#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qop n GLN 7 N 0.00 1.18 0.04 1.64 0.00 -1.26 -4.49 117.38 114.50 2qop n GLN 7 Ca 0.00 -0.06 0.13 0.00 0.00 0.00 0.00 57.00 57.07 2qop n GLN 7 Cb 0.00 -1.30 0.48 0.00 0.00 0.00 0.00 30.24 29.42 2qop n GLN 7 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.06 176.21 2qop n GLU 8 N -2.17 0.12 -0.00 2.61 0.00 -1.26 -2.95 120.64 116.98 2qop n GLU 8 Ca -0.10 0.09 -0.12 0.00 0.00 0.00 0.00 57.16 57.02 2qop n GLU 8 Cb 0.59 -1.63 0.00 0.00 0.00 0.00 0.00 31.44 30.41 2qop n GLU 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2qop h ALA 9 N 2.78 0.55 0.00 -1.84 0.00 -2.00 -2.24 119.26 116.51 2qop h ALA 9 Ca 0.00 -0.56 -0.11 0.00 0.00 0.00 0.00 54.91 54.25 2qop h ALA 9 Cb 0.61 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2qop h ALA 9 CO 0.00 0.70 -0.51 1.96 0.00 0.00 0.00 179.25 181.41 2qop h GLN 10 N 0.46 0.00 -0.60 0.00 7.50 -1.81 -2.71 115.11 117.95 2qop h GLN 10 Ca -0.01 0.00 -0.08 0.00 0.50 0.00 0.00 58.65 59.05 2qop h GLN 10 Cb 1.23 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.73 2qop h GLN 10 CO 0.12 0.51 0.06 1.49 -1.50 0.00 0.00 178.83 179.51 2qop h GLU 11 N 0.00 1.02 0.00 1.46 4.57 -1.43 -2.86 114.58 117.35 2qop h GLU 11 Ca -0.01 -0.30 -0.06 0.00 -1.18 0.00 0.00 59.36 57.82 2qop h GLU 11 Cb 1.30 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.77 2qop h GLU 11 CO 0.07 0.98 -0.28 1.79 -1.18 0.00 0.00 179.01 180.38 2qop h THR 12 N 0.92 0.53 -0.53 0.32 1.35 -1.42 -3.27 112.91 110.81 2qop h THR 12 Ca 0.18 -1.54 -0.01 0.00 -0.55 0.00 0.00 66.41 64.49 2qop h THR 12 Cb 0.48 2.10 -0.03 0.00 -1.73 0.00 0.00 68.15 68.97 2qop h THR 12 CO 0.02 0.28 0.30 -0.09 -0.25 0.00 0.00 175.52 175.78 2qop h ARG 13 N 0.00 0.73 0.00 4.72 2.43 -1.24 -1.66 114.38 119.36 2qop h ARG 13 Ca -0.00 -0.08 -0.05 0.00 -0.81 0.00 0.00 59.98 59.04 2qop h ARG 13 Cb 1.07 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.47 2qop h ARG 13 CO 0.04 0.56 -0.24 -0.56 -1.51 0.00 0.00 179.97 178.25 2qop h GLN 14 N 0.71 0.00 0.00 0.20 3.07 -1.64 -3.04 115.11 114.40 2qop h GLN 14 Ca 0.19 0.00 -0.11 0.00 0.09 0.00 0.00 58.65 58.82 2qop h GLN 14 Cb 0.03 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.57 2qop h GLN 14 CO -0.03 0.24 -0.51 1.25 0.09 0.00 0.00 178.83 179.87 2qop h HIS 15 N 0.00 0.00 -0.42 0.06 2.76 -1.46 -0.87 115.15 115.23 2qop h HIS 15 Ca -0.00 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.10 2qop h HIS 15 Cb 0.95 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.90 2qop h HIS 15 CO 0.00 0.51 -0.02 0.82 -1.30 0.00 0.00 177.93 177.94 2qop h ILE 16 N 0.00 1.26 -0.35 6.26 1.08 -1.22 -1.16 117.51 123.40 2qop h ILE 16 Ca -0.01 -1.07 -0.04 0.00 -0.39 0.00 0.00 64.86 63.36 2qop h ILE 16 Cb 0.94 1.12 -0.02 0.00 -3.07 0.00 0.00 36.82 35.79 2qop h ILE 16 CO 0.07 0.36 0.03 -0.07 -0.69 0.00 0.00 178.15 177.85 2qop h LEU 17 N 0.58 0.49 -0.03 1.44 3.38 -1.39 0.12 115.31 119.90 2qop h LEU 17 Ca 0.12 -0.08 -0.24 0.00 0.09 0.00 0.00 57.88 57.76 2qop h LEU 17 Cb 0.52 -0.13 0.02 0.00 0.09 0.00 0.00 40.66 41.16 2qop h LEU 17 CO 0.03 0.54 -0.92 0.44 0.09 0.00 0.00 178.44 178.61 2qop h ASP 18 N 0.51 0.86 -0.19 -0.43 3.32 -1.10 -2.91 116.42 116.48 2qop h ASP 18 Ca 0.11 -0.72 -0.19 0.00 0.02 0.00 0.00 57.03 56.25 2qop h ASP 18 Cb 0.29 -0.26 0.01 0.00 0.22 0.00 0.00 39.33 39.58 2qop h ASP 18 CO 0.01 1.46 -0.63 0.58 -1.72 0.00 0.00 179.24 178.94 2qop h VAL 19 N 0.34 1.29 0.00 -1.35 2.07 -1.01 -2.33 116.25 115.28 2qop h VAL 19 Ca -0.11 -1.84 -0.00 0.00 0.82 0.00 0.00 66.70 65.58 2qop h VAL 19 Cb 1.58 1.89 0.00 0.00 -1.52 0.00 0.00 31.29 33.24 2qop h VAL 19 CO 0.18 0.58 -0.00 0.00 0.02 0.00 0.00 177.57 178.35 2qop h ALA 20 N 0.58 -0.01 0.00 1.67 0.00 -0.87 0.40 119.26 121.04 2qop h ALA 20 Ca -0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2qop h ALA 20 Cb 1.25 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 2qop h ALA 20 CO 0.13 -0.46 -0.07 1.25 0.00 0.00 0.00 179.25 180.11 2qop h LEU 21 N -0.10 0.00 -0.02 0.00 5.85 -1.57 0.15 115.31 119.62 2qop h LEU 21 Ca -0.00 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.62 2qop h LEU 21 Cb 0.09 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.13 2qop h LEU 21 CO 0.00 0.07 -0.39 -0.09 -0.34 0.00 0.00 178.44 177.69 2qop h ARG 22 N 0.00 0.30 -0.01 1.25 2.43 -1.02 -3.32 114.38 114.02 2qop h ARG 22 Ca -0.00 -0.30 -0.15 0.00 -0.81 0.00 0.00 59.98 58.72 2qop h ARG 22 Cb 0.14 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 2qop h ARG 22 CO 0.01 0.98 -0.69 -0.07 -1.51 0.00 0.00 179.97 178.68 2qop h LEU 23 N -0.26 0.07 -0.17 3.80 3.38 -0.30 -3.06 115.31 118.77 2qop h LEU 23 Ca -0.04 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2qop h LEU 23 Cb 1.10 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.83 2qop h LEU 23 CO 0.08 0.74 0.00 0.49 0.09 0.00 0.00 178.44 179.84 2qop n PHE 24 N -3.74 0.21 -0.04 1.13 0.99 0.46 -2.55 117.46 113.91 2qop n PHE 24 Ca -0.01 0.08 -0.15 0.00 -0.00 0.00 0.00 57.45 57.37 2qop n PHE 24 Cb 0.68 -0.63 -0.14 0.00 -1.00 0.00 0.00 39.48 38.39 2qop n PHE 24 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 2qop n SER 25 N -1.69 1.37 -0.01 4.37 3.41 -1.16 -2.78 113.62 117.13 2qop n SER 25 Ca 0.03 0.18 -0.16 0.00 -0.26 0.00 0.00 58.87 58.66 2qop n SER 25 Cb 0.20 -0.24 -0.11 0.00 -0.26 0.00 0.00 64.21 63.79 2qop n SER 25 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2qop h GLN 26 N 0.03 0.28 0.00 4.33 7.50 -1.56 -3.40 115.11 122.29 2qop h GLN 26 Ca -0.43 -0.30 0.00 0.00 0.50 0.00 0.00 58.65 58.42 2qop h GLN 26 Cb 2.04 0.08 0.00 0.00 0.05 0.00 0.00 27.48 29.65 2qop h GLN 26 CO 0.05 1.00 0.00 0.00 -1.50 0.00 0.00 178.83 178.38 2qop n GLN 27 N -4.37 1.84 0.00 1.46 10.64 -1.06 -5.13 117.38 120.76 2qop n GLN 27 Ca -0.10 -1.13 0.00 0.00 -1.83 0.00 0.00 57.00 53.94 2qop n GLN 27 Cb 0.58 -0.88 0.00 0.00 -0.86 0.00 0.00 30.24 29.08 2qop n GLN 27 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2qop n GLY 28 N -0.33 -2.18 0.05 2.61 0.00 -1.12 -4.36 105.19 99.87 2qop n GLY 28 Ca 0.00 -1.50 -0.02 0.00 0.00 0.00 0.00 46.02 44.50 2qop n GLY 28 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2qop n VAL 29 N -0.28 0.71 -0.18 1.61 0.31 -1.26 -4.25 118.33 114.99 2qop n VAL 29 Ca 0.00 -0.59 -0.05 0.00 -0.01 0.00 0.00 64.34 63.69 2qop n VAL 29 Cb 0.00 -0.32 0.13 0.00 -0.91 0.00 0.00 33.84 32.74 2qop n VAL 29 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2qop h SER 30 N 0.00 0.91 -0.38 4.52 4.64 -1.91 -3.11 113.55 118.23 2qop h SER 30 Ca -0.28 -0.18 -0.08 0.00 -0.47 0.00 0.00 61.79 60.77 2qop h SER 30 Cb 1.57 -0.24 -0.05 0.00 -0.31 0.00 0.00 62.40 63.37 2qop h SER 30 CO 0.02 0.88 0.04 -1.54 -0.87 0.00 0.00 176.83 175.36 2qop n SER 31 N -4.25 3.76 -3.77 4.97 3.41 -1.26 -4.88 113.62 111.60 2qop n SER 31 Ca 0.04 -3.23 -0.29 0.00 -0.26 0.00 0.00 58.87 55.13 2qop n SER 31 Cb 0.25 -0.61 -0.16 0.00 -0.26 0.00 0.00 64.21 63.43 2qop n SER 31 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2qop s THR 32 N -2.96 0.83 0.73 6.66 2.01 -1.18 -5.02 115.64 116.72 2qop s THR 32 Ca 0.45 -0.99 -0.04 0.00 0.31 0.00 