -0.11 0.00 0.00 0.00 0.00 53.44 53.98 2cpt n ALA 44 Cb 0.45 -0.38 -0.04 0.00 0.00 0.00 0.00 19.45 19.47 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 1.12 -0.97 0.00 2.07 -1.52 -1.17 116.25 115.79 2cpt h VAL 45 Ca 0.29 -0.35 0.27 0.00 0.82 0.00 0.00 66.70 67.73 2cpt h VAL 45 Cb 0.48 1.02 -0.14 0.00 -1.52 0.00 0.00 31.29 31.14 2cpt h VAL 45 CO -0.77 0.12 0.49 1.56 0.02 0.00 0.00 177.57 178.99 2cpt h GLN 46 N 0.18 0.37 0.06 1.57 1.08 0.15 0.11 115.11 118.62 2cpt h GLN 46 Ca 0.06 -0.02 -0.22 0.00 -1.45 0.00 0.00 58.65 57.03 2cpt h GLN 46 Cb 0.11 -0.08 0.02 0.00 -0.05 0.00 0.00 27.48 27.47 2cpt h GLN 46 CO -0.01 0.25 -0.88 1.88 -0.95 0.00 0.00 178.83 179.12 2cpt h TYR 47 N 0.38 0.77 -0.72 2.96 0.05 -0.99 -2.90 116.97 116.52 2cpt h TYR 47 Ca 0.65 -0.46 0.12 0.00 0.05 0.00 0.00 58.73 59.10 2cpt h TYR 47 Cb 1.37 -0.07 -0.09 0.00 1.01 0.00 0.00 36.73 38.95 2cpt h TYR 47 CO -0.07 1.30 0.30 0.74 -1.05 0.00 0.00 178.16 179.38 2cpt h PHE 48 N 0.02 0.51 0.53 4.88 0.04 0.39 -1.91 116.94 121.42 2cpt h PHE 48 Ca -0.13 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.65 2cpt h PHE 48 Cb 1.59 -0.12 0.01 0.00 2.20 0.00 0.00 35.95 39.63 2cpt h PHE 48 CO 0.14 0.10 -0.26 -0.07 -0.60 0.00 0.00 178.31 177.63 2cpt h LEU 49 N 0.47 -0.61 -1.81 1.54 3.38 -1.15 -2.53 115.31 114.60 2cpt h LEU 49 Ca 0.38 -0.04 0.48 0.00 0.09 0.00 0.00 57.88 58.80 2cpt h LEU 49 Cb 0.53 0.16 -0.09 0.00 0.09 0.00 0.00 40.66 41.35 2cpt h LEU 49 CO -0.36 -0.22 1.13 -0.74 0.09 0.00 0.00 178.44 178.34 2cpt h HIS 50 N -1.09 0.17 -0.00 1.13 2.76 -1.28 0.47 115.15 117.31 2cpt h HIS 50 Ca -0.07 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.09 2cpt h HIS 50 Cb 0.61 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.53 2cpt h HIS 50 CO 0.01 -0.06 -0.04 0.28 -1.30 0.00 0.00 177.93 176.82 2cpt h VAL 51 N 0.03 1.61 0.00 5.26 2.07 -1.23 -2.78 116.25 121.22 2cpt h VAL 51 Ca 0.83 -1.85 0.00 0.00 0.82 0.00 0.00 66.70 66.50 2cpt h VAL 51 Cb 3.10 2.85 0.00 0.00 -1.52 0.00 0.00 31.29 35.72 2cpt h VAL 51 CO -0.14 0.48 0.00 0.52 0.02 0.00 0.00 177.57 178.46 2cpt n VAL 52 N -4.68 0.90 -0.06 2.57 0.31 0.15 0.48 118.33 117.99 2cpt n VAL 52 Ca -0.09 0.23 -0.05 0.00 -0.01 0.00 0.00 64.34 64.42 2cpt n VAL 52 Cb 0.40 -1.08 -0.02 0.00 -0.91 0.00 0.00 33.84 32.24 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 -1.32 0.38 -0.13 5.55 0.00 -0.21 -4.35 118.16 118.09 2cpt n LYS 53 Ca 0.04 0.41 -0.26 0.00 0.00 