#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qhd h VAL 2 N 0.00 0.37 -0.04 2.46 3.04 -1.65 -0.94 116.25 119.48 2qhd h VAL 2 Ca 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.68 2qhd h VAL 2 Cb 0.00 0.97 -0.00 0.00 -2.01 0.00 0.00 31.29 30.25 2qhd h VAL 2 CO 0.00 0.00 -0.00 0.58 -1.01 0.00 0.00 177.57 177.14 2qhd h VAL 3 N 0.00 1.26 -0.39 1.51 2.07 -1.96 -1.35 116.25 117.39 2qhd h VAL 3 Ca 0.01 -0.80 -0.02 0.00 0.82 0.00 0.00 66.70 66.71 2qhd h VAL 3 Cb 0.08 1.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 2qhd h VAL 3 CO -0.00 0.22 0.17 -0.33 0.02 0.00 0.00 177.57 177.64 2qhd h GLU 4 N -0.23 0.57 -0.67 1.57 3.07 -1.58 -2.34 114.58 114.97 2qhd h GLU 4 Ca 0.01 -0.10 0.09 0.00 -0.50 0.00 0.00 59.36 58.86 2qhd h GLU 4 Cb 0.35 -0.10 -0.07 0.00 -0.84 0.00 0.00 28.75 28.09 2qhd h GLU 4 CO 0.00 0.53 0.32 1.25 -1.40 0.00 0.00 179.01 179.71 2qhd h LEU 5 N 0.48 0.41 -0.81 1.33 5.85 -1.26 -1.03 115.31 120.30 2qhd h LEU 5 Ca 0.13 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 2qhd h LEU 5 Cb 0.16 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 2qhd h LEU 5 CO -0.01 0.24 0.38 1.23 -0.34 0.00 0.00 178.44 179.94 2qhd h GLY 6 N 0.56 1.25 0.98 3.75 0.00 -1.02 -1.76 103.07 106.83 2qhd h GLY 6 Ca 0.33 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 2qhd h GLY 6 CO -0.26 0.60 0.24 0.50 0.00 0.00 0.00 176.54 177.62 2qhd h LYS 7 N 1.15 0.78 -0.61 4.80 1.57 -0.75 -1.98 116.57 121.54 2qhd h LYS 7 Ca 0.28 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2qhd h LYS 7 Cb 0.14 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 2qhd h LYS 7 CO -0.03 0.66 0.39 0.52 -0.57 0.00 0.00 179.45 180.43 2qhd h MET 8 N 0.72 0.81 -0.25 3.15 2.86 -1.00 -0.66 114.93 120.56 2qhd h MET 8 Ca 0.18 -0.06 0.04 0.00 -2.06 0.00 0.00 59.70 57.80 2qhd h MET 8 Cb 0.16 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.60 2qhd h MET 8 CO -0.02 0.55 0.02 0.82 1.06 0.00 0.00 176.91 179.34 2qhd h ILE 9 N 0.83 0.85 -0.32 -1.22 1.08 -1.00 0.17 117.51 117.89 2qhd h ILE 9 Ca 0.22 -0.04 -0.00 0.00 -0.39 0.00 0.00 64.86 64.65 2qhd h ILE 9 Cb -0.07 0.73 -0.02 0.00 -3.07 0.00 0.00 36.82 34.39 2qhd h ILE 9 CO -0.05 0.02 0.20 0.40 -0.69 0.00 0.00 178.15 178.03 2qhd h ILE 10 N 0.11 1.11 -0.81 -0.67 2.04 -1.09 0.15 117.51 118.34 2qhd h ILE 10 Ca 0.12 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 2qhd h ILE 10 Cb 0.14 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 2qhd h ILE 10 CO -0.18 0.11 0.49 1.56 0.00 0.00 0.00 178.15 180.13 2qhd h GLN 11 N 0.42 1.10 0.15 2.37 4.20 -0.50 0.48 115.11 123.34 2qhd h GLN 11 Ca 0.12 -0.09 -0.35 0.00 0.06 0.00 0.00 58.65 58.38 2qhd h GLN 11 Cb -0.00 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.54 2qhd h GLN 11 CO -0.02 0.77 -1.82 0.93 -0.67 0.00 0.00 178.83 178.02 2qhd h GLU 12 N 1.12 0.33 0.00 1.46 4.39 -0.43 -3.40 114.58 118.04 2qhd h GLU 12 Ca 0.29 -0.56 0.00 0.00 0.34 0.00 0.00 59.36 59.43 2qhd h GLU 12 Cb -0.05 0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 2qhd h GLU 12 CO -0.06 1.27 -1.15 0.25 -1.16 0.00 0.00 179.01 178.16 2qhd n THR 13 N -3.59 0.00 -0.97 1.13 -2.24 0.51 -4.66 114.28 104.45 2qhd n THR 13 Ca -0.28 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 2qhd n THR 13 Cb 1.04 0.74 0.00 0.00 -2.10 0.00 0.00 70.33 70.01 2qhd n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qhd n GLY 14 N 1.43 0.57 3.42 3.38 0.00 0.16 -5.00 105.19 109.15 2qhd n GLY 14 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 2qhd n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qhd s LYS 16 N -0.29 1.54 0.32 1.61 1.02 -1.26 -4.99 119.74 117.70 2qhd s LYS 16 Ca 0.00 -1.28 -0.17 0.00 0.02 0.00 0.00 55.97 