#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gqw s LEU 5 N 0.00 4.30 -0.50 6.15 1.43 -1.26 -5.05 118.68 123.75 1gqw s LEU 5 Ca 0.00 0.78 -0.23 0.00 -1.03 0.00 0.00 54.13 53.64 1gqw s LEU 5 Cb 0.00 -3.19 0.04 0.00 0.03 0.00 0.00 46.19 43.07 1gqw s LEU 5 CO 0.00 0.10 0.85 -0.94 0.23 0.00 0.00 176.35 176.59 1gqw s SER 6 N -2.02 6.36 -0.20 2.29 1.04 -1.26 -4.96 113.70 114.96 1gqw s SER 6 Ca 0.37 -0.29 -0.02 0.00 0.48 0.00 0.00 55.95 56.50 1gqw s SER 6 Cb -0.13 -2.40 0.00 0.00 0.10 0.00 0.00 66.02 63.59 1gqw s SER 6 CO 0.20 -1.07 -0.12 -0.63 0.98 0.00 0.00 173.24 172.61 1gqw s ILE 7 N 3.57 2.77 -0.26 -1.02 1.01 -1.26 -2.35 121.20 123.66 1gqw s ILE 7 Ca 0.29 -0.70 0.00 0.00 0.00 0.00 0.00 60.65 60.24 1gqw s ILE 7 Cb -0.13 -2.22 0.04 0.00 0.01 0.00 0.00 42.46 40.16 1gqw s ILE 7 CO 0.20 0.48 -0.07 -0.89 0.00 0.00 0.00 174.94 174.66 1gqw s THR 8 N 1.37 2.60 0.08 2.92 2.01 0.17 -4.95 115.64 119.85 1gqw s THR 8 Ca 0.05 -1.31 -0.31 0.00 0.31 0.00 0.00 61.69 60.43 1gqw s THR 8 Cb -0.14 -2.42 -0.07 0.00 0.01 0.00 0.00 72.50 69.88 1gqw s THR 8 CO -0.07 0.07 1.38 -2.16 -0.69 0.00 0.00 174.62 173.15 1gqw s PRO 9 N 1.23 4.32 0.00 4.92 0.04 -1.26 0.62 135.00 144.87 1gqw s PRO 9 Ca -0.04 2.02 0.30 0.00 0.04 0.00 0.00 61.00 63.32 1gqw s PRO 9 Cb -0.18 -3.35 1.44 0.00 0.04 0.00 0.00 34.50 32.45 1gqw s PRO 9 CO -0.04 -0.46 2.01 1.28 0.04 0.00 0.00 177.00 179.82 1gqw n LEU 10 N 4.33 0.07 -3.62 -3.56 4.77 -0.65 -4.88 117.00 113.45 1gqw n LEU 10 Ca 0.12 0.27 0.03 0.00 -0.03 0.00 0.00 56.01 56.39 1gqw n LEU 10 Cb 0.43 -0.29 -0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1gqw n LEU 10 CO 0.58 0.01 1.14 -0.83 -1.33 0.00 0.00 177.39 176.97 1gqw s GLY 11 N -2.61 -0.43 0.49 -0.72 0.00 -1.26 -4.98 107.32 97.81 1gqw s GLY 11 Ca 0.27 0.76 0.14 0.00 0.00 0.00 0.00 44.72 45.88 1gqw s GLY 11 CO 0.47 0.70 2.12 -0.56 0.00 0.00 0.00 173.10 175.83 1gqw h PRO 12 N 2.00 0.14 0.00 2.90 0.13 -1.94 -3.43 132.00 131.80 1gqw h PRO 12 Ca -0.31 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1gqw h PRO 12 Cb 1.20 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1gqw h PRO 12 CO 0.29 0.10 0.00 0.66 -0.23 0.00 0.00 178.00 178.83 1gqw n TYR 13 N -4.51 0.00 -0.90 1.56 4.01 -1.26 -5.07 117.16 110.98 1gqw n TYR 13 Ca -0.01 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.44 1gqw n TYR 13 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 1gqw n TYR 13 CO 0.00 0.00 0.00 1.51 -0.46 0.00 0.00 176.86 177.91 1gqw n ILE 14 N 0.00 0.30 0.00 -0.72 3.06 -1.26 -4.86 119.36 115.88 1gqw n ILE 14 Ca 0.00 -0.35 0.00 0.00 -2.50 0.00 0.00 62.75 59.90 1gqw n ILE 14 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 1gqw n ILE 14 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1gqw n GLY 15 N 1.69 1.13 3.62 4.50 0.00 -1.25 -4.18 105.19 110.70 1gqw n GLY 15 Ca 0.07 -1.52 -0.03 0.00 0.00 0.00 0.00 46.02 44.53 1gqw n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gqw s ALA 16 N -1.45 -2.13 -0.01 4.61 0.00 -0.90 -1.64 121.76 120.25 1gqw s ALA 16 Ca 0.00 1.74 0.06 0.00 0.00 0.00 0.00 51.96 53.76 1gqw s ALA 16 Cb 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 1gqw s ALA 16 CO 0.00 -0.56 -0.19 -1.14 0.00 0.00 0.00 175.76 173.87 1gqw s GLN 17 N -2.20 1.53 0.25 0.00 0.74 0.20 -1.14 119.66 119.05 1gqw s GLN 17 Ca 0.10 -0.70 0.03 0.00 0.05 0.00 0.00 55.36 54.85 1gqw s GLN 17 Cb -0.01 -1.49 -0.05 0.00 1.10 0.00 0.00 33.01 32.56 1gqw s GLN 17 CO -0.04 0.41 0.03 0.42 -0.55 0.00 0.00 175.29 175.55 1gqw s ILE 18 N -0.47 0.98 -0.37 -2.34 1.01 -0.74 0.43 121.20 119.69 1gqw s ILE 18 Ca 0.07 -2.02 0.00 0.00 0.00 0.00 0.00 60.65 58.71 1gqw s ILE 18 Cb -0.07 -2.48 0.13 0.00 0.01 0.00 0.00 42.46 40.05 1gqw s ILE 18 CO -0.01 -0.21 0.20 -0.44 0.00 0.00 0.00 174.94 174.49 1gqw s SER 19 N -3.34 3.40 0.00 3.58 0.01 -0.99 -4.50 113.70 111.86 1gqw s SER 19 Ca 0.32 -2.21 0.00 0.00 1.31 0.00 0.00 55.95 55.36 1gqw s SER 19 Cb 0.07 -0.69 0.00 0.00 0.21 0.00 0.00 66.02 65.61 1gqw s SER 19 CO 0.11 -0.32 0.00 0.61 0.41 0.00 0.00 173.24 174.05 1gqw n GLY 20 N 4.05 0.73 0.01 3.44 0.00 -1.26 -4.06 105.19 108.10 1gqw n GLY 20 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1gqw n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gqw n ALA 21 N -3.00 0.05 -0.58 4.61 0.00 -1.26 -5.11 120.51 115.22 1gqw n ALA 21 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.18 1gqw n ALA 21 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1gqw n ALA 21 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1gqw n ASP 22 N 0.00 0.36 -1.20 0.00 8.00 -1.26 -4.88 116.55 117.56 1gqw n ASP 22 Ca 0.00 0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.84 1gqw n ASP 22 Cb 0.01 -0.38 0.00 0.00 -0.02 0.00 0.00 41.12 40.73 1gqw n ASP 22 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 1gqw n ARG 25 N 2.90 0.00 -1.25 -1.24 1.85 -1.26 -4.90 116.66 112.76 1gqw n ARG 25 Ca 0.21 0.00 -0.35 0.00 -1.00 0.00 0.00 57.85 56.71 1gqw n ARG 25 Cb -0.02 -0.45 0.10 0.00 -1.05 0.00 0.00 32.46 31.04 1gqw n ARG 25 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1gqw n PRO 26 N -0.01 0.36 -3.16 2.89 -0.04 -1.26 -4.99 135.00 128.79 1gqw n PRO 26 Ca 0.00 0.18 -0.38 0.00 -0.04 0.00 0.00 63.50 63.27 1gqw n PRO 26 Cb 0.00 -2.23 -0.06 0.00 -0.04 0.00 0.00 33.50 31.17 1gqw n PRO 26 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1gqw s LEU 27 N -3.47 4.47 -0.44 1.53 1.43 -1.26 -5.01 118.68 115.92 1gqw s LEU 27 Ca 0.72 1.39 -0.28 0.00 -1.03 0.00 0.00 54.13 54.92 1gqw s LEU 27 Cb -0.32 -3.26 0.01 0.00 0.03 0.00 0.00 46.19 42.65 1gqw s LEU 27 CO 0.52 0.16 1.48 -0.94 0.23 0.00 0.00 176.35 177.80 1gqw s SER 28 N -1.36 6.20 0.00 2.29 1.04 -1.26 -4.77 113.70 115.84 1gqw s SER 28 Ca 0.36 0.76 0.00 0.00 0.48 0.00 0.00 55.95 57.55 1gqw s SER 28 Cb -0.19 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.39 1gqw s SER 28 CO 0.21 -1.56 0.00 0.47 0.98 0.00 0.00 173.24 173.35 1gqw n ASP 29 N 9.30 0.00 -0.27 7.02 9.92 -1.26 0.35 116.55 141.60 1gqw n ASP 29 Ca 0.17 0.00 0.21 0.00 -0.53 0.00 0.00 54.79 54.63 1gqw n ASP 29 Cb 0.48 0.00 0.52 0.00 -0.64 0.00 0.00 41.12 41.48 1gqw n ASP 29 CO 0.00 0.00 0.00 -1.13 0.13 0.00 0.00 177.20 176.20 1gqw h ASN 30 N 0.00 0.41 0.09 -2.24 -0.73 -2.00 -1.05 115.58 110.06 1gqw h ASN 30 Ca 0.00 0.05 -0.00 0.00 1.87 0.00 0.00 56.30 58.22 1gqw h ASN 30 Cb 0.00 -0.02 0.00 0.00 0.27 0.00 0.00 38.32 38.57 1gqw h ASN 30 CO 0.00 0.13 -0.05 1.56 -0.37 0.00 0.00 177.43 178.71 1gqw h GLN 31 N 0.39 -0.12 -1.07 6.67 4.20 0.56 -3.13 115.11 122.60 1gqw h GLN 31 Ca 0.52 0.01 0.31 0.00 0.06 0.00 0.00 58.65 59.55 1gqw h GLN 31 Cb 1.32 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 29.09 1gqw h GLN 31 CO -0.21 0.18 1.01 0.35 -0.67 0.00 0.00 178.83 179.49 1gqw h PHE 32 N -1.00 0.00 -0.08 2.96 3.04 -1.40 1.76 116.94 122.22 1gqw h PHE 32 Ca -0.01 0.00 -0.22 0.00 3.98 0.00 0.00 57.97 61.71 1gqw h PHE 32 Cb 0.36 0.00 0.01 0.00 2.56 0.00 0.00 35.95 38.87 1gqw h PHE 32 CO 0.07 0.00 -0.84 0.93 -2.02 0.00 0.00 178.31 176.44 1gqw h GLU 33 N 0.00 0.64 -0.39 1.11 4.39 -1.22 -1.44 114.58 117.66 1gqw h GLU 33 Ca 0.51 -0.57 -0.08 0.00 0.34 0.00 0.00 59.36 59.56 1gqw h GLU 33 Cb 2.53 0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 31.30 1gqw h GLU 33 CO -0.01 1.19 -0.07 1.96 -1.16 0.00 0.00 179.01 180.92 1gqw h GLN 34 N 0.41 0.74 0.29 2.33 4.20 0.26 -2.19 115.11 121.15 1gqw h GLN 34 Ca -0.07 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.36 1gqw h GLN 34 Cb 1.47 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 29.20 1gqw h GLN 34 CO 0.16 0.87 -0.14 1.25 -0.67 0.00 0.00 178.83 180.30 1gqw h LEU 35 N 0.55 -0.33 -0.10 1.46 5.85 -1.02 -0.48 115.31 121.24 1gqw h LEU 35 Ca 0.10 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.85 1gqw h LEU 35 Cb 0.58 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.64 1gqw h LEU 35 CO 0.03 -0.21 -0.36 0.22 -0.34 0.00 0.00 178.44 177.79 1gqw h TYR 36 N -0.42 -1.00 0.00 1.25 3.20 -1.25 0.55 116.97 119.30 1gqw h TYR 36 Ca -0.04 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1gqw h TYR 36 Cb 0.32 0.45 0.00 0.00 1.54 0.00 0.00 36.73 39.04 1gqw h TYR 36 CO -0.05 -0.43 0.00 0.45 -1.64 0.00 0.00 178.16 176.49 1gqw h HIS 37 N -0.45 0.00 0.00 -3.82 3.86 -1.29 -1.47 115.15 111.98 1gqw h HIS 37 Ca 0.08 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 1gqw h HIS 37 Cb 0.58 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.05 1gqw h HIS 37 CO -0.42 0.00 -0.05 0.00 0.86 0.00 0.00 177.93 178.32 1gqw h ALA 38 N 2.05 0.01 0.00 2.45 0.00 0.15 -1.66 119.26 122.27 1gqw h ALA 38 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1gqw h ALA 38 Cb 0.12 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1gqw h ALA 38 CO 0.00 0.03 0.00 0.28 0.00 0.00 0.00 179.25 179.56 1gqw n VAL 39 N -4.66 0.00 -0.06 0.00 0.31 0.14 -1.52 118.33 112.55 1gqw n VAL 39 Ca -0.07 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.18 1gqw n VAL 39 Cb 0.33 -0.80 -0.06 0.00 -0.91 0.00 0.00 33.84 32.39 1gqw n VAL 39 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1gqw n LEU 40 N -0.89 2.28 -0.04 7.52 7.94 -0.63 -4.36 117.00 128.83 1gqw n LEU 40 Ca 0.03 -0.05 -0.13 0.00 -1.11 0.00 0.00 56.01 54.75 1gqw n LEU 40 Cb 0.01 -0.28 -0.01 0.00 0.53 0.00 0.00 43.42 43.67 1gqw n LEU 40 CO 0.02 0.60 0.42 -0.09 -1.11 0.00 0.00 177.39 177.24 1gqw h ARG 41 N 0.00 0.75 -6.56 1.96 2.43 -0.28 -3.41 114.38 109.27 1gqw h ARG 41 Ca -0.28 -0.50 -0.68 0.00 -0.81 0.00 0.00 59.98 57.71 1gqw h ARG 41 Cb 1.48 0.07 -0.21 0.00 -0.42 0.00 0.00 29.97 30.89 1gqw h ARG 41 CO -0.03 1.12 -0.79 -1.01 -1.51 0.00 0.00 179.97 177.75 1gqw s HIS 42 N -4.02 2.60 -0.27 2.20 3.76 -0.65 -4.90 115.29 114.02 1gqw s HIS 42 Ca -0.09 -0.23 0.23 0.00 -0.15 0.00 0.00 55.06 54.82 1gqw s HIS 42 Cb 0.10 -1.47 0.50 0.00 1.11 0.00 0.00 32.58 32.82 1gqw s HIS 42 CO 0.88 0.28 1.66 1.96 -0.85 0.00 0.00 174.74 178.67 1gqw h GLN 43 N 4.42 0.00 -4.98 1.40 7.50 -1.81 -3.38 115.11 118.27 1gqw h GLN 43 Ca -0.48 0.00 -0.36 0.00 0.50 0.00 0.00 58.65 58.31 1gqw h GLN 43 Cb 1.16 0.00 -0.22 0.00 0.05 0.00 0.00 27.48 28.47 1gqw h GLN 43 CO 0.48 0.10 -0.76 0.08 -1.50 0.00 0.00 178.83 177.23 1gqw s VAL 44 N -3.27 0.85 0.03 -0.54 1.01 -1.26 -1.17 120.40 116.05 1gqw s VAL 44 Ca 0.05 -1.11 0.03 0.00 0.00 0.00 0.00 61.98 60.94 1gqw s VAL 44 Cb 0.06 -0.84 -0.02 0.00 0.00 0.00 0.00 36.38 35.58 1gqw s VAL 44 CO 0.66 -0.24 -0.08 0.68 0.00 0.00 0.00 175.10 176.12 1gqw s VAL 45 N -1.19 0.62 -0.05 2.92 -7.23 0.35 -2.11 120.40 113.71 1gqw s VAL 45 Ca -0.04 -0.91 0.04 0.00 -1.81 0.00 0.00 61.98 59.26 1gqw s VAL 45 Cb -0.09 -0.63 0.00 0.00 0.56 0.00 0.00 36.38 36.22 1gqw s VAL 45 CO 0.01 -0.22 -0.16 -0.36 -0.31 0.00 0.00 175.10 174.06 1gqw s PHE 46 N -1.05 1.62 -0.03 2.82 0.08 -0.29 -1.42 117.98 119.70 1gqw s PHE 46 Ca -0.06 -0.50 0.03 0.00 0.12 0.00 0.00 56.93 56.53 1gqw s PHE 46 Cb -0.08 -1.11 0.00 0.00 -0.57 0.00 0.00 43.02 41.26 1gqw s PHE 46 CO 0.01 -0.19 -0.12 -0.51 -0.10 0.00 0.00 175.22 174.30 1gqw s LEU 47 N 0.18 1.84 0.29 -0.37 1.43 0.22 -1.79 118.68 120.49 1gqw s LEU 47 Ca -0.06 -0.26 0.09 0.00 -1.03 0.00 0.00 54.13 52.87 1gqw s LEU 47 Cb -0.12 -0.73 -0.04 0.00 0.03 0.00 0.00 46.19 45.33 1gqw s LEU 47 CO 0.03 0.10 0.08 -0.13 0.23 0.00 0.00 176.35 176.66 1gqw s ARG 48 N 0.13 2.41 -1.05 1.70 0.52 -1.26 0.22 118.95 121.62 1gqw s ARG 48 Ca -0.03 -1.41 -0.07 0.00 -0.52 0.00 0.00 55.73 53.69 1gqw s ARG 48 Cb -0.10 -2.22 -0.06 0.00 0.52 0.00 0.00 34.95 33.09 1gqw s ARG 48 CO 0.01 0.27 0.90 -0.25 0.02 0.00 0.00 175.30 176.26 1gqw n ASP 49 N -1.03 -6.55 -3.45 0.23 8.00 -0.91 -4.93 116.55 107.90 1gqw n ASP 49 Ca -0.05 -0.72 -0.28 0.00 0.71 0.00 0.00 54.79 54.45 1gqw n ASP 49 Cb 0.60 -5.02 -0.11 0.00 -0.02 0.00 0.00 41.12 36.57 1gqw n ASP 49 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1gqw s GLN 50 N -4.52 0.93 -1.42 -1.24 -1.52 0.26 -5.00 119.66 107.15 1gqw s GLN 50 Ca 0.45 -2.00 -0.13 0.00 -1.95 0.00 0.00 55.36 51.72 1gqw s GLN 50 Cb -0.07 -1.54 0.07 0.00 -0.22 0.00 0.00 33.01 31.25 1gqw s GLN 50 CO 0.75 -1.33 2.14 0.00 -0.25 0.00 0.00 175.29 176.60 1gqw n ALA 51 N 3.09 5.46 -1.94 6.09 0.00 -1.26 -4.61 120.51 127.34 1gqw n ALA 51 Ca 0.24 -3.97 -0.27 0.00 0.00 0.00 0.00 53.44 49.44 1gqw n ALA 51 Cb 0.44 -3.42 0.11 0.00 0.00 0.00 0.00 19.45 16.58 1gqw n ALA 51 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1gqw s ILE 52 N 2.63 2.14 0.25 0.00 -4.36 -1.26 -5.10 121.20 115.50 1gqw s ILE 52 Ca 0.46 -0.22 0.09 0.00 -0.26 0.00 0.00 60.65 60.72 1gqw s ILE 52 Cb 0.13 -2.92 -0.04 0.00 1.25 0.00 0.00 42.46 40.88 1gqw s ILE 52 CO -0.07 0.00 -0.00 0.42 0.24 0.00 0.00 174.94 175.53 1gqw s THR 53 N -3.46 3.50 0.13 8.37 -4.23 -1.26 -4.97 115.64 113.72 1gqw s THR 53 Ca 0.66 -1.81 -0.30 0.00 -1.18 0.00 0.00 61.69 59.05 1gqw s THR 53 Cb -0.08 -2.85 -0.07 0.00 1.34 0.00 0.00 72.50 70.85 1gqw s THR 53 CO 0.48 -0.32 1.57 -0.65 -0.54 0.00 0.00 174.62 175.16 1gqw h PRO 54 N 2.06 -0.47 -0.95 3.99 0.11 -1.99 0.26 132.00 135.00 1gqw h PRO 54 Ca -0.45 0.03 0.20 0.00 0.11 0.00 0.00 66.00 65.90 1gqw h PRO 54 Cb 1.24 0.11 -0.11 0.00 0.11 0.00 0.00 31.00 32.34 1gqw h PRO 54 CO 0.60 -0.32 0.52 1.96 -0.21 0.00 0.00 178.00 180.55 1gqw h GLN 55 N -0.49 0.59 -0.32 1.05 7.50 -1.96 -0.51 115.11 120.96 1gqw h GLN 55 Ca 0.07 -0.04 -0.08 0.00 0.50 0.00 0.00 58.65 59.11 1gqw h GLN 55 Cb 0.64 -0.13 -0.02 0.00 0.05 0.00 0.00 27.48 28.02 1gqw h GLN 55 CO -0.44 0.39 -0.16 1.96 -1.50 0.00 0.00 178.83 179.08 1gqw h GLN 56 N 0.60 0.56 0.09 1.46 4.20 -1.03 -2.98 115.11 118.01 1gqw h GLN 56 Ca 0.57 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 59.09 1gqw h GLN 56 Cb 0.97 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.71 1gqw h GLN 56 CO -0.44 0.70 -0.04 0.37 -0.67 0.00 0.00 178.83 178.75 1gqw h GLN 57 N 0.51 -0.11 -0.90 1.46 4.15 0.88 -3.04 115.11 118.06 1gqw h GLN 57 Ca 0.09 0.01 0.23 0.00 0.77 0.00 0.00 58.65 59.75 1gqw h GLN 57 Cb 0.57 0.03 -0.05 0.00 0.21 0.00 0.00 27.48 28.23 1gqw h GLN 57 CO 0.04 0.37 0.62 -0.09 -1.93 0.00 0.00 178.83 177.84 1gqw h ARG 58 N -0.66 0.20 -0.05 1.69 2.43 -1.39 0.18 114.38 116.79 1gqw h ARG 58 Ca -0.01 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1gqw h ARG 58 Cb 0.53 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1gqw h ARG 58 CO 0.02 0.13 0.01 0.00 -1.51 0.00 0.00 179.97 178.62 1gqw h ALA 59 N 1.59 0.07 -0.52 2.80 0.00 -1.48 -1.89 119.26 119.82 1gqw h ALA 59 Ca 0.46 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 55.19 1gqw h ALA 59 Cb 1.45 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 1gqw h ALA 59 CO -0.10 -0.32 0.12 1.25 0.00 0.00 0.00 179.25 180.20 1gqw h LEU 60 N -0.13 0.74 0.07 0.00 5.85 -0.61 -2.91 115.31 118.32 1gqw h LEU 60 Ca 0.02 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.60 1gqw h LEU 60 Cb 0.23 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.07 1gqw h LEU 60 CO 0.00 0.74 -0.03 0.00 -0.34 0.00 0.00 178.44 178.80 1gqw h ALA 61 N 1.36 -0.09 -0.96 1.25 0.00 -0.95 -2.91 119.26 116.97 1gqw h ALA 61 Ca 0.17 -0.03 0.17 0.00 0.00 0.00 0.00 54.91 55.21 1gqw h ALA 61 Cb 0.29 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.02 1gqw h ALA 61 CO -0.00 -0.54 0.56 1.96 0.00 0.00 0.00 179.25 181.23 1gqw h GLN 62 N -0.12 0.73 0.00 0.00 4.20 -1.15 0.14 115.11 118.91 1gqw h GLN 62 Ca -0.01 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1gqw h GLN 62 Cb 0.10 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.71 1gqw h GLN 62 CO 0.02 0.48 0.12 0.54 -0.67 0.00 0.00 178.83 179.32 1gqw n ARG 63 N -4.78 0.00 -0.11 1.46 5.12 -1.10 -1.79 116.66 115.46 1gqw n ARG 63 Ca 0.21 0.29 -0.16 0.00 -1.93 0.00 0.00 57.85 56.26 1gqw n ARG 63 Cb 0.51 -1.62 -0.10 0.00 -1.16 0.00 0.00 32.46 30.09 1gqw n ARG 63 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 1gqw n PHE 64 N -1.26 0.00 0.00 -1.55 3.01 0.48 -5.10 117.46 113.04 1gqw n PHE 64 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1gqw n PHE 64 Cb 0.12 -0.81 0.00 0.00 -0.01 0.00 0.00 39.48 38.78 1gqw n PHE 64 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1gqw n GLY 65 N 2.39 -1.01 3.69 1.37 0.00 -0.74 -5.10 105.19 105.80 1gqw n GLY 65 Ca -0.38 -1.06 -0.32 0.00 0.00 0.00 0.00 46.02 44.26 1gqw n GLY 65 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gqw s GLU 66 N -2.00 1.40 0.52 1.61 2.02 -1.26 -4.17 118.70 116.82 1gqw s GLU 66 Ca 0.00 1.57 0.04 0.00 0.02 0.00 0.00 54.97 56.60 1gqw s GLU 66 Cb 0.00 -1.77 0.10 0.00 0.10 0.00 0.00 34.13 32.56 1gqw s GLU 66 CO 0.00 -2.35 0.72 1.28 0.02 0.00 0.00 175.26 174.92 1gqw n LEU 67 N -3.81 0.00 -3.97 1.80 4.77 -1.26 -1.62 117.00 112.90 1gqw n LEU 67 Ca 0.12 -1.88 -0.14 0.00 -0.03 0.00 0.00 56.01 54.08 1gqw n LEU 67 Cb 0.52 -0.42 -0.13 0.00 -2.33 0.00 0.00 43.42 41.05 1gqw n LEU 67 CO 0.49 -0.77 -0.39 -2.28 -1.33 0.00 0.00 177.39 173.11 1gqw s HIS 68 N -2.14 0.43 -0.26 -1.77 5.65 -0.29 -4.36 115.29 112.55 1gqw s HIS 68 Ca 0.51 -0.22 -0.05 0.00 0.25 0.00 0.00 55.06 55.55 1gqw s HIS 68 Cb -0.04 -0.27 -0.00 0.00 -1.18 0.00 0.00 32.58 31.09 1gqw s HIS 68 CO 0.33 -0.04 0.03 0.42 -0.65 0.00 0.00 174.74 174.83 1gqw s ILE 69 N -0.53 3.73 0.17 0.89 1.01 -1.26 -4.49 121.20 120.72 1gqw s ILE 69 Ca -0.03 -0.58 -0.32 0.00 0.00 0.00 0.00 60.65 59.72 1gqw s ILE 69 Cb -0.04 -2.83 -0.10 0.00 0.01 0.00 0.00 42.46 39.49 1gqw s ILE 69 CO -0.00 0.23 1.59 -2.28 0.00 0.00 0.00 174.94 174.48 1gqw s HIS 70 N 1.49 3.04 -1.88 3.97 5.65 -1.26 -4.89 115.29 121.41 1gqw s HIS 70 Ca 0.04 0.60 0.21 0.00 0.25 0.00 0.00 55.06 56.15 1gqw s HIS 70 Cb -0.16 -3.95 1.19 0.00 -1.18 0.00 0.00 32.58 28.48 1gqw s HIS 70 CO 0.00 -3.52 1.63 -0.35 -0.65 0.00 0.00 174.74 171.84 1gqw n PRO 71 N 3.93 0.58 0.10 2.88 -0.04 -1.26 -4.36 135.00 136.83 1gqw n PRO 71 Ca 0.14 0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 1gqw n PRO 71 Cb 0.38 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 1gqw n PRO 71 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1gqw n VAL 72 N -1.06 0.47 -1.65 0.52 0.31 -1.26 -4.85 118.33 110.81 1gqw n VAL 72 Ca 0.14 0.16 -0.39 0.00 -0.01 0.00 0.00 64.34 64.24 1gqw n VAL 72 Cb 0.09 -0.96 0.04 0.00 -0.91 0.00 0.00 33.84 32.10 1gqw n VAL 72 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1gqw n TYR 73 N -3.42 1.38 -2.17 3.52 4.01 -1.26 -4.97 117.16 114.25 1gqw n TYR 73 Ca 0.00 0.47 -0.33 0.00 -0.16 0.00 0.00 57.90 57.88 1gqw n TYR 73 Cb 0.02 -2.24 -0.00 0.00 -0.31 0.00 0.00 39.34 36.81 1gqw n TYR 73 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1gqw s PRO 74 N -2.53 3.50 0.42 -0.72 0.04 -1.26 -4.81 135.00 129.64 1gqw s PRO 74 Ca 0.70 1.17 0.08 0.00 0.04 0.00 0.00 61.00 62.98 1gqw s PRO 74 Cb -0.46 -2.06 -0.00 0.00 0.04 0.00 0.00 34.50 32.01 1gqw s PRO 74 CO 0.51 -0.65 0.48 -3.38 0.04 0.00 0.00 177.00 173.99 1gqw s HIS 75 N -2.44 2.72 1.17 0.56 -3.43 -1.26 -0.98 115.29 111.63 1gqw s HIS 75 Ca 0.63 -0.46 -0.20 0.00 -0.80 0.00 0.00 55.06 54.24 1gqw s HIS 75 Cb -0.15 -2.27 0.28 0.00 -1.43 0.00 0.00 32.58 29.02 1gqw s HIS 75 CO 0.34 -0.28 1.19 0.00 -2.00 0.00 0.00 174.74 173.98 1gqw s ALA 76 N -2.42 1.04 0.00 -1.38 0.00 -0.35 -4.64 121.76 114.01 1gqw s ALA 76 Ca 0.51 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 