#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qy7 s TYR 21 N 0.00 2.62 0.97 1.20 1.51 -1.26 -5.13 117.35 117.25 2qy7 s TYR 21 Ca 0.00 -0.23 -0.12 0.00 -1.01 0.00 0.00 57.07 55.71 2qy7 s TYR 21 Cb 0.00 -1.23 0.17 0.00 -0.11 0.00 0.00 41.96 40.79 2qy7 s TYR 21 CO 0.00 0.57 1.09 -1.54 -1.11 0.00 0.00 175.55 174.56 2qy7 s SER 22 N -3.18 2.89 0.22 2.29 1.04 -1.26 -4.83 113.70 110.87 2qy7 s SER 22 Ca 0.28 1.28 -0.07 0.00 0.48 0.00 0.00 55.95 57.92 2qy7 s SER 22 Cb -0.08 -1.96 0.30 0.00 0.10 0.00 0.00 66.02 64.39 2qy7 s SER 22 CO 0.17 -2.98 1.81 -0.08 0.98 0.00 0.00 173.24 173.14 2qy7 h GLU 23 N -1.79 0.73 -0.17 4.02 4.81 -2.00 -0.97 114.58 119.21 2qy7 h GLU 23 Ca -0.53 -0.04 -0.20 0.00 -0.13 0.00 0.00 59.36 58.46 2qy7 h GLU 23 Cb 1.31 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.53 2qy7 h GLU 23 CO 0.57 0.48 -0.69 0.97 -0.73 0.00 0.00 179.01 179.61 2qy7 h ILE 24 N 0.75 1.30 -0.82 2.32 6.09 -1.97 -2.05 117.51 123.14 2qy7 h ILE 24 Ca 0.34 -1.93 0.05 0.00 -1.37 0.00 0.00 64.86 61.95 2qy7 h ILE 24 Cb 0.23 1.90 -0.06 0.00 0.47 0.00 0.00 36.82 39.37 2qy7 h ILE 24 CO -0.20 0.61 0.51 -0.33 -3.07 0.00 0.00 178.15 175.67 2qy7 h GLU 25 N 0.50 0.92 -0.58 2.19 5.08 -1.82 -1.65 114.58 119.23 2qy7 h GLU 25 Ca -0.03 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 2qy7 h GLU 25 Cb 1.29 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 2qy7 h GLU 25 CO 0.14 0.61 0.17 0.77 -1.00 0.00 0.00 179.01 179.70 2qy7 h SER 26 N 0.95 0.82 -0.37 1.42 0.02 -0.96 -1.18 113.55 114.24 2qy7 h SER 26 Ca 0.35 -0.14 -0.08 0.00 -0.84 0.00 0.00 61.79 61.08 2qy7 h SER 26 Cb 0.12 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 2qy7 h SER 26 CO -0.15 0.78 -0.07 0.11 -1.14 0.00 0.00 176.83 176.36 2qy7 h LYS 27 N 0.86 0.70 -0.51 3.45 1.57 -0.92 -0.65 116.57 121.06 2qy7 h LYS 27 Ca 0.19 -0.26 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2qy7 h LYS 27 Cb 0.27 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 2qy7 h LYS 27 CO -0.01 0.84 0.31 0.28 -0.57 0.00 0.00 179.45 180.30 2qy7 h VAL 28 N 0.50 1.16 -0.64 0.50 2.07 -1.13 -0.60 116.25 118.10 2qy7 h VAL 28 Ca 0.10 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.21 2qy7 h VAL 28 Cb 0.57 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 2qy7 h VAL 28 CO 0.03 0.16 0.21 0.03 0.02 0.00 0.00 177.57 178.02 2qy7 h ARG 29 N 0.69 0.99 -0.40 1.57 3.08 -1.15 -2.27 114.38 116.89 2qy7 h ARG 29 Ca 0.18 -0.21 0.05 0.00 0.07 0.00 0.00 59.98 60.07 2qy7 h ARG 29 Cb -0.01 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 29.85 2qy7 h ARG 29 CO -0.03 0.86 0.14 1.49 -1.07 0.00 0.00 179.97 181.36 2qy7 h GLU 30 N 0.92 0.30 0.00 0.04 4.81 -1.01 -2.40 114.58 117.24 2qy7 h GLU 30 Ca 0.21 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2qy7 h GLU 30 Cb 0.28 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.59 2qy7 h GLU 30 CO -0.01 0.20 -0.01 0.00 -0.73 0.00 0.00 179.01 178.46 2qy7 h ALA 31 N 1.25 1.01 -0.34 2.92 0.00 -0.77 -2.71 119.26 120.63 2qy7 h ALA 31 Ca 0.18 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.90 2qy7 h ALA 31 Cb 0.16 -0.00 -0.11 0.00 0.00 0.00 0.00 17.79 17.83 2qy7 h ALA 31 CO -0.18 0.02 -0.15 0.25 0.00 0.00 0.00 179.25 179.19 2qy7 n THR 32 N -3.12 2.54 -1.33 0.00 -2.24 -0.88 -4.08 114.28 105.16 2qy7 n THR 32 Ca -0.01 -2.89 -0.29 0.00 -2.27 0.00 0.00 64.05 58.59 2qy7 n THR 32 Cb 0.24 -0.35 0.19 0.00 -2.10 0.00 0.00 70.33 68.30 2qy7 n THR 32 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2qy7 s ASN 33 N -2.66 2.38 0.00 3.42 2.20 -0.96 -4.31 114.94 115.02 2qy7 s ASN 33 Ca 0.44 0.85 0.29 0.00 -0.94 0.00 0.00 52.86 53.50 2qy7 s ASN 33 Cb 0.41 -1.30 1.21 0.00 -2.00 0.00 0.00 41.25 39.56 2qy7 s ASN 33 CO -0.01 -3.24 1.88 0.47 -2.94 0.00 0.00 177.10 173.26 2qy7 n ASP 34 N -4.20 0.12 -4.77 3.54 8.00 -1.26 -4.43 116.55 113.54 2qy7 n ASP 34 Ca 0.09 0.14 -0.39 0.00 0.71 0.00 0.00 54.79 55.34 2qy7 n ASP 34 Cb 0.59 -0.31 -0.01 0.00 -0.02 0.00 0.00 41.12 41.37 2qy7 n ASP 34 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2qy7 s ASP 35 N -2.85 6.37 0.00 -2.24 1.01 -1.26 -4.89 116.67 112.81 2qy7 s ASP 35 Ca 0.18 2.50 -0.02 0.00 0.71 0.00 0.00 52.55 55.93 2qy7 s ASP 35 Cb 0.19 -2.63 -0.07 0.00 1.01 0.00 0.00 42.92 41.43 2qy7 s ASP 35 CO 0.53 -0.79 1.90 -0.81 0.21 0.00 0.00 175.17 176.21 2qy7 n PRO 36 N 0.05 0.97 -3.77 8.23 -0.04 -1.26 -4.70 135.00 134.48 2qy7 n PRO 36 Ca 0.04 -0.26 -0.13 0.00 -0.04 0.00 0.00 63.50 63.11 2qy7 n PRO 36 Cb 0.45 -1.40 -0.09 0.00 -0.04 0.00 0.00 33.50 32.42 2qy7 n PRO 36 CO 0.00 0.00 0.00 -0.46 -0.04 0.00 0.00 175.50 175.00 2qy7 s TRP 37 N 0.94 -0.19 0.00 0.54 -0.00 -1.26 -5.17 118.94 113.80 2qy7 s TRP 37 Ca 0.17 0.33 0.00 0.00 -0.00 0.00 0.00 56.10 56.60 2qy7 s TRP 37 Cb 0.08 