54.54 2qhd s LYS 16 Cb 0.00 -1.98 -0.09 0.00 -0.52 0.00 0.00 37.83 35.24 2qhd s LYS 16 CO 0.00 0.46 0.78 -1.54 -0.92 0.00 0.00 175.35 174.13 2qhd s SER 17 N -2.05 6.88 0.27 2.83 1.04 -1.26 -2.91 113.70 118.50 2qhd s SER 17 Ca 0.15 1.39 0.01 0.00 0.48 0.00 0.00 55.95 57.98 2qhd s SER 17 Cb -0.10 -2.42 0.61 0.00 0.10 0.00 0.00 66.02 64.21 2qhd s SER 17 CO 0.07 -0.18 1.73 1.55 0.98 0.00 0.00 173.24 177.40 2qhd h PRO 18 N 2.46 0.51 -5.34 4.02 0.13 -1.93 -3.36 132.00 128.49 2qhd h PRO 18 Ca -0.48 -0.03 -0.62 0.00 -0.87 0.00 0.00 66.00 64.00 2qhd h PRO 18 Cb 1.18 -0.12 -0.13 0.00 0.13 0.00 0.00 31.00 32.06 2qhd h PRO 18 CO 0.65 0.34 -0.52 0.12 -0.23 0.00 0.00 178.00 178.35 2qhd s PHE 19 N -5.94 3.37 -2.48 1.56 5.36 -1.26 -0.02 117.98 118.57 2qhd s PHE 19 Ca -0.12 0.26 0.25 0.00 -0.96 0.00 0.00 56.93 56.35 2qhd s PHE 19 Cb 0.23 -2.09 0.34 0.00 -0.34 0.00 0.00 43.02 41.16 2qhd s PHE 19 CO 0.78 0.30 1.32 -0.35 -1.46 0.00 0.00 175.22 175.82 2qhd n PRO 20 N 3.28 1.70 -0.33 10.12 -0.04 -1.26 -4.94 135.00 143.53 2qhd n PRO 20 Ca -0.17 -1.32 0.04 0.00 -0.04 0.00 0.00 63.50 62.01 2qhd n PRO 20 Cb 0.52 -1.47 0.19 0.00 -0.04 0.00 0.00 33.50 32.70 2qhd n PRO 20 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2qhd h SER 21 N 3.22 0.85 0.00 3.54 0.02 -1.66 -3.32 113.55 116.20 2qhd h SER 21 Ca 0.00 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 2qhd h SER 21 Cb 0.79 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.19 2qhd h SER 21 CO 0.00 0.49 0.00 -1.22 -1.14 0.00 0.00 176.83 174.96 2qhd n TYR 22 N -4.64 0.00 0.32 3.45 4.02 0.97 -4.56 117.16 116.72 2qhd n TYR 22 Ca 0.16 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 58.13 2qhd n TYR 22 Cb 0.27 0.00 0.38 0.00 -0.02 0.00 0.00 39.34 39.97 2qhd n TYR 22 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 2qhd n THR 23 N -0.35 1.11 -2.03 -0.72 -2.24 -0.49 -3.69 114.28 105.88 2qhd n THR 23 Ca 0.00 0.38 -0.01 0.00 -2.27 0.00 0.00 64.05 62.14 2qhd n THR 23 Cb 0.02 -1.28 -0.02 0.00 -2.10 0.00 0.00 70.33 66.95 2qhd n THR 23 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2qhd n SER 24 N -1.91 -0.19 -4.73 3.42 3.41 -1.19 -4.07 113.62 108.37 2qhd n SER 24 Ca 0.01 -1.42 -0.42 0.00 -0.26 0.00 0.00 58.87 56.78 2qhd n SER 24 Cb 0.14 0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.09 2qhd n SER 24 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2qhd s TYR 25 N 0.00 3.12 0.00 7.33 5.04 -1.16 -3.80 117.35 127.88 2qhd s TYR 25 Ca 0.02 0.87 0.00 0.00 -2.44 0.00 0.00 57.07 55.52 2qhd s TYR 25 Cb 0.02 -3.81 0.00 0.00 0.35 0.00 0.00 41.96 38.53 2qhd s TYR 25 CO -0.01 -2.81 0.00 0.41 -1.34 0.00 0.00 175.55 171.80 2qhd n GLY 26 N 3.15 0.99 0.07 8.97 0.00 0.29 -1.82 105.19 116.84 2qhd n GLY 26 Ca 0.11 -0.60 0.12 0.00 0.00 0.00 0.00 46.02 45.65 2qhd n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qhd n PHE 28 N -2.17 0.00 -2.20 0.00 3.01 -1.25 -4.09 117.46 110.77 2qhd n PHE 28 Ca 0.03 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.07 2qhd n PHE 28 Cb 0.44 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.89 2qhd n PHE 28 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2qhd n GLY 30 N 3.82 0.79 0.00 0.00 0.00 -1.25 -2.97 105.19 105.58 2qhd n GLY 30 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2qhd n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qhd n GLY 31 N -2.23 3.67 0.00 -0.02 0.00 -0.75 -4.89 105.19 100.97 2qhd n GLY 31 Ca 0.00 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.25 2qhd n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qhd n GLY 32 N -1.51 4.04 0.09 -0.02 0.00 -1.26 -3.84 105.19 102.69 2qhd n GLY 32 Ca 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.51 