51.32 1gqw s ALA 76 Cb -0.06 -2.80 0.00 0.00 0.00 0.00 0.00 23.12 20.25 1gqw s ALA 76 CO 0.30 -3.40 0.22 -0.85 0.00 0.00 0.00 175.76 172.04 1gqw n GLU 77 N -4.57 0.00 -2.08 0.00 0.00 -1.26 -3.53 120.64 109.20 1gqw n GLU 77 Ca 0.16 0.22 -0.24 0.00 0.00 0.00 0.00 57.16 57.30 1gqw n GLU 77 Cb 0.60 -0.62 0.02 0.00 0.00 0.00 0.00 31.44 31.44 1gqw n GLU 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1gqw n GLY 78 N -0.50 6.29 2.53 -1.84 0.00 -1.26 -4.89 105.19 105.52 1gqw n GLY 78 Ca 0.00 -2.65 -0.28 0.00 0.00 0.00 0.00 46.02 43.09 1gqw n GLY 78 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gqw s VAL 79 N -4.67 -0.02 -1.00 1.61 1.01 -1.23 -5.00 120.40 111.10 1gqw s VAL 79 Ca 0.50 -1.15 0.23 0.00 0.00 0.00 0.00 61.98 61.56 1gqw s VAL 79 Cb 0.41 -1.02 0.19 0.00 0.00 0.00 0.00 36.38 35.96 1gqw s VAL 79 CO 0.02 -0.82 1.73 0.47 0.00 0.00 0.00 175.10 176.50 1gqw n ASP 80 N 4.70 0.00 0.16 3.32 9.92 -1.26 -2.62 116.55 130.76 1gqw n ASP 80 Ca 0.03 0.50 0.10 0.00 -0.53 0.00 0.00 54.79 54.89 1gqw n ASP 80 Cb 0.40 -0.50 0.08 0.00 -0.64 0.00 0.00 41.12 40.46 1gqw n ASP 80 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 1gqw h GLU 81 N 0.00 0.00 -4.30 -1.24 3.07 -1.94 -3.43 114.58 106.73 1gqw h GLU 81 Ca 0.00 0.00 -0.74 0.00 -0.50 0.00 0.00 59.36 58.12 1gqw h GLU 81 Cb 0.39 0.00 -0.24 0.00 -0.84 0.00 0.00 28.75 28.06 1gqw h GLU 81 CO 0.00 0.05 -0.35 0.42 -1.40 0.00 0.00 179.01 177.74 1gqw s ILE 82 N -3.24 4.95 0.31 3.13 1.01 -1.14 -3.83 121.20 122.40 1gqw s ILE 82 Ca 0.03 -1.25 -0.29 0.00 0.00 0.00 0.00 60.65 59.15 1gqw s ILE 82 Cb 0.07 -4.02 -0.10 0.00 0.01 0.00 0.00 42.46 38.42 1gqw s ILE 82 CO 0.73 -0.62 1.21 -0.63 0.00 0.00 0.00 174.94 175.63 1gqw s ILE 83 N 1.57 3.06 -0.20 2.92 1.01 0.31 -1.21 121.20 128.67 1gqw s ILE 83 Ca 0.04 1.06 -0.02 0.00 0.00 0.00 0.00 60.65 61.72 1gqw s ILE 83 Cb -0.25 -3.67 -0.01 0.00 0.01 0.00 0.00 42.46 38.54 1gqw s ILE 83 CO 0.05 0.25 -0.08 -0.69 0.00 0.00 0.00 174.94 174.46 1gqw s VAL 84 N -1.17 3.13 -0.67 2.92 1.01 -0.15 -0.37 120.40 125.10 1gqw s VAL 84 Ca 0.47 -0.59 -0.06 0.00 0.00 0.00 0.00 61.98 61.81 1gqw s VAL 84 Cb -0.36 -2.39 0.17 0.00 0.00 0.00 0.00 36.38 33.80 1gqw s VAL 84 CO 0.47 0.46 0.52 -0.76 0.00 0.00 0.00 175.10 175.80 1gqw s LEU 85 N 1.22 5.68 -0.39 3.92 1.43 0.16 -4.45 118.68 126.24 1gqw s LEU 85 Ca 0.02 -2.76 -0.09 0.00 -1.03 0.00 0.00 54.13 50.27 1gqw s LEU 85 Cb -0.14 -1.96 0.05 0.00 0.03 0.00 0.00 46.19 44.17 1gqw s LEU 85 CO -0.03 -0.44 0.22 -0.62 0.23 0.00 0.00 176.35 175.71 1gqw s ASP 86 N 1.19 5.62 0.09 2.29 2.15 -1.26 -1.06 116.67 125.68 1gqw s ASP 86 Ca 0.17 -1.27 0.03 0.00 0.43 0.00 0.00 52.55 51.91 1gqw s ASP 86 Cb -0.18 -1.98 -0.04 0.00 -0.30 0.00 0.00 42.92 40.42 1gqw s ASP 86 CO -0.05 -0.45 0.10 0.42 -0.17 0.00 0.00 175.17 175.02 1gqw s THR 87 N 1.47 4.60 -0.80 1.71 -4.23 0.13 -4.87 115.64 113.64 1gqw s THR 87 Ca 0.02 -0.77 0.00 0.00 -1.18 0.00 0.00 61.69 59.76 1gqw s THR 87 Cb -0.21 -3.23 0.00 0.00 1.34 0.00 0.00 72.50 70.39 1gqw s THR 87 CO 0.04 0.10 0.00 0.00 -0.54 0.00 0.00 174.62 174.22 1gqw n HIS 88 N 0.35 0.00 -0.19 3.99 1.44 -0.56 -2.19 115.22 118.06 1gqw n HIS 88 Ca -0.08 0.00 -0.05 0.00 -2.01 0.00 0.00 57.72 55.57 1gqw n HIS 88 Cb 0.52 0.00 0.11 0.00 0.12 0.00 0.00 29.99 30.74 1gqw n HIS 88 CO 0.00 0.00 0.00 -0.91 -2.81 0.00 0.00 176.34 172.62 1gqw h ASN 89 N 0.00 0.93 -0.01 4.39 2.35 -1.86 -1.88 115.58 119.50 1gqw h ASN 89 Ca 0.00 -0.19 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 1gqw h ASN 89 Cb 0.00 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.12 1gqw h ASN 89 CO 0.00 0.91 0.00 0.47 -1.65 0.00 0.00 177.43 177.16 1gqw n ASP 90 N -4.24 0.20 -2.79 5.81 8.00 -1.26 -4.21 116.55 118.06 1gqw n ASP 90 Ca 0.04 -1.13 -0.04 0.00 0.71 0.00 0.00 54.79 54.38 1gqw n ASP 90 Cb 0.26 -0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.36 1gqw n ASP 90 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1gqw s ASN 91 N -1.93 -1.43 0.82 -2.24 2.47 -0.87 -5.16 114.94 106.60 1gqw s ASN 91 Ca 0.44 -1.64 -0.13 0.00 0.42 0.00 0.00 52.86 51.94 1gqw s ASN 91 Cb 0.20 1.87 0.09 0.00 -1.45 0.00 0.00 41.25 41.96 1gqw s ASN 91 CO 0.34 -0.06 1.19 -0.81 -3.72 0.00 0.00 177.10 174.04 1gqw n PRO 92 N 3.03 0.14 -2.37 0.43 -0.04 -0.76 -1.49 135.00 133.93 1gqw n PRO 92 Ca 0.17 0.12 -0.41 0.00 -0.04 0.00 0.00 63.50 63.35 1gqw n PRO 92 Cb 0.56 -2.43 -0.04 0.00 -0.04 0.00 0.00 33.50 31.56 1gqw n PRO 92 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1gqw s PRO 93 N -4.13 4.53 -0.16 0.54 0.04 -1.26 -4.84 135.00 129.72 1gqw s PRO 93 Ca 0.73 1.91 0.15 0.00 0.04 0.00 0.00 61.00 63.83 1gqw s PRO 93 Cb -0.29 -3.18 0.42 0.00 0.04 0.00 0.00 34.50 31.50 1gqw s PRO 93 CO 0.51 0.04 1.21 -0.40 0.04 0.00 0.00 177.00 178.39 1gqw n ASP 94 N 1.53 1.62 -0.07 6.66 5.75 -1.26 -4.70 116.55 126.07 1gqw n ASP 94 Ca 0.01 -3.42 0.07 0.00 -0.01 0.00 0.00 54.79 51.43 1gqw n ASP 94 Cb 0.44 -0.47 0.10 0.00 -1.03 0.00 0.00 41.12 40.16 1gqw n ASP 94 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1gqw n ASN 95 N -0.71 2.28 -3.59 -1.12 3.02 -1.26 -4.83 115.26 109.05 1gqw n ASN 95 Ca 0.16 -2.72 -0.41 0.00 -0.03 0.00 0.00 54.58 51.59 1gqw n ASN 95 Cb 0.81 -0.29 -0.01 0.00 -0.61 0.00 0.00 39.78 39.68 1gqw n ASN 95 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1gqw n ASP 96 N -1.09 6.45 -3.59 6.41 5.75 -1.18 -1.40 116.55 127.91 1gqw n ASP 96 Ca 0.11 -2.91 -0.11 0.00 -0.01 0.00 0.00 54.79 51.87 1gqw n ASP 96 Cb 0.52 -1.52 -0.06 0.00 -1.03 0.00 0.00 41.12 39.03 1gqw n ASP 96 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1gqw s ASN 97 N 1.65 -0.41 -0.22 -1.12 4.22 -1.26 -4.93 114.94 112.87 1gqw s ASN 97 Ca 0.53 0.58 -0.29 0.00 -2.14 0.00 0.00 52.86 51.54 1gqw s ASN 97 Cb 0.15 0.52 -0.02 0.00 1.28 0.00 0.00 41.25 43.17 1gqw s ASN 97 CO -0.06 -0.29 1.50 0.26 -2.04 0.00 0.00 177.10 176.47 1gqw s TRP 98 N -0.65 2.33 0.14 1.54 0.52 -1.26 -4.45 118.94 117.10 1gqw s TRP 98 Ca -0.01 0.65 -0.11 0.00 0.02 0.00 0.00 56.10 56.65 1gqw s TRP 98 Cb -0.02 -3.90 0.01 0.00 -1.15 0.00 0.00 33.47 28.41 1gqw s TRP 98 CO -0.01 -2.57 0.31 -3.38 0.02 0.00 0.00 176.95 171.32 1gqw s HIS 99 N 4.67 0.14 -0.14 -1.98 -3.43 -1.15 -0.71 115.29 112.69 1gqw s HIS 99 Ca 0.66 -0.52 0.01 0.00 -0.80 0.00 0.00 55.06 54.41 1gqw s HIS 99 Cb -0.23 0.06 -0.00 0.00 -1.43 0.00 0.00 32.58 30.98 1gqw s HIS 99 CO 0.26 -0.69 -0.17 0.99 -2.00 0.00 0.00 174.74 173.13 1gqw s THR 100 N -3.89 2.58 0.14 -5.38 2.01 -1.26 -1.12 115.64 108.72 1gqw s THR 100 Ca 0.10 -0.81 -0.35 0.00 0.31 0.00 0.00 61.69 60.94 1gqw s THR 100 Cb 0.03 -2.07 -0.15 0.00 0.01 0.00 0.00 72.50 70.31 1gqw s THR 100 CO -0.06 0.53 1.39 0.47 -0.69 0.00 0.00 174.62 176.25 1gqw n ASP 101 N 3.91 2.14 -3.51 3.53 8.00 -1.26 -3.83 116.55 125.53 1gqw n ASP 101 Ca -0.19 1.11 -0.26 0.00 0.71 0.00 0.00 54.79 56.16 1gqw n ASP 101 Cb 0.52 -1.29 0.01 0.00 -0.02 0.00 0.00 41.12 40.34 1gqw n ASP 101 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1gqw n VAL 102 N 2.55 -2.98 -0.18 2.53 0.31 -1.26 -4.44 118.33 114.85 1gqw n VAL 102 Ca 0.17 0.01 0.09 0.00 -0.01 0.00 0.00 64.34 64.60 1gqw n VAL 102 Cb 0.24 -2.68 0.23 0.00 -0.91 0.00 0.00 33.84 30.72 1gqw n VAL 102 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1gqw n THR 103 N -1.68 0.89 0.06 2.52 -2.24 -1.25 -4.02 114.28 108.56 1gqw n THR 103 Ca -0.22 -0.95 0.05 0.00 -2.27 0.00 0.00 64.05 60.66 1gqw n THR 103 Cb 0.61 0.60 0.23 0.00 -2.10 0.00 0.00 70.33 69.67 1gqw n THR 103 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 1gqw n PHE 104 N 1.17 1.08 -4.39 4.78 1.16 -1.26 -4.84 117.46 115.16 1gqw n PHE 104 Ca 0.18 -0.40 -0.25 0.00 -1.87 0.00 0.00 57.45 55.12 1gqw n PHE 104 Cb 0.53 -0.26 -0.11 0.00 -1.61 0.00 0.00 39.48 38.03 1gqw n PHE 104 CO 0.00 0.00 0.00 0.96 -1.87 0.00 0.00 176.76 175.85 1gqw s ILE 105 N -1.88 2.15 0.37 1.97 -4.36 -1.26 -4.74 121.20 113.46 1gqw s ILE 105 Ca 0.32 -2.01 0.09 0.00 -0.26 0.00 0.00 60.65 58.79 1gqw s ILE 105 Cb 0.22 -2.02 0.32 0.00 1.25 0.00 0.00 42.46 42.23 1gqw s ILE 105 CO 0.12 -0.21 1.92 -0.08 0.24 0.00 0.00 174.94 176.93 1gqw h GLU 106 N 3.17 0.64 -2.28 0.37 4.81 -1.95 -3.16 114.58 116.18 1gqw h GLU 106 Ca -0.44 -0.04 -0.60 0.00 -0.13 0.00 0.00 59.36 58.15 1gqw h GLU 106 Cb 1.21 -0.14 -0.42 0.00 0.63 0.00 0.00 28.75 30.03 1gqw h GLU 106 CO 0.50 0.42 -0.67 -2.37 -0.73 0.00 0.00 179.01 176.16 1gqw n THR 107 N -4.51 1.80 -1.59 0.32 5.66 -1.26 -4.50 114.28 110.20 1gqw n THR 107 Ca 0.14 -4.98 -0.44 0.00 -3.05 0.00 0.00 64.05 55.72 1gqw n THR 107 Cb 0.38 -2.08 -0.01 0.00 -1.55 0.00 0.00 70.33 67.07 1gqw n THR 107 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1gqw n PRO 108 N 1.10 1.35 -1.60 1.09 -0.04 -1.20 -3.97 135.00 131.74 1gqw n PRO 108 Ca 0.28 0.48 -0.47 0.00 -0.04 0.00 0.00 63.50 63.75 1gqw n PRO 108 Cb 0.42 -1.89 -0.03 0.00 -0.04 0.00 0.00 33.50 31.96 1gqw n PRO 108 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1gqw n PRO 109 N 0.58 1.37 -0.15 0.54 -0.04 -1.26 -3.39 135.00 132.67 1gqw n PRO 109 Ca 0.09 0.49 0.11 0.00 -0.04 0.00 0.00 63.50 64.15 1gqw n PRO 109 Cb 0.34 -1.97 0.29 0.00 -0.04 0.00 0.00 33.50 32.12 1gqw n PRO 109 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1gqw n ALA 110 N 1.11 2.47 0.00 0.55 0.00 -0.09 -4.22 120.51 120.32 1gqw n ALA 110 Ca 0.12 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.82 1gqw n ALA 110 Cb 0.28 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1gqw n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gqw n GLY 111 N 1.29 0.50 3.35 0.00 0.00 -1.14 -2.46 105.19 106.73 1gqw