#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w9y h ALA 0 N 0.00 1.23 -0.00 4.61 0.00 -1.90 -3.21 119.26 119.99 2w9y h ALA 0 Ca 0.00 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 2w9y h ALA 0 Cb 0.00 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2w9y h ALA 0 CO 0.00 0.38 -0.71 0.52 0.00 0.00 0.00 179.25 179.44 2w9y h MET 1 N 1.08 0.02 -3.75 0.00 2.86 -1.82 -3.48 114.93 109.83 2w9y h MET 1 Ca 0.38 -0.02 -0.29 0.00 -2.06 0.00 0.00 59.70 57.71 2w9y h MET 1 Cb 0.10 0.00 0.06 0.00 0.06 0.00 0.00 31.60 31.83 2w9y h MET 1 CO -0.15 0.72 -0.46 0.43 1.06 0.00 0.00 176.91 178.51 2w9y n SER 2 N -3.71 -4.97 -0.19 1.22 7.64 -1.21 -4.86 113.62 107.52 2w9y n SER 2 Ca -0.01 -0.27 0.17 0.00 1.01 0.00 0.00 58.87 59.77 2w9y n SER 2 Cb 0.69 -3.74 0.51 0.00 -1.01 0.00 0.00 64.21 60.66 2w9y n SER 2 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2w9y h VAL 3 N -1.34 0.75 0.00 0.44 2.07 -1.93 -1.74 116.25 114.50 2w9y h VAL 3 Ca -0.39 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 66.99 2w9y h VAL 3 Cb 1.27 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 2w9y h VAL 3 CO 0.41 0.07 0.00 0.00 0.02 0.00 0.00 177.57 178.07 2w9y h ALA 4 N 1.63 1.00 0.00 1.67 0.00 -2.00 -2.27 119.26 119.29 2w9y h ALA 4 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 2w9y h ALA 4 Cb 0.99 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2w9y h ALA 4 CO -0.14 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 177.98 2w9y n SER 5 N -3.00 0.07 -4.76 0.00 3.41 -0.65 -4.86 113.62 103.83 2w9y n SER 5 Ca -0.01 0.51 -0.35 0.00 -0.26 0.00 0.00 58.87 58.76 2w9y n SER 5 Cb 0.21 -0.53 0.03 0.00 -0.26 0.00 0.00 64.21 63.66 2w9y n SER 5 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2w9y s LEU 6 N -3.13 3.62 0.63 1.04 1.43 -0.86 -4.99 118.68 116.42 2w9y s LEU 6 Ca 0.12 2.22 -0.18 0.00 -1.03 0.00 0.00 54.13 55.26 2w9y s LEU 6 Cb 0.16 -4.58 -0.02 0.00 0.03 0.00 0.00 46.19 41.78 2w9y s LEU 6 CO 0.47 -1.50 1.25 -2.84 0.23 0.00 0.00 176.35 173.96 2w9y s PRO 7 N -3.50 2.71 0.00 1.29 0.02 -1.26 -4.83 135.00 129.42 2w9y s PRO 7 Ca 0.73 1.94 0.00 0.00 0.02 0.00 0.00 61.00 63.70 2w9y s PRO 7 Cb -0.26 -1.88 0.00 0.00 0.02 0.00 0.00 34.50 32.38 2w9y s PRO 7 CO 0.33 -1.44 0.09 -1.91 -0.33 0.00 0.00 177.00 173.74 2w9y n GLU 8 N -1.82 0.07 0.00 5.54 2.13 -1.26 -1.91 120.64 123.39 2w9y n GLU 8 Ca 0.15 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.97 2w9y n GLU 8 Cb 0.49 -1.47 0.00 0.00 0.27 0.00 0.00 31.44 30.73 2w9y n GLU 8 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2w9y n VAL 10 N 1.33 0.00 -0.35 6.31 0.31 -1.26 -1.63 118.33 123.04 2w9y n VAL 10 Ca 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 64.34 64.39 2w9y n VAL 10 Cb 0.03 0.00 0.21 0.00 -0.91 0.00 0.00 33.84 33.18 2w9y n VAL 10 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2w9y h LYS 11 N 0.00 0.95 -1.08 5.55 1.57 -1.70 -2.37 116.57 119.49 2w9y h LYS 11 Ca 0.00 -0.06 0.36 0.00 -1.87 0.00 0.00 60.65 59.08 2w9y h LYS 11 Cb 0.00 -0.21 -0.14 0.00 0.08 0.00 0.00 32.23 31.95 2w9y h LYS 11 CO 0.00 0.63 0.64 -0.91 -0.57 0.00 0.00 179.45 179.24 2w9y h ASN 12 N 0.98 0.42 0.41 0.86 2.35 -1.59 -2.16 115.58 116.84 2w9y h ASN 12 Ca 0.47 0.18 0.00 0.00 -0.55 0.00 0.00 56.30 56.40 2w9y h ASN 12 Cb 0.42 0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.93 2w9y h ASN 12 CO -0.25 -0.18 -0.34 0.49 -1.65 0.00 0.00 177.43 175.50 2w9y n PHE 13 N -4.97 0.00 -2.22 1.19 3.72 -0.89 -1.52 117.46 112.78 2w9y n PHE 13 Ca 0.34 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.31 2w9y n PHE 13 Cb 1.13 -0.21 -0.03 0.00 -0.94 0.00 0.00 39.48 39.44 2w9y n PHE 13 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2w9y s PHE 14 N -2.75 2.73 0.69 1.38 0.40 -0.81 -4.97 117.98 114.64 2w9y s PHE 14 Ca 0.18 0.75 -0.16 0.00 -0.60 0.00 0.00 56.93 57.10 2w9y s PHE 14 Cb 0.19 -3.68 0.01 0.00 0.51 0.00 0.00 43.02 40.05 2w9y s PHE 14 CO 0.60 -2.56 1.24 -2.14 0.70 0.00 0.00 175.22 173.06 2w9y s PRO 15 N 2.76 2.35 0.26 0.24 0.02 -1.26 -4.79 135.00 134.58 2w9y s PRO 15 Ca 0.64 1.88 -0.01 0.00 0.02 0.00 0.00 61.00 63.53 2w9y s PRO 15 Cb -0.30 -1.84 0.52 0.00 0.02 0.00 0.00 34.50 32.89 2w9y s PRO 15 CO 0.25 -1.70 1.77 1.15 -0.33 0.00 0.00 177.00 178.15 2w9y h THR 16 N 0.11 0.76 -0.51 0.99 2.02 -1.94 -2.33 112.91 112.01 2w9y h THR 16 Ca -0.49 -0.23 -0.07 0.00 0.77 0.00 0.00 66.41 66.39 2w9y h THR 16 Cb 1.31 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 2w9y h THR 16 CO 0.51 0.12 0.04 1.05 0.37 0.00 0.00 175.52 177.62 2w9y h GLU 17 N 0.67 0.83 -0.55 6.66 9.09 -1.95 0.25 114.58 129.58 2w9y h GLU 17 Ca 0.46 -0.21 -0.02 0.00 0.05 0.00 