#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gqz n PRO 5 N 0.00 2.18 0.05 0.00 -0.02 -1.26 -4.85 135.00 131.10 3gqz n PRO 5 Ca 0.00 0.78 0.03 0.00 -2.02 0.00 0.00 63.50 62.28 3gqz n PRO 5 Cb 0.00 -2.45 0.40 0.00 -0.02 0.00 0.00 33.50 31.43 3gqz n PRO 5 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3gqz h GLN 6 N 4.10 0.43 -0.63 -0.52 4.15 -2.05 -1.90 115.11 118.69 3gqz h GLN 6 Ca -0.46 -0.06 0.03 0.00 0.77 0.00 0.00 58.65 58.93 3gqz h GLN 6 Cb 1.27 -0.08 -0.04 0.00 0.21 0.00 0.00 27.48 28.84 3gqz h GLN 6 CO 0.75 0.38 0.39 0.37 -1.93 0.00 0.00 178.83 178.79 3gqz h GLN 7 N 0.43 0.76 0.29 1.69 4.15 -1.99 -0.09 115.11 120.35 3gqz h GLN 7 Ca 0.11 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.47 3gqz h GLN 7 Cb 0.13 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 27.65 3gqz h GLN 7 CO -0.01 0.50 -0.14 0.82 -1.93 0.00 0.00 178.83 178.07 3gqz h ILE 8 N 0.78 0.74 -0.66 2.39 2.04 -1.75 -1.86 117.51 119.19 3gqz h ILE 8 Ca 0.25 -0.49 0.13 0.00 1.00 0.00 0.00 64.86 65.76 3gqz h ILE 8 Cb 0.01 1.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.96 3gqz h ILE 8 CO -0.10 0.10 -0.18 -1.13 0.00 0.00 0.00 178.15 176.84 3gqz h ASN 9 N -0.66 -0.67 -0.08 1.72 -1.24 -1.22 -1.59 115.58 111.84 3gqz h ASN 9 Ca -0.04 0.20 -0.02 0.00 0.71 0.00 0.00 56.30 57.15 3gqz h ASN 9 Cb 0.46 0.43 -0.00 0.00 0.73 0.00 0.00 38.32 39.94 3gqz h ASN 9 CO 0.07 -0.23 -0.03 0.44 -1.29 0.00 0.00 177.43 176.38 3gqz h ASP 10 N -0.01 0.16 -0.59 1.15 3.32 -0.96 -1.88 116.42 117.60 3gqz h ASP 10 Ca 0.32 -0.41 -0.06 0.00 0.02 0.00 0.00 57.03 56.90 3gqz h ASP 10 Cb 0.50 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.98 3gqz h ASP 10 CO -0.69 0.53 0.15 -0.29 -1.72 0.00 0.00 179.24 177.22 3gqz h ILE 11 N -0.21 1.25 0.31 0.35 6.09 -1.16 -1.06 117.51 123.09 3gqz h ILE 11 Ca 0.02 -0.91 -0.02 0.00 -1.37 0.00 0.00 64.86 62.58 3gqz h ILE 11 Cb 0.47 0.61 0.00 0.00 0.47 0.00 0.00 36.82 38.37 3gqz h ILE 11 CO 0.01 0.34 -0.15 0.58 -3.07 0.00 0.00 178.15 175.86 3gqz h VAL 12 N 0.94 0.69 -0.90 2.19 2.07 -1.27 -1.89 116.25 118.08 3gqz h VAL 12 Ca 0.20 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 3gqz h VAL 12 Cb 0.34 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 3gqz h VAL 12 CO 0.00 0.10 0.54 0.45 0.02 0.00 0.00 177.57 178.69 3gqz h HIS 13 N -0.72 1.19 0.00 1.57 3.86 -1.32 0.44 115.15 120.17 3gqz h HIS 13 Ca -0.04 -0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.10 3gqz h HIS 13 Cb 0.49 -0.39 -0.01 0.00 1.06 0.00 0.00 27.41 28.56 3gqz h HIS 13 CO 0.01 0.79 -0.33 0.00 0.86 0.00 0.00 177.93 179.27 3gqz h ARG 14 N 1.24 0.00 0.08 2.45 3.08 -1.21 -2.50 114.38 117.52 3gqz h ARG 14 Ca 0.32 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 60.11 3gqz h ARG 14 Cb -0.05 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 3gqz h ARG 14 CO -0.06 0.33 -1.40 1.15 -1.07 0.00 0.00 179.97 178.91 3gqz h THR 15 N 0.00 0.97 0.14 2.04 2.02 -0.98 -3.41 112.91 113.69 3gqz h THR 15 Ca -0.00 -2.33 -0.28 0.00 0.77 0.00 0.00 66.41 64.57 3gqz h THR 15 Cb 0.85 2.58 0.01 0.00 -1.74 0.00 0.00 68.15 69.84 3gqz h THR 15 CO 0.04 0.63 -1.28 0.40 0.37 0.00 0.00 175.52 175.68 3gqz h ILE 16 N -0.46 1.46 0.11 3.11 1.08 -0.97 -3.21 117.51 118.63 3gqz h ILE 16 Ca -0.32 -3.02 0.01 0.00 -0.39 0.00 0.00 64.86 61.14 3gqz h ILE 16 Cb 1.65 2.95 -0.02 0.00 -3.07 0.00 0.00 36.82 38.32 3gqz h ILE 16 CO -0.01 0.88 -0.17 0.74 -0.69 0.00 0.00 178.15 178.90 3gqz h THR 17 N 0.08 0.62 0.00 -0.27 2.02 -1.64 -0.04 112.91 113.67 3gqz h THR 17 Ca -0.15 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 66.97 3gqz h THR 17 Cb 1.99 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 69.01 3gqz h THR 17 CO 0.21 0.00 -0.28 1.55 0.37 0.00 0.00 175.52 177.36 3gqz h PRO 18 N -0.33 0.00 -0.29 6.66 0.13 -1.79 -2.56 132.00 133.83 3gqz h PRO 18 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 3gqz h PRO 18 Cb 0.35 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.46 3gqz h PRO 18 CO -0.09 0.28 0.19 1.25 -0.23 0.00 0.00 178.00 179.41 3gqz h LEU 19 N 0.00 0.33 -0.96 1.56 5.85 -1.37 0.09 115.31 120.81 3gqz h LEU 19 Ca -0.00 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.71 3gqz h LEU 19 Cb 0.52 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 3gqz h LEU 19 CO 0.04 0.24 0.62 0.40 -0.34 0.00 0.00 178.44 179.40 3gqz h ILE 20 N 0.39 1.25 0.83 4.05 2.04 -0.88 -1.04 117.51 124.15 3gqz h ILE 20 Ca 0.10 -0.48 -0.04 0.00 1.00 0.00 0.00 64.86 65.44 3gqz h ILE 20 Cb -0.04 -0.15 0.01 0.00 -0.74 0.00 0.00 36.82 35.89 3gqz h ILE 20 CO -0.02 0.25 -0.40 -0.08 0.00 0.00 0.00 178.15 177.90 3gqz h GLU 21 N 1.31 -1.08 -0.89 2.37 4.57 -1.14 -1.00 114.58 118.73 3gqz h GLU 21 Ca 0.35 0.07 0.07 0.00 -1.18 0.00 0.00 59.36 58.68 3gqz h GLU 21 Cb -0.13 0.24 -0.07 0.00 -0.16 0.00 0.00 28.75 28.64 3gqz h GLU 21 CO -0.07 -0.71 0.55 1.96 -1.18 0.00 0.00 179.01 179.56 3gqz h GLN 22 N -1.26 0.95 -0.01 1.92 4.20 -0.87 -2.59 115.11 117.45 3gqz h GLN 22 Ca -0.11 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.54 3gqz h GLN 22 Cb 0.86 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 28.43 3gqz h GLN 22 CO 0.19 0.63 -0.25 1.04 -0.67 0.00 0.00 178.83 179.77 3gqz n GLN 23 N -4.62 0.93 -3.72 1.46 1.13 -0.41 -4.96 117.38 107.19 3gqz n GLN 23 Ca 0.14 -0.56 -0.25 0.00 -1.94 0.00 0.00 57.00 54.39 3gqz n GLN 23 Cb 0.21 -1.49 0.05 0.00 0.11 0.00 0.00 30.24 29.12 3gqz n GLN 23 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3gqz n LYS 24 N -0.55 -6.06 -2.67 -1.09 5.02 -0.42 -4.94 118.16 107.45 3gqz n LYS 24 Ca 0.13 0.69 -0.43 0.00 -2.02 0.00 0.00 58.31 56.68 3gqz n LYS 24 Cb 0.36 -5.54 -0.02 0.00 -0.02 0.00 0.00 35.03 29.80 3gqz n LYS 24 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3gqz s ILE 25 N -3.42 4.73 0.19 -0.18 1.01 -0.96 -4.97 121.20 117.61 3gqz s ILE 25 Ca 0.38 2.04 -0.08 0.00 0.00 0.00 0.00 60.65 62.99 3gqz s ILE 25 Cb -0.18 -4.31 0.06 0.00 0.01 0.00 0.00 42.46 38.04 3gqz s ILE 25 CO 0.79 -0.09 1.64 -0.65 0.00 0.00 0.00 174.94 176.63 3gqz h PRO 26 N 7.28 1.02 -2.82 2.79 0.11 -1.88 -3.46 132.00 135.03 3gqz h PRO 26 Ca -0.25 -0.34 -0.11 0.00 0.11 0.00 0.00 66.00 65.41 3gqz h PRO 26 Cb 1.10 -0.09 -0.21 0.00 0.11 0.00 0.00 31.00 31.92 3gqz h PRO 26 CO 0.92 1.03 -0.20 0.20 -0.21 0.00 0.00 178.00 179.73 3gqz s GLY 27 N -3.63 -0.25 -0.10 -0.55 0.00 -1.21 -0.51 107.32 101.08 3gqz s GLY 27 Ca -0.11 0.67 -0.13 0.00 0.00 0.00 0.00 44.72 45.15 3gqz s GLY 27 CO 0.85 0.45 0.34 -0.29 0.00 0.00 0.00 173.10 174.46 3gqz s MET 28 N -0.91 0.49 -0.02 2.90 1.75 -0.68 -2.32 119.30 120.51 3gqz s MET 28 Ca -0.10 0.29 0.05 0.00 -1.25 0.00 0.00 55.69 54.68 3gqz s MET 28 Cb -0.04 0.23 -0.01 0.00 2.84 0.00 0.00 34.83 37.85 3gqz s MET 28 CO 0.04 -0.09 -0.17 0.00 -0.65 0.00 0.00 175.02 174.15 3gqz s ALA 29 N -0.26 1.42 -0.02 4.11 0.00 0.06 -0.80 121.76 126.28 3gqz s ALA 29 Ca -0.04 -0.72 0.03 0.00 0.00 0.00 0.00 51.96 51.23 3gqz s ALA 29 Cb -0.03 -0.38 -0.00 0.00 0.00 0.00 0.00 23.12 22.70 3gqz s ALA 29 CO 0.02 0.33 -0.09 0.08 0.00 0.00 0.00 175.76 176.09 3gqz s VAL 30 N -0.32 0.77 -0.05 0.00 1.01 0.21 -0.79 120.40 121.23 3gqz s VAL 30 Ca 0.05 -0.39 0.06 0.00 0.00 0.00 0.00 61.98 61.70 3gqz s VAL 30 Cb -0.07 -0.66 -0.01 0.00 0.00 0.00 0.00 36.38 35.63 3gqz s VAL 30 CO -0.00 0.23 -0.23 0.00 0.00 0.00 0.00 175.10 175.10 3gqz s ALA 31 N -0.05 1.96 -0.14 5.51 0.00 -0.60 -0.94 121.76 127.51 3gqz s ALA 31 Ca 0.01 -0.95 0.01 0.00 0.00 0.00 0.00 51.96 51.03 3gqz s ALA 31 Cb -0.06 -0.60 -0.01 0.00 0.00 0.00 0.00 23.12 22.46 3gqz s ALA 31 CO -0.00 0.39 -0.15 0.08 0.00 0.00 0.00 175.76 176.08 3gqz s VAL 32 N -0.17 2.76 -0.30 0.00 1.01 -0.32 -0.95 120.40 122.43 3gqz s VAL 32 Ca -0.02 -0.75 -0.13 0.00 0.00 0.00 0.00 61.98 61.08 3gqz s VAL 32 Cb -0.12 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 3gqz s VAL 32 CO 0.03 0.52 0.25 -0.63 0.00 0.00 0.00 175.10 175.27 3gqz s ILE 33 N 0.57 5.27 -0.09 2.22 1.09 0.27 -0.50 121.20 130.02 3gqz s ILE 33 Ca -0.09 0.12 0.01 0.00 -1.10 0.00 0.00 60.65 59.58 3gqz s ILE 33 Cb -0.16 -3.64 0.02 0.00 -1.06 0.00 0.00 42.46 37.62 3gqz s ILE 33 CO 0.04 0.13 -0.09 -0.47 -0.10 0.00 0.00 174.94 174.44 3gqz s TYR 34 N 1.83 1.46 -1.60 3.97 5.04 -0.49 -1.23 117.35 126.33 3gqz s TYR 34 Ca 0.09 -0.65 -0.16 0.00 -2.44 0.00 0.00 57.07 53.90 3gqz s TYR 34 Cb -0.16 -1.16 0.13 0.00 0.35 0.00 0.00 41.96 41.12 3gqz s TYR 34 CO 0.11 -0.41 0.81 1.04 -1.34 0.00 0.00 175.55 175.75 3gqz n GLN 35 N 4.46 -3.86 -0.47 4.97 6.02 -0.95 -1.62 117.38 125.93 3gqz n GLN 35 Ca -0.17 0.45 0.00 0.00 -0.01 0.00 0.00 57.00 57.27 3gqz n GLN 35 Cb 0.51 -5.23 0.00 0.00 1.02 0.00 0.00 30.24 26.54 3gqz n GLN 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3gqz n GLY 36 N -1.44 1.70 3.50 1.08 0.00 -0.97 -5.03 105.19 104.03 3gqz n GLY 36 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 3gqz n GLY 36 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3gqz s LYS 37 N -0.13 3.05 0.25 1.61 2.20 -0.64 -5.01 119.74 121.06 3gqz s LYS 37 Ca 0.00 -0.60 -0.15 0.00 -0.36 0.00 0.00 55.97 54.86 3gqz s LYS 37 Cb 0.00 -2.63 -0.08 0.00 -1.51 0.00 0.00 37.83 33.61 3gqz s LYS 37 CO 0.00 0.46 0.67 -1.25 -0.36 0.00 0.00 175.35 174.87 3gqz s PRO 38 N -0.28 4.03 -0.04 4.03 0.04 -1.26 -1.40 135.00 140.12 3gqz s PRO 38 Ca 0.03 0.62 0.01 0.00 0.04 0.00 0.00 61.00 61.70 3gqz s PRO 38 Cb -0.13 -2.67 0.02 0.00 0.04 0.00 0.00 34.50 31.76 3gqz s PRO 38 CO 0.03 0.30 -0.05 0.71 0.04 0.00 0.00 177.00 178.03 3gqz s TYR 39 N -1.75 0.78 0.03 0.56 1.51 0.35 -4.98 117.35 113.85 3gqz s TYR 39 Ca 0.47 -0.22 0.04 0.00 -1.01 0.00 0.00 57.07 56.36 3gqz s TYR 39 Cb -0.13 -0.67 -0.03 0.00 -0.11 0.00 0.00 41.96 41.01 3gqz s TYR 39 CO 0.19 -0.19 -0.08 0.71 -1.11 0.00 0.00 175.55 175.08 3gqz s TYR 40 N 0.85 2.83 -0.05 2.71 2.02 -1.26 -1.17 117.35 123.29 3gqz s TYR 40 Ca -0.12 -0.08 -0.03 0.00 -0.37 0.00 0.00 57.07 56.47 3gqz s TYR 40 Cb -0.14 -1.56 0.02 0.00 -0.40 0.00 0.00 41.96 39.88 3gqz s TYR 40 CO 0.01 0.37 0.11 -0.06 -1.57 0.00 0.00 175.55 174.41 3gqz s PHE 41 N -1.04 -0.12 0.08 2.71 0.40 -0.11 -5.02 117.98 114.88 3gqz s PHE 41 Ca 0.18 0.34 0.04 0.00 -0.60 0.00 0.00 56.93 56.89 3gqz s PHE 41 Cb -0.11 -0.02 -0.03 0.00 0.51 0.00 0.00 43.02 43.36 3gqz s PHE 41 CO 0.09 -0.10 -0.11 0.95 0.70 0.00 0.00 175.22 176.75 3gqz s THR 42 N 0.52 0.92 0.02 0.64 -4.23 -1.26 -0.62 115.64 111.63 3gqz s THR 42 Ca -0.04 -1.41 0.01 0.00 -1.18 0.00 0.00 61.69 59.06 3gqz s THR 42 Cb -0.05 -1.11 -0.02 0.00 1.34 0.00 0.00 72.50 72.66 3gqz s THR 42 CO -0.02 -0.41 -0.04 0.26 -0.54 0.00 0.00 174.62 173.87 3gqz s TRP 43 N -1.83 0.35 0.00 3.99 0.51 0.02 -5.00 118.94 116.97 3gqz s TRP 43 Ca -0.00 -0.49 0.00 0.00 -2.12 0.00 0.00 56.10 53.48 3gqz s TRP 43 Cb -0.07 -0.23 0.00 0.00 -0.81 0.00 0.00 33.47 32.36 3gqz s TRP 43 CO 0.01 -0.15 0.00 0.41 -0.51 0.00 0.00 176.95 176.70 3gqz n GLY 44 N 1.65 1.10 3.19 0.98 0.00 -1.26 -1.68 105.19 109.17 3gqz n GLY 44 Ca -0.23 -0.69 -0.29 0.00 0.00 0.00 0.00 46.02 44.81 3gqz n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gqz s TYR 45 N 0.00 2.05 0.11 1.61 1.51 0.34 -1.55 117.35 121.42 3gqz s TYR 45 Ca 0.00 -0.64 0.00 0.00 -1.01 0.00 0.00 57.07 55.43 3gqz s TYR 45 Cb 0.00 -1.37 -0.20 0.00 -0.11 0.00 0.00 41.96 40.28 3gqz s TYR 45 CO 0.00 -0.22 1.23 0.00 -1.11 0.00 0.00 175.55 175.46 3gqz h ALA 46 N 6.26 0.26 -2.97 3.71 0.00 -0.76 -3.19 119.26 122.58 3gqz h ALA 46 Ca -0.31 -0.85 -0.45 0.00 0.00 0.00 0.00 54.91 53.30 3gqz h ALA 46 Cb 1.18 -0.05 -0.40 0.00 0.00 0.00 0.00 17.79 18.51 3gqz h ALA 46 CO 0.47 1.03 -0.74 0.34 0.00 0.00 0.00 179.25 180.35 3gqz s ASP 47 N -6.98 2.30 0.01 0.00 -1.08 -1.06 -0.98 116.67 108.88 3gqz s ASP 47 Ca -0.02 -0.61 -0.25 0.00 -0.52 0.00 0.00 52.55 51.15 3gqz s ASP 47 Cb 0.09 -0.17 -0.18 0.00 -1.46 0.00 0.00 42.92 41.19 3gqz s ASP 47 CO 0.85 -0.35 1.39 0.40 0.52 0.00 0.00 175.17 177.98 3gqz h ILE 48 N 6.41 1.17 -0.77 4.11 2.04 -1.85 -0.38 117.51 128.24 3gqz h ILE 48 Ca -0.16 -0.75 0.07 0.00 1.00 0.00 0.00 64.86 65.03 3gqz h ILE 48 Cb 1.14 1.66 -0.06 0.00 -0.74 0.00 0.00 36.82 38.82 3gqz h ILE 48 CO 0.30 0.19 0.44 0.00 0.00 0.00 0.00 178.15 179.08 3gqz h ALA 49 N 0.52 1.06 -0.17 1.87 0.00 -1.98 -2.30 119.26 118.26 3gqz h ALA 49 Ca -0.01 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3gqz h ALA 49 Cb 0.36 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3gqz h ALA 