#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gqc s LYS 2 N 0.00 4.68 -0.03 -1.46 2.20 -1.26 -4.95 119.74 118.92 1gqc s LYS 2 Ca 0.00 1.33 0.03 0.00 -0.36 0.00 0.00 55.97 56.97 1gqc s LYS 2 Cb 0.00 -3.32 -0.00 0.00 -1.51 0.00 0.00 37.83 32.99 1gqc s LYS 2 CO 0.00 0.39 -0.12 0.00 -0.36 0.00 0.00 175.35 175.26 1gqc s ALA 3 N -0.57 1.07 0.10 3.13 0.00 -1.26 -1.29 121.76 122.94 1gqc s ALA 3 Ca 0.41 -0.47 0.05 0.00 0.00 0.00 0.00 51.96 51.95 1gqc s ALA 3 Cb -0.23 -0.35 -0.04 0.00 0.00 0.00 0.00 23.12 22.50 1gqc s ALA 3 CO 0.28 0.20 -0.12 0.14 0.00 0.00 0.00 175.76 176.27 1gqc s VAL 4 N 0.02 1.11 -0.09 0.00 -7.23 -0.73 -0.48 120.40 113.00 1gqc s VAL 4 Ca -0.01 -1.64 -0.02 0.00 -1.81 0.00 0.00 61.98 58.51 1gqc s VAL 4 Cb -0.08 -1.39 -0.03 0.00 0.56 0.00 0.00 36.38 35.43 1gqc s VAL 4 CO 0.01 -0.47 -0.01 -0.63 -0.31 0.00 0.00 175.10 173.69 1gqc s ILE 5 N -2.21 4.23 -0.07 -0.62 1.01 0.34 -1.50 121.20 122.38 1gqc s ILE 5 Ca 0.06 -0.27 0.02 0.00 0.00 0.00 0.00 60.65 60.46 1gqc s ILE 5 Cb -0.04 -2.78 0.01 0.00 0.01 0.00 0.00 42.46 39.66 1gqc s ILE 5 CO 0.01 0.59 -0.11 -0.69 0.00 0.00 0.00 174.94 174.74 1gqc s VAL 6 N -0.77 1.09 -0.37 2.92 1.01 0.09 -0.71 120.40 123.66 1gqc s VAL 6 Ca 0.12 -0.45 -0.01 0.00 0.00 0.00 0.00 61.98 61.64 1gqc s VAL 6 Cb -0.11 -1.00 0.09 0.00 0.00 0.00 0.00 36.38 35.35 1gqc s VAL 6 CO 0.02 0.35 0.12 -0.63 0.00 0.00 0.00 175.10 174.95 1gqc s ILE 7 N 0.72 3.01 -0.00 2.22 1.01 0.11 -2.00 121.20 126.27 1gqc s ILE 7 Ca -0.14 -1.92 -0.30 0.00 0.00 0.00 0.00 60.65 58.29 1gqc s ILE 7 Cb -0.16 -3.00 -0.07 0.00 0.01 0.00 0.00 42.46 39.25 1gqc s ILE 7 CO 0.03 -0.51 1.64 -2.84 0.00 0.00 0.00 174.94 173.26 1gqc s PRO 8 N 1.13 4.20 -0.39 2.79 0.02 -1.25 -1.42 135.00 140.07 1gqc s PRO 8 Ca 0.05 2.23 0.09 0.00 0.02 0.00 0.00 61.00 63.39 1gqc s PRO 8 Cb -0.21 -3.81 0.27 0.00 0.02 0.00 0.00 34.50 30.77 1gqc s PRO 8 CO -0.04 -0.78 0.57 0.00 -0.33 0.00 0.00 177.00 176.42 1gqc n ALA 9 N 6.39 2.26 -1.76 -1.55 0.00 -0.16 -3.50 120.51 122.20 1gqc n ALA 9 Ca 0.16 -3.36 -0.38 0.00 0.00 0.00 0.00 53.44 49.87 1gqc n ALA 9 Cb 0.42 -0.84 0.01 0.00 0.00 0.00 0.00 19.45 19.04 1gqc n ALA 9 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1gqc s ARG 10 N -1.40 3.49 0.12 0.00 1.70 -1.26 -4.45 118.95 117.15 1gqc s ARG 10 Ca 0.36 2.00 -0.14 0.00 -0.47 0.00 0.00 55.73 57.48 1gqc s ARG 10 Cb 0.21 -2.35 -0.04 0.00 -0.57 0.00 0.00 34.95 32.19 1gqc s ARG 10 CO -0.11 -0.84 1.50 -0.92 -1.08 0.00 0.00 175.30 173.86 1gqc h TYR 11 N 1.81 0.86 -4.04 5.89 3.20 -1.94 -3.43 116.97 119.33 1gqc h TYR 11 Ca -0.50 -0.20 -0.51 0.00 3.14 0.00 0.00 58.73 60.65 1gqc h TYR 11 Cb 1.27 -0.20 0.08 0.00 1.54 0.00 0.00 36.73 39.42 1gqc h TYR 11 CO 0.50 0.93 0.49 0.20 -1.64 0.00 0.00 178.16 178.64 1gqc s GLY 12 N -3.53 2.76 -0.20 1.82 0.00 -1.26 -0.99 107.32 105.91 1gqc s GLY 12 Ca -0.12 0.98 -0.25 0.00 0.00 0.00 0.00 44.72 45.32 1gqc s GLY 12 CO 0.82 1.41 0.68 -0.45 0.00 0.00 0.00 173.10 175.56 1gqc s SER 13 N -1.42 -0.69 0.05 1.64 0.15 -1.26 -4.81 113.70 107.36 1gqc s SER 13 Ca 0.68 1.19 -0.18 0.00 0.70 0.00 0.00 55.95 58.35 1gqc s SER 13 Cb -0.29 1.17 -0.15 0.00 -1.71 0.00 0.00 66.02 65.03 1gqc s SER 13 CO 0.35 -0.33 1.29 -1.28 1.20 0.00 0.00 173.24 174.46 1gqc h SER 14 N 4.53 0.59 0.38 5.45 0.87 -1.96 -3.23 113.55 120.17 1gqc h SER 14 Ca -0.28 -0.58 -0.18 0.00 -1.23 0.00 0.00 61.79 59.51 1gqc h SER 14 Cb 1.16 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.91 1gqc h SER 14 CO 0.16 1.06 -1.78 0.54 -0.53 0.00 0.00 176.83 176.27 1gqc n ARG 15 N -4.31 0.65 -3.25 2.24 1.74 -1.26 -4.73 116.66 107.73 1gqc n ARG 15 Ca -0.07 0.08 -0.25 0.00 -0.77 0.00 0.00 57.85 56.84 1gqc n ARG 15 Cb 0.52 -1.67 -0.08 0.00 -1.02 0.00 0.00 32.46 30.21 1gqc n ARG 15 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1gqc n LEU 16 N -2.72 -0.22 -4.56 0.55 4.77 -1.26 -4.82 117.00 108.75 1gqc n LEU 16 Ca -0.14 -4.51 -0.46 0.00 -0.03 0.00 0.00 56.01 50.87 1gqc n LEU 16 Cb 0.86 0.61 -0.02 0.00 -2.33 0.00 0.00 43.42 42.54 1gqc n LEU 16 CO 0.44 1.98 0.51 -2.65 -1.33 0.00 0.00 177.39 176.33 1gqc n PRO 17 N 2.00 1.09 -2.35 3.23 -0.02 -1.22 -1.10 135.00 136.64 1gqc n PRO 17 Ca 0.24 0.38 -0.13 0.00 -2.02 0.00 0.00 63.50 61.98 1gqc n PRO 17 Cb 0.51 -1.72 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 1gqc n PRO 17 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gqc n GLY 18 N 1.50 -0.12 0.27 -1.23 0.00 -0.16 -4.93 105.19 100.51 1gqc n GLY 18 Ca 0.12 -0.33 0.05 0.00 0.00 0.00 0.00 46.02 45.86 1gqc n GLY 18 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1gqc h LYS 19 N -0.19 0.20 -0.82 1.61 3.64 -1.17 -2.01 116.57 117.83 1gqc h LYS 19 Ca -0.30 -0.01 0.20 0.00 -1.27 0.00 0.00 60.65 59.26 1gqc h LYS 19 Cb 1.22 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.94 1gqc h LYS 19 CO 0.35 0.13 0.56 -1.35 -2.27 0.00 0.00 179.45 176.87 1gqc h PRO 20 N 0.20 0.28 -0.01 1.90 0.11 -1.84 -1.45 132.00 131.18 1gqc h PRO 20 Ca 0.40 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.50 1gqc h PRO 20 Cb 0.69 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.74 1gqc h PRO 20 CO -0.55 0.18 -0.24 1.28 -0.21 0.00 0.00 178.00 178.46 1gqc n LEU 21 N -4.44 0.99 -4.69 2.35 4.77 -0.76 -1.35 117.00 113.87 1gqc n LEU 21 Ca 0.17 -0.24 -0.44 0.00 -0.03 0.00 0.00 56.01 55.46 1gqc n LEU 21 Cb 0.70 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.63 1gqc n LEU 21 CO 0.33 0.18 1.20 0.18 -1.33 0.00 0.00 177.39 177.96 1gqc n LEU 22 N -0.66 3.42 -4.73 2.23 4.77 -0.55 -4.55 117.00 116.92 1gqc n LEU 22 Ca 0.12 1.10 -0.41 0.00 -0.03 0.00 0.00 56.01 56.79 1gqc n LEU 22 Cb 0.34 -1.47 -0.03 0.00 -2.33 0.00 0.00 43.42 39.92 1gqc n LEU 22 CO 0.26 -0.19 0.87 -0.62 -1.33 0.00 0.00 177.39 176.38 1gqc s ASP 23 N 0.79 7.12 -0.14 -1.43 2.15 -1.26 -0.17 116.67 123.74 1gqc s ASP 23 Ca 0.74 2.13 -0.01 0.00 0.43 0.00 0.00 52.55 55.85 1gqc s ASP 23 Cb -0.62 -2.60 0.04 0.00 -0.30 0.00 0.00 42.92 39.44 1gqc s ASP 23 CO 0.40 -0.38 -0.04 -0.63 -0.17 0.00 0.00 175.17 174.35 1gqc s ILE 24 N 0.30 0.91 -1.14 4.11 1.01 0.43 -4.84 121.20 121.99 1gqc s ILE 24 Ca 0.54 -0.38 -0.06 0.00 0.00 0.00 0.00 60.65 60.74 1gqc s ILE 24 Cb -0.31 -1.06 0.06 0.00 0.01 0.00 0.00 42.46 41.17 1gqc s ILE 24 CO 0.34 0.20 0.16 1.33 0.00 0.00 0.00 174.94 176.97 1gqc n VAL 25 N 4.96 -0.40 0.00 2.92 0.24 -1.26 -0.64 118.33 124.14 1gqc n VAL 25 Ca -0.11 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 61.99 1gqc n VAL 25 Cb 0.49 -0.54 0.00 0.00 -1.47 0.00 0.00 33.84 32.32 1gqc n VAL 25 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1gqc n GLY 26 N -1.59 1.47 3.05 7.63 0.00 -1.26 -5.07 105.19 109.41 1gqc n GLY 26 Ca -0.10 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.75 1gqc n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gqc s LYS 27 N -0.87 0.68 0.34 1.61 1.02 0.19 -5.09 119.74 117.62 1gqc s LYS 27 Ca 0.00 -0.49 -0.29 0.00 0.02 0.00 0.00 55.97 55.21 1gqc s LYS 27 Cb 0.00 -0.62 -0.11 0.00 -0.52 0.00 0.00 37.83 36.58 1gqc s LYS 27 CO 0.00 0.16 1.45 -1.25 -0.92 0.00 0.00 175.35 174.78 1gqc s PRO 28 N -0.70 4.19 0.25 -1.68 0.04 -1.26 -0.43 135.00 135.41 1gqc s PRO 28 Ca -0.00 2.45 -0.11 0.00 0.04 0.00 0.00 61.00 63.38 1gqc s PRO 28 Cb -0.06 -3.01 0.36 0.00 0.04 0.00 0.00 34.50 31.83 1gqc s PRO 28 CO 0.00 -0.44 1.57 1.98 0.04 0.00 0.00 177.00 180.15 1gqc h MET 29 N 3.49 -0.01 -0.67 4.56 1.85 -0.45 0.47 114.93 124.16 1gqc h MET 29 Ca -0.49 0.00 0.20 0.00 -0.61 0.00 0.00 59.70 58.79 1gqc h MET 29 Cb 1.23 0.00 -0.03 0.00 0.43 0.00 0.00 31.60 33.24 1gqc h MET 29 CO 0.67 -0.01 0.52 0.97 -0.40 0.00 0.00 176.91 178.67 1gqc h ILE 30 N -0.01 0.56 -0.27 1.77 6.09 -1.45 -0.48 117.51 123.72 1gqc h ILE 30 Ca 0.41 0.00 -0.18 0.00 -1.37 0.00 0.00 64.86 63.72 1gqc h ILE 30 Cb 0.65 0.63 0.00 0.00 0.47 0.00 0.00 36.82 38.57 1gqc h ILE 30 CO -0.94 0.00 -0.53 -0.61 -3.07 0.00 0.00 178.15 173.00 1gqc h GLN 31 N 0.00 0.84 -0.81 2.19 4.15 -0.33 -1.49 115.11 119.66 1gqc h GLN 31 Ca 0.32 -0.54 0.00 0.00 0.77 0.00 0.00 58.65 59.20 1gqc h GLN 31 Cb 1.36 0.07 -0.04 0.00 0.21 0.00 0.00 27.48 29.08 1gqc h