0.00 59.36 59.64 2w9y h GLU 17 Cb 0.61 -0.10 -0.02 0.00 -1.65 0.00 0.00 28.75 27.58 2w9y h GLU 17 CO -0.34 0.81 0.26 1.96 0.05 0.00 0.00 179.01 181.75 2w9y h GLN 18 N 0.78 0.79 -0.47 1.06 7.50 -1.78 -0.45 115.11 122.53 2w9y h GLN 18 Ca 0.16 -0.12 -0.14 0.00 0.50 0.00 0.00 58.65 59.05 2w9y h GLN 18 Cb 0.41 -0.14 -0.01 0.00 0.05 0.00 0.00 27.48 27.79 2w9y h GLN 18 CO 0.01 0.65 -0.24 -0.07 -1.50 0.00 0.00 178.83 177.69 2w9y h LEU 19 N 0.74 1.03 -0.64 1.46 3.38 -1.10 -0.88 115.31 119.29 2w9y h LEU 19 Ca 0.19 -0.40 -0.12 0.00 0.09 0.00 0.00 57.88 57.64 2w9y h LEU 19 Cb 0.12 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2w9y h LEU 19 CO -0.02 1.20 -0.25 -0.33 0.09 0.00 0.00 178.44 179.13 2w9y h GLU 20 N 0.85 0.80 -0.27 1.13 5.08 -0.46 -0.49 114.58 121.22 2w9y h GLU 20 Ca 0.11 -0.34 -0.01 0.00 -1.00 0.00 0.00 59.36 58.12 2w9y h GLU 20 Cb 0.82 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 2w9y h GLU 20 CO 0.07 0.96 0.14 0.35 -1.00 0.00 0.00 179.01 179.53 2w9y h PHE 21 N 0.69 0.39 -0.75 4.33 3.57 -0.87 -2.23 116.94 122.05 2w9y h PHE 21 Ca 0.09 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 2w9y h PHE 21 Cb 0.77 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.36 2w9y h PHE 21 CO 0.04 0.34 0.33 0.77 -2.23 0.00 0.00 178.31 177.57 2w9y h SER 22 N 0.32 1.01 -0.20 0.41 0.02 -0.72 -2.00 113.55 112.39 2w9y h SER 22 Ca 0.09 -0.15 -0.00 0.00 -0.84 0.00 0.00 61.79 60.89 2w9y h SER 22 Cb 0.09 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 2w9y h SER 22 CO -0.01 0.88 0.12 0.28 -1.14 0.00 0.00 176.83 176.96 2w9y h SER 23 N 1.07 0.25 1.59 3.07 0.02 -1.00 -2.88 113.55 115.68 2w9y h SER 23 Ca 0.26 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.18 2w9y h SER 23 Cb 0.16 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.64 2w9y h SER 23 CO -0.03 0.20 -0.08 0.77 -1.14 0.00 0.00 176.83 176.56 2w9y h SER 24 N 0.30 0.00 -2.59 3.07 4.64 -0.73 -3.46 113.55 114.78 2w9y h SER 24 Ca 0.08 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.86 2w9y h SER 24 Cb 0.00 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.10 2w9y h SER 24 CO -0.01 0.08 1.08 -0.63 -0.87 0.00 0.00 176.83 176.48 2w9y s ILE 25 N -3.34 3.22 0.80 0.95 -1.09 -1.09 -4.99 121.20 115.66 2w9y s ILE 25 Ca 0.05 0.46 -0.09 0.00 -2.23 0.00 0.00 60.65 58.84 2w9y s ILE 25 Cb 0.07 -3.30 0.12 0.00 -1.58 0.00 0.00 42.46 37.77 2w9y s ILE 25 CO 0.64 -0.02 1.12 0.42 -1.23 0.00 0.00 174.94 175.87 2w9y s THR 26 N 3.52 2.13 0.31 2.92 -4.23 -1.26 -4.32 115.64 114.72 2w9y s THR 26 Ca 0.77 -0.22 0.08 0.00 -1.18 0.00 0.00 61.69 61.14 2w9y s THR 26 Cb -0.38 -2.91 0.05 0.00 1.34 0.00 0.00 72.50 70.60 2w9y s THR 26 CO 0.33 0.00 1.73 0.00 -0.54 0.00 0.00 174.62 176.14 2w9y h ALA 27 N -0.96 1.18 0.00 3.99 0.00 -1.99 -1.93 119.26 119.55 2w9y h ALA 27 Ca -0.43 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.09 2w9y h ALA 27 Cb 1.28 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2w9y h ALA 27 CO 0.50 0.56 -0.18 0.38 0.00 0.00 0.00 179.25 180.51 2w9y h ASP 28 N 0.16 0.00 0.33 0.00 2.03 -2.02 -3.33 116.42 113.59 2w9y h ASP 28 Ca 0.01 -0.02 -0.27 0.00 -0.73 0.00 0.00 57.03 56.03 2w9y h ASP 28 Cb 0.77 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 39.29 2w9y h ASP 28 CO 0.06 0.01 -1.15 -0.33 -1.03 0.00 0.00 179.24 176.80 2w9y h GLU 29 N 0.00 0.46 -0.67 4.15 5.08 -1.74 -3.36 114.58 118.52 2w9y h GLU 29 Ca 0.00 -0.61 0.09 0.00 -1.00 0.00 0.00 59.36 57.84 2w9y h GLU 29 Cb 0.92 0.20 -0.07 0.00 0.50 0.00 0.00 28.75 30.30 2w9y h GLU 29 CO 0.00 1.25 0.31 -0.22 -1.00 0.00 0.00 179.01 179.35 2w9y h LYS 30 N 0.21 0.53 0.00 2.33 3.64 -1.54 -1.04 116.57 120.70 2w9y h LYS 30 Ca -0.14 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.18 2w9y h LYS 30 Cb 1.82 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 33.52 2w9y h LYS 30 CO 0.21 0.35 -0.16 -1.35 -2.27 0.00 0.00 179.45 176.22 2w9y h PRO 31 N 0.54 0.00 -0.26 1.90 0.11 -1.75 -0.14 132.00 132.40 2w9y h PRO 31 Ca 0.33 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.42 2w9y h PRO 31 Cb 0.35 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 2w9y h PRO 31 CO -0.27 0.16 0.11 0.28 -0.21 0.00 0.00 178.00 178.07 2w9y h VAL 32 N 0.00 1.17 -0.54 3.15 2.07 -1.36 -0.61 116.25 120.14 2w9y h VAL 32 Ca -0.00 -0.52 -0.07 0.00 0.82 0.00 0.00 66.70 66.93 2w9y h VAL 32 Cb 0.44 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 2w9y h VAL 32 CO 0.02 0.17 0.08 -0.07 0.02 0.00 0.00 177.57 177.80 2w9y h LEU 33 N 0.28 0.87 0.23 2.57 3.38 -0.92 -2.38 115.31 119.34 2w9y h LEU 33 Ca 0.09 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.80 2w9y h LEU 33 Cb 0.17 