49 CO 0.01 0.12 0.00 1.63 0.00 0.00 0.00 179.25 181.02 3gqz n LYS 50 N -4.73 2.02 -3.87 0.00 5.02 -1.22 -4.96 118.16 110.41 3gqz n LYS 50 Ca 0.11 -1.52 -0.25 0.00 -2.02 0.00 0.00 58.31 54.63 3gqz n LYS 50 Cb 0.21 -1.45 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 3gqz n LYS 50 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3gqz n LYS 51 N 0.77 -4.19 -3.36 1.97 5.02 -0.28 -4.96 118.16 113.13 3gqz n LYS 51 Ca 0.17 0.51 -0.39 0.00 -2.02 0.00 0.00 58.31 56.58 3gqz n LYS 51 Cb 0.45 -4.94 -0.08 0.00 -0.02 0.00 0.00 35.03 30.45 3gqz n LYS 51 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 3gqz s GLN 52 N -6.37 4.12 0.60 1.97 -1.52 -0.43 -5.00 119.66 113.04 3gqz s GLN 52 Ca 0.14 0.19 -0.14 0.00 -1.95 0.00 0.00 55.36 53.60 3gqz s GLN 52 Cb -0.07 -3.58 -0.04 0.00 -0.22 0.00 0.00 33.01 29.10 3gqz s GLN 52 CO 0.85 -0.15 1.04 -1.25 -0.25 0.00 0.00 175.29 175.54 3gqz s PRO 53 N 1.65 3.41 0.11 2.91 0.04 -1.26 -0.21 135.00 141.65 3gqz s PRO 53 Ca 0.19 1.01 -0.31 0.00 0.04 0.00 0.00 61.00 61.93 3gqz s PRO 53 Cb -0.15 -2.05 -0.07 0.00 0.04 0.00 0.00 34.50 32.26 3gqz s PRO 53 CO 0.09 -0.72 1.33 0.08 0.04 0.00 0.00 177.00 177.82 3gqz s VAL 54 N -2.75 3.48 0.45 -0.36 1.01 -0.59 -4.22 120.40 117.41 3gqz s VAL 54 Ca 0.60 1.08 0.03 0.00 0.00 0.00 0.00 61.98 63.68 3gqz s VAL 54 Cb -0.13 -3.69 -0.02 0.00 0.00 0.00 0.00 36.38 32.54 3gqz s VAL 54 CO 0.43 0.09 0.11 0.42 0.00 0.00 0.00 175.10 176.14 3gqz s THR 55 N 1.00 0.67 -0.66 3.92 -4.23 -1.26 -4.70 115.64 110.38 3gqz s THR 55 Ca 0.62 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 59.32 3gqz s THR 55 Cb -0.35 -2.24 0.18 0.00 1.34 0.00 0.00 72.50 71.44 3gqz s THR 55 CO 0.31 0.00 1.57 0.00 -0.54 0.00 0.00 174.62 175.96 3gqz n GLN 56 N -1.04 0.11 0.00 3.99 6.02 -1.26 -2.30 117.38 122.90 3gqz n GLN 56 Ca -0.10 0.40 0.11 0.00 -0.01 0.00 0.00 57.00 57.40 3gqz n GLN 56 Cb 0.65 -1.73 0.09 0.00 1.02 0.00 0.00 30.24 30.27 3gqz n GLN 56 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3gqz n GLN 57 N -1.94 1.98 -2.12 -1.09 1.13 -1.26 -3.85 117.38 110.23 3gqz n GLN 57 Ca 0.02 -1.75 -0.42 0.00 -1.94 0.00 0.00 57.00 52.91 3gqz n GLN 57 Cb 0.17 -1.42 -0.03 0.00 0.11 0.00 0.00 30.24 29.08 3gqz n GLN 57 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 3gqz s THR 58 N -1.83 3.07 -0.12 5.09 2.01 -0.97 -4.86 115.64 118.03 3gqz s THR 58 Ca 0.25 0.81 -0.20 0.00 0.31 0.00 0.00 61.69 62.86 3gqz s THR 58 Cb 0.18 -3.52 -0.04 0.00 0.01 0.00 0.00 72.50 69.14 3gqz s THR 58 CO 0.28 0.08 0.55 -0.76 -0.69 0.00 0.00 174.62 174.09 3gqz s LEU 59 N 0.63 4.27 0.09 4.42 1.43 0.18 -4.07 118.68 125.64 3gqz s LEU 59 Ca 0.63 0.91 0.09 0.00 -1.03 0.00 0.00 54.13 54.72 3gqz s LEU 59 Cb -0.39 -2.82 -0.04 0.00 0.03 0.00 0.00 46.19 42.98 3gqz s LEU 59 CO 0.34 -0.07 -0.20 -0.36 0.23 0.00 0.00 176.35 176.30 3gqz s PHE 60 N 0.85 2.50 -0.12 0.29 0.40 -0.31 -1.59 117.98 120.00 3gqz s PHE 60 Ca 0.29 -0.28 -0.29 0.00 -0.60 0.00 0.00 56.93 56.04 3gqz s PHE 60 Cb -0.16 -1.37 -0.02 0.00 0.51 0.00 0.00 43.02 41.98 3gqz s PHE 60 CO 0.12 0.33 1.22 -1.21 0.70 0.00 0.00 175.22 176.38 3gqz s GLU 61 N -1.88 4.29 0.45 0.44 2.02 -1.26 -1.52 118.70 121.23 3gqz s GLU 61 Ca 0.16 1.65 0.24 0.00 0.02 0.00 0.00 54.97 57.04 3gqz s GLU 61 Cb -0.10 -3.67 0.49 0.00 0.10 0.00 0.00 34.13 30.95 3gqz s GLU 61 CO 0.08 -0.59 1.66 -0.07 0.02 0.00 0.00 175.26 176.36 3gqz h LEU 62 N 9.05 0.00 0.00 1.80 3.38 -1.62 -3.43 115.31 124.48 3gqz h LEU 62 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 3gqz h LEU 62 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 3gqz h LEU 62 CO 0.93 0.03 0.00 0.61 0.09 0.00 0.00 178.44 180.10 3gqz n GLY 63 N 0.93 3.35 0.06 0.83 0.00 -1.26 -2.34 105.19 106.77 3gqz n GLY 63 Ca 0.03 -0.11 0.08 0.00 0.00 0.00 0.00 46.02 46.02 3gqz n GLY 63 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3gqz n SER 64 N 3.86 0.27 0.32 1.61 7.64 -1.25 -1.31 113.62 124.75 3gqz n SER 64 Ca 0.00 0.58 0.20 0.00 1.01 0.00 0.00 58.87 60.66 3gqz n SER 64 Cb 0.00 -0.63 1.07 0.00 -1.01 0.00 0.00 64.21 63.64 3gqz n SER 64 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3gqz h VAL 65 N 0.00 0.19 -0.70 0.44 2.07 -1.57 -1.51 116.25 115.17 3gqz h VAL 65 Ca 0.00 -0.08 0.19 0.00 0.82 0.00 0.00 66.70 67.63 3gqz h VAL 65 Cb 0.23 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 3gqz h VAL 65 CO 0.00 0.01 0.50 0.28 0.02 0.00 0.00 177.57 178.37 3gqz h SER 66 N 0.00 0.09 0.16 0.57 0.02 -1.39 -2.12 113.55 110.88 3gqz h SER 66 Ca -0.00 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 3gqz h SER 66 Cb 0.06 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 62.59 3gqz h SER 66 CO 0.00 0.04 -0.04 0.11 -1.14 0.00 0.00 176.83 175.80 3gqz h LYS 67 N 0.10 0.00 -0.34 3.45 1.57 -1.42 -1.72 116.57 118.20 3gqz h LYS 67 Ca 0.34 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.99 3gqz h LYS 67 Cb 1.21 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.50 3gqz h LYS 67 CO -0.04 0.04 -0.31 1.79 -0.57 0.00 0.00 179.45 180.37 3gqz h THR 68 N 0.00 1.28 -0.36 -0.16 1.35 -1.58 0.35 112.91 113.79 3gqz h THR 68 Ca -0.00 -1.45 -0.05 0.00 -0.55 0.00 0.00 66.41 64.36 3gqz h THR 68 Cb 0.14 1.35 -0.01 0.00 -1.73 0.00 0.00 68.15 67.89 3gqz h THR 68 CO 0.01 0.47 0.02 -0.26 -0.25 0.00 0.00 175.52 175.50 3gqz h PHE 69 N 0.62 0.68 -0.61 4.73 0.04 -1.47 -1.98 116.94 118.94 3gqz h PHE 69 Ca 0.07 -0.11 0.03 0.00 2.80 0.00 0.00 57.97 60.75 3gqz h PHE 69 Cb 0.83 -0.18 -0.04 0.00 2.20 0.00 0.00 35.95 38.76 3gqz h PHE 69 CO 0.04 0.71 0.37 1.15 -0.60 0.00 0.00 178.31 179.99 3gqz h THR 70 N 0.45 1.08 -0.55 -1.55 2.02 -1.31 0.34 112.91 113.39 3gqz h THR 70 Ca 0.10 -0.25 0.01 0.00 0.77 0.00 0.00 66.41 67.04 3gqz h THR 70 Cb 0.43 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 3gqz h THR 70 CO 0.02 0.13 0.36 1.23 0.37 0.00 0.00 175.52 177.63 3gqz h GLY 71 N 0.74 0.77 1.01 2.16 0.00 -0.84 -0.73 103.07 106.19 3gqz h GLY 71 Ca 0.24 -0.28 -0.13 0.00 0.00 0.00 0.00 47.33 47.16 3gqz h GLY 71 CO -0.10 0.26 -0.31 -2.08 0.00 0.00 0.00 176.54 174.32 3gqz h VAL 72 N 0.72 1.29 -0.68 4.60 2.07 -1.07 -0.56 116.25 122.63 3gqz h VAL 72 Ca 0.21 -1.48 0.02 0.00 0.82 0.00 0.00 66.70 66.27 3gqz h VAL 72 Cb -0.06 1.52 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 3gqz h VAL 72 CO -0.06 0.48 0.43 0.25 0.02 0.00 0.00 177.57 178.69 3gqz h LEU 73 N 0.53 0.71 -0.56 2.57 5.85 -0.82 0.13 115.31 123.72 3gqz h LEU 73 Ca 0.05 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3gqz h LEU 73 Cb 0.88 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.73 3gqz h LEU 73 CO 0.08 0.50 0.35 1.23 -0.34 0.00 0.00 178.44 180.26 3gqz h GLY 74 N 0.85 0.80 0.96 3.75 0.00 -1.01 -1.59 103.07 106.82 3gqz h GLY 74 Ca 0.27 -0.32 0.02 0.00 0.00 0.00 0.00 47.33 47.30 3gqz h GLY 74 CO -0.09 0.31 0.58 -1.33 0.00 0.00 0.00 176.54 176.01 3gqz h GLY 75 N 0.75 1.26 1.05 4.60 0.00 -0.55 -1.53 103.07 108.65 3gqz h GLY 75 Ca 0.20 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 3gqz h GLY 75 CO -0.04 0.42 0.52 -1.80 0.00 0.00 0.00 176.54 175.64 3gqz h ASP 76 N 1.16 1.11 -0.54 0.19 3.58 -0.47 -1.44 116.42 120.01 3gqz h ASP 76 Ca 0.33 -0.08 -0.07 0.00 0.42 0.00 0.00 57.03 57.63 3gqz h ASP 76 Cb -0.08 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.66 3gqz h ASP 76 CO -0.09 0.87 0.07 0.00 -2.88 0.00 0.00 179.24 177.21 3gqz h ALA 77 N 1.31 1.03 -0.17 -0.78 0.00 -0.65 -0.84 119.26 119.17 3gqz h ALA 77 Ca 0.32 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3gqz h ALA 77 Cb -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3gqz h ALA 77 CO -0.06 0.62 0.07 0.82 0.00 0.00 0.00 179.25 180.70 3gqz h ILE 78 N 0.89 1.14 -0.32 0.00 2.04 -1.00 -1.14 117.51 119.13 3gqz h ILE 78 Ca 0.18 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 3gqz h ILE 78 Cb 0.42 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 3gqz h ILE 78 CO 0.01 0.13 0.17 0.00 0.00 0.00 0.00 178.15 178.46 3gqz h ALA 79 N 0.93 1.70 0.00 1.87 0.00 -1.02 -0.42 119.26 122.31 3gqz h ALA 79 Ca 0.06 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3gqz h ALA 79 Cb 0.15 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3gqz h ALA 79 CO -0.01 0.26 0.00 0.54 0.00 0.00 0.00 179.25 180.04 3gqz n ARG 80 N -4.45 0.15 -1.10 0.00 1.74 -0.34 -4.91 116.66 107.75 3gqz n ARG 80 Ca 0.02 0.06 -0.04 0.00 -0.77 0.00 0.00 57.85 57.12 3gqz n ARG 80 Cb 0.10 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.03 3gqz n ARG 80 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gqz n GLY 81 N 0.99 0.66 0.11 -0.13 0.00 -0.17 -4.94 105.19 101.71 3gqz n GLY 81 Ca 0.08 -0.75 -0.16 0.00 0.00 0.00 0.00 46.02 45.20 3gqz n GLY 81 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3gqz h GLU 82 N 0.12 0.23 -4.70 1.61 5.08 -1.41 -3.47 114.58 112.04 3gqz h GLU 82 Ca -0.07 -0.40 -0.25 0.00 -1.00 0.00 0.00 59.36 57.63 3gqz h GLU 82 Cb 0.26 0.15 -0.15 0.00 0.50 0.00 0.00 28.75 29.51 3gqz h GLU 82 CO 0.11 1.11 -0.67 0.96 -1.00 0.00 0.00 179.01 179.52 3gqz s ILE 83 N -2.63 0.59 -0.02 3.13 -4.36 -1.19 -4.85 121.20 111.86 3gqz s ILE 83 Ca -0.07 -1.96 0.04 0.00 -0.26 0.00 0.00 60.65 58.41 3gqz s ILE 83 Cb 0.07 -2.00 -0.01 0.00 1.25 0.00 0.00 42.46 41.78 3gqz s ILE 83 CO 0.86 -0.57 -0.15 -0.54 0.24 0.00 0.00 174.94 174.77 3gqz s LYS 84 N -3.92 1.38 0.56 0.37 1.02 -1.26 -4.25 119.74 113.65 3gqz s LYS 84 Ca 0.21 -0.53 0.33 0.00 0.02 0.00 0.00 55.97 56.00 3gqz s LYS 84 Cb 0.06 -1.27 1.63 0.00 -0.52 0.00 0.00 37.83 37.72 3gqz s LYS 84 CO 0.01 0.26 2.10 -0.07 -0.92 0.00 0.00 175.35 176.74 3gqz h LEU 85 N 6.04 0.00 -0.04 3.17 3.38 -1.98 -1.56 115.31 124.31 3gqz h LEU 85 Ca -0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.63 3gqz h LEU 85 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 3gqz h LEU 85 CO 0.48 0.07 0.00 -1.54 0.09 0.00 0.00 178.44 177.54 3gqz n SER 86 N -3.35 0.18 -4.77 -0.43 3.41 -1.26 -1.02 113.62 106.39 3gqz n SER 86 Ca -0.01 0.52 -0.40 0.00 -0.26 0.00 0.00 58.87 58.72 3gqz n SER 86 Cb 0.23 -0.57 -0.02 0.00 -0.26 0.00 0.00 64.21 63.59 3gqz n SER 86 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3gqz s ASP 87 N -3.34 6.71 0.43 4.04 1.01 -0.59 -4.82 116.67 120.11 3gqz s ASP 87 Ca 0.11 2.51 -0.25 0.00 0.71 0.00 0.00 52.55 55.63 3gqz s ASP 87 Cb 0.15 -2.63 -0.08 0.00 1.01 0.00 0.00 42.92 41.37 3gqz s ASP 87 CO 0.48 -0.56 1.34 -2.84 0.21 0.00 0.00 175.17 173.81 3gqz s PRO 88 N -1.95 3.82 0.34 8.23 0.02 -1.26 -1.60 135.00 142.60 3gqz s PRO 88 Ca 0.52 2.23 0.10 0.00 0.02 0.00 0.00 61.00 63.87 3gqz s PRO 88 Cb -0.35 -2.68 0.88 0.00 0.02 0.00 0.00 34.50 32.36 3gqz s PRO 88 CO 0.46 -0.64 1.77 1.15 -0.33 0.00 0.00 177.00 179.41 3gqz h THR 89 N 2.34 0.62 0.00 0.99 2.02 -1.39 -1.34 112.91 116.15 3gqz h THR 89 Ca -0.50 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.47 3gqz h THR 89 Cb 1.26 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 3gqz h THR 89 CO 0.62 0.11 0.00 0.71 0.37 0.00 0.00 175.52 177.33 3gqz h THR 90 N 0.61 0.00 -0.63 3.16 1.35 -1.82 -2.45 112.91 113.13 3gqz h THR 90 Ca 0.59 -0.31 -0.03 0.00 -0.55 0.00 0.00 66.41 66.12 3gqz h THR 90 Cb 1.13 1.17 -0.03 0.00 -1.73 0.00 0.00 68.15 68.69 3gqz h THR 90 CO -0.37 0.00 0.27 0.50 -0.25 0.00 0.00 175.52 175.67 3gqz h LYS 91 N 0.00 0.91 -0.01 4.72 3.64 -1.61 -2.66 116.57 121.56 3gqz h LYS 91 Ca 0.00 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 3gqz h LYS 91 Cb 0.35 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 3gqz h LYS 91 CO 0.00 0.73 -0.76 0.66 -2.27 0.00 0.00 179.45 177.80 3gqz n TYR 92 N -4.33 0.00 -3.34 1.91 4.02 -0.96 -4.56 117.16 109.91 3gqz n TYR 92 Ca 0.06 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.69 3gqz n TYR 92 Cb 0.15 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.38 3gqz n TYR 92 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 176.86 177.72 3gqz n TRP 93 N -0.92 -0.50 0.26 -0.72 -0.00 -0.98 -5.00 117.44 109.58 3gqz n TRP 93 Ca 0.06 -3.44 0.18 0.00 -0.00 0.00 0.00 57.50 54.29 3gqz n TRP 93 Cb 0.37 0.00 0.92 0.00 -0.00 0.00 0.00 31.31 32.60 3gqz n TRP 93 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 3gqz h PRO 94 N 5.02 0.00 0.00 5.87 0.11 -1.71 -1.01 132.00 140.28 3gqz h PRO 94 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 3gqz h PRO 94 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 3gqz h PRO 94 CO 0.42 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.14 