n GLY 111 Ca 0.17 -0.75 -0.11 0.00 0.00 0.00 0.00 46.02 45.33 1gqw n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gqw s ALA 112 N -2.00 -1.03 -0.12 4.61 0.00 -1.12 -0.31 121.76 121.78 1gqw s ALA 112 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 51.96 51.98 1gqw s ALA 112 Cb 0.00 0.74 0.03 0.00 0.00 0.00 0.00 23.12 23.89 1gqw s ALA 112 CO 0.00 -0.68 -0.08 0.42 0.00 0.00 0.00 175.76 175.42 1gqw s ILE 113 N -3.80 1.10 -0.16 0.00 1.01 0.11 -3.03 121.20 116.43 1gqw s ILE 113 Ca 0.03 -0.35 -0.05 0.00 0.00 0.00 0.00 60.65 60.28 1gqw s ILE 113 Cb 0.01 -1.11 -0.03 0.00 0.01 0.00 0.00 42.46 41.33 1gqw s ILE 113 CO -0.11 0.36 0.02 -0.22 0.00 0.00 0.00 174.94 174.99 1gqw s LEU 114 N 1.68 3.59 -0.18 2.97 2.96 0.98 -0.02 118.68 130.66 1gqw s LEU 114 Ca 0.05 0.02 -0.01 0.00 -0.22 0.00 0.00 54.13 53.97 1gqw s LEU 114 Cb -0.13 -1.88 0.00 0.00 0.50 0.00 0.00 46.19 44.69 1gqw s LEU 114 CO -0.08 0.20 -0.14 0.00 -1.32 0.00 0.00 176.35 175.01 1gqw s ALA 115 N 0.17 2.52 -0.93 5.97 0.00 0.44 -0.74 121.76 129.19 1gqw s ALA 115 Ca 0.02 -1.15 -0.24 0.00 0.00 0.00 0.00 51.96 50.59 1gqw s ALA 115 Cb -0.13 -1.34 0.03 0.00 0.00 0.00 0.00 23.12 21.68 1gqw s ALA 115 CO 0.01 -0.26 1.52 0.00 0.00 0.00 0.00 175.76 177.04 1gqw s ALA 116 N 1.18 2.51 0.00 0.00 0.00 -0.12 -1.94 121.76 123.39 1gqw s ALA 116 Ca 0.02 -1.90 0.00 0.00 0.00 0.00 0.00 51.96 50.08 1gqw s ALA 116 Cb -0.14 -4.48 0.00 0.00 0.00 0.00 0.00 23.12 18.50 1gqw s ALA 116 CO -0.06 -3.78 0.24 1.63 0.00 0.00 0.00 175.76 173.79 1gqw n LYS 117 N 8.98 0.00 -4.35 0.00 4.76 -0.61 -0.18 118.16 126.77 1gqw n LYS 117 Ca 0.28 0.41 -0.30 0.00 -2.87 0.00 0.00 58.31 55.84 1gqw n LYS 117 Cb 0.50 -1.04 -0.17 0.00 -1.84 0.00 0.00 35.03 32.48 1gqw n LYS 117 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1gqw s GLU 118 N -1.30 2.39 0.30 1.97 2.12 -0.77 -4.49 118.70 118.91 1gqw s GLU 118 Ca 0.00 -0.61 0.08 0.00 0.36 0.00 0.00 54.97 54.80 1gqw s GLU 118 Cb 0.00 -2.05 -0.04 0.00 0.26 0.00 0.00 34.13 32.30 1gqw s GLU 118 CO 0.00 -0.11 0.12 -0.51 -0.54 0.00 0.00 175.26 174.21 1gqw s LEU 119 N 1.12 3.37 0.60 2.70 1.43 -1.26 0.09 118.68 126.72 1gqw s LEU 119 Ca -0.03 -0.61 -0.00 0.00 -1.03 0.00 0.00 54.13 52.46 1gqw s LEU 119 Cb -0.14 -1.88 0.05 0.00 0.03 0.00 0.00 46.19 44.24 1gqw s LEU 119 CO -0.05 -0.15 0.84 -2.16 0.23 0.00 0.00 176.35 175.06 1gqw s PRO 120 N -3.80 2.38 0.23 1.29 0.04 -1.23 -4.89 135.00 129.01 1gqw s PRO 120 Ca 0.35 -0.73 -0.18 0.00 0.04 0.00 0.00 61.00 60.48 1gqw s PRO 120 Cb -0.05 -2.41 0.23 0.00 0.04 0.00 0.00 34.50 32.31 1gqw s PRO 120 CO 0.22 -0.89 1.55 0.77 0.04 0.00 0.00 177.00 178.69 1gqw h SER 121 N -0.12 -1.47 -5.07 6.66 0.02 -1.93 -3.44 113.55 108.20 1gqw h SER 121 Ca -0.42 0.31 0.05 0.00 -0.84 0.00 0.00 61.79 60.89 1gqw h SER 121 Cb 1.30 0.77 -0.03 0.00 0.14 0.00 0.00 62.40 64.57 1gqw h SER 121 CO 0.52 -0.29 0.30 0.42 -1.14 0.00 0.00 176.83 176.65 1gqw s THR 122 N -5.93 0.00 0.00 -2.27 -4.23 -1.26 -5.15 115.64 96.80 1gqw s THR 122 Ca -0.14 -0.93 0.00 0.00 -1.18 0.00 0.00 61.69 59.44 1gqw s THR 122 Cb 0.20 -2.46 0.00 0.00 1.34 0.00 0.00 72.50 71.58 1gqw s THR 122 CO 0.71 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.40 1gqw n GLY 123 N -0.51 -0.78 4.00 3.99 0.00 -1.26 -4.72 105.19 105.91 1gqw n GLY 123 Ca -0.06 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.34 1gqw n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gqw n GLY 124 N 0.00 0.70 2.74 -0.02 0.00 -1.26 -4.65 105.19 102.71 1gqw n GLY 124 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1gqw n GLY 124 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gqw n ASP 125 N 0.00 -2.53 -4.00 1.61 9.92 -1.26 -4.24 116.55 116.05 1gqw n ASP 125 Ca 0.00 0.65 -0.20 0.00 -0.53 0.00 0.00 54.79 54.71 1gqw n ASP 125 Cb 0.00 -0.73 -0.15 0.00 -0.64 0.00 0.00 41.12 39.60 1gqw n ASP 125 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1gqw s THR 126 N -1.45 0.75 0.20 -3.53 2.01 -1.07 0.13 115.64 112.67 1gqw s THR 126 Ca 0.49 -0.36 0.11 0.00 0.31 0.00 0.00 61.69 62.24 1gqw s THR 126 Cb -0.51 -0.66 -0.04 0.00 0.01 0.00 0.00 72.50 71.30 1gqw s THR 126 CO 0.53 0.23 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.70 1gqw s LEU 127 N 0.10 2.45 -0.03 4.42 1.43 0.17 -1.02 118.68 126.19 1gqw s LEU 127 Ca -0.01 -0.88 0.03 0.00 -1.03 0.00 0.00 54.13 52.23 1gqw s LEU 127 Cb -0.07 -1.10 0.00 0.00 0.03 0.00 0.00 46.19 45.05 1gqw s LEU 127 CO 0.00 0.08 -0.12 0.26 0.23 0.00 0.00 176.35 176.81 1gqw s TRP 128 N -1.82 1.23 -0.03 0.29 0.51 -0.13 -0.23 118.94 118.76 1gqw s TRP 128 Ca 0.21 -0.34 0.06 0.00 -2.12 0.00 0.00 56.10 53.91 1gqw s TRP 128 Cb -0.07 -0.86 -0.02 0.00 -0.81 0.00 0.00 33.47 31.70 1gqw s TRP 128 CO 0.10 -0.14 -0.20 -0.08 -0.51 0.00 0.00 176.95 176.13 1gqw s THR 129 N 0.20 2.61 -0.27 2.01 -1.32 0.34 -0.95 115.64 118.26 1gqw s THR 129 Ca -0.04 -0.92 -0.23 0.00 -1.21 0.00 0.00 61.69 59.29 1gqw s THR 129 Cb -0.10 -1.98 -0.01 0.00 -1.51 0.00 0.00 72.50 68.90 1gqw s THR 129 CO 0.01 0.57 0.77 -0.55 -2.21 0.00 0.00 174.62 173.21 1gqw s SER 130 N -0.72 6.71 0.31 8.08 0.15 0.38 -1.67 113.70 126.93 1gqw s SER 130 Ca 0.11 0.82 0.07 0.00 0.70 0.00 0.00 55.95 57.65 1gqw s SER 130 Cb -0.10 -2.40 0.50 0.00 -1.71 0.00 0.00 66.02 62.30 1gqw s SER 130 CO 0.00 -0.52 1.73 1.23 1.20 0.00 0.00 173.24 176.89 1gqw h GLY 131 N 9.22 0.27 0.91 9.45 0.00 -0.86 -1.77 103.07 120.30 1gqw h GLY 131 Ca -0.24 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 46.83 1gqw h GLY 131 CO 0.85 0.22 -0.14 -2.22 0.00 0.00 0.00 176.54 175.25 1gqw h ILE 132 N 0.22 0.73 -0.56 2.60 2.04 -1.77 -0.44 117.51 120.33 1gqw h ILE 132 Ca 0.02 -0.18 -0.04 0.00 1.00 0.00 0.00 64.86 65.66 1gqw h ILE 132 Cb 0.74 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 1gqw h ILE 132 CO 0.06 0.04 0.20 0.00 0.00 0.00 0.00 178.15 178.45 1gqw h ALA 133 N 0.19 0.73 -0.98 1.87 0.00 -1.86 -1.12 119.26 118.09 1gqw h ALA 133 Ca -0.04 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 54.79 1gqw h ALA 133 Cb 0.37 -0.22 -0.08 0.00 0.00 0.00 0.00 17.79 17.86 1gqw h ALA 133 CO 0.07 0.36 0.62 0.00 0.00 0.00 0.00 179.25 180.29 1gqw h ALA 134 N 1.06 1.42 -0.31 0.00 0.00 -1.22 -1.32 119.26 118.88 1gqw h ALA 134 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 1gqw h ALA 134 Cb 0.23 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1gqw h ALA 134 CO -0.01 0.30 -0.20 -0.92 0.00 0.00 0.00 179.25 178.42 1gqw h TYR 135 N 1.04 0.79 0.00 0.00 5.03 -0.49 -2.74 116.97 120.61 1gqw h TYR 135 Ca 0.46 -0.21 -0.01 0.00 2.58 0.00 0.00 58.73 61.55 1gqw h TYR 135 Cb 0.34 -0.18 -0.00 0.00 1.55 0.00 0.00 36.73 38.44 1gqw h TYR 135 CO -0.01 0.92 -0.05 0.93 -1.32 0.00 0.00 178.16 178.64 1gqw h GLU 136 N 0.44 0.00 0.00 1.82 5.08 -0.48 -1.28 114.58 120.15 1gqw h GLU 136 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1gqw h GLU 136 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 1gqw h GLU 136 CO 0.05 0.05 0.00 0.00 -1.00 0.00 0.00 179.01 178.11 1gqw n ALA 137 N -2.27 2.30 -1.84 3.43 0.00 -0.57 -4.81 120.51 116.75 1gqw n ALA 137 Ca -0.02 -0.11 -0.40 0.00 0.00 0.00 0.00 53.44 52.91 1gqw n ALA 137 Cb 0.15 -1.45 -0.06 0.00 0.00 0.00 0.00 19.45 18.09 1gqw n ALA 137 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1gqw s LEU 138 N -2.89 4.62 0.95 0.00 1.43 -0.49 -5.02 118.68 117.28 1gqw s LEU 138 Ca 0.17 1.94 -0.11 0.00 -1.03 0.00 0.00 54.13 55.10 1gqw s LEU 138 Cb 0.18 -3.61 0.16 0.00 0.03 0.00 0.00 46.19 42.96 1gqw s LEU 138 CO 0.49 0.11 1.12 -0.94 0.23 0.00 0.00 176.35 177.36 1gqw s SER 139 N -0.97 2.68 0.09 2.29 1.04 -1.26 -4.69 113.70 112.88 1gqw s SER 139 Ca 0.42 2.03 -0.30 0.00 0.48 0.00 0.00 55.95 58.58 1gqw s SER 139 Cb -0.26 -2.51 -0.14 0.00 0.10 0.00 0.00 66.02 63.21 1gqw s SER 139 CO 0.32 -3.23 1.63 0.58 0.98 0.00 0.00 173.24 173.52 1gqw h VAL 140 N -1.96 0.36 -1.02 5.02 2.07 -1.96 -1.28 116.25 117.49 1gqw h VAL 140 Ca -0.47 0.00 0.28 0.00 0.82 0.00 0.00 66.70 67.33 1gqw h VAL 140 Cb 1.28 0.36 -0.06 0.00 -1.52 0.00 0.00 31.29 31.35 1gqw h VAL 140 CO 0.44 0.00 0.71 1.55 0.02 0.00 0.00 177.57 180.29 1gqw h PRO 141 N -0.69 0.15 -0.06 1.57 0.13 -2.00 0.28 132.00 131.39 1gqw h PRO 141 Ca -0.03 -0.01 -0.22 0.00 -0.87 0.00 0.00 66.00 64.87 1gqw h PRO 141 Cb 0.60 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.70 1gqw h PRO 141 CO -0.01 0.10 -0.86 0.74 -0.23 0.00 0.00 178.00 177.74 1gqw h PHE 142 N 0.16 0.76 -0.73 1.56 -1.00 -1.69 -0.90 116.94 115.09 1gqw h PHE 142 Ca 0.52 -0.37 -0.04 0.00 2.81 0.00 0.00 57.97 60.89 1gqw h PHE 142 Cb 1.76 -0.10 -0.03 0.00 3.61 0.00 0.00 35.95 41.18 1gqw h PHE 142 CO -0.00 1.18 0.30 0.00 -1.61 0.00 0.00 178.31 178.18 1gqw h ARG 143 N 0.34 1.08 0.47 1.51 3.08 0.58 0.25 114.38 121.70 1gqw h ARG 143 Ca -0.07 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 59.77 1gqw h ARG 143 Cb 1.48 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 31.35 1gqw h ARG 143 CO 0.16 0.88 -0.23 1.96 -1.07 0.00 0.00 179.97 181.67 1gqw h GLN 144 N 1.04 -0.61 -0.99 0.04 4.20 -1.01 0.15 115.11 117.92 1gqw h GLN 144 Ca 0.24 0.04 0.19 0.00 0.06 0.00 0.00 58.65 59.19 1gqw h GLN 144 Cb 0.19 0.14 -0.11 0.00 0.30 0.00 0.00 27.48 28.00 1gqw h GLN 144 CO -0.02 -0.32 0.59 1.25 -0.67 0.00 0.00 178.83 179.66 1gqw h LEU 145 N -0.83 0.75 0.12 1.46 7.12 -0.79 -2.83 115.31 120.31 1gqw h LEU 145 Ca -0.06 0.10 -0.20 0.00 0.13 0.00 0.00 57.88 57.84 1gqw h LEU 145 Cb 0.57 -0.03 0.01 0.00 -0.53 0.00 0.00 40.66 40.68 1gqw h LEU 145 CO 0.11 0.25 -0.97 -0.07 -0.13 0.00 0.00 178.44 177.63 1gqw h LEU 146 N 0.73 0.40 -8.92 2.25 3.38 -0.38 -3.41 115.31 109.35 1gqw h