2qhd n GLY 32 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qhd n GLU 33 N -1.51 0.00 -2.65 1.61 1.02 -1.26 -4.79 120.64 113.06 2qhd n GLU 33 Ca 0.00 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.73 2qhd n GLU 33 Cb 0.00 -0.72 -0.05 0.00 -0.02 0.00 0.00 31.44 30.65 2qhd n GLU 33 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2qhd s ARG 34 N -1.54 4.72 0.00 3.49 0.52 -1.26 -4.51 118.95 120.37 2qhd s ARG 34 Ca 0.00 1.58 0.00 0.00 -0.52 0.00 0.00 55.73 56.79 2qhd s ARG 34 Cb 0.00 -3.29 0.00 0.00 0.52 0.00 0.00 34.95 32.18 2qhd s ARG 34 CO 0.00 0.29 0.00 0.41 0.02 0.00 0.00 175.30 176.02 2qhd n GLY 35 N 1.79 4.81 3.78 -3.53 0.00 -1.21 -4.75 105.19 106.07 2qhd n GLY 35 Ca 0.00 -1.73 -0.30 0.00 0.00 0.00 0.00 46.02 43.99 2qhd n GLY 35 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qhd s PRO 36 N 3.36 2.04 0.50 1.61 0.04 -1.26 0.53 135.00 141.83 2qhd s PRO 36 Ca 0.00 0.76 -0.23 0.00 0.04 0.00 0.00 61.00 61.58 2qhd s PRO 36 Cb 0.00 -1.90 -0.06 0.00 0.04 0.00 0.00 34.50 32.58 2qhd s PRO 36 CO 0.00 -1.68 1.30 -1.25 0.04 0.00 0.00 177.00 175.41 2qhd s PRO 37 N -5.07 3.42 0.17 0.56 0.04 -1.26 -4.84 135.00 128.01 2qhd s PRO 37 Ca 0.61 2.10 -0.02 0.00 0.04 0.00 0.00 61.00 63.73 2qhd s PRO 37 Cb -0.15 -2.37 0.02 0.00 0.04 0.00 0.00 34.50 32.04 2qhd s PRO 37 CO 0.55 -0.92 1.41 -0.07 0.04 0.00 0.00 177.00 178.01 2qhd h LEU 38 N 1.79 0.49 0.00 -3.56 3.38 -1.97 -3.48 115.31 111.95 2qhd h LEU 38 Ca -0.50 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.13 2qhd h LEU 38 Cb 1.28 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2qhd h LEU 38 CO 0.59 1.09 0.00 -0.90 0.09 0.00 0.00 178.44 179.31 2qhd n ASP 39 N -3.82 0.00 -0.26 -0.43 5.68 -1.26 -5.01 116.55 111.45 2qhd n ASP 39 Ca -0.05 -0.82 -0.05 0.00 -0.50 0.00 0.00 54.79 53.37 2qhd n ASP 39 Cb 0.73 0.00 0.06 0.00 -1.14 0.00 0.00 41.12 40.77 2qhd n ASP 39 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2qhd h ALA 40 N 1.99 0.93 -0.43 2.12 0.00 -1.94 0.28 119.26 122.21 2qhd h ALA 40 Ca 0.00 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2qhd h ALA 40 Cb 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2qhd h ALA 40 CO 0.00 0.40 0.16 1.15 0.00 0.00 0.00 179.25 180.96 2qhd h THR 41 N 1.00 1.21 -0.49 0.00 2.02 -1.91 -1.49 112.91 113.25 2qhd h THR 41 Ca 0.26 -0.66 -0.05 0.00 0.77 0.00 0.00 66.41 66.73 2qhd h THR 41 Cb -0.03 0.84 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 2qhd h THR 41 CO -0.05 0.24 0.09 -0.78 0.37 0.00 0.00 175.52 175.39 2qhd h ASP 42 N 0.55 0.71 0.30 4.18 3.58 -1.82 -1.56 116.42 122.35 2qhd h ASP 42 Ca 0.14 -0.13 -0.09 0.00 0.42 0.00 0.00 57.03 57.37 2qhd h ASP 42 Cb 0.22 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 2qhd h ASP 42 CO -0.01 0.72 -0.39 0.03 -2.88 0.00 0.00 179.24 176.71 2qhd h ARG 43 N 0.73 0.13 -0.41 0.28 3.08 -0.67 -2.06 114.38 115.46 2qhd h ARG 43 Ca 0.16 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.17 2qhd h ARG 43 Cb 0.32 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 2qhd h ARG 43 CO 0.00 0.51 0.25 0.00 -1.07 0.00 0.00 179.97 179.66 2qhd h LEU 46 N 0.65 0.61 -1.32 0.00 5.85 -1.07 -0.55 115.31 119.47 2qhd h LEU 46 Ca 0.11 -0.31 -0.04 0.00 0.84 0.00 0.00 57.88 58.48 2qhd h LEU 46 Cb 0.56 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2qhd h LEU 46 CO 0.03 0.77 0.02 0.00 -0.34 0.00 0.00 178.44 178.92 2qhd h ALA 47 N 0.86 1.45 -0.35 1.25 0.00 -0.99 0.12 119.26 121.61 2qhd h ALA 47 Ca 0.10 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2qhd h ALA 47 Cb 0.46 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2qhd h ALA 47 CO 0.02 0.39 -0.06 1.25 0.00 0.00 0.00 179.25 180.85 2qhd h HIS 48 N 