3gqz h GLU 95 N 0.00 0.00 -5.62 1.05 3.07 -1.94 -3.38 114.58 107.76 3gqz h GLU 95 Ca 0.05 0.00 -0.60 0.00 -0.50 0.00 0.00 59.36 58.31 3gqz h GLU 95 Cb 0.36 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.21 3gqz h GLU 95 CO -0.00 0.00 2.01 1.28 -1.40 0.00 0.00 179.01 180.90 3gqz n LEU 96 N -2.41 4.61 0.02 1.33 4.77 -0.38 -4.73 117.00 120.20 3gqz n LEU 96 Ca 0.03 -3.74 0.11 0.00 -0.03 0.00 0.00 56.01 52.38 3gqz n LEU 96 Cb 0.31 -1.73 0.05 0.00 -2.33 0.00 0.00 43.42 39.73 3gqz n LEU 96 CO 0.25 -0.26 0.09 0.35 -1.33 0.00 0.00 177.39 176.48 3gqz n THR 97 N 6.64 0.11 -1.75 -5.08 -2.24 -1.26 -4.83 114.28 105.87 3gqz n THR 97 Ca 0.48 -0.16 -0.41 0.00 -2.27 0.00 0.00 64.05 61.69 3gqz n THR 97 Cb 0.46 0.33 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 3gqz n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gqz n ALA 98 N -1.71 1.97 -0.32 6.98 0.00 -1.26 -4.90 120.51 121.27 3gqz n ALA 98 Ca 0.03 0.33 0.03 0.00 0.00 0.00 0.00 53.44 53.83 3gqz n ALA 98 Cb 0.40 -2.36 0.17 0.00 0.00 0.00 0.00 19.45 17.66 3gqz n ALA 98 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 3gqz h LYS 99 N 2.70 0.93 0.00 0.00 2.10 -1.93 -2.36 116.57 118.00 3gqz h LYS 99 Ca -0.49 -0.06 0.00 0.00 -2.00 0.00 0.00 60.65 58.10 3gqz h LYS 99 Cb 1.26 -0.21 0.00 0.00 -0.90 0.00 0.00 32.23 32.38 3gqz h LYS 99 CO 0.63 0.62 0.09 -0.56 -2.00 0.00 0.00 179.45 178.22 3gqz h GLN 100 N 0.96 0.00 0.00 0.07 -0.00 -1.94 0.02 115.11 114.23 3gqz h GLN 100 Ca 0.41 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.06 3gqz h GLN 100 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.76 3gqz h GLN 100 CO -0.21 0.00 -0.11 0.91 -0.00 0.00 0.00 178.83 179.42 3gqz n TRP 101 N -2.47 0.43 -1.70 0.06 7.02 -0.89 -4.70 117.44 115.18 3gqz n TRP 101 Ca -0.02 0.13 -0.42 0.00 -1.02 0.00 0.00 57.50 56.17 3gqz n TRP 101 Cb 0.13 -0.67 -0.03 0.00 -2.42 0.00 0.00 31.31 28.32 3gqz n TRP 101 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 3gqz s ASN 102 N -3.74 6.28 0.00 -0.99 0.01 -0.01 -2.07 114.94 114.42 3gqz s ASN 102 Ca 0.12 2.46 0.00 0.00 -0.71 0.00 0.00 52.86 54.72 3gqz s ASN 102 Cb 0.16 -2.53 0.00 0.00 0.41 0.00 0.00 41.25 39.29 3gqz s ASN 102 CO 0.59 -1.22 0.00 0.61 -1.51 0.00 0.00 177.10 175.57 3gqz n GLY 103 N 4.74 0.62 3.58 0.66 0.00 -1.26 -5.02 105.19 108.51 3gqz n GLY 103 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 3gqz n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gqz s ILE 104 N -2.27 4.82 0.42 -0.61 1.01 -0.88 -4.89 121.20 118.81 3gqz s ILE 104 Ca 0.00 0.76 0.08 0.00 0.00 0.00 0.00 60.65 61.49 3gqz s ILE 104 Cb 0.00 -4.13 0.00 0.00 0.01 0.00 0.00 42.46 38.34 3gqz s ILE 104 CO 0.00 -0.34 0.52 0.42 0.00 0.00 0.00 174.94 175.53 3gqz s THR 105 N 2.87 2.93 0.43 2.92 -4.23 -1.26 -1.10 115.64 118.20 3gqz s THR 105 Ca 0.28 -1.09 0.09 0.00 -1.18 0.00 0.00 61.69 59.79 3gqz s THR 105 Cb -0.14 -3.01 0.27 0.00 1.34 0.00 0.00 72.50 70.96 3gqz s THR 105 CO 0.15 -0.00 2.07 -0.07 -0.54 0.00 0.00 174.62 176.23 3gqz h LEU 106 N 0.75 0.38 -0.28 4.79 3.38 -1.23 -1.84 115.31 121.26 3gqz h LEU 106 Ca -0.40 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 57.59 3gqz h LEU 106 Cb 1.28 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.90 3gqz h LEU 106 CO 0.48 0.27 0.07 0.25 0.09 0.00 0.00 178.44 179.61 3gqz h LEU 107 N 0.45 0.05 -0.61 1.67 5.85 -1.36 -1.16 115.31 120.21 3gqz h LEU 107 Ca 0.14 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.94 3gqz h LEU 107 Cb -0.00 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 3gqz h LEU 107 CO -0.03 0.06 0.35 0.45 -0.34 0.00 0.00 178.44 178.94 3gqz h HIS 108 N 0.19 0.65 -0.48 1.25 3.86 -1.63 -2.05 115.15 116.95 3gqz h HIS 108 Ca 0.13 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.35 3gqz h HIS 108 Cb 0.12 -0.20 -0.02 0.00 1.06 0.00 0.00 27.41 28.36 3gqz h HIS 108 CO -0.15 0.34 0.23 -0.07 0.86 0.00 0.00 177.93 179.14 3gqz h LEU 109 N 0.67 0.62 -1.74 2.43 3.38 -1.23 -1.17 115.31 118.27 3gqz h LEU 109 Ca 0.26 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 3gqz h LEU 109 Cb 0.10 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 3gqz h LEU 109 CO -0.14 0.57 -0.16 0.00 0.09 0.00 0.00 178.44 178.80 3gqz h ALA 110 N 1.08 1.29 -0.11 1.53 0.00 -0.80 -2.82 119.26 119.43 3gqz h ALA 110 Ca 0.16 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3gqz h ALA 110 Cb 0.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3gqz h ALA 110 CO -0.02 0.20 0.00 0.25 0.00 0.00 0.00 179.25 179.68 3gqz n THR 111 N -3.70 1.50 -2.16 0.00 -2.24 -0.81 -4.40 114.28 102.48 3gqz n THR 111 Ca -0.02 -1.55 -0.19 0.00 -2.27 0.00 0.00 64.05 60.03 3gqz n THR 111 Cb 0.28 0.14 -0.03 0.00 -2.10 0.00 0.00 70.33 68.62 3gqz n THR 111 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3gqz n TYR 112 N -0.62 -0.67 -1.09 4.78 4.01 -0.99 -4.83 117.16 117.76 3gqz n TYR 112 Ca 0.11 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.93 3gqz n TYR 112 Cb 0.51 -3.53 0.21 0.00 -0.31 0.00 0.00 39.34 36.22 3gqz n TYR 112 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3gqz n THR 113 N -3.64 2.16 0.28 -0.72 -2.24 -0.48 -1.51 114.28 108.13 3gqz n THR 113 Ca -0.21 -2.15 0.17 0.00 -2.27 0.00 0.00 64.05 59.58 3gqz n THR 113 Cb 0.65 -0.26 0.65 0.00 -2.10 0.00 0.00 70.33 69.28 3gqz n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gqz h ALA 114 N 1.02 1.00 0.00 6.98 0.00 -1.79 0.17 119.26 126.64 3gqz h ALA 114 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3gqz h ALA 114 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3gqz h ALA 114 CO 0.14 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.80 3gqz n GLY 115 N 0.08 1.87 0.02 0.00 0.00 -1.26 -4.15 105.19 101.76 3gqz n GLY 115 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3gqz n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gqz n GLY 116 N 0.00 0.93 3.76 -0.02 0.00 -1.26 -0.66 105.19 107.93 3gqz n GLY 116 Ca 0.00 -0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 3gqz n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gqz s LEU 117 N -0.02 4.01 0.76 0.99 1.43 -1.26 -4.72 118.68 119.86 3gqz s LEU 117 Ca 0.00 2.75 -0.11 0.00 -1.03 0.00 0.00 54.13 55.74 3gqz s LEU 117 Cb 0.00 -4.11 0.05 0.00 0.03 0.00 0.00 46.19 42.16 3gqz s LEU 117 CO 0.00 -1.27 1.09 -2.16 0.23 0.00 0.00 176.35 174.24 3gqz s PRO 118 N -2.64 2.40 0.18 1.29 0.04 -1.26 -4.73 135.00 130.29 3gqz s PRO 118 Ca 0.65 0.63 -0.13 0.00 0.04 0.00 0.00 61.00 62.20 3gqz s PRO 118 Cb -0.40 -1.96 0.13 0.00 0.04 0.00 0.00 34.50 32.31 3gqz s PRO 118 CO 0.49 -1.39 1.82 1.25 0.04 0.00 0.00 177.00 179.20 3gqz h LEU 119 N -0.92 0.52 -9.06 -3.56 5.85 -1.93 -3.27 115.31 102.93 3gqz h LEU 119 Ca -0.46 0.01 -0.59 0.00 0.84 0.00 0.00 57.88 57.68 3gqz h LEU 119 Cb 1.26 -0.10 -0.16 0.00 0.37 0.00 0.00 40.66 42.03 3gqz h LEU 119 CO 0.60 0.37 -0.78 -1.10 -0.34 0.00 0.00 178.44 177.19 3gqz s GLN 120 N -6.13 1.53 -0.02 1.25 -1.52 -1.26 -0.59 119.66 112.91 3gqz s GLN 120 Ca -0.13 -1.63 -0.26 0.00 -1.95 0.00 0.00 55.36 51.39 3gqz s GLN 120 Cb 0.14 -1.64 -0.04 0.00 -0.22 0.00 0.00 33.01 31.25 3gqz s GLN 120 CO 0.74 0.32 0.82 0.08 -0.25 0.00 0.00 175.29 177.00 3gqz s VAL 121 N -2.28 4.93 0.52 1.09 1.01 -1.26 -4.72 120.40 119.69 3gqz s VAL 121 Ca 0.24 1.71 -0.22 0.00 0.00 0.00 0.00 61.98 63.71 3gqz s VAL 121 Cb -0.05 -4.16 -0.06 0.00 0.00 0.00 0.00 36.38 32.10 3gqz s VAL 121 CO 0.11 0.23 1.30 -2.65 0.00 0.00 0.00 175.10 174.09 3gqz n PRO 122 N 3.69 1.68 0.20 2.72 -0.02 -1.26 -4.85 135.00 137.17 3gqz n PRO 122 Ca 0.01 0.61 0.14 0.00 -2.02 0.00 0.00 63.50 62.25 3gqz n PRO 122 Cb 0.51 -2.49 0.72 0.00 -0.02 0.00 0.00 33.50 32.21 3gqz n PRO 122 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3gqz h ASP 123 N 1.51 0.00 1.44 2.55 3.32 -2.00 -1.71 116.42 121.53 3gqz h ASP 123 Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 3gqz h ASP 123 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 3gqz h ASP 123 CO 0.57 0.00 0.00 -0.33 -1.72 0.00 0.00 179.24 177.76 3gqz h GLU 124 N 0.00 0.00 -6.34 3.56 3.07 -2.03 -3.43 114.58 109.40 3gqz h GLU 124 Ca 0.00 0.00 -0.57 0.00 -0.50 0.00 0.00 59.36 58.29 3gqz h GLU 124 Cb 0.09 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 27.95 3gqz h GLU 124 CO 0.00 0.00 0.92 0.08 -1.40 0.00 0.00 179.01 178.61 3gqz s VAL 125 N -3.20 4.29 0.00 3.13 1.01 -0.65 -4.84 120.40 120.15 3gqz s VAL 125 Ca 0.08 1.47 0.00 0.00 0.00 0.00 0.00 61.98 63.53 3gqz s VAL 125 Cb 0.10 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 32.21 3gqz s VAL 125 CO 0.58 -0.49 0.00 0.29 0.00 0.00 0.00 175.10 175.48 3gqz n LYS 126 N 7.14 1.50 -3.51 2.72 4.76 -1.26 -4.43 118.16 125.08 3gqz n LYS 126 Ca 0.14 0.00 -0.21 0.00 -2.87 0.00 0.00 58.31 55.36 3gqz n LYS 126 Cb 0.47 -0.90 -0.01 0.00 -1.84 0.00 0.00 35.03 32.75 3gqz n LYS 126 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 3gqz s SER 127 N -3.22 5.04 0.29 4.39 1.04 -1.26 -5.01 113.70 114.96 3gqz s SER 127 Ca 0.00 -0.82 0.07 0.00 0.48 0.00 0.00 55.95 55.68 3gqz s SER 127 Cb 0.00 -0.30 0.44 0.00 0.10 0.00 0.00 66.02 66.26 3gqz s SER 127 CO 0.00 -0.83 1.68 0.77 0.98 0.00 0.00 173.24 175.84 3gqz h SER 128 N 0.84 0.22 -0.53 7.02 4.64 -1.99 -2.20 113.55 121.55 3gqz h SER 128 Ca -0.39 -0.10 -0.06 0.00 -0.47 0.00 0.00 61.79 60.77 3gqz h SER 128 Cb 1.28 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 63.28 3gqz h SER 128 CO 0.54 0.65 0.08 0.28 -0.87 0.00 0.00 176.83 177.51 3gqz h SER 129 N 0.17 0.84 -0.73 4.97 0.02 -1.99 -1.20 113.55 115.62 3gqz h SER 129 Ca 0.01 -0.26 0.05 0.00 -0.84 0.00 0.00 61.79 60.75 3gqz h SER 129 Cb 0.87 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 63.13 3gqz h SER 129 CO 0.07 0.89 0.44 0.44 -1.14 0.00 0.00 176.83 177.53 3gqz h ASP 130 N 0.76 0.70 -0.37 3.07 3.32 -1.93 -1.74 116.42 120.22 3gqz h ASP 130 Ca 0.16 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.14 3gqz h ASP 130 Cb 0.41 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 3gqz h ASP 130 CO 0.01 0.46 -0.09 0.25 -1.72 0.00 0.00 179.24 178.16 3gqz h LEU 131 N 0.83 0.72 -0.34 1.55 5.85 -1.17 -1.81 115.31 120.93 3gqz h LEU 131 Ca 0.31 -0.36 0.02 0.00 0.84 0.00 0.00 57.88 58.69 3gqz h LEU 131 Cb 0.11 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 3gqz h LEU 131 CO -0.15 0.92 0.18 0.25 -0.34 0.00 0.00 178.44 179.30 3gqz h LEU 132 N 0.51 0.28 -0.49 2.25 5.85 -1.07 -2.44 115.31 120.21 3gqz h LEU 132 Ca 0.09 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.85 3gqz h LEU 132 Cb 0.60 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.55 3gqz h LEU 132 CO 0.04 0.21 0.28 0.03 -0.34 0.00 0.00 178.44 178.65 3gqz h ARG 133 N 0.38 0.53 -0.20 1.25 3.08 -1.18 -0.12 114.38 118.13 3gqz h ARG 133 Ca 0.14 -0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.21 3gqz h ARG 133 Cb 0.03 -0.12 -0.06 0.00 0.08 0.00 0.00 29.97 29.90 3gqz h ARG 133 CO -0.08 0.35 -0.21 0.35 -1.07 0.00 0.00 179.97 179.31 3gqz h PHE 134 N 0.55 -0.54 -0.11 3.04 3.57 -1.11 0.13 116.94 122.47 3gqz h PHE 134 Ca 0.20 0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.56 3gqz h PHE 134 Cb 0.05 0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 3gqz h PHE 134 CO -0.08 -0.28 -0.65 1.88 -2.23 0.00 0.00 178.31 176.95 3gqz h TYR 135 N -0.23 0.57 -0.81 0.41 0.05 -1.21 -2.28 116.97 113.47 3gqz h TYR 135 Ca 0.12 -0.23 -0.03 0.00 0.05 0.00 0.00 58.73 58.64 3gqz h TYR 135 Cb 0.41 -0.10 -0.04 0.00 1.01 0.00 0.00 36.73 38.02 3gqz h TYR 135 CO -0.34 0.97 0.40 1.96 -1.05 0.00 0.00 178.16 180.09 3gqz h GLN 136 N 0.32 1.16 0.00 4.88 1.08 -0.82 -3.17 115.11 118.56 3gqz h GLN 136 Ca -0.02 -0.16 0.00 0.00 -1.45 0.00 0.00 58.65 57.03 3gqz h GLN 136 Cb 1.21 -0.21 0.00 0.00 -0.05 0.00 0.00 27.48 28.42 3gqz h GLN 136 CO 0.11 0.88 -0.47 0.09 -0.95 0.00 0.00 178.83 178.49 3gqz n ASN 137 N -4.32 0.66 -4.74 1.46 5.03 0.02 -4.86 115.26 108.52 3gqz n ASN 137 Ca 0.08 0.18 -0.42 0.00 0.87 0.00 0.00 54.58 55.29 3gqz n ASN 137 Cb 0.13 -0.03 -0.02 0.00 -1.02 0.00 0.00 39.78 38.84 3gqz n ASN 137 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 3gqz s TRP 138 N -3.13 2.97 -0.26 3.10 -0.00 -0.87 -5.01 118.94 115.74 3gqz s TRP 138 Ca 0.08 0.84 -0.04 0.00 -0.00 0.00 0.00 56.10 56.99 3gqz s TRP 138 Cb 0.14 -3.91 0.02 0.00 -0.00 0.00 0.00 33.47 29.71 3gqz s TRP 138 CO 0.69 -3.13 -0.01 -0.65 -0.00 0.00 0.00 176.95 173.85 3gqz s GLN 139 N 0.04 2.97 0.45 5.86 -1.52 -1.26 -4.99 119.66 121.21 3gqz s GLN 139 Ca 0.63 -0.91 -0.25 0.00 -1.95 0.00 0.00 55.36 52.89 3gqz s GLN 139 Cb -0.44 -3.12 -0.08 0.00 -0.22 0.00 0.00 33.01 29.16 3gqz s GLN 139 CO 0.41 -0.40 1.33 -1.25 -0.25 0.00 0.00 175.29 175.13 3gqz s PRO 140 N 1.40 3.71 0.05 2.91 0.04 -1.26 -4.96 135.00 136.89 3gqz s PRO 140 Ca 0.01 2.20 -0.06 0.00 0.04 0.00 0.00 61.00 63.19 3gqz s PRO 140 Cb -0.17 -2.59 -0.29 0.00 0.04 0.00 0.00 34.50 31.49 3gqz s PRO 140 CO -0.02 -0.72 1.06 0.00 0.04 0.00 0.00 177.00 177.36 3gqz h ALA 141 N 2.28 0.09 -2.29 8.56 0.00 -1.18 -3.48 119.26 123.24 3gqz h ALA 141 Ca -0.50 -0.92 -0.32 0.00 0.00 0.00 0.00 54.91 53.16 3gqz h ALA 141 Cb 1.26 0.09 -0.15 0.00 0.00 0.00 0.00 17.79 18.99 3gqz h ALA 141 CO 0.61 0.96 -0.72 -1.58 0.00 0.00 0.00 179.25 178.53 3gqz s TRP 142 N -2.64 1.22 0.64 0.00 0.51 -1.10 -5.06 118.94 112.51 3gqz s TRP 142 Ca -0.06 -0.76 -0.18 0.00 -2.12 0.00 0.00 56.10 52.98 3gqz s TRP 142 Cb 0.07 -0.63 -0.02 0.00 -0.81 0.00 0.00 33.47 32.08 3gqz s TRP 142 CO 0.89 0.06 1.30 0.00 -0.51 0.00 0.00 176.95 178.69 3gqz s ALA 143 N -3.25 2.43 0.56 0.98 0.00 -1.26 -4.42 121.76 116.80 3gqz s ALA 143 Ca 0.15 1.22 -0.21 0.00 0.00 0.00 0.00 51.96 53.12 3gqz s ALA 143 Cb 0.02 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.55 3gqz s ALA 143 CO 0.00 -1.56 1.32 -1.25 0.00 0.00 0.00 175.76 174.27 3gqz s PRO 144 N -3.33 3.08 -1.00 0.00 0.04 -1.26 -3.39 135.00 129.13 3gqz s PRO 144 Ca 0.82 2.13 0.00 0.00 0.04 0.00 0.00 61.00 63.98 3gqz s PRO 144 Cb -0.38 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 31.99 3gqz s PRO 144 CO 0.40 -1.20 0.00 0.41 0.04 0.00 0.00 177.00 176.65 3gqz n GLY 145 N 0.71 -0.01 0.01 0.56 0.00 0.60 -4.90 105.19 102.15 3gqz n GLY 145 Ca 0.11 -0.41 -0.01 0.00 0.00 0.00 0.00 46.02 45.72 3gqz n GLY 145 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3gqz n THR 146 N -3.92 0.09 -4.11 2.61 -2.24 -1.22 -4.84 114.28 100.66 3gqz n THR 146 Ca -0.14 -0.05 -0.14 0.00 -2.27 0.00 0.00 64.05 61.45 3gqz n THR 146 Cb 0.59 -0.82 -0.13 0.00 -2.10 0.00 0.00 70.33 67.87 3gqz n THR 146 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3gqz s GLN 147 N -2.03 0.46 -0.20 -0.78 -0.21 -1.26 -1.47 119.66 114.17 3gqz s GLN 147 Ca -0.01 -0.44 -0.12 0.00 0.02 0.00 0.00 55.36 54.80 3gqz s GLN 147 Cb 0.00 -0.34 -0.05 0.00 1.00 0.00 0.00 33.01 33.62 3gqz s GLN 147 CO 0.05 0.08 0.23 0.50 -2.12 0.00 0.00 175.29 174.03 3gqz s ARG 148 N -0.78 4.19 -0.18 2.91 3.52 0.46 -4.24 118.95 124.83 3gqz s ARG 148 Ca -0.04 -0.06 -0.05 0.00 -0.13 0.00 0.00 55.73 55.45 3gqz s ARG 148 Cb -0.06 -3.46 0.06 0.00 -1.56 0.00 0.00 34.95 29.93 3gqz s ARG 148 CO 0.00 0.18 0.09 -1.17 -0.81 0.00 0.00 175.30 173.59 3gqz s LEU 149 N 0.69 0.40 0.15 -0.88 2.96 -0.57 -1.68 118.68 119.75 3gqz s LEU 149 Ca 0.12 -0.69 -0.34 0.00 -0.22 0.00 0.00 54.13 53.01 3gqz s LEU 149 Cb -0.13 -0.27 -0.16 0.00 0.50 0.00 0.00 46.19 46.14 3gqz s LEU 149 CO 0.03 -0.36 1.26 0.00 -1.32 0.00 0.00 176.35 175.96 3gqz n TYR 150 N 5.27 1.49 -3.65 5.38 4.19 -1.26 -4.79 117.16 123.79 3gqz n TYR 150 Ca -0.07 0.62 -0.02 0.00 3.31 0.00 0.00 57.90 61.75 3gqz n TYR 150 Cb 0.48 -2.32 -0.05 0.00 0.49 0.00 0.00 39.34 37.94 3gqz n TYR 150 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 3gqz s ALA 151 N 0.10 -1.96 0.38 2.98 0.00 -1.26 -4.52 121.76 117.48 3gqz s ALA 151 Ca 0.77 2.26 0.09 0.00 0.00 0.00 0.00 51.96 55.07 3gqz s ALA 151 Cb -0.86 -1.74 0.76 0.00 0.00 0.00 0.00 23.12 21.28 3gqz s ALA 151 CO 0.49 -0.92 1.91 -0.91 0.00 0.00 0.00 175.76 176.34 3gqz h ASN 152 N 8.02 0.28 0.76 0.00 2.35 -1.01 -2.60 115.58 123.38 3gqz h ASN 152 Ca -0.18 -0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.52 3gqz h ASN 152 Cb 1.10 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 39.40 3gqz h ASN 152 CO 0.10 0.41 -0.01 0.77 -1.65 0.00 0.00 177.43 177.05 3gqz h SER 153 N 0.28 0.00 0.00 5.81 4.64 -1.61 -0.64 113.55 122.04 3gqz h SER 153 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3gqz h SER 153 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 3gqz h SER 153 CO 0.02 0.01 -0.03 -1.28 -0.87 0.00 0.00 176.83 174.69 3gqz h SER 154 N 0.00 0.00 0.45 4.97 0.87 -1.71 -3.19 113.55 114.94 3gqz h SER 154 Ca -0.00 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.49 3gqz h SER 154 Cb 0.40 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 3gqz h SER 154 CO 0.00 0.25 -0.31 -0.29 -0.53 0.00 0.00 176.83 175.95 3gqz h ILE 155 N -0.47 1.05 -0.36 2.23 2.10 -1.43 -2.26 117.51 118.37 3gqz h ILE 155 Ca 0.00 -1.15 0.04 0.00 1.08 0.00 0.00 64.86 64.83 3gqz h ILE 155 Cb 0.03 1.65 -0.04 0.00 -1.09 0.00 0.00 36.82 37.37 3gqz h ILE 155 CO 0.00 0.31 0.13 1.23 -1.08 0.00 0.00 178.15 178.74 3gqz h GLY 156 N 1.22 0.45 1.12 8.18 0.00 -1.29 -0.19 103.07 112.57 3gqz h GLY 156 Ca -0.00 -0.08 -0.11 0.00 0.00 0.00 0.00 47.33 47.14 3gqz h GLY 156 CO 0.04 0.03 -0.07 -2.00 0.00 0.00 0.00 176.54 174.54 3gqz h LEU 157 N 0.28 1.03 -0.47 3.11 5.85 -1.46 -2.28 115.31 121.37 3gqz h LEU 157 Ca 0.16 -0.32 0.08 0.00 0.84 0.00 0.00 57.88 58.64 3gqz h LEU 157 Cb 0.13 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 40.81 3gqz h LEU 157 CO -0.16 1.12 0.07 0.15 -0.34 0.00 0.00 178.44 179.28 3gqz h PHE 158 N 0.93 0.10 -0.46 1.25 3.57 -1.02 -1.02 116.94 120.29 3gqz h PHE 158 Ca 0.15 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 3gqz h PHE 158 Cb 0.64 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 3gqz h PHE 158 CO 0.04 -0.03 0.26 0.78 -2.23 0.00 0.00 178.31 177.13 3gqz h GLY 159 N 0.20 0.68 1.00 2.40 0.00 -0.80 0.37 103.07 106.92 3gqz h GLY 159 Ca 0.24 -0.30 -0.04 0.00 0.00 0.00 0.00 47.33 47.22 3gqz h GLY 159 CO -0.33 0.29 0.22 0.00 0.00 0.00 0.00 176.54 176.72 3gqz h ALA 160 N 1.10 0.79 -0.01 3.60 0.00 -1.12 -3.15 119.26 120.47 3gqz h ALA 160 Ca 0.16 -0.18 -0.21 0.00 0.00 0.00 0.00 54.91 54.67 3gqz h ALA 160 Cb 0.04 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 3gqz h ALA 160 CO -0.03 0.43 -0.90 -0.07 0.00 0.00 0.00 179.25 178.69 3gqz h LEU 161 N 0.85 0.45 -1.72 0.00 3.38 -1.01 -3.27 115.31 114.00 3gqz h LEU 161 Ca 0.20 -0.35 0.02 0.00 0.09 0.00 0.00 57.88 57.84 3gqz h LEU 161 Cb 0.24 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3gqz h LEU 161 CO -0.01 1.14 0.23 0.00 0.09 0.00 0.00 178.44 179.89 3gqz h ALA 162 N 0.83 1.86 0.00 1.53 0.00 -0.89 -2.54 119.26 120.05 3gqz h ALA 162 Ca -0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3gqz h ALA 162 Cb 1.52 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.21 3gqz h ALA 162 CO 0.15 0.10 -0.60 1.33 0.00 0.00 0.00 179.25 180.23 3gqz n VAL 163 N -4.49 0.13 -0.12 0.00 0.24 -1.22 -4.46 118.33 108.41 3gqz n VAL 163 Ca 0.03 -0.11 -0.05 0.00 -2.04 0.00 0.00 64.34 62.17 3gqz n VAL 163 Cb 0.14 0.13 0.02 0.00 -1.47 0.00 0.00 33.84 32.65 3gqz n VAL 163 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 3gqz h LYS 164 N 0.00 0.01 0.00 7.34 1.57 -1.50 -1.63 116.57 122.36 3gqz h LYS 164 Ca 0.00 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3gqz h LYS 164 Cb 0.60 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.91 3gqz h LYS 164 CO 0.00 0.01 -0.01 -1.35 -0.57 0.00 0.00 179.45 177.52 3gqz h PRO 165 N 0.01 0.00 0.00 3.15 0.11 -1.78 -1.81 132.00 131.68 3gqz h PRO 165 Ca 0.20 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.27 3gqz h PRO 165 Cb 0.30 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.40 3gqz h PRO 165 CO -0.41 0.01 -0.19 0.66 -0.21 0.00 0.00 178.00 177.87 3gqz h SER 166 N 0.00 0.00 0.00 -2.05 4.64 -1.58 -3.46 113.55 111.10 3gqz h SER 166 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3gqz h SER 166 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3gqz h SER 166 CO 0.00 0.19 0.00 0.61 -0.87 0.00 0.00 176.83 176.76 3gqz n GLY 167 N -0.11 1.78 3.87 -0.77 0.00 -0.68 -5.02 105.19 104.26 3gqz n GLY 167 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 3gqz n GLY 167 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gqz s LEU 168 N 0.00 4.03 0.77 0.99 1.43 -1.26 -5.07 118.68 119.57 3gqz s LEU 168 Ca 0.00 1.12 -0.11 0.00 -1.03 0.00 0.00 54.13 54.11 3gqz s LEU 168 Cb 0.00 -3.93 0.05 0.00 0.03 0.00 0.00 46.19 42.34 3gqz s LEU 168 CO 0.00 -0.23 1.09 -0.94 0.23 0.00 0.00 176.35 176.50 3gqz s SER 169 N -2.59 4.56 0.18 2.29 1.04 -1.26 -4.64 113.70 113.27 3gqz s SER 169 Ca 0.51 1.81 -0.14 0.00 0.48 0.00 0.00 55.95 58.62 3gqz s SER 169 Cb -0.10 -2.52 0.14 0.00 0.10 0.00 0.00 66.02 63.64 3gqz s SER 169 CO 0.23 -2.00 1.75 0.15 0.98 0.00 0.00 173.24 174.34 3gqz h PHE 170 N -1.10 0.28 0.20 5.02 3.57 -1.93 -0.65 116.94 122.34 3gqz h PHE 170 Ca -0.44 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.10 3gqz h PHE 170 Cb 1.23 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.89 3gqz h PHE 170 CO 0.58 0.09 -0.26 1.49 -2.23 0.00 0.00 178.31 177.98 3gqz h GLU 171 N 0.33 -0.50 -0.65 1.11 4.81 -1.99 -0.69 114.58 117.00 3gqz h GLU 171 Ca 0.22 0.03 0.11 0.00 -0.13 0.00 0.00 59.36 59.59 3gqz h GLU 171 Cb 0.23 0.11 -0.08 0.00 0.63 0.00 0.00 28.75 29.64 3gqz h GLU 171 CO -0.23 -0.33 0.23 1.96 -0.73 0.00 0.00 179.01 179.91 3gqz h GLN 172 N -0.52 0.39 -0.33 1.92 4.20 -1.85 -0.02 115.11 118.90 3gqz h GLN 172 Ca 0.01 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.64 3gqz h GLN 172 Cb 0.50 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 3gqz h GLN 172 CO -0.09 0.25 -0.00 0.00 -0.67 0.00 0.00 178.83 178.32 3gqz h ALA 173 N 1.46 0.45 -0.52 3.87 0.00 -0.94 -1.39 119.26 122.18 3gqz h ALA 173 Ca 0.34 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3gqz h ALA 173 Cb 0.45 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3gqz h ALA 173 CO -0.35 0.21 0.29 1.98 0.00 0.00 0.00 179.25 181.38 3gqz h MET 174 N 0.39 0.73 0.11 0.00 1.85 -0.56 -0.42 114.93 117.02 3gqz h MET 174 Ca 0.09 -0.08 -0.01 0.00 -0.61 0.00 0.00 59.70 59.10 3gqz h MET 174 Cb 0.45 -0.14 0.00 0.00 0.43 0.00 0.00 31.60 32.34 3gqz h MET 174 CO 0.02 0.56 -0.05 0.37 -0.40 0.00 0.00 176.91 177.40 3gqz h GLN 175 N 0.70 -0.14 0.00 0.39 5.75 -0.93 -1.18 115.11 119.70 3gqz h GLN 175 Ca 0.19 0.01 -0.18 0.00 -0.15 0.00 0.00 58.65 58.52 3gqz h GLN 175 Cb 0.03 0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.59 3gqz h GLN 175 CO -0.03 0.06 -0.85 1.79 -2.65 0.00 0.00 178.83 177.15 3gqz h THR 176 N -0.32 1.61 0.00 2.39 1.35 -1.21 -0.08 112.91 116.65 3gqz h THR 176 Ca -0.01 -2.90 0.00 0.00 -0.55 0.00 0.00 66.41 62.94 3gqz h THR 176 Cb 0.26 2.57 0.00 0.00 -1.73 0.00 0.00 68.15 69.25 3gqz h THR 176 CO 0.02 0.83 -1.47 0.54 -0.25 0.00 0.00 175.52 175.19 3gqz n ARG 177 N -3.53 0.81 0.06 4.72 1.74 -0.17 -4.44 116.66 115.84 3gqz n ARG 177 Ca -0.01 -0.11 0.00 0.00 -0.77 0.00 0.00 57.85 56.97 3gqz n ARG 177 Cb 0.81 -1.38 0.00 0.00 -1.02 0.00 0.00 32.46 30.87 3gqz n ARG 177 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3gqz n VAL 178 N -1.88 0.75 0.24 1.55 0.31 -0.77 -4.76 118.33 113.78 3gqz n VAL 178 Ca -0.01 0.25 -0.15 0.00 -0.01 0.00 0.00 64.34 64.42 3gqz n VAL 178 Cb 0.39 -1.29 -0.08 0.00 -0.91 0.00 0.00 33.84 31.95 3gqz n VAL 178 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 3gqz h PHE 179 N 0.00 -0.55 0.38 3.52 0.04 -1.25 -2.89 116.94 116.19 3gqz h PHE 179 Ca 0.00 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.75 3gqz h PHE 179 Cb 0.13 0.18 -0.02 0.00 2.20 0.00 0.00 35.95 38.45 3gqz h PHE 179 CO 0.00 -0.27 -0.33 1.96 -0.60 0.00 0.00 178.31 179.07 3gqz h GLN 180 N -0.75 -0.70 -0.56 1.51 4.20 -1.25 -0.18 115.11 117.39 3gqz h GLN 180 Ca -0.06 0.05 0.10 0.00 0.06 0.00 0.00 58.65 58.80 3gqz h GLN 180 Cb 0.53 0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.44 3gqz h GLN 180 CO 0.10 -0.47 0.38 -1.35 -0.67 0.00 0.00 178.83 176.82 3gqz h PRO 181 N -0.73 0.33 -0.11 1.46 0.11 -1.78 -0.99 132.00 130.31 3gqz h PRO 181 Ca -0.03 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.06 3gqz h PRO 181 Cb 0.64 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.67 3gqz h PRO 181 CO -0.03 0.22 0.00 1.28 -0.21 0.00 0.00 178.00 179.26 3gqz n LEU 182 N -4.46 1.73 -3.66 2.35 4.77 -1.09 -4.94 117.00 111.69 3gqz n LEU 182 Ca 0.09 -0.66 -0.26 0.00 -0.03 0.00 0.00 56.01 55.15 3gqz n LEU 182 Cb 0.38 -0.06 0.06 0.00 -2.33 0.00 0.00 43.42 41.47 3gqz n LEU 182 CO 0.34 0.33 0.20 0.29 -1.33 0.00 0.00 177.39 177.22 3gqz n LYS 183 N 0.35 -7.18 -2.81 3.23 5.02 -0.38 -4.91 118.16 111.48 3gqz n LYS 183 