0.00 61.69 61.42 2qop s THR 32 Cb 0.38 -1.41 0.11 0.00 0.01 0.00 0.00 72.50 71.59 2qop s THR 32 CO 0.08 -0.37 1.02 -0.94 -0.69 0.00 0.00 174.62 173.72 2qop s SER 33 N 1.69 4.39 0.52 3.53 1.04 -1.26 -4.86 113.70 118.74 2qop s SER 33 Ca 0.02 -0.01 0.29 0.00 0.48 0.00 0.00 55.95 56.73 2qop s SER 33 Cb -0.17 -0.46 1.41 0.00 0.10 0.00 0.00 66.02 66.90 2qop s SER 33 CO -0.14 -1.84 2.04 -0.07 0.98 0.00 0.00 173.24 174.21 2qop h LEU 34 N -0.64 0.00 -0.88 2.42 4.07 -1.98 -2.42 115.31 115.87 2qop h LEU 34 Ca -0.40 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.44 2qop h LEU 34 Cb 1.28 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 43.00 2qop h LEU 34 CO 0.47 0.12 -0.55 1.23 -1.08 0.00 0.00 178.44 178.62 2qop h GLY 35 N 1.16 0.02 1.95 0.83 0.00 -1.95 -2.07 103.07 103.01 2qop h GLY 35 Ca -0.00 -0.02 -0.15 0.00 0.00 0.00 0.00 47.33 47.15 2qop h GLY 35 CO 0.02 0.02 -0.72 0.83 0.00 0.00 0.00 176.54 176.69 2qop h GLU 36 N 0.01 0.05 -0.00 4.80 5.08 -1.82 -3.05 114.58 119.65 2qop h GLU 36 Ca -0.00 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.15 2qop h GLU 36 Cb 0.98 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.22 2qop h GLU 36 CO 0.07 0.74 -0.76 0.82 -1.00 0.00 0.00 179.01 178.89 2qop h ILE 37 N 0.03 1.53 0.66 3.13 1.08 -1.43 -3.37 117.51 119.14 2qop h ILE 37 Ca -0.01 -2.57 -0.03 0.00 -0.39 0.00 0.00 64.86 61.86 2qop h ILE 37 Cb 1.27 2.39 0.00 0.00 -3.07 0.00 0.00 36.82 37.41 2qop h ILE 37 CO 0.10 0.74 -0.34 0.00 -0.69 0.00 0.00 178.15 177.95 2qop h ALA 38 N 1.21 -1.23 -0.31 1.87 0.00 -1.26 -3.05 119.26 116.49 2qop h ALA 38 Ca -0.01 -0.20 -0.66 0.00 0.00 0.00 0.00 54.91 54.04 2qop h ALA 38 Cb 1.34 0.40 -0.06 0.00 0.00 0.00 0.00 17.79 19.48 2qop h ALA 38 CO 0.10 -1.17 2.79 1.63 0.00 0.00 0.00 179.25 182.60 2qop n LYS 39 N -4.57 3.94 0.00 0.00 5.02 -1.22 -2.12 118.16 119.20 2qop n LYS 39 Ca -0.11 -2.70 0.00 0.00 -2.02 0.00 0.00 58.31 53.48 2qop n LYS 39 Cb 0.37 -2.64 0.00 0.00 -0.02 0.00 0.00 35.03 32.74 2qop n LYS 39 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qop n ALA 40 N 2.54 0.42 0.88 7.82 0.00 -1.17 -4.82 120.51 126.19 2qop n ALA 40 Ca 0.68 0.00 0.11 0.00 0.00 0.00 0.00 53.44 54.23 2qop n ALA 40 Cb 0.29 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.72 2qop n ALA 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qop n ALA 41 N -0.42 4.21 -1.27 0.00 0.00 -1.16 -5.00 120.51 116.87 2qop n ALA 41 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.92 2qop n ALA 41 Cb 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 18.58 2qop n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qop n GLY 42 N 1.47 0.60 3.21 0.00 0.00 -1.20 -5.03 105.19 104.25 2qop n GLY 42 Ca 0.04 -0.37 -0.09 0.00 0.00 0.00 0.00 46.02 45.59 2qop n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qop s VAL 43 N -2.48 0.13 0.60 1.61 0.11 -0.90 -5.06 120.40 114.42 2qop s VAL 43 Ca 0.00 -1.10 -0.13 0.00 -2.93 0.00 0.00 61.98 57.82 2qop s VAL 43 Cb 0.00 -1.25 -0.04 0.00 -1.53 0.00 0.00 36.38 33.56 2qop s VAL 43 CO 0.00 -0.61 1.03 0.42 -3.33 0.00 0.00 175.10 172.61 2qop s THR 44 N -3.60 4.32 0.10 5.04 -4.23 -1.26 -3.71 115.64 112.30 2qop s THR 44 Ca 0.03 0.92 0.25 0.00 -1.18 0.00 0.00 61.69 61.70 2qop s THR 44 Cb 0.04 -3.62 0.25 0.00 1.34 0.00 0.00 72.50 70.50 2qop s THR 44 CO -0.10 -0.83 1.82 -0.09 -0.54 0.00 0.00 174.62 174.88 2qop h ARG 45 N 0.07 0.00 0.00 3.99 2.43 -1.93 -2.73 114.38 116.21 2qop h ARG 45 Ca -0.45 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.71 2qop h ARG 45 Cb 1.20 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.75 2qop h ARG 45 CO 0.60 0.20 -0.06 0.78 -1.51 0.00 0.00 179.97 179.98 2qop h GLY 46 N 2.19 0.00 0.48 2.80 0.00 -2.00 -3.21 103.07 103.34 2qop h GLY 46 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 2qop h GLY 46 CO 0.03 0.00 -1.71 0.00 0.00 0.00 0.00 176.54 174.85 2qop n ALA 47 N -2.12 2.24 0.14 3.60 0.00 -1.05 -3.88 120.51 119.44 2qop n ALA 47 Ca 0.01 -0.63 0.01 0.00 0.00 0.00 0.00 53.44 52.84 2qop n ALA 47 Cb 0.39 -0.77 0.12 0.00 0.00 0.00 0.00 19.45 19.18 2qop n ALA 47 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2qop h ILE 48 N 0.00 1.13 0.00 0.00 2.10 -1.52 -2.90 117.51 116.32 2qop h ILE 48 Ca -0.15 -2.23 0.00 0.00 1.08 0.00 0.00 64.86 63.55 2qop h ILE 48 Cb 1.41 2.31 0.00 0.00 -1.09 0.00 0.00 36.82 39.46 2qop h ILE 48 CO 0.02 0.57 -0.26 -1.22 -1.08 0.00 0.00 178.15 176.18 2qop n TYR 49 N -3.43 0.06 0.03 2.19 4.01 -1.21 -2.75 117.16 116.05 2qop n TYR 49 Ca 0.00 0.02 -0.19 0.00 -0.16 0.00 0.00 57.90 57.57 2qop n TYR 49 Cb 0.69 -0.40 -0.10 0.00 -0.31 0.00 0.00 39.34 39.21 2qop n TYR 49 CO 0.00 0.00 0.00 2.35 -0.46 0.00 0.00 176.86 178.75 2qop h TRP 50 N 0.00 0.95 0.04 -0.72 2.91 -1.62 -3.36 115.95 114.15 2qop h TRP 50 Ca 0.00 -0.51 -0.16 0.00 1.13 0.00 0.00 58.89 59.35 2qop h TRP 50 Cb 0.52 -0.11 0.01 0.00 -0.51 0.00 0.00 29.16 29.07 2qop h TRP 50 CO 0.00 1.34 -0.64 0.45 -1.03 0.00 0.00 178.44 178.56 2qop h HIS 51 N 0.29 0.58 -4.16 2.65 3.86 -1.61 -3.47 115.15 113.30 2qop h HIS 51 Ca -0.11 -0.34 -0.59 0.00 -1.16 0.00 0.00 60.37 58.17 2qop h HIS 51 Cb 1.58 -0.05 -0.25 0.00 1.06 0.00 0.00 27.41 29.74 2qop h HIS 51 CO 0.11 1.18 -0.84 -0.06 0.86 0.00 0.00 177.93 179.18 2qop s PHE 52 N -2.99 1.85 -0.06 2.45 0.08 -1.11 -5.06 117.98 113.14 2qop s PHE 52 Ca -0.13 -0.38 -0.19 0.00 0.12 0.00 0.00 56.93 56.35 2qop s PHE 52 Cb 0.03 -1.10 -0.14 0.00 -0.57 0.00 0.00 43.02 41.24 2qop s PHE 52 CO 0.82 0.11 0.75 -0.22 -0.10 0.00 0.00 175.22 176.57 2qop h LYS 53 N 4.79 -0.20 0.00 0.44 3.64 -1.87 -3.37 116.57 119.99 2qop h LYS 53 Ca -0.43 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 2qop h LYS 53 Cb 1.16 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.03 2qop h LYS 53 CO 0.43 0.20 0.00 -0.40 -2.27 0.00 0.00 179.45 177.42 2qop n ASP 54 N -4.90 0.00 -0.14 4.20 5.75 -1.26 -4.99 116.55 115.21 2qop n ASP 54 Ca -0.07 0.00 -0.11 0.00 -0.01 0.00 0.00 54.79 54.60 2qop n ASP 54 Cb 0.25 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.32 2qop n ASP 54 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 2qop h LYS 55 N 0.00 0.78 -0.11 0.11 1.79 -1.98 -2.72 116.57 114.44 2qop h LYS 55 Ca 0.00 -0.30 -0.19 0.00 -2.18 0.00 0.00 60.65 57.98 2qop h LYS 55 Cb 0.00 -0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 30.60 2qop h LYS 55 CO 0.00 0.91 -0.72 0.77 -1.08 0.00 0.00 179.45 179.32 2qop h SER 56 N 0.60 0.62 0.05 0.86 0.02 -1.97 -2.63 113.55 111.09 2qop h SER 56 Ca 0.10 -0.40 -0.13 0.00 -0.84 0.00 0.00 61.79 60.53 2qop h SER 56 Cb 0.62 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 2qop h SER 56 CO 0.04 1.15 -0.42 -0.78 -1.14 0.00 0.00 176.83 175.68 2qop h ASP 57 N 0.36 0.50 -0.10 3.07 -0.00 -1.95 0.13 116.42 118.42 2qop h ASP 57 Ca -0.03 -0.22 -0.14 0.00 -0.00 0.00 0.00 57.03 56.63 2qop h ASP 57 Cb 1.31 -0.14 -0.01 0.00 -0.00 0.00 0.00 39.33 40.49 2qop h ASP 57 CO 0.13 0.86 -0.42 0.25 -0.00 0.00 0.00 179.24 180.06 2qop h LEU 58 N 0.38 0.69 -0.02 2.28 5.85 -1.50 -2.84 115.31 120.15 2qop h LEU 58 Ca 0.03 -0.32 -0.19 0.00 0.84 0.00 0.00 57.88 58.24 2qop h LEU 58 Cb 0.90 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.71 2qop h LEU 58 CO 0.08 1.02 -0.91 0.15 -0.34 0.00 0.00 178.44 178.43 2qop h PHE 59 N 0.52 0.00 0.00 1.25 3.57 -1.22 -3.27 116.94 117.79 2qop h PHE 59 Ca 0.04 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.44 2qop h PHE 59 Cb 0.95 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.68 2qop h PHE 59 CO 0.04 0.91 -0.45 0.77 -2.23 0.00 0.00 178.31 177.36 2qop h SER 60 N 0.00 0.00 1.13 0.41 0.02 -0.78 -3.21 113.55 111.11 2qop h SER 60 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2qop h SER 60 Cb 1.