#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qpp n MET 30 N 0.00 0.61 0.00 2.89 0.00 -1.26 -2.92 117.12 116.45 2qpp n MET 30 Ca 0.00 -0.16 0.13 0.00 0.00 0.00 0.00 57.70 57.67 2qpp n MET 30 Cb 0.00 -1.50 0.43 0.00 0.00 0.00 0.00 33.22 32.15 2qpp n MET 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2qpp n ALA 31 N -1.05 2.98 -2.15 3.17 0.00 -1.26 -4.39 120.51 117.80 2qpp n ALA 31 Ca 0.15 -0.24 -0.42 0.00 0.00 0.00 0.00 53.44 52.93 2qpp n ALA 31 Cb 0.26 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 18.40 2qpp n ALA 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2qpp s ASP 32 N -2.96 6.89 0.29 0.00 1.01 -1.15 -4.91 116.67 115.84 2qpp s ASP 32 Ca 0.14 2.30 0.03 0.00 0.71 0.00 0.00 52.55 55.73 2qpp s ASP 32 Cb 0.18 -2.59 0.68 0.00 1.01 0.00 0.00 42.92 42.20 2qpp s ASP 32 CO 0.61 -0.58 1.74 0.25 0.21 0.00 0.00 175.17 177.41 2qpp h LEU 33 N 6.29 0.56 -1.25 1.23 5.85 -1.89 -0.60 115.31 125.49 2qpp h LEU 33 Ca -0.43 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 2qpp h LEU 33 Cb 1.21 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.24 2qpp h LEU 33 CO 0.82 0.16 0.35 0.77 -0.34 0.00 0.00 178.44 180.20 2qpp h SER 34 N 0.60 0.76 -0.10 1.25 4.64 -1.89 0.11 113.55 118.92 2qpp h SER 34 Ca 0.54 -0.05 -0.06 0.00 -0.47 0.00 0.00 61.79 61.75 2qpp h SER 34 Cb 0.90 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.79 2qpp h SER 34 CO -0.43 0.61 -0.17 -0.33 -0.87 0.00 0.00 176.83 175.65 2qpp h GLU 35 N 0.87 0.30 -0.89 4.77 4.39 -1.45 -2.64 114.58 119.94 2qpp h GLU 35 Ca 0.22 -0.18 0.09 0.00 0.34 0.00 0.00 59.36 59.83 2qpp h GLU 35 Cb 0.01 0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 28.62 2qpp h GLU 35 CO -0.04 0.76 0.57 -0.07 -1.16 0.00 0.00 179.01 179.08 2qpp h LEU 36 N -0.13 0.81 -0.23 1.33 3.38 -0.77 0.11 115.31 119.81 2qpp h LEU 36 Ca 0.01 0.02 -0.21 0.00 0.09 0.00 0.00 57.88 57.79 2qpp h LEU 36 Cb 0.74 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.34 2qpp h LEU 36 CO 0.04 0.49 -0.71 -0.07 0.09 0.00 0.00 178.44 178.28 2qpp h LEU 37 N 0.90 0.91 -0.09 1.67 3.38 -0.84 -0.08 115.31 121.17 2qpp h LEU 37 Ca 0.41 -0.56 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 2qpp h LEU 37 Cb 0.37 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2qpp h LEU 37 CO -0.17 1.36 -0.18 0.50 0.09 0.00 0.00 178.44 180.04 2qpp h LYS 38 N 0.56 0.29 -0.25 1.13 3.64 -1.01 -1.43 116.57 119.49 2qpp h LYS 38 Ca -0.03 -0.18 -0.05 0.00 -1.27 0.00 0.00 60.65 59.11 2qpp h LYS 38 Cb 1.32 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.16 2qpp h LYS 38 CO 0.15 0.77 -0.05 0.93 -2.27 0.00 0.00 179.45 178.98 2qpp h GLU 39 N -0.16 0.48 0.00 1.90 5.08 -1.11 -3.01 114.58 117.77 2qpp h GLU 39 Ca 0.00 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.17 2qpp h GLU 39 Cb 0.76 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 2qpp h GLU 39 CO 0.04 0.70 -0.08 0.78 -1.00 0.00 0.00 179.01 179.45 2qpp h GLY 40 N 0.23 0.00 -0.93 -3.84 0.00 -1.02 -2.96 103.07 94.55 2qpp h GLY 40 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 2qpp h GLY 40 CO 0.02 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.26 2qpp n THR 41 N -3.59 1.68 0.11 4.70 -2.24 -0.54 -4.77 114.28 109.63 2qpp n THR 41 Ca -0.02 -1.60 -0.13 0.00 -2.27 0.00 0.00 64.05 60.03 2qpp n THR 41 Cb 0.20 0.06 -0.06 0.00 -2.10 0.00 0.00 70.33 68.43 2qpp n THR 41 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2qpp h LYS 42 N 1.20 -0.37 -0.72 -0.78 3.64 -1.37 -0.50 116.57 117.66 2qpp h LYS 42 Ca 0.00 0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.46 2qpp h LYS 42 Cb 1.02 0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.87 2qpp h LYS 42 CO 0.08 -0.25 0.42 0.93 -2.27 0.00 0.00 179.45 178.37 2qpp h GLU 43 N -0.39 0.77 -0.86 1.90 3.07 -1.86 -1.24 114.58 115.97 2qpp h GLU 43 Ca 0.02 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 58.81 2qpp h GLU 43 Cb 0.40 -0.17 -0.04 0.00 -0.84 0.00 0.00 28.75 28.10 2qpp h GLU 43 CO -0.10 0.51 0.44 0.00 -1.40 0.00 0.00 179.01 178.46 2qpp h ALA 44 N 1.35 1.16 -0.44 3.43 0.00 -1.83 -1.96 119.26 120.97 2qpp h ALA 44 Ca 0.31 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 2qpp h ALA 44 Cb 0.15 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2qpp h ALA 44 CO -0.16 0.65 -0.20 1.25 0.00 0.00 0.00 179.25 180.79 2qpp h HIS 45 N 1.21 1.04 -0.42 0.00 -0.00 -0.51 -0.90 115.15 115.56 2qpp h HIS 45 Ca 0.30 -0.25 0.06 0.00 -0.00 0.00 0.00 60.37 60.47 2qpp h HIS 45 Cb 0.07 -0.24 -0.05 0.00 -0.00 0.00 0.00 27.41 27.19 2qpp h HIS 45 CO 0.01 1.04 0.13 -0.44 -0.00 0.00 0.00 177.93 178.68 2qpp h ASP 46 N 0.73 0.12 -0.41 3.26 3.32 -1.12 0.78 116.42 123.11 2qpp h ASP 46 Ca 0.10 0.05 0.03 0.00 0.02 0.00 0.00 57.03 57.23 2qpp h ASP 46 Cb 0.76 0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.33 2qpp h ASP 46 CO 0.06 0.10 0.20 0.03 -1.72 0.00 0.00 179.24 177.92 2qpp h ARG 47 N 0.29 0.40 -0.75 3.56 3.08 -1.09 -2.43 114.38 117.43 2qpp h ARG 47 Ca 0.20 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.20 2qpp h ARG 47 Cb 0.20 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 2qpp h ARG 47 CO -0.22 0.27 0.37 0.00 -1.07 0.00 0.00 179.97 179.32 2qpp h ALA 48 N 1.22 0.97 -0.40 0.04 0.00 -0.76 -2.46 119.26 117.86 2qpp h ALA 48 Ca 0.17 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2qpp h ALA 48 Cb 0.08 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2qpp h ALA 48 CO -0.12 0.53 0.27 0.93 0.00 0.00 0.00 179.25 180.85 2qpp h GLU 49 N 1.06 0.48 -0.37 0.00 5.08 -0.54 -3.23 114.58 117.06 2qpp h GLU 49 Ca 0.26 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 2qpp h GLU 49 Cb 0.11 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2qpp h GLU 49 CO -0.03 0.32 0.00 0.09 -1.00 0.00 0.00 179.01 178.38 2qpp n ASN 50 N -4.48 3.11 -4.80 1.42 3.02 -0.94 -4.61 115.26 107.97 2qpp n ASN 50 Ca 0.03 -2.09 -0.34 0.00 -0.03 0.00 0.00 54.58 52.16 2qpp n ASN 50 Cb 0.10 -0.28 -0.04 0.00 -0.61 0.00 0.00 39.78 38.95 2qpp n ASN 50 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2qpp s THR 51 N -1.16 3.97 0.20 3.41 -1.32 -0.95 -4.89 115.64 114.90 2qpp s THR 51 Ca 0.27 1.21 -0.11 0.00 -1.21 0.00 0.00 61.69 61.86 2qpp s THR 51 Cb 0.15 -3.49 0.13 0.00 -1.51 0.00 0.00 72.50 67.77 2qpp s THR 51 CO 0.17 -0.28 1.83 -0.61 -2.21 0.00 0.00 174.62 173.51 2qpp h GLN 52 N 1.61 0.73 -0.45 7.08 5.75 -1.93 -2.00 115.11 125.90 2qpp h GLN 52 Ca -0.49 -0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 57.94 2qpp h GLN 52 Cb 1.21 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 29.57 2qpp h GLN 52 CO 0.60 0.48 0.21 0.35 -2.65 0.00 0.00 178.83 177.81 2qpp h PHE 53 N 0.75 0.66 -0.53 3.99 3.57 -1.93 -0.42 116.94 123.02 2qpp h PHE 53 Ca 0.27 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.71 2qpp h PHE 53 Cb 0.07 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.59 2qpp h PHE 53 CO -0.06 0.54 0.24 0.28 -2.23 0.00 0.00 178.31 177.08 2qpp h VAL 54 N 0.58 1.21 -0.75 1.41 2.07 -1.79 0.70 116.25 119.68 2qpp h VAL 54 Ca 0.15 -0.61 -0.05 0.00 0.82 0.00 0.00 66.70 67.02 2qpp h VAL 54 Cb 0.14 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 2qpp h VAL 54 CO -0.02 0.24 0.27 0.11 0.02 0.00 0.00 177.57 178.19 2qpp h LYS 55 N 0.71 1.13 -0.10 1.57 1.57 -1.22 -1.97 116.57 118.25 2qpp h LYS 55 Ca 0.18 -0.21 -0.15 0.00 -1.87 0.00 0.00 60.65 58.59 2qpp h LYS 55 Cb 0.15 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 2qpp h LYS 55 CO -0.02 0.93 -0.60 -0.44 -0.57 0.00 0.00 179.45 178.75 2qpp h ASP 56 N 1.09 0.38 0.43 0.86 3.32 -0.71 -2.52 116.42 119.27 