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2w9y h LEU 33 CO -0.01 0.91 -0.38 -0.74 0.09 0.00 0.00 178.44 178.32 2w9y h HIS 34 N 0.79 -1.04 -0.86 1.13 2.76 -0.99 0.88 115.15 117.83 2w9y h HIS 34 Ca 0.16 0.02 0.13 0.00 -2.20 0.00 0.00 60.37 58.48 2w9y h HIS 34 Cb 0.42 0.42 -0.09 0.00 1.55 0.00 0.00 27.41 29.72 2w9y h HIS 34 CO 0.03 -0.50 0.47 1.49 -1.30 0.00 0.00 177.93 178.12 2w9y h GLU 35 N -0.68 0.70 0.00 5.26 4.81 -0.95 -1.29 114.58 122.43 2w9y h GLU 35 Ca 0.00 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 59.06 2w9y h GLU 35 Cb 0.66 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 29.90 2w9y h GLU 35 CO -0.15 0.46 -0.51 0.28 -0.73 0.00 0.00 179.01 178.36 2w9y h VAL 36 N 0.72 1.47 0.00 0.32 2.07 -1.09 -3.25 116.25 116.48 2w9y h VAL 36 Ca 0.45 -2.06 -0.08 0.00 0.82 0.00 0.00 66.70 65.82 2w9y h VAL 36 Cb 0.55 2.68 -0.01 0.00 -1.52 0.00 0.00 31.29 32.98 2w9y h VAL 36 CO -0.31 0.59 -0.38 -0.26 0.02 0.00 0.00 177.57 177.22 2w9y h PHE 37 N -0.23 0.00 0.00 1.57 0.04 -0.69 -2.45 116.94 115.17 2w9y h PHE 37 Ca -0.06 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.70 2w9y h PHE 37 Cb 1.24 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.39 2w9y h PHE 37 CO 0.16 0.38 -0.01 0.37 -0.60 0.00 0.00 178.31 178.62 2w9y h GLN 38 N 0.00 0.00 0.00 1.51 4.15 -1.27 -0.13 115.11 119.36 2w9y h GLN 38 Ca -0.00 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.37 2w9y h GLN 38 Cb 0.76 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.45 2w9y h GLN 38 CO 0.05 0.01 -0.24 0.87 -1.93 0.00 0.00 178.83 177.59 2w9y h LYS 39 N 0.00 0.00 0.00 1.69 1.57 -1.51 -3.46 116.57 114.85 2w9y h LYS 39 Ca -0.00 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.53 2w9y h LYS 39 Cb 0.27 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.54 2w9y h LYS 39 CO 0.00 0.24 -0.16 0.72 -0.57 0.00 0.00 179.45 179.68 2w9y n HIS 40 N -3.38 -0.13 -0.07 -1.35 8.25 -0.06 -5.17 115.22 113.31 2w9y n HIS 40 Ca 0.00 -0.98 -0.13 0.00 -0.26 0.00 0.00 57.72 56.36 2w9y n HIS 40 Cb 0.45 -0.15 -0.14 0.00 1.12 0.00 0.00 29.99 31.26 2w9y n HIS 40 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2w9y n SER 41 N -1.43 0.98 0.00 0.41 7.64 -1.26 -4.98 113.62 114.98 2w9y n SER 41 Ca -0.06 0.13 0.00 0.00 1.01 0.00 0.00 58.87 59.95 2w9y n SER 41 Cb 0.26 0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 2w9y n SER 41 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2w9y n GLY 47 N 1.49 -1.47 0.03 0.00 0.00 -1.26 0.36 105.19 104.32 2w9y n GLY 47 Ca 0.00 0.57 0.12 0.00 0.00 0.00 0.00 46.02 46.71 2w9y n GLY 47 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2w9y n GLU 48 N -4.17 0.12 0.19 1.61 2.13 -1.26 -3.47 120.64 115.79 2w9y n GLU 48 Ca 0.01 0.03 0.03 0.00 0.66 0.00 0.00 57.16 57.89 2w9y n GLU 48 Cb 0.11 -1.57 0.38 0.00 0.27 0.00 0.00 31.44 30.62 2w9y n GLU 48 CO 0.00 0.00 0.00 0.52 -0.41 0.00 0.00 177.13 177.24 2w9y h MET 49 N 0.00 0.02 -0.46 5.31 2.86 -0.56 -3.22 114.93 118.88 2w9y h MET 49 Ca 0.00 -0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.67 2w9y h MET 49 Cb 0.60 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.22 2w9y h MET 49 CO 0.00 0.35 0.23 0.82 1.06 0.00 0.00 176.91 179.37 2w9y h ILE 50 N 0.01 0.96 0.17 -1.22 2.04 -1.42 0.62 117.51 118.67 2w9y h ILE 50 Ca -0.00 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.71 2w9y h ILE 50 Cb 0.60 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 2w9y h ILE 50 CO 0.04 0.08 -0.17 0.44 0.00 0.00 0.00 178.15 178.55 2w9y h ASP 51 N 0.46 -0.44 -0.48 1.72 3.32 -1.79 -0.43 116.42 118.79 2w9y h ASP 51 Ca 0.20 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.26 2w9y h ASP 51 Cb 0.11 0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 2w9y h ASP 51 CO -0.14 -0.25 0.17 -0.33 -1.72 0.00 0.00 179.24 176.97 2w9y h GLU 52 N -0.36 0.73 -0.84 3.56 5.08 -1.54 -2.17 114.58 119.04 2w9y h GLU 52 Ca 0.00 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 2w9y h GLU 52 Cb 0.34 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.44 2w9y h GLU 52 CO -0.04 0.67 0.50 0.28 -1.00 0.00 0.00 179.01 179.41 2w9y h VAL 53 N 0.64 1.24 -0.04 3.13 2.07 -0.83 -3.09 116.25 119.37 2w9y h VAL 53 Ca 0.16 -0.53 -0.15 0.00 0.82 0.00 0.00 66.70 67.00 2w9y h VAL 53 Cb 0.23 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 2w9y h VAL 53 CO -0.01 0.25 -0.64 0.77 0.02 0.00 0.00 177.57 177.96 2w9y h SER 54 N 1.15 0.17 -0.25 0.57 4.64 -0.76 -0.22 113.55 118.86 2w9y h SER 54 Ca 0.30 -0.10 -0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2w9y h SER 54 Cb -0.03 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.00 2w9y h SER 54 CO -0.05 