0.08 0.00 0.00 -0.00 0.00 0.00 33.47 33.64 2qy7 s TRP 37 CO 0.00 -0.34 0.00 0.41 -0.00 0.00 0.00 176.95 177.02 2qy7 n GLY 38 N 1.60 -3.04 3.81 5.86 0.00 -1.26 -4.93 105.19 107.22 2qy7 n GLY 38 Ca -0.20 -1.93 -0.33 0.00 0.00 0.00 0.00 46.02 43.56 2qy7 n GLY 38 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qy7 s PRO 39 N -0.61 3.37 0.66 1.61 0.04 -1.26 -4.97 135.00 133.85 2qy7 s PRO 39 Ca 0.00 1.19 -0.16 0.00 0.04 0.00 0.00 61.00 62.07 2qy7 s PRO 39 Cb 0.00 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2qy7 s PRO 39 CO 0.00 -0.77 1.19 -1.54 0.04 0.00 0.00 177.00 175.92 2qy7 s SER 40 N -2.79 4.74 0.21 6.66 1.04 -1.26 -4.87 113.70 117.42 2qy7 s SER 40 Ca 0.63 2.31 -0.11 0.00 0.48 0.00 0.00 55.95 59.27 2qy7 s SER 40 Cb -0.16 -2.59 0.28 0.00 0.10 0.00 0.00 66.02 63.66 2qy7 s SER 40 CO 0.36 -1.90 1.69 1.23 0.98 0.00 0.00 173.24 175.60 2qy7 h GLY 41 N 0.22 0.70 0.97 7.32 0.00 -2.00 -2.03 103.07 108.25 2qy7 h GLY 41 Ca -0.49 0.02 0.01 0.00 0.00 0.00 0.00 47.33 46.88 2qy7 h GLY 41 CO 0.53 -0.15 0.46 -1.61 0.00 0.00 0.00 176.54 175.76 2qy7 h GLN 42 N 0.19 0.90 -0.51 4.80 5.75 -1.99 -0.64 115.11 123.61 2qy7 h GLN 42 Ca 0.31 -0.05 -0.08 0.00 -0.15 0.00 0.00 58.65 58.68 2qy7 h GLN 42 Cb 0.48 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 28.81 2qy7 h GLN 42 CO -0.45 0.59 0.02 1.25 -2.65 0.00 0.00 178.83 177.60 2qy7 h LEU 43 N 0.92 0.86 -1.05 -2.39 5.85 -1.84 -1.53 115.31 116.13 2qy7 h LEU 43 Ca 0.26 -0.30 -0.06 0.00 0.84 0.00 0.00 57.88 58.63 2qy7 h LEU 43 Cb -0.08 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.70 2qy7 h LEU 43 CO -0.07 0.94 0.07 0.24 -0.34 0.00 0.00 178.44 179.29 2qy7 h MET 44 N 0.75 0.75 -0.84 1.25 2.86 -1.24 -2.11 114.93 116.35 2qy7 h MET 44 Ca 0.15 -0.17 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2qy7 h MET 44 Cb 0.49 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 32.00 2qy7 h MET 44 CO 0.02 0.72 0.51 0.78 1.06 0.00 0.00 176.91 180.00 2qy7 h GLY 45 N 0.94 1.21 0.88 8.32 0.00 -0.84 -0.65 103.07 112.94 2qy7 h GLY 45 Ca 0.15 -0.49 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 2qy7 h GLY 45 CO 0.01 0.48 0.03 0.83 0.00 0.00 0.00 176.54 177.88 2qy7 h GLU 46 N 1.14 0.51 -0.51 4.80 5.08 -0.92 -1.65 114.58 123.02 2qy7 h GLU 46 Ca 0.30 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2qy7 h GLU 46 Cb -0.06 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 2qy7 h GLU 46 CO -0.06 0.63 0.31 0.82 -1.00 0.00 0.00 179.01 179.71 2qy7 h ILE 47 N 0.32 1.16 -0.84 3.13 2.04 -1.32 -1.88 117.51 120.11 2qy7 h ILE 47 Ca 0.09 -0.35 0.08 0.00 1.00 0.00 0.00 64.86 65.68 2qy7 h ILE 47 Cb 0.38 0.46 -0.07 0.00 -0.74 0.00 0.00 36.82 36.86 2qy7 h ILE 47 CO 0.01 0.16 0.50 0.00 0.00 0.00 0.00 178.15 178.82 2qy7 h ALA 48 N 1.15 1.19 -0.71 1.87 0.00 -0.94 -1.49 119.26 120.33 2qy7 h ALA 48 Ca 0.18 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.12 2qy7 h ALA 48 Cb -0.01 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 2qy7 h ALA 48 CO -0.03 0.16 0.47 0.87 0.00 0.00 0.00 179.25 180.72 2qy7 h LYS 49 N 0.86 0.93 -0.07 0.00 1.57 -0.93 -2.56 116.57 116.38 2qy7 h LYS 49 Ca 0.39 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 59.10 2qy7 h LYS 49 Cb 0.30 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 2qy7 h LYS 49 CO -0.22 0.62 -0.06 0.00 -0.57 0.00 0.00 179.45 179.22 2qy7 h ALA 50 N 1.26 1.78 0.00 3.86 0.00 -0.48 -2.67 119.26 123.00 2qy7 h ALA 50 Ca 0.26 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2qy7 h ALA 50 Cb -0.11 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2qy7 h ALA 50 CO -0.06 0.17 -0.01 1.79 0.00 0.00 0.00 179.25 181.15 2qy7 h THR 51 N 0.10 0.09 0.00 0.00 1.35 -0.95 -1.18 112.91 112.31 2qy7 h THR 51 Ca 0.02 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.80 2qy7 h THR 51 Cb 0.17 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 67.66 2qy7 h THR 51 CO 0.01 0.01 -0.30 -0.26 -0.25 0.00 0.00 175.52 174.72 2qy7 h PHE 52 N 0.00 0.00 -3.31 4.73 -1.00 -1.57 -3.41 116.94 112.38 2qy7 h PHE 52 Ca -0.00 0.00 -0.56 0.00 2.81 0.00 0.00 57.97 60.22 2qy7 h PHE 52 Cb 0.07 0.00 -0.08 0.00 3.61 0.00 0.00 35.95 39.56 2qy7 h PHE 52 CO 0.00 0.00 0.94 -1.64 -1.61 0.00 0.00 178.31 176.00 2qy7 s MET 53 N -3.17 3.55 0.43 1.51 -1.94 -0.45 -4.91 119.30 114.33 2qy7 s MET 53 Ca 0.07 0.29 0.18 0.00 -1.71 0.00 0.00 55.69 54.52 2qy7 s MET 53 Cb 0.11 -3.99 1.10 0.00 2.01 0.00 0.00 34.83 34.06 2qy7 s MET 53 CO 0.67 -1.61 1.90 0.10 -0.01 0.00 0.00 175.02 176.08 2qy7 h TYR 54 N 9.46 0.45 0.00 -0.03 -0.00 -1.85 0.38 116.97 125.39 2qy7 h TYR 54 Ca -0.25 0.01 -0.08 0.00 0.00 0.00 0.00 58.73 58.42 2qy7 h TYR 54 Cb 1.06 -0.14 -0.01 0.00 0.00 0.00 0.00 36.73 37.63 2qy7 h TYR 54 CO 1.02 0.15 -0.72 0.93 -0.00 0.00 0.00 178.16 179.54 2qy7 h GLU 55 N 0.37 0.00 0.00 0.10 5.08 -1.93 -3.35 114.58 114.85 2qy7 h GLU 55 Ca 0.40 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.63 2qy7 h GLU 55 Cb 1.