2qpp h ASP 56 Ca 0.25 -0.22 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 2qpp h ASP 56 Cb 0.24 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.69 2qpp h ASP 56 CO -0.02 0.89 -0.21 0.15 -1.72 0.00 0.00 179.24 178.33 2qpp h PHE 57 N 0.25 -0.54 -0.46 4.55 3.57 -0.68 -0.24 116.94 123.39 2qpp h PHE 57 Ca -0.00 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.49 2qpp h PHE 57 Cb 1.11 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 40.01 2qpp h PHE 57 CO 0.03 -0.29 0.31 -0.07 -2.23 0.00 0.00 178.31 176.05 2qpp h LEU 58 N -0.66 0.52 -0.94 0.59 3.38 -1.32 0.19 115.31 117.06 2qpp h LEU 58 Ca -0.06 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2qpp h LEU 58 Cb 0.49 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2qpp h LEU 58 CO 0.10 0.37 0.00 0.11 0.09 0.00 0.00 178.44 179.11 2qpp h LYS 59 N 0.61 0.00 0.00 1.13 1.57 -1.45 -3.47 116.57 114.96 2qpp h LYS 59 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2qpp h LYS 59 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 2qpp h LYS 59 CO -0.04 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.25 2qpp n GLY 60 N 0.13 0.81 0.04 3.86 0.00 0.05 -4.99 105.19 105.09 2qpp n GLY 60 Ca 0.02 -0.45 0.12 0.00 0.00 0.00 0.00 46.02 45.71 2qpp n GLY 60 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2qpp n ASN 61 N 0.84 0.51 -4.71 1.61 3.02 -0.12 -4.85 115.26 111.56 2qpp n ASN 61 Ca 0.00 -0.26 -0.41 0.00 -0.03 0.00 0.00 54.58 53.88 2qpp n ASN 61 Cb 0.03 0.14 -0.04 0.00 -0.61 0.00 0.00 39.78 39.29 2qpp n ASN 61 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2qpp s ILE 62 N -2.91 4.96 0.62 2.41 1.09 -1.24 -4.98 121.20 121.14 2qpp s ILE 62 Ca 0.14 1.68 0.02 0.00 -1.10 0.00 0.00 60.65 61.39 2qpp s ILE 62 Cb 0.18 -4.15 0.08 0.00 -1.06 0.00 0.00 42.46 37.51 2qpp s ILE 62 CO 0.65 0.18 0.86 -0.54 -0.10 0.00 0.00 174.94 175.99 2qpp s LYS 63 N 1.11 2.15 0.13 2.79 1.02 -1.26 -4.86 119.74 120.83 2qpp s LYS 63 Ca 0.42 -1.09 -0.23 0.00 0.02 0.00 0.00 55.97 55.09 2qpp s LYS 63 Cb -0.19 -2.46 -0.01 0.00 -0.52 0.00 0.00 37.83 34.65 2qpp s LYS 63 CO 0.20 -1.02 1.65 -0.22 -0.92 0.00 0.00 175.35 175.04 2qpp h LYS 64 N -0.13 -0.22 -0.31 1.68 3.64 -1.96 -1.10 116.57 118.15 2qpp h LYS 64 Ca -0.37 0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 58.93 2qpp h LYS 64 Cb 1.28 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 33.14 2qpp h LYS 64 CO 0.45 -0.15 -0.18 0.93 -2.27 0.00 0.00 179.45 178.22 2qpp h GLU 65 N -0.23 0.58 -0.00 1.90 4.39 -1.99 -0.71 114.58 118.52 2qpp h GLU 65 Ca 0.10 -0.20 -0.14 0.00 0.34 0.00 0.00 59.36 59.47 2qpp h GLU 65 Cb 0.38 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 2qpp h GLU 65 CO -0.27 0.73 -0.64 1.25 -1.16 0.00 0.00 179.01 178.92 2qpp h LEU 66 N 0.52 0.01 -0.65 1.33 5.85 -1.88 -1.66 115.31 118.83 2qpp h LEU 66 Ca 0.08 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.66 2qpp h LEU 66 Cb 0.61 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 2qpp h LEU 66 CO 0.04 0.65 -0.39 0.15 -0.34 0.00 0.00 178.44 178.56 2qpp h PHE 67 N 0.01 0.74 -0.44 1.25 3.57 -0.77 -1.15 116.94 120.14 2qpp h PHE 67 Ca -0.01 -0.21 -0.06 0.00 3.53 0.00 0.00 57.97 61.23 2qpp h PHE 67 Cb 1.14 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.70 2qpp h PHE 67 CO 0.00 0.91 0.04 0.87 -2.23 0.00 0.00 178.31 177.90 2qpp h LYS 68 N 0.51 0.70 -0.23 1.11 1.57 -0.84 -0.46 116.57 118.93 2qpp h LYS 68 Ca 0.05 -0.16 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 2qpp h LYS 68 Cb 0.90 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.11 2qpp h LYS 68 CO 0.08 0.69 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.54 2qpp h LEU 69 N 0.66 0.42 -0.05 2.94 3.38 -1.17 -2.32 115.31 119.17 2qpp h LEU 69 Ca 0.14 -0.34 0.03 0.00 0.09 0.00 0.00 57.88 57.80 2qpp h LEU 69 Cb 0.36 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 2qpp h LEU 69 CO 0.01 0.67 -0.15 0.00 0.09 0.00 0.00 178.44 179.05 2qpp h ALA 70 N 0.77 -0.14 -1.00 1.53 0.00 -0.94 -1.66 119.26 117.82 2qpp h ALA 70 Ca 0.06 0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.05 2qpp h ALA 70 Cb 0.47 0.29 -0.06 0.00 0.00 0.00 0.00 17.79 18.49 2qpp h ALA 70 CO 0.02 -0.63 0.65 1.15 0.00 0.00 0.00 179.25 180.44 2qpp h THR 71 N -0.23 1.12 -0.57 0.00 2.02 -1.15 -1.80 112.91 112.29 2qpp h THR 71 Ca 0.07 -0.41 0.04 0.00 0.77 0.00 0.00 66.41 66.88 2qpp h THR 71 Cb 0.32 -0.19 -0.04 0.00 -1.74 0.00 0.00 68.15 66.50 2qpp h THR 71 CO -0.19 0.22 0.31 0.74 0.37 0.00 0.00 175.52 176.97 2qpp h THR 72 N 1.20 0.99 -0.39 3.16 2.02 -0.94 0.96 112.91 119.91 2qpp h THR 72 Ca 0.42 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 67.39 2qpp h THR 72 Cb 0.12 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 2qpp h THR 72 CO -0.16 0.11 0.21 0.00 0.37 0.00 0.00 175.52 176.05 2qpp h ALA 73 N 1.29 0.50 -0.31 6.16 0.00 -0.62 -2.67 119.26 123.59 2qpp h ALA 73 Ca 0.24 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.11 2qpp h ALA 73 Cb 0.12 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 2qpp h ALA 73 CO -0.15 0.03 0.08 -0.07 0.00 0.00 0.00 179.25 179.14 2qpp h LEU 74 N 0.49 0.06 -0.19 0.00 4.07 -0.94 -1.72 115.31 117.09 2qpp h LEU 74 Ca 0.14 0.04 0.05 0.00 0.08 0.00 0.00 57.88 58.19 2qpp h LEU 74 Cb 0.07 0.04 -0.05 0.00 1.08 0.00 0.00 40.66 41.80 2qpp h LEU 74 CO -0.02 0.07 -0.15 0.22 -1.08 0.00 0.00 178.44 177.49 2qpp h TYR 75 N 0.21 -0.36 -0.41 1.13 3.20 -0.52 0.14 116.97 120.36 2qpp h TYR 75 Ca 0.14 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.92 2qpp h TYR 75 Cb 0.13 0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 2qpp h TYR 75 CO -0.15 -0.21 -0.22 0.74 -1.64 0.00 0.00 178.16 176.67 2qpp h PHE 76 N -0.15 1.00 0.20 -3.82 0.04 -1.43 -1.18 116.94 111.60 2qpp h PHE 76 Ca 0.11 -0.26 0.00 0.00 2.80 0.00 0.00 57.97 60.63 2qpp h PHE 76 Cb 0.32 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.23 2qpp h PHE 76 CO -0.29 1.04 -0.18 1.15 -0.60 0.00 0.00 178.31 179.42 2qpp h THR 77 N 0.68 0.60 0.00 -1.55 2.02 -0.97 -2.08 112.91 111.60 2qpp h THR 77 Ca 0.09 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.17 2qpp h THR 77 Cb 0.78 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 2qpp h THR 77 CO 0.06 0.00 -0.46 1.88 0.37 0.00 0.00 175.52 177.37 2qpp h TYR 78 N -0.41 0.00 0.27 3.16 -1.99 -0.98 -0.82 116.97 116.21 2qpp h TYR 78 Ca -0.00 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 2qpp h TYR 78 Cb 0.38 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.11 2qpp h TYR 78 CO -0.14 0.46 -0.15 0.77 -0.00 0.00 0.00 178.16 179.10 2qpp h SER 79 N 0.00 -0.37 -0.31 3.88 0.02 -1.08 0.93 113.55 116.61 2qpp h SER 79 Ca -0.00 0.02 0.04 0.00 -0.84 0.00 0.00 61.79 61.00 2qpp h SER 79 Cb 0.85 0.11 -0.04 0.00 0.14 0.00 0.00 62.40 63.46 2qpp h SER 79 CO 0.06 -0.25 0.10 0.00 -1.14 0.00 0.00 176.83 175.60 2qpp h ALA 80 N 0.32 0.35 -0.43 3.77 0.00 -1.16 -0.49 119.26 121.62 2qpp h ALA 80 Ca -0.03 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2qpp h ALA 80 Cb 0.32 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2qpp h ALA 80 CO 0.04 -0.31 0.20 1.25 0.00 0.00 0.00 179.25 180.44 2qpp h LEU 81 N 0.23 0.57 -0.63 0.00 5.85 -1.01 -1.90 115.31 118.41 2qpp h LEU 81 Ca 0.14 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 2qpp h LEU 81 Cb 0.12 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.01 2qpp h LEU 81 CO -0.16 0.54 -0.04 -0.33 -0.34 0.00 0.00 178.44 178.12 2qpp h GLU 82 N 0.55 0.00 -0.15 1.25 5.08 -0.63 -1.14 114.58 119.55 2qpp h GLU 82 Ca 0.15 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.34 