0.76 0.16 0.50 -0.87 0.00 0.00 176.83 177.33 2w9y h LYS 55 N 0.10 0.34 0.00 4.77 3.11 -1.32 -2.71 116.57 120.86 2w9y h LYS 55 Ca -0.01 -0.02 -0.26 0.00 -2.81 0.00 0.00 60.65 57.55 2w9y h LYS 55 Cb 1.15 -0.08 -0.04 0.00 -1.00 0.00 0.00 32.23 32.27 2w9y h LYS 55 CO 0.09 0.24 -1.56 0.87 -2.81 0.00 0.00 179.45 176.28 2w9y h LYS 56 N 0.35 0.00 -0.95 1.90 1.57 -1.25 -3.45 116.57 114.75 2w9y h LYS 56 Ca 0.09 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 2w9y h LYS 56 Cb -0.02 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 32.10 2w9y h LYS 56 CO -0.02 0.52 -0.40 -1.58 -0.57 0.00 0.00 179.45 177.40 2w9y s HIS 57 N -2.67 -1.69 0.19 -1.35 5.04 -0.19 -5.06 115.29 109.57 2w9y s HIS 57 Ca -0.04 0.52 -0.12 0.00 -1.54 0.00 0.00 55.06 53.89 2w9y s HIS 57 Cb 0.08 0.30 0.20 0.00 0.04 0.00 0.00 32.58 33.20 2w9y s HIS 57 CO 0.82 -1.09 1.75 -1.35 -2.34 0.00 0.00 174.74 172.54 2w9y h PRO 58 N 7.26 0.39 -0.47 2.88 0.11 -1.72 -1.33 132.00 139.12 2w9y h PRO 58 Ca 0.02 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 65.97 2w9y h PRO 58 Cb 1.19 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 2w9y h PRO 58 CO 0.10 0.26 -0.24 0.93 -0.21 0.00 0.00 178.00 178.84 2w9y h GLU 59 N 0.40 0.98 -0.57 1.05 4.39 -1.94 0.10 114.58 118.99 2w9y h GLU 59 Ca 0.26 -0.43 0.03 0.00 0.34 0.00 0.00 59.36 59.56 2w9y h GLU 59 Cb 0.27 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.85 2w9y h GLU 59 CO -0.25 1.10 0.33 1.25 -1.16 0.00 0.00 179.01 180.29 2w9y h LEU 60 N 0.84 0.52 -0.89 1.33 5.85 -1.84 -2.06 115.31 119.05 2w9y h LEU 60 Ca 0.10 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.76 2w9y h LEU 60 Cb 0.82 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 2w9y h LEU 60 CO 0.07 0.36 0.02 1.23 -0.34 0.00 0.00 178.44 179.77 2w9y h GLY 61 N 0.64 0.90 0.75 3.75 0.00 -0.60 -0.77 103.07 107.75 2w9y h GLY 61 Ca 0.24 -0.60 0.03 0.00 0.00 0.00 0.00 47.33 47.00 2w9y h GLY 61 CO -0.12 0.56 0.04 1.70 0.00 0.00 0.00 176.54 178.71 2w9y h LYS 62 N 0.78 0.12 -0.85 4.80 3.64 -0.86 -0.18 116.57 124.02 2w9y h LYS 62 Ca 0.15 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.49 2w9y h LYS 62 Cb 0.45 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.20 2w9y h LYS 62 CO 0.02 0.08 0.41 0.00 -2.27 0.00 0.00 179.45 177.68 2w9y h ARG 63 N 0.13 1.22 -0.28 1.90 3.08 -1.00 -1.42 114.38 118.01 2w9y h ARG 63 Ca 0.10 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 2w9y h ARG 63 Cb 0.09 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 2w9y h ARG 63 CO -0.13 0.94 0.13 1.25 -1.07 0.00 0.00 179.97 181.09 2w9y h LEU 64 N 1.21 0.38 -1.44 3.04 5.85 -0.94 -2.39 115.31 121.02 2w9y h LEU 64 Ca 0.29 -0.13 0.11 0.00 0.84 0.00 0.00 57.88 58.99 2w9y h LEU 64 Cb 0.12 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 2w9y h LEU 64 CO -0.04 0.40 0.50 0.00 -0.34 0.00 0.00 178.44 178.97 2w9y h ALA 65 N 0.99 1.88 -0.29 1.25 0.00 -0.76 -1.55 119.26 120.79 2w9y h ALA 65 Ca 0.10 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 2w9y h ALA 65 Cb 0.13 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2w9y h ALA 65 CO -0.01 -0.06 -0.17 1.15 0.00 0.00 0.00 179.25 180.16 2w9y h THR 66 N 0.60 1.25 -0.17 0.00 2.02 -0.84 -0.97 112.91 114.80 2w9y h THR 66 Ca 0.36 -1.13 -0.01 0.00 0.77 0.00 0.00 66.41 66.40 2w9y h THR 66 Cb 0.57 1.21 -0.01 0.00 -1.74 0.00 0.00 68.15 68.19 2w9y h THR 66 CO -0.13 0.37 0.06 0.58 0.37 0.00 0.00 175.52 176.77 2w9y h VAL 67 N 0.47 1.16 -0.41 3.16 2.07 -0.81 -1.37 116.25 120.53 2w9y h VAL 67 Ca 0.08 -0.50 -0.08 0.00 0.82 0.00 0.00 66.70 67.02 2w9y h VAL 67 Cb 0.57 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 2w9y h VAL 67 CO 0.04 0.16 -0.08 -0.07 0.02 0.00 0.00 177.57 177.63 2w9y h LEU 68 N 0.11 0.69 -0.76 2.57 4.07 -1.17 -1.23 115.31 119.58 2w9y h LEU 68 Ca 0.05 -0.19 0.02 0.00 0.08 0.00 0.00 57.88 57.85 2w9y h LEU 68 Cb 0.19 -0.18 -0.04 0.00 1.08 0.00 0.00 40.66 41.70 2w9y h LEU 68 CO -0.00 0.81 0.49 -0.08 -1.08 0.00 0.00 178.44 178.58 2w9y h GLU 69 N 0.65 0.95 -0.61 1.13 4.57 -1.05 -2.79 114.58 117.43 2w9y h GLU 69 Ca 0.12 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 58.20 2w9y h GLU 69 Cb 0.52 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 2w9y h GLU 69 CO 0.03 0.63 0.25 0.78 -1.18 0.00 0.00 179.01 179.52 2w9y h GLY 70 N 0.98 0.98 1.97 1.92 0.00 -0.39 -2.70 103.07 105.84 2w9y h GLY 70 Ca 0.29 -0.54 -0.04 0.00 0.00 0.00 0.00 47.33 47.05 2w9y h GLY 70 CO -0.09 0.50 -0.19 3.43 0.00 0.00 0.00 176.54 180.20 2w9y h ASN 71 N 0.86 0.03 -0.69 0.19 -0.26 -1.00 -3.07 115.58 111.64 2w9y h ASN 71 Ca 0.20 -0.01 -0.03 0.00 -0.56 0.00 0.00 56.30 55.91 2w9y h ASN 71 