GLN 31 CO -0.00 1.17 0.52 0.45 -1.93 0.00 0.00 178.83 179.04 1gqc h HIS 32 N 0.61 1.04 -0.37 3.99 3.86 -1.05 0.12 115.15 123.36 1gqc h HIS 32 Ca 0.01 0.01 -0.15 0.00 -1.16 0.00 0.00 60.37 59.09 1gqc h HIS 32 Cb 1.14 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 29.26 1gqc h HIS 32 CO 0.08 0.67 -0.35 0.28 0.86 0.00 0.00 177.93 179.47 1gqc h VAL 33 N 1.10 1.28 -0.07 2.45 2.07 -1.38 -2.69 116.25 119.02 1gqc h VAL 33 Ca 0.29 -1.52 -0.02 0.00 0.82 0.00 0.00 66.70 66.28 1gqc h VAL 33 Cb -0.09 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1gqc h VAL 33 CO -0.06 0.50 -0.02 0.22 0.02 0.00 0.00 177.57 178.24 1gqc h TYR 34 N 0.70 0.15 -0.89 1.57 5.03 -0.86 -1.43 116.97 121.24 1gqc h TYR 34 Ca 0.07 -0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.35 1gqc h TYR 34 Cb 0.92 -0.04 -0.04 0.00 1.55 0.00 0.00 36.73 39.12 1gqc h TYR 34 CO 0.05 0.47 0.57 0.93 -1.32 0.00 0.00 178.16 178.86 1gqc h GLU 35 N -0.22 1.18 -0.11 1.82 5.08 -0.81 -1.50 114.58 120.02 1gqc h GLU 35 Ca 0.02 -0.09 -0.14 0.00 -1.00 0.00 0.00 59.36 58.15 1gqc h GLU 35 Cb 0.42 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1gqc h GLU 35 CO 0.01 0.80 -0.55 0.00 -1.00 0.00 0.00 179.01 178.27 1gqc h ARG 36 N 1.21 0.34 -0.24 2.33 3.08 -1.44 -2.38 114.38 117.29 1gqc h ARG 36 Ca 0.32 -0.21 -0.02 0.00 0.07 0.00 0.00 59.98 60.14 1gqc h ARG 36 Cb -0.10 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1gqc h ARG 36 CO -0.07 0.80 0.06 0.00 -1.07 0.00 0.00 179.97 179.69 1gqc h ALA 37 N 1.16 1.65 0.00 0.04 0.00 -0.34 -1.27 119.26 120.50 1gqc h ALA 37 Ca 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1gqc h ALA 37 Cb 1.05 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1gqc h ALA 37 CO 0.09 0.27 -0.16 -0.07 0.00 0.00 0.00 179.25 179.38 1gqc h LEU 38 N 0.34 0.00 -0.02 0.00 3.38 -0.77 -2.56 115.31 115.68 1gqc h LEU 38 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1gqc h LEU 38 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1gqc h LEU 38 CO -0.00 0.16 -0.02 0.00 0.09 0.00 0.00 178.44 178.66 1gqc n GLN 39 N -3.46 0.35 -2.57 1.13 6.02 -0.48 -4.79 117.38 113.57 1gqc n GLN 39 Ca -0.01 -0.02 -0.43 0.00 -0.01 0.00 0.00 57.00 56.53 1gqc n GLN 39 Cb 0.33 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.07 1gqc n GLN 39 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1gqc s VAL 40 N -2.67 4.53 0.52 5.09 1.01 -0.96 -4.95 120.40 122.97 1gqc s VAL 40 Ca 0.25 1.85 -0.17 0.00 0.00 0.00 0.00 61.98 63.90 1gqc s VAL 40 Cb 0.20 -4.19 -0.07 0.00 0.00 0.00 0.00 36.38 32.31 1gqc s VAL 40 CO 0.48 -0.14 1.00 0.00 0.00 0.00 0.00 175.10 176.45 1gqc s ALA 41 N 3.10 2.97 0.00 5.51 0.00 -1.26 -3.88 121.76 128.20 1gqc s ALA 41 Ca 0.49 0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.75 1gqc s ALA 41 Cb -0.18 -3.16 0.00 0.00 0.00 0.00 0.00 23.12 19.78 1gqc s ALA 41 CO 0.11 -0.32 0.00 0.41 0.00 0.00 0.00 175.76 175.96 1gqc n GLY 42 N -1.18 0.86 3.64 0.00 0.00 -1.26 -4.92 105.19 102.33 1gqc n GLY 42 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 1gqc n GLY 42 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gqc s VAL 43 N -3.44 4.94 0.05 1.61 1.01 -1.25 -4.38 120.40 118.93 1gqc s VAL 43 Ca 0.00 0.02 -0.08 0.00 0.00 0.00 0.00 61.98 61.93 1gqc s VAL 43 Cb 0.00 -3.25 -0.31 0.00 0.00 0.00 0.00 36.38 32.82 1gqc s VAL 43 CO 0.00 0.43 1.06 0.00 0.00 0.00 0.00 175.10 176.58 1gqc h ALA 44 N 6.96 0.04 -3.06 5.51 0.00 -1.16 -3.48 119.26 124.08 1gqc h ALA 44 Ca -0.38 -0.91 -0.17 0.00 0.00 0.00 0.00 54.91 53.46 1gqc h ALA 44 Cb 1.17 0.10 -0.23 0.00 0.00 0.00 0.00 17.79 18.82 1gqc h ALA 44 CO 0.69 0.91 -0.52 -1.21 0.00 0.00 0.00 179.25 179.12 1gqc s GLU 45 N -2.63 0.33 -0.14 0.00 2.02 -1.24 -5.06 118.70 111.97 1gqc s GLU 45 Ca -0.06 -0.10 0.01 0.00 0.02 0.00 0.00 54.97 54.84 1gqc s GLU 45 Cb 0.06 0.14 0.02 0.00 0.10 0.00 0.00 34.13 34.45 1gqc s GLU 45 CO 0.90 -0.07 -0.18 0.08 0.02 0.00 0.00 175.26 176.01 1gqc s VAL 46 N -0.66 1.82 0.09 2.63 1.01 -1.26 -0.51 120.40 123.51 1gqc s VAL 46 Ca -0.08 -0.82 0.08 0.00 0.00 0.00 0.00 61.98 61.17 1gqc s VAL 46 Cb -0.04 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.66 1gqc s VAL 46 CO 0.01 0.50 -0.21 0.26 0.00 0.00 0.00 175.10 175.66 1gqc s TRP 47 N 1.11 1.78 -0.30 5.22 0.52 0.11 -4.49 118.94 122.89 1gqc s TRP 47 Ca -0.02 -0.41 -0.06 0.00 0.02 0.00 0.00 56.10 55.64 1gqc s TRP 47 Cb -0.14 -1.00 0.02 0.00 -1.15 0.00 0.00 33.47 31.20 1gqc s TRP 47 CO -0.06 0.17 0.07 0.08 0.02 0.00 0.00 176.95 177.23 1gqc s VAL 48 N -1.06 3.80 -0.46 4.03 1.01 -1.03 0.04 120.40 126.73 1gqc s VAL 48 Ca 0.07 -0.84 -0.19 0.00 0.00 0.00 0.00 61.98 61.01 1gqc s VAL 48 Cb -0.10 -3.00 0.04 0.00 0.00 0.00 0.00 36.38 33.32 1gqc s VAL 48 CO 0.04 0.03 0.60 0.00 0.00 0.00 0.00 175.10 175.77 1gqc s ALA 49 N 1.46 3.37 0.48 5.51 0.00 -0.51 -1.51 121.76 130.55 1gqc s ALA 49 Ca 0.01 -1.47 0.03 0.00 0.00 0.00 0.00 51.96 50.54 1gqc s ALA 49 Cb -0.18 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 1gqc s ALA 49 CO 0.02 -1.84 0.01 -0.08 0.00 0.00 0.00 175.76 173.87 1gqc s THR 50 N 2.63 1.45 0.00 0.00 -1.32 -0.98 -0.98 115.64 116.43 1gqc s THR 50 Ca 0.18 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.66 1gqc s THR 50 Cb -0.16 -2.45 0.00 0.00 -1.51 0.00 0.00 72.50 68.38 1gqc s THR 50 CO 0.15 0.00 0.00 -0.90 -2.21 0.00 0.00 174.62 171.66 1gqc n ASP 51 N -1.17 1.58 -4.40 8.08 5.75 -1.26 -0.83 116.55 124.31 1gqc n ASP 51 Ca -0.14 -0.26 -0.32 0.00 -0.01 0.00 0.00 54.79 54.05 1gqc n ASP 51 Cb 0.67 0.84 -0.14 0.00 -1.03 0.00 0.00 41.12 41.45 1gqc n ASP 51 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1gqc s ASP 52 N -1.15 3.74 0.54 -1.12 -1.08 -1.26 -4.80 116.67 111.54 1gqc s ASP 52 Ca 0.00 -0.31 0.24 0.00 -0.52 0.00 0.00 52.55 51.96 1gqc s ASP 52 Cb 0.00 -0.95 1.42 0.00 -1.46 0.00 0.00 42.92 41.93 1gqc s ASP 52 CO 0.00 0.29 2.06 -0.65 0.52 0.00 0.00 175.17 177.39 1gqc h PRO 53 N 5.77 0.00 -0.34 4.34 0.11 -1.99 -1.97 132.00 137.93 1gqc h PRO 53 Ca -0.39 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.59 1gqc h PRO 53 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1gqc h PRO 53 CO 0.50 0.00 -0.32 0.00 -0.21 0.00 0.00 178.00 177.97 1gqc h ARG 54 N 0.00 0.75 -0.01 1.05 3.08 -1.99 -0.81 114.38 116.45 1gqc h ARG 54 Ca 0.15 -0.35 -0.00 0.00 0.07 0.00 0.00 59.98 59.84 1gqc h ARG 54 Cb 0.63 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.67 1gqc h ARG 54 CO -0.00 0.97 -0.01 0.28 -1.07 0.00 0.00 179.97 180.14 1gqc h VAL 55 N 0.63 1.38 -0.95 2.04 2.07 -1.77 -1.88 116.25 117.77 1gqc h VAL 55 Ca 0.07 -1.13 0.17 0.00 0.82 0.00 0.00 66.70 66.64 1gqc h VAL 55 Cb 0.85 2.12 -0.10 0.00 -1.52 0.00 0.00 31.29 32.65 1gqc h VAL 55 CO 0.07 0.29 0.55 -0.08 0.02 0.00 0.00 177.57 178.43 1gqc h GLU 56 N -0.45 0.70 -0.24 1.57 4.81 -1.35 -0.27 114.58 119.35 1gqc h GLU 56 Ca 0.00 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.14 1gqc h GLU 56 Cb 0.49 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 1gqc h GLU 56 CO 0.00 0.46 -0.05 1.96 -0.73 0.00 0.00 179.01 180.66 1gqc h GLN 57 N 0.72 0.46 -0.97 1.92 1.08 -1.04 -2.27 115.11 115.00 1gqc h GLN 57 Ca 0.54 -0.17 0.01 0.00 -1.45 0.00 0.00 58.65 57.58 1gqc h GLN 57 Cb 0.80 -0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 28.15 1gqc h GLN 57 CO -0.38 0.68 0.64 0.00 -0.95 0.00 0.00 178.83 178.83 1gqc h ALA 58 N 0.76 1.24 -0.44 3.87 0.00 -0.47 -0.27 119.26 123.95 1gqc h ALA 58 Ca 0.06 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 1gqc h ALA 58 Cb 0.50 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1gqc h ALA 58 CO 0.02 0.61 -0.25 0.28 0.00 0.00 0.00 179.25 179.92 1gqc h VAL 59 N 1.31 1.27 0.00 0.00 2.07 -1.02 -3.08 116.25 116.80 1gqc h VAL 59 Ca 0.36 -1.40 -0.12 0.00 0.82 0.00 0.00 66.70 66.36 1gqc h VAL 59 Cb -0.14 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 1gqc h VAL 59 CO -0.08 0.48 -0.57 1.56 0.02 0.00 0.00 177.57 178.98 1gqc h GLN 60 N 0.79 0.00 0.00 1.57 4.20 -0.91 0.26 115.11 121.02 1gqc h GLN 60 Ca 0.10 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.74 1gqc h GLN 60 Cb 0.81 