2qpp h GLU 82 Cb 0.13 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.39 2qpp h GLU 82 CO -0.02 0.04 -0.55 1.49 -1.00 0.00 0.00 179.01 178.97 2qpp h GLU 83 N 0.00 0.64 0.00 2.33 4.81 -0.83 -2.22 114.58 119.31 2qpp h GLU 83 Ca -0.00 -0.48 -0.14 0.00 -0.13 0.00 0.00 59.36 58.61 2qpp h GLU 83 Cb 0.82 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.26 2qpp h GLU 83 CO 0.00 1.10 -0.67 0.93 -0.73 0.00 0.00 179.01 179.65 2qpp h GLU 84 N 0.30 0.00 -0.01 1.92 4.39 -1.12 -0.98 114.58 119.07 2qpp h GLU 84 Ca -0.03 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.50 2qpp h GLU 84 Cb 1.17 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.81 2qpp h GLU 84 CO 0.12 0.67 -0.79 0.52 -1.16 0.00 0.00 179.01 178.36 2qpp h MET 85 N 0.00 0.17 -0.39 2.33 2.86 -1.29 -1.95 114.93 116.66 2qpp h MET 85 Ca -0.01 -0.16 -0.11 0.00 -2.06 0.00 0.00 59.70 57.36 2qpp h MET 85 Cb 1.19 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.88 2qpp h MET 85 CO 0.09 0.87 -0.19 1.49 1.06 0.00 0.00 176.91 180.23 2qpp h GLU 86 N 0.10 0.74 -0.37 1.72 4.57 -1.21 -1.58 114.58 118.56 2qpp h GLU 86 Ca -0.03 -0.28 -0.16 0.00 -1.18 0.00 0.00 59.36 57.71 2qpp h GLU 86 Cb 1.38 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.93 2qpp h GLU 86 CO 0.12 0.88 -0.41 -0.09 -1.18 0.00 0.00 179.01 178.32 2qpp h ARG 87 N 0.65 0.93 -0.67 1.92 2.43 -1.10 -3.22 114.38 115.32 2qpp h ARG 87 Ca 0.10 -0.50 0.00 0.00 -0.81 0.00 0.00 59.98 58.76 2qpp h ARG 87 Cb 0.69 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.26 2qpp h ARG 87 CO 0.05 1.16 0.00 0.09 -1.51 0.00 0.00 179.97 179.76 2qpp n ASN 88 N -4.05 4.59 0.06 -3.80 3.02 -0.74 -4.61 115.26 109.73 2qpp n ASN 88 Ca -0.03 -2.37 0.21 0.00 -0.03 0.00 0.00 54.58 52.36 2qpp n ASN 88 Cb 0.56 -0.57 0.74 0.00 -0.61 0.00 0.00 39.78 39.90 2qpp n ASN 88 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 2qpp h LYS 89 N 4.09 0.00 -0.02 3.52 2.10 -1.29 0.38 116.57 125.35 2qpp h LYS 89 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2qpp h LYS 89 Cb 1.37 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.70 2qpp h LYS 89 CO 0.20 0.00 -0.35 -0.25 -2.00 0.00 0.00 179.45 177.04 2qpp n ASP 90 N -3.83 2.06 -4.70 7.07 8.00 -1.26 -4.23 116.55 119.66 2qpp n ASP 90 Ca 0.08 -1.53 -0.42 0.00 0.71 0.00 0.00 54.79 53.63 2qpp n ASP 90 Cb 0.64 0.39 -0.03 0.00 -0.02 0.00 0.00 41.12 42.11 2qpp n ASP 90 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2qpp s HIS 91 N -2.20 2.97 0.59 1.24 2.46 0.12 -4.80 115.29 115.67 2qpp s HIS 91 Ca 0.18 0.83 0.29 0.00 0.47 0.00 0.00 55.06 56.83 2qpp s HIS 91 Cb 0.17 -3.69 1.54 0.00 -0.13 0.00 0.00 32.58 30.46 2qpp s HIS 91 CO 0.47 -2.53 1.98 -1.35 -2.47 0.00 0.00 174.74 170.84 2qpp h PRO 92 N 7.48 0.00 -0.04 2.88 0.11 -1.93 0.58 132.00 141.08 2qpp h PRO 92 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2qpp h PRO 92 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2qpp h PRO 92 CO 0.89 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.68 2qpp n ALA 93 N -2.35 2.56 0.00 -0.75 0.00 -1.26 -4.38 120.51 114.33 2qpp n ALA 93 Ca 0.06 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.02 2qpp n ALA 93 Cb 0.53 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.85 2qpp n ALA 93 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2qpp n PHE 94 N 0.28 0.00 -0.33 0.00 7.35 -0.12 -4.82 117.46 119.81 2qpp n PHE 94 Ca 0.18 0.00 0.04 0.00 -0.76 0.00 0.00 57.45 56.91 2qpp n PHE 94 Cb 0.37 0.00 0.10 0.00 0.35 0.00 0.00 39.48 40.30 2qpp n PHE 94 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2qpp n ALA 95 N -0.83 0.13 0.24 3.13 0.00 0.19 -0.17 120.51 123.20 2qpp n ALA 95 Ca 0.00 0.98 0.15 0.00 0.00 0.00 0.00 53.44 54.57 2qpp n ALA 95 Cb 0.10 -0.55 0.83 0.00 0.00 0.00 0.00 19.45 19.82 2qpp n ALA 95 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2qpp h PRO 96 N 0.00 0.00 -0.36 0.00 0.11 -1.87 -1.61 132.00 128.27 2qpp h PRO 96 Ca 0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.52 2qpp h PRO 96 Cb 0.63 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.74 2qpp h PRO 96 CO -0.93 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.14 2qpp n LEU 97 N -2.60 2.92 -4.60 2.35 4.77 0.76 -4.86 117.00 115.74 2qpp n LEU 97 Ca -0.02 -1.29 -0.43 0.00 -0.03 0.00 0.00 56.01 54.24 2qpp n LEU 97 Cb 0.10 -0.24 -0.02 0.00 -2.33 0.00 0.00 43.42 40.93 2qpp n LEU 97 CO 0.13 0.64 1.07 -0.47 -1.33 0.00 0.00 177.39 177.44 2qpp s TYR 98 N -1.53 2.75 -0.46 -1.77 6.04 -0.61 -4.93 117.35 116.84 2qpp s TYR 98 Ca 0.37 0.74 0.08 0.00 0.04 0.00 0.00 57.07 58.30 2qpp s TYR 98 Cb 0.21 -4.36 0.29 0.00 -1.04 0.00 0.00 41.96 37.06 2qpp s TYR 98 CO 0.29 -1.39 0.68 1.19 -1.54 0.00 0.00 175.55 174.78 2qpp n PHE 99 N 7.96 1.16 -0.35 4.97 3.72 -1.26 -4.96 117.46 128.71 2qpp n PHE 99 Ca 0.13 -3.81 0.01 0.00 -0.05 0.00 0.00 57.45 53.73 2qpp n PHE 99 Cb 0.49 -0.43 0.15 0.00 -0.94 0.00 0.00 39.48 38.75 2qpp n PHE 99 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2qpp h PRO 100 N 3.64 1.10 -0.04 -1.08 0.13 -1.97 -0.79 132.00 132.99 2qpp h PRO 100 Ca 0.11 -0.07 -0.22 0.00 -0.87 0.00 0.00 66.00 64.95 2qpp h PRO 100 Cb 0.81 -0.25 0.02 0.00 0.13 0.00 0.00 31.00 31.71 2qpp h PRO 100 CO 0.59 0.73 -0.84 1.98 -0.23 0.00 0.00 178.00 180.23 2qpp h MET 101 N 1.13 0.65 0.20 0.86 4.05 -1.95 -3.18 114.93 116.70 2qpp h MET 101 Ca 0.40 -0.64 -0.29 0.00 -0.28 0.00 0.00 59.70 58.90 2qpp h MET 101 Cb 0.11 0.17 0.03 0.00 -0.80 0.00 0.00 31.60 31.11 2qpp h MET 101 CO -0.16 1.24 -1.29 0.93 0.23 0.00 0.00 176.91 177.87 2qpp h GLU 102 N 0.30 0.43 0.00 0.39 3.07 -1.84 -3.43 114.58 113.49 2qpp h GLU 102 Ca -0.09 -0.73 -0.22 0.00 -0.50 0.00 0.00 59.36 57.82 2qpp h GLU 102 Cb 1.50 0.27 -0.04 0.00 -0.84 0.00 0.00 28.75 29.64 2qpp h GLU 102 CO 0.17 1.35 -1.82 1.28 -1.40 0.00 0.00 179.01 178.58 2qpp n LEU 103 N -3.86 1.89 -4.63 1.33 4.77 -0.31 -4.61 117.00 111.58 2qpp n LEU 103 Ca -0.17 -0.05 -0.47 0.00 -0.03 0.00 0.00 56.01 55.28 2qpp n LEU 103 Cb 0.99 -0.22 -0.04 0.00 -2.33 0.00 0.00 43.42 41.82 2qpp n LEU 103 CO 0.54 0.58 0.96 1.41 -1.33 0.00 0.00 177.39 179.55 2qpp n HIS 104 N -2.75 1.86 0.50 -1.77 8.25 -1.20 -4.91 115.22 115.20 2qpp n HIS 104 Ca -0.23 0.49 0.09 0.00 -0.26 0.00 0.00 57.72 57.81 2qpp n HIS 104 Cb 0.81 -2.41 -0.11 0.00 1.12 0.00 0.00 29.99 29.40 2qpp n HIS 104 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2qpp n ARG 105 N 2.34 0.98 -0.30 -0.41 5.12 -1.26 -4.66 116.66 118.47 2qpp n ARG 105 Ca 0.15 -0.06 0.08 0.00 -1.93 0.00 0.00 57.85 56.08 2qpp n ARG 105 Cb 0.27 -1.36 0.24 0.00 -1.16 0.00 0.00 32.46 30.44 2qpp n ARG 105 CO 0.00 0.00 0.00 -0.22 -1.93 0.00 0.00 177.63 175.48 2qpp h LYS 106 N 0.00 0.60 -0.33 5.56 3.64 -1.91 0.12 116.57 124.24 2qpp h LYS 106 Ca 0.00 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.25 2qpp h LYS 106 Cb 0.57 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 2qpp h LYS 106 CO 0.00 0.39 -0.15 1.49 -2.27 0.00 0.00 179.45 178.92 2qpp h GLU 107 N 0.61 0.69 -0.43 1.90 4.81 -2.00 -0.75 114.58 119.41 2qpp h GLU 107 Ca 0.48 -0.30 -0.01 0.00 -0.13 0.00 0.00 59.36 59.40 2qpp h GLU 107 Cb 0.70 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.04 2qpp h GLU 107 CO -0.38 0.89 0.21 0.00 -0.73 0.00 0.00 179.01 179.01 2qpp h ALA 108 N 0.78 0.56 -0.78 2.92 0.00 -1.58 -2.56 119.26 118.59 2qpp h ALA 108 Ca 0.08 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2qpp h ALA 108 Cb 0.68 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 2qpp h ALA 108 CO 0.05 0.11 0.34 -0.07 0.00 0.00 0.00 179.25 179.68 2qpp