Cb 0.20 -0.01 -0.03 0.00 -1.06 0.00 0.00 38.32 37.42 2w9y h ASN 71 CO -0.02 0.22 0.30 0.11 -1.06 0.00 0.00 177.43 176.98 2w9y h LYS 72 N 0.03 1.01 -0.24 0.81 1.57 -1.25 -1.72 116.57 116.78 2w9y h LYS 72 Ca 0.01 -0.17 0.04 0.00 -1.87 0.00 0.00 60.65 58.66 2w9y h LYS 72 Cb 0.35 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2w9y h LYS 72 CO 0.03 0.82 0.17 -0.22 -0.57 0.00 0.00 179.45 179.68 2w9y h LYS 73 N 0.97 0.13 0.00 3.15 3.64 -1.63 -0.93 116.57 121.90 2w9y h LYS 73 Ca 0.23 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 2w9y h LYS 73 Cb 0.17 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2w9y h LYS 73 CO -0.02 0.09 0.00 0.00 -2.27 0.00 0.00 179.45 177.24 2w9y h ARG 74 N 0.14 0.00 0.00 1.90 3.08 -1.44 -2.25 114.38 115.80 2w9y h ARG 74 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 2w9y h ARG 74 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2w9y h ARG 74 CO -0.01 0.00 -0.51 1.28 -1.07 0.00 0.00 179.97 179.65 2w9y n LEU 75 N -2.93 0.55 -4.73 3.04 4.77 -0.35 -4.88 117.00 112.46 2w9y n LEU 75 Ca 0.01 0.14 -0.42 0.00 -0.03 0.00 0.00 56.01 55.71 2w9y n LEU 75 Cb 0.27 -0.24 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 2w9y n LEU 75 CO 0.25 0.03 1.30 0.47 -1.33 0.00 0.00 177.39 178.12 2w9y n ASP 76 N -1.77 3.87 0.00 -1.43 8.00 -0.85 -2.86 116.55 121.51 2w9y n ASP 76 Ca 0.05 1.10 0.00 0.00 0.71 0.00 0.00 54.79 56.65 2w9y n ASP 76 Cb 0.38 -1.57 0.00 0.00 -0.02 0.00 0.00 41.12 39.91 2w9y n ASP 76 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2w9y n GLY 77 N 3.10 2.04 3.78 0.44 0.00 -1.26 -5.01 105.19 108.28 2w9y n GLY 77 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 2w9y n GLY 77 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w9y s LEU 78 N 0.00 3.70 0.83 0.99 1.43 -1.14 -5.05 118.68 119.45 2w9y s LEU 78 Ca 0.00 2.12 -0.11 0.00 -1.03 0.00 0.00 54.13 55.11 2w9y s LEU 78 Cb 0.00 -4.57 0.09 0.00 0.03 0.00 0.00 46.19 41.74 2w9y s LEU 78 CO 0.00 -1.23 1.09 -0.94 0.23 0.00 0.00 176.35 175.50 2w9y s SER 79 N -1.92 4.11 0.30 2.29 1.04 -1.26 -4.76 113.70 113.51 2w9y s SER 79 Ca 0.71 1.48 0.02 0.00 0.48 0.00 0.00 55.95 58.64 2w9y s SER 79 Cb -0.23 -2.19 0.59 0.00 0.10 0.00 0.00 66.02 64.29 2w9y s SER 79 CO 0.28 -2.24 1.87 -0.65 0.98 0.00 0.00 173.24 173.49 2w9y h PRO 80 N -1.27 0.94 -0.27 4.02 0.11 -1.99 -0.21 132.00 133.34 2w9y h PRO 80 Ca -0.47 -0.06 -0.15 0.00 0.11 0.00 0.00 66.00 65.43 2w9y h PRO 80 Cb 1.27 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 2w9y h PRO 80 CO 0.56 0.62 -0.41 0.00 -0.21 0.00 0.00 178.00 178.55 2w9y h ALA 81 N 1.53 0.41 -0.28 -0.75 0.00 -2.00 -1.04 119.26 117.14 2w9y h ALA 81 Ca 0.45 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 2w9y h ALA 81 Cb 0.41 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2w9y h ALA 81 CO -0.21 0.52 -0.37 0.00 0.00 0.00 0.00 179.25 179.20 2w9y h ALA 82 N 0.67 0.82 -0.32 0.00 0.00 -1.75 -1.69 119.26 116.99 2w9y h ALA 82 Ca 0.02 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 2w9y h ALA 82 Cb 1.01 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2w9y h ALA 82 CO 0.10 0.64 0.05 0.28 0.00 0.00 0.00 179.25 180.32 2w9y h VAL 83 N 0.54 1.24 -0.72 0.00 2.07 -0.99 0.38 116.25 118.76 2w9y h VAL 83 Ca 0.05 -0.83 0.11 0.00 0.82 0.00 0.00 66.70 66.85 2w9y h VAL 83 Cb 0.88 1.16 -0.08 0.00 -1.52 0.00 0.00 31.29 31.73 2w9y h VAL 83 CO 0.08 0.27 0.33 -0.08 0.02 0.00 0.00 177.57 178.19 2w9y h GLU 84 N 0.36 0.51 0.05 1.57 4.81 -1.04 -1.27 114.58 119.56 2w9y h GLU 84 Ca 0.10 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2w9y h GLU 84 Cb 0.36 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.62 2w9y h GLU 84 CO 0.01 0.34 -0.02 -0.92 -0.73 0.00 0.00 179.01 177.68 2w9y h TYR 85 N 0.53 -0.06 -0.92 0.92 3.20 -1.11 -2.65 116.97 116.89 2w9y h TYR 85 Ca 0.37 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.26 2w9y h TYR 85 Cb 0.47 0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.71 2w9y h TYR 85 CO -0.13 0.09 0.61 0.00 -1.64 0.00 0.00 178.16 177.08 2w9y h ALA 86 N 0.76 1.37 -0.48 1.82 0.00 -0.50 -0.60 119.26 121.64 2w9y h ALA 86 Ca -0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2w9y h ALA 86 Cb 0.17 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2w9y h ALA 86 CO 0.01 0.56 0.12 0.87 0.00 0.00 0.00 179.25 180.81 2w9y h LYS 87 N 1.21 0.72 -0.49 0.00 1.57 -1.26 -0.42 116.57 117.91 2w9y h LYS 87 Ca 0.35 -0.14 -0.10 0.00 -1.87 0.00 0.00 60.65 58.90 2w9y h LYS 87 Cb -0.08 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.09 2w9y h LYS 87 CO -0.09 0.66 -0.08 0.87 -0.57 0.00 0.00 179.45 180.24 2w9y h LYS 88 N 0.70 0.87 -0.22 3.15 1.57 -1.01 -0.92 116.57 120.72 2w9y h LYS 88 Ca 0.16 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 2w9y h LYS 88 Cb 0.26 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2w9y h LYS 88 CO -0.00 0.92 0.08 1.25 -0.57 0.00 0.00 179.45 181.13 2w9y h LEU 89 N 0.79 0.32 -0.70 2.94 6.46 -0.58 -1.43 115.31 123.10 2w9y h LEU 89 Ca 0.13 -0.18 -0.12 0.00 -0.12 0.00 0.00 57.88 57.59 2w9y h LEU 89 Cb 0.59 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.42 2w9y h LEU 89 CO 0.04 0.41 -0.29 0.40 -0.62 0.00 0.00 178.44 178.38 2w9y h ILE 90 N 0.20 1.28 -0.78 4.05 1.08 -1.01 -1.21 117.51 121.12 2w9y h ILE 90 Ca 0.07 -1.41 0.06 0.00 -0.39 0.00 0.00 64.86 63.19 2w9y h ILE 90 Cb 0.20 1.34 -0.06 0.00 -3.07 0.00 0.00 36.82 35.23 2w9y h ILE 90 CO -0.00 0.46 0.47 -0.74 -0.69 0.00 0.00 178.15 177.65 2w9y h HIS 91 N 0.59 0.88 0.04 1.37 2.76 -1.03 0.18 115.15 119.93 2w9y h HIS 91 Ca 0.07 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.27 2w9y h HIS 91 Cb 0.79 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 29.47 2w9y h HIS 91 CO 0.04 0.45 -0.02 1.98 -1.30 0.00 0.00 177.93 179.08 2w9y h MET 92 N 0.87 -0.05 -0.93 5.26 1.85 -0.30 -1.61 114.93 120.02 2w9y h MET 92 Ca 0.34 0.00 0.01 0.00 -0.61 0.00 0.00 59.70 59.45 2w9y h MET 92 Cb 0.15 0.01 -0.05 0.00 0.43 0.00 0.00 31.60 32.14 2w9y h MET 92 CO -0.17 -0.01 0.62 0.28 -0.40 0.00 0.00 176.91 177.23 2w9y h VAL 93 N -0.07 1.23 -0.07 -5.77 2.07 -0.85 -1.23 116.25 111.56 2w9y h VAL 93 Ca -0.01 -0.43 -0.21 0.00 0.82 0.00 0.00 66.70 66.88 2w9y h VAL 93 Cb 0.06 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 29.70 2w9y h VAL 93 CO 0.01 0.23 -0.81 0.71 0.02 0.00 0.00 177.57 177.73 2w9y h THR 94 N 1.25 1.36 -0.33 2.57 1.35 -0.83 -1.12 112.91 117.16 2w9y h THR 94 Ca 0.35 -2.19 0.00 0.00 -0.55 0.00 0.00 66.41 64.02 2w9y h THR 94 Cb -0.13 2.18 -0.02 0.00 -1.73 0.00 0.00 68.15 68.45 2w9y h THR 94 CO -0.08 0.67 0.22 0.74 -0.25 0.00 0.00 175.52 176.82 2w9y h THR 95 N 0.32 1.09 -0.13 6.82 2.02 -1.14 -1.51 112.91 120.37 2w9y h THR 95 Ca -0.05 -0.16 0.02 0.00 0.77 0.00 0.00 66.41 66.99 2w9y h THR 95 Cb 1.41 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 68.40 2w9y h THR 95 CO 0.15 0.08 0.01 0.74 0.37 0.00 0.00 175.52 176.87 2w9y h THR 96 N 0.45 0.92 -0.49 3.16 2.02 -1.07 -0.28 112.91 117.62 2w9y h THR 96 Ca 0.12 -0.02 -0.06 0.00 0.77 0.00 0.00 66.41 67.22 2w9y h THR 96 Cb -0.05 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 2w9y h THR 96 CO -0.03 0.01 0.05 0.25 0.37 0.00 0.00 175.52 176.17 2w9y h LEU 97 N 0.06 0.75 -0.44 2.58 5.85 -1.13 0.97 115.31 123.95 2w9y h LEU 97 Ca 0.06 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 2w9y h LEU 97 Cb 0.07 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 2w9y h LEU 97 CO -0.10 0.79 0.23 0.00 -0.34 0.00 0.00 178.44 179.03 2w9y h SER 99 N 0.57 0.96 -0.77 0.00 0.02 -0.36 -1.48 113.55 112.51 2w9y h SER 99 Ca 0.15 -0.35 -0.00 0.00 -0.84 0.00 0.00 61.79 60.75 2w9y h SER 99 Cb 0.07 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.31 2w9y h SER 99 CO -0.02 1.08 0.46 0.25 -1.14 0.00 0.00 176.83 177.46 2w9y h LEU 100 N 0.82 0.92 -0.41 5.07 5.85 -0.70 0.00 115.31 126.86 2w9y h LEU 100 Ca 0.13 -0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.70 2w9y h LEU 100 Cb 0.64 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 2w9y h LEU 100 CO 0.04 0.71 -0.08 0.74 -0.34 0.00 0.00 178.44 179.52 2w9y h THR 101 N 1.05 1.27 -0.01 1.05 2.02 -0.59 -3.16 112.91 114.54 2w9y h THR 101 Ca 0.27 -1.16 0.00 0.00 0.77 0.00 0.00 66.41 66.29 2w9y h THR 101 Cb -0.04 1.18 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 2w9y h THR 101 CO -0.05 0.39 -0.06 1.33 0.37 0.00 0.00 175.52 177.50 2w9y n VAL 102 N -4.34 0.00 -2.34 3.16 0.24 -0.61 -4.68 118.33 109.75 2w9y n VAL 102 Ca -0.01 -0.24 -0.07 0.00 -2.04 0.00 0.00 64.34 61.99 2w9y n VAL 102 Cb 0.35 0.55 0.01 0.00 -1.47 0.00 0.00 33.84 33.28 2w9y n VAL 102 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2w9y n GLY 103 N 1.23 0.23 3.90 7.63 0.00 -0.16 -5.06 105.19 112.96 2w9y n GLY 103 Ca 0.17 -0.55 -0.29 0.00 0.00 0.00 0.00 46.02 45.35 2w9y n GLY 103 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w9y s LYS 104 N -4.66 3.64 0.71 1.61 -0.14 -0.36 -5.04 119.74 115.50 2w9y s LYS 104 Ca 0.06 -0.01 -0.13 0.00 -1.36 0.00 0.00 55.97 54.52 2w9y s LYS 104 Cb -0.02 -2.69 0.03 0.00 -1.68 0.00 0.00 37.83 33.46 2w9y s LYS 104 CO 0.07 0.27 1.10 -2.14 -0.76 0.00 0.00 175.35 173.90 2w9y s PRO 105 N -3.35 2.55 -0.20 -1.68 0.02 -1.26 -4.45 135.00 126.63 2w9y s PRO 105 Ca 0.43 1.30 -0.05 0.00 0.02 0.00 0.00 61.00 62.70 2w9y s PRO 105 Cb -0.11 -1.92 -0.03 