Ca 0.17 0.77 -0.44 0.00 -2.02 0.00 0.00 58.31 56.79 3gqz n LYS 183 Cb 0.36 -5.77 0.00 0.00 -0.02 0.00 0.00 35.03 29.60 3gqz n LYS 183 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3gqz n LEU 184 N -4.88 5.59 -0.23 -0.35 4.77 -0.16 -4.80 117.00 116.93 3gqz n LEU 184 Ca 0.02 -4.53 0.14 0.00 -0.03 0.00 0.00 56.01 51.61 3gqz n LEU 184 Cb 0.55 -1.58 0.64 0.00 -2.33 0.00 0.00 43.42 40.71 3gqz n LEU 184 CO 0.67 0.91 0.91 0.59 -1.33 0.00 0.00 177.39 179.15 3gqz n ASN 185 N 5.07 0.79 -2.23 -1.43 3.02 -1.26 -3.46 115.26 115.75 3gqz n ASN 185 Ca 0.37 -1.06 -0.14 0.00 -0.03 0.00 0.00 54.58 53.73 3gqz n ASN 185 Cb 0.41 -0.01 0.04 0.00 -0.61 0.00 0.00 39.78 39.61 3gqz n ASN 185 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3gqz n HIS 186 N -0.52 2.05 -4.60 3.10 8.25 -1.26 -5.01 115.22 117.22 3gqz n HIS 186 Ca 0.18 -2.12 -0.27 0.00 -0.26 0.00 0.00 57.72 55.25 3gqz n HIS 186 Cb 0.27 -0.29 -0.17 0.00 1.12 0.00 0.00 29.99 30.92 3gqz n HIS 186 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3gqz s THR 187 N -4.15 1.40 0.02 1.59 2.01 -1.22 -3.32 115.64 111.97 3gqz s THR 187 Ca 0.42 -0.61 0.01 0.00 0.31 0.00 0.00 61.69 61.82 3gqz s THR 187 Cb 0.38 -1.27 -0.02 0.00 0.01 0.00 0.00 72.50 71.60 3gqz s THR 187 CO 0.00 0.42 -0.05 0.26 -0.69 0.00 0.00 174.62 174.56 3gqz s TRP 188 N 0.78 0.43 -0.13 4.92 0.52 0.43 -4.99 118.94 120.90 3gqz s TRP 188 Ca -0.11 -0.37 -0.09 0.00 0.02 0.00 0.00 56.10 55.54 3gqz s TRP 188 Cb -0.16 -0.27 -0.25 0.00 -1.15 0.00 0.00 33.47 31.64 3gqz s TRP 188 CO 0.02 -0.09 0.36 0.82 0.02 0.00 0.00 176.95 178.08 3gqz h ILE 189 N 4.72 0.68 -3.15 2.03 2.04 -1.85 0.26 117.51 122.24 3gqz h ILE 189 Ca -0.32 -2.33 -0.67 0.00 1.00 0.00 0.00 64.86 62.55 3gqz h ILE 189 Cb 1.20 2.48 -0.33 0.00 -0.74 0.00 0.00 36.82 39.43 3gqz h ILE 189 CO 0.44 0.82 -0.83 0.20 0.00 0.00 0.00 178.15 178.78 3gqz s ASN 190 N -7.03 3.42 -0.11 1.72 0.01 -1.26 -4.70 114.94 106.98 3gqz s ASN 190 Ca -0.23 -0.58 -0.29 0.00 -0.71 0.00 0.00 52.86 51.04 3gqz s ASN 190 Cb 0.06 -1.54 -0.05 0.00 0.41 0.00 0.00 41.25 40.14 3gqz s ASN 190 CO 0.75 -0.00 1.65 -0.69 -1.51 0.00 0.00 177.10 177.29 3gqz s VAL 191 N 1.32 3.62 0.55 1.60 1.01 -1.26 -4.98 120.40 122.26 3gqz s VAL 191 Ca 0.05 0.74 -0.18 0.00 0.00 0.00 0.00 61.98 62.59 3gqz s VAL 191 Cb -0.13 -3.53 -0.06 0.00 0.00 0.00 0.00 36.38 32.66 3gqz s VAL 191 CO -0.10 -0.13 1.06 -2.84 0.00 0.00 0.00 175.10 173.09 3gqz s PRO 192 N 4.28 3.50 0.41 2.72 0.02 -1.26 -4.90 135.00 139.77 3gqz s PRO 192 Ca 0.73 1.31 0.21 0.00 0.02 0.00 0.00 61.00 63.27 3gqz s PRO 192 Cb -0.30 -2.05 1.18 0.00 0.02 0.00 0.00 34.50 33.34 3gqz s PRO 192 CO 0.29 -0.68 1.76 -1.35 -0.33 0.00 0.00 177.00 176.69 3gqz h PRO 193 N 0.94 0.31 -0.13 5.54 0.11 -2.01 0.19 132.00 136.95 3gqz h PRO 193 Ca -0.48 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.65 3gqz h PRO 193 Cb 1.22 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 3gqz h PRO 193 CO 0.58 0.21 0.13 0.00 -0.21 0.00 0.00 178.00 178.71 3gqz h ALA 194 N 1.60 1.79 -0.01 -0.75 0.00 -2.02 -2.68 119.26 117.18 3gqz h ALA 194 Ca 0.62 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.52 3gqz h ALA 194 Cb 1.69 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.49 3gqz h ALA 194 CO -0.29 -0.20 -0.29 0.39 0.00 0.00 0.00 179.25 178.86 3gqz n GLU 195 N -3.93 1.58 -0.26 0.00 -0.58 0.04 -4.61 120.64 112.87 3gqz n GLU 195 Ca 0.00 -1.02 0.07 0.00 -0.42 0.00 0.00 57.16 55.79 3gqz n GLU 195 Cb 0.24 -1.33 0.19 0.00 -0.57 0.00 0.00 31.44 29.98 3gqz n GLU 195 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 3gqz h GLU 196 N 2.31 0.20 -0.04 3.49 3.07 -1.34 -0.51 114.58 121.76 3gqz h GLU 196 Ca 0.00 -0.01 0.01 0.00 -0.50 0.00 0.00 59.36 58.86 3gqz h GLU 196 Cb 0.64 -0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 28.50 3gqz h GLU 196 CO 0.00 0.13 0.05 1.57 -1.40 0.00 0.00 179.01 179.36 3gqz h LYS 197 N 0.20 0.00 0.00 2.33 2.10 -1.81 -0.48 116.57 118.91 3gqz h LYS 197 Ca 0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.09 3gqz h LYS 197 Cb 0.79 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.12 3gqz h LYS 197 CO -0.59 0.00 -0.66 0.09 -2.00 0.00 0.00 179.45 176.30 3gqz n ASN 198 N -3.75 0.61 -4.60 7.07 3.02 -0.22 -4.90 115.26 112.49 3gqz n ASN 198 Ca -0.02 -0.33 -0.43 0.00 -0.03 0.00 0.00 54.58 53.77 3gqz n ASN 198 Cb 0.14 0.43 -0.02 0.00 -0.61 0.00 0.00 39.78 39.72 3gqz n ASN 198 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3gqz s TYR 199 N -3.04 2.69 0.57 3.10 5.04 -0.19 -0.64 117.35 124.88 3gqz s TYR 199 Ca 0.09 0.69 -0.20 0.00 -2.44 0.00 0.00 57.07 55.20 3gqz s TYR 199 Cb 0.17 -4.42 -0.04 0.00 0.35 0.00 0.00 41.96 38.02 3gqz s TYR 199 CO 0.74 -1.49 1.29 0.00 -1.34 0.00 0.00 175.55 174.76 3gqz s ALA 200 N 4.77 2.66 0.17 3.97 0.00 -0.62 -4.92 121.76 127.79 3gqz s ALA 200 Ca 0.51 1.20 -0.24 0.00 0.00 0.00 0.00 51.96 53.43 3gqz s ALA 200 Cb -0.09 -3.52 -0.08 0.00 0.00 0.00 0.00 23.12 19.43 3gqz s ALA 200 CO 0.32 -1.32 0.76 -1.58 0.00 0.00 0.00 175.76 173.94 3gqz s TRP 201 N -1.41 3.86 0.48 0.00 0.52 -0.15 -4.93 118.94 117.31 3gqz s TRP 201 Ca 0.75 1.58 -0.10 0.00 0.02 0.00 0.00 56.10 58.34 3gqz s TRP 201 Cb -0.37 -2.73 -0.06 0.00 -1.15 0.00 0.00 33.47 29.17 3gqz s TRP 201 CO 0.41 0.48 0.85 0.20 0.02 0.00 0.00 176.95 178.92 3gqz s GLY 202 N -1.24 1.81 -0.10 0.98 0.00 -0.65 -4.82 107.32 103.29 3gqz s GLY 202 Ca 0.37 -0.19 0.01 0.00 0.00 0.00 0.00 44.72 44.91 3gqz s GLY 202 CO 0.25 0.02 -0.11 -0.19 0.00 0.00 0.00 173.10 173.07 3gqz s TYR 203 N -2.63 1.68 -0.13 1.90 2.02 -0.50 -0.43 117.35 119.26 3gqz s TYR 203 Ca 0.52 -0.79 -0.02 0.00 -0.37 0.00 0.00 57.07 56.41 3gqz s TYR 203 Cb -0.10 -1.28 0.04 0.00 -0.40 0.00 0.00 41.96 40.21 3gqz s TYR 203 CO 0.38 -0.47 0.00 0.50 -1.57 0.00 0.00 175.55 174.40 3gqz s ARG 204 N 1.25 0.79 -1.52 -0.62 3.52 -0.42 -4.41 118.95 117.54 3gqz s ARG 204 Ca -0.03 -0.17 -0.13 0.00 -0.13 0.00 0.00 55.73 55.28 3gqz s ARG 204 Cb -0.14 -1.52 0.08 0.00 -1.56 0.00 0.00 34.95 31.82 3gqz s ARG 204 CO -0.04 -0.43 0.95 0.39 -0.81 0.00 0.00 175.30 175.36 3gqz n GLU 205 N 5.07 -5.37 -0.58 5.12 1.02 -1.26 -1.79 120.64 122.85 3gqz n GLU 205 Ca -0.09 0.59 0.00 0.00 -0.02 0.00 0.00 57.16 57.64 3gqz n GLU 205 Cb 0.49 -5.44 0.00 0.00 -0.02 0.00 0.00 31.44 26.47 3gqz n GLU 205 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gqz n GLY 206 N -1.68 1.74 3.87 0.62 0.00 -1.26 -5.02 105.19 103.45 3gqz n GLY 206 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 3gqz n GLY 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gqz s LYS 207 N -0.04 3.66 -0.12 1.61 -0.14 -0.74 -5.06 119.74 118.92 3gqz s LYS 207 Ca 0.00 0.09 -0.30 0.00 -1.36 0.00 0.00 55.97 54.40 3gqz s LYS 207 Cb 0.00 -3.14 -0.01 0.00 -1.68 0.00 0.00 37.83 32.99 3gqz s LYS 207 CO 0.00 0.69 1.06 0.00 -0.76 0.00 0.00 175.35 176.34 3gqz s ALA 208 N -1.17 3.48 0.02 5.17 0.00 -1.26 -1.31 121.76 126.70 3gqz s ALA 208 Ca 0.23 0.40 0.01 0.00 0.00 0.00 0.00 51.96 52.60 3gqz s ALA 208 Cb -0.14 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 19.49 3gqz s ALA 208 CO 0.12 -0.74 -0.04 0.14 0.00 0.00 0.00 175.76 175.25 3gqz s VAL 209 N 2.31 0.21 0.23 0.00 -7.23 0.43 -4.94 120.40 111.41 3gqz s VAL 209 Ca 0.49 -0.69 0.11 0.00 -1.81 0.00 0.00 61.98 60.08 3gqz s VAL 209 Cb -0.19 -0.29 -0.05 0.00 0.56 0.00 0.00 36.38 36.41 3gqz s VAL 209 CO 0.17 -0.31 -0.14 -1.00 -0.31 0.00 0.00 175.10 173.51 3gqz s HIS 210 N -1.00 2.47 0.33 2.82 3.76 -1.26 -1.64 115.29 120.76 3gqz s HIS 210 Ca -0.10 -0.28 -0.29 0.00 -0.15 0.00 0.00 55.06 54.24 3gqz s HIS 210 Cb -0.07 -1.15 -0.12 0.00 1.11 0.00 0.00 32.58 32.36 3gqz s HIS 210 CO -0.00 0.59 1.52 1.55 -0.85 0.00 0.00 174.74 177.55 3gqz n VAL 211 N -0.30 1.49 -2.93 -0.90 3.14 -1.26 -4.99 118.33 112.59 3gqz n VAL 211 Ca -0.09 -0.37 -0.36 0.00 -2.96 0.00 0.00 64.34 60.56 3gqz n VAL 211 Cb 0.58 -1.91 -0.06 0.00 -1.06 0.00 0.00 33.84 31.38 3gqz n VAL 211 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 3gqz s SER 212 N 0.17 7.17 0.59 6.55 0.01 -1.26 -5.05 113.70 121.88 3gqz s SER 212 Ca 0.59 1.63 -0.19 0.00 1.31 0.00 0.00 55.95 59.29 3gqz s SER 212 Cb -0.50 -2.50 -0.03 0.00 0.21 0.00 0.00 66.02 63.19 3gqz s SER 212 CO 0.56 -0.06 1.26 -2.84 0.41 0.00 0.00 173.24 172.56 3gqz s PRO 213 N -2.17 2.93 0.20 12.44 0.02 -1.26 -5.04 135.00 142.13 3gqz s PRO 213 Ca 0.49 1.96 -0.22 0.00 0.02 0.00 0.00 61.00 63.25 3gqz s PRO 213 Cb -0.17 -1.99 0.05 0.00 0.02 0.00 0.00 34.50 32.41 3gqz s PRO 213 CO 0.21 -1.27 0.68 0.20 -0.33 0.00 0.00 177.00 176.49 3gqz s GLY 214 N -1.41 -0.37 0.28 0.52 0.00 -1.26 -5.08 107.32 100.00 3gqz s GLY 214 Ca 0.77 0.16 -0.30 0.00 0.00 0.00 0.00 44.72 45.35 3gqz s GLY 214 CO 0.38 0.06 1.46 0.00 0.00 0.00 0.00 173.10 174.99 3gqz s ALA 215 N -3.78 3.63 -1.34 3.20 0.00 -1.26 -2.55 121.76 119.66 3gqz s ALA 215 Ca 0.06 1.40 0.00 0.00 0.00 0.00 0.00 51.96 53.41 3gqz s ALA 215 Cb -0.03 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.52 3gqz s ALA 215 CO -0.04 -0.81 0.00 1.28 0.00 0.00 0.00 175.76 176.19 3gqz n LEU 216 N 1.97 -1.46 -0.14 0.00 4.77 -1.26 -4.81 117.00 116.07 3gqz n LEU 216 Ca 0.06 0.11 -0.12 0.00 -0.03 0.00 0.00 56.01 56.03 3gqz n LEU 216 Cb 0.40 -2.46 -0.02 0.00 -2.33 0.00 0.00 43.42 39.01 3gqz n LEU 216 CO 0.61 -0.17 0.64 -2.24 -1.33 0.00 0.00 177.39 174.91 3gqz h ASP 217 N 0.00 0.91 -0.59 -1.43 2.03 -1.91 -3.17 116.42 112.27 3gqz h ASP 217 Ca -0.37 -0.41 0.06 0.00 -0.73 0.00 0.00 57.03 55.58 3gqz h ASP 217 Cb 1.27 -0.25 -0.05 0.00 -0.83 0.00 0.00 39.33 39.47 3gqz h ASP 217 CO 0.44 1.13 0.29 0.00 -1.03 0.00 0.00 179.24 180.07 3gqz h ALA 218 N 0.82 0.78 0.00 4.15 0.00 -1.89 -0.42 119.26 122.69 3gqz h ALA 218 Ca 0.09 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3gqz h ALA 218 Cb 0.80 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 3gqz h ALA 218 CO 0.07 -0.06 -0.08 0.93 0.00 0.00 0.00 179.25 180.10 3gqz h GLU 219 N 0.55 0.00 0.00 0.00 3.07 -1.89 -3.28 114.58 113.03 3gqz h GLU 219 Ca 0.27 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 59.03 3gqz h GLU 219 Cb 0.21 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.10 3gqz h GLU 219 CO -0.20 0.08 -1.37 0.00 -1.40 0.00 0.00 179.01 176.12 3gqz n ALA 220 N -2.14 1.86 -2.29 3.43 0.00 -1.00 -4.54 120.51 115.84 3gqz n ALA 220 Ca 0.01 -0.30 -0.04 0.00 0.00 0.00 0.00 53.44 53.11 3gqz n ALA 220 Cb 0.37 0.27 0.03 0.00 0.00 0.00 0.00 19.45 20.12 3gqz n ALA 220 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 3gqz n TYR 221 N -2.52 -0.88 0.42 0.00 0.18 -0.28 -4.12 117.16 109.97 3gqz n TYR 221 Ca -0.11 -0.93 0.05 0.00 1.88 0.00 0.00 57.90 58.79 3gqz n TYR 221 Cb 0.64 0.94 0.01 0.00 -0.38 0.00 0.00 39.34 40.55 3gqz n TYR 221 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3gqz n GLY 222 N -0.66 -0.22 3.77 -7.48 0.00 -0.55 -4.28 105.19 95.77 3gqz n GLY 222 Ca -0.19 -0.28 -0.39 0.00 0.00 0.00 0.00 46.02 45.16 3gqz n GLY 222 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gqz s VAL 223 N -1.22 4.62 -0.03 1.61 1.01 -1.26 -4.46 120.40 120.67 3gqz s VAL 223 Ca 0.09 1.52 0.07 0.00 0.00 0.00 0.00 61.98 63.65 3gqz s VAL 223 Cb 0.08 -4.05 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 3gqz s VAL 223 CO 0.22 0.47 -0.23 -0.54 0.00 0.00 0.00 175.10 175.02 3gqz s LYS 224 N -0.70 2.27 0.16 2.72 3.01 0.93 -1.57 119.74 126.56 3gqz s LYS 224 Ca 0.34 -0.87 -0.15 0.00 -1.01 0.00 0.00 55.97 54.28 3gqz s LYS 224 Cb -0.21 -2.14 0.03 0.00 -1.01 0.00 0.00 37.83 34.49 3gqz s LYS 224 CO 0.23 0.55 0.43 0.45 0.51 0.00 0.00 175.35 177.51 3gqz s SER 225 N -0.57 -0.20 0.50 2.83 0.15 -0.58 -0.43 113.70 115.41 3gqz s SER 225 Ca 0.08 -0.47 -0.00 0.00 0.70 0.00 0.00 55.95 56.26 3gqz s SER 225 Cb -0.11 0.51 0.01 0.00 -1.71 0.00 0.00 66.02 64.72 3gqz s SER 225 CO -0.00 -0.94 0.74 0.42 1.20 0.00 0.00 173.24 174.66 3gqz s THR 226 N -3.86 3.49 0.32 6.45 -4.23 -1.21 -1.16 115.64 115.45 3gqz s THR 226 Ca 0.08 -0.49 0.02 0.00 -1.18 0.00 0.00 61.69 60.11 3gqz s THR 226 Cb 0.01 -3.31 0.17 0.00 1.34 0.00 0.00 72.50 70.71 3gqz s THR 226 CO -0.07 -0.23 1.87 -0.29 -0.54 0.00 0.00 174.62 175.36 3gqz h ILE 227 N 0.21 1.20 -0.44 2.99 6.09 -1.72 -1.81 117.51 124.03 3gqz h ILE 227 Ca -0.45 -0.74 -0.10 0.00 -1.37 0.00 0.00 64.86 62.20 3gqz h ILE 227 Cb 1.27 0.79 -0.01 0.00 0.47 0.00 0.00 36.82 39.33 3gqz h ILE 227 CO 0.56 0.27 -0.11 -0.33 -3.07 0.00 0.00 178.15 175.47 3gqz h