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.24 2qop h SER 60 CO 0.12 0.45 0.00 -0.08 -1.14 0.00 0.00 176.83 176.18 2qop h GLU 61 N 0.00 0.00 -0.55 3.45 4.57 -1.55 -3.13 114.58 117.37 2qop h GLU 61 Ca -0.00 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.14 2qop h GLU 61 Cb 1.27 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.83 2qop h GLU 61 CO 0.06 0.00 0.19 0.82 -1.18 0.00 0.00 179.01 178.90 2qop h ILE 62 N 0.00 1.23 0.00 2.32 1.08 -1.66 -2.86 117.51 117.62 2qop h ILE 62 Ca 0.00 -0.75 -0.01 0.00 -0.39 0.00 0.00 64.86 63.71 2qop h ILE 62 Cb 0.56 0.69 -0.00 0.00 -3.07 0.00 0.00 36.82 35.01 2qop h ILE 62 CO 0.00 0.28 -0.04 -0.50 -0.69 0.00 0.00 178.15 177.21 2qop h TRP 63 N 0.75 0.00 0.00 1.37 6.55 -1.74 -1.37 115.95 121.51 2qop h TRP 63 Ca 0.18 0.00 -0.18 0.00 0.95 0.00 0.00 58.89 59.84 2qop h TRP 63 Cb 0.25 0.00 -0.02 0.00 -0.86 0.00 0.00 29.16 28.53 2qop h TRP 63 CO 0.01 0.04 -0.86 0.93 -1.05 0.00 0.00 178.44 177.51 2qop h GLU 64 N 0.00 0.02 0.00 0.49 4.39 -1.60 -3.34 114.58 114.54 2qop h GLU 64 Ca -0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2qop h GLU 64 Cb 0.62 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.27 2qop h GLU 64 CO 0.00 0.86 -0.27 -0.11 -1.16 0.00 0.00 179.01 178.34 2qop n LEU 65 N -3.54 0.67 -0.02 1.33 7.94 -1.22 -4.91 117.00 117.25 2qop n LEU 65 Ca -0.01 0.13 -0.16 0.00 -1.11 0.00 0.00 56.01 54.86 2qop n LEU 65 Cb 0.81 -0.17 -0.12 0.00 0.53 0.00 0.00 43.42 44.47 2qop n LEU 65 CO 0.45 -0.55 0.35 0.77 -1.11 0.00 0.00 177.39 177.31 2qop h SER 66 N 0.00 0.26 -0.41 1.96 4.64 -1.69 -3.46 113.55 114.84 2qop h SER 66 Ca 0.00 -0.80 0.00 0.00 -0.47 0.00 0.00 61.79 60.52 2qop h SER 66 Cb 0.27 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2qop h SER 66 CO 0.00 1.03 0.00 1.21 -0.87 0.00 0.00 176.83 178.20 2qop n GLU 67 N -4.45 1.28 0.00 4.77 4.07 -0.56 -4.79 120.64 120.96 2qop n GLU 67 Ca -0.10 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.00 2qop n GLU 67 Cb 0.55 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.93 2qop n GLU 67 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 2qop n SER 68 N -0.13 0.00 0.00 4.31 7.64 -1.25 -4.77 113.62 119.42 2qop n SER 68 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2qop n SER 68 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2qop n SER 68 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2qop n ASN 69 N 10.38 0.00 0.17 6.43 5.15 -1.26 -4.73 115.26 131.40 2qop n ASN 69 Ca 0.00 0.00 0.02 0.00 -0.60 0.00 0.00 54.58 54.00 2qop n ASN 69 Cb 0.00 -1.92 0.30 0.00 -0.53 0.00 0.00 39.78 37.63 2qop n ASN 69 CO 0.00 0.00 0.00 0.16 1.40 0.00 0.00 177.26 178.82 2qop h ILE 70 N 0.00 1.29 -0.26 -1.44 3.07 -1.98 0.98 117.51 119.17 2qop h ILE 70 Ca 0.00 -1.57 -0.14 0.00 1.55 0.00 0.00 64.86 64.71 2qop h ILE 70 Cb 0.00 1.85 -0.01 0.00 -0.27 0.00 0.00 36.82 38.39 2qop h ILE 70 CO 0.00 0.44 -0.40 1.23 -1.05 0.00 0.00 178.15 178.37 2qop h GLY 71 N 1.42 0.66 1.89 0.16 0.00 -2.00 -1.58 103.07 103.63 2qop h GLY 71 Ca -0.00 -0.67 -0.16 0.00 0.00 0.00 0.00 47.33 46.50 2qop h GLY 71 CO 0.06 0.60 -0.73 -2.09 0.00 0.00 0.00 176.54 174.38 2qop h GLU 72 N 0.50 0.10 -0.02 4.80 4.57 -1.85 -3.02 114.58 119.66 2qop h GLU 72 Ca 0.04 -0.09 -0.07 0.00 -1.18 0.00 0.00 59.36 58.06 2qop h GLU 72 Cb 0.92 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.52 2qop h GLU 72 CO 0.08 0.79 -0.34 -0.07 -1.18 0.00 0.00 179.01 178.29 2qop h LEU 73 N 0.07 0.04 -0.13 1.64 3.38 -0.63 -2.33 115.31 117.35 2qop h LEU 73 Ca -0.02 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2qop h LEU 73 Cb 1.30 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 2qop h LEU 73 CO 0.10 0.38 0.04 -0.33 0.09 0.00 0.00 178.44 178.72 2qop h GLU 74 N 0.04 0.21 -0.06 1.13 5.08 -1.17 -2.26 114.58 117.54 2qop h GLU 74 Ca 0.00 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2qop h GLU 74 Cb 0.62 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 2qop h GLU 74 CO 0.05 0.34 0.04 -0.07 -1.00 0.00 0.00 179.01 178.37 2qop h LEU 75 N 0.03 0.02 -0.01 1.33 -0.00 -1.40 0.12 115.31 115.40 2qop h LEU 75 Ca 0.04 -0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.92 2qop h LEU 75 Cb 0.22 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 40.88 2qop h LEU 75 CO -0.00 0.02 -0.02 -0.08 -0.00 0.00 0.00 178.44 178.35 2qop h GLU 76 N 0.02 0.03 0.00 1.13 4.81 -1.24 -3.23 114.58 116.11 2qop h GLU 76 Ca 0.03 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2qop h GLU 76 Cb 0.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.47 2qop h GLU 76 CO -0.00 0.62 -0.64 1.88 -0.73 0.00 0.00 179.01 180.14 2qop h TYR 77 N -0.56 0.00 -0.00 0.92 -1.99 -1.18 -3.09 116.97 111.07 2qop h TYR 77 Ca -0.00 0.00 -0.14 0.00 2.00 0.00 0.00 58.73 60.59 2qop h TYR 77 Cb 0.62 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.33 2qop h TYR 77 CO 0.13 0.00 -0.66 1.96 -0.00 0.00 0.00 178.16 179.60 2qop h GLN 78 N 0.00 0.02 -0.02 4.88 4.20 -0.91 0.17 115.11 123.44 2qop h GLN 78 Ca 0.00 -0.01 -0.17 0.00 0.06 0.00 0.00 58.65 58.52 2qop h GLN 78 Cb 0.99 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.75 2qop h GLN 78 CO 0.00 0.67 -0.77 0.00 -0.67 0.00 0.00 178.83 178.06 2qop h ALA 79 N 1.33 0.67 0.01 3.87 0.00 -1.60 -3.17 119.26 120.35 2qop h ALA 79 Ca -0.01 -0.66 -0.20 0.00 0.00 0.00 0.00 54.91 54.04 2qop h ALA 79 Cb 1.17 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2qop h ALA 79 CO 0.09 0.86 -0.90 0.87 0.00 0.00 0.00 179.25 180.17 2qop h LYS 80 N 0.11 0.24 -3.15 0.00 1.57 -1.43 -3.40 116.57 110.51 2qop h LYS 80 Ca -0.03 -0.26 -0.62 0.00 -1.87 0.00 0.00 60.65 57.87 2qop h LYS 80 Cb 1.35 0.08 -0.41 0.00 0.08 0.00 0.00 32.23 33.33 2qop h LYS 80 CO 0.11 0.99 -0.68 -0.06 -0.57 0.00 0.00 179.45 179.24 2qop s PHE 81 N -3.20 2.60 -0.03 -1.35 0.08 0.57 -5.09 117.98 111.55 2qop s PHE 81 Ca -0.03 -2.82 -0.30 0.00 0.12 0.00 0.00 56.93 53.90 2qop s PHE 81 Cb 0.10 -2.33 -0.02 0.00 -0.57 0.00 0.00 43.02 40.19 2qop s PHE 81 CO 0.84 -0.75 0.99 -2.14 -0.10 0.00 0.00 175.22 174.06 2qop s PRO 82 N -0.07 4.51 -0.59 0.24 0.02 -1.20 -3.68 135.00 134.23 2qop s PRO 82 Ca 0.18 1.41 0.00 0.00 0.02 0.00 0.00 61.00 62.61 2qop s PRO 82 Cb -0.23 -3.49 0.00 0.00 0.02 0.00 0.00 34.50 30.80 2qop s PRO 82 CO -0.02 -0.14 0.00 0.41 -0.33 0.00 0.00 177.00 176.93 2qop n GLY 83 N 2.96 0.49 2.43 0.52 0.00 -1.26 -5.00 105.19 105.33 2qop n GLY 83 Ca 0.07 -0.70 -0.28 0.00 0.00 0.00 0.00 46.02 45.11 2qop n GLY 83 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qop