0.00 0.02 0.00 0.00 34.50 32.46 2w9y s PRO 105 CO 0.28 -1.43 0.01 0.42 -0.33 0.00 0.00 177.00 175.94 2w9y s ILE 106 N -2.59 4.04 -0.29 2.83 -1.09 -1.26 -4.99 121.20 117.86 2w9y s ILE 106 Ca 0.64 -0.29 -0.06 0.00 -2.23 0.00 0.00 60.65 58.72 2w9y s ILE 106 Cb -0.19 -2.82 0.01 0.00 -1.58 0.00 0.00 42.46 37.88 2w9y s ILE 106 CO 0.48 0.43 0.05 -0.62 -1.23 0.00 0.00 174.94 174.05 2w9y s ASP 107 N 0.93 4.98 0.00 3.58 2.15 -1.26 -4.97 116.67 122.08 2w9y s ASP 107 Ca 0.01 -0.75 0.09 0.00 0.43 0.00 0.00 52.55 52.33 2w9y s ASP 107 Cb -0.14 -1.84 0.29 0.00 -0.30 0.00 0.00 42.92 40.93 2w9y s ASP 107 CO 0.02 -0.18 1.23 -0.90 -0.17 0.00 0.00 175.17 175.16 2w9y n ASP 108 N 4.83 1.17 -0.35 -0.34 5.68 -1.26 -3.91 116.55 122.37 2w9y n ASP 108 Ca -0.15 -1.94 -0.02 0.00 -0.50 0.00 0.00 54.79 52.18 2w9y n ASP 108 Cb 0.48 -0.14 0.11 0.00 -1.14 0.00 0.00 41.12 40.43 2w9y n ASP 108 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2w9y h ALA 109 N 3.47 1.22 -0.49 2.12 0.00 -1.99 -1.95 119.26 121.64 2w9y h ALA 109 Ca 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2w9y h ALA 109 Cb 0.30 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2w9y h ALA 109 CO 0.00 0.53 0.16 -0.44 0.00 0.00 0.00 179.25 179.50 2w9y h ASP 110 N 1.22 0.65 -0.53 0.00 3.32 -2.00 -0.70 116.42 118.38 2w9y h ASP 110 Ca 0.36 -0.09 -0.12 0.00 0.02 0.00 0.00 57.03 57.20 2w9y h ASP 110 Cb -0.06 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 2w9y h ASP 110 CO -0.10 0.62 -0.14 0.00 -1.72 0.00 0.00 179.24 177.90 2w9y h ALA 111 N 1.48 0.73 -0.66 3.45 0.00 -1.71 -1.32 119.26 121.23 2w9y h ALA 111 Ca 0.17 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 2w9y h ALA 111 Cb 0.19 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2w9y h ALA 111 CO -0.01 0.67 0.19 0.87 0.00 0.00 0.00 179.25 180.97 2w9y h LYS 112 N 0.90 1.01 -0.42 0.00 1.79 -0.74 -1.64 116.57 117.46 2w9y h LYS 112 Ca 0.13 -0.21 -0.03 0.00 -2.18 0.00 0.00 60.65 58.37 2w9y h LYS 112 Cb 0.71 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 31.20 2w9y h LYS 112 CO 0.05 0.87 0.16 0.00 -1.08 0.00 0.00 179.45 179.46 2w9y h ARG 113 N 0.97 0.63 -0.79 3.15 2.47 -0.92 -1.96 114.38 117.94 2w9y h ARG 113 Ca 0.21 -0.12 0.08 0.00 -1.26 0.00 0.00 59.98 58.89 2w9y h ARG 113 Cb 0.29 -0.10 -0.07 0.00 -1.65 0.00 0.00 29.97 28.45 2w9y h ARG 113 CO -0.01 0.60 0.46 -0.07 0.56 0.00 0.00 179.97 181.51 2w9y h LEU 114 N 0.54 0.68 -0.35 3.04 3.38 -0.87 -0.42 115.31 121.31 2w9y h LEU 114 Ca 0.14 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 2w9y h LEU 114 Cb 0.21 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2w9y h LEU 114 CO -0.01 0.41 0.13 -0.74 0.09 0.00 0.00 178.44 178.32 2w9y h HIS 115 N 0.81 0.55 -0.80 1.13 2.76 -1.15 -1.73 115.15 116.72 2w9y h HIS 115 Ca 0.37 -0.05 0.02 0.00 -2.20 0.00 0.00 60.37 58.51 2w9y h HIS 115 Cb 0.27 -0.16 -0.04 0.00 1.55 0.00 0.00 27.41 29.03 2w9y h HIS 115 CO -0.06 0.52 0.52 0.37 -1.30 0.00 0.00 177.93 177.98 2w9y h GLN 116 N 0.42 1.01 -0.04 5.26 -0.00 -0.91 -2.80 115.11 118.04 2w9y h GLN 116 Ca 0.12 -0.06 -0.12 0.00 -0.00 0.00 0.00 58.65 58.58 2w9y h GLN 116 Cb 0.21 -0.23 -0.01 0.00 0.00 0.00 0.00 27.48 27.45 2w9y h GLN 116 CO -0.01 0.67 -0.54 0.93 0.00 0.00 0.00 178.83 179.88 2w9y h GLU 117 N 1.04 0.11 -0.60 1.69 4.39 -0.98 -2.30 114.58 117.92 2w9y h GLU 117 Ca 0.30 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.88 2w9y h GLU 117 Cb -0.06 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.57 2w9y h GLU 117 CO -0.09 0.63 0.14 0.35 -1.16 0.00 0.00 179.01 178.88 2w9y h PHE 118 N 0.09 0.96 0.00 4.33 3.57 -1.06 -2.18 116.94 122.65 2w9y h PHE 118 Ca -0.00 -0.10 -0.03 0.00 3.53 0.00 0.00 57.97 61.36 2w9y h PHE 118 Cb 0.99 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.45 2w9y h PHE 118 CO 0.01 0.80 -0.17 1.96 -2.23 0.00 0.00 178.31 178.68 2w9y h GLN 119 N 0.89 0.00 -0.38 1.11 1.08 -1.19 -2.42 115.11 114.20 2w9y h GLN 119 Ca 0.19 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.39 2w9y h GLN 119 Cb 0.32 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.75 2w9y h GLN 119 CO -0.00 0.17 0.00 -1.13 -0.95 0.00 0.00 178.83 176.92 2w9y n SER 120 N -3.78 2.94 -4.84 1.46 3.41 -0.83 -4.93 113.62 107.04 2w9y n SER 120 Ca -0.02 -1.93 -0.31 0.00 -0.26 0.00 0.00 58.87 56.35 2w9y n SER 120 Cb 0.27 -0.24 0.02 0.00 -0.26 0.00 0.00 64.21 64.00 2w9y n SER 120 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2w9y s LEU 121 N -1.40 3.26 0.77 1.04 1.43 -0.91 -5.03 118.68 117.83 2w9y s LEU 121 Ca 0.37 1.54 -0.13 0.00 -1.03 0.00 0.00 54.13 54.88 2w9y s LEU 121 Cb 0.21 -4.49 0.06 0.00 0.03 0.00 0.00 46.19 42.00 2w9y s LEU 