LEU 146 Ca 0.58 -0.91 -0.61 0.00 0.09 0.00 0.00 57.88 57.03 1gqw h LEU 146 Cb 0.92 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 1gqw h LEU 146 CO -0.40 1.44 1.43 -1.20 0.09 0.00 0.00 178.44 179.80 1gqw n SER 147 N -4.10 3.06 0.00 -0.43 7.64 0.51 -1.52 113.62 118.77 1gqw n SER 147 Ca -0.18 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.07 1gqw n SER 147 Cb 0.82 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.55 1gqw n SER 147 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1gqw n GLY 148 N 5.77 1.12 3.72 0.23 0.00 -1.26 -4.89 105.19 109.88 1gqw n GLY 148 Ca 0.31 -0.30 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 1gqw n GLY 148 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gqw s LEU 149 N 0.00 2.73 0.05 0.99 1.43 -0.58 -4.87 118.68 118.43 1gqw s LEU 149 Ca 0.00 1.82 0.07 0.00 -1.03 0.00 0.00 54.13 54.99 1gqw s LEU 149 Cb 0.00 -4.35 -0.03 0.00 0.03 0.00 0.00 46.19 41.84 1gqw s LEU 149 CO 0.00 -2.50 -0.19 -0.13 0.23 0.00 0.00 176.35 173.76 1gqw s ARG 150 N -4.84 1.24 0.05 1.70 0.52 -1.26 -1.16 118.95 115.21 1gqw s ARG 150 Ca 0.63 -0.92 0.06 0.00 -0.52 0.00 0.00 55.73 54.99 1gqw s ARG 150 Cb -0.19 -1.35 -0.02 0.00 0.52 0.00 0.00 34.95 33.91 1gqw s ARG 150 CO 0.57 0.34 -0.18 0.00 0.02 0.00 0.00 175.30 176.05 1gqw s ALA 151 N -0.86 1.53 0.08 2.13 0.00 -0.22 -1.38 121.76 123.04 1gqw s ALA 151 Ca 0.06 -0.99 -0.23 0.00 0.00 0.00 0.00 51.96 50.79 1gqw s ALA 151 Cb -0.09 -0.26 -0.06 0.00 0.00 0.00 0.00 23.12 22.70 1gqw s ALA 151 CO 0.02 0.32 0.70 -2.00 0.00 0.00 0.00 175.76 174.80 1gqw s GLU 152 N -1.26 4.43 -0.06 0.00 2.12 -0.08 -1.59 118.70 122.26 1gqw s GLU 152 Ca 0.05 0.97 0.05 0.00 0.36 0.00 0.00 54.97 56.41 1gqw s GLU 152 Cb -0.09 -3.30 -0.01 0.00 0.26 0.00 0.00 34.13 30.99 1gqw s GLU 152 CO 0.02 0.46 -0.23 -1.01 -0.54 0.00 0.00 175.26 173.95 1gqw s HIS 153 N -0.62 2.49 -0.11 5.30 3.76 0.06 -0.23 115.29 125.94 1gqw s HIS 153 Ca 0.34 -0.68 -0.01 0.00 -0.15 0.00 0.00 55.06 54.57 1gqw s HIS 153 Cb -0.21 -1.62 0.03 0.00 1.11 0.00 0.00 32.58 31.89 1gqw s HIS 153 CO 0.22 -0.19 -0.05 0.34 -0.85 0.00 0.00 174.74 174.21 1gqw s ASP 154 N -0.16 2.12 0.40 1.40 -1.08 -0.86 -2.14 116.67 116.35 1gqw s ASP 154 Ca -0.03 -0.30 0.16 0.00 -0.52 0.00 0.00 52.55 51.86 1gqw s ASP 154 Cb -0.14 -0.74 1.04 0.00 -1.46 0.00 0.00 42.92 41.62 1gqw s ASP 154 CO 0.04 -0.15 1.84 0.15 0.52 0.00 0.00 175.17 177.56 1gqw h PHE 155 N 8.21 0.62 0.00 -5.34 3.57 -1.87 -0.41 116.94 121.71 1gqw h PHE 155 Ca -0.26 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.26 1gqw h PHE 155 Cb 1.13 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.68 1gqw h PHE 155 CO 0.47 0.15 0.00 0.00 -2.23 0.00 0.00 178.31 176.70 1gqw h ARG 156 N 0.45 0.00 -0.60 1.11 3.08 -1.90 -2.67 114.38 113.85 1gqw h ARG 156 Ca 0.50 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.45 1gqw h ARG 156 Cb 1.17 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.20 1gqw h ARG 156 CO -0.21 0.00 -0.01 -0.22 -1.07 0.00 0.00 179.97 178.46 1gqw h LYS 157 N 0.00 1.07 -0.19 0.04 3.64 -1.36 -1.93 116.57 117.85 1gqw h LYS 157 Ca 0.00 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 1gqw h LYS 157 Cb 0.31 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1gqw h LYS 157 CO 0.00 1.05 0.00 0.45 -2.27 0.00 0.00 179.45 178.68 1gqw n SER 158 N -4.18 3.05 -3.10 4.20 2.88 -1.18 -4.44 113.62 110.85 1gqw n SER 158 Ca 0.03 -1.93 -0.16 0.00 -1.33 0.00 0.00 58.87 55.47 1gqw n SER 158 Cb 0.35 -0.11 -0.01 0.00 -0.75 0.00 0.00 64.21 63.70 1gqw n SER 158 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 1gqw n PHE 159 N 1.28 -0.41 -0.71 0.66 3.01 -1.01 -5.12 117.46 115.15 1gqw n PHE 159 Ca 0.15 -3.49 -0.32 0.00 1.01 0.00 0.00 57.45 54.80 1gqw n PHE 159 Cb 0.56 -0.03 0.15 0.00 -0.01 0.00 0.00 39.48 40.15 1gqw n PHE 159 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1gqw n PRO 160 N 0.34 -0.68 0.47 -1.08 -0.04 -0.74 -4.54 135.00 128.74 1gqw n PRO 160 Ca 0.21 -0.15 -0.19 0.00 -0.04 0.00 0.00 63.50 63.34 1gqw n PRO 160 Cb 0.66 -2.04 -0.09 0.00 -0.04 0.00 0.00 33.50 32.00 1gqw n PRO 160 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1gqw h GLU 161 N -1.83 -1.16 -1.72 0.54 5.08 -1.99 -3.18 114.58 110.32 1gqw h GLU 161 Ca -0.46 0.08 0.51 0.00 -1.00 0.00 0.00 59.36 58.49 1gqw h GLU 161 Cb 1.29 0.26 -0.08 0.00 0.50 0.00 0.00 28.75 30.73 1gqw h GLU 161 CO 0.38 -0.78 1.22 0.10 -1.00 0.00 0.00 179.01 178.94 1gqw h TYR 162 N -1.21 0.07 0.00 4.33 -0.00 -2.00 0.18 116.97 118.34 1gqw h TYR 162 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.61 1gqw h TYR 162 Cb 0.93 -0.02 0.00 0.00 0.00 0.00 0.00 36.73 37.64 1gqw h TYR 162 CO 0.02 -0.03 0.00 1.63 -0.00 0.00 0.00 178.16 179.78 1gqw n LYS 163 N -4.09 0.02 -2.42 0.10 5.02 -1.20 -3.33 118.16 112.25 1gqw n LYS 163 Ca 0.39 0.26 -0.13 0.00 -2.02 0.00 0.00 58.31 56.81 1gqw n LYS 163 Cb 1.77 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 35.32 1gqw n LYS 163 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1gqw n TYR 164 N -1.48 2.07 -0.27 2.13 4.02 0.63 -4.66 117.16 119.59 1gqw n TYR 164 Ca 0.04 -2.25 0.10 0.00 -0.01 0.00 0.00 57.90 55.77 1gqw n TYR 164 Cb 0.16 -0.28 0.26 0.00 -0.02 0.00 0.00 39.34 39.45 1gqw n TYR 164 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1gqw n ARG 165 N -0.63 2.75 -2.87 -0.72 1.74 -1.21 -1.11 116.66 114.62 1gqw n ARG 165 Ca 0.26 -2.43 -0.43 0.00 -0.77 0.00 0.00 57.85 54.48 1gqw n ARG 165 Cb 0.88 -1.46 -0.04 0.00 -1.02 0.00 0.00 32.46 30.82 1gqw n ARG 165 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 1gqw s LYS 166 N -1.02 3.22 0.00 5.56 0.00 -1.26 -4.55 119.74 121.70 1gqw s LYS 166 Ca 0.39 -1.04 0.00 0.00 0.00 0.00 0.00 55.97 55.33 1gqw s LYS 166 Cb 0.21 -4.40 0.00 0.00 0.00 0.00 0.00 37.83 33.63 1gqw s LYS 166 CO 0.27 -1.82 0.00 -2.37 0.00 0.00 0.00 175.35 171.43 1gqw n THR 167 N 5.86 -2.22 -0.17 3.79 5.66 -1.26 -4.63 114.28 121.31 1gqw n THR 167 Ca 0.03 0.00 0.27 0.00 -3.05 0.00 0.00 64.05 61.29 1gqw n THR 167 Cb 0.46 -2.65 0.46 0.00 -1.55 0.00 0.00 70.33 67.05 1gqw n THR 167 CO 0.00 0.00 0.00 1.05 -3.05 0.00 0.00 175.07 173.07 1gqw h GLU 168 N 0.00 0.00 -0.33 1.09 -0.00 -1.91 1.68 114.58 115.11 1gqw h GLU 168 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1gqw h GLU 168 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 1gqw h GLU 168 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 179.01 177.10 1gqw n GLU 169 N -3.27 0.50 0.11 1.06 0.00 -1.26 -2.28 120.64 115.50 1gqw n GLU 169 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.37 1gqw n GLU 169 Cb 1.43 -1.16 0.00 0.00 0.00 0.00 0.00 31.44 31.71 1gqw n GLU 169 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1gqw n GLU 170 N -0.01 0.00 0.00 5.31 2.13 0.57 -4.41 120.64 124.23 1gqw n GLU 170 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1gqw n GLU 170 Cb 0.08 -0.19 0.00 0.00 0.27 0.00 0.00 31.44 31.61 1gqw n GLU 170 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 1gqw n HIS 171 N -3.49 0.00 -0.11 4.31 -0.00 -0.26 0.13 115.22 115.79 1gqw n HIS 171 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 57.72 57.58 1gqw n HIS 171 Cb 0.00 -0.24 -0.14 0.00 -0.00 0.00 0.00 29.99 29.61 1gqw n HIS 171 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1gqw n GLN 172 N -1.22 0.67 0.12 -0.41 10.64 -0.97 -3.16 117.38 123.05 1gqw n GLN 172 Ca 0.00 0.09 -0.02 0.00 -1.83 0.00 0.00 57.00 55.24 1gqw n GLN 172 Cb 0.02 -1.54 0.11 0.00 -0.86 0.00 0.00 30.24 27.98 1gqw n GLN 172 CO 0.00 0.00 0.00 -0.09 -1.83 0.00 0.00 177.06 175.14 1gqw h ARG 173 N 0.00 0.00 0.49 2.61 2.43 0.85 -3.02 114.38 117.74 1gqw h ARG 173 Ca -0.55 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.59 1gqw h ARG 173 Cb 2.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.61 1gqw h ARG 173 CO -0.03 0.69 -0.23 2.35 -1.51 0.00 0.00 179.97 181.24 1gqw h TRP 174 N 0.00 -0.61 -1.13 2.20 7.01 0.88 -2.74 115.95 121.57 1gqw h TRP 174 Ca -0.01 -0.01 0.32 0.00 2.11 0.00 0.00 58.89 61.30 1gqw h TRP 174 Cb 1.24 0.20 -0.10 0.00 -2.10 0.00 0.00 29.16 28.40 1gqw h TRP 174 CO 0.00 -0.38 0.74 0.00 -2.79 0.00 0.00 178.44 176.01 1gqw h ARG 175 N -0.97 0.27 -0.03 2.65 2.47 -1.63 0.18 114.38 117.32 1gqw h ARG 175 Ca -0.07 -0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 58.64 1gqw h ARG 175 Cb 0.50 -0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 28.76 1gqw h ARG 175 CO 0.11 0.18 0.02 0.93 0.56 0.00 0.00 179.97 181.76 1gqw h GLU 176 N 0.27 0.05 -0.05 0.04 5.08 -1.46 -1.37 114.58 117.14 1gqw h GLU 176 Ca 0.65 -0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.92 1gqw h GLU 176 Cb 1.86 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 31.09 1gqw h GLU 176 CO -0.30 0.12 -0.34 0.00 -1.00 0.00 0.00 179.01 177.49 1gqw h ALA 177 N 0.93 1.35 0.52 3.43 0.00 -0.40 -2.62 119.26 122.47 1gqw h ALA 177 Ca 0.01 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 1gqw h ALA 177 Cb 0.09 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.81 1gqw h ALA 177 CO -0.00 0.47 -0.25 0.28 0.00 0.00 0.00 179.25 179.75 1gqw h VAL 178 N 0.08 0.00 -0.51 0.00 2.07 -0.83 -2.22 116.25 114.85 1gqw h VAL 178 Ca 0.01 -0.22 0.15 0.00 0.82 0.00 0.00 66.70 67.46 1gqw h VAL 178 Cb 0.64 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1gqw h VAL 178 CO 0.05 0.00 0.40 0.00 0.02 0.00 0.00 177.57 178.03 1gqw h ALA 179 N -1.46 2.41 -0.01 1.67 0.00 -1.29 0.31 119.26 120.90 1gqw h ALA 179 Ca -0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1gqw h ALA 179 Cb 0.54 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1gqw h ALA 179 CO 0.12 -0.66 -0.04 0.36 0.00 0.00 0.00 179.25 179.03 1gqw n LYS 180 N -4.22 1.30 -2.96 0.00 2.85 -0.99 -4.25 118.16 109.89 1gqw n LYS 180 Ca 0.09 -0.60 -0.14 0.00 -1.05 0.00 0.00 58.31 56.62 1gqw n LYS 180 Cb 0.61 -1.49 0.01 0.00 -0.65 0.00 0.00 35.03 33.52 1gqw n LYS 180 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1gqw n ASN 181 N -0.33 0.37 -4.63 -5.58 3.02 0.11 -5.05 115.26 103.17 1gqw n ASN 181 Ca 0.19 -2.99 -0.30 0.00 -0.03 0.00 0.00 54.58 51.44 1gqw n ASN 181 Cb 0.29 -0.14 0.19 0.00 -0.61 0.00 0.00 39.78 39.50 1gqw n ASN 181 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1gqw s PRO 182 N -2.07 0.57 0.49 3.52 0.04 -1.13 -4.47 135.00 131.94 1gqw s PRO 182 Ca 0.33 1.41 -0.24 0.00 0.04 0.00 0.00 61.00 62.54 1gqw s PRO 182 Cb 0.37 -1.69 -0.07 0.00 0.04 0.00 0.00 34.50 33.16 1gqw s PRO 182 CO -0.05 -2.89 1.35 -1.25 0.04 0.00 0.00 177.00 174.20 1gqw s PRO 183 N -4.60 3.49 0.32 0.56 0.04 -1.26 -4.85 135.00 128.71 1gqw s PRO 183 Ca 0.67 2.23 0.06 0.00 0.04 0.00 0.00 61.00 64.00 1gqw s PRO 183 Cb -0.23 -2.47 -0.03 0.00 0.04 0.00 0.00 34.50 31.81 1gqw s PRO 183 CO 0.59 -0.91 0.29 -0.48 0.04 0.00 0.00 177.00 176.54 1gqw s LEU 184 N -3.06 1.63 -0.04 -3.56 2.34 -0.91 -4.95 118.68 110.13 1gqw s LEU 184 Ca 0.65 -1.70 0.02 0.00 0.06 0.00 0.00 54.13 53.16 1gqw s LEU 184 Cb -0.40 0.65 -0.03 0.00 -0.56 0.00 0.00 46.19 45.85 1gqw s LEU 184 CO 0.49 -1.07 -0.07 -0.76 -1.06 0.00 0.00 176.35 173.88 1gqw s LEU 185 N -3.34 3.17 0.01 1.48 1.43 -1.26 -0.76 118.68 119.41 1gqw s LEU 185 Ca 0.40 -0.07 0.02 0.00 -1.03 0.00 0.00 54.13 53.44 1gqw s LEU 185 Cb 0.02 -1.74 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 1gqw s LEU 185 CO 0.26 0.33 -0.05 -1.00 0.23 0.00 0.00 176.35 176.11 1gqw s HIS 186 N -0.89 0.47 0.35 0.29 3.76 -0.62 -4.95 115.29 113.70 1gqw s HIS 186 Ca 0.14 -0.26 -0.28 0.00 -0.15 0.00 0.00 55.06 54.51 1gqw s HIS 186 Cb -0.11 -0.29 -0.11 0.00 1.11 0.00 0.00 32.58 33.18 1gqw s HIS 186 CO 0.04 -0.05 1.44 -1.25 -0.85 0.00 0.00 174.74 174.07 1gqw s PRO 187 N -0.74 4.19 0.41 8.40 0.04 -1.26 -1.06 135.00 144.99 1gqw s PRO 187 Ca -0.04 2.46 0.11 0.00 0.04 0.00 0.00 61.00 63.57 1gqw s PRO 187 Cb -0.05 -3.01 0.88 0.00 0.04 0.00 0.00 34.50 32.36 1gqw s PRO 187 CO -0.00 -0.44 1.97 0.28 0.04 0.00 0.00 177.00 178.85 1gqw h VAL 188 N 3.05 1.14 -3.53 -0.36 2.07 -1.41 -3.38 116.25 113.84 1gqw h VAL 188 Ca -0.50 -0.62 -0.64 0.00 0.82 0.00 0.00 66.70 65.76 1gqw h VAL 188 Cb 1.23 1.15 -0.37 0.00 -1.52 0.00 0.00 31.29 31.79 1gqw h VAL 188 CO 0.66 0.19 -0.81 -0.69 0.02 0.00 0.00 177.57 176.94 1gqw s VAL 189 N -4.81 1.87 0.04 2.57 1.01 -1.26 -0.20 120.40 119.62 1gqw s VAL 189 Ca -0.05 -1.22 -0.05 0.00 0.00 0.00 0.00 61.98 60.66 1gqw s VAL 189 Cb 0.16 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.56 1gqw s VAL 189 CO 0.72 0.14 0.27 -0.60 0.00 0.00 0.00 175.10 175.63 1gqw s ARG 190 N 1.28 3.55 -0.12 2.72 3.52 0.09 -4.40 118.95 125.59 1gqw s ARG 190 Ca -0.03 -0.15 -0.05 0.00 -0.13 0.00 0.00 55.73 55.37 1gqw s ARG 190 Cb -0.17 -3.03 -0.04 0.00 -1.56 0.00 0.00 34.95 30.15 1gqw s ARG 190 CO -0.08 0.61 0.05 0.99 -0.81 0.00 0.00 175.30 176.06 1gqw s THR 191 N -1.40 4.69 -0.07 4.11 2.01 0.50 -1.49 115.64 123.99 1gqw s THR 191 Ca 0.31 -0.09 -0.30 0.00 0.31 0.00 0.00 61.69 61.92 1gqw s THR 191 Cb -0.13 -3.03 -0.05 0.00 0.01 0.00 0.00 72.50 69.30 1gqw s THR 191 CO 0.20 0.56 1.53 -2.28 -0.69 0.00 0.00 174.62 173.94 1gqw s HIS 192 N -0.51 2.31 0.25 4.92 2.46 -0.19 -4.51 115.29 120.02 1gqw s HIS 192 Ca 0.10 0.47 -0.09 0.00 0.47 0.00 0.00 55.06 56.01 1gqw s HIS 192 Cb -0.12 -3.79 0.40 0.00 -0.13 0.00 0.00 32.58 28.94 1gqw s HIS 192 CO 0.02 -3.15 1.61 -1.35 -2.47 0.00 0.00 174.74 169.40 1gqw h PRO 193 N 8.95 0.03 0.00 2.88 0.11 -1.93 0.41 132.00 142.45 1gqw h PRO 193 Ca -0.36 -0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.67 1gqw h PRO 193 Cb 1.16 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1gqw h PRO 193 CO 0.95 0.02 -0.99 0.28 -0.21 0.00 0.00 178.00 178.05 1gqw n VAL 194 N -5.46 1.47 0.15 3.15 0.31 -1.26 -4.54 118.33 112.15 1gqw n VAL 194 Ca 0.13 0.10 -0.00 0.00 -0.01 0.00 0.00 64.34 64.55 1gqw n VAL 194 Cb 0.45 -2.28 0.22 0.00 -0.91 0.00 0.00 33.84 31.32 1gqw n VAL 194 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1gqw h SER 195 N -1.00 0.01 -0.02 4.52 4.64 -1.98 -3.46 113.55 116.26 1gqw h SER 195 Ca -0.12 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.19 1gqw h SER 195 Cb 0.90 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.98 1gqw h SER 195 CO -0.07 0.56 -0.01 0.61 -0.87 0.00 0.00 176.83 177.05 1gqw n GLY 196 N 0.06 0.36 3.81 -0.77 0.00 0.14 -4.93 105.19 103.87 1gqw n GLY 196 Ca -0.01 -0.04 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 1gqw n GLY 196 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gqw s LYS 197 N -0.76 3.53 0.13 1.61 1.02 -1.26 -4.37 119.74 119.64 1gqw s LYS 197 Ca 0.00 1.16 -0.15 0.00 0.02 0.00 0.00 55.97 57.01 1gqw s LYS 197 Cb 0.00 -2.06 -0.07 0.00 -0.52 0.00 0.00 37.83 35.18 1gqw s LYS 197 CO 0.00 -0.64 0.54 -0.65 -0.92 0.00 0.00 175.35 173.69 1gqw s GLN 198 N -3.97 4.00 -0.09 1.68 -1.52 -1.26 -1.02 119.66 117.47 1gqw s GLN 198 Ca 0.63 0.51 -0.21 0.00 -1.95 0.00 0.00 55.36 54.33 1gqw s GLN 198 Cb -0.15 -2.97 0.05 0.00 -0.22 0.00 0.00 33.01 29.72 1gqw s GLN 198 CO 0.33 0.50 0.50 0.00 -0.25 0.00 0.00 175.29 176.38 1gqw s ALA 199 N -1.42 -1.28 0.37 6.09 0.00 -0.56 -4.41 121.76 120.55 1gqw s ALA 199 Ca 0.36 1.04 -0.27 0.00 0.00 0.00 0.00 51.96 53.10 1gqw s ALA 199 Cb -0.15 -0.27 -0.09 0.00 0.00 0.00 0.00 23.12 22.60 1gqw s ALA 199 CO 0.19 -0.29 1.23 -0.51 0.00 0.00 0.00 175.76 176.38 1gqw s LEU 200 N -0.73 4.31 -0.31 0.00 1.43 -1.06 -0.74 118.68 121.58 1gqw s LEU 200 Ca -0.08 2.52 0.15 0.00 -1.03 0.00 0.00 54.13 55.69 1gqw s LEU 200 Cb -0.03 -3.84 0.47 0.00 0.03 0.00 0.00 46.19 42.82 1gqw s LEU 200 CO 0.05 -0.62 1.10 0.33 0.23 0.00 0.00 176.35 177.43 1gqw n PHE 201 N 0.42 1.93 -4.40 0.29 7.35 0.71 -4.72 117.46 119.04 1gqw n PHE 201 Ca 0.02 -2.44 -0.26 0.00 -0.76 0.00 0.00 57.45 54.01 1gqw n PHE 201 Cb 0.44 -0.27 -0.12 0.00 0.35 0.00 0.00 39.48 39.89 1gqw n PHE 201 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 1gqw s VAL 202 N -4.11 2.21 -0.06 -2.13 -7.23 -1.26 -4.76 120.40 103.07 1gqw s VAL 202 Ca 0.36 -1.97 -0.04 0.00 -1.81 0.00 0.00 61.98 58.52 1gqw s VAL 202 Cb 0.39 -2.04 0.03 0.00 0.56 0.00 0.00 36.38 35.32 1gqw s VAL 202 CO -0.02 -0.14 0.14 0.54 -0.31 0.00 0.00 175.10 175.30 1gqw s ASN 203 N -2.60 -0.12 0.49 4.85 2.20 -1.26 -4.97 114.94 113.53 1gqw s ASN 203 Ca 0.19 0.28 0.29 0.00 -0.94 0.00 0.00 52.86 52.67 1gqw s ASN 203 Cb -0.08 0.22 1.37 0.00 -2.00 0.00 0.00 41.25 40.76 1gqw s ASN 203 CO 0.09 -0.10 1.82 -0.08 -2.94 0.00 0.00 177.10 175.89 1gqw h GLU 204 N 6.68 0.14 -0.85 3.55 4.81 -1.84 -1.01 114.58 126.05 1gqw h GLU 204 Ca -0.35 -0.01 0.09 0.00 -0.13 0.00 0.00 59.36 58.96 1gqw h GLU 204 Cb 1.17 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 30.45 1gqw h GLU 204 CO 0.43 0.09 0.51 0.78 -0.73 0.00 0.00 179.01 180.09 1gqw h GLY 205 N 0.14 1.32 0.00 1.92 0.00 -1.27 -3.39 103.07 101.80 1gqw h GLY 205 Ca 0.52 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1gqw h GLY 205 CO -0.10 0.18 -0.70 0.69 0.00 0.00 0.00 176.54 176.61 1gqw n PHE 206 N -4.69 0.00 -1.67 5.60 3.72 -0.75 -3.47 117.46 116.20 1gqw n PHE 206 Ca 0.14 0.00 -0.45 0.00 -0.05 0.00 0.00 57.45 57.08 1gqw n PHE 206 Cb 0.25 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.75 1gqw n PHE 206 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1gqw n THR 207 N -1.71 0.60 -0.11 4.37 -1.04 -0.46 -2.02 114.28 113.91 1gqw n THR 207 Ca 0.00 -0.11 -0.12 0.00 -2.04 0.00 0.00 64.05 61.78 1gqw n THR 207 Cb 0.35 -2.05 -0.15 0.00 -1.82 0.00 0.00 70.33 66.66 1gqw n THR 207 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1gqw n THR 208 N 5.15 1.39 -3.63 12.58 -2.24 0.68 -4.83 114.28 123.38 1gqw n THR 208 Ca 0.21 -0.76 -0.05 0.00 -2.27 0.00 0.00 64.05 61.18 1gqw n THR 208 Cb 0.35 -0.74 -0.05 0.00 -2.10 0.00 0.00 70.33 67.78 1gqw n THR 208 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gqw s ARG 209 N -2.49 0.22 -0.53 -0.78 1.70 -1.25 -5.00 118.95 110.82 1gqw s ARG 209 Ca -0.17 0.09 -0.26 0.00 -0.47 0.00 0.00 55.73 54.92 1gqw s ARG 209 Cb 0.07 0.10 0.03 0.00 -0.57 0.00 0.00 34.95 34.58 1gqw s ARG 209 CO 0.75 -0.06 1.01 0.42 -1.08 0.00 0.00 175.30 176.34 1gqw s ILE 210 N -0.79 4.32 0.07 4.99 1.01 -1.26 -0.90 121.20 128.64 1gqw s ILE 210 Ca 0.06 0.63 0.30 0.00 0.00 0.00 0.00 60.65 61.63 1gqw s ILE 210 Cb -0.02 -4.56 0.30 0.00 0.01 0.00 0.00 42.46 38.20 1gqw s ILE 210 CO -0.07 -1.08 1.91 1.62 0.00 0.00 0.00 174.94 177.33 1gqw h VAL 211 N 6.09 0.00 -0.91 2.92 3.04 -1.58 -3.25 116.25 122.55 1gqw h VAL 211 Ca -0.25 -0.04 -0.58 0.00 -1.01 0.00 0.00 66.70 64.82 1gqw h VAL 211 Cb 1.07 0.73 -0.30 0.00 -2.01 0.00 0.00 31.29 30.78 1gqw h VAL 211 CO 1.10 0.00 0.54 0.47 -1.01 0.00 0.00 177.57 178.67 1gqw n ASP 212 N -2.56 5.96 -3.66 3.17 8.00 -1.25 -4.94 116.55 121.27 1gqw n ASP 212 Ca -0.02 -3.74 -0.09 0.00 0.71 0.00 0.00 54.79 51.65 1gqw n ASP 212 Cb 0.07 -0.84 -0.02 0.00 -0.02 0.00 0.00 41.12 40.31 1gqw n ASP 212 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1gqw s VAL 213 N -4.29 0.00 0.70 2.53 -7.23 -1.23 -5.01 120.40 105.88 1gqw s VAL 213 Ca 0.60 -0.54 -0.16 0.00 -1.81 0.00 0.00 61.98 60.07 1gqw s VAL 213 Cb 0.48 -1.55 0.02 0.00 0.56 0.00 0.00 36.38 35.90 1gqw s VAL 213 CO 0.03 0.00 1.24 -0.94 -0.31 0.00 0.00 175.10 175.11 1gqw s SER 214 N -2.84 4.30 0.19 4.85 1.04 -1.26 -4.54 113.70 115.45 