s ASP 84 N -2.83 2.00 0.40 1.61 -1.08 -1.24 -4.99 116.67 110.54 2qop s ASP 84 Ca 0.00 -2.79 0.17 0.00 -0.52 0.00 0.00 52.55 49.40 2qop s ASP 84 Cb 0.00 -0.45 0.84 0.00 -1.46 0.00 0.00 42.92 41.84 2qop s ASP 84 CO 0.00 -0.21 1.84 1.55 0.52 0.00 0.00 175.17 178.87 2qop h PRO 85 N 6.09 0.00 -0.14 4.34 0.13 -1.91 -3.06 132.00 137.45 2qop h PRO 85 Ca 0.20 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.15 2qop h PRO 85 Cb 0.93 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.05 2qop h PRO 85 CO 0.34 0.33 -0.64 1.25 -0.23 0.00 0.00 178.00 179.05 2qop h LEU 86 N 0.00 0.62 -0.61 1.56 6.46 -1.94 -1.61 115.31 119.80 2qop h LEU 86 Ca -0.00 -0.37 -0.15 0.00 -0.12 0.00 0.00 57.88 57.24 2qop h LEU 86 Cb 0.67 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.41 2qop h LEU 86 CO 0.04 1.10 -0.67 0.28 -0.62 0.00 0.00 178.44 178.57 2qop h SER 87 N 0.39 0.15 -0.37 1.25 0.02 -1.97 -1.01 113.55 112.02 2qop h SER 87 Ca -0.01 -0.10 -0.07 0.00 -0.84 0.00 0.00 61.79 60.77 2qop h SER 87 Cb 1.21 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 2qop h SER 87 CO 0.12 0.78 -0.05 0.58 -1.14 0.00 0.00 176.83 177.11 2qop h VAL 88 N 0.09 1.27 -0.25 2.27 2.07 -1.43 0.25 116.25 120.53 2qop h VAL 88 Ca -0.01 -1.09 -0.03 0.00 0.82 0.00 0.00 66.70 66.39 2qop h VAL 88 Cb 1.20 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 2qop h VAL 88 CO 0.10 0.36 0.02 0.25 0.02 0.00 0.00 177.57 178.32 2qop h LEU 89 N 0.49 0.33 -0.02 2.57 5.85 -1.21 -2.30 115.31 121.01 2qop h LEU 89 Ca 0.10 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 2qop h LEU 89 Cb 0.54 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.49 2qop h LEU 89 CO 0.03 0.37 -0.08 -0.09 -0.34 0.00 0.00 178.44 178.33 2qop h ARG 90 N 0.35 0.08 -0.09 1.25 2.43 -0.82 -3.24 114.38 114.34 2qop h ARG 90 Ca 0.08 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.09 2qop h ARG 90 Cb 0.20 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 2qop h ARG 90 CO 0.00 0.72 -0.40 0.93 -1.51 0.00 0.00 179.97 179.71 2qop h GLU 91 N -0.54 0.20 -0.57 0.20 4.39 -0.42 -1.76 114.58 116.08 2qop h GLU 91 Ca -0.00 -0.09 -0.07 0.00 0.34 0.00 0.00 59.36 59.54 2qop h GLU 91 Cb 0.73 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.36 2qop h GLU 91 CO 0.02 0.57 0.09 0.82 -1.16 0.00 0.00 179.01 179.35 2qop h ILE 92 N 0.17 1.26 -0.04 3.13 5.03 -1.55 -1.92 117.51 123.57 2qop h ILE 92 Ca 0.02 -0.98 -0.13 0.00 -0.12 0.00 0.00 64.86 63.64 2qop h ILE 92 Cb 0.79 0.79 -0.01 0.00 -3.03 0.00 0.00 36.82 35.35 2qop h ILE 92 CO 0.06 0.36 -0.58 -0.07 -0.68 0.00 0.00 178.15 177.24 2qop h LEU 93 N 0.84 0.16 -0.54 1.44 3.38 -1.51 -0.55 115.31 118.53 2qop h LEU 93 Ca 0.17 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 2qop h LEU 93 Cb 0.42 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2qop h LEU 93 CO 0.01 0.70 0.05 0.40 0.09 0.00 0.00 178.44 179.69 2qop h ILE 94 N 0.11 1.26 -0.45 1.22 2.04 -1.27 -2.50 117.51 117.91 2qop h ILE 94 Ca -0.00 -1.03 -0.10 0.00 1.00 0.00 0.00 64.86 64.73 2qop h ILE 94 Cb 1.05 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 2qop h ILE 94 CO 0.08 0.37 -0.11 -0.74 0.00 0.00 0.00 178.15 177.75 2qop h HIS 95 N 0.80 0.91 -0.29 1.37 2.76 -1.05 -2.00 115.15 117.66 2qop h HIS 95 Ca 0.16 -0.17 -0.02 0.00 -2.20 0.00 0.00 60.37 58.13 2qop h HIS 95 Cb 0.47 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 29.18 2qop h HIS 95 CO 0.03 0.89 0.09 0.28 -1.30 0.00 0.00 177.93 177.92 2qop h VAL 96 N 0.75 1.20 -0.40 5.26 2.07 -1.03 -0.54 116.25 123.56 2qop h VAL 96 Ca 0.12 -0.66 -0.11 0.00 0.82 0.00 0.00 66.70 66.87 2qop h VAL 96 Cb 0.61 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 2qop h VAL 96 CO 0.04 0.22 -0.21 -0.07 0.02 0.00 0.00 177.57 177.56 2qop h LEU 97 N 0.31 0.80 -0.11 2.57 4.07 -1.41 -2.96 115.31 118.57 2qop h LEU 97 Ca 0.09 -0.28 -0.24 0.00 0.08 0.00 0.00 57.88 57.53 2qop h LEU 97 Cb 0.25 -0.22 0.01 0.00 1.08 0.00 0.00 40.66 41.78 2qop h LEU 97 CO -0.00 0.99 -0.97 -0.33 -1.08 0.00 0.00 178.44 177.05 2qop h GLU 98 N 0.69 0.54 -0.27 1.13 5.08 -1.31 -3.30 114.58 117.14 2qop h GLU 98 Ca 0.10 -0.57 -0.10 0.00 -1.00 0.00 0.00 59.36 57.78 2qop h GLU 98 Cb 0.73 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 2qop h GLU 98 CO 0.06 1.20 -0.25 0.66 -1.00 0.00 0.00 179.01 179.67 2qop h SER 99 N 0.31 0.53 0.46 1.42 4.64 -1.12 -1.61 113.55 118.18 2qop h SER 99 Ca -0.10 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 2qop h SER 99 Cb 1.61 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 2qop h SER 99 CO 0.18 0.78 0.00 0.41 -0.87 0.00 0.00 176.83 177.32 2qop n THR 100 N -4.11 1.03 -0.12 2.95 -1.04 -1.12 -1.40 114.28 110.47 2qop n THR 100 Ca -0.00 0.36 -0.21 0.00 -2.04 0.00 0.00 64.05 62.16 2qop n THR 100 Cb 0.41 -1.26 -0.07 0.00 -1.82 0.00 0.00 70.33 67.59 2qop n THR 100 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2qop n VAL 101 N -1.98 1.51 -0.10 12.58 0.31 -0.88 -4.27 118.33 125.51 2qop n VAL 101 Ca 0.02 -0.14 -0.11 0.00 -0.01 0.00 0.00 64.34 64.10 2qop n VAL 101 Cb 0.15 -2.09 -0.16 0.00 -0.91 0.00 0.00 33.84 30.84 2qop n VAL 101 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 2qop n THR 102 N -4.36 1.42 -2.79 2.52 5.66 -0.66 -4.92 114.28 111.15 2qop n THR 102 Ca -0.36 -0.83 -0.41 0.00 -3.05 0.00 0.00 64.05 59.40 2qop n THR 102 Cb 0.71 -0.58 -0.05 0.00 -1.55 0.00 0.00 70.33 68.86 2qop n THR 102 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 2qop s GLU 103 N -2.50 4.68 0.02 1.09 2.02 -0.49 -4.99 118.70 118.54 2qop s GLU 103 Ca -0.11 1.38 -0.21 0.00 0.02 0.00 0.00 54.97 56.05 2qop s GLU 103 Cb 0.06 -3.35 -0.17 0.00 0.10 0.00 0.00 34.13 30.77 2qop s GLU 103 CO 0.81 0.29 1.26 0.93 0.02 0.00 0.00 175.26 178.57 2qop h GLU 104 N 5.30 0.35 0.00 1.61 3.07 -1.91 -1.51 114.58 121.49 2qop h GLU 104 Ca -0.44 -0.24 -0.01 0.00 -0.50 0.00 0.00 59.36 58.18 2qop h GLU 104 Cb 1.21 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 29.15 2qop h GLU 104 CO 0.71 0.84 -0.04 0.00 -1.40 0.00 0.00 179.01 179.11 2qop h ARG 105 N -0.08 0.00 0.00 2.33 3.08 -1.94 -1.65 114.38 116.11 2qop h ARG 105 Ca 0.00 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.76 2qop h ARG 105 Cb 0.84 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.84 2qop h ARG 105 CO 0.05 0.04 -1.81 0.54 -1.07 0.00 0.00 179.97 177.73 2qop n ARG 106 N -3.17 0.64 -0.04 0.04 5.12 -1.22 -3.66 116.66 114.37 2qop n ARG 106 Ca 0.00 0.22 -0.15 0.00 -1.93 0.00 0.00 57.85 56.00 2qop n ARG 106 Cb 0.32 -1.74 -0.12 0.00 -1.16 0.00 0.00 32.46 29.76 2qop n ARG 106 CO 0.00 0.00 0.00 -0.09 -1.93 0.00 0.00 177.63 175.61 2qop h ARG 107 N 0.00 0.07 -0.17 5.56 2.43 -1.14 -3.32 114.38 117.81 2qop h ARG 107 Ca -0.32 -0.08 -0.11 0.00 -0.81 0.00 0.00 59.98 58.66 2qop h ARG 107 Cb 1.99 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 31.56 2qop h ARG 107 CO 0.06 0.91 -0.38 -0.07 -1.51 0.00 0.00 179.97 178.98 2qop h LEU 108 N -0.74 0.39 0.16 3.80 3.38 -1.51 -2.50 115.31 118.29 2qop h LEU 108 Ca -0.02 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 2qop h LEU 108 Cb 0.95 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2qop