0.00 0.00 58.31 58.49 2cpt n LYS 53 Cb 0.08 -1.46 -0.11 0.00 0.00 0.00 0.00 35.03 33.54 2cpt n LYS 53 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2cpt n TYR 54 N -4.17 0.17 -0.05 5.64 4.02 -1.05 -4.39 117.16 117.33 2cpt n TYR 54 Ca -0.07 0.06 -0.09 0.00 -0.01 0.00 0.00 57.90 57.79 2cpt n TYR 54 Cb 0.26 -1.02 0.05 0.00 -0.02 0.00 0.00 39.34 38.62 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 -4.06 1.47 -1.54 -0.72 1.02 0.11 -4.96 120.64 111.96 2cpt n GLU 55 Ca -0.50 -1.06 -0.50 0.00 -0.02 0.00 0.00 57.16 55.09 2cpt n GLU 55 Cb 0.89 -1.42 -0.04 0.00 -0.02 0.00 0.00 31.44 30.85 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 0.14 -1.39 -0.19 0.62 0.00 0.18 -4.54 120.51 115.33 2cpt n ALA 56 Ca 0.21 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.12 2cpt n ALA 56 Cb 0.81 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 18.32 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 1.51 0.00 -3.84 0.00 1.13 -1.26 -5.01 117.38 109.91 2cpt n GLN 57 Ca 0.16 0.14 -0.05 0.00 -1.94 0.00 0.00 57.00 55.30 2cpt n GLN 57 Cb 0.23 -0.58 0.01 0.00 0.11 0.00 0.00 30.24 30.02 2cpt n GLN 57 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2cpt s GLY 58 N -2.33 0.16 0.50 1.08 0.00 -1.26 -4.97 107.32 100.50 2cpt s GLY 58 Ca 0.00 -0.44 0.20 0.00 0.00 0.00 0.00 44.72 44.48 2cpt s GLY 58 CO 0.00 0.99 2.09 -0.55 0.00 0.00 0.00 173.10 175.63 2cpt h ASP 59 N 2.00 0.00 0.08 1.64 5.19 -1.99 0.36 116.42 123.69 2cpt h ASP 59 Ca -0.28 0.00 -0.23 0.00 -0.62 0.00 0.00 57.03 55.90 2cpt h ASP 59 Cb 1.23 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.73 2cpt h ASP 59 CO 0.36 0.10 -1.18 0.11 -3.12 0.00 0.00 179.24 175.51 2cpt h LYS 60 N 0.00 0.16 -0.32 3.56 1.79 -2.00 -3.28 116.57 116.48 2cpt h LYS 60 Ca -0.00 -0.28 -0.09 0.00 -2.18 0.00 0.00 60.65 58.10 2cpt h LYS 60 Cb 0.19 0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 30.93 2cpt h LYS 60 CO 0.01 1.13 -0.19 0.00 -1.08 0.00 0.00 179.45 179.33 2cpt h ALA 61 N -0.12 1.08 0.58 3.86 0.00 -1.89 -2.21 119.26 120.55 2cpt h ALA 61 Ca -0.27 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.29 2cpt h ALA 61 Cb 1.57 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.22 2cpt h ALA 61 CO -0.00 0.56 -0.33 0.87 0.00 0.00 0.00 179.25 180.35 2cpt h LYS 62 N 0.53 -0.81 -0.92 0.00 1.57 -0.44 -1.17 116.57 115.32 2cpt h LYS 62 Ca 0.08 0.06 0.11 0.00 -1.87 0.00 0.00 60.65 59.03 2cpt h LYS 62 Cb 0.62 0.18 -0.07 