1gqw s SER 214 Ca 0.07 2.46 -0.15 0.00 0.48 0.00 0.00 55.95 58.80 1gqw s SER 214 Cb -0.04 -2.60 0.18 0.00 0.10 0.00 0.00 66.02 63.66 1gqw s SER 214 CO -0.02 -2.20 1.64 -0.08 0.98 0.00 0.00 173.24 173.56 1gqw h GLU 215 N -0.02 -0.01 -0.14 4.02 4.81 -1.98 0.83 114.58 122.09 1gqw h GLU 215 Ca -0.49 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 58.69 1gqw h GLU 215 Cb 1.31 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.68 1gqw h GLU 215 CO 0.51 -0.01 -0.14 0.87 -0.73 0.00 0.00 179.01 179.50 1gqw h LYS 216 N -0.01 0.22 -0.05 1.92 1.79 -1.99 0.21 116.57 118.67 1gqw h LYS 216 Ca 0.26 -0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.65 1gqw h LYS 216 Cb 0.41 -0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.03 1gqw h LYS 216 CO -0.57 0.37 -0.06 0.93 -1.08 0.00 0.00 179.45 179.05 1gqw h GLU 217 N 0.21 0.12 -0.80 3.15 5.08 -0.62 -0.77 114.58 120.96 1gqw h GLU 217 Ca 0.04 -0.07 0.06 0.00 -1.00 0.00 0.00 59.36 58.39 1gqw h GLU 217 Cb 0.39 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.59 1gqw h GLU 217 CO 0.02 0.62 0.48 1.03 -1.00 0.00 0.00 179.01 180.16 1gqw h SER 218 N -0.36 0.76 -0.26 1.42 0.87 0.70 -0.65 113.55 116.02 1gqw h SER 218 Ca 0.00 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1gqw h SER 218 Cb 0.60 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 1gqw h SER 218 CO 0.01 0.49 0.15 -0.08 -0.53 0.00 0.00 176.83 176.88 1gqw h GLU 219 N 0.89 0.36 -0.30 2.24 4.22 -0.89 -1.15 114.58 119.95 1gqw h GLU 219 Ca 0.35 -0.04 -0.00 0.00 0.08 0.00 0.00 59.36 59.75 1gqw h GLU 219 Cb 0.15 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1gqw h GLU 219 CO -0.17 0.30 0.19 0.00 -2.18 0.00 0.00 179.01 177.15 1gqw h ALA 220 N 1.04 0.39 -0.67 2.92 0.00 -0.32 -2.56 119.26 120.06 1gqw h ALA 220 Ca 0.09 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1gqw h ALA 220 Cb 0.03 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1gqw h ALA 220 CO -0.02 -0.12 0.26 -0.07 0.00 0.00 0.00 179.25 179.30 1gqw h LEU 221 N 0.39 0.94 -1.02 0.00 3.38 -1.00 -2.71 115.31 115.30 1gqw h LEU 221 Ca 0.11 -0.18 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 1gqw h LEU 221 Cb -0.00 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1gqw h LEU 221 CO -0.02 0.86 -0.29 -0.07 0.09 0.00 0.00 178.44 179.01 1gqw h LEU 222 N 0.96 0.35 -0.36 1.67 3.38 -1.11 -0.04 115.31 120.17 1gqw h LEU 222 Ca 0.22 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1gqw h LEU 222 Cb 0.23 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1gqw h LEU 222 CO -0.02 0.64 0.18 0.28 0.09 0.00 0.00 178.44 179.60 1gqw h SER 223 N 0.30 0.46 0.16 -0.43 0.02 -1.23 0.42 113.55 113.26 1gqw h SER 223 Ca 0.04 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 1gqw h SER 223 Cb 0.68 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.10 1gqw h SER 223 CO 0.05 0.45 -0.08 0.15 -1.14 0.00 0.00 176.83 176.27 1gqw h PHE 224 N 0.44 -0.20 0.21 3.45 3.57 -1.18 -2.62 116.94 120.61 1gqw h PHE 224 Ca 0.12 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 1gqw h PHE 224 Cb 0.11 0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.92 1gqw h PHE 224 CO -0.02 -0.04 -0.10 -0.07 -2.23 0.00 0.00 178.31 175.85 1gqw h LEU 225 N -0.31 -0.24 -1.99 0.59 3.38 -0.79 0.62 115.31 116.57 1gqw h LEU 225 Ca -0.02 -0.07 0.11 0.00 0.09 0.00 0.00 57.88 57.99 1gqw h LEU 225 Cb 0.25 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1gqw h LEU 225 CO 0.04 -0.09 0.43 -0.26 0.09 0.00 0.00 178.44 178.64 1gqw h PHE 226 N -0.38 0.00 0.03 1.13 0.04 -0.15 -0.61 116.94 117.00 1gqw h PHE 226 Ca -0.03 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.57 1gqw h PHE 226 Cb 0.29 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.43 1gqw h PHE 226 CO -0.04 0.00 -0.88 0.00 -0.60 0.00 0.00 178.31 176.79 1gqw h ALA 227 N 1.51 0.15 -0.82 2.45 0.00 -0.99 -3.38 119.26 118.18 1gqw h ALA 227 Ca 0.18 -0.94 0.20 0.00 0.00 0.00 0.00 54.91 54.35 1gqw h ALA 227 Cb 1.03 0.42 -0.13 0.00 0.00 0.00 0.00 17.79 19.12 1gqw h ALA 227 CO -0.00 0.50 0.23 1.25 0.00 0.00 0.00 179.25 181.23 1gqw h HIS 228 N -0.81 0.36 0.00 0.00 -0.00 0.18 0.20 115.15 115.07 1gqw h HIS 228 Ca -0.22 0.05 0.00 0.00 -0.00 0.00 0.00 60.37 60.19 1gqw h HIS 228 Cb 1.33 -0.03 0.00 0.00 -0.00 0.00 0.00 27.41 28.71 1gqw h HIS 228 CO 0.17 -0.13 0.00 0.44 -0.00 0.00 0.00 177.93 178.40 1gqw n ILE 229 N -5.17 0.72 0.10 6.26 -6.64 -0.82 -2.50 119.36 111.30 1gqw n ILE 229 Ca 0.18 0.18 0.00 0.00 -1.77 0.00 0.00 62.75 61.35 1gqw n ILE 229 Cb 0.58 -1.00 -0.03 0.00 -1.44 0.00 0.00 39.64 37.76 1gqw n ILE 229 CO 0.00 0.00 0.00 0.74 -1.77 0.00 0.00 176.55 175.52 1gqw h THR 230 N 0.00 0.86 -1.04 7.28 2.02 -0.79 -3.46 112.91 117.78 1gqw h THR 230 Ca 0.00 -2.31 -0.85 0.00 0.77 0.00 0.00 66.41 64.02 1gqw h THR 230 Cb 0.10 2.37 0.02 0.00 -1.74 0.00 0.00 68.15 68.90 1gqw h THR 230 CO 0.00 0.49 0.60 1.17 0.37 0.00 0.00 175.52 178.15 1gqw n LYS 231 N -3.14 0.09 -0.29 6.66 4.81 -1.04 -4.79 118.16 120.46 1gqw n LYS 231 Ca -0.02 0.03 0.22 0.00 -0.87 0.00 0.00 58.31 57.68 1gqw n LYS 231 Cb 0.79 -1.55 0.53 0.00 0.02 0.00 0.00 35.03 34.83 1gqw n LYS 231 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 1gqw h PRO 232 N 4.82 0.35 -0.12 1.64 0.13 -1.93 -0.30 132.00 136.59 1gqw h PRO 232 Ca -0.45 -0.02 0.03 0.00 -0.87 0.00 0.00 66.00 64.69 1gqw h PRO 232 Cb 1.38 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.42 1gqw h PRO 232 CO 0.92 0.23 0.10 0.93 -0.23 0.00 0.00 178.00 179.95 1gqw h GLU 233 N 0.36 0.00 -0.46 0.86 3.07 -1.98 -1.95 114.58 114.47 1gqw h GLU 233 Ca 0.53 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.39 1gqw h GLU 233 Cb 1.43 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.34 1gqw h GLU 233 CO -0.21 0.00 0.00 1.19 -1.40 0.00 0.00 179.01 178.59 1gqw n PHE 234 N -4.21 0.36 -4.15 4.33 3.72 -0.12 -4.85 117.46 112.54 1gqw n PHE 234 Ca -0.00 -0.15 -0.15 0.00 -0.05 0.00 0.00 57.45 57.10 1gqw n PHE 234 Cb 0.22 -0.08 -0.06 0.00 -0.94 0.00 0.00 39.48 38.62 1gqw n PHE 234 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 176.76 177.85 1gqw s GLN 235 N -1.63 1.77 0.02 -1.08 -2.07 -0.74 -0.47 119.66 115.46 1gqw s GLN 235 Ca 0.13 -1.79 0.02 0.00 -1.82 0.00 0.00 55.36 51.90 1gqw s GLN 235 Cb 0.08 0.39 -0.01 0.00 -1.09 0.00 0.00 33.01 32.38 1gqw s GLN 235 CO 0.07 -0.70 -0.07 0.08 -1.32 0.00 0.00 175.29 173.36 1gqw s VAL 236 N -3.35 0.47 -0.05 3.63 1.01 -0.13 -4.94 120.40 117.04 1gqw s VAL 236 Ca 0.34 -0.69 0.05 0.00 0.00 0.00 0.00 61.98 61.68 1gqw s VAL 236 Cb 0.01 -0.48 -0.01 0.00 0.00 0.00 0.00 36.38 35.90 1gqw s VAL 236 CO 0.21 -0.16 -0.21 -0.60 0.00 0.00 0.00 175.10 174.34 1gqw s ARG 237 N -0.92 2.25 -0.11 2.72 3.52 -1.26 -0.95 118.95 124.19 1gqw s ARG 237 Ca -0.05 -0.77 0.03 0.00 -0.13 0.00 0.00 55.73 54.81 1gqw s ARG 237 Cb -0.06 -1.90 0.01 0.00 -1.56 0.00 0.00 34.95 31.43 1gqw s ARG 237 CO 0.00 0.30 -0.21 -0.46 -0.81 0.00 0.00 175.30 174.12 1gqw s TRP 238 N -0.03 2.45 -0.52 5.12 -0.11 -0.19 -5.01 118.94 120.65 1gqw s TRP 238 Ca -0.05 -1.12 -0.19 0.00 1.22 0.00 0.00 56.10 55.97 1gqw s TRP 238 Cb -0.13 -1.67 0.07 0.00 -1.50 0.00 0.00 33.47 30.23 1gqw s TRP 238 CO 0.03 -0.49 0.62 0.50 -4.62 0.00 0.00 176.95 172.99 1gqw s ARG 239 N 0.63 3.10 0.59 5.86 3.52 -1.26 -2.60 118.95 128.79 1gqw s ARG 239 Ca -0.12 -1.00 -0.18 0.00 -0.13 0.00 0.00 55.73 54.29 1gqw s ARG 239 Cb -0.16 -4.13 -0.06 0.00 -1.56 0.00 0.00 34.95 29.04 1gqw s ARG 239 CO 0.03 -1.26 0.80 0.91 -0.81 0.00 0.00 175.30 174.97 1gqw n TRP 240 N 6.10 0.24 -3.81 5.12 7.02 -1.26 -5.04 117.44 125.82 1gqw n TRP 240 Ca -0.08 0.44 -0.12 0.00 -1.02 0.00 0.00 57.50 56.72 1gqw n TRP 240 Cb 0.45 -2.07 -0.11 0.00 -2.42 0.00 0.00 31.31 27.17 1gqw n TRP 240 CO 0.00 0.00 0.00 -1.14 -2.02 0.00 0.00 177.69 174.53 1gqw s GLN 241 N -2.52 0.41 0.54 -0.99 0.74 -1.26 -5.03 119.66 111.56 1gqw s GLN 241 Ca 0.73 0.01 -0.19 0.00 0.05 0.00 0.00 55.36 55.97 1gqw s GLN 241 Cb -0.43 0.19 -0.09 0.00 1.10 0.00 0.00 33.01 33.78 1gqw s GLN 241 CO 0.49 -0.09 0.57 -2.30 -0.55 0.00 0.00 175.29 173.42 1gqw n PRO 242 N 2.19 0.59 -3.79 1.67 -0.02 -1.26 -2.53 135.00 131.84 1gqw n PRO 242 Ca -0.17 0.22 -0.29 0.00 -2.02 0.00 0.00 63.50 61.24 1gqw n PRO 242 Cb 0.57 -1.71 0.01 0.00 -0.02 0.00 0.00 33.50 32.35 1gqw n PRO 242 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1gqw n ASN 243 N 0.55 -4.52 -4.92 2.55 3.02 0.75 -4.42 115.26 108.26 1gqw n ASN 243 Ca 0.12 -0.70 -0.27 0.00 -0.03 0.00 0.00 54.58 53.70 1gqw n ASN 243 Cb 0.46 -3.64 -0.03 0.00 -0.61 0.00 0.00 39.78 35.96 1gqw n ASN 243 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1gqw s ASP 244 N -3.14 6.39 -0.05 6.41 1.11 -1.05 -0.58 116.67 125.76 1gqw s ASP 244 Ca 0.60 0.56 0.02 0.00 0.18 0.00 0.00 52.55 53.91 1gqw s ASP 244 Cb -0.31 -2.08 0.01 0.00 1.07 0.00 0.00 42.92 41.62 1gqw s ASP 244 CO 0.74 -0.19 -0.10 -0.63 1.18 0.00 0.00 175.17 176.18 1gqw s ILE 245 N -2.10 0.91 -0.10 0.77 -1.09 0.61 -0.95 121.20 119.25 1gqw s ILE 245 Ca 0.41 -0.36 0.03 0.00 -2.23 0.00 0.00 60.65 58.51 1gqw s ILE 245 Cb -0.10 -0.86 0.01 0.00 -1.58 0.00 0.00 42.46 39.93 1gqw s ILE 245 CO 0.31 0.30 -0.20 0.00 -1.23 0.00 0.00 174.94 174.13 1gqw s ALA 246 N 0.68 1.96 -0.07 9.38 0.00 0.09 0.72 121.76 134.52 1gqw s ALA 246 Ca -0.13 -0.87 0.01 0.00 0.00 0.00 0.00 51.96 50.98 1gqw s ALA 246 Cb -0.15 -0.82 0.02 0.00 0.00 0.00 0.00 23.12 22.17 1gqw s ALA 246 CO 0.02 0.13 -0.09 0.42 0.00 0.00 0.00 175.76 176.24 1gqw s ILE 247 N 0.61 0.96 0.03 0.00 1.01 -0.51 -0.01 121.20 123.29 1gqw s ILE 247 Ca -0.14 -0.33 -0.05 0.00 0.00 0.00 0.00 60.65 60.13 1gqw s ILE 247 Cb -0.17 -0.93 -0.01 0.00 0.01 0.00 0.00 42.46 41.37 1gqw s ILE 247 CO 0.04 0.33 0.09 -1.66 0.00 0.00 0.00 174.94 173.74 1gqw s TRP 248 N 1.04 0.19 -0.90 3.97 -2.14 -1.17 -0.50 118.94 119.44 1gqw s TRP 248 Ca -0.08 -0.47 -0.24 0.00 2.66 0.00 0.00 56.10 57.97 1gqw s TRP 248 Cb -0.14 -0.14 0.05 0.00 -3.10 0.00 0.00 33.47 30.14 1gqw s TRP 248 CO -0.01 -0.35 1.35 0.34 -2.66 0.00 0.00 176.95 175.63 1gqw s ASP 249 N -2.02 6.38 0.00 -2.66 -1.08 -0.31 -2.81 116.67 114.17 1gqw s ASP 249 Ca -0.06 -1.14 0.00 0.00 -0.52 0.00 0.00 52.55 50.83 1gqw s ASP 249 Cb -0.02 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.89 1gqw s ASP 249 CO -0.04 -1.59 0.37 -3.20 0.52 0.00 0.00 175.17 171.24 1gqw n ASN 250 N 8.84 0.07 -0.40 -0.34 5.15 -1.03 -2.76 115.26 124.79 1gqw n ASN 250 Ca 0.21 -0.81 0.06 0.00 -0.60 0.00 0.00 54.58 53.44 1gqw n ASN 250 Cb 0.50 -0.03 0.03 0.00 -0.53 0.00 0.00 39.78 39.74 1gqw n ASN 250 CO 0.00 0.00 0.00 -2.11 1.40 0.00 0.00 177.26 176.55 1gqw n ARG 251 N -0.36 1.28 -1.11 1.20 1.85 -1.26 -4.56 116.66 113.69 1gqw n ARG 251 Ca 0.00 -0.99 0.02 0.00 -1.00 0.00 0.00 57.85 55.88 1gqw n ARG 251 Cb 0.02 -1.20 0.01 0.00 -1.05 0.00 0.00 32.46 30.24 1gqw n ARG 251 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 1gqw n VAL 252 N 0.30 0.00 -3.99 8.89 0.24 -1.11 -5.00 118.33 117.66 1gqw n VAL 252 Ca 0.06 -0.58 -0.10 0.00 -2.04 0.00 0.00 64.34 61.69 1gqw n VAL 252 Cb 0.28 0.77 -0.07 0.00 -1.47 0.00 0.00 33.84 33.35 1gqw n VAL 252 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1gqw s THR 253 N 0.00 0.07 0.11 3.34 -4.23 -1.24 -0.18 115.64 113.50 1gqw s THR 253 Ca 0.20 -1.46 0.04 0.00 -1.18 0.00 0.00 61.69 59.29 1gqw s THR 253 Cb 0.23 -1.89 -0.04 0.00 1.34 0.00 0.00 72.50 72.14 1gqw s THR 253 CO -0.10 -0.30 -0.10 -1.10 -0.54 0.00 0.00 174.62 172.48 1gqw s GLN 254 N -3.98 0.92 0.05 3.99 -0.21 -0.67 -4.58 119.66 115.17 1gqw s GLN 254 Ca 0.18 -1.25 -0.08 0.00 0.02 0.00 0.00 55.36 54.23 1gqw s GLN 254 Cb 0.04 -0.57 -0.00 0.00 1.00 0.00 0.00 33.01 33.47 1gqw s GLN 254 CO 0.01 0.08 0.17 -3.38 -2.12 0.00 0.00 175.29 170.05 1gqw s HIS 255 N -2.69 0.11 -0.00 0.91 -3.43 -0.28 -0.50 115.29 109.41 1gqw s HIS 255 Ca 0.09 -0.40 0.04 0.00 -0.80 0.00 0.00 55.06 53.99 1gqw s HIS 255 Cb -0.01 -0.06 -0.01 0.00 -1.43 0.00 0.00 32.58 31.06 1gqw s HIS 255 CO 0.00 -0.44 -0.11 -0.47 -2.00 0.00 0.00 174.74 171.72 1gqw s TYR 256 N -2.87 1.02 -0.27 0.38 6.14 0.68 -2.95 117.35 119.49 1gqw s TYR 256 Ca -0.03 -0.22 0.02 0.00 0.64 0.00 0.00 57.07 57.49 1gqw s TYR 256 Cb 0.00 -0.65 0.07 0.00 0.42 0.00 0.00 41.96 41.80 1gqw s TYR 256 CO -0.06 -0.01 -0.05 0.00 0.64 0.00 0.00 175.55 176.07 1gqw s ALA 257 N -0.36 2.43 0.19 3.97 0.00 -0.49 0.42 121.76 127.91 1gqw s ALA 257 Ca 0.04 -1.83 -0.33 0.00 0.00 0.00 0.00 51.96 49.84 1gqw s ALA 257 Cb -0.05 -1.64 -0.15 0.00 0.00 0.00 0.00 23.12 21.29 1gqw s ALA 257 CO -0.00 -1.33 1.28 0.09 0.00 0.00 0.00 175.76 175.80 1gqw n ASN 258 N 4.48 1.94 -4.16 0.00 3.02 0.12 -3.08 115.26 117.58 1gqw n ASN 258 Ca -0.09 1.14 -0.38 0.00 -0.03 0.00 0.00 54.58 55.22 1gqw n ASN 258 Cb 0.43 -1.30 -0.05 0.00 -0.61 0.00 0.00 39.78 38.24 1gqw n ASN 258 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gqw s ALA 259 N -0.04 4.26 -0.31 5.41 0.00 -1.26 -4.08 121.76 125.74 1gqw s ALA 259 Ca 0.73 -3.76 0.17 0.00 0.00 0.00 0.00 51.96 49.10 1gqw s ALA 259 Cb -0.78 -2.97 0.45 0.00 0.00 0.00 0.00 23.12 19.83 1gqw s ALA 259 CO 0.50 -2.16 1.34 -0.40 0.00 0.00 0.00 175.76 175.04 1gqw n ASP 260 N 2.59 -0.07 0.00 0.00 5.75 -1.26 -4.87 116.55 118.68 1gqw n ASP 260 Ca 0.20 -2.15 0.00 0.00 -0.01 0.00 0.00 54.79 52.83 1gqw n ASP 260 Cb 0.38 0.15 0.00 0.00 -1.03 0.00 0.00 41.12 40.62 1gqw n ASP 260 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1gqw n TYR 261 N -1.08 0.00 -1.75 2.11 0.18 -1.26 -4.64 117.16 110.72 1gqw n TYR 261 Ca -0.06 0.00 -0.37 0.00 1.88 0.00 0.00 57.90 59.35 1gqw n TYR 261 Cb 0.84 0.00 0.07 0.00 -0.38 0.00 0.00 39.34 39.87 1gqw n TYR 261 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1gqw s LEU 262 N -0.92 3.58 0.46 -3.48 1.02 -1.26 -1.67 118.68 116.40 1gqw s LEU 262 Ca 0.00 2.62 0.30 0.00 0.02 0.00 0.00 54.13 57.07 1gqw s LEU 262 Cb 0.00 -4.62 1.19 0.00 0.02 0.00 0.00 46.19 42.78 1gqw s LEU 262 CO 0.00 -2.00 1.88 1.55 0.02 0.00 0.00 176.35 177.81 1gqw h PRO 263 N 0.55 0.00 -5.62 1.29 0.13 -1.97 -3.52 132.00 122.86 1gqw h PRO 263 Ca -0.51 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.08 1gqw h PRO 263 Cb 1.34 0.00 0.20 0.00 0.13 0.00 0.00 31.00 32.67 1gqw h PRO 263 CO 0.53 0.00 -1.46 1.04 -0.23 0.00 0.00 178.00 177.88 1gqw n GLN 264 N -2.83 0.00 -3.69 0.86 6.02 -0.67 -4.15 117.38 112.92 1gqw n GLN 264 Ca 0.01 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.66 1gqw n GLN 264 Cb 0.30 -0.94 -0.05 0.00 1.02 0.00 0.00 30.24 30.57 1gqw n GLN 264 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1gqw s ARG 265 N -1.47 3.65 -0.05 -1.09 3.52 -1.26 -4.49 118.95 117.76 1gqw s ARG 265 Ca 0.44 0.03 -0.02 0.00 -0.13 0.00 0.00 55.73 56.06 1gqw s ARG 265 Cb -0.30 -3.06 0.04 0.00 -1.56 0.00 0.00 34.95 30.06 1gqw s ARG 265 CO 0.71 0.63 0.09 0.50 -0.81 0.00 0.00 175.30 176.42 1gqw s ARG 266 N -1.76 0.01 -0.13 5.12 3.52 -0.93 -3.57 118.95 121.21 1gqw s ARG 266 Ca 0.29 0.33 0.02 0.00 -0.13 0.00 0.00 55.73 56.24 1gqw s ARG 266 Cb -0.14 -0.26 0.01 0.00 -1.56 0.00 0.00 34.95 33.00 1gqw s ARG 266 CO 0.16 -0.21 -0.18 0.42 -0.81 0.00 0.00 175.30 174.68 1gqw s ILE 267 N 1.43 1.77 0.02 4.11 1.01 0.11 -0.70 121.20 128.96 1gqw s ILE 267 Ca -0.06 -0.80 0.04 0.00 0.00 0.00 0.00 60.65 59.83 1gqw s ILE 267 Cb -0.12 -1.60 -0.02 0.00 0.01 0.00 0.00 42.46 40.74 1gqw s ILE 267 CO -0.04 0.49 -0.12 -0.04 0.00 0.00 0.00 174.94 175.23 1gqw s MET 268 N 0.97 0.86 -0.10 2.79 -1.94 -0.22 -1.57 119.30 120.09 1gqw s MET 268 Ca -0.05 -0.58 0.00 0.00 -1.71 0.00 0.00 55.69 53.35 1gqw s MET 268 Cb -0.15 -0.83 -0.02 0.00 2.01 0.00 0.00 34.83 35.84 1gqw s MET 268 CO -0.03 0.21 -0.09 -1.01 -0.01 0.00 0.00 175.02 174.09 1gqw s HIS 269 N -0.62 2.88 -0.05 -0.03 3.76 -0.82 0.35 115.29 120.78 1gqw s HIS 269 Ca 0.02 -0.23 0.04 0.00 -0.15 0.00 0.00 55.06 54.73 1gqw s HIS 269 Cb -0.06 -1.78 0.00 0.00 1.11 0.00 0.00 32.58 31.85 1gqw s HIS 269 CO 0.00 0.10 -0.16 0.50 -0.85 0.00 0.00 174.74 174.34 1gqw s ARG 270 N -0.27 1.70 -0.31 1.40 3.52 0.50 -0.42 118.95 125.06 1gqw s ARG 270 Ca 0.03 -0.55 -0.09 0.00 -0.13 0.00 0.00 55.73 54.99 1gqw s ARG 270 Cb -0.13 -1.46 -0.00 0.00 -1.56 0.00 0.00 34.95 31.80 1gqw s ARG 270 CO 0.03 0.19 0.15 0.00 -0.81 0.00 0.00 175.30 174.86 1gqw s ALA 271 N 0.15 3.25 -0.21 6.12 0.00 0.97 -0.53 121.76 131.52 1gqw s ALA 271 Ca -0.06 -1.41 -0.15 0.00 0.00 0.00 0.00 51.96 50.35 1gqw s ALA 271 Cb -0.12 -2.36 -0.04 0.00 0.00 0.00 0.00 23.12 20.60 1gqw s ALA 271 CO 0.02 -0.92 0.35 0.99 0.00 0.00 0.00 175.76 176.20 1gqw s THR 272 N 1.60 5.23 -0.22 0.00 2.01 -1.25 0.06 115.64 123.07 1gqw s THR 272 Ca 0.04 0.61 -0.03 0.00 0.31 0.00 0.00 61.69 62.62 1gqw s THR 272 Cb -0.17 -3.68 -0.01 0.00 0.01 0.00 0.00 72.50 68.65 1gqw s THR 272 CO 0.06 0.27 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.58 1gqw s ILE 273 N 1.22 3.30 0.45 1.82 1.01 0.58 -1.14 121.20 128.43 1gqw s ILE 273 Ca 0.17 -0.52 -0.25 0.00 0.00 0.00 0.00 60.65 60.05 1gqw s ILE 273 Cb -0.14 -2.49 -0.08 0.00 0.01 0.00 0.00 42.46 39.76 1gqw s ILE 273 CO 0.07 0.43 1.30 -0.76 0.00 0.00 0.00 174.94 175.98 1gqw s LEU 274 N 1.43 4.09 0.00 2.97 1.43 -0.64 -0.92 118.68 127.05 1gqw s LEU 274 Ca 0.05 2.64 0.01 0.00 -1.03 0.00 0.00 54.13 55.80 1gqw s LEU 274 Cb -0.14 -4.04 -0.00 0.00 0.03 0.00 0.00 46.19 42.03 1gqw s LEU 274 CO -0.04 -1.04 0.04 0.61 0.23 0.00 0.00 176.35 176.16 1gqw n GLY 275 N 0.63 3.62 0.00 -3.19 0.00 -1.22 -4.23 105.19 100.80 1gqw n GLY 275 Ca 0.06 -2.23 0.00 0.00 0.00 0.00 0.00 46.02 43.85 1gqw n GLY 275 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gqw n ASP 276 N -1.40 0.00 -4.66 1.61 5.75 -1.26 -4.66 116.55 111.93 1gqw n ASP 276 Ca -0.11 0.00 -0.39 0.00 -0.01 0.00 0.00 54.79 54.28 1gqw n ASP 276 Cb 0.47 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.49 1gqw n ASP 276 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1gqw s LYS 277 N 0.00 4.16 0.36 0.11 2.20 -1.26 -4.21 119.74 121.11 1gqw s LYS 277 Ca 0.00 0.30 -0.28 0.00 -0.36 0.00 0.00 55.97 55.62 1gqw s LYS 277 Cb 0.00 -3.56 -0.11 0.00 -1.51 0.00 0.00 37.83 32.65 1gqw s LYS 277 CO 0.00 -0.13 1.49 -1.25 -0.36 0.00 0.00 175.35 175.10 1gqw s PRO 278 N 1.58 4.13 0.09 4.03 0.04 -1.26 -5.01 135.00 138.60 1gqw s PRO 278 Ca 0.21 2.55 -0.13 0.00 0.04 0.00 0.00 61.00 63.67 1gqw s PRO 278 Cb -0.15 -2.98 0.02 0.00 0.04 0.00 0.00 34.50 31.43 1gqw s PRO 278 CO 0.09 -0.52 0.32 -0.59 0.04 0.00 0.00 177.00 176.34 1gqw s PHE 279 N -0.99 -0.08 0.35 0.56 -0.12 -1.26 -4.76 117.98 111.67 1gqw s PHE 279 Ca 0.54 -0.22 0.08 0.00 -0.05 0.00 0.00 56.93 57.28 1gqw s PHE 279 Cb -0.46 0.13 -0.04 0.00 -0.63 0.00 0.00 43.02 42.01 1gqw s PHE 279 CO 0.61 -0.60 0.18 -0.47 -0.05 0.00 0.00 175.22 174.88 1gqw s TYR 280 N -3.48 2.73 -0.30 3.49 5.04 -1.26 -0.37 117.35 123.20 1gqw s TYR 280 Ca 0.01 -0.39 -0.15 0.00 -2.44 0.00 0.00 57.07 54.10 1gqw s TYR 280 Cb 0.02 -1.72 0.18 0.00 0.35 0.00 0.00 41.96 40.79 1gqw s TYR 280 CO -0.09 0.28 1.12 1.03 -1.34 0.00 0.00 175.55 176.55 1gqw s ARG 281 N -3.89 0.11 0.00 4.97 3.00 -1.26 -4.89 118.95 117.00 1gqw s ARG 281 Ca 0.39 0.17 0.00 0.00 0.00 0.00 0.00 55.73 56.29 1gqw s ARG 281 Cb -0.02 0.09 0.00 0.00 0.00 0.00 0.00 34.95 35.02 1gqw s ARG 281 CO 0.23 -0.14 0.48 0.00 0.00 0.00 0.00 175.30 175.87