h LEU 109 N 0.56 1.05 -0.62 0.00 -0.00 -0.74 -2.12 115.31 113.44 2qpp h LEU 109 Ca 0.15 -0.15 0.01 0.00 -0.00 0.00 0.00 57.88 57.89 2qpp h LEU 109 Cb 0.11 -0.27 -0.03 0.00 -0.00 0.00 0.00 40.66 40.46 2qpp h LEU 109 CO -0.02 0.92 0.41 0.74 -0.00 0.00 0.00 178.44 180.48 2qpp h THR 110 N 1.13 1.14 -0.39 0.22 2.02 -0.93 0.34 112.91 116.44 2qpp h THR 110 Ca 0.27 -0.28 -0.08 0.00 0.77 0.00 0.00 66.41 67.08 2qpp h THR 110 Cb 0.17 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 2qpp h THR 110 CO -0.03 0.15 -0.11 0.11 0.37 0.00 0.00 175.52 176.02 2qpp h LYS 111 N 0.82 0.69 -0.42 6.66 1.57 -1.12 -0.44 116.57 124.33 2qpp h LYS 111 Ca 0.23 -0.22 -0.11 0.00 -1.87 0.00 0.00 60.65 58.68 2qpp h LYS 111 Cb -0.07 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 2qpp h LYS 111 CO -0.06 0.78 -0.18 -0.44 -0.57 0.00 0.00 179.45 178.97 2qpp h ASP 112 N 0.63 0.88 -0.77 0.86 3.32 -0.99 -1.40 116.42 118.96 2qpp h ASP 112 Ca 0.11 -0.40 -0.01 0.00 0.02 0.00 0.00 57.03 56.75 2qpp h ASP 112 Cb 0.55 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.82 2qpp h ASP 112 CO 0.03 1.08 0.44 0.24 -1.72 0.00 0.00 179.24 179.31 2qpp h MET 113 N 0.68 1.06 -0.74 3.56 2.86 -0.60 -2.31 114.93 119.44 2qpp h MET 113 Ca 0.09 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 2qpp h MET 113 Cb 0.74 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 32.16 2qpp h MET 113 CO 0.06 0.77 0.36 0.93 1.06 0.00 0.00 176.91 180.08 2qpp h GLU 114 N 1.05 1.06 -0.64 1.72 5.08 -0.94 -1.30 114.58 120.61 2qpp h GLU 114 Ca 0.27 -0.15 -0.06 0.00 -1.00 0.00 0.00 59.36 58.41 2qpp h GLU 114 Cb 0.00 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.04 2qpp h GLU 114 CO -0.05 0.83 0.16 -0.92 -1.00 0.00 0.00 179.01 178.03 2qpp h TYR 115 N 1.03 1.08 0.16 4.33 3.20 -0.89 -0.61 116.97 125.27 2qpp h TYR 115 Ca 0.25 -0.13 -0.34 0.00 3.14 0.00 0.00 58.73 61.66 2qpp h TYR 115 Cb 0.12 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.09 2qpp h TYR 115 CO 0.01 0.89 -1.70 0.74 -1.64 0.00 0.00 178.16 176.46 2qpp h PHE 116 N 0.95 0.63 0.00 -3.82 0.04 -1.38 -3.40 116.94 109.95 2qpp h PHE 116 Ca 0.20 -0.46 -0.37 0.00 2.80 0.00 0.00 57.97 60.14 2qpp h PHE 116 Cb 0.36 -0.03 -0.07 0.00 2.20 0.00 0.00 35.95 38.41 2qpp h PHE 116 CO 0.03 1.59 -2.39 1.19 -0.60 0.00 0.00 178.31 178.13 2qpp n PHE 117 N -3.54 0.00 0.00 -0.55 3.72 -0.50 -5.12 117.46 111.47 2qpp n PHE 117 Ca -0.22 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.18 2qpp n PHE 117 Cb 1.07 -1.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.61 2qpp n PHE 117 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qpp n GLY 118 N 1.78 -1.29 0.24 1.37 0.00 -0.24 -4.73 105.19 102.32 2qpp n GLY 118 Ca -0.33 -2.18 -0.05 0.00 0.00 0.00 0.00 46.02 43.46 2qpp n GLY 118 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2qpp h GLU 119 N 3.81 0.57 -1.97 1.61 4.39 -1.93 -3.14 114.58 117.93 2qpp h GLU 119 Ca 0.00 -0.23 -0.67 0.00 0.34 0.00 0.00 59.36 58.80 2qpp h GLU 119 Cb 0.00 -0.03 -0.24 0.00 -0.10 0.00 0.00 28.75 28.39 2qpp h GLU 119 CO 0.00 0.78 0.82 0.27 -1.16 0.00 0.00 179.01 179.72 2qpp n ASN 120 N -4.11 7.16 0.16 1.42 0.23 -1.26 -4.66 115.26 114.20 2qpp n ASN 120 Ca -0.00 -3.61 0.03 0.00 -0.53 0.00 0.00 54.58 50.47 2qpp n ASN 120 Cb 0.42 -1.12 0.19 0.00 -2.08 0.00 0.00 39.78 37.19 2qpp n ASN 120 CO 0.00 0.00 0.00 4.11 -0.93 0.00 0.00 177.26 180.44 2qpp h TRP 121 N 2.95 0.00 -0.30 -2.53 5.08 -1.83 -3.25 115.95 116.07 2qpp h TRP 121 Ca 0.51 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 60.48 2qpp h TRP 121 Cb 0.30 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.44 2qpp h TRP 121 CO 1.28 0.48 0.19 0.93 -1.28 0.00 0.00 178.44 180.04 2qpp h GLU 122 N 0.00 0.40 0.00 0.12 5.08 -1.89 -2.38 114.58 115.91 2qpp h GLU 122 Ca -0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2qpp h GLU 122 Cb 1.13 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.30 2qpp h GLU 122 CO 0.06 0.30 0.00 -0.85 -1.00 0.00 0.00 179.01 177.52 2qpp n GLU 123 N -4.86 0.24 0.00 2.33 0.28 -1.23 -2.80 120.64 114.61 2qpp n GLU 123 Ca -0.01 0.06 0.12 0.00 -0.16 0.00 0.00 57.16 57.17 2qpp n GLU 123 Cb 0.04 -1.50 0.29 0.00 1.43 0.00 0.00 31.44 31.70 2qpp n GLU 123 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 2qpp n GLN 124 N -1.36 0.73 -4.50 3.44 6.02 -0.90 -4.99 117.38 115.83 2qpp n GLN 124 Ca 0.10 -0.47 -0.21 0.00 -0.01 0.00 0.00 57.00 56.41 2qpp n GLN 124 Cb 0.23 -1.49 -0.14 0.00 1.02 0.00 0.00 30.24 29.86 2qpp n GLN 124 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2qpp s VAL 125 N -2.59 1.12 -0.00 5.09 1.01 -1.12 -5.10 120.40 118.81 2qpp s VAL 125 Ca 0.21 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 2qpp s VAL 125 Cb 0.19 -0.98 -0.00 0.00 0.00 0.00 0.00 36.38 35.59 2qpp s VAL 125 CO 0.57 0.16 0.02 0.00 0.00 0.00 0.00 175.10 175.85 2qpp s GLN 126 N -0.75 0.17 0.16 2.72 -2.07 -1.26 -4.97 119.66 113.65 2qpp s GLN 126 Ca 0.04 -0.20 -0.31 0.00 -1.82 0.00 0.00 55.36 53.06 2qpp s GLN 126 Cb -0.07 0.07 -0.10 0.00 -1.09 0.00 0.00 33.01 31.82 2qpp s GLN 126 CO 0.00 -0.03 1.61 0.00 -1.32 0.00 0.00 175.29 175.55 2qpp s ALA 127 N -0.58 3.79 0.66 2.60 0.00 -1.26 -4.97 121.76 122.00 2qpp s ALA 127 Ca -0.06 1.39 -0.18 0.00 0.00 0.00 0.00 51.96 53.10 2qpp s ALA 127 Cb -0.04 -3.65 -0.00 0.00 0.00 0.00 0.00 23.12 19.43 2qpp s ALA 127 CO -0.00 -0.85 1.28 -2.14 0.00 0.00 0.00 175.76 174.04 2qpp s PRO 128 N 1.38 2.51 0.25 0.00 0.02 -1.26 -4.78 135.00 133.12 2qpp s PRO 128 Ca 0.72 2.01 -0.04 0.00 0.02 0.00 0.00 61.00 63.71 2qpp s PRO 128 Cb -0.44 -1.85 0.47 0.00 0.02 0.00 0.00 34.50 32.70 2qpp s PRO 128 CO 0.32 -1.62 1.74 0.87 -0.33 0.00 0.00 177.00 177.98 2qpp h LYS 129 N 0.44 0.46 0.00 5.54 1.57 -2.00 -0.68 116.57 121.90 2qpp h LYS 129 Ca -0.50 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.15 2qpp h LYS 129 Cb 1.33 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.52 2qpp h LYS 129 CO 0.53 0.31 -0.45 0.00 -0.57 0.00 0.00 179.45 179.26 2qpp h ALA 130 N 1.55 1.08 -0.23 3.86 0.00 -1.91 -2.83 119.26 120.78 2qpp h ALA 130 Ca 0.42 -0.41 -0.16 0.00 0.00 0.00 0.00 54.91 54.76 2qpp h ALA 130 Cb 0.63 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2qpp h ALA 130 CO -0.39 0.56 -0.52 0.00 0.00 0.00 0.00 179.25 178.90 2qpp h ALA 131 N 1.55 0.66 -0.55 0.00 0.00 -1.51 -2.90 119.26 116.50 2qpp h ALA 131 Ca -0.00 -0.50 0.05 0.00 0.00 0.00 0.00 54.91 54.45 2qpp h ALA 131 Cb 0.89 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 2qpp h ALA 131 CO 0.06 0.68 0.29 1.96 0.00 0.00 0.00 179.25 182.24 2qpp h GLN 132 N 0.51 0.55 -0.25 0.00 4.20 -1.11 0.56 115.11 119.57 2qpp h GLN 132 Ca 0.02 -0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.72 2qpp h GLN 132 Cb 1.07 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.70 2qpp h GLN 132 CO 0.10 0.36 0.10 0.87 -0.67 0.00 0.00 178.83 179.59 2qpp h LYS 133 N 0.57 0.21 -0.12 1.46 1.79 -1.50 0.21 116.57 119.19 2qpp h LYS 133 Ca 0.24 -0.01 0.03 0.00 -2.18 0.00 0.00 60.65 58.73 2qpp h LYS 133 Cb 0.13 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 30.71 2qpp h LYS 133 CO -0.16 0.14 -0.05 -0.92 -1.08 0.00 0.00 179.45 177.38 2qpp h TYR 134 N 0.22 -0.13 -0.48 -1.35 -0.00 -1.26 -1.25 116.97 112.72 2qpp h TYR 134 Ca 0.11 0.01 0.03 0.00 -0.00 0.00 0.00 58.73 58.88 2qpp h TYR 134 Cb 0.07 0.08 -0.04 0.00 -0.00 0.00 0.00 36.73 36.84 2qpp h TYR 134 CO -0.12 -0.09 0.26 0.28 -0.00 0.00 0.00 178.16 178.49 2qpp h VAL 135 N -0.04 1.00 -0.72 1.81 2.07 -0.52 -0.96 116.25 118.89 2qpp h VAL 135 Ca 0.07 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 