0.46 0.73 -0.67 0.00 -0.00 -0.75 0.55 115.15 115.48 2qhd h HIS 48 Ca 0.10 -0.15 0.01 0.00 -0.00 0.00 0.00 60.37 60.33 2qhd h HIS 48 Cb 0.27 -0.18 -0.03 0.00 -0.00 0.00 0.00 27.41 27.47 2qhd h HIS 48 CO 0.01 0.80 0.44 1.03 -0.00 0.00 0.00 177.93 180.21 2qhd h SER 49 N 0.45 0.77 -0.77 3.26 0.87 -0.57 -1.21 113.55 116.35 2qhd h SER 49 Ca 0.09 -0.03 -0.04 0.00 -1.23 0.00 0.00 61.79 60.59 2qhd h SER 49 Cb 0.55 -0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 62.28 2qhd h SER 49 CO 0.03 0.56 0.32 0.00 -0.53 0.00 0.00 176.83 177.22 2qhd h TYR 52 N 0.68 0.00 0.00 0.00 -1.99 -0.85 -0.22 116.97 114.59 2qhd h TYR 52 Ca 0.18 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.91 2qhd h TYR 52 Cb 0.04 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.77 2qhd h TYR 52 CO -0.02 0.09 0.00 -0.25 -0.00 0.00 0.00 178.16 177.98 2qhd n ASP 53 N -4.30 0.23 -0.59 3.88 8.00 -0.67 -1.36 116.55 121.74 2qhd n ASP 53 Ca -0.03 0.56 0.12 0.00 0.71 0.00 0.00 54.79 56.16 2qhd n ASP 53 Cb 0.17 -0.61 0.40 0.00 -0.02 0.00 0.00 41.12 41.06 2qhd n ASP 53 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2qhd n THR 54 N -1.77 0.15 -2.66 -3.53 -2.24 -0.09 -4.20 114.28 99.94 2qhd n THR 54 Ca 0.02 -0.35 -0.26 0.00 -2.27 0.00 0.00 64.05 61.19 2qhd n THR 54 Cb 0.16 0.50 -0.01 0.00 -2.10 0.00 0.00 70.33 68.88 2qhd n THR 54 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2qhd n LEU 55 N 0.40 4.40 0.17 3.22 4.77 -0.46 -4.84 117.00 124.65 2qhd n LEU 55 Ca 0.17 -5.31 0.13 0.00 -0.03 0.00 0.00 56.01 50.98 2qhd n LEU 55 Cb 0.37 -0.42 0.57 0.00 -2.33 0.00 0.00 43.42 41.60 2qhd n LEU 55 CO 0.14 2.25 0.89 1.55 -1.33 0.00 0.00 177.39 180.89 2qhd h PRO 56 N 2.74 0.00 -0.02 3.23 0.13 -1.75 -1.57 132.00 134.77 2qhd h PRO 56 Ca 0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.35 2qhd h PRO 56 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 2qhd h PRO 56 CO 0.82 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.19 2qhd n ASP 59 N -2.42 1.06 -4.55 1.44 5.75 -1.26 -4.90 116.55 111.67 2qhd n ASP 59 Ca 0.01 -1.38 -0.29 0.00 -0.01 0.00 0.00 54.79 53.13 2qhd n ASP 59 Cb 0.21 -0.01 -0.09 0.00 -1.03 0.00 0.00 41.12 40.20 2qhd n ASP 59 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2qhd n SER 67 N -1.14 2.40 0.13 0.00 7.64 -1.26 -4.98 113.62 116.40 2qhd n SER 67 Ca -0.11 -3.09 0.19 0.00 1.01 0.00 0.00 58.87 56.87 2qhd n SER 67 Cb 0.66 -0.69 0.73 0.00 -1.01 0.00 0.00 64.21 63.90 2qhd n SER 67 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2qhd h PRO 68 N 5.03 0.00 0.00 1.43 0.13 -1.91 0.65 132.00 137.33 2qhd h PRO 68 Ca 0.18 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.28 2qhd h PRO 68 Cb 0.77 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.89 2qhd h PRO 68 CO 0.67 0.00 -0.79 0.87 -0.23 0.00 0.00 178.00 178.52 2qhd h LYS 69 N 0.00 0.00 0.00 0.86 1.57 -1.93 -3.38 116.57 113.68 2qhd h LYS 69 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2qhd h LYS 69 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.43 2qhd h LYS 69 CO -0.00 0.07 -0.47 0.25 -0.57 0.00 0.00 179.45 178.72 2qhd n THR 70 N -2.84 0.00 -2.39 -0.16 -2.24 -0.83 -0.25 114.28 105.57 2qhd n THR 70 Ca -0.00 -0.20 -0.43 0.00 -2.27 0.00 0.00 64.05 61.15 2qhd n THR 70 Cb 0.59 0.70 -0.02 0.00 -2.10 0.00 0.00 70.33 69.50 2qhd n THR 70 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2qhd s ASP 71 N -1.35 6.58 0.50 3.42 2.15 0.16 -3.28 116.67 124.86 2qhd s ASP 71 Ca 0.00 1.15 -0.20 0.00 0.43 0.00 0.00 52.55 53.93 2qhd s ASP 71 Cb 0.00 -2.54 -0.08 0.00 -0.30 0.00 0.00 42.92 40.00 2qhd s ASP 71 CO 0.00 -1.17 1.04 -0.13 -0.17 0.00 0.00 175.17 174.74 2qhd s ARG 72 N 4.37 3.75 0.24 4.34 1.81 -1.26 -3.66 