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.23 2qy7 h GLU 55 CO -0.13 0.26 -1.00 1.96 -1.00 0.00 0.00 179.01 179.11 2qy7 h GLN 56 N 0.00 0.00 -0.11 2.33 4.20 -1.23 -3.41 115.11 116.90 2qy7 h GLN 56 Ca -0.04 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.71 2qy7 h GLN 56 Cb 1.29 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 29.03 2qy7 h GLN 56 CO 0.04 0.34 -0.16 0.35 -0.67 0.00 0.00 178.83 178.73 2qy7 h PHE 57 N 0.00 -0.40 -0.48 2.96 3.57 -1.53 -2.44 116.94 118.62 2qy7 h PHE 57 Ca -0.08 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.46 2qy7 h PHE 57 Cb 1.45 0.19 -0.03 0.00 2.79 0.00 0.00 35.95 40.35 2qy7 h PHE 57 CO 0.00 -0.23 0.28 -1.35 -2.23 0.00 0.00 178.31 174.78 2qy7 h PRO 58 N -0.20 0.53 -0.63 6.41 0.11 -1.81 -0.71 132.00 135.70 2qy7 h PRO 58 Ca 0.09 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.09 2qy7 h PRO 58 Cb 0.33 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 31.29 2qy7 h PRO 58 CO -0.23 0.35 0.12 0.93 -0.21 0.00 0.00 178.00 178.96 2qy7 h GLU 59 N 0.55 1.04 -0.01 1.05 5.08 -1.81 0.32 114.58 120.80 2qy7 h GLU 59 Ca 0.20 -0.27 0.02 0.00 -1.00 0.00 0.00 59.36 58.31 2qy7 h GLU 59 Cb 0.04 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 2qy7 h GLU 59 CO -0.10 0.96 -0.15 1.25 -1.00 0.00 0.00 179.01 179.97 2qy7 h LEU 60 N 0.96 -0.43 -0.38 1.33 6.46 -1.23 -0.56 115.31 121.47 2qy7 h LEU 60 Ca 0.19 0.06 -0.08 0.00 -0.12 0.00 0.00 57.88 57.94 2qy7 h LEU 60 Cb 0.41 0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.51 2qy7 h LEU 60 CO 0.01 -0.20 -0.06 0.24 -0.62 0.00 0.00 178.44 177.80 2qy7 h MET 61 N -0.24 0.70 -0.92 1.25 2.86 -0.78 -0.85 114.93 116.96 2qy7 h MET 61 Ca 0.05 -0.26 0.04 0.00 -2.06 0.00 0.00 59.70 57.47 2qy7 h MET 61 Cb 0.31 -0.05 -0.06 0.00 0.06 0.00 0.00 31.60 31.87 2qy7 h MET 61 CO -0.15 0.84 0.60 -0.91 1.06 0.00 0.00 176.91 178.35 2qy7 h ASN 62 N 0.51 0.99 -0.37 1.22 -0.26 -0.28 -1.05 115.58 116.34 2qy7 h ASN 62 Ca 0.10 -0.01 -0.14 0.00 -0.56 0.00 0.00 56.30 55.69 2qy7 h ASN 62 Cb 0.56 -0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 37.59 2qy7 h ASN 62 CO 0.03 0.67 -0.30 -0.03 -1.06 0.00 0.00 177.43 176.74 2qy7 h MET 63 N 1.15 0.89 0.00 0.81 4.05 -0.92 -1.33 114.93 119.58 2qy7 h MET 63 Ca 0.37 -0.42 0.01 0.00 -0.28 0.00 0.00 59.70 59.38 2qy7 h MET 63 Cb 0.03 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 30.80 2qy7 h MET 63 CO -0.13 1.07 -0.06 1.25 0.23 0.00 0.00 176.91 179.27 2qy7 h LEU 64 N 0.75 -0.17 -0.96 3.39 6.46 -0.56 0.20 115.31 124.42 2qy7 h LEU 64 Ca 0.08 0.03 -0.06 0.00 -0.12 0.00 0.00 57.88 57.81 2qy7 h LEU 64 Cb 0.87 0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.85 2qy7 h LEU 64 CO 0.08 -0.09 0.06 -0.50 -0.62 0.00 0.00 178.44 177.37 2qy7 h TRP 65 N -0.10 0.85 -0.35 1.25 -0.00 -1.20 -1.67 115.95 114.72 2qy7 h TRP 65 Ca 0.02 -0.10 -0.03 0.00 -0.00 0.00 0.00 58.89 58.79 2qy7 h TRP 65 Cb 0.13 -0.24 -0.02 0.00 -0.00 0.00 0.00 29.16 29.04 2qy7 h TRP 65 CO -0.13 0.75 0.12 1.03 -0.00 0.00 0.00 178.44 180.22 2qy7 h SER 66 N 0.77 0.51 -0.20 -3.49 0.87 -1.03 0.62 113.55 111.61 2qy7 h SER 66 Ca 0.16 -0.19 -0.05 0.00 -1.23 0.00 0.00 61.79 60.47 2qy7 h SER 66 Cb 0.38 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.19 2qy7 h SER 66 CO 0.01 0.57 -0.03 0.03 -0.53 0.00 0.00 176.83 176.88 2qy7 h ARG 67 N 0.42 0.50 -0.04 2.24 2.47 -0.63 -1.55 114.38 117.79 2qy7 h ARG 67 Ca 0.12 -0.11 -0.21 0.00 -1.26 0.00 0.00 59.98 58.52 2qy7 h ARG 67 Cb 0.23 -0.07 0.01 0.00 -1.65 0.00 0.00 29.97 28.50 2qy7 h ARG 67 CO -0.01 0.55 -0.78 1.98 0.56 0.00 0.00 179.97 182.27 2qy7 h MET 68 N 0.48 0.60 0.00 0.04 4.05 -1.13 -3.41 114.93 115.56 2qy7 h MET 68 Ca 0.10 -0.59 -0.02 0.00 -0.28 0.00 0.00 59.70 58.91 2qy7 h MET 68 Cb 0.36 0.16 -0.00 0.00 -0.80 0.00 0.00 31.60 31.31 2qy7 h MET 68 CO 0.01 1.21 -1.17 1.28 0.23 0.00 0.00 176.91 178.47 2qy7 n LEU 69 N -4.04 0.00 -4.67 3.39 4.77 0.20 -4.81 117.00 111.83 2qy7 n LEU 69 Ca -0.10 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.51 2qy7 n LEU 69 Cb 0.75 0.02 -0.09 0.00 -2.33 0.00 0.00 43.42 41.78 2qy7 n LEU 69 CO 0.51 0.02 -0.09 -0.54 -1.33 0.00 0.00 177.39 175.97 2qy7 s LYS 70 N -2.19 4.12 -1.29 3.23 1.02 -0.59 -4.47 119.74 119.57 2qy7 s LYS 70 Ca -0.01 -0.11 -0.16 0.00 0.02 0.00 0.00 55.97 55.71 2qy7 s LYS 70 Cb 0.02 -3.53 0.01 0.00 -0.52 0.00 0.00 37.83 33.81 2qy7 s LYS 70 CO 0.14 0.05 0.54 -0.25 -0.92 0.00 0.00 175.35 174.92 2qy7 n ASP 71 N 4.26 -2.68 -0.66 2.83 8.00 -1.26 -4.80 116.55 122.24 2qy7 n ASP 71 Ca -0.13 -1.13 0.07 0.00 0.71 0.00 0.00 54.79 54.32 2qy7 n