GLU 228 N 0.63 0.85 -0.45 2.19 5.08 -1.95 -0.77 114.58 120.16 3gqz h GLU 228 Ca 0.14 -0.33 -0.11 0.00 -1.00 0.00 0.00 59.36 58.06 3gqz h GLU 228 Cb 0.28 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 3gqz h GLU 228 CO 0.00 0.96 -0.16 -0.44 -1.00 0.00 0.00 179.01 178.37 3gqz h ASP 229 N 0.68 0.86 -0.16 1.42 5.19 -1.86 -2.14 116.42 120.40 3gqz h ASP 229 Ca 0.11 -0.29 -0.12 0.00 -0.62 0.00 0.00 57.03 56.11 3gqz h ASP 229 Cb 0.65 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.92 3gqz h ASP 229 CO 0.04 1.01 -0.32 0.24 -3.12 0.00 0.00 179.24 177.10 3gqz h MET 230 N 0.76 0.66 -0.64 3.56 2.86 -1.22 -0.30 114.93 120.60 3gqz h MET 230 Ca 0.11 -0.30 0.03 0.00 -2.06 0.00 0.00 59.70 57.48 3gqz h MET 230 Cb 0.68 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.29 3gqz h MET 230 CO 0.05 0.90 0.39 0.00 1.06 0.00 0.00 176.91 179.31 3gqz h ALA 231 N 1.08 0.83 -0.12 6.32 0.00 -1.01 -0.83 119.26 125.53 3gqz h ALA 231 Ca 0.06 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 3gqz h ALA 231 Cb 0.83 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3gqz h ALA 231 CO 0.07 0.14 -0.39 -0.09 0.00 0.00 0.00 179.25 178.98 3gqz h ARG 232 N 0.77 0.26 -0.37 0.00 2.43 -1.05 -0.49 114.38 115.93 3gqz h ARG 232 Ca 0.26 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.30 3gqz h ARG 232 Cb 0.03 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 3gqz h ARG 232 CO -0.11 0.62 0.18 2.35 -1.51 0.00 0.00 179.97 181.50 3gqz h TRP 233 N 0.22 0.53 -0.38 2.20 -0.00 -0.73 -1.14 115.95 116.66 3gqz h TRP 233 Ca 0.02 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 58.88 3gqz h TRP 233 Cb 0.79 -0.17 -0.02 0.00 -0.00 0.00 0.00 29.16 29.77 3gqz h TRP 233 CO 0.01 0.44 0.20 0.28 -0.00 0.00 0.00 178.44 179.38 3gqz h VAL 234 N 0.47 1.15 -0.75 2.65 2.07 -0.84 -1.76 116.25 119.23 3gqz h VAL 234 Ca 0.13 -0.39 0.09 0.00 0.82 0.00 0.00 66.70 67.35 3gqz h VAL 234 Cb 0.10 0.72 -0.07 0.00 -1.52 0.00 0.00 31.29 30.53 3gqz h VAL 234 CO -0.02 0.15 0.40 1.56 0.02 0.00 0.00 177.57 179.69 3gqz h GLN 235 N 0.48 0.66 -0.74 1.57 4.20 -0.96 0.17 115.11 120.48 3gqz h GLN 235 Ca 0.13 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.75 3gqz h GLN 235 Cb 0.07 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.66 3gqz h GLN 235 CO -0.02 0.44 0.26 0.77 -0.67 0.00 0.00 178.83 179.60 3gqz h SER 236 N 0.68 1.06 1.04 1.46 0.02 -0.92 -2.32 113.55 114.58 3gqz h SER 236 Ca 0.36 -0.20 -0.14 0.00 -0.84 0.00 0.00 61.79 60.98 3gqz h SER 236 Cb 0.35 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 3gqz h SER 236 CO -0.25 0.97 -0.64 0.78 -1.14 0.00 0.00 176.83 176.55 3gqz h ASN 237 N 1.09 0.00 -0.01 3.07 2.35 -0.70 -2.86 115.58 118.52 3gqz h ASN 237 Ca 0.24 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.84 3gqz h ASN 237 Cb 0.27 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 3gqz h ASN 237 CO -0.01 0.64 -0.48 -0.07 -1.65 0.00 0.00 177.43 175.86 3gqz h LEU 238 N 0.00 0.62 -6.01 1.61 3.38 -0.50 -3.40 115.31 111.01 3gqz h LEU 238 Ca -0.01 -0.30 -0.56 0.00 0.09 0.00 0.00 57.88 57.10 3gqz h LEU 238 Cb 1.34 -0.17 -0.39 0.00 0.09 0.00 0.00 40.66 41.52 3gqz h LEU 238 CO 0.08 1.00 -1.10 1.17 0.09 0.00 0.00 178.44 179.68 3gqz n LYS 239 N -3.99 0.71 0.27 1.13 4.81 -0.89 -4.78 118.16 115.42 3gqz n LYS 239 Ca -0.02 -3.23 0.11 0.00 -0.87 0.00 0.00 58.31 54.30 3gqz n LYS 239 Cb 0.56 -1.23 0.75 0.00 0.02 0.00 0.00 35.03 35.13 3gqz n LYS 239 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 3gqz h PRO 240 N 4.05 0.00 0.00 1.64 0.13 -1.72 -2.67 132.00 133.43 3gqz h PRO 240 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 3gqz h PRO 240 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 3gqz h PRO 240 CO 0.46 0.05 0.00 -0.07 -0.23 0.00 0.00 178.00 178.21 3gqz h LEU 241 N 0.00 0.00 -0.00 1.56 3.38 -1.91 -1.39 115.31 116.95 3gqz h LEU 241 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3gqz h LEU 241 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3gqz h LEU 241 CO 0.01 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.01 3gqz n ASP 242 N -2.58 0.02 -4.72 -0.43 9.92 -1.01 -4.80 116.55 112.96 3gqz n ASP 242 Ca 0.01 0.50 -0.41 0.00 -0.53 0.00 0.00 54.79 54.36 3gqz n ASP 242 Cb 0.22 -0.51 -0.04 0.00 -0.64 0.00 0.00 41.12 40.15 3gqz n ASP 242 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3gqz s ILE 243 N -3.00 4.80 0.07 0.53 1.01 -0.53 -4.98 121.20 119.09 3gqz s ILE 243 Ca 0.12 1.94 -0.07 0.00 0.00 0.00 0.00 60.65 62.65 3gqz s ILE 243 Cb 0.17 -4.26 -0.29 0.00 0.01 0.00 0.00 42.46 38.08 3gqz s ILE 243 CO 0.48 0.23 1.12 0.78 0.00 0.00 0.00 174.94 177.54 3gqz h ASN 244 N 6.41 0.52 -2.48 3.58 2.35 -1.87 -3.44 115.58 120.65 3gqz h ASN 244 Ca -0.42 -0.55 -0.57 0.00 -0.55 0.00 0.00 56.30 54.22 3gqz h ASN 244 Cb 1.21 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 39.40 3gqz h ASN 244 CO 0.74 1.42 1.26 -1.61 -1.65 0.00 0.00 177.43 177.60 3gqz s GLU 245 N -2.68 3.62 0.21 0.81 2.02 -1.26 -4.91 118.70 116.51 3gqz s GLU 245 Ca -0.05 1.89 -0.07 0.00 0.02 0.00 0.00 54.97 56.77 3gqz s GLU 245 Cb 0.06 -4.17 0.15 0.00 0.10 0.00 0.00 34.13 30.28 3gqz s GLU 245 CO 0.90 -1.53 1.66 0.87 0.02 0.00 0.00 175.26 177.18 3gqz h LYS 246 N 12.15 0.95 -0.05 1.61 1.79 -2.00 -1.52 116.57 129.51 3gqz h LYS 246 Ca -0.38 -0.31 -0.13 0.00 -2.18 0.00 0.00 60.65 57.65 3gqz h LYS 246 Cb 1.19 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.75 3gqz h LYS 246 CO 0.98 0.97 -0.55 1.79 -1.08 0.00 0.00 179.45 181.56 3gqz h THR 247 N 0.87 1.38 -0.16 -0.16 1.35 -1.92 -2.05 112.91 112.22 3gqz h THR 247 Ca 0.15 -1.87 -0.09 0.00 -0.55 0.00 0.00 66.41 64.04 3gqz h THR 247 Cb 0.58 1.96 -0.00 0.00 -1.73 0.00 0.00 68.15 68.95 3gqz h THR 247 CO 0.03 0.55 -0.26 0.25 -0.25 0.00 0.00 175.52 175.84 3gqz h LEU 248 N 0.11 0.50 -0.51 3.87 5.85 -1.84 0.10 115.31 123.39 3gqz h LEU 248 Ca -0.00 -0.53 0.09 0.00 0.84 0.00 0.00 57.88 58.27 3gqz h LEU 248 Cb 1.01 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.82 3gqz h LEU 248 CO 0.08 0.94 0.12 -0.61 -0.34 0.00 0.00 178.44 178.64 3gqz h GLN 249 N 0.08 0.26 -0.44 1.25 4.15 -1.24 -0.81 115.11 118.37 3gqz h GLN 249 Ca 0.01 -0.02 -0.11 0.00 0.77 0.00 0.00 58.65 59.31 3gqz h GLN 249 Cb 0.84 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.46 3gqz h GLN 249 CO 0.06 0.17 -0.15 1.96 -1.93 0.00 0.00 178.83 178.94 3gqz h GLN 250 N 0.27 0.84 -0.56 1.69 4.20 -1.33 -2.74 115.11 117.47 3gqz h GLN 250 Ca 0.26 -0.31 0.01 0.00 0.06 0.00 0.00 58.65 58.67 3gqz h GLN 250 Cb 0.34 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.03 3gqz h GLN 250 CO -0.32 0.93 0.37 0.78 -0.67 0.00 0.00 178.83 179.92 3gqz h GLY 251 N 0.96 0.79 0.98 3.46 0.00 -0.39 -0.83 103.07 108.05 3gqz h GLY 251 Ca 0.12 -0.29 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 3gqz h GLY 251 CO 0.05 0.28 0.21 -2.22 0.00 0.00 0.00 176.54 174.86 3gqz h ILE 252 N 0.75 1.12 -0.86 2.60 2.04 -1.09 -1.21 117.51 120.85 3gqz h ILE 252 Ca 0.21 -0.27 0.01 0.00 1.00 0.00 0.00 64.86 65.81 3gqz h ILE 252 Cb -0.07 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 36.63 3gqz h ILE 252 CO -0.05 0.12 0.57 1.56 0.00 0.00 0.00 178.15 180.34 3gqz h GLN 253 N 0.45 1.13 -0.34 2.37 4.20 -1.26 -2.50 115.11 119.17 3gqz h GLN 253 Ca 0.12 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.68 3gqz h GLN 253 Cb 0.00 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.51 3gqz h GLN 253 CO -0.02 0.75 -0.17 -0.07 -0.67 0.00 0.00 178.83 178.65 3gqz h LEU 254 N 1.16 0.61 -1.46 1.46 3.38 -0.85 -2.77 115.31 116.84 3gqz h LEU 254 Ca 0.32 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 3gqz h LEU 254 Cb -0.12 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 3gqz h LEU 254 CO -0.07 0.79 -0.27 0.00 0.09 0.00 0.00 178.44 178.99 3gqz h ALA 255 N 1.26 1.33 -0.30 1.53 0.00 -0.80 -2.74 119.26 119.54 3gqz h ALA 255 Ca 0.09 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3gqz h ALA 255 Cb 0.61 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3gqz h ALA 255 CO 0.04 0.33 0.00 1.04 0.00 0.00 0.00 179.25 180.66 3gqz n GLN 256 N -3.89 2.25 -1.92 0.00 6.02 -1.01 -0.78 117.38 118.05 3gqz n GLN 256 Ca -0.02 -1.88 -0.33 0.00 -0.01 0.00 0.00 57.00 54.77 3gqz n GLN 256 Cb 0.35 -1.47 0.03 0.00 1.02 0.00 0.00 30.24 30.16 3gqz n GLN 256 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 3gqz s SER 257 N -1.53 5.51 -0.38 1.08 0.01 -1.03 -4.19 113.70 113.17 3gqz s SER 257 Ca 0.36 1.88 -0.13 0.00 1.31 0.00 0.00 55.95 59.36 3gqz s SER 257 Cb 0.21 -2.54 0.01 0.00 0.21 0.00 0.00 66.02 63.91 3gqz s SER 257 CO 0.30 -1.35 0.26 -0.13 0.41 0.00 0.00 173.24 172.73 3gqz s ARG 258 N -4.13 3.09 -0.22 12.44 0.52 -0.48 -4.06 118.95 126.11 3gqz s ARG 258 Ca 0.65 -0.92 0.11 0.00 -0.52 0.00 0.00 55.73 55.04 3gqz s ARG 258 Cb -0.18 -3.87 -0.21 0.00 0.52 0.00 0.00 34.95 31.21 3gqz s ARG 258 CO 0.39 -0.65 -0.05 0.66 0.02 0.00 0.00 175.30 175.67 3gqz n TYR 259 N 5.11 0.02 -3.99 -0.53 4.01 -0.65 -2.89 117.16 118.25 3gqz n TYR 259 Ca -0.12 0.01 -0.09 0.00 -0.16 0.00 0.00 57.90 57.54 3gqz n TYR 259 Cb 0.48 -1.00 -0.10 0.00 -0.31 0.00 0.00 39.34 38.40 3gqz n TYR 259 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 3gqz s TRP 260 N -2.51 0.30 -0.06 -0.72 0.52 -1.24 -1.78 118.94 113.45 3gqz s TRP 260 Ca -0.21 -0.64 0.04 0.00 0.02 0.00 0.00 56.10 55.31 3gqz s TRP 260 Cb 0.07 -0.22 0.00 0.00 -1.15 0.00 0.00 33.47 32.18 3gqz s TRP 260 CO 0.73 -0.29 -0.17 -1.14 0.02 0.00 0.00 176.95 176.09 3gqz s GLN 261 N -2.39 2.04 -0.15 4.98 0.74 -0.79 -1.39 119.66 122.68 3gqz s GLN 261 Ca -0.07 -0.61 -0.01 0.00 0.05 0.00 0.00 55.36 54.72 3gqz s GLN 261 Cb -0.03 -1.68 0.04 0.00 1.10 0.00 0.00 33.01 32.44 3gqz s GLN 261 CO -0.04 0.17 -0.05 0.95 -0.55 0.00 0.00 175.29 175.77 3gqz s THR 262 N 0.28 1.07 0.00 -0.34 -4.23 -0.07 -1.45 115.64 110.88 3gqz s THR 262 Ca -0.10 -0.55 0.00 0.00 -1.18 0.00 0.00 61.69 59.86 3gqz s THR 262 Cb -0.14 -1.22 0.00 0.00 1.34 0.00 0.00 72.50 72.48 3gqz s THR 262 CO 0.04 0.17 0.00 0.61 -0.54 0.00 0.00 174.62 174.90 3gqz n GLY 263 N 4.90 3.32 1.22 3.99 0.00 -1.26 -1.25 105.19 116.10 3gqz n GLY 263 Ca -0.12 0.25 0.12 0.00 0.00 0.00 0.00 46.02 46.26 3gqz n GLY 263 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3gqz n ASP 264 N 10.05 3.59 -4.45 1.61 8.00 -1.26 -4.97 116.55 129.12 3gqz n ASP 264 Ca 0.00 -1.99 -0.33 0.00 0.71 0.00 0.00 54.79 53.18 3gqz n ASP 264 Cb 0.00 -0.36 -0.13 0.00 -0.02 0.00 0.00 41.12 40.61 3gqz n ASP 264 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 3gqz s MET 265 N -1.28 3.42 -0.10 -1.24 1.75 -0.38 -4.41 119.30 117.06 3gqz s MET 265 Ca 0.43 -0.60 0.01 0.00 -1.25 0.00 0.00 55.69 54.29 3gqz s MET 265 Cb 0.24 -2.74 -0.02 0.00 2.84 0.00 0.00 34.83 35.15 3gqz s MET 265 CO 0.32 0.29 -0.15 0.71 -0.65 0.00 0.00 175.02 175.54 3gqz s TYR 266 N 0.20 2.75 -0.21 4.11 2.02 0.63 -0.90 117.35 125.96 3gqz s TYR 266 Ca -0.05 -0.54 -0.19 0.00 -0.37 0.00 0.00 57.07 55.92 3gqz s TYR 266 Cb -0.14 -1.77 -0.03 0.00 -0.40 0.00 0.00 41.96 39.62 3gqz s TYR 266 CO 0.04 -0.12 0.57 -1.14 -1.57 0.00 0.00 175.55 173.33 3gqz s GLN 267 N 0.04 4.18 0.00 -0.62 2.00 -0.49 -1.00 119.66 123.77 3gqz s GLN 267 Ca -0.05 0.50 0.00 0.00 -2.00 0.00 0.00 55.36 53.80 3gqz s GLN 267 Cb -0.15 -3.58 0.00 0.00 0.80 0.00 0.00 33.01 30.08 3gqz s GLN 267 CO 0.04 -0.23 0.00 0.41 -0.50 0.00 0.00 175.29 175.02 3gqz n GLY 268 N 3.92 2.03 3.38 2.59 0.00 0.06 -1.63 105.19 115.53 3gqz n GLY 268 Ca -0.03 -2.04 -0.45 0.00 0.00 0.00 0.00 46.02 43.51 3gqz n GLY 268 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gqz s LEU 269 N 0.00 5.45 0.00 0.99 1.43 0.04 -4.59 118.68 122.00 3gqz s LEU 269 Ca 0.00 -1.55 0.00 0.00 -1.03 0.00 0.00 54.13 51.55 3gqz s LEU 269 Cb 0.00 -2.30 0.00 0.00 0.03 0.00 0.00 46.19 43.92 3gqz s LEU 269 CO 0.00 -1.08 0.00 0.61 0.23 0.00 0.00 176.35 176.11 3gqz n GLY 270 N 5.21 1.85 3.75 -3.19 0.00 -1.26 -4.25 105.19 107.30 3gqz n GLY 270 Ca -0.06 -0.13 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 3gqz n GLY 270 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3gqz s TRP 271 N 0.00 2.28 0.10 1.61 0.52 -1.26 -4.67 118.94 117.53 3gqz s TRP 271 Ca 0.00 1.51 0.09 0.00 0.02 0.00 0.00 56.10 57.72 3gqz s TRP 271 Cb 0.00 -3.54 -0.04 0.00 -1.15 0.00 0.00 33.47 28.74 3gqz s TRP 271 CO 0.00 -2.44 -0.22 -1.21 0.02 0.00 0.00 176.95 173.10 3gqz s GLU 272 N -3.38 1.21 0.03 4.98 2.02 -0.82 -0.76 118.70 121.98 3gqz s GLU 272 Ca 0.79 -1.18 0.01 0.00 0.02 0.00 0.00 54.97 54.60 3gqz s GLU 272 Cb -0.32 -1.51 -0.02 0.00 0.10 0.00 0.00 34.13 32.38 3gqz s GLU 272 CO 0.36 0.36 -0.05 -1.64 0.02 0.00 0.00 175.26 174.30 3gqz s MET 273 N -1.88 0.39 0.08 1.61 -1.94 -0.17 -0.75 119.30 116.64 3gqz s MET 273 Ca 0.08 -0.59 0.05 0.00 -1.71 0.00 0.00 55.69 53.52 3gqz s MET 273 Cb -0.10 -0.11 -0.03 0.00 2.01 0.00 0.00 34.83 36.60 3gqz s MET 273 CO 0.04 0.01 -0.14 -0.51 -0.01 0.00 0.00 175.02 174.42 3gqz s LEU 274 N -1.28 2.31 0.31 -0.03 1.02 -0.32 -0.26 118.68 120.42 3gqz s LEU 274 Ca -0.11 -0.66 -0.29 0.00 0.02 0.00 0.00 54.13 53.09 3gqz s LEU 274 Cb -0.09 -0.49 -0.11 0.00 0.02 0.00 0.00 46.19 45.53 3gqz s LEU 274 CO -0.00 -0.11 1.51 -1.81 0.02 0.00 0.00 176.35 175.95 3gqz s ASP 275 N -1.91 6.46 -0.12 2.29 1.01 -1.26 -0.20 116.67 122.94 3gqz s ASP 275 Ca -0.00 2.89 -0.09 0.00 0.71 0.00 0.00 52.55 56.06 3gqz s ASP 275 Cb -0.09 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.16 3gqz s ASP 275 CO 0.02 -0.82 0.19 0.86 0.21 0.00 0.00 175.17 175.63 3gqz s TRP 276 N -0.41 3.57 0.43 4.23 -0.11 -0.44 -3.65 118.94 122.57 3gqz s TRP 276 Ca 0.58 0.58 -0.25 0.00 1.22 0.00 0.00 56.10 58.23 3gqz s TRP 276 Cb -0.45 -2.07 -0.08 0.00 -1.50 0.00 0.00 33.47 29.37 3gqz s TRP 276 CO 0.52 0.60 1.23 -1.25 -4.62 0.00 0.00 176.95 173.42 3gqz s PRO 277 N -0.66 3.86 -0.14 5.86 0.04 -1.26 -4.75 135.00 137.95 3gqz s PRO 277 Ca 0.15 1.96 -0.06 0.00 0.04 0.00 0.00 61.00 63.09 3gqz s PRO 277 Cb -0.13 -2.59 -0.04 0.00 0.04 0.00 0.00 34.50 31.78 3gqz s PRO 277 CO 0.04 -0.52 0.08 0.08 0.04 0.00 0.00 177.00 176.73 3gqz s VAL 278 N -1.39 4.97 -0.43 -0.36 1.01 -1.24 -5.06 120.40 117.91 3gqz s VAL 278 Ca 0.60 0.02 -0.25 0.00 0.00 0.00 0.00 61.98 62.35 3gqz s VAL 278 Cb -0.33 -3.18 0.02 0.00 0.00 0.00 0.00 36.38 32.89 3gqz s VAL 278 CO 0.42 0.55 0.89 0.21 0.00 0.00 0.00 175.10 177.17 3gqz s ASN 279 N -0.44 6.53 0.00 3.32 3.84 -1.26 -4.95 114.94 121.98 3gqz s ASN 279 Ca 0.10 0.22 0.21 0.00 0.21 0.00 0.00 52.86 53.60 3gqz s ASN 279 Cb -0.12 -2.44 1.19 0.00 -0.55 0.00 0.00 41.25 39.34 3gqz s ASN 279 CO 0.02 -0.95 1.65 -0.81 -2.79 0.00 0.00 177.10 174.22 3gqz n PRO 280 N 6.92 0.55 -0.18 0.43 -0.04 -1.26 -3.91 135.00 137.50 3gqz n PRO 280 Ca 0.05 0.03 -0.05 0.00 -0.04 0.00 0.00 63.50 63.49 3gqz n PRO 280 Cb 0.48 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.49 3gqz n PRO 280 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 3gqz h ASP 281 N 0.00 0.53 -0.13 3.54 3.58 -1.99 -1.67 116.42 120.28 3gqz h ASP 281 Ca 0.00 0.00 -0.06 0.00 0.42 0.00 0.00 57.03 57.39 3gqz h ASP 281 Cb 0.06 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 40.99 3gqz h ASP 281 CO 0.00 0.37 -0.09 0.77 -2.88 0.00 0.00 179.24 177.42 3gqz h SER 282 N 0.65 0.43 0.47 2.28 4.64 -1.92 0.24 113.55 120.33 3gqz h SER 282 Ca 0.22 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 3gqz h SER 282 Cb 0.02 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 3gqz h SER 282 CO -0.10 0.56 -0.40 2.30 -0.87 0.00 0.00 176.83 178.32 3gqz n ILE 283 N -4.24 0.00 -0.08 0.95 -5.35 -1.02 -1.11 119.36 108.50 3gqz n ILE 283 Ca 0.01 -0.03 -0.18 0.00 -0.27 0.00 0.00 62.75 62.28 3gqz n ILE 283 Cb 0.29 0.22 -0.06 0.00 -1.74 0.00 0.00 39.64 38.35 3gqz n ILE 283 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 3gqz n ILE 284 N -1.30 1.02 -0.03 7.28 5.41 -0.66 -4.20 119.36 126.88 3gqz n ILE 284 Ca 0.07 -0.20 -0.02 0.00 1.00 0.00 0.00 62.75 63.61 3gqz n ILE 284 Cb 0.34 -1.78 -0.07 0.00 -0.71 0.00 0.00 39.64 37.42 3gqz n ILE 284 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3gqz n ASN 285 N -3.83 2.87 -0.43 4.38 3.02 0.72 -4.70 115.26 117.29 3gqz n ASN 285 Ca -0.32 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.23 3gqz n ASN 285 Cb 0.70 0.89 0.00 0.00 -0.61 0.00 0.00 39.78 40.77 3gqz n ASN 285 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gqz n GLY 286 N 2.34 1.76 0.29 7.41 0.00 -0.37 -4.89 105.19 111.74 3gqz n GLY 286 Ca -0.11 -1.84 0.19 0.00 0.00 0.00 0.00 46.02 44.27 3gqz n GLY 286 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3gqz h SER 287 N 0.00 0.00 -0.20 1.61 4.64 -1.87 -2.52 113.55 115.22 3gqz h SER 287 Ca 0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 3gqz h SER 287 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 3gqz h SER 287 CO 0.00 0.00 -0.12 0.47 -0.87 0.00 0.00 176.83 176.31 3gqz n ASP 288 N -2.96 2.63 -0.20 4.97 8.00 -0.27 -4.65 116.55 124.07 3gqz n ASP 288 Ca -0.01 -3.50 0.15 0.00 0.71 0.00 0.00 54.79 52.14 3gqz n ASP 288 Cb 0.16 -0.56 0.73 0.00 -0.02 0.00 0.00 41.12 41.42 3gqz n ASP 288 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3gqz n ASN 289 N -1.05 0.66 0.00 -2.24 6.94 -0.95 -4.45 115.26 114.17 3gqz n ASN 289 Ca 0.25 -1.12 0.00 0.00 -0.02 0.00 0.00 54.58 53.69 3gqz n ASN 289 Cb 0.86 -0.01 0.00 0.00 -2.36 0.00 0.00 39.78 38.27 3gqz n ASN 289 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3gqz n LYS 290 N -0.54 -0.46 -0.02 -3.83 4.76 -1.26 -4.23 118.16 112.59 3gqz n LYS 290 Ca 0.20 0.11 -0.13 0.00 -2.87 0.00 0.00 58.31 55.63 3gqz n LYS 290 Cb 0.23 -3.55 -0.09 0.00 -1.84 0.00 0.00 35.03 29.78 3gqz n LYS 290 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 3gqz h ILE 291 N 0.00 1.36 -3.46 -0.18 1.08 -1.93 -3.45 117.51 110.94 3gqz h ILE 291 Ca 0.00 -1.09 -0.53 0.00 -0.39 0.00 0.00 64.86 62.85 3gqz h ILE 291 Cb 0.23 2.06 -0.03 0.00 -3.07 0.00 0.00 36.82 36.00 3gqz h ILE 291 CO 0.00 0.29 -0.09 0.00 -0.69 0.00 0.00 178.15 177.66 3gqz s ALA 292 N -4.39 3.54 -0.55 1.87 0.00 -1.26 -5.03 121.76 115.94 3gqz s ALA 292 Ca -0.16 -0.23 -0.28 0.00 0.00 0.00 0.00 51.96 51.30 3gqz s ALA 292 Cb 0.02 -2.48 0.03 0.00 0.00 0.00 0.00 23.12 20.70 3gqz s ALA 292 CO 0.68 0.49 1.16 -1.17 0.00 0.00 0.00 175.76 176.92 3gqz s LEU 293 N -2.78 3.55 -0.14 0.00 2.96 -1.26 -5.01 118.68 116.00 3gqz s LEU 293 Ca 0.48 0.19 0.01 0.00 -0.22 0.00 0.00 54.13 54.59 3gqz s LEU 293 Cb -0.11 -3.26 -0.00 0.00 0.50 0.00 0.00 46.19 43.31 3gqz s LEU 293 CO 0.21 -1.39 -0.17 0.00 -1.32 0.00 0.00 176.35 173.67 3gqz s ALA 294 N 4.74 2.42 -0.41 5.97 0.00 -1.26 -5.08 121.76 128.14 3gqz s ALA 294 Ca 0.44 -1.02 -0.22 0.00 0.00 0.00 0.00 51.96 51.16 3gqz s ALA 294 Cb -0.08 -1.12 0.02 0.00 0.00 0.00 0.00 23.12 21.94 3gqz s ALA 294 CO 0.27 0.06 0.74 0.00 0.00 0.00 0.00 175.76 176.83 3gqz s ALA 295 N 0.67 3.36 -0.12 0.00 0.00 -1.26 -4.49 121.76 119.91 3gqz s ALA 295 Ca -0.09 -0.93 0.03 0.00 0.00 0.00 0.00 51.96 50.98 3gqz s ALA 295 Cb -0.16 -3.37 0.01 0.00 0.00 0.00 0.00 23.12 19.60 3gqz s ALA 295 CO 0.02 -1.70 -0.21 1.03 0.00 0.00 0.00 175.76 174.90 3gqz s ARG 296 N 3.08 2.84 0.36 0.00 1.81 -0.68 -4.96 118.95 121.41 3gqz s ARG 296 Ca 0.28 -0.79 -0.28 0.00 -1.72 0.00 0.00 55.73 53.21 3gqz s ARG 296 Cb -0.13 -2.26 -0.11 0.00 -0.45 0.00 0.00 34.95 32.00 3gqz s ARG 296 CO 0.19 0.03 1.48 -2.14 -0.68 0.00 0.00 175.30 174.19 3gqz s PRO 297 N 0.70 4.14 0.16 3.54 0.02 -1.26 -0.40 135.00 141.90 3gqz s PRO 297 Ca -0.11 2.53 0.10 0.00 0.02 0.00 0.00 61.00 63.54 3gqz s PRO 297 Cb -0.16 -2.99 -0.04 0.00 0.02 0.00 0.00 34.50 31.33 3gqz s PRO 297 CO 0.01 -0.50 -0.19 0.14 -0.33 0.00 0.00 177.00 176.13 3gqz s VAL 298 N -0.97 2.68 -0.25 3.83 -7.23 -0.54 -4.71 120.40 113.21 3gqz s VAL 298 Ca 0.54 -1.75 -0.05 0.00 -1.81 0.00 0.00 61.98 58.90 3gqz s VAL 298 Cb -0.46 -2.27 -0.01 0.00 0.56 0.00 0.00 36.38 34.21 3gqz s VAL 298 CO 0.60 -0.03 0.02 -0.75 -0.31 0.00 0.00 175.10 174.63 3gqz s LYS 299 N -2.48 3.34 0.29 4.82 2.20 -0.53 -4.82 119.74 122.56 3gqz s LYS 299 Ca 0.20 -0.67 -0.30 0.00 -0.36 0.00 0.00 55.97 54.84 3gqz s LYS 299 Cb -0.09 -3.18 -0.12 0.00 -1.51 0.00 0.00 37.83 32.92 3gqz s LYS 299 CO 0.11 -0.27 1.53 0.00 -0.36 0.00 0.00 175.35 176.35 3gqz n ALA 300 N 4.84 2.13 -3.19 3.13 0.00 -1.26 -1.88 120.51 124.27 3gqz n ALA 300 Ca -0.17 0.38 -0.45 0.00 0.00 0.00 0.00 53.44 53.20 3gqz n ALA 300 Cb 0.50 -2.40 -0.05 0.00 0.00 0.00 0.00 19.45 17.50 3gqz n ALA 300 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3gqz s ILE 301 N -0.13 5.02 -0.31 0.00 -1.09 -0.73 -4.91 121.20 119.04 3gqz s ILE 301 Ca 0.64 -1.22 -0.02 0.00 -2.23 0.00 0.00 60.65 57.81 3gqz s ILE 301 Cb -0.54 -4.40 0.05 0.00 -1.58 0.00 0.00 42.46 35.99 3gqz s ILE 301 CO 0.50 -0.98 0.02 -0.89 -1.23 0.00 0.00 174.94 172.37 3gqz s THR 302 N 2.14 3.11 0.90 2.92 2.01 -1.26 -1.04 115.64 124.43 3gqz s THR 302 Ca 0.07 -1.39 -0.14 0.00 0.31 0.00 0.00 61.69 60.55 3gqz s THR 302 Cb -0.27 -2.81 0.16 0.00 0.01 0.00 0.00 72.50 69.60 3gqz s THR 302 CO 0.05 -0.15 1.26 -2.16 -0.69 0.00 0.00 174.62 172.93 3gqz s PRO 303 N 1.27 1.04 0.20 4.92 0.04 -1.26 -5.07 135.00 136.14 3gqz s PRO 303 Ca -0.04 -0.35 -0.32 0.00 0.04 0.00 0.00 61.00 60.33 3gqz s PRO 303 Cb -0.20 -1.91 -0.14 0.00 0.04 0.00 0.00 34.50 32.29 3gqz s PRO 303 CO -0.01 -2.13 1.50 -2.30 0.04 0.00 0.00 177.00 174.10 3gqz n PRO 304 N -3.58 2.13 -2.10 0.56 -0.02 -0.20 -4.96 135.00 126.83 3gqz n PRO 304 Ca 0.13 0.76 -0.42 0.00 -2.02 0.00 0.00 63.50 61.96 3gqz n PRO 304 Cb 0.60 -2.48 -0.03 0.00 -0.02 0.00 0.00 33.50 31.57 3gqz n PRO 304 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3gqz s THR 305 N 0.43 3.07 0.84 3.45 2.01 -1.14 -4.83 115.64 119.47 3gqz s THR 305 Ca 0.73 0.78 -0.13 0.00 0.31 0.00 0.00 61.69 63.38 3gqz s THR 305 Cb -0.66 -3.50 0.07 0.00 0.01 0.00 0.00 72.50 68.43 3gqz s THR 305 CO 0.44 0.07 0.97 -2.65 -0.69 0.00 0.00 174.62 172.75 3gqz n PRO 306 N 3.82 -0.01 -1.68 4.92 -0.02 -1.26 -1.38 135.00 139.38 3gqz n PRO 306 Ca 0.12 0.07 -0.65 0.00 -2.02 0.00 0.00 63.50 61.02 3gqz n PRO 306 Cb 0.41 -2.25 -0.10 0.00 -0.02 0.00 0.00 33.50 31.54 3gqz n PRO 306 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gqz n ALA 307 N -3.42 -0.92 -2.62 3.55 0.00 -1.26 -4.74 120.51 111.10 3gqz n ALA 307 Ca 0.12 0.43 -0.41 0.00 0.00 0.00 0.00 53.44 53.58 3gqz n ALA 307 Cb 0.51 -2.01 -0.07 0.00 0.00 0.00 0.00 19.45 17.89 3gqz n ALA 307 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3gqz s VAL 308 N 3.52 5.00 0.22 0.00 1.01 -1.26 -4.98 120.40 123.91 3gqz s VAL 308 Ca 1.06 1.09 -0.09 0.00 0.00 0.00 0.00 61.98 64.04 3gqz s VAL 308 Cb -1.41 -3.92 0.19 0.00 0.00 0.00 0.00 36.38 31.24 3gqz s VAL 308 CO 0.77 0.03 1.89 0.03 0.00 0.00 0.00 175.10 177.82 3gqz h ARG 309 N 7.92 1.08 -3.73 2.72 2.47 -1.97 -3.21 114.38 119.67 3gqz h ARG 309 Ca -0.27 -0.07 -0.73 0.00 -1.26 0.00 0.00 59.98 57.65 3gqz h ARG 309 Cb 1.13 -0.24 -0.09 0.00 -1.65 0.00 0.00 29.97 29.11 3gqz h ARG 309 CO 0.76 0.72 2.67 0.00 0.56 0.00 0.00 179.97 184.68 3gqz n ALA 310 N -2.33 5.55 -2.70 0.04 0.00 -1.26 -0.91 120.51 118.90 3gqz n ALA 310 Ca 0.09 -4.06 -0.17 0.00 0.00 0.00 0.00 53.44 49.29 3gqz n ALA 310 Cb 0.02 -3.28 -0.12 0.00 0.00 0.00 0.00 19.45 16.07 3gqz n ALA 310 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3gqz s SER 311 N 2.10 1.55 -0.46 0.00 0.01 -1.21 -1.32 113.70 114.36 3gqz s SER 311 Ca 0.44 -0.63 -0.20 0.00 1.31 0.00 0.00 55.95 56.88 3gqz s SER 311 Cb 0.12 -0.03 0.04 0.00 0.21 0.00 0.00 66.02 66.36 3gqz s SER 311 CO -0.05 -0.11 0.62 0.86 0.41 0.00 0.00 173.24 174.97 3gqz s TRP 312 N -1.41 3.06 -0.20 2.43 -0.11 0.72 -4.08 118.94 119.35 3gqz s TRP 312 Ca -0.02 -0.25 -0.07 0.00 1.22 0.00 0.00 56.10 56.97 3gqz s TRP 312 Cb -0.09 -3.38 -0.04 0.00 -1.50 0.00 0.00 33.47 28.46 3gqz s TRP 312 CO 0.02 -0.92 0.06 0.08 -4.62 0.00 0.00 176.95 171.57 3gqz s VAL 313 N 2.72 4.61 0.14 5.86 1.01 -0.09 -1.18 120.40 133.46 3gqz s VAL 313 Ca 0.19 -0.09 -0.15 0.00 0.00 0.00 0.00 61.98 61.93 3gqz s VAL 313 Cb -0.16 -3.09 0.03 0.00 0.00 0.00 0.00 36.38 33.15 3gqz s VAL 313 CO 0.16 0.43 0.39 -1.38 0.00 0.00 0.00 175.10 174.70 3gqz s HIS 314 N 0.69 -0.09 -0.16 5.22 -3.43 0.07 -0.47 115.29 117.12 3gqz s HIS 314 Ca 0.03 -0.25 -0.13 0.00 -0.80 0.00 0.00 55.06 53.91 3gqz s HIS 314 Cb -0.13 0.22 0.05 0.00 -1.43 0.00 0.00 32.58 31.28 3gqz s HIS 314 CO 0.02 -0.73 0.42 0.21 -2.00 0.00 0.00 174.74 172.66 3gqz s LYS 315 N -3.84 0.46 0.17 -0.38 2.47 -0.42 -1.94 119.74 116.25 3gqz s LYS 315 Ca 0.06 0.66 0.04 0.00 -1.56 0.00 0.00 55.97 55.17 3gqz s LYS 315 Cb 0.02 0.15 -0.04 0.00 -1.46 0.00 0.00 37.83 36.50 3gqz s LYS 315 CO -0.09 -0.09 0.20 -0.08 0.16 0.00 0.00 175.35 175.45 3gqz s THR 316 N 0.63 4.83 0.01 3.43 -1.32 -1.26 -1.67 115.64 120.28 3gqz s THR 316 Ca -0.03 -0.95 -0.20 0.00 -1.21 0.00 0.00 