0.00 0.08 0.00 0.00 32.23 33.04 2cpt h LYS 62 CO 0.04 -0.54 0.59 -0.56 -0.57 0.00 0.00 179.45 178.42 2cpt h GLN 63 N -0.84 0.87 0.20 3.15 3.07 -1.62 0.27 115.11 120.21 2cpt h GLN 63 Ca -0.08 -0.05 0.01 0.00 0.09 0.00 0.00 58.65 58.62 2cpt h GLN 63 Cb 0.66 -0.20 -0.02 0.00 0.08 0.00 0.00 27.48 28.01 2cpt h GLN 63 CO 0.10 0.57 -0.24 0.77 0.09 0.00 0.00 178.83 180.12 2cpt h SER 64 N 0.89 -0.65 -0.39 0.06 0.02 -1.19 -0.83 113.55 111.46 2cpt h SER 64 Ca 0.44 0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 61.41 2cpt h SER 64 Cb 0.47 0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.23 2cpt h SER 64 CO -0.20 -0.34 0.06 0.40 -1.14 0.00 0.00 176.83 175.61 2cpt h ILE 65 N -0.49 1.24 -0.38 3.27 2.04 -0.67 -3.12 117.51 119.40 2cpt h ILE 65 Ca 0.01 -0.86 0.08 0.00 1.00 0.00 0.00 64.86 65.09 2cpt h ILE 65 Cb 0.47 1.05 -0.08 0.00 -0.74 0.00 0.00 36.82 37.53 2cpt h ILE 65 CO -0.08 0.29 -0.14 0.03 0.00 0.00 0.00 178.15 178.25 2cpt h ARG 66 N 0.49 -0.06 -0.93 2.37 3.08 -0.75 -0.84 114.38 117.73 2cpt h ARG 66 Ca 0.12 0.00 0.28 0.00 0.07 0.00 0.00 59.98 60.45 2cpt h ARG 66 Cb 0.37 0.01 -0.15 0.00 0.08 0.00 0.00 29.97 30.28 2cpt h ARG 66 CO 0.01 -0.04 0.32 0.00 -1.07 0.00 0.00 179.97 179.19 2cpt h ALA 67 N 1.26 1.52 -0.33 0.04 0.00 -1.08 0.32 119.26 120.98 2cpt h ALA 67 Ca 0.19 0.23 -0.07 0.00 0.00 0.00 0.00 54.91 55.26 2cpt h ALA 67 Cb 0.35 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2cpt h ALA 67 CO -0.42 -0.55 -0.05 0.87 0.00 0.00 0.00 179.25 179.09 2cpt h LYS 68 N 0.20 0.62 -0.75 0.00 6.56 -1.23 -2.42 116.57 119.54 2cpt h LYS 68 Ca 0.63 -0.22 0.14 0.00 -1.06 0.00 0.00 60.65 60.14 2cpt h LYS 68 Cb 1.37 -0.04 -0.09 0.00 -0.57 0.00 0.00 32.23 32.90 2cpt h LYS 68 CO -0.68 0.78 0.31 0.00 -2.06 0.00 0.00 179.45 177.79 2cpt h THR 70 N 0.46 1.28 0.60 0.00 2.02 -1.26 -1.33 112.91 114.68 2cpt h THR 70 Ca 0.41 -1.12 -0.03 0.00 0.77 0.00 0.00 66.41 66.44 2cpt h THR 70 Cb 0.61 1.44 0.01 0.00 -1.74 0.00 0.00 68.15 68.47 2cpt h THR 70 CO -0.39 0.35 -0.29 -0.08 0.37 0.00 0.00 175.52 175.48 2cpt h GLU 71 N 0.30 -0.77 -0.99 6.66 4.57 -0.77 -1.24 114.58 122.33 2cpt h GLU 71 Ca 0.07 0.05 0.18 0.00 -1.18 0.00 0.00 59.36 58.48 2cpt h GLU 71 Cb 0.56 0.18 -0.10 0.00 -0.16 0.00 0.00 28.75 29.23 2cpt h GLU 71 CO 0.03 -0.51 0.62 1.88 -1.18 0.00 0.00 179.01 179.84 2cpt h TYR 72 N -0.86 1.02 0.21 0.92 0.05 -0.71 -0.14 116.97 117.46 2cpt h TYR 72 Ca -0.08 