ASP 71 Cb 0.52 -2.58 0.10 0.00 -0.02 0.00 0.00 41.12 39.14 2qy7 n ASP 71 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2qy7 n ASN 72 N -2.65 2.50 0.05 -2.24 6.94 -1.26 -4.63 115.26 113.96 2qy7 n ASN 72 Ca -0.19 -1.72 0.12 0.00 -0.02 0.00 0.00 54.58 52.77 2qy7 n ASN 72 Cb 0.63 -0.08 0.47 0.00 -2.36 0.00 0.00 39.78 38.44 2qy7 n ASN 72 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2qy7 n LYS 73 N 0.84 0.10 0.00 -3.83 5.02 -1.26 -3.08 118.16 115.94 2qy7 n LYS 73 Ca 0.10 0.18 0.05 0.00 -2.02 0.00 0.00 58.31 56.62 2qy7 n LYS 73 Cb 0.40 -1.63 -0.01 0.00 -0.02 0.00 0.00 35.03 33.77 2qy7 n LYS 73 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2qy7 n LYS 74 N -1.80 2.50 -3.57 1.97 5.02 -1.26 -4.81 118.16 116.20 2qy7 n LYS 74 Ca 0.05 -0.47 -0.27 0.00 -2.02 0.00 0.00 58.31 55.60 2qy7 n LYS 74 Cb 0.30 -1.03 -0.10 0.00 -0.02 0.00 0.00 35.03 34.19 2qy7 n LYS 74 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2qy7 n ASN 75 N -0.45 2.84 -0.19 4.39 3.02 -1.18 -4.95 115.26 118.74 2qy7 n ASN 75 Ca 0.03 -3.21 -0.08 0.00 -0.03 0.00 0.00 54.58 51.29 2qy7 n ASN 75 Cb 0.18 -0.69 0.02 0.00 -0.61 0.00 0.00 39.78 38.68 2qy7 n ASN 75 CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 2qy7 h TRP 76 N 4.71 0.85 -0.93 3.10 5.08 -1.87 -2.82 115.95 124.07 2qy7 h TRP 76 Ca 0.17 -0.08 0.02 0.00 1.08 0.00 0.00 58.89 60.08 2qy7 h TRP 76 Cb 0.73 -0.25 -0.05 0.00 -3.00 0.00 0.00 29.16 26.60 2qy7 h TRP 76 CO 0.64 0.73 0.61 0.00 -1.28 0.00 0.00 178.44 179.14 2qy7 h ARG 77 N 0.73 1.20 -0.58 0.12 3.08 -1.92 -0.30 114.38 116.71 2qy7 h ARG 77 Ca 0.17 -0.07 0.10 0.00 0.07 0.00 0.00 59.98 60.25 2qy7 h ARG 77 Cb 0.27 -0.27 -0.08 0.00 0.08 0.00 0.00 29.97 29.97 2qy7 h ARG 77 CO -0.01 0.79 0.17 -0.09 -1.07 0.00 0.00 179.97 179.77 2qy7 h ARG 78 N 1.24 0.31 -0.12 0.04 2.43 -1.69 0.10 114.38 116.69 2qy7 h ARG 78 Ca 0.35 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.47 2qy7 h ARG 78 Cb -0.11 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.37 2qy7 h ARG 78 CO -0.08 0.21 -0.05 0.28 -1.51 0.00 0.00 179.97 178.81 2qy7 h VAL 79 N 0.32 1.31 -0.40 0.20 2.07 -1.08 -1.16 116.25 117.52 2qy7 h VAL 79 Ca 0.30 -1.07 0.05 0.00 0.82 0.00 0.00 66.70 66.80 2qy7 h VAL 79 Cb 0.40 1.78 -0.05 0.00 -1.52 0.00 0.00 31.29 31.90 2qy7 h VAL 79 CO -0.34 0.31 0.11 0.22 0.02 0.00 0.00 177.57 177.89 2qy7 h TYR 80 N -0.11 0.20 -0.26 1.57 3.20 -0.90 -1.31 116.97 119.36 2qy7 h TYR 80 Ca 0.03 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.84 2qy7 h TYR 80 Cb 0.51 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 2qy7 h TYR 80 CO 0.06 0.06 -0.16 0.87 -1.64 0.00 0.00 178.16 177.35 2qy7 h LYS 81 N 0.26 0.46 -0.13 1.82 1.57 -0.74 0.07 116.57 119.88 2qy7 h LYS 81 Ca 0.19 -0.14 -0.10 0.00 -1.87 0.00 0.00 60.65 58.73 2qy7 h LYS 81 Cb 0.20 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 2qy7 h LYS 81 CO -0.22 0.61 -0.37 0.66 -0.57 0.00 0.00 179.45 179.57 2qy7 h SER 82 N 0.42 0.29 -0.20 0.86 4.64 -0.69 0.56 113.55 119.43 2qy7 h SER 82 Ca 0.07 -0.11 -0.08 0.00 -0.47 0.00 0.00 61.79 61.20 2qy7 h SER 82 Cb 0.53 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 62.54 2qy7 h SER 82 CO 0.03 0.64 -0.20 -0.07 -0.87 0.00 0.00 176.83 176.36 2qy7 h LEU 83 N 0.24 0.53 -1.09 5.97 3.38 -0.74 0.96 115.31 124.56 2qy7 h LEU 83 Ca 0.03 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.52 2qy7 h LEU 83 Cb 0.76 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.32 2qy7 h LEU 83 CO 0.06 0.89 0.56 -0.07 0.09 0.00 0.00 178.44 179.97 2qy7 h LEU 84 N 0.17 1.03 -0.24 1.67 3.38 -0.79 -0.12 115.31 120.41 2qy7 h LEU 84 Ca 0.03 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 2qy7 h LEU 84 Cb 0.74 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2qy7 h LEU 84 CO 0.05 0.77 -0.09 0.25 0.09 0.00 0.00 178.44 179.51 2qy7 h LEU 85 N 1.20 0.49 -0.98 1.67 5.85 -0.82 -2.04 115.31 120.69 2qy7 h LEU 85 Ca 0.32 -0.39 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 2qy7 h LEU 85 Cb -0.10 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 2qy7 h LEU 85 CO -0.06 0.77 0.60 0.25 -0.34 0.00 0.00 178.44 179.66 2qy7 h LEU 86 N 0.21 1.15 -0.77 2.25 5.85 -0.46 -0.08 115.31 123.46 2qy7 h LEU 86 Ca 0.06 -0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2qy7 h LEU 86 Cb 0.58 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 2qy7 h LEU 86 CO 0.03 0.86 0.35 0.00 -0.34 0.00 0.00 178.44 179.35 2qy7 h ALA 87 N 1.34 0.99 -0.68 1.25 0.00 -0.92 0.12 119.26 121.36 2qy7 h ALA 87 Ca 0.35 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 2qy7 h ALA 87 Cb -0.09 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.37 2qy7 h ALA 87 CO -0.07 0.57 0.21 -0.92 0.00 0.00 0.00 179.25 179.05 2qy7 h TYR 88 N 1.09 1.10 -0.17 0.00 3.20 -0.78 -3.03 116.97 118.38 2qy7 h TYR 88 Ca 0.26 -0.11 -0.16 0.00 3.14 0.00 0.00 58.73 61.86 2qy7 h TYR 88 Cb 0.14 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 2qy7 h TYR 88 CO 0.01 0.88 -0.56 -0.07 -1.64 0.00 0.00 178.16 176.78 2qy7 h LEU 89 N 0.99 0.58 -1.57 2.82 3.38 -0.53 0.03 115.31 121.02 2qy7 h LEU 89 Ca 0.22 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2qy7 h LEU 89 Cb 0.30 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2qy7 h LEU 89 CO -0.01 1.02 -0.04 0.40 0.09 0.00 0.00 178.44 179.90 2qy7 h ILE 90 N 0.40 1.13 0.13 1.22 2.04 -0.78 0.14 117.51 121.78 2qy7 h ILE 90 Ca 0.01 -0.52 -0.32 0.00 1.00 0.00 0.00 64.86 65.03 2qy7 h ILE 90 Cb 1.10 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 38.24 2qy7 h ILE 90 CO 0.10 0.17 -1.63 0.03 0.00 0.00 0.00 178.15 176.82 2qy7 h ARG 91 N 0.21 0.27 0.00 2.37 3.08 -1.39 -3.43 114.38 115.50 2qy7 h ARG 91 Ca 0.05 -0.47 0.00 0.00 0.07 0.00 0.00 59.98 59.63 2qy7 h ARG 91 Cb 0.22 0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.45 2qy7 h ARG 91 CO 0.01 1.14 -0.51 0.09 -1.07 0.00 0.00 179.97 179.63 2qy7 n ASN 92 N -3.47 1.66 -2.13 7.04 3.02 -0.02 -4.50 115.26 116.86 2qy7 n ASN 92 Ca -0.20 -0.36 -0.01 0.00 -0.03 0.00 0.00 54.58 53.98 2qy7 n ASN 92 Cb 1.05 1.05 0.01 0.00 -0.61 0.00 0.00 39.78 41.28 2qy7 n ASN 92 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qy7 n GLY 93 N 1.53 1.13 3.56 7.41 0.00 0.46 -4.86 105.19 114.42 2qy7 n GLY 93 Ca 0.00 -2.01 -0.37 0.00 0.00 0.00 0.00 46.02 43.64 2qy7 n GLY 93 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2qy7 n SER 94 N -2.99 -0.01 0.23 1.61 2.88 -1.26 -4.87 113.62 109.21 2qy7 n SER 94 Ca 0.01 0.72 0.14 0.00 -1.33 0.00 0.00 58.87 58.41 2qy7 n SER 94 Cb 0.03 -1.32 0.79 0.00 -0.75 0.00 0.00 64.21 62.96 2qy7 n SER 94 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2qy7 h GLU 95 N 0.13 0.00 0.00 -1.46 4.57 -1.93 -1.29 114.58 114.59 2qy7 h GLU 95 Ca -0.47 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 57.70 2qy7 h GLU 95 Cb 1.36 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.95 2qy7 h GLU 95 CO 0.48 0.00 -0.03 0.00 -1.18 0.00 0.00 179.01 178.27 2qy7 h ARG 96 N 0.00 0.00 -0.76 1.92 3.08 -1.91 -1.27 114.38 115.43 2qy7 h ARG 96 Ca 0.05 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 2qy7 h ARG 96 Cb 0.24 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.25 2qy7 h ARG 96 CO -0.00 0.03 0.42 0.28 -1.07 0.00 0.00 179.97 179.64 2qy7 h VAL 97 N 0.00 1.23 -0.33 2.04 2.07 -1.57 -1.64 116.25 118.05 2qy7 h VAL 97 Ca -0.00 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 66.97 2qy7 h VAL 97 Cb 0.07 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.03 2qy7 h VAL 97 CO 0.00 0.25 0.20 0.58 0.02 0.00 0.00 177.57 178.62 2qy7 h VAL 98 N 1.05 1.06 -0.56 2.57 2.07 -1.35 -0.88 116.25 120.20 2qy7 h VAL 98 Ca 0.27 -0.14 -0.04 0.00 0.82 0.00 0.00 66.70 67.61 2qy7 h VAL 98 Cb 0.02 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 2qy7 h VAL 98 CO -0.04 0.07 0.19 0.74 0.02 0.00 0.00 177.57 178.55 2qy7 h THR 99 N 0.41 1.23 0.18 2.57 2.02 -1.33 -1.67 112.91 116.33 2qy7 h THR 99 Ca 0.12 -0.76 -0.01 0.00 0.77 0.00 0.00 66.41 66.53 2qy7 h THR 99 Cb -0.02 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.07 2qy7 h THR 99 CO -0.05 0.29 -0.09 -1.28 0.37 0.00 0.00 175.52 174.76 2qy7 h SER 100 N 0.77 -0.21 -0.92 4.18 0.87 -1.11 -1.03 113.55 116.11 2qy7 h SER 100 Ca 0.18 0.00 0.09 0.00 -1.23 0.00 0.00 61.79 60.83 2qy7 h SER 100 Cb 0.25 0.05 -0.07 0.00 -0.44 0.00 0.00 62.40 62.19 2qy7 h SER 100 CO -0.01 -0.14 0.56 0.00 -0.53 0.00 0.00 176.83 176.71 2qy7 h ALA 101 N 0.56 1.32 -0.40 6.23 0.00 -1.00 -1.47 119.26 124.49 2qy7 h ALA 101 Ca -0.03 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 2qy7 h ALA 101 Cb 0.20 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2qy7 h ALA 101 CO 0.04 0.24 -0.32 0.00 0.00 0.00 0.00 179.25 179.20 2qy7 h ARG 102 N 0.96 0.91 0.00 0.00 3.08 -1.08 -1.00 114.38 117.25 2qy7 h ARG 102 Ca 0.43 -0.44 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2qy7 h ARG 102 Cb 0.33 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2qy7 h ARG 102 CO -0.22 1.10 0.00 0.93 -1.07 0.00 0.00 179.97 180.70 2qy7 h GLU 103 N 0.76 0.00 -0.18 0.04 5.08 -0.73 -2.68 114.58 116.87 2qy7 h GLU 103 Ca 0.08 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2qy7 h GLU 103 Cb 0.90 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.15 2qy7 h GLU 103 CO 0.08 0.00 -0.01 0.72 -1.00 0.00 0.00 179.01 178.81 2qy7 n HIS 104 N -2.38 0.63 0.05 4.33 8.25 -0.60 -4.79 115.22 120.72 2qy7 n HIS 104 Ca 0.03 -0.95 0.09 0.00 -0.26 0.00 0.00 57.72 56.64 2qy7 n HIS 104 Cb 0.32 -0.27 0.54 0.00 1.12 0.00 0.00 29.99 31.71 2qy7 n HIS 104 