2qpp h VAL 135 Cb 0.14 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.31 2qpp h VAL 135 CO -0.15 0.10 0.43 -0.33 0.02 0.00 0.00 177.57 177.63 2qpp h GLU 136 N 0.52 0.98 -0.25 1.57 5.08 -0.31 -1.55 114.58 120.62 2qpp h GLU 136 Ca 0.20 -0.09 -0.19 0.00 -1.00 0.00 0.00 59.36 58.28 2qpp h GLU 136 Cb 0.07 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.12 2qpp h GLU 136 CO -0.12 0.70 -0.58 -0.09 -1.00 0.00 0.00 179.01 177.92 2qpp h ARG 137 N 1.00 0.83 -0.42 2.33 9.65 -0.84 -2.14 114.38 124.80 2qpp h ARG 137 Ca 0.26 -0.56 0.02 0.00 -1.10 0.00 0.00 59.98 58.60 2qpp h ARG 137 Cb -0.03 0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 28.61 2qpp h ARG 137 CO -0.05 1.19 0.25 0.82 2.80 0.00 0.00 179.97 184.98 2qpp h ILE 138 N 0.60 1.04 -0.51 1.20 2.04 -0.83 -0.69 117.51 120.36 2qpp h ILE 138 Ca -0.00 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 2qpp h ILE 138 Cb 1.19 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 2qpp h ILE 138 CO 0.13 0.09 0.22 0.45 0.00 0.00 0.00 178.15 179.04 2qpp h HIS 139 N 0.50 0.76 0.03 1.37 3.86 -1.29 -0.78 115.15 119.60 2qpp h HIS 139 Ca 0.17 -0.05 0.02 0.00 -1.16 0.00 0.00 60.37 59.34 2qpp h HIS 139 Cb 0.01 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.22 2qpp h HIS 139 CO -0.07 0.62 -0.12 -0.92 0.86 0.00 0.00 177.93 178.30 2qpp h TYR 140 N 0.69 -0.30 -0.48 2.45 3.20 -1.06 -0.49 116.97 120.98 2qpp h TYR 140 Ca 0.17 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.06 2qpp h TYR 140 Cb 0.16 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.54 2qpp h TYR 140 CO 0.00 -0.18 0.31 0.82 -1.64 0.00 0.00 178.16 177.48 2qpp h ILE 141 N -0.21 1.12 0.00 1.81 1.08 -1.01 0.22 117.51 120.52 2qpp h ILE 141 Ca 0.03 -0.23 -0.04 0.00 -0.39 0.00 0.00 64.86 64.23 2qpp h ILE 141 Cb 0.25 0.43 -0.01 0.00 -3.07 0.00 0.00 36.82 34.42 2qpp h ILE 141 CO -0.10 0.12 -0.20 1.23 -0.69 0.00 0.00 178.15 178.51 2qpp h GLY 142 N 0.65 0.00 0.09 5.37 0.00 -0.92 -0.97 103.07 107.28 2qpp h GLY 142 Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.38 2qpp h GLY 142 CO -0.04 0.00 -2.06 -1.06 0.00 0.00 0.00 176.54 173.38 2qpp n GLN 143 N -3.86 0.67 0.00 4.80 6.02 -0.21 -4.59 117.38 120.20 2qpp n GLN 143 Ca -0.02 -0.10 0.00 0.00 -0.01 0.00 0.00 57.00 56.87 2qpp n GLN 143 Cb 0.29 -1.55 0.00 0.00 1.02 0.00 0.00 30.24 30.01 2qpp n GLN 143 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2qpp n ASN 144 N -2.47 3.62 -3.19 1.08 3.02 0.73 -4.89 115.26 113.16 2qpp n ASN 144 Ca -0.14 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.19 2qpp n ASN 144 Cb 0.77 0.45 -0.05 0.00 -0.61 0.00 0.00 39.78 40.34 2qpp n ASN 144 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2qpp n GLU 145 N -1.46 1.12 0.31 3.52 1.02 -0.42 -4.98 120.64 119.75 2qpp n GLU 145 Ca 0.00 -3.50 0.20 0.00 -0.02 0.00 0.00 57.16 53.84 2qpp n GLU 145 Cb 0.27 -1.54 0.98 0.00 -0.02 0.00 0.00 31.44 31.12 2qpp n GLU 145 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2qpp h PRO 146 N 3.59 0.00 0.00 3.49 0.13 -1.68 -1.75 132.00 135.78 2qpp h PRO 146 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2qpp h PRO 146 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 2qpp h PRO 146 CO 0.53 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.35 2qpp h GLU 147 N 0.00 0.00 -0.40 0.86 9.09 -1.89 -2.74 114.58 119.51 2qpp h GLU 147 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2qpp h GLU 147 Cb 0.22 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.32 2qpp h GLU 147 CO 0.00 0.00 0.00 1.28 0.05 0.00 0.00 179.01 180.34 2qpp n LEU 148 N -2.75 3.39 0.16 3.06 4.77 -0.66 -4.47 117.00 120.50 2qpp n LEU 148 Ca 0.00 -1.56 0.02 0.00 -0.03 0.00 0.00 56.01 54.44 2qpp n LEU 148 Cb 0.21 -0.26 0.38 0.00 -2.33 0.00 0.00 43.42 41.42 2qpp n LEU 148 CO 0.22 0.75 0.80 0.25 -1.33 0.00 0.00 177.39 178.07 2qpp h LEU 149 N 4.12 0.10 -1.60 2.23 5.85 -1.62 -2.29 115.31 122.10 2qpp h LEU 149 Ca 0.00 -0.03 0.14 0.00 0.84 0.00 0.00 57.88 58.83 2qpp h LEU 149 Cb 0.94 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.89 2qpp h LEU 149 CO 0.00 0.37 0.49 1.62 -0.34 0.00 0.00 178.44 180.58 2qpp h VAL 150 N 0.10 0.81 -0.80 1.05 3.04 -1.80 -1.14 116.25 117.50 2qpp h VAL 150 Ca 0.01 -0.14 -0.00 0.00 -1.01 0.00 0.00 66.70 65.57 2qpp h VAL 150 Cb 0.52 0.37 -0.04 0.00 -2.01 0.00 0.00 31.29 30.13 2qpp h VAL 150 CO 0.04 0.07 0.50 0.00 -1.01 0.00 0.00 177.57 177.17 2qpp h ALA 151 N 1.65 1.37 0.12 3.17 0.00 -1.70 0.17 119.26 124.04 2qpp h ALA 151 Ca 0.35 -0.08 -0.29 0.00 0.00 0.00 0.00 54.91 54.89 2qpp h ALA 151 Cb 0.80 -0.33 0.03 0.00 0.00 0.00 0.00 17.79 18.30 2qpp h ALA 151 CO -0.11 0.56 -1.22 0.45 0.00 0.00 0.00 179.25 178.93 2qpp h HIS 152 N 1.10 1.01 0.02 0.00 -0.00 -1.34 -2.42 115.15 113.52 2qpp h HIS 152 Ca 0.29 -0.63 -0.00 0.00 -0.00 0.00 0.00 60.37 60.03 2qpp h HIS 152 Cb -0.07 -0.08 0.00 0.00 -0.00 0.00 0.00 27.41 27.25 2qpp h HIS 152 CO 0.00 1.47 -0.01 0.00 -0.00 0.00 0.00 177.93 179.39 2qpp h ALA 153 N 0.28 -0.03 -0.27 2.45 0.00 -1.32 -2.54 119.26 117.84 2qpp h ALA 153 Ca -0.19 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.70 2qpp h ALA 153 Cb 1.90 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 19.62 2qpp h ALA 153 CO 0.23 -0.45 -0.47 -0.92 0.00 0.00 0.00 179.25 177.65 2qpp h TYR 154 N -0.17 -1.38 -0.72 0.00 3.20 -0.72 0.31 116.97 117.48 2qpp h TYR 154 Ca -0.00 0.06 0.04 0.00 3.14 0.00 0.00 58.73 61.97 2qpp h TYR 154 Cb 0.16 0.64 -0.05 0.00 1.54 0.00 0.00 36.73 39.02 2qpp h TYR 154 CO -0.03 -0.48 0.44 1.15 -1.64 0.00 0.00 178.16 177.60 2qpp h THR 155 N -0.44 1.05 0.00 1.81 2.02 -1.41 -2.60 112.91 113.33 2qpp h THR 155 Ca 0.09 -0.29 -0.00 0.00 0.77 0.00 0.00 66.41 66.98 2qpp h THR 155 Cb 0.62 0.15 -0.00 0.00 -1.74 0.00 0.00 68.15 67.18 2qpp h THR 155 CO -0.50 0.15 -0.02 0.03 0.37 0.00 0.00 175.52 175.55 2qpp h ARG 156 N 0.83 0.00 -0.38 6.66 2.47 -1.17 -3.31 114.38 119.48 2qpp h ARG 156 Ca 0.30 0.00 -0.12 0.00 -1.26 0.00 0.00 59.98 58.90 2qpp h ARG 156 Cb 0.09 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.40 2qpp h ARG 156 CO -0.14 0.13 -0.23 1.88 0.56 0.00 0.00 179.97 182.17 2qpp h TYR 157 N -1.00 0.98 -0.84 3.04 0.05 -1.02 -1.36 116.97 116.82 2qpp h TYR 157 Ca -0.00 -0.26 -0.01 0.00 0.05 0.00 0.00 58.73 58.51 2qpp h TYR 157 Cb 0.15 -0.22 -0.04 0.00 1.01 0.00 0.00 36.73 37.63 2qpp h TYR 157 CO 0.03 1.03 0.48 0.52 -1.05 0.00 0.00 178.16 179.18 2qpp h MET 158 N 0.64 1.15 0.02 4.88 2.86 -1.60 -0.26 114.93 122.63 2qpp h MET 158 Ca 0.08 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2qpp h MET 158 Cb 0.80 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 32.22 2qpp h MET 158 CO 0.07 0.83 -0.04 0.78 1.06 0.00 0.00 176.91 179.61 2qpp h GLY 159 N 1.16 -0.05 0.37 8.32 0.00 -1.62 -2.90 103.07 108.35 2qpp h GLY 159 Ca 0.30 0.04 0.14 0.00 0.00 0.00 0.00 47.33 47.81 2qpp h GLY 159 CO -0.05 -0.04 0.63 -0.55 0.00 0.00 0.00 176.54 176.52 2qpp h ASP 160 N -0.07 0.88 1.07 0.19 3.32 -0.62 -1.24 116.42 119.96 2qpp h ASP 160 Ca 0.01 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.12 2qpp h ASP 160 Cb 0.08 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.52 2qpp h ASP 160 CO -0.03 0.42 0.00 0.18 -1.72 0.00 0.00 179.24 178.10 2qpp n LEU 161 N -4.66 0.47 -0.07 1.55 4.77 -0.16 -2.34 117.00 116.55 2qpp n LEU 161 Ca 0.20 0.57 -0.15 0.00 -0.03 0.00 0.00 56.01 56.60 2qpp n LEU 161 Cb 0.42 -0.44 -0.14 0.00 -2.33 0.00 0.00 43.42 40.93 2qpp n LEU 161 CO 0.26 -0.23 -1.03 -1.20 -1.33 0.00 0.00 177.39 173.86 2qpp n SER 162 N -1.97 1.32 0.00 -1.43 