61.69 59.30 3gqz s THR 316 Cb -0.05 -3.49 0.04 0.00 -1.51 0.00 0.00 72.50 67.49 3gqz s THR 316 CO -0.04 -0.13 0.44 -0.83 -2.21 0.00 0.00 174.62 171.86 3gqz s GLY 317 N -3.23 -0.31 0.03 6.08 0.00 -0.09 -3.85 107.32 105.94 3gqz s GLY 317 Ca 0.32 0.55 -0.15 0.00 0.00 0.00 0.00 44.72 45.45 3gqz s GLY 317 CO 0.26 0.28 0.32 0.00 0.00 0.00 0.00 173.10 173.96 3gqz s ALA 318 N -1.82 -0.76 0.30 3.20 0.00 -1.26 -0.08 121.76 121.35 3gqz s ALA 318 Ca -0.09 0.15 0.01 0.00 0.00 0.00 0.00 51.96 52.02 3gqz s ALA 318 Cb -0.02 0.25 -0.00 0.00 0.00 0.00 0.00 23.12 23.34 3gqz s ALA 318 CO 0.02 -0.37 0.04 0.25 0.00 0.00 0.00 175.76 175.71 3gqz n THR 319 N 0.78 0.00 -0.31 0.00 -2.24 -0.52 -3.89 114.28 108.10 3gqz n THR 319 Ca -0.19 -1.56 0.15 0.00 -2.27 0.00 0.00 64.05 60.18 3gqz n THR 319 Cb 0.58 0.42 0.40 0.00 -2.10 0.00 0.00 70.33 69.64 3gqz n THR 319 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3gqz h GLY 320 N 0.91 1.38 -0.25 3.38 0.00 -1.97 -3.12 103.07 103.41 3gqz h GLY 320 Ca -0.25 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 46.80 3gqz h GLY 320 CO 0.40 -0.02 0.00 0.61 0.00 0.00 0.00 176.54 177.53 3gqz n GLY 321 N -1.41 0.82 3.12 4.60 0.00 -1.26 -4.50 105.19 106.55 3gqz n GLY 321 Ca 0.21 -0.08 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 3gqz n GLY 321 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gqz s PHE 322 N -0.60 0.83 -0.02 1.61 0.40 -1.18 -2.07 117.98 116.94 3gqz s PHE 322 Ca 0.04 -0.64 0.01 0.00 -0.60 0.00 0.00 56.93 55.74 3gqz s PHE 322 Cb 0.02 -0.48 0.01 0.00 0.51 0.00 0.00 43.02 43.09 3gqz s PHE 322 CO 0.03 -0.08 -0.04 0.20 0.70 0.00 0.00 175.22 176.03 3gqz s GLY 323 N -2.14 0.32 0.06 4.36 0.00 -0.54 -1.44 107.32 107.93 3gqz s GLY 323 Ca -0.01 -0.07 0.01 0.00 0.00 0.00 0.00 44.72 44.65 3gqz s GLY 323 CO -0.01 0.20 -0.06 -1.35 0.00 0.00 0.00 173.10 171.87 3gqz s SER 324 N 0.48 0.84 -0.16 1.64 1.04 0.89 -0.94 113.70 117.50 3gqz s SER 324 Ca -0.05 -0.74 -0.14 0.00 0.48 0.00 0.00 55.95 55.49 3gqz s SER 324 Cb -0.09 0.08 0.04 0.00 0.10 0.00 0.00 66.02 66.15 3gqz s SER 324 CO -0.00 -0.34 0.42 -0.47 0.98 0.00 0.00 173.24 173.82 3gqz s TYR 325 N -2.41 -0.48 -0.03 5.02 5.04 -0.48 -0.91 117.35 123.09 3gqz s TYR 325 Ca -0.02 1.15 0.01 0.00 -2.44 0.00 0.00 57.07 55.78 3gqz s TYR 325 Cb -0.03 0.17 0.01 0.00 0.35 0.00 0.00 41.96 42.47 3gqz s TYR 325 CO -0.03 -0.24 -0.05 0.08 -1.34 0.00 0.00 175.55 173.97 3gqz s VAL 326 N 0.36 0.54 -0.03 3.14 1.01 -0.67 -0.62 120.40 124.14 3gqz s VAL 326 Ca -0.01 -0.17 -0.06 0.00 0.00 0.00 0.00 61.98 61.73 3gqz s VAL 326 Cb -0.04 -0.54 0.01 0.00 0.00 0.00 0.00 36.38 35.81 3gqz s VAL 326 CO -0.01 0.21 0.14 0.00 0.00 0.00 0.00 175.10 175.44 3gqz s ALA 327 N 0.60 -0.34 0.10 5.51 0.00 -0.77 -1.31 121.76 125.55 3gqz s ALA 327 Ca -0.08 0.16 -0.15 0.00 0.00 0.00 0.00 51.96 51.90 3gqz s ALA 327 Cb -0.11 -0.09 0.03 0.00 0.00 0.00 0.00 23.12 22.94 3gqz s ALA 327 CO 0.00 -0.13 0.35 -0.59 0.00 0.00 0.00 175.76 175.39 3gqz s PHE 328 N -0.59 -0.13 -0.32 0.00 -0.71 0.38 -0.42 117.98 116.19 3gqz s PHE 328 Ca -0.07 -0.17 0.01 0.00 -1.04 0.00 0.00 56.93 55.66 3gqz s PHE 328 Cb -0.04 0.17 0.10 0.00 -1.21 0.00 0.00 43.02 42.04 3gqz s PHE 328 CO 0.01 -0.64 0.09 0.42 -1.34 0.00 0.00 175.22 173.76 3gqz s ILE 329 N -3.57 1.35 0.26 -4.49 1.01 0.69 -0.91 121.20 115.54 3gqz s ILE 329 Ca 0.02 -1.74 -0.01 0.00 0.00 0.00 0.00 60.65 58.92 3gqz s ILE 329 Cb 0.02 -2.01 0.25 0.00 0.01 0.00 0.00 42.46 40.73 3gqz s ILE 329 CO -0.10 -0.66 1.75 -0.65 0.00 0.00 0.00 174.94 175.28 3gqz h PRO 330 N 7.89 0.54 -0.65 2.79 0.11 -1.70 -1.55 132.00 139.43 3gqz h PRO 330 Ca -0.10 -0.03 0.10 0.00 0.11 0.00 0.00 66.00 66.08 3gqz h PRO 330 Cb 1.01 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 31.96 3gqz h PRO 330 CO 0.49 0.36 0.43 1.49 -0.21 0.00 0.00 178.00 180.56 3gqz h GLU 331 N 0.56 0.46 -0.02 1.05 4.57 -1.34 -2.82 114.58 117.02 3gqz h GLU 331 Ca 0.47 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.62 3gqz h GLU 331 Cb 0.72 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.21 3gqz h GLU 331 CO -0.40 0.30 -0.00 1.63 -1.18 0.00 0.00 179.01 179.36 3gqz n LYS 332 N -4.48 1.63 -3.80 1.92 5.02 -0.62 -4.97 118.16 112.86 3gqz n LYS 332 Ca 0.11 -1.62 -0.27 0.00 -2.02 0.00 0.00 58.31 54.51 3gqz n LYS 332 Cb 0.38 -1.36 0.04 0.00 -0.02 0.00 0.00 35.03 34.06 3gqz n LYS 332 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3gqz n GLU 333 N 1.05 -5.83 -4.49 1.97 1.02 -0.97 -4.52 120.64 108.86 3gqz n GLU 333 Ca 0.11 0.65 -0.21 0.00 -0.02 0.00 0.00 57.16 57.69 3gqz n GLU 333 Cb 0.47 -5.50 -0.15 0.00 -0.02 0.00 0.00 31.44 26.24 3gqz n GLU 333 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3gqz s LEU 334 N -7.12 1.87 0.22 -4.62 2.96 -1.17 -2.25 118.68 108.58 3gqz s LEU 334 Ca 0.48 -0.22 -0.21 0.00 -0.22 0.00 0.00 54.13 53.96 3gqz s LEU 334 Cb -0.23 -0.63 0.04 0.00 0.50 0.00 0.00 46.19 45.87 3gqz s LEU 334 CO 0.81 0.10 0.65 -0.83 -1.32 0.00 0.00 176.35 175.76 3gqz s GLY 335 N 0.04 -0.30 -0.03 7.98 0.00 -0.37 -0.22 107.32 114.42 3gqz s GLY 335 Ca -0.01 0.01 -0.06 0.00 0.00 0.00 0.00 44.72 44.66 3gqz s GLY 335 CO 0.00 -0.01 0.15 -1.50 0.00 0.00 0.00 173.10 171.74 3gqz s ILE 336 N -3.85 0.04 -0.06 0.90 2.07 0.44 -0.57 121.20 120.18 3gqz s ILE 336 Ca 0.07 -0.32 0.03 0.00 -1.41 0.00 0.00 60.65 59.02 3gqz s ILE 336 Cb -0.03 -0.32 0.00 0.00 0.13 0.00 0.00 42.46 42.24 3gqz s ILE 336 CO -0.02 -0.18 -0.16 -0.69 -1.91 0.00 0.00 174.94 171.98 3gqz s VAL 337 N -0.60 1.41 -0.18 4.00 1.01 -0.12 -1.85 120.40 124.07 3gqz s VAL 337 Ca -0.07 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.25 3gqz s VAL 337 Cb -0.04 -1.24 0.03 0.00 0.00 0.00 0.00 36.38 35.13 3gqz s VAL 337 CO 0.01 0.41 -0.12 -0.04 0.00 0.00 0.00 175.10 175.36 3gqz s MET 338 N 0.36 2.14 -0.13 2.72 -1.94 0.21 -1.56 119.30 121.11 3gqz s MET 338 Ca -0.11 -0.71 0.03 0.00 -1.71 0.00 0.00 55.69 53.18 3gqz s MET 338 Cb -0.14 -2.28 0.01 0.00 2.01 0.00 0.00 34.83 34.42 3gqz s MET 338 CO 0.04 -0.34 -0.22 -0.51 -0.01 0.00 0.00 175.02 173.98 3gqz s LEU 339 N 1.44 2.15 0.04 -0.03 1.43 0.03 -1.38 118.68 122.36 3gqz s LEU 339 Ca 0.02 -0.57 0.04 0.00 -1.03 0.00 0.00 54.13 52.58 3gqz s LEU 339 Cb -0.15 -1.45 -0.02 0.00 0.03 0.00 0.00 46.19 44.60 3gqz s LEU 339 CO -0.09 0.11 -0.11 0.00 0.23 0.00 0.00 176.35 176.48 3gqz s ALA 340 N 0.66 0.90 -0.54 4.21 0.00 -0.11 -0.76 121.76 126.11 3gqz s ALA 340 Ca -0.11 -0.79 -0.01 0.00 0.00 0.00 0.00 51.96 51.06 3gqz s ALA 340 Cb -0.16 -0.08 0.40 0.00 0.00 0.00 0.00 23.12 23.27 3gqz s ALA 340 CO 0.02 0.12 2.00 0.27 0.00 0.00 0.00 175.76 178.17 3gqz n ASN 341 N 1.72 6.93 -3.76 0.00 6.94 -0.98 -1.47 115.26 124.64 3gqz n ASN 341 Ca -0.20 -3.55 -0.13 0.00 -0.02 0.00 0.00 54.58 50.69 3gqz n ASN 341 Cb 0.55 -0.98 -0.11 0.00 -2.36 0.00 0.00 39.78 36.88 3gqz n ASN 341 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 3gqz s LYS 342 N -3.17 0.33 -0.06 -3.83 2.20 -0.88 -1.41 119.74 112.92 3gqz s LYS 342 Ca 0.54 0.44 -0.30 0.00 -0.36 0.00 0.00 55.97 56.29 3gqz s LYS 342 Cb 0.43 0.12 -0.03 0.00 -1.51 0.00 0.00 37.83 36.83 3gqz s LYS 342 CO 0.00 -0.06 1.24 1.21 -0.36 0.00 0.00 175.35 177.38 3gqz s ASN 343 N 0.36 7.01 0.11 1.43 3.84 -1.25 -2.60 114.94 123.83 3gqz s ASN 343 Ca -0.02 1.85 0.01 0.00 0.21 0.00 0.00 52.86 54.91 3gqz s ASN 343 Cb -0.03 -2.56 -0.04 0.00 -0.55 0.00 0.00 41.25 38.07 3gqz s ASN 343 CO -0.01 -0.63 -0.03 -0.72 -2.79 0.00 0.00 177.10 172.92 3gqz s TYR 344 N 2.41 0.90 0.36 0.43 -0.85 -1.26 -4.95 117.35 114.39 3gqz s TYR 344 Ca 0.57 -1.00 -0.28 0.00 -0.52 0.00 0.00 57.07 55.83 3gqz s TYR 344 Cb -0.25 -0.53 -0.11 0.00 0.38 0.00 0.00 41.96 41.45 3gqz s TYR 344 CO 0.22 -0.25 1.50 -2.30 -1.52 0.00 0.00 175.55 173.20 3gqz n PRO 345 N -0.07 2.67 -0.20 -3.49 -0.02 -1.26 -4.91 135.00 127.72 3gqz n PRO 345 Ca -0.10 0.94 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 3gqz n PRO 345 Cb 0.62 -2.68 0.11 0.00 -0.02 0.00 0.00 33.50 31.53 3gqz n PRO 345 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 3gqz h ASN 346 N 3.22 0.19 -0.85 2.55 -1.24 -1.94 -2.62 115.58 114.89 3gqz h ASN 346 Ca -0.50 0.08 0.16 0.00 0.71 0.00 0.00 56.30 56.75 3gqz h ASN 346 Cb 1.24 0.07 -0.06 0.00 0.73 0.00 0.00 38.32 40.30 3gqz h ASN 346 CO 0.66 0.11 0.56 -0.65 -1.29 0.00 0.00 177.43 176.82 3gqz h PRO 347 N 0.38 0.53 -0.53 6.67 0.11 -1.84 -1.07 132.00 136.25 3gqz h PRO 347 Ca 0.31 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.30 3gqz h PRO 347 Cb 0.39 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.36 3gqz h PRO 347 CO -0.32 0.35 -0.00 0.00 -0.21 0.00 0.00 178.00 177.82 3gqz h ALA 348 N 1.62 0.99 -0.02 -0.75 0.00 -1.83 -0.60 119.26 118.66 3gqz h ALA 348 Ca 0.43 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 3gqz h ALA 348 Cb 0.85 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 3gqz h ALA 348 CO -0.18 0.62 -0.00 0.00 0.00 0.00 0.00 179.25 179.69 3gqz h ARG 349 N 0.84 0.04 -0.84 0.00 3.08 -1.23 -2.53 114.38 113.75 3gqz h ARG 349 Ca 0.16 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 3gqz h ARG 349 Cb 0.50 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.51 3gqz h ARG 349 CO 0.02 0.36 0.45 0.28 -1.07 0.00 0.00 179.97 180.02 3gqz h VAL 350 N -0.28 1.25 -0.31 2.04 2.07 -1.19 -0.74 116.25 119.08 3gqz h VAL 350 Ca 0.01 -0.62 0.07 0.00 0.82 0.00 0.00 66.70 66.97 3gqz h VAL 350 Cb 0.34 0.13 -0.07 0.00 -1.52 0.00 0.00 31.29 30.17 3gqz h VAL 350 CO 0.00 0.28 -0.18 0.44 0.02 0.00 0.00 177.57 178.12 3gqz h ASP 351 N 1.17 -0.61 -0.43 0.57 3.32 -1.08 -0.30 116.42 119.05 3gqz h ASP 351 Ca 0.29 0.13 -0.06 0.00 0.02 0.00 0.00 57.03 57.42 3gqz h ASP 351 Cb 0.04 0.32 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 3gqz h ASP 351 CO -0.05 -0.22 0.05 0.00 -1.72 0.00 0.00 179.24 177.30 3gqz h ALA 352 N 1.04 0.57 -0.61 3.45 0.00 -0.99 -1.59 119.26 121.13 3gqz h ALA 352 Ca 0.16 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3gqz h ALA 352 Cb 0.40 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3gqz h ALA 352 CO -0.40 0.31 0.24 0.00 0.00 0.00 0.00 179.25 179.40 3gqz h ALA 353 N 0.93 0.79 -0.08 0.00 0.00 -0.91 -2.03 119.26 117.95 3gqz h ALA 353 Ca 0.13 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3gqz h ALA 353 Cb 0.41 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 3gqz h ALA 353 CO 0.01 0.41 0.04 2.35 0.00 0.00 0.00 179.25 182.06 3gqz h TRP 354 N 0.85 0.12 -0.66 0.00 2.91 -0.97 -1.35 115.95 116.85 3gqz h TRP 354 Ca 0.20 -0.01 0.11 0.00 1.13 0.00 0.00 58.89 60.33 3gqz h TRP 354 Cb 0.21 -0.04 -0.08 0.00 -0.51 0.00 0.00 29.16 28.74 3gqz h TRP 354 CO 0.01 0.20 0.24 0.37 -1.03 0.00 0.00 178.44 178.23 3gqz h GLN 355 N -0.00 0.39 0.07 2.65 4.15 -1.10 0.79 115.11 122.05 3gqz h GLN 355 Ca 0.03 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.42 3gqz h GLN 355 Cb 0.13 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.73 3gqz h GLN 355 CO -0.00 0.26 -0.03 0.82 -1.93 0.00 0.00 178.83 177.94 3gqz h ILE 356 N 0.40 1.21 -0.39 2.39 2.04 -1.25 -2.96 117.51 118.95 3gqz h ILE 356 Ca 0.35 -1.05 -0.15 0.00 1.00 0.00 0.00 64.86 65.01 3gqz h ILE 356 Cb 0.47 1.88 -0.01 0.00 -0.74 0.00 0.00 36.82 38.42 3gqz h ILE 356 CO -0.35 0.26 -0.34 -0.07 0.00 0.00 0.00 178.15 177.65 3gqz h LEU 357 N -0.57 0.94 -1.25 1.44 3.38 -1.07 -2.78 115.31 115.39 3gqz h LEU 357 Ca -0.01 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.54 3gqz h LEU 357 Cb 0.49 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 3gqz h LEU 357 CO 0.02 1.18 0.26 -1.13 0.09 0.00 0.00 178.44 178.85 3gqz h ASN 358 N 0.74 0.70 0.40 -0.43 -1.24 -0.95 0.79 115.58 115.59 3gqz h ASN 358 Ca 0.07 -0.07 -0.10 0.00 0.71 0.00 0.00 56.30 56.92 3gqz h ASN 358 Cb 0.91 -0.18 -0.01 0.00 0.73 0.00 0.00 38.32 39.77 3gqz h ASN 358 CO 0.08 0.60 -0.44 0.00 -1.29 0.00 0.00 177.43 176.38 3gqz h ALA 359 N 1.51 1.22 0.00 1.57 0.00 -1.35 -3.26 119.26 118.95 3gqz h ALA 359 Ca 0.19 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 3gqz h ALA 359 Cb 0.09 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3gqz h ALA 359 CO -0.02 0.57 -1.50 1.28 0.00 0.00 0.00 179.25 179.58 3gqz n LEU 360 N -4.01 0.46 0.00 0.00 4.77 -0.82 -5.12 117.00 112.28 3gqz n LEU 360 Ca -0.02 0.18 0.04 0.00 -0.03 0.00 0.00 56.01 56.19 3gqz n LEU 360 Cb 0.48 -0.01 0.26 0.00 -2.33 0.00 0.00 43.42 41.81 3gqz n LEU 360 CO 0.40 -0.07 0.48 1.67 -1.33 0.00 0.00 177.39 178.55