121 CO 0.29 -1.07 1.15 -0.94 0.23 0.00 0.00 176.35 176.02 2w9y s SER 122 N -3.82 4.14 0.35 2.29 1.04 -1.26 -4.77 113.70 111.68 2w9y s SER 122 Ca 0.57 2.15 0.05 0.00 0.48 0.00 0.00 55.95 59.20 2w9y s SER 122 Cb -0.12 -2.56 0.70 0.00 0.10 0.00 0.00 66.02 64.14 2w9y s SER 122 CO 0.51 -2.29 1.96 0.28 0.98 0.00 0.00 173.24 174.68 2w9y h SER 123 N -0.74 0.70 -0.41 7.02 0.02 -1.97 -1.12 113.55 117.04 2w9y h SER 123 Ca -0.46 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.38 2w9y h SER 123 Cb 1.27 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.64 2w9y h SER 123 CO 0.49 0.46 -0.17 -0.08 -1.14 0.00 0.00 176.83 176.39 2w9y h GLU 124 N 0.80 0.90 -0.10 3.45 4.81 -1.99 -1.52 114.58 120.93 2w9y h GLU 124 Ca 0.31 -0.35 -0.14 0.00 -0.13 0.00 0.00 59.36 59.06 2w9y h GLU 124 Cb 0.21 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 2w9y h GLU 124 CO -0.10 1.00 -0.55 -0.44 -0.73 0.00 0.00 179.01 178.18 2w9y h ASP 125 N 0.79 0.33 -0.31 1.04 3.32 -1.77 -1.41 116.42 118.42 2w9y h ASP 125 Ca 0.12 -0.18 -0.12 0.00 0.02 0.00 0.00 57.03 56.87 2w9y h ASP 125 Cb 0.71 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 2w9y h ASP 125 CO 0.05 0.82 -0.27 1.56 -1.72 0.00 0.00 179.24 179.68 2w9y h GLN 126 N 0.23 0.73 -0.45 3.56 4.20 -1.12 -1.49 115.11 120.77 2w9y h GLN 126 Ca 0.00 -0.37 -0.11 0.00 0.06 0.00 0.00 58.65 58.23 2w9y h GLN 126 Cb 1.04 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.81 2w9y h GLN 126 CO 0.09 0.99 -0.16 0.00 -0.67 0.00 0.00 178.83 179.08 2w9y h ALA 127 N 0.73 0.86 -0.38 3.87 0.00 -1.16 -1.66 119.26 121.52 2w9y h ALA 127 Ca 0.05 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 2w9y h ALA 127 Cb 0.84 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2w9y h ALA 127 CO 0.07 0.64 -0.01 0.00 0.00 0.00 0.00 179.25 179.95 2w9y h ALA 128 N 1.05 0.51 -0.56 0.00 0.00 -1.11 -0.38 119.26 118.76 2w9y h ALA 128 Ca 0.12 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.79 2w9y h ALA 128 Cb 0.69 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 2w9y h ALA 128 CO 0.05 0.29 0.34 -0.07 0.00 0.00 0.00 179.25 179.86 2w9y h LEU 129 N 0.49 0.54 -0.95 0.00 3.38 -1.17 -1.06 115.31 116.55 2w9y h LEU 129 Ca 0.11 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 2w9y h LEU 129 Cb 0.48 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2w9y h LEU 129 CO 0.02 0.38 -0.08 0.03 0.09 0.00 0.00 178.44 178.88 2w9y h ARG 130 N 0.66 0.68 -0.40 1.13 3.08 -1.06 -0.37 114.38 118.11 2w9y h ARG 130 Ca 0.23 -0.20 -0.11 0.00 0.07 0.00 0.00 59.98 59.97 2w9y h ARG 130 Cb 0.04 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2w9y h ARG 130 CO -0.11 0.75 -0.16 -0.22 -1.07 0.00 0.00 179.97 179.16 2w9y h LYS 131 N 0.63 0.82 0.00 0.04 3.64 -0.88 -2.28 116.57 118.55 2w9y h LYS 131 Ca 0.12 -0.35 -0.02 0.00 -1.27 0.00 0.00 60.65 59.13 2w9y h LYS 131 Cb 0.51 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.30 2w9y h LYS 131 CO 0.03 0.97 -0.09 -0.91 -2.27 0.00 0.00 179.45 177.18 2w9y h ASN 132 N 0.63 0.00 -2.05 4.20 4.21 -1.01 -3.38 115.58 118.18 2w9y h ASN 132 Ca 0.09 0.00 -0.54 0.00 1.21 0.00 0.00 56.30 57.06 2w9y h ASN 132 Cb 0.71 0.00 -0.40 0.00 -1.12 0.00 0.00 38.32 37.51 2w9y h ASN 132 CO 0.05 0.09 -1.03 0.59 -1.29 0.00 0.00 177.43 175.84 2w9y n ASN 133 N -3.16 1.21 0.06 5.81 3.02 -0.16 -4.73 115.26 117.31 2w9y n ASN 133 Ca 0.02 -2.97 0.10 0.00 -0.03 0.00 0.00 54.58 51.69 2w9y n ASN 133 Cb 0.46 -0.63 0.40 0.00 -0.61 0.00 0.00 39.78 39.40 2w9y n ASN 133 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2w9y n PRO 134 N 0.85 0.09 0.00 3.52 -0.04 -0.88 -2.28 135.00 136.26 2w9y n PRO 134 Ca 0.24 0.32 0.12 0.00 -0.04 0.00 0.00 63.50 64.15 2w9y n PRO 134 Cb 0.54 -1.68 0.27 0.00 -0.04 0.00 0.00 33.50 32.60 2w9y n PRO 134 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2w9y n ASP 135 N -1.85 0.80 -4.87 3.54 5.75 -1.26 -4.89 116.55 113.77 2w9y n ASP 135 Ca 0.03 -0.61 -0.37 0.00 -0.01 0.00 0.00 54.79 53.83 2w9y n ASP 135 Cb 0.21 0.25 -0.06 0.00 -1.03 0.00 0.00 41.12 40.49 2w9y n ASP 135 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2w9y s ILE 136 N -2.77 5.35 -0.61 2.12 1.01 -0.97 -4.91 121.20 120.42 2w9y s ILE 136 Ca 0.17 0.42 -0.17 0.00 0.00 0.00 0.00 60.65 61.06 2w9y s ILE 136 Cb 0.18 -3.50 0.13 0.00 0.01 0.00 0.00 42.46 39.28 2w9y s ILE 136 CO 0.63 0.61 0.64 -0.75 0.00 0.00 0.00 174.94 176.07 2w9y s LYS 137 N -1.04 3.11 0.00 2.79 2.20 -0.57 -5.04 119.74 121.18 2w9y s LYS 137 Ca 0.18 -1.64 0.26 0.00 -0.36 0.00 0.00 55.97 54.40 2w9y s LYS 137 Cb -0.14 -4.33 1.53 0.00 -1.51 0.00 0.00 37.83 33.38 2w9y s LYS 137 CO 0.07 -1.43 1.88 1.19 -0.36 0.00 0.00 175.35 176.70