h LEU 108 CO 0.02 0.74 -0.08 0.25 0.09 0.00 0.00 178.44 179.46 2qop h LEU 109 N 0.31 -0.18 -1.20 1.67 7.12 -1.72 -2.87 115.31 118.45 2qop h LEU 109 Ca 0.03 -0.13 0.00 0.00 0.13 0.00 0.00 57.88 57.92 2qop h LEU 109 Cb 0.81 0.05 0.00 0.00 -0.53 0.00 0.00 40.66 40.99 2qop h LEU 109 CO 0.07 0.02 0.00 0.24 -0.13 0.00 0.00 178.44 178.63 2qop h MET 110 N -0.37 0.00 -0.00 1.25 2.86 -1.65 -2.13 114.93 114.88 2qop h MET 110 Ca -0.02 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.54 2qop h MET 110 Cb 0.29 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 2qop h MET 110 CO 0.04 0.00 -0.36 1.49 1.06 0.00 0.00 176.91 179.14 2qop h GLU 111 N 0.00 0.00 0.23 1.72 4.57 -1.25 -2.92 114.58 116.93 2qop h GLU 111 Ca 0.00 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 2qop h GLU 111 Cb 0.54 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 2qop h GLU 111 CO 0.00 0.36 -0.11 0.82 -1.18 0.00 0.00 179.01 178.90 2qop h ILE 112 N 0.00 0.00 -0.40 2.32 1.08 -1.17 -1.50 117.51 117.84 2qop h ILE 112 Ca -0.00 -0.31 0.08 0.00 -0.39 0.00 0.00 64.86 64.24 2qop h ILE 112 Cb 0.64 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.31 2qop h ILE 112 CO 0.05 0.00 -0.11 0.40 -0.69 0.00 0.00 178.15 177.79 2qop h ILE 113 N -0.62 0.58 -0.00 -0.67 5.03 -1.64 0.16 117.51 120.35 2qop h ILE 113 Ca -0.03 0.00 -0.16 0.00 -0.12 0.00 0.00 64.86 64.55 2qop h ILE 113 Cb 0.24 0.58 -0.02 0.00 -3.03 0.00 0.00 36.82 34.58 2qop h ILE 113 CO 0.05 0.00 -0.77 -0.26 -0.68 0.00 0.00 178.15 176.49 2qop h PHE 114 N -0.02 0.02 0.00 1.37 0.05 -1.68 -3.43 116.94 113.26 2qop h PHE 114 Ca 0.19 -0.01 0.00 0.00 3.82 0.00 0.00 57.97 61.97 2qop h PHE 114 Cb 0.31 -0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.26 2qop h PHE 114 CO -0.36 0.78 -0.47 0.72 -0.18 0.00 0.00 178.31 178.80 2qop n HIS 115 N -3.64 -0.17 -2.11 -0.55 8.25 -1.03 -4.94 115.22 111.04 2qop n HIS 115 Ca -0.01 0.03 -0.38 0.00 -0.26 0.00 0.00 57.72 57.10 2qop n HIS 115 Cb 0.74 0.24 0.03 0.00 1.12 0.00 0.00 29.99 32.12 2qop n HIS 115 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2qop n LYS 116 N -2.87 3.15 -4.25 -0.41 4.76 0.48 -4.97 118.16 114.04 2qop n LYS 116 Ca 0.00 -3.82 -0.15 0.00 -2.87 0.00 0.00 58.31 51.47 2qop n LYS 116 Cb 0.23 -2.29 -0.10 0.00 -1.84 0.00 0.00 35.03 31.04 2qop n LYS 116 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qop h GLU 118 N 2.83 0.00 -5.26 0.00 5.08 -1.93 -3.49 114.58 111.81 2qop h GLU 118 Ca -0.37 0.00 -0.41 0.00 -1.00 0.00 0.00 59.36 57.58 2qop h GLU 118 Cb 1.19 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.48 2qop h GLU 118 CO 0.62 0.00 -0.64 1.19 -1.00 0.00 0.00 179.01 179.18 2qop n PHE 119 N -4.13 -2.19 0.00 4.33 0.99 -1.26 -4.91 117.46 110.28 2qop n PHE 119 Ca -0.03 0.68 0.00 0.00 -0.00 0.00 0.00 57.45 58.10 2qop n PHE 119 Cb 0.13 -4.24 0.00 0.00 -1.00 0.00 0.00 39.48 34.37 2qop n PHE 119 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.76 178.09 2qop n VAL 120 N -4.55 0.03 0.00 -4.37 0.24 -1.26 -4.64 118.33 103.78 2qop n VAL 120 Ca -0.04 0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 2qop n VAL 120 Cb 0.58 -0.80 0.00 0.00 -1.47 0.00 0.00 33.84 32.15 2qop n VAL 120 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qop n GLY 121 N 3.07 1.13 0.08 7.63 0.00 -1.26 -4.27 105.19 111.56 2qop n GLY 121 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2qop n GLY 121 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qop n GLU 122 N 0.00 0.15 0.00 1.61 -0.58 -1.26 -2.64 120.64 117.92 2qop n GLU 122 Ca 0.00 0.27 0.14 0.00 -0.42 0.00 0.00 57.16 57.16 2qop n GLU 122 Cb 0.00 -1.73 0.62 0.00 -0.57 0.00 0.00 31.44 29.76 2qop n GLU 122 CO 0.00 0.00 0.00 -0.12 -0.48 0.00 0.00 177.13 176.53 2qop n MET 123 N -2.00 1.11 0.18 3.49 1.56 -1.26 -3.16 117.12 117.04 2qop n MET 123 Ca 0.04 -0.47 0.11 0.00 -0.27 0.00 0.00 57.70 57.11 2qop n MET 123 Cb 0.29 -1.49 0.11 0.00 2.15 0.00 0.00 33.22 34.28 2qop n MET 123 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2qop h ALA 124 N 3.96 0.85 -0.23 -5.12 0.00 -1.68 -3.13 119.26 113.91 2qop h ALA 124 Ca 0.00 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 2qop h ALA 124 Cb 0.35 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2qop h ALA 124 CO 0.00 0.05 -0.23 0.28 0.00 0.00 0.00 179.25 179.35 2qop h VAL 125 N 0.00 1.32 0.00 0.00 2.07 -1.73 -2.37 116.25 115.53 2qop h VAL 125 Ca -0.00 -1.39 -0.03 0.00 0.82 0.00 0.00 66.70 66.09 2qop h VAL 125 Cb 1.03 1.70 -0.00 0.00 -1.52 0.00 0.00 31.29 32.49 2qop h VAL 125 CO 0.00 0.43 -0.16 -0.37 0.02 0.00 0.00 177.57 177.50 2qop h VAL 126 N 0.26 0.34 -0.36 2.57 -1.51 -1.73 -2.03 116.25 113.79 2qop h VAL 126 Ca 0.04 -1.05 -0.13 0.00 -1.23 0.00 0.00 66.70 64.33 2qop h VAL 126 Cb 0.78 1.80 -0.01 0.00 -2.13 0.00 0.00 31.29 31.74 2qop h VAL 126 CO 0.06 0.15 -0.30 -0.61 -1.23 0.00 0.00 177.57 175.63 2qop h GLN 127 N 0.00 0.77 0.00 5.19 4.15 -1.47 0.35 115.11 124.11 2qop h GLN 127 Ca -0.00 -0.35 -0.10 0.00 0.77 0.00 0.00 58.65 58.97 2qop h GLN 127 Cb 0.79 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.45 2qop h GLN 127 CO 0.02 0.97 -0.47 1.96 -1.93 0.00 0.00 178.83 179.39 2qop h GLN 128 N 0.65 0.00 -0.05 1.69 1.08 -1.19 -0.82 115.11 116.47 2qop h GLN 128 Ca 0.07 0.00 -0.22 0.00 -1.45 0.00 0.00 58.65 57.06 2qop h GLN 128 Cb 0.84 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.27 2qop h GLN 128 CO 0.07 0.47 -0.85 0.00 -0.95 0.00 0.00 178.83 177.57 2qop h ALA 129 N 1.53 0.41 0.00 3.87 0.00 -1.11 -3.12 119.26 120.85 2qop h ALA 129 Ca -0.00 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 54.25 2qop h ALA 129 Cb 1.02 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2qop h ALA 129 CO 0.06 0.76 0.00 1.96 0.00 0.00 0.00 179.25 182.03 2qop h GLN 130 N 0.32 0.00 -0.07 0.00 4.20 -0.86 -3.10 115.11 115.61 2qop h GLN 130 Ca -0.06 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 2qop h GLN 130 Cb 1.47 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.24 2qop h GLN 130 CO 0.15 0.00 0.02 -0.09 -0.67 0.00 0.00 178.83 178.25 2qop h ARG 131 N 0.00 0.11 0.00 1.46 9.65 -1.08 -0.01 114.38 124.51 2qop h ARG 131 Ca 0.00 -0.02 -0.09 0.00 -1.10 0.00 0.00 59.98 58.77 2qop h ARG 131 Cb 0.89 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.44 2qop h ARG 131 CO 0.00 0.28 -0.42 -0.91 2.80 0.00 0.00 179.97 181.72 2qop h ASN 132 N -0.08 0.00 0.29 -3.80 2.35 -1.63 -1.82 115.58 110.89 2qop h ASN 132 Ca 0.02 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.67 2qop h ASN 132 Cb 0.22 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 2qop h ASN 132 CO -0.00 0.42 -0.41 0.25 -1.65 0.00 0.00 177.43 176.05 2qop h LEU 133 N 0.00 0.16 0.05 1.61 6.46 -1.43 -1.63 115.31 120.54 2qop h LEU 133 Ca -0.00 -0.06 -0.22 0.00 -0.12 0.00 0.00 57.88 57.47 2qop h LEU 133 Cb 0.89 -0.04 0.02 0.00 -0.73 0.00 0.00 40.66 40.79 2qop h LEU 133 CO 0.06 0.56 -0.91 0.00 -0.62 0.00 0.00 178.44 177.52 2qop h LEU 135 N 0.07 0.76 -0.84 0.00 4.07 -1.30 -2.83 115.31 115.23 2qop h LEU 135 Ca -0.13 -0.33 -0.02 0.00 0.08 0.00 0.00 57.88 57.48 2qop h LEU 135 Cb 1.61 -0.21 -0.00 0.00 1.08 0.00 0.00 