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.72 2cpt h TYR 72 Cb 0.61 -0.31 0.00 0.00 1.01 0.00 0.00 36.73 38.04 2cpt h TYR 72 CO 0.07 0.26 -0.11 -0.07 -1.05 0.00 0.00 178.16 177.27 2cpt h LEU 73 N 0.76 -0.25 -0.85 3.88 3.38 -1.13 -0.89 115.31 120.20 2cpt h LEU 73 Ca 0.56 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.53 2cpt h LEU 73 Cb 0.88 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.65 2cpt h LEU 73 CO -0.34 -0.18 0.51 -0.78 0.09 0.00 0.00 178.44 177.74 2cpt h ASP 74 N -0.29 1.03 0.31 -0.43 3.58 -0.15 -2.13 116.42 118.33 2cpt h ASP 74 Ca -0.03 -0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.35 2cpt h ASP 74 Cb 0.23 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 41.01 2cpt h ASP 74 CO 0.05 0.79 -0.20 -0.09 -2.88 0.00 0.00 179.24 176.91 2cpt h ARG 75 N 1.17 -0.47 -0.47 0.28 9.65 -0.80 -2.89 114.38 120.84 2cpt h ARG 75 Ca 0.31 0.03 0.08 0.00 -1.10 0.00 0.00 59.98 59.29 2cpt h ARG 75 Cb -0.05 0.11 -0.06 0.00 -1.39 0.00 0.00 29.97 28.58 2cpt h ARG 75 CO -0.06 -0.32 0.11 0.00 2.80 0.00 0.00 179.97 182.51 2cpt h ALA 76 N 0.17 0.54 -0.95 2.80 0.00 -1.00 -1.79 119.26 119.04 2cpt h ALA 76 Ca -0.03 0.09 0.28 0.00 0.00 0.00 0.00 54.91 55.25 2cpt h ALA 76 Cb 0.41 0.11 -0.17 0.00 0.00 0.00 0.00 17.79 18.14 2cpt h ALA 76 CO 0.03 -0.29 0.19 0.93 0.00 0.00 0.00 179.25 180.10 2cpt h GLU 77 N 0.25 0.08 -0.22 0.00 5.08 -1.17 0.38 114.58 118.98 2cpt h GLU 77 Ca 0.23 -0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.54 2cpt h GLU 77 Cb 0.29 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 2cpt h GLU 77 CO -0.29 0.05 -0.06 0.87 -1.00 0.00 0.00 179.01 178.58 2cpt h LYS 78 N 0.08 0.43 -0.55 2.33 1.79 -1.27 -2.75 116.57 116.63 2cpt h LYS 78 Ca 0.62 -0.17 0.16 0.00 -2.18 0.00 0.00 60.65 59.08 2cpt h LYS 78 Cb 1.34 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.95 2cpt h LYS 78 CO -0.79 0.67 0.54 -0.07 -1.08 0.00 0.00 179.45 178.72 2cpt h LEU 79 N 0.16 0.00 0.05 2.94 3.38 0.01 0.62 115.31 122.46 2cpt h LEU 79 Ca 0.05 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 2cpt h LEU 79 Cb 0.52 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.28 2cpt h LEU 79 CO 0.02 0.00 -0.28 0.11 0.09 0.00 0.00 178.44 178.38 2cpt h LYS 80 N 0.00 0.11 0.00 1.13 1.57 -1.07 -2.37 116.57 115.93 2cpt h LYS 80 Ca 0.26 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2cpt h LYS 80 Cb 1.35 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.72 2cpt h LYS 80 CO -0.00 1.07 0.00 1.05 -0.57 0.00 0.00 179.45 181.00 2cpt h GLU 81 N -0.76 0.00 0.04 3.15 4.11 -0.86 -2.08 114.58 118.18 2cpt h GLU 81 Ca -0.05 0.00 -0.32 0.00 0.07 0.00 0.00 59.36 59.06 2cpt h GLU 81 Cb 1.21 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.41 2cpt h GLU 81 CO 0.05 0.00 -1.83 0.98 0.07 0.00 0.00 179.01 178.28 2cpt n TYR 82 N -2.68 1.04 0.13 2.06 4.19 0.03 -3.47 117.16 118.47 2cpt n TYR 82 Ca -0.00 0.32 -0.02 0.00 3.31 0.00 0.00 57.90 61.51 2cpt n TYR 82 Cb 0.18 -1.17 0.14 0.00 0.49 0.00 0.00 39.34 38.98 2cpt n TYR 82 CO 0.00 0.00 0.00 -0.07 0.91 0.00 0.00 176.86 177.70 2cpt h LEU 83 N 0.02 0.00 -0.07 2.98 3.38 -0.93 -2.00 115.31 118.69 2cpt h LEU 83 Ca -0.34 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2cpt h LEU 83 Cb 2.03 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.78 2cpt h LEU 83 CO 0.08 0.66 -0.21 2.29 0.09 0.00 0.00 178.44 181.35 2cpt n LYS 84 N -3.75 0.20 -0.06 1.13 2.85 -0.83 -3.23 118.16 114.47 2cpt n LYS 84 Ca -0.01 -0.07 -0.01 0.00 -1.05 0.00 0.00 58.31 57.17 2cpt n LYS 84 Cb 0.65 -1.50 -0.16 0.00 -0.65 0.00 0.00 35.03 33.37 2cpt n LYS 84 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 2cpt n ASN 85 N -1.34 0.02 -0.02 -5.58 5.15 -1.08 -4.47 115.26 107.94 2cpt n ASN 85 Ca 0.08 0.01 -0.09 0.00 -0.60 0.00 0.00 54.58 53.98 2cpt n ASN 85 Cb 0.32 1.41 -0.08 0.00 -0.53 0.00 0.00 39.78 40.90 2cpt n ASN 85 CO 0.00 0.00 0.00 0.50 1.40 0.00 0.00 177.26 179.16 2cpt h LYS 86 N 0.00 -0.07 0.00 1.20 3.64 -1.43 -3.46 116.57 116.46 2cpt h LYS 86 Ca -0.30 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 58.84 2cpt h LYS 86 Cb 1.70 0.02 0.14 0.00 -0.41 0.00 0.00 32.23 33.67 2cpt h LYS 86 CO 0.02 0.47 -0.12 0.39 -2.27 0.00 0.00 179.45 177.95 2cpt n GLU 87 N -4.76 -3.46 -0.18 1.90 1.02 -1.20 -4.86 120.64 109.10 2cpt n GLU 87 Ca -0.07 -0.95 -0.11 0.00 -0.02 0.00 0.00 57.16 56.01 2cpt n GLU 87 Cb 0.28 -1.33 -0.07 0.00 -0.02 0.00 0.00 31.44 30.31 2cpt n GLU 87 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2cpt h LYS 88 N 0.00 -0.29 -4.34 3.49 3.11 -1.90 -3.41 116.57 113.23 2cpt h LYS 88 Ca -0.26 0.02 -0.60 0.00 -2.81 0.00 0.00 60.65 57.00 2cpt h LYS 88 Cb 0.87 0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 32.16 2cpt h LYS 88 CO 0.15 -0.19 0.69 1.63 -2.81 0.00 0.00 179.45 178.92 2cpt n LYS 89 N -5.39 0.00 -4.00 1.90 5.02 -1.26 -4.89 118.16 109.55 2cpt n LYS 89 Ca -0.01 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.18 