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.58 1gqc h GLN 60 CO 0.07 0.57 -0.30 0.00 -0.67 0.00 0.00 178.83 178.49 1gqc h ALA 61 N 1.43 1.35 -0.55 3.87 0.00 -0.97 -2.18 119.26 122.21 1gqc h ALA 61 Ca -0.01 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1gqc h ALA 61 Cb 1.17 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1gqc h ALA 61 CO 0.07 0.38 0.00 1.97 0.00 0.00 0.00 179.25 181.67 1gqc n PHE 62 N -3.96 1.61 -0.19 0.00 1.16 -1.21 -4.94 117.46 109.93 1gqc n PHE 62 Ca -0.02 -0.69 0.00 0.00 -1.87 0.00 0.00 57.45 54.87 1gqc n PHE 62 Cb 0.37 -0.35 0.00 0.00 -1.61 0.00 0.00 39.48 37.89 1gqc n PHE 62 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1gqc n GLY 63 N 0.67 1.17 3.71 4.97 0.00 -0.82 -5.06 105.19 109.82 1gqc n GLY 63 Ca 0.25 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.99 1gqc n GLY 63 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gqc s GLY 64 N -1.79 1.57 -0.17 -0.02 0.00 0.91 -4.94 107.32 102.87 1gqc s GLY 64 Ca 0.00 -0.46 -0.06 0.00 0.00 0.00 0.00 44.72 44.20 1gqc s GLY 64 CO 0.00 0.15 0.02 0.54 0.00 0.00 0.00 173.10 173.81 1gqc s LYS 65 N -5.09 3.84 0.11 2.90 1.02 -1.26 -4.07 119.74 117.18 1gqc s LYS 65 Ca 0.65 -0.42 0.06 0.00 0.02 0.00 0.00 55.97 56.28 1gqc s LYS 65 Cb -0.17 -3.09 -0.04 0.00 -0.52 0.00 0.00 37.83 34.01 1gqc s LYS 65 CO 0.56 0.24 -0.14 0.00 -0.92 0.00 0.00 175.35 175.09 1gqc s ALA 66 N 0.41 1.43 -0.06 5.17 0.00 -1.26 -2.46 121.76 124.99 1gqc s ALA 66 Ca 0.00 -1.22 -0.01 0.00 0.00 0.00 0.00 51.96 50.74 1gqc s ALA 66 Cb -0.13 -0.09 0.03 0.00 0.00 0.00 0.00 23.12 22.92 1gqc s ALA 66 CO 0.01 0.13 -0.00 -1.50 0.00 0.00 0.00 175.76 174.40 1gqc s ILE 67 N -1.87 0.35 0.39 0.00 2.07 -0.57 -4.93 121.20 116.64 1gqc s ILE 67 Ca 0.06 0.10 -0.26 0.00 -1.41 0.00 0.00 60.65 59.14 1gqc s ILE 67 Cb -0.06 -0.49 -0.09 0.00 0.13 0.00 0.00 42.46 41.95 1gqc s ILE 67 CO 0.03 0.24 1.18 -0.04 -1.91 0.00 0.00 174.94 174.44 1gqc s MET 68 N 1.71 4.11 0.10 3.50 -1.94 -1.26 -2.32 119.30 123.20 1gqc s MET 68 Ca 0.01 1.88 -0.03 0.00 -1.71 0.00 0.00 55.69 55.83 1gqc s MET 68 Cb -0.13 -2.74 -0.03 0.00 2.01 0.00 0.00 34.83 33.95 1gqc s MET 68 CO -0.04 -0.28 0.09 0.95 -0.01 0.00 0.00 175.02 175.72 1gqc s THR 69 N -1.37 0.14 0.14 2.05 -4.23 -0.01 -4.90 115.64 107.46 1gqc s THR 69 Ca 0.56 -1.68 -0.34 0.00 -1.18 0.00 0.00 61.69 59.05 1gqc s THR 69 Cb -0.32 -1.73 -0.16 0.00 1.34 0.00 0.00 72.50 71.64 1gqc s THR 69 CO 0.40 -0.64 1.26 0.54 -0.54 0.00 0.00 174.62 175.63 1gqc n ARG 70 N -0.04 1.24 -0.13 3.99 1.74 -1.26 -4.47 116.66 117.73 1gqc n ARG 70 Ca -0.10 0.45 0.02 0.00 -0.77 0.00 0.00 57.85 57.45 1gqc n ARG 70 Cb 0.62 -2.02 0.08 0.00 -1.02 0.00 0.00 32.46 30.13 1gqc n ARG 70 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1gqc n ASN 71 N 2.26 1.39 -0.60 0.55 6.94 -1.26 -3.66 115.26 120.89 1gqc n ASN 71 Ca 0.16 -2.09 0.06 0.00 -0.02 0.00 0.00 54.58 52.69 1gqc n ASN 71 Cb 0.23 -0.30 0.12 0.00 -2.36 0.00 0.00 39.78 37.47 1gqc n ASN 71 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1gqc n ASP 72 N 0.05 1.46 -4.78 0.53 3.85 -1.26 -5.05 116.55 111.35 1gqc n ASP 72 Ca 0.06 -2.96 -0.36 0.00 -0.71 0.00 0.00 54.79 50.81 1gqc n ASP 72 Cb 0.28 -0.40 -0.03 0.00 -1.35 0.00 0.00 41.12 39.62 1gqc n ASP 72 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.20 175.19 1gqc s HIS 73 N -1.94 3.15 -0.83 2.11 3.76 -1.24 -4.96 115.29 115.34 1gqc s HIS 73 Ca 0.29 1.61 0.25 0.00 -0.15 0.00 0.00 55.06 57.06 1gqc s HIS 73 Cb 0.28 -3.17 0.56 0.00 1.11 0.00 0.00 32.58 31.37 1gqc s HIS 73 CO -0.05 -0.84 1.47 0.39 -0.85 0.00 0.00 174.74 174.86 1gqc n GLU 74 N -0.28 0.14 -3.50 1.40 -0.58 -1.26 -4.96 120.64 111.59 1gqc n GLU 74 Ca 0.06 0.05 -0.09 0.00 -0.42 0.00 0.00 57.16 56.76 1gqc n GLU 74 Cb 0.50 -1.60 -0.02 0.00 -0.57 0.00 0.00 31.44 29.75 1gqc n GLU 74 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1gqc s SER 75 N -3.61 -0.37 0.44 1.62 1.04 -1.26 -5.02 113.70 106.54 1gqc s SER 75 Ca 0.09 0.03 0.18 0.00 0.48 0.00 0.00 55.95 56.73 1gqc s SER 75 Cb 0.16 0.39 1.12 0.00 0.10 0.00 0.00 66.02 67.78 1gqc s SER 75 CO 0.68 -0.61 1.92 1.23 0.98 0.00 0.00 173.24 177.43 1gqc h GLY 76 N 2.04 0.62 1.15 7.32 0.00 -1.97 -1.09 103.07 111.14 1gqc h GLY 76 Ca -0.22 -0.15 -0.07 0.00 0.00 0.00 0.00 47.33 46.89 1gqc h GLY 76 CO 0.31 0.04 0.14 -0.84 0.00 0.00 0.00 176.54 176.19 1gqc h THR 77 N 0.35 1.26 -0.07 4.70 2.02 -1.99 -0.57 112.91 118.60 1gqc h THR 77 Ca 0.38 -0.97 -0.07 0.00 0.77 0.00 0.00 66.41 66.52 1gqc h THR 77 Cb 0.97 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 1gqc h THR 77 CO -0.11 0.37 -0.29 0.44 0.37 0.00 0.00 175.52 176.29 1gqc h ASP 78 N 0.99 0.13 0.28 4.18 3.45 -1.61 -1.29 116.42 122.57 1gqc h ASP 78 Ca 0.20 -0.04 -0.25 0.00 0.43 0.00 0.00 57.03 57.38 1gqc h ASP 78 Cb 0.38 -0.04 0.01 0.00 -0.56 0.00 0.00 39.33 39.13 1gqc h ASP 78 CO 0.01 0.43 -1.03 -0.09 -1.57 0.00 0.00 179.24 176.99 1gqc h ARG 79 N 0.12 0.47 -0.64 3.56 2.43 -1.16 -2.99 114.38 116.17 1gqc h ARG 79 Ca 0.02 -0.55 -0.02 0.00 -0.81 0.00 0.00 59.98 58.62 1gqc h ARG 79 Cb 0.59 0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.27 1gqc h ARG 79 CO 0.04 1.19 0.30 1.25 -1.51 0.00 0.00 179.97 181.24 1gqc h LEU 80 N 0.25 0.82 -0.98 3.80 5.85 -0.54 -1.04 115.31 123.47 1gqc h LEU 80 Ca -0.11 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.46 1gqc h LEU 80 Cb 1.68 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.48 1gqc h LEU 80 CO 0.18 0.70 0.04 0.58 -0.34 0.00 0.00 178.44 179.61 1gqc h VAL 81 N 0.91 1.23 -0.41 1.05 2.07 -1.16 -0.42 116.25 119.52 1gqc h VAL 81 Ca 0.22 -0.93 -0.06 0.00 0.82 0.00 0.00 66.70 66.76 1gqc h VAL 81 Cb 0.10 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1gqc h VAL 81 CO -0.03 0.33 0.03 -0.08 0.02 0.00 0.00 177.57 177.84 1gqc h GLU 82 N 0.74 0.71 -0.47 1.57 4.81 -1.18 -2.66 114.58 118.10 1gqc h GLU 82 Ca 0.15 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1gqc h GLU 82 Cb 0.39 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.68 1gqc h GLU 82 CO 0.01 0.77 0.24 0.28 -0.73 0.00 0.00 179.01 179.58 1gqc h VAL 83 N 0.55 1.15 -0.73 0.32 2.07 -0.63 -2.92 116.25 116.06 1gqc h VAL 83 Ca 0.12 -0.42 0.07 0.00 0.82 0.00 0.00 66.70 67.29 1gqc h VAL 83 Cb 0.43 0.55 -0.06 0.00 -1.52 0.00 0.00 31.29 30.69 1gqc h VAL 83 CO 0.02 0.17 0.41 -0.03 0.02 0.00 0.00 177.57 178.16 1gqc h MET 84 N 0.65 0.71 0.00 1.57 1.85 -0.73 0.39 114.93 119.37 1gqc h MET 84 Ca 0.17 -0.04 -0.03 0.00 -0.61 0.00 0.00 59.70 59.19 1gqc h MET 84 Cb 0.05 -0.16 -0.00 0.00 0.43 0.00 0.00 31.60 31.92 1gqc h MET 84 CO -0.02 0.47 -0.13 0.45 -0.40 0.00 0.00 176.91 177.28 1gqc h HIS 85 N 0.73 0.00 0.00 1.39 -0.00 -1.47 -3.19 115.15 112.61 1gqc h HIS 85 Ca 0.33 0.00 -0.27 0.00 -0.00 0.00 0.00 60.37 60.43 1gqc h HIS 85 Cb 0.23 0.00 -0.05 0.00 -0.00 0.00 0.00 27.41 27.59 1gqc h HIS 85 CO -0.07 0.13 -2.09 1.63 -0.00 0.00 0.00 177.93 177.53 1gqc n LYS 86 N -3.54 0.67 -4.06 2.45 5.02 -0.10 -4.86 118.16 113.73 1gqc n LYS 86 Ca -0.01 0.04 -0.33 0.00 -2.02 0.00 0.00 58.31 55.99 1gqc n LYS 86 Cb 0.27 -1.60 -0.15 0.00 -0.02 0.00 0.00 35.03 33.53 1gqc n LYS 86 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1gqc s VAL 87 N -2.72 2.26 0.02 -0.18 1.01 0.12 -5.09 120.40 115.82 1gqc s VAL 87 Ca -0.08 -1.44 -0.30 0.00 0.00 0.00 0.00 61.98 60.15 1gqc s VAL 87 Cb 0.08 -2.25 -0.05 0.00 0.00 0.00 0.00 36.38 34.16 1gqc s VAL 87 CO 0.84 0.09 1.22 -1.61 0.00 0.00 0.00 175.10 175.63 1gqc s GLU 88 N 1.16 4.40 0.11 2.72 2.02 -1.26 -4.64 118.70 123.21 1gqc s GLU 88 Ca -0.05 1.76 -0.25 0.00 0.02 0.00 0.00 54.97 56.45 1gqc s GLU 88 Cb -0.18 -3.43 0.08 0.00 0.10 0.00 0.00 34.13 30.70 1gqc s GLU 88 CO -0.06 -0.34 0.68 0.00 0.02 0.00 0.00 175.26 175.56 1gqc s ALA 89 N 1.50 -1.67 -0.07 5.21 0.00 -1.26 -4.99 121.76 120.47 1gqc s ALA 89 Ca 0.58 0.66 0.10 0.00 0.00 0.00 0.00 51.96 53.31 1gqc s ALA 89 Cb -0.28 0.72 -0.24 0.00 0.00 0.00 0.00 23.12 23.32 1gqc s ALA 89 CO 0.27 -0.73 0.54 -0.25 0.00 0.00 0.00 175.76 175.59 1gqc n ASP 90 N -0.29 1.01 -3.95 0.00 8.00 -0.41 -4.66 116.55 116.25 1gqc n ASP 90 Ca -0.15 0.33 -0.22 0.00 0.71 0.00 0.00 