118.95 128.53 2qhd s ARG 72 Ca 0.58 1.35 -0.13 0.00 -1.72 0.00 0.00 55.73 55.81 2qhd s ARG 72 Cb -0.16 -2.09 -0.00 0.00 -0.45 0.00 0.00 34.95 32.24 2qhd s ARG 72 CO 0.26 -0.47 0.46 1.52 -0.68 0.00 0.00 175.30 176.38 2qhd s TYR 73 N -2.02 0.36 0.08 -0.53 -0.85 -1.26 -4.91 117.35 108.22 2qhd s TYR 73 Ca 0.67 -0.72 0.10 0.00 -0.52 0.00 0.00 57.07 56.60 2qhd s TYR 73 Cb -0.16 0.17 -0.03 0.00 0.38 0.00 0.00 41.96 42.31 2qhd s TYR 73 CO 0.22 -0.96 -0.26 0.15 -1.52 0.00 0.00 175.55 173.17 2qhd s LYS 74 N -4.01 1.64 0.16 -3.49 1.02 -1.26 -4.95 119.74 108.84 2qhd s LYS 74 Ca 0.22 -1.21 -0.12 0.00 0.02 0.00 0.00 55.97 54.88 2qhd s LYS 74 Cb -0.00 -1.96 0.00 0.00 -0.52 0.00 0.00 37.83 35.36 2qhd s LYS 74 CO 0.08 0.49 0.34 1.52 -0.92 0.00 0.00 175.35 176.85 2qhd s TYR 75 N -0.93 0.19 0.37 3.18 -0.85 -1.26 -2.70 117.35 115.35 2qhd s TYR 75 Ca 0.13 -0.55 0.03 0.00 -0.52 0.00 0.00 57.07 56.16 2qhd s TYR 75 Cb -0.10 0.08 -0.04 0.00 0.38 0.00 0.00 41.96 42.28 2qhd s TYR 75 CO 0.04 -0.74 0.09 0.15 -1.52 0.00 0.00 175.55 173.57 2qhd s LYS 76 N -3.92 1.81 -0.37 -3.49 -0.14 -0.66 -4.96 119.74 108.01 2qhd s LYS 76 Ca 0.12 -2.06 0.01 0.00 -1.36 0.00 0.00 55.97 52.68 2qhd s LYS 76 Cb 0.02 -0.76 0.11 0.00 -1.68 0.00 0.00 37.83 35.53 2qhd s LYS 76 CO -0.03 -0.34 0.15 1.03 -0.76 0.00 0.00 175.35 175.40 2qhd s ARG 77 N -3.81 1.09 -0.36 1.68 0.52 -1.25 0.28 118.95 117.10 2qhd s ARG 77 Ca 0.29 -1.61 -0.13 0.00 -0.52 0.00 0.00 55.73 53.76 2qhd s ARG 77 Cb 0.05 -2.35 -0.01 0.00 0.52 0.00 0.00 34.95 33.17 2qhd s ARG 77 CO 0.14 -1.05 0.25 -2.00 0.02 0.00 0.00 175.30 172.66 2qhd s GLU 78 N 0.96 3.33 -1.00 3.54 2.12 0.11 -4.33 118.70 123.44 2qhd s GLU 78 Ca 0.13 -0.76 -0.05 0.00 0.36 0.00 0.00 54.97 54.66 2qhd s GLU 78 Cb -0.21 -3.83 0.01 0.00 0.26 0.00 0.00 34.13 30.35 2qhd s GLU 78 CO -0.12 -0.53 0.61 -1.71 -0.54 0.00 0.00 175.26 172.98 2qhd n ASN 79 N 5.11 -4.85 0.00 -1.70 2.85 -1.26 -1.71 115.26 113.70 2qhd n ASN 79 Ca -0.12 -0.28 0.00 0.00 -0.11 0.00 0.00 54.58 54.07 2qhd n ASN 79 Cb 0.49 -3.57 0.00 0.00 1.24 0.00 0.00 39.78 37.93 2qhd n ASN 79 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2qhd n GLY 80 N -1.41 0.72 3.76 8.20 0.00 -1.26 -5.00 105.19 110.20 2qhd n GLY 80 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 2qhd n GLY 80 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qhd s GLU 81 N -0.24 2.90 -0.07 1.61 2.12 -0.69 -5.06 118.70 119.26 2qhd s GLU 81 Ca 0.00 -0.63 -0.30 0.00 0.36 0.00 0.00 54.97 54.40 2qhd s GLU 81 Cb 0.00 -2.74 -0.02 0.00 0.26 0.00 0.00 34.13 31.63 2qhd s GLU 81 CO 0.00 0.59 1.03 0.42 -0.54 0.00 0.00 175.26 176.76 2qhd s ILE 82 N -1.29 4.71 -0.35 -3.70 -1.09 -1.26 0.09 121.20 118.31 2qhd s ILE 82 Ca 0.26 1.98 -0.01 0.00 -2.23 0.00 0.00 60.65 60.64 2qhd s ILE 82 Cb -0.12 -4.27 0.08 0.00 -1.58 0.00 0.00 42.46 36.58 2qhd s ILE 82 CO 0.18 0.04 0.10 -0.63 -1.23 0.00 0.00 174.94 173.39 2qhd s ILE 83 N 1.81 2.99 0.40 2.92 -1.09 0.14 -4.91 121.20 123.46 2qhd s ILE 83 Ca 0.50 -1.84 -0.25 0.00 -2.23 0.00 0.00 60.65 56.83 2qhd s ILE 83 Cb -0.20 -2.94 -0.08 0.00 -1.58 0.00 0.00 42.46 37.65 2qhd s ILE 83 CO 0.21 -0.44 1.15 0.00 -1.23 0.00 0.00 174.94 174.63 2qhd s GLU 85 N -2.32 -0.10 0.00 0.00 -1.05 -1.10 -4.96 118.70 109.16 2qhd s GLU 85 Ca 0.57 -0.29 0.00 0.00 -0.15 0.00 0.00 54.97 55.10 2qhd s GLU 85 Cb -0.29 -1.75 0.00 0.00 -0.44 0.00 0.00 34.13 31.65 2qhd s GLU 85 CO 0.37 -2.93 0.87 0.09 0.95 0.00 0.00 175.26 174.61 2qhd n ASN 86 N -4.16 0.00 -0.27 0.83 4.13 -1.26 -4.01 115.26 110.51 2qhd n ASN 86 Ca 0.15 -1.76 0.08 0.00 1.68 0.00 0.00 54.58 54.73 2qhd n ASN 86 Cb 0.59 -0.15 0.22 0.00 -1.54 0.00 0.00 39.78 38.91 2qhd n ASN 86 