2cpt n LYS 89 Cb 0.34 -1.08 -0.04 0.00 -0.02 0.00 0.00 35.03 34.23 2cpt n LYS 89 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2cpt s ALA 90 N 3.06 -0.06 -0.20 7.82 0.00 -1.26 -4.31 121.76 126.82 2cpt s ALA 90 Ca 0.80 -1.02 0.17 0.00 0.00 0.00 0.00 51.96 51.91 2cpt s ALA 90 Cb -1.08 1.04 0.06 0.00 0.00 0.00 0.00 23.12 23.14 2cpt s ALA 90 CO 0.55 -0.86 1.34 1.96 0.00 0.00 0.00 175.76 178.74 2cpt h GLN 91 N 2.18 0.00 -5.34 0.00 4.20 -1.96 -3.45 115.11 110.75 2cpt h GLN 91 Ca -0.27 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 57.94 2cpt h GLN 91 Cb 1.25 0.00 -0.29 0.00 0.30 0.00 0.00 27.48 28.73 2cpt h GLN 91 CO 0.37 0.36 -0.82 0.21 -0.67 0.00 0.00 178.83 178.28 2cpt s LYS 92 N -3.01 1.23 0.59 1.46 2.20 -1.26 -5.14 119.74 115.81 2cpt s LYS 92 Ca 0.03 -0.53 -0.18 0.00 -0.36 0.00 0.00 55.97 54.94 2cpt s LYS 92 Cb 0.07 -1.18 -0.03 0.00 -1.51 0.00 0.00 37.83 35.18 2cpt s LYS 92 CO 0.75 0.31 1.12 -1.25 -0.36 0.00 0.00 175.35 175.92 2cpt s PRO 93 N -0.30 3.12 -0.12 4.03 0.04 -1.26 -5.06 135.00 135.44 2cpt s PRO 93 Ca 0.05 1.52 -0.06 0.00 0.04 0.00 0.00 61.00 62.55 2cpt s PRO 93 Cb -0.06 -1.98 0.06 0.00 0.04 0.00 0.00 34.50 32.55 2cpt s PRO 93 CO -0.00 -1.02 0.28 0.08 0.04 0.00 0.00 177.00 176.37 2cpt s VAL 94 N -2.02 -0.18 -0.63 -0.36 1.01 -1.26 -5.09 120.40 111.88 2cpt s VAL 94 Ca 0.70 0.18 -0.26 0.00 0.00 0.00 0.00 61.98 62.60 2cpt s VAL 94 Cb -0.22 -0.44 -0.11 0.00 0.00 0.00 0.00 36.38 35.61 2cpt s VAL 94 CO 0.33 0.08 2.45 1.17 0.00 0.00 0.00 175.10 179.13 2cpt n LYS 95 N 4.63 0.78 -3.65 2.72 3.00 -1.26 -4.83 118.16 119.55 2cpt n LYS 95 Ca -0.18 -0.13 -0.08 0.00 -0.00 0.00 0.00 58.31 57.92 2cpt n LYS 95 Cb 0.52 -3.12 -0.02 0.00 0.00 0.00 0.00 35.03 32.42 2cpt n LYS 95 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 2cpt s GLU 96 N 8.46 1.32 0.20 1.64 -1.05 -1.26 -5.15 118.70 122.86 2cpt s GLU 96 Ca 1.04 -0.64 -0.30 0.00 -0.15 0.00 0.00 54.97 54.92 2cpt s GLU 96 Cb -0.35 0.51 -0.08 0.00 -0.44 0.00 0.00 34.13 33.76 2cpt s GLU 96 CO 0.28 -0.59 1.16 0.20 0.95 0.00 0.00 175.26 177.26 2cpt s GLY 97 N -2.80 2.79 0.03 -3.83 0.00 -1.26 -5.04 107.32 97.20 2cpt s GLY 97 Ca 0.08 0.92 0.05 0.00 0.00 0.00 0.00 44.72 45.77 2cpt s GLY 97 CO -0.02 1.75 -0.15 -0.86 0.00 0.00 0.00 173.10 173.81 2cpt s GLN 98 N -0.52 1.08 0.07 2.90 1.03 -1.26 -5.06 119.66 117.89 2cpt s GLN 98 Ca 0.50 -0.72 -0.01 0.00 0.04 0.00 0.00 55.36 55.17 2cpt s GLN 98 