54.79 55.46 1gqc n ASP 90 Cb 0.64 -0.10 -0.16 0.00 -0.02 0.00 0.00 41.12 41.47 1gqc n ASP 90 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1gqc s ILE 91 N -2.58 0.82 -0.11 0.53 1.01 -0.60 -1.68 121.20 118.60 1gqc s ILE 91 Ca -0.09 -0.29 0.02 0.00 0.00 0.00 0.00 60.65 60.30 1gqc s ILE 91 Cb 0.08 -0.79 -0.01 0.00 0.01 0.00 0.00 42.46 41.74 1gqc s ILE 91 CO 0.81 0.29 -0.18 -0.31 0.00 0.00 0.00 174.94 175.55 1gqc s TYR 92 N 0.83 2.69 -0.20 3.97 1.51 -0.14 -1.78 117.35 124.23 1gqc s TYR 92 Ca -0.12 -0.72 -0.05 0.00 -1.01 0.00 0.00 57.07 55.17 1gqc s TYR 92 Cb -0.15 -1.76 -0.03 0.00 -0.11 0.00 0.00 41.96 39.92 1gqc s TYR 92 CO 0.01 -0.23 0.01 0.42 -1.11 0.00 0.00 175.55 174.65 1gqc s ILE 93 N 0.18 4.02 -0.40 2.71 1.01 -0.56 0.36 121.20 128.51 1gqc s ILE 93 Ca -0.10 -0.29 -0.14 0.00 0.00 0.00 0.00 60.65 60.12 1gqc s ILE 93 Cb -0.16 -2.82 0.02 0.00 0.01 0.00 0.00 42.46 39.52 1gqc s ILE 93 CO 0.06 0.43 0.28 0.21 0.00 0.00 0.00 174.94 175.91 1gqc s ASN 94 N 0.99 6.02 -0.19 3.58 2.47 0.30 -0.73 114.94 127.38 1gqc s ASN 94 Ca 0.02 -0.94 -0.06 0.00 0.42 0.00 0.00 52.86 52.30 1gqc s ASN 94 Cb -0.14 -2.13 -0.03 0.00 -1.45 0.00 0.00 41.25 37.50 1gqc s ASN 94 CO 0.02 -0.44 0.02 -0.76 -3.72 0.00 0.00 177.10 172.22 1gqc s LEU 95 N 1.64 3.50 0.30 3.21 1.43 -0.84 -1.92 118.68 126.00 1gqc s LEU 95 Ca 0.04 -0.07 -0.29 0.00 -1.03 0.00 0.00 54.13 52.78 1gqc s LEU 95 Cb -0.19 -1.88 -0.11 0.00 0.03 0.00 0.00 46.19 44.04 1gqc s LEU 95 CO 0.09 0.13 1.45 -1.10 0.23 0.00 0.00 176.35 177.15 1gqc s GLN 96 N 0.64 4.22 0.00 1.70 -1.52 -1.26 -3.85 119.66 119.58 1gqc s GLN 96 Ca 0.01 2.40 0.29 0.00 -1.95 0.00 0.00 55.36 56.11 1gqc s GLN 96 Cb -0.14 -3.05 1.25 0.00 -0.22 0.00 0.00 33.01 30.85 1gqc s GLN 96 CO 0.02 -0.44 1.91 0.41 -0.25 0.00 0.00 175.29 176.94 1gqc n GLY 97 N 1.51 -1.39 1.03 3.09 0.00 -1.23 -3.46 105.19 104.75 1gqc n GLY 97 Ca 0.04 -0.14 0.04 0.00 0.00 0.00 0.00 46.02 45.95 1gqc n GLY 97 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gqc n ASP 98 N -1.41 3.49 -3.75 1.61 5.68 -1.26 -4.53 116.55 116.39 1gqc n ASP 98 Ca 0.09 -3.26 -0.28 0.00 -0.50 0.00 0.00 54.79 50.84 1gqc n ASP 98 Cb 0.31 -0.59 -0.12 0.00 -1.14 0.00 0.00 41.12 39.59 1gqc n ASP 98 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1gqc s GLU 99 N -2.97 1.90 0.00 0.11 2.02 -1.22 -0.94 118.70 117.60 1gqc s GLU 99 Ca 0.44 -2.84 0.30 0.00 0.02 0.00 0.00 54.97 52.88 1gqc s GLU 99 Cb 0.37 -2.77 1.41 0.00 0.10 0.00 0.00 34.13 33.24 1gqc s GLU 99 CO 0.06 -1.29 2.00 -0.35 0.02 0.00 0.00 175.26 175.70 1gqc n PRO 100 N 2.42 0.34 -0.31 0.39 -0.04 -1.26 -3.53 135.00 133.02 1gqc n PRO 100 Ca 0.21 -0.02 0.07 0.00 -0.04 0.00 0.00 63.50 63.71 1gqc n PRO 100 Cb 0.38 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.56 1gqc n PRO 100 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1gqc n MET 101 N -1.31 2.37 -1.64 0.54 2.81 -1.26 -4.68 117.12 113.95 1gqc n MET 101 Ca 0.12 -1.76 -0.41 0.00 -1.81 0.00 0.00 57.70 53.85 1gqc n MET 101 Cb 0.27 -1.49 0.02 0.00 -0.71 0.00 0.00 33.22 31.30 1gqc n MET 101 CO 0.00 0.00 0.00 1.51 1.51 0.00 0.00 175.97 178.99 1gqc n ILE 102 N 0.78 2.60 -3.69 2.02 0.13 -1.23 -4.63 119.36 115.34 1gqc n ILE 102 Ca 0.16 -0.50 -0.38 0.00 -1.10 0.00 0.00 62.75 60.93 1gqc n ILE 102 Cb 0.49 -1.27 -0.12 0.00 -0.84 0.00 0.00 39.64 37.90 1gqc n ILE 102 CO 0.00 0.00 0.00 -0.13 2.80 0.00 0.00 176.55 179.22 1gqc s ARG 103 N -2.14 3.15 0.35 9.51 0.52 -1.26 -4.98 118.95 124.10 1gqc s ARG 103 Ca 0.64 -0.83 0.16 0.00 -0.52 0.00 0.00 55.73 55.18 1gqc s ARG 103 Cb -0.53 -3.51 1.14 0.00 0.52 0.00 0.00 34.95 32.57 1gqc s ARG 103 CO 0.56 -0.47 1.65 -1.35 0.02 0.00 0.00 175.30 175.71 1gqc h PRO 104 N 8.31 0.26 -0.22 3.54 0.11 -1.94 0.86 132.00 142.92 1gqc h PRO 104 Ca -0.31 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.77 1gqc h PRO 104 Cb 1.13 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1gqc h PRO 104 CO 0.62 0.17 0.06 0.00 -0.21 0.00 0.00 178.00 178.64 1gqc h ARG 105 N 0.27 0.31 -0.43 1.05 2.47 -1.93 -1.85 114.38 114.28 1gqc h ARG 105 Ca 0.75 -0.04 -0.09 0.00 -1.26 0.00 0.00 59.98 59.35 1gqc h ARG 105 Cb 1.79 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 30.04 1gqc h ARG 105 CO -0.61 0.29 -0.07 -0.44 0.56 0.00 0.00 179.97 179.70 1gqc h ASP 106 N 0.31 0.80 0.39 7.04 3.32 0.33 -2.16 116.42 126.45 1gqc h ASP 106 Ca 0.08 -0.35 -0.04 0.00 0.02 0.00 0.00 57.03 56.74 1gqc h ASP 106 Cb 0.12 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1gqc h ASP 106 CO -0.00 0.96 -0.20 0.58 -1.72 0.00 0.00 179.24 178.86 1gqc h VAL 107 N 0.63 0.82 -0.19 -1.35 2.07 -1.16 -2.48 116.25 114.60 1gqc h VAL 107 Ca 0.11 -0.78 -0.16 0.00 0.82 0.00 0.00 66.70 66.69 1gqc h VAL 107 Cb 0.59 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 1gqc h VAL 107 CO 0.04 0.20 -0.52 -0.33 0.02 0.00 0.00 177.57 176.97 1gqc h GLU 108 N 0.00 0.69 -0.40 1.57 5.08 -1.00 -2.07 114.58 118.45 1gqc h GLU 108 Ca -0.00 -0.49 0.07 0.00 -1.00 0.00 0.00 59.36 57.94 1gqc h GLU 108 Cb 0.45 0.08 -0.06 0.00 0.50 0.00 0.00 28.75 29.72 1gqc h GLU 108 CO 0.03 1.11 0.06 1.15 -1.00 0.00 0.00 179.01 180.35 1gqc h THR 109 N 0.39 0.76 -0.18 1.13 2.02 -1.01 0.24 112.91 116.25 1gqc h THR 109 Ca -0.01 -0.06 0.03 0.00 0.77 0.00 0.00 66.41 67.14 1gqc h THR 109 Cb 1.14 0.57 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 1gqc h THR 109 CO 0.11 0.03 -0.02 0.25 0.37 0.00 0.00 175.52 176.27 1gqc h LEU 110 N 0.18 -0.11 -0.53 2.58 5.85 -1.40 -1.19 115.31 120.69 1gqc h LEU 110 Ca 0.20 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.93 1gqc h LEU 110 Cb 0.25 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 1gqc h LEU 110 CO -0.28 -0.03 0.23 0.25 -0.34 0.00 0.00 178.44 178.27 1gqc h LEU 111 N 0.04 0.72 -1.24 2.25 6.46 -0.80 -2.67 115.31 120.07 1gqc h LEU 111 Ca 0.08 -0.16 0.02 0.00 -0.12 0.00 0.00 57.88 57.71 1gqc h LEU 111 Cb 0.11 -0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 39.82 1gqc h LEU 111 CO -0.16 0.68 0.52 1.56 -0.62 0.00 0.00 178.44 180.42 1gqc h GLN 112 N 0.72 0.99 -0.83 1.25 1.08 -0.20 -1.32 115.11 116.80 1gqc h GLN 112 Ca 0.18 -0.06 -0.00 0.00 -1.45 0.00 0.00 58.65 57.31 1gqc h GLN 112 Cb 0.17 -0.22 -0.04 0.00 -0.05 0.00 0.00 27.48 27.34 1gqc h GLN 112 CO -0.02 0.65 0.50 0.78 -0.95 0.00 0.00 178.83 179.80 1gqc h GLY 113 N 1.02 1.21 0.82 3.46 0.00 -0.89 0.20 103.07 108.89 1gqc h GLY 113 Ca 0.30 -0.50 -0.04 0.00 0.00 0.00 0.00 47.33 47.08 1gqc h GLY 113 CO -0.08 0.49 -0.03 -0.33 0.00 0.00 0.00 176.54 176.59 1gqc h MET 114 N 1.14 0.40 0.00 4.80 2.86 -1.10 -3.09 114.93 119.94 1gqc h MET 114 Ca 0.30 -0.14 -0.10 0.00 -2.06 0.00 0.00 59.70 57.69 1gqc h MET 114 Cb -0.04 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 1gqc h MET 114 CO -0.06 0.62 -0.50 0.00 1.06 0.00 0.00 176.91 178.04 1gqc h ARG 115 N 0.14 0.00 0.00 1.72 3.08 -0.96 -2.91 114.38 115.46 1gqc h ARG 115 Ca 0.06 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 1gqc h ARG 115 Cb 0.46 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 1gqc h ARG 115 CO 0.02 0.50 -0.02 -0.44 -1.07 0.00 0.00 179.97 178.95 1gqc h ASP 116 N 0.00 0.00 -2.57 7.04 3.32 -0.61 -3.37 116.42 120.23 1gqc h ASP 116 Ca -0.00 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.49 1gqc h ASP 116 Cb 0.89 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 40.06 1gqc h ASP 116 CO 0.06 0.02 -0.83 -0.62 -1.72 0.00 0.00 179.24 176.16 1gqc s ASP 117 N -5.84 2.92 0.00 6.45 2.15 -1.10 -4.99 116.67 116.25 1gqc s ASP 117 Ca 0.02 -2.00 0.05 0.00 0.43 0.00 0.00 52.55 51.06 1gqc s ASP 117 Cb 0.08 -0.31 0.24 0.00 -0.30 0.00 0.00 42.92 42.63 1gqc s ASP 117 CO 0.58 -0.33 1.09 -2.65 -0.17 0.00 0.00 175.17 173.69 1gqc n PRO 118 N 4.25 0.03 0.04 4.34 -0.02 -1.21 -1.73 135.00 140.70 1gqc n PRO 118 Ca 0.09 0.33 0.12 0.00 -2.02 0.00 0.00 63.50 62.02 1gqc n PRO 118 Cb 0.38 -1.50 0.15 0.00 -0.02 0.00 0.00 33.50 32.52 1gqc n PRO 118 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gqc n ALA 119 N -1.40 3.22 -2.08 3.55 0.00 -1.26 -4.87 120.51 117.67 1gqc n ALA 119 Ca 0.02 -0.32 -0.43 0.00 0.00 0.00 0.00 53.44 52.72 1gqc