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 2qy7 h ILE 105 N 1.18 0.97 0.00 1.59 6.09 -0.82 -1.51 117.51 125.01 2qy7 h ILE 105 Ca 0.01 -0.10 -0.14 0.00 -1.37 0.00 0.00 64.86 63.26 2qy7 h ILE 105 Cb 1.30 0.66 -0.02 0.00 0.47 0.00 0.00 36.82 39.23 2qy7 h ILE 105 CO 0.15 0.05 -0.82 1.88 -3.07 0.00 0.00 178.15 176.35 2qy7 h TYR 106 N 0.29 0.00 -0.84 2.19 -1.99 -1.86 -1.50 116.97 113.26 2qy7 h TYR 106 Ca 0.16 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.88 2qy7 h TYR 106 Cb 0.26 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 38.95 2qy7 h TYR 106 CO -0.00 0.61 0.49 -0.44 -0.00 0.00 0.00 178.16 178.82 2qy7 h ASP 107 N 0.00 1.01 -0.16 3.88 3.32 -1.67 -1.68 116.42 121.13 2qy7 h ASP 107 Ca -0.05 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 2qy7 h ASP 107 Cb 1.51 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.80 2qy7 h ASP 107 CO 0.07 0.79 0.08 -0.07 -1.72 0.00 0.00 179.24 178.39 2qy7 h LEU 108 N 1.15 0.21 -2.55 1.55 3.38 -1.22 -2.58 115.31 115.25 2qy7 h LEU 108 Ca 0.30 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 2qy7 h LEU 108 Cb -0.02 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 2qy7 h LEU 108 CO -0.05 0.26 -0.01 0.03 0.09 0.00 0.00 178.44 178.75 2qy7 h ARG 109 N 0.14 0.00 0.00 1.13 3.08 -1.07 -1.86 114.38 115.80 2qy7 h ARG 109 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2qy7 h ARG 109 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2qy7 h ARG 109 CO -0.01 0.01 0.00 0.66 -1.07 0.00 0.00 179.97 179.57 2qy7 h SER 110 N 0.00 0.00 0.03 7.04 4.64 -0.88 -1.85 113.55 122.54 2qy7 h SER 110 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qy7 h SER 110 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2qy7 h SER 110 CO 0.00 0.00 -0.06 0.18 -0.87 0.00 0.00 176.83 176.08 2qy7 n LEU 111 N -2.37 1.60 0.14 5.97 4.77 -0.70 -4.23 117.00 122.18 2qy7 n LEU 111 Ca 0.00 -0.52 0.12 0.00 -0.03 0.00 0.00 56.01 55.58 2qy7 n LEU 111 Cb 0.14 -0.02 0.50 0.00 -2.33 0.00 0.00 43.42 41.71 2qy7 n LEU 111 CO 0.16 0.27 0.86 -0.62 -1.33 0.00 0.00 177.39 176.73 2qy7 n GLU 112 N 0.14 0.20 -0.40 3.23 1.02 -0.69 -1.67 120.64 122.46 2qy7 n GLU 112 Ca 0.17 0.44 0.06 0.00 -0.02 0.00 0.00 57.16 57.81 2qy7 n GLU 112 Cb 0.39 -1.89 0.19 0.00 -0.02 0.00 0.00 31.44 30.11 2qy7 n GLU 112 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2qy7 n ASN 113 N -2.26 2.57 -4.69 1.62 3.02 -1.26 -4.79 115.26 109.48 2qy7 n ASN 113 Ca 0.02 -3.38 -0.45 0.00 -0.03 0.00 0.00 54.58 50.74 2qy7 n ASN 113 Cb 0.22 -0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 38.84 2qy7 n ASN 113 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qy7 n TYR 114 N -1.11 2.39 -4.45 3.10 9.36 -0.67 -4.97 117.16 120.81 2qy7 n TYR 114 Ca 0.21 0.27 -0.34 0.00 3.32 0.00 0.00 57.90 61.36 2qy7 n TYR 114 Cb 0.78 -2.55 -0.13 0.00 -0.63 0.00 0.00 39.34 36.81 2qy7 n TYR 114 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 2qy7 s HIS 115 N 0.63 2.95 -0.29 2.98 5.65 -1.26 -4.59 115.29 121.36 2qy7 s HIS 115 Ca 0.74 -0.48 -0.13 0.00 0.25 0.00 0.00 55.06 55.44 2qy7 s HIS 115 Cb -0.62 -1.94 0.12 0.00 -1.18 0.00 0.00 32.58 28.95 2qy7 s HIS 115 CO 0.41 -0.16 0.71 0.12 -0.65 0.00 0.00 174.74 175.18 2qy7 s PHE 116 N 0.51 -1.14 -0.14 3.88 5.36 -1.26 -4.87 117.98 120.32 2qy7 s PHE 116 Ca -0.05 2.09 0.02 0.00 -0.96 0.00 0.00 56.93 58.04 2qy7 s PHE 116 Cb -0.15 0.69 0.01 0.00 -0.34 0.00 0.00 43.02 43.23 2qy7 s PHE 116 CO 0.03 -0.57 -0.21 0.08 -1.46 0.00 0.00 175.22 173.09 2qy7 s VAL 117 N 2.31 2.02 1.11 3.12 1.01 -1.26 -0.64 120.40 128.07 2qy7 s VAL 117 Ca -0.07 -0.95 -0.18 0.00 0.00 0.00 0.00 61.98 60.77 2qy7 s VAL 117 Cb -0.08 -1.80 0.25 0.00 0.00 0.00 0.00 36.38 34.75 2qy7 s VAL 117 CO -0.19 0.54 1.19 1.51 0.00 0.00 0.00 175.10 178.15 2qy7 s ASP 118 N 0.88 1.75 0.53 3.32 1.47 0.28 -4.88 116.67 120.03 2qy7 s ASP 118 Ca -0.06 0.49 -0.20 0.00 1.18 0.00 0.00 52.55 53.97 2qy7 s ASP 118 Cb -0.15 -0.66 -0.06 0.00 -0.34 0.00 0.00 42.92 41.71 2qy7 s ASP 118 CO -0.03 -3.60 1.12 -1.61 0.68 0.00 0.00 175.17 171.73 2qy7 s GLU 119 N -5.59 3.44 -2.00 2.11 0.41 -1.26 -2.00 118.70 113.80 2qy7 s GLU 119 Ca 0.72 1.58 0.00 0.00 -0.41 0.00 0.00 54.97 56.86 2qy7 s GLU 119 Cb -0.07 -2.03 0.00 0.00 -1.78 0.00 0.00 34.13 30.25 2qy7 s GLU 119 CO 0.55 -0.77 0.00 -2.39 -0.49 0.00 0.00 175.26 172.15 2qy7 n HIS 120 N -1.23 -0.17 -1.31 1.61 1.44 -1.26 -4.48 115.22 109.83 2qy7 n HIS 120 Ca 0.11 0.00 -0.03 0.00 -2.01 0.00 0.00 57.72 55.79 2qy7 n HIS 120 Cb 0.51 -3.31 -0.01 0.00 0.12 0.00 0.00 29.99 27.30 2qy7 n HIS 120 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2qy7 n GLY 121 N -0.40 0.53 3.68 -1.39 0.00 -0.85 -5.03 105.19 101.73 2qy7 n GLY 121 Ca -0.19 -0.90 -0.40 0.00 0.00 0.00 0.00 46.02 44.53 2qy7 n GLY 121 