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 2qhd h SER 88 N 0.00 0.27 -3.92 6.41 4.64 -1.96 -3.42 113.55 115.57 2qhd h SER 88 Ca 0.00 0.13 -0.34 0.00 -0.47 0.00 0.00 61.79 61.11 2qhd h SER 88 Cb 1.30 0.11 -0.15 0.00 -0.31 0.00 0.00 62.40 63.36 2qhd h SER 88 CO 0.00 0.06 -0.70 0.42 -0.87 0.00 0.00 176.83 175.73 2qhd s THR 89 N -5.98 1.17 0.20 2.95 -4.23 -1.26 -5.05 115.64 103.44 2qhd s THR 89 Ca -0.12 -2.06 -0.08 0.00 -1.18 0.00 0.00 61.69 58.25 2qhd s THR 89 Cb 0.22 -1.95 0.10 0.00 1.34 0.00 0.00 72.50 72.21 2qhd s THR 89 CO 0.77 -0.66 1.69 -1.28 -0.54 0.00 0.00 174.62 174.60 2qhd h SER 90 N 2.71 1.02 -0.38 3.99 0.87 -1.98 -2.47 113.55 117.32 2qhd h SER 90 Ca -0.37 -0.25 -0.02 0.00 -1.23 0.00 0.00 61.79 59.91 2qhd h SER 90 Cb 1.20 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.87 2qhd h SER 90 CO 0.64 1.03 0.15 0.00 -0.53 0.00 0.00 176.83 178.12 2qhd h LYS 92 N 0.46 1.10 0.13 0.00 1.57 -1.89 0.16 116.57 118.10 2qhd h LYS 92 Ca 0.13 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2qhd h LYS 92 Cb 0.19 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2qhd h LYS 92 CO -0.01 0.76 -0.06 -0.22 -0.57 0.00 0.00 179.45 179.34 2qhd h LYS 93 N 1.12 -0.17 -0.51 3.15 1.63 -1.11 -1.86 116.57 118.82 2qhd h LYS 93 Ca 0.29 0.01 -0.10 0.00 -0.85 0.00 0.00 60.65 60.01 2qhd h LYS 93 Cb -0.07 0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.58 2qhd h LYS 93 CO -0.06 0.22 -0.07 0.00 -3.45 0.00 0.00 179.45 176.10 2qhd h ARG 94 N -0.61 0.92 -0.20 1.90 3.08 -0.68 -1.57 114.38 117.22 2qhd h ARG 94 Ca -0.02 -0.30 -0.02 0.00 0.07 0.00 0.00 59.98 59.71 2qhd h ARG 94 Cb 0.47 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 2qhd h ARG 94 CO 0.03 0.95 0.03 0.82 -1.07 0.00 0.00 179.97 180.72 2qhd h ILE 95 N 0.83 1.23 -0.79 2.04 2.04 -0.76 -2.58 117.51 119.53 2qhd h ILE 95 Ca 0.14 -0.76 0.05 0.00 1.00 0.00 0.00 64.86 65.29 2qhd h ILE 95 Cb 0.59 1.35 -0.05 0.00 -0.74 0.00 0.00 36.82 37.97 2qhd h ILE 95 CO 0.04 0.23 0.52 0.00 0.00 0.00 0.00 178.15 178.94 2qhd h GLU 97 N 0.91 0.00 -0.17 0.00 4.39 -1.04 0.11 114.58 118.77 2qhd h GLU 97 Ca 0.33 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.92 2qhd h GLU 97 Cb 0.14 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.79 2qhd h GLU 97 CO -0.10 0.40 -0.30 0.00 -1.16 0.00 0.00 179.01 177.85 2qhd h ASP 99 N 0.15 0.75 -0.35 0.00 3.32 -1.16 -1.94 116.42 117.20 2qhd h ASP 99 Ca 0.01 -0.33 0.05 0.00 0.02 0.00 0.00 57.03 56.78 2qhd h ASP 99 Cb 0.88 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 40.18 2qhd h ASP 99 CO 0.07 0.90 0.07 0.50 -1.72 0.00 0.00 179.24 179.06 2qhd h LYS 100 N 0.58 0.18 -0.65 3.56 3.64 -0.81 -1.25 116.57 121.83 2qhd h LYS 100 Ca 0.11 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.50 2qhd h LYS 100 Cb 0.54 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.28 2qhd h LYS 100 CO 0.03 0.12 0.41 0.00 -2.27 0.00 0.00 179.45 177.74 2qhd h ALA 101 N 1.26 0.84 -0.16 5.00 0.00 -1.12 -1.90 119.26 123.18 2qhd h ALA 101 Ca 0.17 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.87 2qhd h ALA 101 Cb 0.19 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 2qhd h ALA 101 CO -0.22 0.19 -0.64 -0.24 0.00 0.00 0.00 179.25 178.34 2qhd h VAL 102 N 0.82 1.33 -0.48 0.00 3.04 -1.01 -1.98 116.25 117.96 2qhd h VAL 102 Ca 0.25 -1.92 -0.02 0.00 -1.01 0.00 0.00 66.70 64.00 2qhd h VAL 102 Cb -0.02 1.89 -0.02 0.00 -2.01 0.00 0.00 31.29 31.14 2qhd h VAL 102 CO -0.09 0.60 0.23 0.00 -1.01 0.00 0.00 177.57 177.29 2qhd h ALA 103 N 0.86 0.62 -0.58 3.17 0.00 -1.02 -0.15 119.26 122.17 2qhd h ALA 103 Ca -0.01 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 2qhd h ALA 103 Cb 1.21 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2qhd