n ALA 119 Cb 0.05 -1.10 -0.03 0.00 0.00 0.00 0.00 19.45 18.37 1gqc n ALA 119 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1gqc s LEU 120 N -3.82 4.06 -0.05 0.00 2.96 -0.71 -4.93 118.68 116.20 1gqc s LEU 120 Ca 0.07 1.86 -0.25 0.00 -0.22 0.00 0.00 54.13 55.60 1gqc s LEU 120 Cb 0.15 -3.53 -0.19 0.00 0.50 0.00 0.00 46.19 43.11 1gqc s LEU 120 CO 0.74 -1.12 1.05 -0.65 -1.32 0.00 0.00 176.35 175.05 1gqc h PRO 121 N 10.23 -0.09 -5.08 0.98 0.11 -1.90 -3.44 132.00 132.82 1gqc h PRO 121 Ca -0.35 0.01 -0.38 0.00 0.11 0.00 0.00 66.00 65.38 1gqc h PRO 121 Cb 1.16 0.02 -0.22 0.00 0.11 0.00 0.00 31.00 32.07 1gqc h PRO 121 CO 0.98 0.44 -0.77 0.08 -0.21 0.00 0.00 178.00 178.52 1gqc s VAL 122 N -3.68 0.92 0.03 3.15 1.01 -1.09 -1.37 120.40 119.37 1gqc s VAL 122 Ca -0.15 -1.13 0.02 0.00 0.00 0.00 0.00 61.98 60.73 1gqc s VAL 122 Cb 0.01 -0.90 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 1gqc s VAL 122 CO 0.60 -0.20 -0.08 0.00 0.00 0.00 0.00 175.10 175.41 1gqc s ALA 123 N -1.16 0.63 0.35 5.51 0.00 -0.45 -1.62 121.76 125.01 1gqc s ALA 123 Ca -0.03 -0.66 -0.02 0.00 0.00 0.00 0.00 51.96 51.25 1gqc s ALA 123 Cb -0.09 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.01 1gqc s ALA 123 CO 0.01 0.04 0.48 -0.08 0.00 0.00 0.00 175.76 176.22 1gqc s THR 124 N -1.04 0.00 0.28 0.00 -1.32 -0.30 -1.59 115.64 111.67 1gqc s THR 124 Ca -0.06 -1.60 0.10 0.00 -1.21 0.00 0.00 61.69 58.92 1gqc s THR 124 Cb -0.08 -2.67 -0.05 0.00 -1.51 0.00 0.00 72.50 68.20 1gqc s THR 124 CO 0.00 0.00 -0.07 -0.76 -2.21 0.00 0.00 174.62 171.58 1gqc s LEU 125 N -3.26 2.96 0.08 9.08 1.43 -1.24 -1.89 118.68 125.83 1gqc s LEU 125 Ca 0.31 -0.82 -0.25 0.00 -1.03 0.00 0.00 54.13 52.35 1gqc s LEU 125 Cb -0.01 -1.46 0.06 0.00 0.03 0.00 0.00 46.19 44.82 1gqc s LEU 125 CO 0.21 -0.01 0.59 0.00 0.23 0.00 0.00 176.35 177.38 1gqc s HIS 127 N -2.80 -0.00 0.55 0.00 -3.43 -0.46 -1.10 115.29 108.05 1gqc s HIS 127 Ca -0.03 -0.07 -0.22 0.00 -0.80 0.00 0.00 55.06 53.94 1gqc s HIS 127 Cb -0.01 -0.01 -0.05 0.00 -1.43 0.00 0.00 32.58 31.08 1gqc s HIS 127 CO -0.05 -0.34 1.35 0.00 -2.00 0.00 0.00 174.74 173.71 1gqc n ALA 128 N 1.27 1.57 -2.55 -1.38 0.00 -1.26 -0.64 120.51 117.51 1gqc n ALA 128 Ca -0.22 0.12 -0.09 0.00 0.00 0.00 0.00 53.44 53.26 1gqc n ALA 128 Cb 0.56 -2.35 -0.07 0.00 0.00 0.00 0.00 19.45 17.58 1gqc n ALA 128 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1gqc s ILE 129 N -1.29 0.14 0.88 0.00 -4.36 -1.10 -4.78 121.20 110.70 1gqc s ILE 129 Ca 0.72 -1.19 -0.12 0.00 -0.26 0.00 0.00 60.65 59.80 1gqc s ILE 129 Cb -0.42 -1.31 0.12 0.00 1.25 0.00 0.00 42.46 42.10 1gqc s ILE 129 CO 0.49 -0.66 1.14 -0.94 0.24 0.00 0.00 174.94 175.21 1gqc s SER 130 N -2.79 3.80 0.30 4.36 1.04 -1.26 -4.21 113.70 114.94 1gqc s SER 130 Ca 0.04 0.98 0.07 0.00 0.48 0.00 0.00 55.95 57.51 1gqc s SER 130 Cb 0.05 -1.56 0.48 0.00 0.10 0.00 0.00 66.02 65.09 1gqc s SER 130 CO -0.10 -2.37 1.72 0.00 0.98 0.00 0.00 173.24 173.47 1gqc h ALA 131 N -1.37 1.15 -0.34 5.32 0.00 -1.97 -0.27 119.26 121.77 1gqc h ALA 131 Ca -0.49 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.00 1gqc h ALA 131 Cb 1.32 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1gqc h ALA 131 CO 0.62 0.56 0.11 0.00 0.00 0.00 0.00 179.25 180.55 1gqc h ALA 132 N 1.40 0.45 -0.63 0.00 0.00 -2.01 -2.69 119.26 115.77 1gqc h ALA 132 Ca 0.02 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1gqc h ALA 132 Cb 0.76 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1gqc h ALA 132 CO 0.06 0.09 0.20 0.93 0.00 0.00 0.00 179.25 180.53 1gqc h GLU 133 N 0.41 0.98 0.00 0.00 5.08 -1.83 -2.62 114.58 116.59 1gqc h GLU 133 Ca 0.11 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1gqc h GLU 133 Cb 0.25 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1gqc h GLU 133 CO -0.00 0.86 0.00 0.00 -1.00 0.00 0.00 179.01 178.87 1gqc h ALA 134 N 1.07 1.00 0.00 3.43 0.00 -0.78 -2.33 119.26 121.65 1gqc h ALA 134 Ca 0.20 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1gqc h ALA 134 Cb 0.29 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1gqc h ALA 134 CO -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 179.25 179.15 1gqc h ALA 135 N 2.04 1.00 -2.15 0.00 0.00 -1.15 -3.38 119.26 115.62 1gqc h ALA 135 Ca 0.00 -0.09 -0.57 0.00 0.00 0.00 0.00 54.91 54.26 1gqc h ALA 135 Cb 0.08 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1gqc h ALA 135 CO 0.00 0.12 0.92 -1.21 0.00 0.00 0.00 179.25 179.08 1gqc s GLU 136 N -3.57 4.22 0.48 0.00 0.41 -0.88 -4.89 118.70 114.46 1gqc s GLU 136 Ca 0.02 1.68 0.32 0.00 -0.41 0.00 0.00 54.97 56.58 1gqc s GLU 136 Cb 0.09 -3.78 1.41 0.00 -1.78 0.00 0.00 34.13 30.06 1gqc s GLU 136 CO 0.60 -0.73 1.95 -1.00 -0.49 0.00 0.00 175.26 175.59 1gqc h PRO 137 N 8.32 0.00 0.00 0.39 0.13 -1.86 -1.61 132.00 137.37 1gqc h PRO 137 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1gqc h PRO 137 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1gqc h PRO 137 CO 0.97 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.40 1gqc h SER 138 N 0.00 0.00 -3.41 1.44 4.64 -1.90 -3.41 113.55 110.91 1gqc h SER 138 Ca 0.00 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.72 1gqc h SER 138 Cb 0.37 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.34 1gqc h SER 138 CO 0.00 0.00 -0.43 -0.89 -0.87 0.00 0.00 176.83 174.64 1gqc s THR 139 N -3.57 5.35 -0.03 2.95 2.01 -0.61 -5.07 115.64 116.67 1gqc s THR 139 Ca 0.02 0.31 -0.21 0.00 0.31 0.00 0.00 61.69 62.12 1gqc s THR 139 Cb 0.08 -3.54 -0.05 0.00 0.01 0.00 0.00 72.50 69.01 1gqc s THR 139 CO 0.56 0.38 0.61 -0.69 -0.69 0.00 0.00 174.62 174.79 1gqc s VAL 140 N 0.73 4.97 0.03 3.82 1.01 -1.26 -4.71 120.40 124.99 1gqc s VAL 140 Ca 0.11 1.27 0.00 0.00 0.00 0.00 0.00 61.98 63.36 1gqc s VAL 140 Cb -0.13 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 1gqc s VAL 140 CO 0.02 0.36 0.13 -0.54 0.00 0.00 0.00 175.10 175.08 1gqc s LYS 141 N 0.16 3.18 0.00 2.72 3.01 0.12 -1.57 119.74 127.37 1gqc s LYS 141 Ca 0.32 -0.49 0.03 0.00 -1.01 0.00 0.00 55.97 54.82 1gqc s LYS 141 Cb -0.18 -2.92 -0.01 0.00 -1.01 0.00 0.00 37.83 33.72 1gqc s LYS 141 CO 0.17 0.62 -0.09 0.54 0.51 0.00 0.00 175.35 177.10 1gqc s VAL 142 N -1.34 0.73 -0.12 3.17 0.11 -0.80 -0.94 120.40 121.21 1gqc s VAL 142 Ca 0.28 -0.49 0.00 0.00 -2.93 0.00 0.00 61.98 58.84 1gqc s VAL 142 Cb -0.12 -0.63 -0.02 0.00 -1.53 0.00 0.00 36.38 34.08 1gqc s VAL 142 CO 0.20 0.14 -0.13 -0.69 -3.33 0.00 0.00 175.10 171.29 1gqc s VAL 143 N -0.35 3.08 0.16 2.04 1.01 -1.09 -4.36 120.40 120.88 1gqc s VAL 143 Ca 0.02 -0.66 0.09 0.00 0.00 0.00 0.00 61.98 61.43 1gqc s VAL 143 Cb -0.04 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 1gqc s VAL 143 CO -0.00 0.53 -0.19 0.68 0.00 0.00 0.00 175.10 176.12 1gqc s VAL 144 N 0.19 1.86 0.41 2.92 -7.23 -1.26 0.39 120.40 117.68 1gqc s VAL 144 Ca -0.08 -1.90 0.02 0.00 -1.81 0.00 0.00 61.98 58.21 1gqc s VAL 144 Cb -0.15 -1.85 0.08 0.00 0.56 0.00 0.00 36.38 35.02 1gqc s VAL 144 CO 0.05 -0.28 0.57 -0.46 -0.31 0.00 0.00 175.10 174.67 1gqc n ASN 145 N 0.35 0.99 -0.32 4.85 0.23 -0.92 -4.90 115.26 115.54 1gqc n ASN 145 Ca -0.14 -1.78 0.08 0.00 -0.53 0.00 0.00 54.58 52.21 1gqc n ASN 145 Cb 0.57 -0.35 0.28 0.00 -2.08 0.00 0.00 39.78 38.20 1gqc n ASN 145 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 1gqc h THR 146 N -0.31 0.93 -0.01 5.53 2.02 -2.02 0.30 112.91 119.34 1gqc h THR 146 Ca -0.19 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.68 1gqc h THR 146 Cb 0.75 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.09 1gqc h THR 146 CO 0.22 0.17 0.00 0.54 0.37 0.00 0.00 175.52 176.82 1gqc n ARG 147 N -4.57 1.14 -1.08 6.66 1.74 -1.26 -4.90 116.66 114.39 1gqc n ARG 147 Ca 0.17 -0.20 -0.03 0.00 -0.77 0.00 0.00 57.85 57.02 1gqc n ARG 147 Cb 0.36 -1.44 -0.01 0.00 -1.02 0.00 0.00 32.46 30.34 1gqc n ARG 147 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1gqc n GLN 148 N -0.70 -0.32 -2.61 5.56 6.02 0.11 -4.90 117.38 120.53 1gqc n GLN 148 Ca 0.21 0.45 -0.36 0.00 -0.01 0.00 0.00 57.00 57.28 1gqc n GLN 148 Cb 0.15 -3.98 -0.05 0.00 1.02 0.00 0.00 30.24 27.38 1gqc n GLN 