Cb -0.32 -1.09 0.02 0.00 0.03 0.00 0.00 33.01 31.64 2cpt s GLN 98 CO 0.38 0.28 0.06 -0.35 -2.54 0.00 0.00 175.29 173.12 2cpt n PRO 99 N 2.11 -1.15 -3.57 9.60 -0.04 -1.26 -5.11 135.00 135.59 2cpt n PRO 99 Ca -0.17 -0.10 -0.16 0.00 -0.04 0.00 0.00 63.50 63.03 2cpt n PRO 99 Cb 0.55 -0.09 -0.06 0.00 -0.04 0.00 0.00 33.50 33.85 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 -1.68 -0.67 1.13 3.54 0.01 -1.26 -5.18 113.70 109.59 2cpt s SER 100 Ca 0.04 0.97 -0.17 0.00 1.31 0.00 0.00 55.95 58.10 2cpt s SER 100 Cb -0.00 0.87 0.25 0.00 0.21 0.00 0.00 66.02 67.35 2cpt s SER 100 CO 0.03 -0.45 1.10 -2.16 0.41 0.00 0.00 173.24 172.17 2cpt s PRO 101 N -0.58 -0.64 -0.89 12.44 0.04 -1.26 -5.00 135.00 139.12 2cpt s PRO 101 Ca -0.06 0.14 -0.02 0.00 0.04 0.00 0.00 61.00 61.11 2cpt s PRO 101 Cb -0.02 -1.65 0.22 0.00 0.04 0.00 0.00 34.50 33.09 2cpt s PRO 101 CO 0.06 -3.37 0.77 0.00 0.04 0.00 0.00 177.00 174.50 2cpt s ALA 102 N -2.99 4.23 0.64 8.56 0.00 -1.26 -5.07 121.76 125.87 2cpt s ALA 102 Ca 0.69 -3.83 -0.18 0.00 0.00 0.00 0.00 51.96 48.64 2cpt s ALA 102 Cb -0.13 -2.82 -0.01 0.00 0.00 0.00 0.00 23.12 20.16 2cpt s ALA 102 CO 0.57 -2.15 1.23 0.16 0.00 0.00 0.00 175.76 175.57 2cpt s ASP 103 N -0.14 4.82 -0.26 0.00 1.47 -1.26 -5.04 116.67 116.26 2cpt s ASP 103 Ca 0.27 2.43 -0.25 0.00 1.18 0.00 0.00 52.55 56.17 2cpt s ASP 103 Cb -0.07 -2.60 0.07 0.00 -0.34 0.00 0.00 42.92 39.98 2cpt s ASP 103 CO -0.12 -1.85 0.74 -1.61 0.68 0.00 0.00 175.17 173.01 2cpt s GLU 104 N -3.50 0.83 0.13 2.11 0.41 -1.26 -5.18 118.70 112.24 2cpt s GLU 104 Ca 0.78 0.94 -0.00 0.00 -0.41 0.00 0.00 54.97 56.27 2cpt s GLU 104 Cb -0.31 0.40 -0.04 0.00 -1.78 0.00 0.00 34.13 32.40 2cpt s GLU 104 CO 0.38 -0.11 0.03 -1.59 -0.49 0.00 0.00 175.26 173.48 2cpt s LYS 105 N 0.29 0.93 0.00 1.61 -2.85 -1.26 -5.14 119.74 113.32 2cpt s LYS 105 Ca -0.00 -1.44 0.00 0.00 -1.00 0.00 0.00 55.97 53.53 2cpt s LYS 105 Cb -0.05 0.11 0.00 0.00 -2.06 0.00 0.00 37.83 35.84 2cpt s LYS 105 CO 0.01 -0.21 0.00 0.41 0.10 0.00 0.00 175.35 175.66 2cpt n GLY 106 N -0.10 0.16 3.29 0.59 0.00 -1.26 -5.18 105.19 102.69 2cpt n GLY 106 Ca -0.07 0.66 -0.24 0.00 0.00 0.00 0.00 46.02 46.37 2cpt n GLY 106 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2cpt s ASN 107 N 0.00 2.56 -0.41 1.61 0.01 -1.26 -5.07 114.94 112.38 2cpt s ASN 107 Ca 0.00 -0.68 -0.43 0.00 -0.71 0.00 0.00 52.86 51.04 2cpt s ASN 107 Cb 0.00 -0.15 -0.18 0.00 0.41 0.00 0.00 41.25 