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qy7 s LYS 122 N -2.69 4.28 -0.49 1.61 2.20 -1.26 -4.82 119.74 118.57 2qy7 s LYS 122 Ca 0.00 0.64 -0.27 0.00 -0.36 0.00 0.00 55.97 55.98 2qy7 s LYS 122 Cb 0.00 -3.53 -0.03 0.00 -1.51 0.00 0.00 37.83 32.76 2qy7 s LYS 122 CO 0.00 -0.12 1.94 0.34 -0.36 0.00 0.00 175.35 177.16 2qy7 s ASP 123 N 1.03 5.34 0.10 1.43 -1.08 -1.26 -0.55 116.67 121.67 2qy7 s ASP 123 Ca 0.30 0.83 0.22 0.00 -0.52 0.00 0.00 52.55 53.38 2qy7 s ASP 123 Cb -0.16 -2.52 -0.14 0.00 -1.46 0.00 0.00 42.92 38.64 2qy7 s ASP 123 CO 0.12 -2.23 0.81 0.00 0.52 0.00 0.00 175.17 174.39 2qy7 n GLN 124 N 8.89 0.61 0.02 4.34 1.13 0.19 -4.22 117.38 128.34 2qy7 n GLN 124 Ca 0.24 -0.02 0.16 0.00 -1.94 0.00 0.00 57.00 55.45 2qy7 n GLN 124 Cb 0.51 -1.69 0.63 0.00 0.11 0.00 0.00 30.24 29.80 2qy7 n GLN 124 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2qy7 h GLY 125 N 4.03 0.15 1.59 1.08 0.00 -1.55 -1.20 103.07 107.17 2qy7 h GLY 125 Ca 0.00 -0.04 0.03 0.00 0.00 0.00 0.00 47.33 47.32 2qy7 h GLY 125 CO 0.00 0.02 0.21 1.19 0.00 0.00 0.00 176.54 177.96 2qy7 h ILE 126 N 0.10 1.00 -0.65 2.60 2.10 -1.81 -1.56 117.51 119.29 2qy7 h ILE 126 Ca 0.22 -0.10 -0.04 0.00 1.08 0.00 0.00 64.86 66.02 2qy7 h ILE 126 Cb 0.74 0.69 -0.03 0.00 -1.09 0.00 0.00 36.82 37.13 2qy7 h ILE 126 CO -0.02 0.05 0.24 0.78 -1.08 0.00 0.00 178.15 178.12 2qy7 h ASN 127 N 0.28 0.91 0.10 2.19 2.35 -1.50 -1.83 115.58 118.09 2qy7 h ASN 127 Ca 0.13 -0.18 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 2qy7 h ASN 127 Cb 0.15 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.29 2qy7 h ASN 127 CO -0.03 0.85 -0.05 0.40 -1.65 0.00 0.00 177.43 176.95 2qy7 h ILE 128 N 0.92 0.96 -0.27 2.81 1.08 -1.44 -1.46 117.51 120.12 2qy7 h ILE 128 Ca 0.21 -0.25 0.04 0.00 -0.39 0.00 0.00 64.86 64.48 2qy7 h ILE 128 Cb 0.24 1.12 -0.04 0.00 -3.07 0.00 0.00 36.82 35.07 2qy7 h ILE 128 CO -0.01 0.06 0.01 0.03 -0.69 0.00 0.00 178.15 177.55 2qy7 h ARG 129 N -0.25 0.09 -0.35 2.37 3.08 -1.23 0.28 114.38 118.37 2qy7 h ARG 129 Ca -0.01 -0.01 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 2qy7 h ARG 129 Cb 0.21 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 2qy7 h ARG 129 CO 0.02 0.06 -0.05 1.96 -1.07 0.00 0.00 179.97 180.90 2qy7 h GLN 130 N 0.10 0.65 -0.59 0.04 4.20 -1.35 -2.51 115.11 115.65 2qy7 h GLN 130 Ca 0.13 -0.23 -0.02 0.00 0.06 0.00 0.00 58.65 58.58 2qy7 h GLN 130 Cb 0.16 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 2qy7 h GLN 130 CO -0.20 0.79 0.27 -0.22 -0.67 0.00 0.00 178.83 178.80 2qy7 h LYS 131 N 0.45 0.85 -0.31 1.46 1.63 -1.03 -1.94 116.57 117.69 2qy7 h LYS 131 Ca 0.09 -0.13 -0.13 0.00 -0.85 0.00 0.00 60.65 59.63 2qy7 h LYS 131 Cb 0.53 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 32.00 2qy7 h LYS 131 CO 0.03 0.70 -0.34 -0.24 -3.45 0.00 0.00 179.45 176.15 2qy7 h VAL 132 N 0.80 1.28 -0.32 2.00 3.04 -0.95 -1.60 116.25 120.51 2qy7 h VAL 132 Ca 0.20 -1.49 0.01 0.00 -1.01 0.00 0.00 66.70 64.41 2qy7 h VAL 132 Cb 0.14 1.41 -0.02 0.00 -2.01 0.00 0.00 31.29 30.81 2qy7 h VAL 132 CO -0.02 0.48 0.19 0.11 -1.01 0.00 0.00 177.57 177.32 2qy7 h LYS 133 N 0.58 0.37 -0.39 4.17 1.57 -1.23 0.10 116.57 121.75 2qy7 h LYS 133 Ca 0.06 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.88 2qy7 h LYS 133 Cb 0.86 -0.08 -0.05 0.00 0.08 0.00 0.00 32.23 33.03 2qy7 h LYS 133 CO 0.07 0.25 0.08 0.93 -0.57 0.00 0.00 179.45 180.21 2qy7 h GLU 134 N 0.38 0.20 -0.22 3.15 4.39 -1.12 -1.39 114.58 119.97 2qy7 h GLU 134 Ca 0.12 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 2qy7 h GLU 134 Cb -0.01 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 2qy7 h GLU 134 CO -0.05 0.13 0.03 1.25 -1.16 0.00 0.00 179.01 179.21 2qy7 h LEU 135 N 0.21 0.36 -0.76 1.33 5.85 -1.03 -1.25 115.31 120.03 2qy7 h LEU 135 Ca 0.19 -0.27 0.06 0.00 0.84 0.00 0.00 57.88 58.70 2qy7 h LEU 135 Cb 0.22 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.10 2qy7 h LEU 135 CO -0.24 0.53 0.45 0.58 -0.34 0.00 0.00 178.44 179.42 2qy7 h VAL 136 N 0.16 1.01 -0.66 1.05 2.07 -0.64 0.12 116.25 119.37 2qy7 h VAL 136 Ca 0.07 -0.28 -0.07 0.00 0.82 0.00 0.00 66.70 67.23 2qy7 h VAL 136 Cb 0.33 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.18 2qy7 h VAL 136 CO 0.01 0.15 0.14 -0.33 0.02 0.00 0.00 177.57 177.56 2qy7 h GLU 137 N 0.83 1.07 -0.16 1.57 5.08 -1.09 -1.97 114.58 119.91 2qy7 h GLU 137 Ca 0.33 -0.27 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 2qy7 h GLU 137 Cb 0.17 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2qy7 h GLU 137 CO -0.17 0.97 -0.01 0.35 -1.00 0.00 0.00 179.01 179.15 2qy7 h PHE 138 N 0.99 0.32 0.00 4.33 3.57 -0.81 -2.99 116.94 122.37 2qy7 h PHE 138 Ca 0.20 -0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.62 2qy7 h PHE 