h ALA 103 CO 0.12 0.19 0.01 0.28 0.00 0.00 0.00 179.25 179.85 2qhd h VAL 104 N 0.64 1.26 -0.63 0.00 2.07 -1.35 -2.34 116.25 115.90 2qhd h VAL 104 Ca 0.17 -1.11 -0.09 0.00 0.82 0.00 0.00 66.70 66.49 2qhd h VAL 104 Cb 0.13 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 2qhd h VAL 104 CO -0.02 0.40 0.04 0.00 0.02 0.00 0.00 177.57 178.01 2qhd h LEU 106 N 1.00 0.74 -0.17 0.00 3.38 -0.87 -2.11 115.31 117.28 2qhd h LEU 106 Ca 0.19 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2qhd h LEU 106 Cb 0.52 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2qhd h LEU 106 CO 0.02 0.79 0.01 -0.09 0.09 0.00 0.00 178.44 179.27 2qhd h ARG 107 N 0.73 0.29 -0.33 1.13 2.43 -1.01 -2.18 114.38 115.45 2qhd h ARG 107 Ca 0.15 -0.09 0.07 0.00 -0.81 0.00 0.00 59.98 59.30 2qhd h ARG 107 Cb 0.41 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 2qhd h ARG 107 CO 0.01 0.50 0.23 -0.22 -1.51 0.00 0.00 179.97 178.98 2qhd h LYS 108 N 0.05 0.10 -0.43 0.20 1.63 -0.89 -2.21 116.57 115.04 2qhd h LYS 108 Ca 0.05 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 2qhd h LYS 108 Cb 0.36 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.96 2qhd h LYS 108 CO 0.01 0.07 0.00 0.09 -3.45 0.00 0.00 179.45 176.17 2qhd n ASN 109 N -4.46 4.43 -0.33 4.20 3.02 -0.82 -4.62 115.26 116.68 2qhd n ASN 109 Ca 0.04 -2.77 0.06 0.00 -0.03 0.00 0.00 54.58 51.88 2qhd n ASN 109 Cb 0.33 -0.55 0.25 0.00 -0.61 0.00 0.00 39.78 39.20 2qhd n ASN 109 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2qhd h LEU 110 N 2.84 0.91 0.00 3.41 3.38 -0.74 -2.43 115.31 122.67 2qhd h LEU 110 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2qhd h LEU 110 Cb 1.51 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.10 2qhd h LEU 110 CO 0.27 0.52 0.00 -0.46 0.09 0.00 0.00 178.44 178.86 2qhd n ASN 111 N -4.55 0.00 -0.05 -0.43 6.94 -1.26 -2.24 115.26 113.66 2qhd n ASN 111 Ca 0.17 0.49 0.00 0.00 -0.02 0.00 0.00 54.58 55.22 2qhd n ASN 111 Cb 0.30 -0.49 0.01 0.00 -2.36 0.00 0.00 39.78 37.24 2qhd n ASN 111 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 2qhd n THR 112 N -1.49 0.97 -1.66 5.53 -2.24 -0.92 -5.03 114.28 109.45 2qhd n THR 112 Ca 0.02 -0.99 -0.46 0.00 -2.27 0.00 0.00 64.05 60.35 2qhd n THR 112 Cb 0.10 0.51 -0.04 0.00 -2.10 0.00 0.00 70.33 68.81 2qhd n THR 112 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2qhd n TYR 113 N -0.40 2.13 -3.91 4.78 9.36 -0.95 -4.94 117.16 123.23 2qhd n TYR 113 Ca 0.01 0.38 -0.35 0.00 3.32 0.00 0.00 57.90 61.26 2qhd n TYR 113 Cb 0.26 -2.48 -0.14 0.00 -0.63 0.00 0.00 39.34 36.35 2qhd n TYR 113 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 2qhd s ASN 114 N 0.58 4.89 0.57 2.98 3.84 -1.26 -4.97 114.94 121.57 2qhd s ASN 114 Ca 0.74 -1.36 0.31 0.00 0.21 0.00 0.00 52.86 52.77 2qhd s ASN 114 Cb -0.69 -1.71 1.44 0.00 -0.55 0.00 0.00 41.25 39.73 2qhd s ASN 114 CO 0.44 -0.28 1.82 0.11 -2.79 0.00 0.00 177.10 176.40 2qhd h LYS 115 N 7.98 0.00 0.00 0.43 6.56 -2.01 0.82 116.57 130.36 2qhd h LYS 115 Ca -0.20 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.39 2qhd h LYS 115 Cb 1.06 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.72 2qhd h LYS 115 CO 0.54 0.00 0.00 0.36 -2.06 0.00 0.00 179.45 178.29 2qhd n LYS 116 N -3.88 0.73 0.00 3.15 2.85 -1.26 -2.63 118.16 117.12 2qhd n LYS 116 Ca 0.16 0.01 0.06 0.00 -1.05 0.00 0.00 58.31 57.48 2qhd n LYS 116 Cb 0.94 -1.50 -0.01 0.00 -0.65 0.00 0.00 35.03 33.81 2qhd n LYS 116 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2qhd n TYR 117 N -1.07 0.00 -0.34 5.58 4.01 0.28 -4.63 117.16 120.99 2qhd n TYR 117 Ca 0.18 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 58.01 2qhd n TYR 117 Cb 0.12 0.00 