148 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1gqc s ASP 149 N -2.61 6.92 0.24 1.08 1.01 -1.26 -0.92 116.67 121.13 1gqc s ASP 149 Ca 0.00 1.98 -0.30 0.00 0.71 0.00 0.00 52.55 54.94 1gqc s ASP 149 Cb 0.00 -2.58 -0.09 0.00 1.01 0.00 0.00 42.92 41.26 1gqc s ASP 149 CO 0.00 -0.37 1.13 0.00 0.21 0.00 0.00 175.17 176.14 1gqc s ALA 150 N -1.66 3.41 -0.19 5.23 0.00 -0.20 -2.16 121.76 126.19 1gqc s ALA 150 Ca 0.56 0.91 -0.04 0.00 0.00 0.00 0.00 51.96 53.39 1gqc s ALA 150 Cb -0.21 -3.36 -0.21 0.00 0.00 0.00 0.00 23.12 19.34 1gqc s ALA 150 CO 0.26 -0.24 0.08 1.28 0.00 0.00 0.00 175.76 177.14 1gqc n LEU 151 N 1.67 2.73 -3.56 0.00 4.77 0.16 -4.80 117.00 117.98 1gqc n LEU 151 Ca 0.01 0.07 -0.11 0.00 -0.03 0.00 0.00 56.01 55.95 1gqc n LEU 151 Cb 0.45 -1.01 -0.05 0.00 -2.33 0.00 0.00 43.42 40.48 1gqc n LEU 151 CO 0.55 0.86 0.72 -0.47 -1.33 0.00 0.00 177.39 177.71 1gqc s TYR 152 N -2.53 -0.40 -0.18 -1.77 5.04 -1.24 -5.01 117.35 111.24 1gqc s TYR 152 Ca -0.29 0.63 -0.01 0.00 -2.44 0.00 0.00 57.07 54.96 1gqc s TYR 152 Cb 0.08 0.46 -0.00 0.00 0.35 0.00 0.00 41.96 42.85 1gqc s TYR 152 CO 0.68 -0.41 -0.11 -0.06 -1.34 0.00 0.00 175.55 174.31 1gqc s PHE 153 N -1.44 2.86 0.04 4.97 0.40 -1.26 -2.69 117.98 120.85 1gqc s PHE 153 Ca -0.02 -1.07 -0.01 0.00 -0.60 0.00 0.00 56.93 55.23 1gqc s PHE 153 Cb -0.00 -1.98 -0.03 0.00 0.51 0.00 0.00 43.02 41.52 1gqc s PHE 153 CO 0.01 -0.54 -0.02 0.45 0.70 0.00 0.00 175.22 175.82 1gqc s SER 154 N 1.12 0.35 0.00 1.36 0.15 -0.11 -4.97 113.70 111.59 1gqc s SER 154 Ca 0.01 -0.74 0.24 0.00 0.70 0.00 0.00 55.95 56.16 1gqc s SER 154 Cb -0.14 0.16 0.31 0.00 -1.71 0.00 0.00 66.02 64.64 1gqc s SER 154 CO -0.03 -0.46 1.28 0.54 1.20 0.00 0.00 173.24 175.77 1gqc n ARG 155 N 0.83 0.43 -2.82 5.44 1.74 -1.26 0.15 116.66 121.17 1gqc n ARG 155 Ca -0.19 -0.30 -0.33 0.00 -0.77 0.00 0.00 57.85 56.26 1gqc n ARG 155 Cb 0.58 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 30.47 1gqc n ARG 155 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1gqc s SER 156 N -2.78 6.82 -0.59 0.55 0.01 -1.26 -4.21 113.70 112.24 1gqc s SER 156 Ca 0.15 1.54 -0.27 0.00 1.31 0.00 0.00 55.95 58.67 1gqc s SER 156 Cb 0.18 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.93 1gqc s SER 156 CO 0.67 -0.37 1.54 -2.84 0.41 0.00 0.00 173.24 172.65 1gqc s PRO 157 N -3.34 3.10 -0.01 12.44 0.02 -1.26 -4.72 135.00 141.23 1gqc s PRO 157 Ca 0.59 0.45 0.06 0.00 0.02 0.00 0.00 61.00 62.12 1gqc s PRO 157 Cb -0.10 -4.21 -0.02 0.00 0.02 0.00 0.00 34.50 30.20 1gqc s PRO 157 CO 0.19 -2.18 -0.20 0.96 -0.33 0.00 0.00 177.00 175.43 1gqc s ILE 158 N 6.88 1.60 0.65 2.83 -4.36 -1.26 -3.82 121.20 123.73 1gqc s ILE 158 Ca 0.55 -0.92 -0.15 0.00 -0.26 0.00 0.00 60.65 59.87 1gqc s ILE 158 Cb -0.12 -1.34 -0.00 0.00 1.25 0.00 0.00 42.46 42.25 1gqc s ILE 158 CO 0.23 0.41 1.11 -2.16 0.24 0.00 0.00 174.94 174.76 1gqc s PRO 159 N -0.60 2.83 0.22 0.37 0.04 -1.26 -4.74 135.00 131.86 1gqc s PRO 159 Ca 0.08 1.40 -0.30 0.00 0.04 0.00 0.00 61.00 62.22 1gqc s PRO 159 Cb -0.08 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.42 1gqc s PRO 159 CO -0.00 -1.23 1.33 -0.47 0.04 0.00 0.00 177.00 176.67 1gqc s TYR 160 N -2.31 3.20 -1.58 0.56 5.04 -1.25 -4.94 117.35 116.07 1gqc s TYR 160 Ca 0.67 1.20 -0.10 0.00 -2.44 0.00 0.00 57.07 56.40 1gqc s TYR 160 Cb -0.21 -3.65 -0.05 0.00 0.35 0.00 0.00 41.96 38.40 1gqc s TYR 160 CO 0.41 -2.02 2.82 -0.35 -1.34 0.00 0.00 175.55 175.06 1gqc n PRO 161 N 2.45 3.66 -0.15 4.97 -0.04 -1.26 -4.62 135.00 140.00 1gqc n PRO 161 Ca 0.06 -2.36 -0.06 0.00 -0.04 0.00 0.00 63.50 61.10 1gqc n PRO 161 Cb 0.42 -2.86 0.03 0.00 -0.04 0.00 0.00 33.50 31.06 1gqc n PRO 161 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1gqc h ARG 162 N 5.11 0.50 -3.12 0.54 9.65 -2.03 -3.09 114.38 121.95 1gqc h ARG 162 Ca 0.82 -0.03 -0.62 0.00 -1.10 0.00 0.00 59.98 59.05 1gqc h ARG 162 Cb 0.33 -0.11 -0.42 0.00 -1.39 0.00 0.00 29.97 28.38 1gqc h ARG 162 CO 1.78 0.33 -0.59 -0.80 2.80 0.00 0.00 179.97 183.49 1gqc s ASN 163 N -5.52 4.69 0.32 -3.80 0.01 -1.26 -5.00 114.94 104.38 1gqc s ASN 163 Ca -0.13 -3.70 0.10 0.00 -0.71 0.00 0.00 52.86 48.42 1gqc s ASN 163 Cb 0.13 -1.62 0.95 0.00 0.41 0.00 0.00 41.25 41.11 1gqc s ASN 163 CO 0.73 -0.11 1.65 0.00 -1.51 0.00 0.00 177.10 177.86 1gqc h ALA 164 N 5.59 1.68 0.00 0.60 0.00 -1.90 0.27 119.26 125.49 1gqc h ALA 164 Ca 0.11 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1gqc h ALA 164 Cb 0.78 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1gqc h ALA 164 CO 0.71 -0.55 0.00 -0.85 0.00 0.00 0.00 179.25 178.55 1gqc n GLU 165 N -5.15 0.13 0.02 0.00 0.00 -1.26 -1.68 120.64 112.69 1gqc n GLU 165 Ca 0.28 0.21 0.11 0.00 0.00 0.00 0.00 57.16 57.75 1gqc n GLU 165 Cb 0.88 -1.50 -0.07 0.00 0.00 0.00 0.00 31.44 30.75 1gqc n GLU 165 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1gqc n LYS 166 N -1.33 0.39 -2.66 3.44 4.76 0.93 -4.97 118.16 118.73 1gqc n LYS 166 Ca 0.05 -0.06 -0.41 0.00 -2.87 0.00 0.00 58.31 55.02 1gqc n LYS 166 Cb 0.10 -1.57 -0.05 0.00 -1.84 0.00 0.00 35.03 31.67 1gqc n LYS 166 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1gqc s ALA 167 N -3.29 3.32 -0.08 7.82 0.00 -0.68 -5.06 121.76 123.80 1gqc s ALA 167 Ca 0.00 0.68 0.02 0.00 0.00 0.00 0.00 51.96 52.66 1gqc s ALA 167 Cb 0.14 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 19.99 1gqc s ALA 167 CO 0.85 -0.02 -0.13 1.03 0.00 0.00 0.00 175.76 177.48 1gqc s ARG 168 N -0.52 1.91 0.13 0.00 3.00 -1.26 -5.03 118.95 117.18 1gqc s ARG 168 Ca 0.46 -0.47 0.05 0.00 0.00 0.00 0.00 55.73 55.77 1gqc s ARG 168 Cb -0.26 -1.60 -0.04 0.00 0.00 0.00 0.00 34.95 33.05 1gqc s ARG 168 CO 0.33 -0.01 0.03 0.71 0.00 0.00 0.00 175.30 176.36 1gqc s TYR 169 N 0.80 2.99 -0.04 -0.53 2.02 -1.26 -4.63 117.35 116.70 1gqc s TYR 169 Ca -0.11 -0.05 -0.00 0.00 -0.37 0.00 0.00 57.07 56.54 1gqc s TYR 169 Cb -0.15 -1.50 0.03 0.00 -0.40 0.00 0.00 41.96 39.94 1gqc s TYR 169 CO 0.02 0.50 -0.00 -0.51 -1.57 0.00 0.00 175.55 173.99 1gqc s LEU 170 N -2.63 0.94 0.04 -1.29 1.43 -1.26 -2.70 118.68 113.21 1gqc s LEU 170 Ca 0.27 -0.05 -0.16 0.00 -1.03 0.00 0.00 54.13 53.16 1gqc s LEU 170 Cb -0.11 -0.31 -0.06 0.00 0.03 0.00 0.00 46.19 45.74 1gqc s LEU 170 CO 0.20 -0.13 0.48 -0.75 0.23 0.00 0.00 176.35 176.37 1gqc s LYS 171 N 1.36 4.03 -0.16 1.70 2.20 0.19 -1.91 119.74 127.15 1gqc s LYS 171 Ca -0.05 0.54 -0.20 0.00 -0.36 0.00 0.00 55.97 55.90 1gqc s LYS 171 Cb -0.13 -3.21 -0.03 0.00 -1.51 0.00 0.00 37.83 32.94 1gqc s LYS 171 CO -0.02 0.66 0.60 -1.58 -0.36 0.00 0.00 175.35 174.64 1gqc s HIS 172 N -1.11 3.44 -0.31 4.03 5.65 -0.61 -1.35 115.29 125.04 1gqc s HIS 172 Ca 0.26 0.96 -0.15 0.00 0.25 0.00 0.00 55.06 56.39 1gqc s HIS 172 Cb -0.18 -2.73 -0.03 0.00 -1.18 0.00 0.00 32.58 28.46 1gqc s HIS 172 CO 0.16 -0.04 0.34 0.08 -0.65 0.00 0.00 174.74 174.63 1gqc s VAL 173 N 1.40 5.19 0.00 0.89 1.01 -0.05 -4.81 120.40 124.03 1gqc s VAL 173 Ca 0.29 0.26 -0.01 0.00 0.00 0.00 0.00 61.98 62.52 1gqc s VAL 173 Cb -0.16 -3.74 -0.05 0.00 0.00 0.00 0.00 36.38 32.44 1gqc s VAL 173 CO 0.12 0.04 1.02 0.61 0.00 0.00 0.00 175.10 176.89 1gqc n GLY 174 N 4.87 1.33 3.69 4.51 0.00 -1.26 -3.68 105.19 114.65 1gqc n GLY 174 Ca -0.09 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1gqc n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gqc s ILE 175 N 2.19 4.37 0.04 -0.61 1.01 -1.26 -4.54 121.20 122.41 1gqc s ILE 175 Ca 0.11 -0.24 0.04 0.00 0.00 0.00 0.00 60.65 60.57 1gqc s ILE 175 Cb 0.05 -2.85 -0.02 0.00 0.01 0.00 0.00 42.46 39.65 1gqc s ILE 175 CO 0.00 0.60 -0.12 -0.31 0.00 0.00 0.00 174.94 175.11 1gqc s TYR 176 N -0.90 1.00 -0.10 3.97 1.51 -0.81 -3.96 117.35 118.06 1gqc s TYR 176 Ca 0.14 -0.40 0.02 0.00 -1.01 0.00 0.00 57.07 55.82 1gqc s TYR 176 Cb -0.11 -0.59 0.01 0.00 -0.11 0.00 0.00 41.96 41.16 1gqc s TYR 176 CO 0.03 0.00 -0.16 0.00 -1.11 0.00 0.00 175.55 174.31 1gqc s ALA 177 N -1.05 1.68 0.00 3.71 0.00 -0.62 0.11 121.76 125.60 1gqc s ALA 177 Ca -0.03 -0.71 0.06 0.00 0.00 0.00 0.00 51.96 51.28 1gqc s ALA 177 Cb -0.08 -0.79 -0.02 0.00 0.00 0.00 0.00 23.12 22.23 1gqc s ALA 177 