7.64 -0.50 -4.71 113.62 113.98 2qpp n SER 162 Ca 0.05 0.07 0.00 0.00 1.01 0.00 0.00 58.87 60.00 2qpp n SER 162 Cb 0.33 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 2qpp n SER 162 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qpp n GLY 163 N 1.95 -0.52 0.24 0.23 0.00 -1.02 -4.83 105.19 101.23 2qpp n GLY 163 Ca -0.34 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.69 2qpp n GLY 163 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2qpp h GLY 164 N 0.00 0.61 1.00 -0.02 0.00 -1.69 -1.29 103.07 101.68 2qpp h GLY 164 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.47 2qpp h GLY 164 CO 0.00 -0.23 0.44 -1.61 0.00 0.00 0.00 176.54 175.14 2qpp h GLN 165 N 0.07 0.92 -0.02 4.80 -0.00 -1.86 0.75 115.11 119.77 2qpp h GLN 165 Ca 0.33 -0.07 -0.00 0.00 -0.00 0.00 0.00 58.65 58.91 2qpp h GLN 165 Cb 0.53 -0.20 -0.00 0.00 0.00 0.00 0.00 27.48 27.81 2qpp h GLN 165 CO -0.60 0.63 0.00 0.28 0.00 0.00 0.00 178.83 179.14 2qpp h VAL 166 N 0.93 1.24 -0.81 2.39 2.07 -1.79 -2.64 116.25 117.63 2qpp h VAL 166 Ca 0.25 -0.72 0.08 0.00 0.82 0.00 0.00 66.70 67.13 2qpp h VAL 166 Cb -0.07 1.70 -0.07 0.00 -1.52 0.00 0.00 31.29 31.33 2qpp h VAL 166 CO -0.05 0.19 0.47 -0.07 0.02 0.00 0.00 177.57 178.13 2qpp h LEU 167 N -0.27 0.70 0.19 2.57 3.38 -0.96 -0.85 115.31 120.07 2qpp h LEU 167 Ca 0.00 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2qpp h LEU 167 Cb 0.31 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2qpp h LEU 167 CO 0.00 0.42 -0.21 0.50 0.09 0.00 0.00 178.44 179.24 2qpp h LYS 168 N 0.82 -0.42 -0.45 1.13 3.64 -0.84 -0.16 116.57 120.29 2qpp h LYS 168 Ca 0.38 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.75 2qpp h LYS 168 Cb 0.30 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 2qpp h LYS 168 CO -0.22 -0.28 0.14 0.87 -2.27 0.00 0.00 179.45 177.69 2qpp h LYS 169 N -0.44 0.66 -0.03 1.90 1.79 -1.08 -0.20 116.57 119.17 2qpp h LYS 169 Ca 0.00 -0.11 -0.00 0.00 -2.18 0.00 0.00 60.65 58.36 2qpp h LYS 169 Cb 0.42 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 30.95 2qpp h LYS 169 CO -0.06 0.58 0.00 0.28 -1.08 0.00 0.00 179.45 179.18 2qpp h VAL 170 N 0.65 1.22 -0.51 0.50 2.07 -0.93 -2.35 116.25 116.90 2qpp h VAL 170 Ca 0.15 -0.65 0.02 0.00 0.82 0.00 0.00 66.70 67.04 2qpp h VAL 170 Cb 0.20 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 2qpp h VAL 170 CO -0.01 0.18 0.31 0.00 0.02 0.00 0.00 177.57 178.06 2qpp h ALA 171 N 0.75 0.65 -0.76 1.67 0.00 -0.67 -1.21 119.26 119.68 2qpp h ALA 171 Ca 0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2qpp h ALA 171 Cb 0.28 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2qpp h ALA 171 CO 0.00 0.01 0.45 1.96 0.00 0.00 0.00 179.25 181.67 2qpp h GLN 172 N 0.61 1.04 -0.18 0.00 4.20 -1.05 -1.95 115.11 117.78 2qpp h GLN 172 Ca 0.20 -0.10 -0.09 0.00 0.06 0.00 0.00 58.65 58.72 2qpp h GLN 172 Cb 0.02 -0.22 -0.00 0.00 0.30 0.00 0.00 27.48 27.58 2qpp h GLN 172 CO -0.09 0.75 -0.25 -0.09 -0.67 0.00 0.00 178.83 178.47 2qpp h ARG 173 N 1.05 0.49 -0.51 1.46 2.43 -1.21 -1.08 114.38 117.00 2qpp h ARG 173 Ca 0.27 -0.29 -0.09 0.00 -0.81 0.00 0.00 59.98 59.07 2qpp h ARG 173 Cb -0.02 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 2qpp h ARG 173 CO -0.05 0.88 -0.05 0.00 -1.51 0.00 0.00 179.97 179.24 2qpp h ALA 174 N 0.61 0.95 -0.18 2.80 0.00 -1.13 -3.27 119.26 119.03 2qpp h ALA 174 Ca 0.02 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2qpp h ALA 174 Cb 0.82 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2qpp h ALA 174 CO 0.06 0.63 0.00 1.28 0.00 0.00 0.00 179.25 181.21 2qpp n LEU 175 N -4.18 2.60 -3.58 0.00 4.77 -0.74 -4.99 117.00 110.89 2qpp n LEU 175 Ca 0.02 -1.35 -0.20 0.00 -0.03 0.00 0.00 56.01 54.45 2qpp n LEU 175 Cb 0.35 -0.11 0.05 0.00 -2.33 0.00 0.00 43.42 41.38 2qpp n LEU 175 CO 0.43 0.55 -0.01 0.29 -1.33 0.00 0.00 177.39 177.32 2qpp n LYS 176 N 0.85 -4.81 -2.91 3.23 4.76 -0.64 -4.99 118.16 113.65 2qpp n LYS 176 Ca 0.11 0.70 -0.30 0.00 -2.87 0.00 0.00 58.31 55.94 2qpp n LYS 176 Cb 0.41 -5.36 -0.04 0.00 -1.84 0.00 0.00 35.03 28.21 2qpp n LYS 176 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2qpp s LEU 177 N -6.43 3.87 0.66 -0.35 1.43 -0.50 -5.05 118.68 112.30 2qpp s LEU 177 Ca 0.09 1.13 -0.17 0.00 -1.03 0.00 0.00 54.13 54.15 2qpp s LEU 177 Cb -0.02 -4.00 0.00 0.00 0.03 0.00 0.00 46.19 42.21 2qpp s LEU 177 CO 0.79 -0.37 1.19 -2.84 0.23 0.00 0.00 176.35 175.35 2qpp s PRO 178 N -3.73 2.61 0.45 1.29 0.02 -1.26 -4.86 135.00 129.52 2qpp s PRO 178 Ca 0.51 1.72 0.24 0.00 0.02 0.00 0.00 61.00 63.49 2qpp s PRO 178 Cb -0.10 -1.89 1.01 0.00 0.02 0.00 0.00 34.50 33.53 2qpp s PRO 178 CO 0.30 -1.47 1.87 0.66 -0.33 0.00 0.00 177.00 178.03 2qpp h SER 179 N 0.25 0.00 0.24 2.53 4.64 -1.96 -3.12 113.55 116.13 2qpp h SER 179 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2qpp h SER 179 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 2qpp h SER 179 CO 0.53 0.22 0.00 0.35 -0.87 0.00 0.00 176.83 177.06 2qpp n THR 180 N -3.46 1.49 0.00 2.95 -2.24 -1.26 -4.86 114.28 106.90 2qpp n THR 180 Ca -0.00 0.40 0.00 0.00 -2.27 0.00 0.00 64.05 62.17 2qpp n THR 180 Cb 0.40 -1.29 0.00 0.00 -2.10 0.00 0.00 70.33 67.34 2qpp n THR 180 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qpp n GLY 181 N -0.80 0.64 3.68 3.38 0.00 -1.18 -5.06 105.19 105.85 2qpp n GLY 181 Ca 0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.59 2qpp n GLY 181 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qpp n GLU 182 N -1.32 2.59 0.00 1.61 4.71 -1.26 -1.80 120.64 125.18 2qpp n GLU 182 Ca 0.00 0.95 0.00 0.00 -0.01 0.00 0.00 57.16 58.10 2qpp n GLU 182 Cb 0.00 -2.82 0.00 0.00 -1.01 0.00 0.00 31.44 27.61 2qpp n GLU 182 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2qpp n GLY 183 N 4.21 1.99 0.16 0.62 0.00 -1.26 -4.44 105.19 106.47 2qpp n GLY 183 Ca 0.19 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.27 2qpp n GLY 183 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qpp n THR 184 N -2.00 1.20 0.31 2.61 -2.24 -0.75 -4.80 114.28 108.62 2qpp n THR 184 Ca 0.00 -1.42 0.18 0.00 -2.27 0.00 0.00 64.05 60.54 2qpp n THR 184 Cb 0.00 0.11 1.00 0.00 -2.10 0.00 0.00 70.33 69.34 2qpp n THR 184 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2qpp h GLN 185 N 0.00 0.00 -0.66 -0.78 4.20 -1.81 -0.84 115.11 115.22 2qpp h GLN 185 Ca 0.00 0.00 0.08 0.00 0.06 0.00 0.00 58.65 58.79 2qpp h GLN 185 Cb 1.03 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.77 2qpp h GLN 185 CO 0.00 0.02 0.44 0.35 -0.67 0.00 0.00 178.83 178.97 2qpp h PHE 186 N 0.00 0.63 -0.01 2.96 3.57 -1.87 -2.75 116.94 119.47 2qpp h PHE 186 Ca -0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2qpp h PHE 186 Cb 0.09 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.62 2qpp h PHE 186 CO 0.00 0.32 -0.08 0.66 -2.23 0.00 0.00 178.31 176.98 2qpp n TYR 187 N -4.48 0.00 -3.90 0.41 4.01 -0.32 -4.75 117.16 108.13 2qpp n TYR 187 Ca 0.10 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.49 2qpp n TYR 187 Cb 0.28 -0.11 -0.14 0.00 -0.31 0.00 0.00 39.34 39.06 2qpp n TYR 187 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 2qpp s LEU 188 N -2.31 2.95 -0.73 7.72 2.96 -1.04 -4.28 118.68 123.95 2qpp s LEU 188 Ca 0.33 -0.37 -0.17 0.00 -0.22 0.00 0.00 54.13 53.70 2qpp s LEU 188 Cb 0.20 -1.76 0.14 0.00 0.50 0.00 0.00 46.19 45.28 2qpp s LEU 188 CO 0.43 -0.02 0.81 -0.36 -1.32 0.00 0.00 176.35 175.90 2qpp s PHE 189 N 1.48 3.25 0.35 5.38 0.08 -1.26 -4.90 117.98 122.36 2qpp s PHE 189 Ca 0.06 -1.37 0.20 0.00 0.12 0.00 0.00 56.93 55.94 2qpp s PHE 189 Cb -0.14 -4.01 1.04 0.00 -0.57 0.00 0.00 43.02 39.33 2qpp s PHE 189 CO -0.02 -1.24 1.92 1.49 -0.10 0.00 0.00 175.22 177.27 2qpp h GLU 190 N 8.69 0.00 -0.45 0.44 4.81 -1.93 -2.69 114.58 123.45 2qpp h GLU 190 Ca -0.08 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 2qpp h GLU 190 Cb 1.06 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.44 2qpp h GLU 190 CO 1.00 0.25 0.00 0.09 -0.73 0.00 0.00 179.01 179.62 2qpp n ASN 191 N -3.81 3.87 -4.20 1.04 3.02 -1.26 -4.84 115.26 109.07 2qpp n ASN 191 Ca -0.02 -2.40 -0.35 0.00 -0.03 0.00 0.00 54.58 51.78 2qpp n ASN 191 Cb 0.34 -0.44 -0.14 0.00 -0.61 0.00 0.00 39.78 38.93 2qpp n ASN 191 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2qpp s VAL 192 N -1.74 2.99 0.13 2.41 1.01 -1.01 -4.79 120.40 119.39 2qpp s VAL 192 Ca 0.39 -1.09 -0.04 0.00 0.00 0.00 0.00 61.98 61.24 2qpp s VAL 192 Cb 0.26 -2.57 -0.18 0.00 0.00 0.00 0.00 36.38 33.89 2qpp s VAL 192 CO 0.18 0.11 1.31 0.44 0.00 0.00 0.00 175.10 177.15 2qpp h ASP 193 N 8.03 0.55 -2.80 3.32 3.32 -1.88 -3.43 116.42 123.52 2qpp h ASP 193 Ca -0.30 -0.43 -0.45 0.00 0.02 0.00 0.00 57.03 55.88 2qpp h ASP 193 Cb 1.10 -0.17 -0.39 0.00 0.22 0.00 0.00 39.33 40.09 2qpp h ASP 193 CO 0.57 1.22 -0.73 0.21 -1.72 0.00 0.00 179.24 178.79 2qpp s ASN 194 N -7.08 2.54 0.20 6.45 3.84 -1.26 -5.03 114.94 114.60 2qpp s ASN 194 Ca -0.06 -0.80 -0.10 0.00 0.21 0.00 0.00 52.86 52.11 2qpp s ASN 194 Cb 0.09 -0.11 0.23 0.00 -0.55 0.00 0.00 41.25 40.91 2qpp s ASN 194 CO 0.87 -0.38 1.78 0.00 -2.79 0.00 0.00 177.10 176.57 2qpp h ALA 195 N 8.39 0.79 -0.29 1.71 0.00 -1.90 -0.48 119.26 127.48 2qpp h ALA 195 Ca -0.17 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.80 2qpp h ALA 195 Cb 1.10 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2qpp h ALA 195 CO 0.34 -0.09 0.16 0.37 0.00 0.00 0.00 179.25 180.04 2qpp h GLN 196 N 0.52 0.32 -0.37 0.00 5.75 -1.96 -0.19 115.11 119.19 2qpp h GLN 196 Ca 0.28 -0.02 -0.12 0.00 -0.15 0.00 0.00 58.65 58.64 2qpp h GLN 196 Cb 0.25 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 2qpp h GLN 196 CO -0.22 0.21 -0.27 1.96 -2.65 0.00 0.00 178.83 177.86 2qpp h GLN 197 N 0.33 0.77 -0.63 1.69 4.20 -1.93 -2.74 115.11 116.80 2qpp h GLN 197 Ca 0.11 -0.33 -0.09 0.00 0.06 0.00 0.00 58.65 58.40 2qpp h GLN 197 Cb 0.01 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 2qpp h GLN 197 CO -0.06 0.95 0.04 0.35 -0.67 0.00 0.00 178.83 179.44 2qpp h PHE 198 N 0.66 1.18 -0.95 2.96 3.57 -0.79 -1.34 116.94 122.22 2qpp h PHE 198 Ca 0.08 -0.19 0.06 0.00 3.53 0.00 0.00 57.97 61.45 2qpp h PHE 198 Cb 0.79 -0.31 -0.06 0.00 2.79 0.00 0.00 35.95 39.15 2qpp h PHE 198 CO 0.04 1.02 0.62 0.87 -2.23 0.00 0.00 178.31 178.62 2qpp h LYS 199 N 1.00 1.08 -0.55 1.11 1.57 -0.98 -0.48 116.57 119.31 2qpp h LYS 199 Ca 0.18 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.81 2qpp h LYS 199 Cb 0.52 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 2qpp h LYS 199 CO 0.02 0.71 -0.02 1.96 -0.57 0.00 0.00 179.45 181.55 2qpp h GLN 200 N 1.11 0.96 -0.43 3.15 4.20 -1.13 -0.98 115.11 121.99 2qpp h GLN 200 Ca 0.40 -0.30 -0.04 0.00 0.06 0.00 0.00 58.65 58.78 2qpp h GLN 200 Cb 0.16 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 2qpp h GLN 200 CO -0.15 0.96 0.12 1.25 -0.67 0.00 0.00 178.83 180.34 2qpp h LEU 201 N 0.87 0.63 -0.33 1.46 6.46 -0.73 -1.80 115.31 121.88 2qpp h LEU 201 Ca 0.16 -0.22 -0.00 0.00 -0.12 0.00 0.00 57.88 57.70 2qpp h LEU 201 Cb 0.55 -0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 40.29 2qpp h LEU 201 CO 0.03 0.68 0.21 0.22 -0.62 0.00 0.00 178.44 178.96 2qpp h TYR 202 N 0.55 0.43 -0.77 1.25 3.20 -0.94 -1.50 116.97 119.19 2qpp h TYR 202 Ca 0.14 0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.04 2qpp h TYR 202 Cb 0.29 -0.14 -0.05 0.00 1.54 0.00 0.00 36.73 38.37 2qpp h TYR 202 CO 0.01 0.30 0.49 0.00 -1.64 0.00 0.00 178.16 177.32 2qpp h ARG 203 N 0.43 0.92 -0.35 1.82 3.08 -1.09 -0.36 114.38 118.82 2qpp h ARG 203 Ca 0.12 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.05 2qpp h ARG 203 Cb -0.01 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 29.81 2qpp h ARG 203 CO -0.02 0.61 -0.04 0.00 -1.07 0.00 0.00 179.97 179.44 2qpp h ALA 204 N 1.33 1.27 -0.01 0.04 0.00 -0.95 -1.07 119.26 119.87 2qpp h ALA 204 Ca 0.31 -0.24 -0.21 0.00 0.00 0.00 0.00 54.91 54.77 2qpp h ALA 204 Cb 0.02 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2qpp h ALA 204 CO -0.11 0.48 -0.90 0.00 0.00 0.00 0.00 179.25 178.72 2qpp h ARG 205 N 0.53 0.36 -0.72 0.00 3.08 -0.83 -2.39 114.38 114.42 2qpp h ARG 205 Ca 0.11 -0.37 -0.03 0.00 0.07 0.00 0.00 59.98 59.75 2qpp h ARG 205 Cb 0.41 0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.53 2qpp h ARG 205 CO 0.02 1.05 0.34 0.52 -1.07 0.00 0.00 179.97 180.83 2qpp h MET 206 N 0.21 1.04 0.00 0.04 2.86 -0.73 -2.64 114.93 115.71 2qpp h MET 206 Ca -0.06 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 2qpp h MET 206 Cb 1.52 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 33.00 2qpp h MET 206 CO 0.15 0.82 0.00 -0.91 1.06 0.00 0.00 176.91 178.03 2qpp h ASN 207 N 1.00 0.00 0.93 1.22 2.35 -1.16 -3.16 115.58 116.77 2qpp h ASN 207 Ca 0.25 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 2qpp h ASN 207 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 2qpp h ASN 207 CO -0.03 0.00 -0.33 0.00 -1.65 0.00 0.00 177.43 175.42 2qpp n ALA 208 N -2.06 2.81 -1.93 -0.83 0.00 -0.90 -4.88 120.51 112.72 2qpp n ALA 208 Ca 0.01 -0.19 -0.42 0.00 0.00 0.00 0.00 53.44 52.84 2qpp n ALA 208 Cb 0.34 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 18.48 2qpp n ALA 208 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2qpp s LEU 209 N -3.73 4.38 -1.06 0.00 1.43 -1.18 -4.90 118.68 113.61 2qpp s LEU 209 Ca 0.10 2.61 -0.23 0.00 -1.03 0.00 0.00 54.13 55.58 2qpp s LEU 209 Cb 0.15 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.74 2qpp s LEU 209 CO 0.65 -0.75 1.81 -0.62 0.23 0.00 0.00 176.35 177.68 2qpp s ASP 210 N 0.76 5.63 -0.02 2.29 -1.08 -1.26 -4.92 116.67 118.06 2qpp s ASP 210 Ca 0.64 -1.35 0.04 0.00 -0.52 0.00 0.00 52.55 51.36 2qpp s ASP 210 Cb -0.42 -2.57 -0.01 0.00 -1.46 0.00 0.00 42.92 38.46 2qpp s ASP 210 CO 0.37 -2.36 -0.14 -0.76 0.52 0.00 0.00 175.17 172.79 2qpp s LEU 211 N 8.47 1.95 0.71 -1.34 1.43 -1.26 -5.04 118.68 123.60 2qpp s LEU 211 Ca 0.62 -0.28 -0.11 0.00 -1.03 0.00 0.00 54.13 53.33 2qpp s LEU 211 Cb -0.02 -0.79 0.02 0.00 0.03 0.00 0.00 46.19 45.43 2qpp s LEU 211 CO 0.02 0.15 1.10 0.54 0.23 0.00 0.00 176.35 178.39 2qpp s ASN 212 N -0.13 5.41 0.47 2.29 2.20 -1.26 -4.91 114.94 119.01 2qpp s ASN 212 Ca 0.01 1.13 0.19 0.00 -0.94 0.00 0.00 52.86 53.25 2qpp s ASN 212 Cb -0.08 -1.92 1.13 0.00 -2.00 0.00 0.00 41.25 38.38 2qpp s ASN 212 CO 0.00 -1.36 2.00 -0.03 -2.94 0.00 0.00 177.10 174.77 2qpp h MET 213 N -0.67 0.00 -0.40 3.55 1.85 -1.99 -2.31 114.93 114.96 2qpp h MET 213 Ca -0.45 0.00 -0.08 0.00 -0.61 0.00 0.00 59.70 58.56 2qpp h MET 213 Cb 1.25 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 33.27 2qpp h MET 213 CO 0.64 0.18 -0.05 -0.22 -0.40 0.00 0.00 176.91 177.06 2qpp h LYS 214 N 0.00 0.74 -0.40 0.39 1.63 -2.00 -2.27 116.57 114.67 2qpp h LYS 214 Ca -0.00 -0.26 -0.15 0.00 -0.85 0.00 0.00 60.65 59.38 2qpp h LYS 214 Cb 0.36 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.93 2qpp h LYS 214 CO 0.02 0.86 -0.35 1.15 -3.45 0.00 0.00 179.45 177.68 2qpp h THR 215 N 0.56 1.27 -0.87 1.00 2.02 -1.86 -2.61 112.91 112.44 2qpp h THR 215 Ca 0.11 -1.52 0.04 0.00 0.77 0.00 0.00 66.41 65.80 2qpp h THR 215 Cb 0.56 1.35 -0.05 0.00 -1.74 