0.26 0.00 -0.31 0.00 0.00 39.34 39.41 2qhd n TYR 117 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 2qhd h THR 118 N 1.20 0.82 -1.26 -0.72 2.02 -1.55 0.94 112.91 114.35 2qhd h THR 118 Ca 0.00 -0.29 -0.58 0.00 0.77 0.00 0.00 66.41 66.32 2qhd h THR 118 Cb 0.39 -0.10 -0.42 0.00 -1.74 0.00 0.00 68.15 66.28 2qhd h THR 118 CO 0.00 0.15 -0.76 -1.22 0.37 0.00 0.00 175.52 174.06 2qhd n TYR 119 N -4.72 3.19 -1.71 3.16 4.02 -1.26 -3.06 117.16 116.78 2qhd n TYR 119 Ca 0.20 -2.82 -0.42 0.00 -0.01 0.00 0.00 57.90 54.85 2qhd n TYR 119 Cb 0.43 -0.17 -0.03 0.00 -0.02 0.00 0.00 39.34 39.56 2qhd n TYR 119 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 176.86 175.38 2qhd s TYR 120 N -3.56 1.68 0.02 -0.72 5.04 -1.01 -4.92 117.35 113.89 2qhd s TYR 120 Ca 0.49 -0.24 -0.30 0.00 -2.44 0.00 0.00 57.07 54.58 2qhd s TYR 120 Cb 0.40 -4.20 -0.07 0.00 0.35 0.00 0.00 41.96 38.45 2qhd s TYR 120 CO -0.11 -5.17 1.63 -1.25 -1.34 0.00 0.00 175.55 169.31 2qhd s PRO 121 N 3.72 4.20 0.53 4.97 0.04 -1.26 -4.82 135.00 142.39 2qhd s PRO 121 Ca 0.84 2.25 0.24 0.00 0.04 0.00 0.00 61.00 64.38 2qhd s PRO 121 Cb -0.43 -3.72 1.46 0.00 0.04 0.00 0.00 34.50 31.85 2qhd s PRO 121 CO 0.39 -0.75 2.13 -0.97 0.04 0.00 0.00 177.00 177.83 2qhd h ASN 122 N 8.68 0.00 0.00 6.66 -1.24 -1.91 -1.67 115.58 126.10 2qhd h ASN 122 Ca -0.41 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.60 2qhd h ASN 122 Cb 1.19 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.24 2qhd h ASN 122 CO 0.93 0.08 0.00 2.22 -1.29 0.00 0.00 177.43 179.37 2qhd n PHE 124 N -3.95 0.00 0.98 0.67 1.16 -1.26 -1.09 117.46 113.96 2qhd n PHE 124 Ca -0.02 0.00 0.12 0.00 -1.87 0.00 0.00 57.45 55.67 2qhd n PHE 124 Cb 0.17 -0.00 0.21 0.00 -1.61 0.00 0.00 39.48 38.25 2qhd n PHE 124 CO 0.00 0.00 0.00 0.91 -1.87 0.00 0.00 176.76 175.80 2qhd n TRP 125 N -1.00 0.02 -2.99 2.97 7.02 -0.63 -4.63 117.44 118.21 2qhd n TRP 125 Ca 0.13 0.01 -0.44 0.00 -1.02 0.00 0.00 57.50 56.18 2qhd n TRP 125 Cb 0.06 -0.25 -0.04 0.00 -2.42 0.00 0.00 31.31 28.66 2qhd n TRP 125 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2qhd n LYS 127 N 6.87 1.32 -1.36 0.00 4.76 -1.23 -4.72 118.16 123.79 2qhd n LYS 127 Ca -0.03 -1.50 -0.29 0.00 -2.87 0.00 0.00 58.31 53.62 2qhd n LYS 127 Cb 0.44 -1.28 0.19 0.00 -1.84 0.00 0.00 35.03 32.54 2qhd n LYS 127 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2qhd s GLY 128 N -1.11 1.61 0.88 0.72 0.00 0.19 -4.93 107.32 104.67 2qhd s GLY 128 Ca 0.19 -0.75 -0.12 0.00 0.00 0.00 0.00 44.72 44.04 2qhd s GLY 128 CO 0.18 -0.03 1.10 0.99 0.00 0.00 0.00 173.10 175.33 2qhd s ASP 129 N -4.00 3.70 -0.85 1.64 1.01 -1.26 -3.90 116.67 113.01 2qhd s ASP 129 Ca 0.68 1.38 -0.19 0.00 0.71 0.00 0.00 52.55 55.13 2qhd s ASP 129 Cb -0.12 -2.07 0.12 0.00 1.01 0.00 0.00 42.92 41.86 2qhd s ASP 129 CO 0.55 -2.48 1.05 -0.63 0.21 0.00 0.00 175.17 173.87 2qhd s ILE 130 N -3.02 4.69 0.49 0.77 1.01 -1.26 -3.34 121.20 120.55 2qhd s ILE 130 Ca 0.63 -1.34 -0.22 0.00 0.00 0.00 0.00 60.65 59.72 2qhd s ILE 130 Cb -0.17 -4.73 -0.06 0.00 0.01 0.00 0.00 42.46 37.51 2qhd s ILE 130 CO 0.56 -1.45 1.22 -1.61 0.00 0.00 0.00 174.94 173.66 2qhd s GLU 131 N 2.84 3.53 0.98 2.79 0.41 -1.26 -5.00 118.70 123.00 2qhd s GLU 131 Ca 0.28 1.91 -0.12 0.00 -0.41 0.00 0.00 54.97 56.64 2qhd s GLU 131 Cb -0.09 -2.33 0.18 0.00 -1.78 0.00 0.00 34.13 30.11 2qhd s GLU 131 CO -0.05 -0.77 1.08 0.15 -0.49 0.00 0.00 175.26 175.18 2qhd s LYS 132 N -2.80 0.52 0.00 1.61 1.02 -1.26 -5.12 119.74 113.71 2qhd s LYS 132 Ca 0.67 0.99 0.31 0.00 0.02 0.00 0.00 55.97 57.95 2qhd s LYS 132 Cb -0.32 -1.71 1.63 0.00 -0.52 0.00 0.00 37.83 36.91 2qhd s LYS 132 CO 0.38 -2.80 2.07 0.00 -0.92 0.00 0.00 175.35 174.09