40.66 43.14 2qop h LEU 135 CO 0.18 1.06 -0.09 -0.33 -1.08 0.00 0.00 178.44 178.18 2qop h GLU 136 N 0.60 0.00 -0.29 1.13 4.39 -1.42 -3.13 114.58 115.86 2qop h GLU 136 Ca 0.05 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.59 2qop h GLU 136 Cb 0.91 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.56 2qop h GLU 136 CO 0.08 0.09 -0.49 1.03 -1.16 0.00 0.00 179.01 178.55 2qop h SER 137 N 0.00 0.86 -0.78 1.42 0.87 -1.35 -1.94 113.55 112.63 2qop h SER 137 Ca -0.00 -0.44 -0.00 0.00 -1.23 0.00 0.00 61.79 60.12 2qop h SER 137 Cb 0.77 -0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 62.45 2qop h SER 137 CO 0.01 1.21 0.48 1.88 -0.53 0.00 0.00 176.83 179.87 2qop h TYR 138 N 0.62 1.03 -0.17 2.24 0.99 -1.46 0.15 116.97 120.37 2qop h TYR 138 Ca 0.03 -0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.64 2qop h TYR 138 Cb 1.07 -0.34 -0.01 0.00 1.00 0.00 0.00 36.73 38.45 2qop h TYR 138 CO 0.06 0.68 -0.40 -0.44 -0.00 0.00 0.00 178.16 178.07 2qop h ASP 139 N 1.07 0.39 0.01 3.88 5.19 -1.59 -0.51 116.42 124.86 2qop h ASP 139 Ca 0.28 -0.16 -0.14 0.00 -0.62 0.00 0.00 57.03 56.39 2qop h ASP 139 Cb -0.05 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.35 2qop h ASP 139 CO -0.05 0.75 -0.44 -0.09 -3.12 0.00 0.00 179.24 176.28 2qop h ARG 140 N 0.31 0.52 -0.00 3.56 2.43 -0.74 -2.94 114.38 117.52 2qop h ARG 140 Ca 0.03 -0.28 -0.24 0.00 -0.81 0.00 0.00 59.98 58.68 2qop h ARG 140 Cb 0.84 0.01 0.02 0.00 -0.42 0.00 0.00 29.97 30.42 2qop h ARG 140 CO 0.07 0.86 -0.92 0.82 -1.51 0.00 0.00 179.97 179.29 2qop h ILE 141 N 0.42 1.32 -0.98 1.20 1.08 -0.58 -3.12 117.51 116.86 2qop h ILE 141 Ca 0.03 -2.20 0.07 0.00 -0.39 0.00 0.00 64.86 62.38 2qop h ILE 141 Cb 0.95 2.44 -0.07 0.00 -3.07 0.00 0.00 36.82 37.07 2qop h ILE 141 CO 0.08 0.67 0.63 -0.33 -0.69 0.00 0.00 178.15 178.51 2qop h GLU 142 N 0.25 1.07 0.00 2.37 5.08 -1.09 0.11 114.58 122.38 2qop h GLU 142 Ca -0.12 -0.06 -0.11 0.00 -1.00 0.00 0.00 59.36 58.07 2qop h GLU 142 Cb 1.59 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 30.58 2qop h GLU 142 CO 0.18 0.71 -0.51 1.96 -1.00 0.00 0.00 179.01 180.35 2qop h GLN 143 N 1.10 0.00 -0.05 2.33 1.08 -1.61 0.18 115.11 118.15 2qop h GLN 143 Ca 0.43 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 57.47 2qop h GLN 143 Cb 0.23 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.65 2qop h GLN 143 CO -0.18 0.51 -0.67 1.15 -0.95 0.00 0.00 178.83 178.69 2qop h THR 144 N 0.00 1.42 -0.18 -0.54 2.02 -1.23 -0.88 112.91 113.52 2qop h THR 144 Ca -0.01 -2.15 -0.12 0.00 0.77 0.00 0.00 66.41 64.90 2qop h THR 144 Cb 1.15 2.13 0.00 0.00 -1.74 0.00 0.00 68.15 69.69 2qop h THR 144 CO 0.07 0.63 -0.37 -0.07 0.37 0.00 0.00 175.52 176.15 2qop h LEU 145 N 0.14 0.63 -1.44 2.58 3.38 -0.59 -3.05 115.31 116.96 2qop h LEU 145 Ca -0.01 -0.55 -0.01 0.00 0.09 0.00 0.00 57.88 57.40 2qop h LEU 145 Cb 1.20 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 2qop h LEU 145 CO 0.10 1.07 0.28 0.11 0.09 0.00 0.00 178.44 180.09 2qop h LYS 146 N 0.22 0.65 0.00 1.13 1.79 -0.60 -1.30 116.57 118.47 2qop h LYS 146 Ca 0.00 -0.06 -0.04 0.00 -2.18 0.00 0.00 60.65 58.38 2qop h LYS 146 Cb 0.97 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 31.47 2qop h LYS 146 CO 0.08 0.47 -0.18 1.25 -1.08 0.00 0.00 179.45 179.99 2qop h HIS 147 N 0.66 0.00 0.00 -1.35 2.76 -1.16 -1.55 115.15 114.51 2qop h HIS 147 Ca 0.17 0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 58.19 2qop h HIS 147 Cb -0.00 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 28.93 2qop h HIS 147 CO 0.00 0.18 -0.96 0.00 -1.30 0.00 0.00 177.93 175.85 2qop h ILE 149 N 0.00 1.29 -0.18 0.00 1.08 -0.76 -0.93 117.51 118.00 2qop h ILE 149 Ca -0.08 -1.69 -0.09 0.00 -0.39 0.00 0.00 64.86 62.62 2qop h ILE 149 Cb 1.56 1.59 -0.01 0.00 -3.07 0.00 0.00 36.82 36.89 2qop h ILE 149 CO 0.07 0.55 -0.28 -0.33 -0.69 0.00 0.00 178.15 177.47 2qop h GLU 150 N 0.62 0.34 -0.01 2.37 5.08 -1.39 -2.31 114.58 119.28 2qop h GLU 150 Ca 0.03 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2qop h GLU 150 Cb 1.07 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.30 2qop h GLU 150 CO 0.11 0.60 -0.07 0.00 -1.00 0.00 0.00 179.01 178.64 2qop n ALA 151 N -2.48 2.72 -3.07 3.43 0.00 -1.19 -4.94 120.51 114.98 2qop n ALA 151 Ca -0.01 -0.33 -0.23 0.00 0.00 0.00 0.00 53.44 52.88 2qop n ALA 151 Cb 0.40 -1.29 0.04 0.00 0.00 0.00 0.00 19.45 18.60 2qop n ALA 151 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2qop n LYS 152 N -0.57 -5.18 0.06 0.00 3.00 -0.87 -4.89 118.16 109.71 2qop n LYS 152 Ca 0.18 0.91 0.11 0.00 -0.00 0.00 0.00 58.31 59.51 2qop n LYS 152 Cb 0.28 -5.80 -0.06 0.00 0.00 0.00 0.00 35.03 29.44 2qop n LYS 152 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.40 176.07 2qop n MET 153 N -4.13 0.62 -4.56 1.64 2.81 -0.39 -4.88 117.12 108.24 2qop n MET 153 Ca -0.11 -0.00 -0.22 0.00 -1.81 0.00 0.00 57.70 55.57 2qop n MET 153 Cb 0.62 -1.71 -0.14 0.00 -0.71 0.00 0.00 33.22 31.27 2qop n MET 153 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2qop s LEU 154 N -5.02 2.09 0.37 4.03 1.43 -1.13 -4.97 118.68 115.48 2qop s LEU 154 Ca -0.03 -0.35 -0.25 0.00 -1.03 0.00 0.00 54.13 52.47 2qop s LEU 154 Cb 0.11 -0.71 -0.13 0.00 0.03 0.00 0.00 46.19 45.49 2qop s LEU 154 CO 0.84 0.13 0.83 -2.65 0.23 0.00 0.00 176.35 175.73 2qop n PRO 155 N 2.38 1.01 0.19 1.29 -0.02 -1.26 -4.43 135.00 134.17 2qop n PRO 155 Ca -0.16 0.36 0.03 0.00 -2.02 0.00 0.00 63.50 61.71 2qop n PRO 155 Cb 0.55 -1.75 0.37 0.00 -0.02 0.00 0.00 33.50 32.65 2qop n PRO 155 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qop h ALA 156 N 1.39 1.41 -0.32 3.55 0.00 -1.97 -2.96 119.26 120.36 2qop h ALA 156 Ca -0.41 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.14 2qop h ALA 156 Cb 1.36 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.07 2qop h ALA 156 CO 0.56 0.44 0.06 -0.40 0.00 0.00 0.00 179.25 179.91 2qop n ASP 157 N -4.11 3.35 -4.72 0.00 5.75 -1.26 -4.90 116.55 110.67 2qop n ASP 157 Ca -0.02 -2.52 -0.41 0.00 -0.01 0.00 0.00 54.79 51.83 2qop n ASP 157 Cb 0.39 -0.61 -0.04 0.00 -1.03 0.00 0.00 41.12 39.84 2qop n ASP 157 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 2qop s LEU 158 N -1.41 4.38 -0.34 -2.12 2.96 -1.12 -2.88 118.68 118.15 2qop s LEU 158 Ca 0.27 1.53 -0.29 0.00 -0.22 0.00 0.00 54.13 55.42 2qop s LEU 158 Cb 0.21 -3.40 0.02 0.00 0.50 0.00 0.00 46.19 43.52 2qop s LEU 158 CO 0.07 -0.17 1.08 -0.04 -1.32 0.00 0.00 176.35 175.98 2qop s MET 159 N 0.70 4.02 0.14 1.98 -1.94 -1.08 -4.94 119.30 118.20 2qop s MET 159 Ca 0.46 1.01 -0.09 0.00 -1.71 0.00 0.00 55.69 55.36 2qop s MET 159 Cb -0.20 -3.76 -0.04 0.00 2.01 0.00 0.00 34.83 32.84 2qop s MET 159 CO 0.25 -0.96 1.40 1.79 -0.01 0.00 0.00 175.02 177.49 2qop h THR 160 N 5.79 1.30 -0.39 2.05 1.35 -1.94 -2.09 112.91 118.98 2qop h THR 160 Ca -0.21 -1.89 -0.06 0.00 -0.55 0.00 0.00 66.41 63.71 2qop h THR 160 Cb 1.06 1.84 -0.01 0.00 -1.73 0.00 0.00 68.15 69.31 2qop h THR 160 CO 1.04 0.60 0.02 -0.09 -0.25 0.00 0.00 175.52 176.83 2qop h ARG 161 N 0.52 0.67 -0.56 4.72 9.65 -1.95 -1.22 114.38 126.21 2qop h ARG 161 Ca -0.02 -0.21 -0.04 0.00 -1.10 0.00 0.00 59.98 58.62 2qop h ARG 161 Cb 1.25 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 29.74 2qop h ARG 161 CO 0.13 0.76 0.17 0.00 2.80 0.00 0.00 179.97 183.83 2qop h ARG 162 N 0.50 0.84 0.00 0.20 2.47 -1.97 -2.63 114.38 113.78 2qop h ARG 162 Ca 0.11 -0.15 -0.13 0.00 -1.26 0.00 0.00 59.98 58.55 2qop h ARG 162 Cb 0.45 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.61 2qop h ARG 162 CO 0.02 0.73 -0.62 0.00 0.56 0.00 0.00 179.97 180.65 2qop h ALA 163 N 1.38 0.95 -0.19 0.04 0.00 -1.23 -2.97 119.26 117.24 2qop h ALA 163 Ca 0.19 -0.57 -0.18 0.00 0.00 0.00 0.00 54.91 54.35 2qop h ALA 163 Cb 0.24 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2qop h ALA 163 CO -0.01 0.78 -0.60 0.00 0.00 0.00 0.00 179.25 179.41 2qop h ALA 164 N 1.38 0.59 -0.43 0.00 0.00 -0.90 -1.61 119.26 118.28 2qop h ALA 164 Ca -0.01 -0.54 -0.14 0.00 0.00 0.00 0.00 54.91 54.22 2qop h ALA 164 Cb 1.12 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2qop h ALA 164 CO 0.08 0.70 -0.30 0.82 0.00 0.00 0.00 179.25 180.55 2qop h ILE 165 N 0.47 1.27 -0.13 0.00 1.08 -1.49 -3.11 117.51 115.60 2qop h ILE 165 Ca -0.00 -1.47 -0.04 0.00 -0.39 0.00 0.00 64.86 62.96 2qop h ILE 165 Cb 1.18 1.26 -0.00 0.00 -3.07 0.00 0.00 36.82 36.18 2qop h ILE 165 CO 0.12 0.50 -0.07 0.40 -0.69 0.00 0.00 178.15 178.40 2qop h ILE 166 N 0.80 1.32 -0.17 -0.67 1.08 -1.51 -2.83 117.51 115.53 2qop h ILE 166 Ca 0.08 -1.13 0.04 0.00 -0.39 0.00 0.00 64.86 63.47 2qop h ILE 166 Cb 0.88 1.79 -0.04 0.00 -3.07 0.00 0.00 36.82 36.38 2qop h ILE 166 CO 0.08 0.33 -0.10 -0.03 -0.69 0.00 0.00 178.15 177.73 2qop h MET 167 N -0.06 -0.10 -0.46 2.37 4.05 -1.33 0.30 114.93 119.70 2qop h MET 167 Ca 0.03 0.01 -0.11 0.00 -0.28 0.00 0.00 59.70 59.35 2qop h MET 167 Cb 0.55 0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.35 2qop h MET 167 CO 0.02 -0.06 -0.15 -0.09 0.23 0.00 0.00 176.91 176.86 2qop h ARG 168 N -0.10 0.86 -0.30 0.39 2.43 -1.64 -1.78 114.38 114.25 2qop h ARG 168 Ca 0.10 -0.32 -0.12 0.00 -0.81 0.00 0.00 59.98 58.83 2qop h ARG 168 Cb 0.25 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 2qop h ARG 168 CO -0.23 0.95 -0.32 0.78 -1.51 0.00 0.00 179.97 179.65 2qop h GLY 169 N 0.96 0.69 1.07 2.80 0.00 -1.19 -1.67 103.07 105.72 2qop h GLY 169 Ca 0.12 -0.63 -0.18 0.00 0.00 0.00 0.00 47.33 46.64 2qop h GLY 169 CO 0.05 0.57 -0.60 -1.82 0.00 0.00 0.00 176.54 174.74 2qop h TYR 170 N 0.54 0.96 0.10 5.60 3.20 -0.31 -2.48 116.97 124.57 2qop h TYR 170 Ca 0.06 -0.39 -0.01 0.00 3.14 0.00 0.00 58.73 61.54 2qop h TYR 170 Cb 0.81 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.92 2qop h TYR 170 CO 0.04 1.20 -0.05 0.82 -1.64 0.00 0.00 178.16 178.52 2qop h ILE 171 N 0.45 0.89 0.00 1.81 1.08 -1.33 -3.04 117.51 117.36 2qop h ILE 171 Ca -0.02 -1.35 -0.03 0.00 -0.39 0.00 0.00 64.86 63.07 2qop h ILE 171 Cb 1.22 1.57 -0.00 0.00 -3.07 0.00 0.00 36.82 36.53 2qop h ILE 171 CO 0.13 0.26 -0.14 0.28 -0.69 0.00 0.00 178.15 177.99 2qop h SER 172 N -0.92 0.00 -0.23 1.72 0.02 -1.46 -2.24 113.55 110.44 2qop h SER 172 Ca -0.01 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.84 2qop h SER 172 Cb 0.53 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.07 2qop h SER 172 CO 0.02 0.14 -0.24 1.23 -1.14 0.00 0.00 176.83 176.84 2qop h GLY 173 N 1.35 0.62 2.00 -3.77 0.00 -1.53 -1.21 103.07 100.52 2qop h GLY 173 Ca -0.00 -0.64 -0.07 0.00 0.00 0.00 0.00 47.33 46.62 2qop h GLY 173 CO 0.02 0.58 -0.31 1.41 0.00 0.00 0.00 176.54 178.23 2qop h LEU 174 N 0.26 0.00 -0.06 3.11 3.38 -1.38 -2.29 115.31 118.34 2qop h LEU 174 Ca 0.03 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 2qop h LEU 174 Cb 0.80 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.55 2qop h LEU 174 CO 0.06 0.31 -0.38 0.24 0.09 0.00 0.00 178.44 178.76 2qop h MET 175 N 0.00 0.37 0.00 1.13 2.86 -1.33 -2.92 114.93 115.04 2qop h MET 175 Ca -0.00 -0.31 -0.07 0.00 -2.06 0.00 0.00 59.70 57.25 2qop h MET 175 Cb 0.77 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.49 2qop h MET 175 CO 0.04 0.96 -0.35 1.05 1.06 0.00 0.00 176.91 179.67 2qop h GLU 176 N -0.13 0.00 0.00 1.72 -0.00 -1.18 -2.46 114.58 112.53 2qop h GLU 176 Ca -0.03 0.00 -0.21 0.00 -0.00 0.00 0.00 59.36 59.12 2qop h GLU 176 Cb 1.05 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.80 2qop h GLU 176 CO 0.08 0.35 -0.91 -0.91 -0.00 0.00 0.00 179.01 177.62 2qop h ASN 177 N 0.00 0.39 0.43 3.06 2.35 -1.50 -2.86 115.58 117.46 2qop h ASN 177 Ca -0.00 -0.32 -0.22 0.00 -0.55 0.00 0.00 56.30 55.21 2qop h ASN 177 Cb 0.95 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 39.20 2qop h ASN 177 CO 0.05 1.12 -0.94 -0.25 -1.65 0.00 0.00 177.43 175.76 2qop h TRP 178 N 0.17 0.50 0.00 1.19 7.01 -1.41 -1.42 115.95 121.99 2qop h TRP 178 Ca -0.06 -0.28 -0.08 0.00 2.11 0.00 0.00 58.89 60.58 2qop h TRP 178 Cb 1.54 -0.05 -0.01 0.00 -2.10 0.00 0.00 29.16 28.54 2qop h TRP 178 CO 0.04 1.10 -0.37 -0.07 -2.79 0.00 0.00 178.44 176.35 2qop h LEU 179 N 0.18 0.00 0.02 0.65 3.38 -1.53 -2.43 115.31 115.58 2qop h LEU 179 Ca -0.07 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 2qop h LEU 179 Cb 1.58 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.34 2qop h LEU 179 CO 0.16 0.37 -0.44 0.15 0.09 0.00 0.00 178.44 178.77 2qop h PHE 180 N 0.00 0.41 -3.07 1.13 3.04 -1.47 -3.43 116.94 113.55 2qop h PHE 180 Ca -0.00 -0.24 -0.59 0.00 3.98 0.00 0.00 57.97 61.12 2qop h PHE 180 Cb 0.91 -0.04 -0.40 0.00 2.56 0.00 0.00 35.95 38.98 2qop h PHE 180 CO 0.00 1.07 -0.76 0.00 -2.02 0.00 0.00 178.31 176.61 2qop s ALA 181 N -3.00 1.67 0.04 2.41 0.00 -0.54 -4.99 121.76 117.36 2qop s ALA 181 Ca -0.15 -1.95 0.17 0.00 0.00 0.00 0.00 51.96 50.04 2qop s ALA 181 Cb 0.02 -1.70 0.43 0.00 0.00 0.00 0.00 23.12 21.87 2qop s ALA 181 CO 0.78 -1.81 1.61 -1.35 0.00 0.00 0.00 175.76 175.00 2qop h PRO 182 N 7.64 0.00 -0.00 0.00 0.11 -1.71 -3.24 132.00 134.80 2qop h PRO 182 Ca -0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.02 2qop h PRO 182 Cb 0.99 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.10 2qop h PRO 182 CO 0.46 0.44 -0.26 1.04 -0.21 0.00 0.00 178.00 179.48 2qop n GLN 183 N -3.40 0.44 -0.03 1.05 3.00 -1.26 -4.20 117.38 112.98 2qop n GLN 183 Ca 0.01 -0.21 -0.13 0.00 -0.01 0.00 0.00 57.00 56.65 2qop n GLN 183 Cb 0.61 -1.50 -0.10 0.00 0.00 0.00 0.00 30.24 29.25 2qop n GLN 183 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2qop h SER 184 N 0.51 0.10 -5.11 1.08 4.64 -1.94 -3.47 113.55 109.35 2qop h SER 184 Ca 0.00 -0.58 -0.08 0.00 -0.47 0.00 0.00 61.79 60.66 2qop h SER 184 Cb 0.46 -0.03 -0.14 0.00 -0.31 0.00 0.00 62.40 62.38 2qop h SER 184 CO 0.00 0.67 -0.26 0.72 -0.87 0.00 0.00 176.83 177.08 2qop s PHE 185 N -3.88 -0.00 -0.47 4.77 -0.12 -1.26 -5.13 117.98 111.89 2qop s PHE 185 Ca -0.16 -0.34 -0.20 0.00 -0.05 0.00 0.00 56.93 56.19 2qop s PHE 185 Cb 0.02 0.06 0.04 0.00 -0.63 0.00 0.00 43.02 42.51 2qop s PHE 185 CO 0.70 -0.58 0.61 0.34 -0.05 0.00 0.00 175.22 176.24 2qop s ASP 186 N -2.68 6.26 0.14 1.98 -1.08 -1.26 -4.89 116.67 115.15 2qop s ASP 186 Ca 0.02 -0.64 0.04 0.00 -0.52 0.00 0.00 52.55 51.45 2qop s ASP 186 Cb 