41.34 2cpt s ASN 107 CO 0.00 0.07 1.79 -0.90 -1.51 0.00 0.00 177.10 176.55 2cpt n ASP 108 N 1.12 1.65 -0.23 -1.22 5.75 -1.26 -4.82 116.55 117.54 2cpt n ASP 108 Ca -0.19 1.00 -0.03 0.00 -0.01 0.00 0.00 54.79 55.56 2cpt n ASP 108 Cb 0.53 -1.01 0.08 0.00 -1.03 0.00 0.00 41.12 39.70 2cpt n ASP 108 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 2cpt h SER 109 N 7.05 0.62 -6.81 -1.12 4.64 -2.07 -3.45 113.55 112.41 2cpt h SER 109 Ca -0.38 0.01 -0.56 0.00 -0.47 0.00 0.00 61.79 60.39 2cpt h SER 109 Cb 1.35 -0.11 -0.20 0.00 -0.31 0.00 0.00 62.40 63.13 2cpt h SER 109 CO 0.99 0.42 -0.87 -0.67 -0.87 0.00 0.00 176.83 175.83 2cpt n ASP 110 N -4.74 -1.87 -4.86 4.97 2.03 -1.26 -4.91 116.55 105.92 2cpt n ASP 110 Ca 0.08 -1.08 -0.31 0.00 0.52 0.00 0.00 54.79 53.99 2cpt n ASP 110 Cb 0.13 -2.50 -0.03 0.00 -0.72 0.00 0.00 41.12 38.00 2cpt n ASP 110 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2cpt s GLY 111 N -3.67 1.97 -0.02 0.27 0.00 -1.26 -5.08 107.32 99.53 2cpt s GLY 111 Ca 0.50 0.00 -0.28 0.00 0.00 0.00 0.00 44.72 44.94 2cpt s GLY 111 CO 0.94 0.25 0.85 -0.45 0.00 0.00 0.00 173.10 174.69 2cpt s SER 112 N -3.22 -0.43 0.01 1.64 0.15 -1.26 -5.17 113.70 105.42 2cpt s SER 112 Ca 0.56 0.16 0.00 0.00 0.70 0.00 0.00 55.95 57.36 2cpt s SER 112 Cb -0.10 0.42 -0.04 0.00 -1.71 0.00 0.00 66.02 64.59 2cpt s SER 112 CO 0.34 -0.61 0.09 -0.83 1.20 0.00 0.00 173.24 173.42 2cpt s GLY 113 N -2.11 2.03 0.20 9.45 0.00 -1.26 -5.02 107.32 110.62 2cpt s GLY 113 Ca 0.01 -0.89 -0.04 0.00 0.00 0.00 0.00 44.72 43.81 2cpt s GLY 113 CO -0.05 -0.79 1.56 -0.56 0.00 0.00 0.00 173.10 173.25 2cpt h PRO 114 N 3.89 0.64 -3.75 2.90 0.13 -2.06 -3.47 132.00 130.27 2cpt h PRO 114 Ca -0.48 -0.34 -0.23 0.00 -0.87 0.00 0.00 66.00 64.07 2cpt h PRO 114 Cb 1.18 0.01 0.08 0.00 0.13 0.00 0.00 31.00 32.40 2cpt h PRO 114 CO 0.64 0.94 -0.39 0.45 -0.23 0.00 0.00 178.00 179.41 2cpt n SER 115 N -4.02 -4.55 -4.86 1.44 2.88 -1.26 -5.01 113.62 98.23 2cpt n SER 115 Ca -0.02 -0.30 -0.36 0.00 -1.33 0.00 0.00 58.87 56.85 2cpt n SER 115 Cb 0.54 -3.15 -0.06 0.00 -0.75 0.00 0.00 64.21 60.79 2cpt n SER 115 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2cpt s SER 116 N -3.16 6.64 0.00 -3.46 0.15 -1.26 -5.37 113.70 107.25 2cpt s SER 116 Ca 0.33 0.77 0.00 0.00 0.70 0.00 0.00 55.95 57.75 2cpt s SER 116 Cb -0.15 -2.17 0.00 0.00 -1.71 0.00 0.00 66.02 61.99 2cpt s SER 116 CO 0.41 0.28 0.00 0.61 1.20 0.00 0.00 173.24 175.74