0.00 0.00 68.15 68.26 2qpp h THR 215 CO 0.03 0.51 0.56 0.11 0.37 0.00 0.00 175.52 177.10 2qpp h LYS 216 N 0.76 1.04 -0.17 6.66 1.57 -1.40 0.11 116.57 125.15 2qpp h LYS 216 Ca 0.07 -0.06 -0.10 0.00 -1.87 0.00 0.00 60.65 58.69 2qpp h LYS 216 Cb 0.94 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 2qpp h LYS 216 CO 0.09 0.69 -0.31 0.93 -0.57 0.00 0.00 179.45 180.28 2qpp h GLU 217 N 1.08 0.34 -0.06 3.15 5.08 -1.37 -1.98 114.58 120.81 2qpp h GLU 217 Ca 0.35 -0.14 -0.14 0.00 -1.00 0.00 0.00 59.36 58.43 2qpp h GLU 217 Cb 0.02 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2qpp h GLU 217 CO -0.12 0.62 -0.59 0.00 -1.00 0.00 0.00 179.01 177.92 2qpp h ARG 218 N 0.30 0.20 -0.59 2.33 3.08 -0.90 -2.42 114.38 116.37 2qpp h ARG 218 Ca 0.04 -0.13 -0.03 0.00 0.07 0.00 0.00 59.98 59.93 2qpp h ARG 218 Cb 0.70 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.75 2qpp h ARG 218 CO 0.05 0.73 0.26 0.82 -1.07 0.00 0.00 179.97 180.76 2qpp h ILE 219 N 0.15 1.22 -0.74 2.04 2.04 -0.50 -2.16 117.51 119.56 2qpp h ILE 219 Ca -0.00 -0.66 -0.05 0.00 1.00 0.00 0.00 64.86 65.15 2qpp h ILE 219 Cb 1.07 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.68 2qpp h ILE 219 CO 0.09 0.26 0.27 0.58 0.00 0.00 0.00 178.15 179.35 2qpp h VAL 220 N 0.81 1.25 -0.43 1.67 2.07 -1.14 -0.68 116.25 119.81 2qpp h VAL 220 Ca 0.20 -0.82 -0.07 0.00 0.82 0.00 0.00 66.70 66.83 2qpp h VAL 220 Cb 0.17 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 2qpp h VAL 220 CO -0.02 0.33 0.00 -0.33 0.02 0.00 0.00 177.57 177.57 2qpp h GLU 221 N 1.08 0.76 -0.36 1.57 5.08 -1.37 -2.01 114.58 119.32 2qpp h GLU 221 Ca 0.24 -0.24 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 2qpp h GLU 221 Cb 0.23 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 2qpp h GLU 221 CO -0.02 0.83 -0.12 1.49 -1.00 0.00 0.00 179.01 180.19 2qpp h GLU 222 N 0.59 0.64 -0.54 2.33 4.57 -1.18 -1.29 114.58 119.69 2qpp h GLU 222 Ca 0.12 -0.20 -0.04 0.00 -1.18 0.00 0.00 59.36 58.07 2qpp h GLU 222 Cb 0.48 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.99 2qpp h GLU 222 CO 0.02 0.74 0.19 0.00 -1.18 0.00 0.00 179.01 178.78 2qpp h ALA 223 N 1.29 1.32 -0.41 2.92 0.00 -0.92 0.18 119.26 123.64 2qpp h ALA 223 Ca 0.10 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 2qpp h ALA 223 Cb 0.54 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2qpp h ALA 223 CO 0.03 0.50 -0.26 -0.91 0.00 0.00 0.00 179.25 178.61 2qpp h ASN 224 N 0.78 0.95 -0.25 0.00 2.35 -0.97 -2.26 115.58 116.18 2qpp h ASN 224 Ca 0.18 -0.42 0.04 0.00 -0.55 0.00 0.00 56.30 55.55 2qpp h ASN 224 Cb 0.19 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.26 2qpp h ASN 224 CO -0.01 1.17 0.00 0.11 -1.65 0.00 0.00 177.43 177.04 2qpp h LYS 225 N 0.73 0.07 -0.61 0.81 1.57 -0.78 -2.38 116.57 115.99 2qpp h LYS 225 Ca 0.08 -0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.98 2qpp h LYS 225 Cb 0.84 -0.02 -0.10 0.00 0.08 0.00 0.00 32.23 33.03 2qpp h LYS 225 CO 0.07 0.05 0.04 0.00 -0.57 0.00 0.00 179.45 179.04 2qpp h ALA 226 N 1.21 0.63 -0.87 3.86 0.00 -0.50 0.53 119.26 124.11 2qpp h ALA 226 Ca 0.12 0.17 0.04 0.00 0.00 0.00 0.00 54.91 55.24 2qpp h ALA 226 Cb 0.15 0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 2qpp h ALA 226 CO -0.20 -0.37 0.56 0.74 0.00 0.00 0.00 179.25 179.98 2qpp h PHE 227 N 0.15 1.05 -0.10 0.00 -1.00 -1.21 -2.66 116.94 113.16 2qpp h PHE 227 Ca 0.32 0.03 -0.14 0.00 2.81 0.00 0.00 57.97 60.99 2qpp h PHE 227 Cb 0.51 -0.35 -0.01 0.00 3.61 0.00 0.00 35.95 39.71 2qpp h PHE 227 CO -0.33 0.59 -0.53 1.49 -1.61 0.00 0.00 178.31 177.91 2qpp h GLU 228 N 1.07 0.30 -0.83 1.51 4.57 -0.45 0.30 114.58 121.04 2qpp h GLU 228 Ca 0.36 -0.18 0.02 0.00 -1.18 0.00 0.00 59.36 58.38 2qpp h GLU 228 Cb 0.05 0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 28.61 2qpp h GLU 228 CO -0.13 0.76 0.54 1.88 -1.18 0.00 0.00 179.01 180.88 2qpp h TYR 229 N 0.23 1.02 -0.68 0.92 -1.99 -0.80 -0.12 116.97 115.56 2qpp h TYR 229 Ca 0.01 0.03 -0.06 0.00 2.00 0.00 0.00 58.73 60.71 2qpp h TYR 229 Cb 1.01 -0.34 -0.03 0.00 2.00 0.00 0.00 36.73 39.37 2qpp h TYR 229 CO 0.02 0.62 0.21 -0.91 -0.00 0.00 0.00 178.16 178.10 2qpp h ASN 230 N 1.08 0.99 -0.89 3.88 2.35 -1.10 -2.36 115.58 119.53 2qpp h ASN 230 Ca 0.32 -0.21 0.09 0.00 -0.55 0.00 0.00 56.30 55.95 2qpp h ASN 230 Cb -0.06 -0.26 -0.07 0.00 0.05 0.00 0.00 38.32 37.97 2qpp h ASN 230 CO -0.09 0.94 0.54 0.24 -1.65 0.00 0.00 177.43 177.41 2qpp h MET 231 N 0.99 0.90 -0.15 0.81 2.86 -0.09 0.41 114.93 120.67 2qpp h MET 231 Ca 0.22 -0.05 -0.14 0.00 -2.06 0.00 0.00 59.70 57.67 2qpp h MET 231 Cb 0.30 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.75 2qpp h MET 231 CO -0.01 0.59 -0.50 1.96 1.06 0.00 0.00 176.91 180.02 2qpp h GLN 232 N 0.93 0.40 -0.22 1.72 1.08 -0.77 0.19 115.11 118.43 2qpp h GLN 232 Ca 0.42 -0.23 -0.05 0.00 -1.45 0.00 0.00 58.65 57.33 2qpp h GLN 232 Cb 0.31 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.76 2qpp h GLN 232 CO -0.22 0.81 -0.06 0.82 -0.95 0.00 0.00 178.83 179.23 2qpp h ILE 233 N 0.32 1.29 -0.69 2.54 2.04 -0.90 -0.72 117.51 121.38 2qpp h ILE 233 Ca 0.01 -1.07 0.03 0.00 1.00 0.00 0.00 64.86 64.84 2qpp h ILE 233 Cb 1.00 1.53 -0.05 0.00 -0.74 0.00 0.00 36.82 38.56 2qpp h ILE 233 CO 0.09 0.33 0.42 -0.26 0.00 0.00 0.00 178.15 178.73 2qpp h PHE 234 N 0.16 0.79 -0.59 1.37 0.04 -0.71 0.23 116.94 118.24 2qpp h PHE 234 Ca 0.06 0.02 -0.07 0.00 2.80 0.00 0.00 57.97 60.78 2qpp h PHE 234 Cb 0.52 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.39 2qpp h PHE 234 CO 0.05 0.44 0.09 -0.97 -0.60 0.00 0.00 178.31 177.32 2qpp h ASN 235 N 0.82 0.94 -0.47 2.17 -1.24 -0.55 -1.90 115.58 115.36 2qpp h ASN 235 Ca 0.28 -0.26 -0.10 0.00 0.71 0.00 0.00 56.30 56.92 2qpp h ASN 235 Cb 0.05 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 38.83 2qpp h ASN 235 CO -0.12 0.97 -0.12 -0.08 -1.29 0.00 0.00 177.43 176.79 2qpp h GLU 236 N 0.88 0.90 -0.28 6.67 4.81 -0.78 -2.62 114.58 124.17 2qpp h GLU 236 Ca 0.18 -0.35 -0.06 0.00 -0.13 0.00 0.00 59.36 59.00 2qpp h GLU 236 Cb 0.43 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.75 2qpp h GLU 236 CO 0.01 1.00 -0.07 -0.07 -0.73 0.00 0.00 179.01 179.15 2qpp h LEU 237 N 0.75 0.42 -0.44 1.64 3.38 -0.81 -2.15 115.31 118.10 2qpp h LEU 237 Ca 0.12 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 2qpp h LEU 237 Cb 0.67 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 2qpp h LEU 237 CO 0.05 0.54 -0.02 -0.78 0.09 0.00 0.00 178.44 178.31 2qpp h ASP 238 N 0.42 0.77 -0.82 -0.43 3.58 -1.31 -2.58 116.42 116.06 2qpp h ASP 238 Ca 0.09 -0.32 0.09 0.00 0.42 0.00 0.00 57.03 57.30 2qpp h ASP 238 Cb 0.39 -0.21 -0.07 0.00 1.72 0.00 0.00 39.33 41.16 2qpp h ASP 238 CO 0.02 0.91 0.47 1.56 -2.88 0.00 0.00 179.24 179.32 2qpp h GLN 239 N 0.62 0.77 0.00 0.28 4.20 -1.05 -0.34 115.11 119.60 2qpp h GLN 239 Ca 0.12 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.75 2qpp h GLN 239 Cb 0.53 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 2qpp h GLN 239 CO 0.03 0.51 -0.18 0.00 -0.67 0.00 0.00 178.83 178.52 2qpp h ALA 240 N 1.44 1.51 -0.29 3.87 0.00 -1.30 -2.95 119.26 121.54 2qpp h ALA 240 Ca 0.39 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2qpp h ALA 240 Cb 0.34 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2qpp h ALA 240 CO -0.24 0.23 0.13 0.78 0.00 0.00 0.00 179.25 180.15 2qpp h GLY 241 N 0.73 0.46 0.00 0.00 0.00 -0.65 -3.51 103.07 100.09 2qpp h GLY 241 Ca -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2qpp h GLY 241 CO 0.02 0.22 0.00 1.44 0.00 0.00 0.00 176.54 178.23