CO 0.01 -0.00 -0.19 0.71 0.00 0.00 0.00 175.76 176.29 1gqc s TYR 178 N 0.85 1.65 0.57 0.00 2.02 0.16 -1.35 117.35 121.25 1gqc s TYR 178 Ca -0.09 -0.33 -0.17 0.00 -0.37 0.00 0.00 57.07 56.11 1gqc s TYR 178 Cb -0.15 -1.04 -0.05 0.00 -0.40 0.00 0.00 41.96 40.32 1gqc s TYR 178 CO 0.01 0.01 1.05 0.50 -1.57 0.00 0.00 175.55 175.54 1gqc s ARG 179 N -0.68 3.47 0.10 -0.62 6.06 -0.47 -0.97 118.95 125.85 1gqc s ARG 179 Ca 0.07 1.20 -0.22 0.00 -2.50 0.00 0.00 55.73 54.28 1gqc s ARG 179 Cb -0.08 -2.05 -0.10 0.00 0.06 0.00 0.00 34.95 32.78 1gqc s ARG 179 CO 0.00 -0.69 1.74 -0.09 -2.50 0.00 0.00 175.30 173.76 1gqc h ARG 180 N 0.68 0.04 -0.69 5.12 2.43 -1.59 -2.68 114.38 117.68 1gqc h ARG 180 Ca -0.47 -0.00 0.20 0.00 -0.81 0.00 0.00 59.98 58.89 1gqc h ARG 180 Cb 1.22 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.73 1gqc h ARG 180 CO 0.58 0.03 0.50 0.38 -1.51 0.00 0.00 179.97 179.94 1gqc h ASP 181 N 0.04 0.02 -0.02 -3.80 3.04 -1.92 0.14 116.42 113.91 1gqc h ASP 181 Ca 0.04 0.00 -0.14 0.00 -3.24 0.00 0.00 57.03 53.69 1gqc h ASP 181 Cb 0.04 -0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.32 1gqc h ASP 181 CO -0.06 0.01 -0.46 0.58 -2.04 0.00 0.00 179.24 177.27 1gqc h VAL 182 N 0.02 1.31 -0.00 4.15 2.07 -1.84 -2.66 116.25 119.29 1gqc h VAL 182 Ca 0.33 -1.66 -0.16 0.00 0.82 0.00 0.00 66.70 66.03 1gqc h VAL 182 Cb 1.30 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 32.68 1gqc h VAL 182 CO -0.01 0.52 -0.76 -0.07 0.02 0.00 0.00 177.57 177.27 1gqc h LEU 183 N 0.45 0.07 -1.16 2.57 3.38 -0.98 -2.57 115.31 117.07 1gqc h LEU 183 Ca 0.03 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1gqc h LEU 183 Cb 0.98 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 1gqc h LEU 183 CO 0.09 0.80 -0.21 1.56 0.09 0.00 0.00 178.44 180.77 1gqc h GLN 184 N 0.03 0.33 -0.00 1.13 4.20 -1.28 -2.94 115.11 116.58 1gqc h GLN 184 Ca -0.01 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1gqc h GLN 184 Cb 1.33 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.08 1gqc h GLN 184 CO 0.10 0.53 -0.66 0.09 -0.67 0.00 0.00 178.83 178.22 1gqc n ASN 185 N -4.18 0.89 -0.06 1.46 3.02 -1.02 -4.69 115.26 110.68 1gqc n ASN 185 Ca -0.00 -0.72 -0.09 0.00 -0.03 0.00 0.00 54.58 53.74 1gqc n ASN 185 Cb 0.35 0.54 -0.02 0.00 -0.61 0.00 0.00 39.78 40.04 1gqc n ASN 185 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1gqc h TYR 186 N 0.35 -0.78 0.00 3.10 3.20 -1.27 -2.04 116.97 119.53 1gqc h TYR 186 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1gqc h TYR 186 Cb 0.52 0.38 0.00 0.00 1.54 0.00 0.00 36.73 39.18 1gqc h TYR 186 CO 0.00 -0.36 0.00 -1.13 -1.64 0.00 0.00 178.16 175.03 1gqc n SER 187 N -5.40 0.04 0.05 -2.11 3.41 -1.26 -0.97 113.62 107.38 1gqc n SER 187 Ca -0.01 0.52 0.12 0.00 -0.26 0.00 0.00 58.87 59.24 1gqc n SER 187 Cb 0.32 -0.52 0.17 0.00 -0.26 0.00 0.00 64.21 63.91 1gqc n SER 187 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gqc n GLN 188 N -1.55 0.27 -2.53 4.33 6.02 -0.77 -4.89 117.38 118.27 1gqc n GLN 188 Ca 0.00 0.07 -0.41 0.00 -0.01 0.00 0.00 57.00 56.65 1gqc n GLN 188 Cb 0.01 -1.66 -0.04 0.00 1.02 0.00 0.00 30.24 29.57 1gqc n GLN 188 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1gqc s LEU 189 N -4.11 4.45 0.47 1.08 1.43 -0.14 -5.03 118.68 116.83 1gqc s LEU 189 Ca 0.06 2.01 -0.17 0.00 -1.03 0.00 0.00 54.13 55.00 1gqc s LEU 189 Cb 0.14 -3.59 -0.09 0.00 0.03 0.00 0.00 46.19 42.68 1gqc s LEU 189 CO 0.73 -0.27 0.94 -2.16 0.23 0.00 0.00 176.35 175.82 1gqc s PRO 190 N 0.10 4.02 0.39 1.29 0.04 -1.26 -5.04 135.00 134.55 1gqc s PRO 190 Ca 0.51 0.94 -0.25 0.00 0.04 0.00 0.00 61.00 62.24 1gqc s PRO 190 Cb -0.28 -2.19 -0.09 0.00 0.04 0.00 0.00 34.50 31.98 1gqc s PRO 190 CO 0.33 -0.15 1.13 -1.21 0.04 0.00 0.00 177.00 177.13 1gqc s GLU 191 N -3.72 4.12 0.25 4.56 2.02 -1.26 -4.94 118.70 119.72 1gqc s GLU 191 Ca 0.59 1.73 0.08 0.00 0.02 0.00 0.00 54.97 57.39 1gqc s GLU 191 Cb -0.10 -2.66 -0.04 0.00 0.10 0.00 0.00 34.13 31.43 1gqc s GLU 191 CO 0.25 -0.24 0.06 -1.54 0.02 0.00 0.00 175.26 173.82 1gqc s SER 192 N -1.26 4.90 0.14 -0.19 1.04 -1.26 -5.01 113.70 112.05 1gqc s SER 192 Ca 0.57 -0.48 -0.18 0.00 0.48 0.00 0.00 55.95 56.33 1gqc s SER 192 Cb -0.28 -1.05 0.00 0.00 0.10 0.00 0.00 66.02 64.79 1gqc s SER 192 CO 0.35 -0.00 1.75 -0.03 0.98 0.00 0.00 173.24 176.29 1gqc h MET 193 N 1.85 0.21 -0.41 4.02 4.05 -1.98 -0.59 114.93 122.09 1gqc h MET 193 Ca -0.46 -0.01 0.06 0.00 -0.28 0.00 0.00 59.70 59.00 1gqc h MET 193 Cb 1.24 -0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 31.94 1gqc h MET 193 CO 0.60 0.14 0.12 -1.35 0.23 0.00 0.00 176.91 176.65 1gqc h PRO 194 N 0.22 0.26 -0.72 0.39 0.11 -1.96 0.24 132.00 130.53 1gqc h PRO 194 Ca 0.12 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 66.30 1gqc h PRO 194 Cb 0.09 -0.06 -0.07 0.00 0.11 0.00 0.00 31.00 31.07 1gqc h PRO 194 CO -0.12 0.17 0.38 1.49 -0.21 0.00 0.00 178.00 179.70 1gqc h GLU 195 N 0.27 0.63 -0.08 1.05 4.81 -1.66 0.23 114.58 119.82 1gqc h GLU 195 Ca 0.19 -0.04 -0.20 0.00 -0.13 0.00 0.00 59.36 59.18 1gqc h GLU 195 Cb 0.20 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1gqc h GLU 195 CO -0.22 0.41 -0.79 1.96 -0.73 0.00 0.00 179.01 179.64 1gqc h GLN 196 N 0.65 0.51 -0.05 1.92 4.20 -0.63 0.60 115.11 122.30 1gqc h GLN 196 Ca 0.35 -0.44 -0.03 0.00 0.06 0.00 0.00 58.65 58.59 1gqc h GLN 196 Cb 0.34 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 1gqc h GLN 196 CO -0.25 1.07 -0.07 0.00 -0.67 0.00 0.00 178.83 178.91 1gqc h ALA 197 N 0.80 0.07 0.00 3.87 0.00 -0.67 -3.28 119.26 120.05 1gqc h ALA 197 Ca -0.05 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1gqc h ALA 197 Cb 1.39 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 1gqc h ALA 197 CO 0.14 -0.09 -0.13 0.93 0.00 0.00 0.00 179.25 180.10 1gqc h GLU 198 N -0.36 0.00 -5.15 0.00 4.39 -0.65 -3.48 114.58 109.33 1gqc h GLU 198 Ca 0.00 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.43 1gqc h GLU 198 Cb 0.63 0.00 0.15 0.00 -0.10 0.00 0.00 28.75 29.43 1gqc h GLU 198 CO 0.02 0.13 -0.67 0.45 -1.16 0.00 0.00 179.01 177.78 1gqc n SER 199 N -3.15 -2.42 -3.67 1.42 2.88 0.16 -4.90 113.62 103.93 1gqc n SER 199 Ca 0.03 -0.54 -0.30 0.00 -1.33 0.00 0.00 58.87 56.73 1gqc n SER 199 Cb 0.55 -4.51 -0.14 0.00 -0.75 0.00 0.00 64.21 59.35 1gqc n SER 199 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1gqc s LEU 200 N -5.70 1.93 0.47 2.46 1.43 -0.92 -5.02 118.68 113.33 1gqc s LEU 200 Ca 0.04 -1.78 0.26 0.00 -1.03 0.00 0.00 54.13 51.61 1gqc s LEU 200 Cb -0.00 -0.77 1.30 0.00 0.03 0.00 0.00 46.19 46.75 1gqc s LEU 200 CO 0.63 -0.39 1.83 -0.08 0.23 0.00 0.00 176.35 178.57 1gqc h GLU 201 N 7.84 0.20 0.00 1.70 4.81 -1.95 -0.86 114.58 126.31 1gqc h GLU 201 Ca -0.11 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.09 1gqc h GLU 201 Cb 1.00 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.33 1gqc h GLU 201 CO 0.45 0.13 -0.07 -0.56 -0.73 0.00 0.00 179.01 178.23 1gqc h GLN 202 N 0.21 0.00 0.00 1.92 -0.00 -1.97 -1.34 115.11 113.92 1gqc h GLN 202 Ca 0.51 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 59.16 1gqc h GLN 202 Cb 1.64 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 29.12 1gqc h GLN 202 CO -0.13 0.07 -0.01 -0.07 -0.00 0.00 0.00 178.83 178.69 1gqc h LEU 203 N 0.00 0.00 -1.56 0.06 3.38 -1.53 -1.59 115.31 114.07 1gqc h LEU 203 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1gqc h LEU 203 Cb 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1gqc h LEU 203 CO 0.01 0.01 0.08 -0.09 0.09 0.00 0.00 178.44 178.53 1gqc h ARG 204 N 0.00 0.37 -0.18 1.13 2.43 -1.42 -1.16 114.38 115.54 1gqc h ARG 204 Ca -0.00 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 58.98 1gqc h ARG 204 Cb 0.03 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 1gqc h ARG 204 CO 0.00 0.33 -0.44 -0.07 -1.51 0.00 0.00 179.97 178.29 1gqc h LEU 205 N 0.37 0.70 -0.91 3.80 3.38 -1.46 -3.02 115.31 118.16 1gqc h LEU 205 Ca 0.09 -0.57 -0.09 0.00 0.09 0.00 0.00 57.88 57.40 1gqc h LEU 205 Cb 0.12 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1gqc h LEU 205 CO -0.01 1.14 -0.17 0.24 