0.03 -2.30 -0.10 0.00 -1.46 0.00 0.00 42.92 39.10 2qop s ASP 186 CO -0.10 -0.81 1.32 0.25 0.52 0.00 0.00 175.17 176.36 2qop h LEU 187 N 9.64 0.16 -0.20 -1.34 5.85 -1.94 -3.11 115.31 124.38 2qop h LEU 187 Ca -0.26 -0.15 -0.11 0.00 0.84 0.00 0.00 57.88 58.20 2qop h LEU 187 Cb 1.10 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 42.07 2qop h LEU 187 CO 0.91 1.03 -0.30 0.50 -0.34 0.00 0.00 178.44 180.24 2qop h LYS 188 N 0.05 0.55 0.00 1.25 3.64 -1.92 -1.57 116.57 118.57 2qop h LYS 188 Ca -0.04 -0.33 -0.13 0.00 -1.27 0.00 0.00 60.65 58.88 2qop h LYS 188 Cb 1.64 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.48 2qop h LYS 188 CO 0.14 0.94 -0.60 0.87 -2.27 0.00 0.00 179.45 178.53 2qop h LYS 189 N 0.22 0.00 -0.57 1.90 1.57 -1.99 -3.20 116.57 114.51 2qop h LYS 189 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2qop h LYS 189 Cb 0.89 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.20 2qop h LYS 189 CO 0.07 0.60 0.00 0.39 -0.57 0.00 0.00 179.45 179.94 2qop n GLU 190 N -3.63 2.72 -0.13 3.15 -0.58 -1.17 -4.60 120.64 116.39 2qop n GLU 190 Ca -0.01 -2.41 -0.08 0.00 -0.42 0.00 0.00 57.16 54.24 2qop n GLU 190 Cb 0.64 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 30.05 2qop n GLU 190 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2qop h ALA 191 N 3.53 0.52 0.00 0.62 0.00 -1.27 -0.85 119.26 121.80 2qop h ALA 191 Ca 0.00 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2qop h ALA 191 Cb 0.90 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2qop h ALA 191 CO 0.00 -0.00 -0.22 0.00 0.00 0.00 0.00 179.25 179.03 2qop h ARG 192 N 0.54 0.00 0.10 0.00 3.08 -1.82 -2.49 114.38 113.79 2qop h ARG 192 Ca 0.15 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.92 2qop h ARG 192 Cb -0.02 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.05 2qop h ARG 192 CO -0.03 0.22 -1.19 -0.44 -1.07 0.00 0.00 179.97 177.47 2qop h ASP 193 N 0.00 0.69 -0.45 7.04 3.45 -1.73 -2.91 116.42 122.52 2qop h ASP 193 Ca -0.00 -0.65 -0.14 0.00 0.43 0.00 0.00 57.03 56.67 2qop h ASP 193 Cb 0.54 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 39.08 2qop h ASP 193 CO 0.03 1.47 -0.25 1.88 -1.57 0.00 0.00 179.24 180.80 2qop h TYR 194 N 0.21 1.12 0.00 4.55 0.05 -0.93 -2.71 116.97 119.27 2qop h TYR 194 Ca -0.15 -0.28 -0.11 0.00 0.05 0.00 0.00 58.73 58.24 2qop h TYR 194 Cb 1.86 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 39.33 2qop h TYR 194 CO 0.09 1.11 -0.51 0.28 -1.05 0.00 0.00 178.16 178.08 2qop h VAL 195 N 0.83 1.29 -0.62 -2.88 2.07 -1.57 -2.35 116.25 113.02 2qop h VAL 195 Ca 0.10 -1.78 -0.06 0.00 0.82 0.00 0.00 66.70 65.78 2qop h VAL 195 Cb 0.83 1.98 -0.03 0.00 -1.52 0.00 0.00 31.29 32.56 2qop h VAL 195 CO 0.07 0.50 0.16 0.00 0.02 0.00 0.00 177.57 178.32 2qop h ALA 196 N 1.49 0.81 -0.31 1.67 0.00 -1.32 -1.26 119.26 120.35 2qop h ALA 196 Ca -0.01 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.55 2qop h ALA 196 Cb 0.94 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2qop h ALA 196 CO 0.07 0.52 -0.33 0.82 0.00 0.00 0.00 179.25 180.32 2qop h ILE 197 N 0.90 1.28 -0.44 0.00 2.04 -1.37 -1.69 117.51 118.23 2qop h ILE 197 Ca 0.20 -1.47 0.02 0.00 1.00 0.00 0.00 64.86 64.61 2qop h ILE 197 Cb 0.34 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.79 2qop h ILE 197 CO 0.00 0.48 0.25 0.25 0.00 0.00 0.00 178.15 179.12 2qop h LEU 198 N 0.57 0.39 -0.49 1.44 7.12 -1.15 -2.42 115.31 120.77 2qop h LEU 198 Ca 0.06 0.01 -0.17 0.00 0.13 0.00 0.00 57.88 57.92 2qop h LEU 198 Cb 0.84 -0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 40.89 2qop h LEU 198 CO 0.07 0.28 -0.60 -0.07 -0.13 0.00 0.00 178.44 177.99 2qop h LEU 199 N 0.50 0.58 -0.20 2.25 4.07 -1.16 -3.17 115.31 118.18 2qop h LEU 199 Ca 0.18 -0.33 0.00 0.00 0.08 0.00 0.00 57.88 57.81 2qop h LEU 199 Cb 0.04 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 41.61 2qop h LEU 199 CO -0.10 1.04 0.00 -0.62 -1.08 0.00 0.00 178.44 177.69 2qop n GLU 200 N -3.93 0.10 -0.08 1.13 1.02 -0.65 -3.01 120.64 115.22 2qop n GLU 200 Ca -0.03 0.24 -0.13 0.00 -0.02 0.00 0.00 57.16 57.22 2qop n GLU 200 Cb 0.63 -1.65 -0.05 0.00 -0.02 0.00 0.00 31.44 30.34 2qop n GLU 200 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 2qop h MET 201 N 0.00 0.54 0.00 3.49 2.86 -1.41 -3.01 114.93 117.39 2qop h MET 201 Ca 0.00 -0.27 -0.02 0.00 -2.06 0.00 0.00 59.70 57.35 2qop h MET 201 Cb 0.41 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.07 2qop h MET 201 CO 0.00 0.85 -0.10 1.88 1.06 0.00 0.00 176.91 180.60 2qop h TYR 202 N 0.23 0.00 -0.01 -0.22 0.99 -1.69 -2.30 116.97 113.97 2qop h TYR 202 Ca 0.04 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.77 2qop h TYR 202 Cb 0.73 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.46 2qop h TYR 202 CO 0.07 0.10 -0.12 1.47 -0.00 0.00 0.00 178.16 179.69 2qop n LEU 203 N -3.17 1.80 0.00 3.88 -0.00 -1.25 -4.45 117.00 113.81 2qop n LEU 203 Ca 0.02 -0.90 0.00 0.00 -0.00 0.00 0.00 56.01 55.13 2qop n LEU 203 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.88 2qop n LEU 203 CO 0.32 0.34 -0.25 0.18 -0.00 0.00 0.00 177.39 177.98 2qop n LEU 204 N 0.33 0.03 -4.72 1.47 4.32 -1.14 -4.94 117.00 112.36 2qop n LEU 204 Ca 0.07 0.00 -0.42 0.00 -0.02 0.00 0.00 56.01 55.64 2qop n LEU 204 Cb 0.30 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.07 2qop n LEU 204 CO 0.12 -0.24 1.19 0.00 -1.22 0.00 0.00 177.39 177.24 2qop n PRO 206 N 4.06 -0.68 0.00 0.00 -0.02 -1.26 -4.19 135.00 132.91 2qop n PRO 206 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 2qop n PRO 206 Cb 0.40 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.88 2qop n PRO 206 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2qop n THR 207 N -2.15 0.00 0.16 3.45 -2.24 -1.26 -4.39 114.28 107.85 2qop n THR 207 Ca 0.00 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.81 2qop n THR 207 Cb 0.00 0.00 0.19 0.00 -2.10 0.00 0.00 70.33 68.42 2qop n THR 207 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2qop h LEU 208 N 0.00 0.00-10.17 3.22 3.38 -1.95 -3.45 115.31 106.34 2qop h LEU 208 Ca 0.00 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 2qop h LEU 208 Cb 0.00 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.77 2qop h LEU 208 CO 0.00 0.51 0.37 -0.13 0.09 0.00 0.00 178.44 179.28 2qop s ARG 209 N -3.36 3.92 0.02 1.13 1.81 -1.26 -2.62 118.95 118.58 2qop s ARG 209 Ca 0.01 1.02 -0.09 0.00 -1.72 0.00 0.00 55.73 54.94 2qop s ARG 209 Cb 0.10 -2.13 0.01 0.00 -0.45 0.00 0.00 34.95 32.48 2qop s ARG 209 CO 0.73 -0.30 0.19 0.54 -0.68 0.00 0.00 175.30 175.77 2qop s ASN 210 N -2.87 0.00 1.18 0.23 4.22 -1.14 -4.98 114.94 111.57 2qop s ASN 210 Ca 0.60 -0.23 -0.16 0.00 -2.14 0.00 0.00 52.86 50.93 2qop s ASN 210 Cb -0.11 0.25 0.28 0.00 1.28 0.00 0.00 41.25 42.95 2qop s ASN 210 CO 0.29 -0.46 1.04 -2.16 -2.04 0.00 0.00 177.10 173.77 2qop s PRO 211 N -1.87 -1.00 0.00 3.55 0.04 -1.26 -4.93 135.00 129.53 2qop s PRO 211 Ca -0.11 0.42 0.01 0.00 0.04 0.00 0.00 61.00 61.36 2qop s PRO 211 Cb -0.05 -1.58 0.06 0.00 0.04 0.00 0.00 34.50 32.97 2qop s PRO 211 CO -0.00 -3.67 0.55 0.00 0.04 0.00 0.00 177.00 173.92