138 Cb 0.39 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.05 2qy7 h PHE 138 CO 0.03 0.53 -0.10 0.00 -2.23 0.00 0.00 178.31 176.54 2qy7 h ALA 139 N 0.75 1.17 -0.01 2.41 0.00 -0.67 -2.61 119.26 120.30 2qy7 h ALA 139 Ca 0.04 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2qy7 h ALA 139 Cb 0.41 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2qy7 h ALA 139 CO 0.01 0.12 -0.23 1.04 0.00 0.00 0.00 179.25 180.19 2qy7 n GLN 140 N -3.46 1.25 -3.56 0.00 6.02 -0.75 -4.67 117.38 112.21 2qy7 n GLN 140 Ca -0.01 -0.85 -0.40 0.00 -0.01 0.00 0.00 57.00 55.73 2qy7 n GLN 140 Cb 0.25 -1.48 -0.06 0.00 1.02 0.00 0.00 30.24 29.97 2qy7 n GLN 140 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2qy7 s ASP 141 N -2.34 6.07 0.26 1.08 -1.08 -0.98 -4.93 116.67 114.75 2qy7 s ASP 141 Ca 0.26 -3.23 -0.04 0.00 -0.52 0.00 0.00 52.55 49.02 2qy7 s ASP 141 Cb 0.19 -1.99 0.33 0.00 -1.46 0.00 0.00 42.92 39.99 2qy7 s ASP 141 CO 0.47 -0.33 1.89 0.44 0.52 0.00 0.00 175.17 178.16 2qy7 h ASP 142 N 6.77 1.00 -0.17 -0.34 3.32 -1.83 0.82 116.42 125.99 2qy7 h ASP 142 Ca 0.10 -0.09 0.04 0.00 0.02 0.00 0.00 57.03 57.10 2qy7 h ASP 142 Cb 0.91 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 40.16 2qy7 h ASP 142 CO 0.81 0.81 -0.10 -0.78 -1.72 0.00 0.00 179.24 178.25 2qy7 h ASP 143 N 1.12 -0.33 -0.11 6.45 3.58 -1.95 -0.11 116.42 125.07 2qy7 h ASP 143 Ca 0.28 0.07 -0.05 0.00 0.42 0.00 0.00 57.03 57.76 2qy7 h ASP 143 Cb 0.03 0.18 -0.00 0.00 1.72 0.00 0.00 39.33 41.26 2qy7 h ASP 143 CO -0.05 -0.13 -0.13 -0.09 -2.88 0.00 0.00 179.24 175.96 2qy7 h ARG 144 N -0.09 0.29 -0.38 0.28 2.43 -1.78 -3.09 114.38 112.03 2qy7 h ARG 144 Ca 0.10 -0.16 0.08 0.00 -0.81 0.00 0.00 59.98 59.19 2qy7 h ARG 144 Cb 0.24 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.72 2qy7 h ARG 144 CO -0.23 0.71 -0.13 1.25 -1.51 0.00 0.00 179.97 180.06 2qy7 h LEU 145 N -0.12 -0.47 -0.40 3.80 6.46 -0.79 -1.35 115.31 122.44 2qy7 h LEU 145 Ca 0.02 0.13 0.05 0.00 -0.12 0.00 0.00 57.88 57.95 2qy7 h LEU 145 Cb 0.67 0.28 -0.04 0.00 -0.73 0.00 0.00 40.66 40.84 2qy7 h LEU 145 CO 0.03 -0.17 0.14 -0.09 -0.62 0.00 0.00 178.44 177.73 2qy7 h ARG 146 N -0.05 0.29 -0.33 1.25 1.12 -1.05 -1.04 114.38 114.57 2qy7 h ARG 146 Ca 0.19 -0.02 -0.07 0.00 -1.11 0.00 0.00 59.98 58.97 2qy7 h ARG 146 Cb 0.34 -0.07 -0.01 0.00 -0.01 0.00 0.00 29.97 30.22 2qy7 h ARG 146 CO -0.42 0.19 -0.07 0.93 -3.11 0.00 0.00 179.97 177.49 2qy7 h GLU 147 N 0.30 0.64 -0.51 0.20 4.39 -1.40 0.19 114.58 118.40 2qy7 h GLU 147 Ca 0.19 -0.24 0.04 0.00 0.34 0.00 0.00 59.36 59.68 2qy7 h GLU 147 Cb 0.17 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.74 2qy7 h GLU 147 CO -0.19 0.81 0.28 0.93 -1.16 0.00 0.00 179.01 179.67 2qy7 h GLU 148 N 0.43 0.52 -0.39 2.33 4.39 -1.13 0.36 114.58 121.08 2qy7 h GLU 148 Ca 0.09 -0.03 -0.09 0.00 0.34 0.00 0.00 59.36 59.66 2qy7 h GLU 148 Cb 0.57 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.09 2qy7 h GLU 148 CO 0.03 0.35 -0.13 0.00 -1.16 0.00 0.00 179.01 178.10 2qy7 h ARG 149 N 0.54 0.78 -0.49 2.33 3.08 -1.05 -0.45 114.38 119.11 2qy7 h ARG 149 Ca 0.22 -0.31 0.06 0.00 0.07 0.00 0.00 59.98 60.01 2qy7 h ARG 149 Cb 0.09 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.06 2qy7 h ARG 149 CO -0.13 0.93 0.20 -0.22 -1.07 0.00 0.00 179.97 179.67 2qy7 h LYS 150 N 0.58 0.39 -0.50 0.04 3.64 -0.75 -1.80 116.57 118.17 2qy7 h LYS 150 Ca 0.10 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.35 2qy7 h LYS 150 Cb 0.66 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 2qy7 h LYS 150 CO 0.04 0.26 -0.10 0.87 -2.27 0.00 0.00 179.45 178.25 2qy7 h LYS 151 N 0.40 0.92 -0.50 1.90 1.57 -0.78 -3.09 116.57 116.97 2qy7 h LYS 151 Ca 0.23 -0.32 -0.05 0.00 -1.87 0.00 0.00 60.65 58.64 2qy7 h LYS 151 Cb 0.21 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 2qy7 h LYS 151 CO -0.21 0.97 0.12 0.00 -0.57 0.00 0.00 179.45 179.76 2qy7 h ALA 152 N 1.05 1.26 0.00 3.86 0.00 -0.68 -1.67 119.26 123.09 2qy7 h ALA 152 Ca 0.13 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 2qy7 h ALA 152 Cb 0.63 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2qy7 h ALA 152 CO 0.04 0.51 -0.24 0.87 0.00 0.00 0.00 179.25 180.44 2qy7 h LYS 153 N 0.74 0.00 0.00 0.00 1.57 -1.26 -3.32 116.57 114.30 2qy7 h LYS 153 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2qy7 h LYS 153 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 2qy7 h LYS 153 CO -0.00 0.24 0.00 1.63 -0.57 0.00 0.00 179.45 180.75 2qy7 n LYS 154 N -3.94 0.00 0.00 3.15 5.02 -0.88 -5.12 118.16 116.38 2qy7 n LYS 154 Ca -0.02 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 2qy7 n LYS 154 Cb 0.32 -0.57 0.00 0.00 -0.02 0.00 0.00 35.03 34.76 2qy7 n LYS 154 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97