0.09 0.00 0.00 178.44 179.74 1gqc h MET 206 N 0.29 0.61 -0.37 1.13 2.86 -1.42 -0.88 114.93 117.16 1gqc h MET 206 Ca -0.00 -0.21 0.03 0.00 -2.06 0.00 0.00 59.70 57.46 1gqc h MET 206 Cb 1.05 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.62 1gqc h MET 206 CO 0.10 0.75 0.16 -0.97 1.06 0.00 0.00 176.91 178.00 1gqc h ASN 207 N 0.55 0.21 0.00 1.22 -1.24 -1.21 -1.23 115.58 113.88 1gqc h ASN 207 Ca 0.09 0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.13 1gqc h ASN 207 Cb 0.60 -0.01 0.00 0.00 0.73 0.00 0.00 38.32 39.64 1gqc h ASN 207 CO 0.04 0.16 0.00 0.00 -1.29 0.00 0.00 177.43 176.34 1gqc n ALA 208 N -2.30 2.39 -0.83 1.57 0.00 -1.08 -4.88 120.51 115.38 1gqc n ALA 208 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1gqc n ALA 208 Cb 0.11 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.17 1gqc n ALA 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gqc n GLY 209 N 0.51 0.58 3.64 0.00 0.00 -0.47 -5.02 105.19 104.43 1gqc n GLY 209 Ca 0.18 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1gqc n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gqc s ILE 210 N -2.00 4.77 0.28 -0.61 1.01 -0.36 -5.00 121.20 119.29 1gqc s ILE 210 Ca 0.00 1.60 -0.29 0.00 0.00 0.00 0.00 60.65 61.95 1gqc s ILE 210 Cb 0.00 -4.19 -0.10 0.00 0.01 0.00 0.00 42.46 38.19 1gqc s ILE 210 CO 0.00 -0.17 1.21 0.21 0.00 0.00 0.00 174.94 176.19 1gqc s ASN 211 N 1.40 7.02 -0.23 3.58 2.47 -1.26 -4.18 114.94 123.74 1gqc s ASN 211 Ca 0.37 2.44 0.01 0.00 0.42 0.00 0.00 52.86 56.10 1gqc s ASN 211 Cb -0.15 -2.63 0.05 0.00 -1.45 0.00 0.00 41.25 37.08 1gqc s ASN 211 CO 0.09 -0.36 -0.09 -0.63 -3.72 0.00 0.00 177.10 172.39 1gqc s ILE 212 N -0.88 1.72 -0.10 -5.21 1.01 -1.26 -2.68 121.20 113.80 1gqc s ILE 212 Ca 0.49 -1.23 -0.16 0.00 0.00 0.00 0.00 60.65 59.74 1gqc s ILE 212 Cb -0.35 -1.87 -0.05 0.00 0.01 0.00 0.00 42.46 40.19 1gqc s ILE 212 CO 0.45 0.02 0.42 -0.60 0.00 0.00 0.00 174.94 175.23 1gqc s ARG 213 N 1.33 4.22 0.44 2.79 3.52 -0.64 -1.04 118.95 129.57 1gqc s ARG 213 Ca -0.05 0.37 0.02 0.00 -0.13 0.00 0.00 55.73 55.93 1gqc s ARG 213 Cb -0.18 -3.38 -0.00 0.00 -1.56 0.00 0.00 34.95 29.83 1gqc s ARG 213 CO -0.07 0.30 0.64 0.95 -0.81 0.00 0.00 175.30 176.32 1gqc s THR 214 N 0.18 3.91 -0.10 4.11 -4.23 -0.10 -1.15 115.64 118.26 1gqc s THR 214 Ca 0.23 -0.60 -0.04 0.00 -1.18 0.00 0.00 61.69 60.10 1gqc s THR 214 Cb -0.15 -3.43 0.05 0.00 1.34 0.00 0.00 72.50 70.31 1gqc s THR 214 CO 0.10 -0.27 0.19 -0.36 -0.54 0.00 0.00 174.62 173.73 1gqc s PHE 215 N -2.50 -0.25 0.21 3.99 0.08 -0.79 -4.82 117.98 113.90 1gqc s PHE 215 Ca 0.48 0.71 -0.30 0.00 0.12 0.00 0.00 56.93 57.95 1gqc s PHE 215 Cb -0.10 -0.18 -0.08 0.00 -0.57 0.00 0.00 43.02 42.09 1gqc s PHE 215 CO 0.37 -0.29 1.00 -2.00 -0.10 0.00 0.00 175.22 174.20 1gqc s GLU 216 N 2.25 4.74 0.24 0.44 2.12 -1.26 -2.14 118.70 125.10 1gqc s GLU 216 Ca 0.02 1.58 0.01 0.00 0.36 0.00 0.00 54.97 56.94 1gqc s GLU 216 Cb -0.12 -3.28 -0.05 0.00 0.26 0.00 0.00 34.13 30.94 1gqc s GLU 216 CO -0.07 0.32 0.08 0.14 -0.54 0.00 0.00 175.26 175.20 1gqc s VAL 217 N -0.76 0.57 0.82 3.70 -7.23 -0.26 -4.93 120.40 112.31 1gqc s VAL 217 Ca 0.44 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.51 1gqc s VAL 217 Cb -0.27 -2.55 0.09 0.00 0.56 0.00 0.00 36.38 34.21 1gqc s VAL 217 CO 0.34 -0.08 1.11 0.00 -0.31 0.00 0.00 175.10 176.16 1gqc s ALA 218 N -3.75 1.98 0.19 1.32 0.00 -1.26 -4.32 121.76 115.93 1gqc s ALA 218 Ca 0.36 0.38 -0.31 0.00 0.00 0.00 0.00 51.96 52.38 1gqc s ALA 218 Cb 0.07 -3.33 -0.16 0.00 0.00 0.00 0.00 23.12 19.70 1gqc s ALA 218 CO 0.12 -2.11 0.97 0.00 0.00 0.00 0.00 175.76 174.73 1gqc n ALA 219 N -3.77 -1.40 -2.82 0.00 0.00 -1.26 -4.87 120.51 106.39 1gqc n ALA 219 Ca 0.10 0.45 -0.30 0.00 0.00 0.00 0.00 53.44 53.70 1gqc n ALA 219 Cb 0.53 -1.90 -0.06 0.00 0.00 0.00 0.00 19.45 18.02 1gqc n ALA 219 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1gqc s THR 220 N -0.57 4.74 0.76 0.00 -4.23 -1.26 -5.09 115.64 109.99 1gqc s THR 220 Ca 0.69 -0.74 -0.15 0.00 -1.18 0.00 0.00 61.69 60.32 1gqc s THR 220 Cb -0.87 -3.32 0.05 0.00 1.34 0.00 0.00 72.50 69.70 1gqc s THR 220 CO 0.55 0.08 1.23 0.61 -0.54 0.00 0.00 174.62 176.56 1gqc n GLY 221 N 0.23 0.17 3.66 3.99 0.00 -1.26 -4.98 105.19 107.00 1gqc n GLY 221 Ca -0.08 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 1gqc n GLY 221 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gqc s PRO 222 N -3.88 0.87 0.48 1.61 0.04 -1.26 -4.89 135.00 127.98 1gqc s PRO 222 Ca 0.76 1.24 0.08 0.00 0.04 0.00 0.00 61.00 63.13 1gqc s PRO 222 Cb -0.32 -1.73 0.04 0.00 0.04 0.00 0.00 34.50 32.52 1gqc s PRO 222 CO 0.47 -2.63 0.62 0.20 0.04 0.00 0.00 177.00 175.70 1gqc s GLY 223 N -2.88 1.92 -0.67 0.56 0.00 -1.26 -4.65 107.32 100.34 1gqc s GLY 223 Ca 0.66 -1.85 -0.03 0.00 0.00 0.00 0.00 44.72 43.50 1gqc s GLY 223 CO 0.59 -1.62 0.49 0.14 0.00 0.00 0.00 173.10 172.70 1gqc s VAL 224 N -2.51 3.81 -0.03 1.40 1.01 -0.11 -4.69 120.40 119.28 1gqc s VAL 224 Ca 0.55 -3.10 0.03 0.00 0.00 0.00 0.00 61.98 59.46 1gqc s VAL 224 Cb -0.07 -3.46 -0.05 0.00 0.00 0.00 0.00 36.38 32.80 1gqc s VAL 224 CO 0.34 -0.91 0.02 0.47 0.00 0.00 0.00 175.10 175.02 1gqc n ASP 225 N 3.31 4.12 -4.29 3.32 9.92 -1.26 -4.90 116.55 126.76 1gqc n ASP 225 Ca 0.10 0.00 -0.21 0.00 -0.53 0.00 0.00 54.79 54.15 1gqc n ASP 225 Cb 0.38 0.67 -0.11 0.00 -0.64 0.00 0.00 41.12 41.42 1gqc n ASP 225 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1gqc s THR 226 N -2.11 1.63 0.34 -3.53 -4.23 -1.26 -4.58 115.64 101.90 1gqc s THR 226 Ca -0.02 -1.75 0.07 0.00 -1.18 0.00 0.00 61.69 58.81 1gqc s THR 226 Cb 0.01 -1.66 0.32 0.00 1.34 0.00 0.00 72.50 72.51 1gqc s THR 226 CO 0.15 -0.28 1.86 -0.65 -0.54 0.00 0.00 174.62 175.15 1gqc h PRO 227 N 3.55 0.73 0.22 3.99 0.11 -1.97 0.35 132.00 138.97 1gqc h PRO 227 Ca -0.42 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1gqc h PRO 227 Cb 1.20 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1gqc h PRO 227 CO 0.48 0.48 -0.11 0.00 -0.21 0.00 0.00 178.00 178.64 1gqc h ALA 228 N 1.59 -0.30 -0.51 -0.75 0.00 -2.00 -2.18 119.26 115.11 1gqc h ALA 228 Ca 0.47 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 1gqc h ALA 228 Cb 0.70 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1gqc h ALA 228 CO -0.23 -0.62 0.25 0.00 0.00 0.00 0.00 179.25 178.65 1gqc h LEU 230 N 0.71 0.89 -1.25 0.00 5.85 -0.04 -0.88 115.31 120.59 1gqc h LEU 230 Ca 0.18 -0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.80 1gqc h LEU 230 Cb 0.07 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1gqc h LEU 230 CO -0.02 0.64 -0.35 -0.33 -0.34 0.00 0.00 178.44 178.03 1gqc h GLU 231 N 1.05 0.04 -0.21 1.25 4.39 -1.09 -2.17 114.58 117.84 1gqc h GLU 231 Ca 0.30 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.96 1gqc h GLU 231 Cb -0.09 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.55 1gqc h GLU 231 CO -0.07 0.39 0.05 -0.22 -1.16 0.00 0.00 179.01 177.99 1gqc h LYS 232 N 0.04 0.34 -0.63 2.33 3.64 -0.94 -0.93 116.57 120.41 1gqc h LYS 232 Ca 0.00 -0.08 -0.07 0.00 -1.27 0.00 0.00 60.65 59.23 1gqc h LYS 232 Cb 0.64 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.39 1gqc h LYS 232 CO 0.05 0.46 0.13 0.28 -2.27 0.00 0.00 179.45 178.10 1gqc h VAL 233 N 0.15 1.25 0.65 2.00 2.07 -0.99 -0.95 116.25 120.44 1gqc h VAL 233 Ca 0.07 -0.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.61 1gqc h VAL 233 Cb 0.28 0.62 0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1gqc h VAL 233 CO 0.00 0.35 -0.31 0.03 0.02 0.00 0.00 177.57 177.66 1gqc h ARG 234 N 0.95 -0.84 -0.89 1.57 3.08 -1.22 0.26 114.38 117.29 1gqc h ARG 234 Ca 0.20 0.06 0.12 0.00 0.07 0.00 0.00 59.98 60.43 1gqc h ARG 234 Cb 0.37 0.19 -0.08 0.00 0.08 0.00 0.00 29.97 30.53 1gqc h ARG 234 CO 0.00 -0.53 0.51 0.00 -1.07 0.00 0.00 179.97 178.89 1gqc h ALA 235 N -0.72 1.33 0.17 0.04 0.00 -1.13 0.87 119.26 119.82 1gqc h ALA 235 Ca -0.09 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1gqc h ALA 235 Cb 0.70 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1gqc h ALA 235 CO 0.15 0.07 -0.08 -0.07 0.00 0.00 0.00 179.25 179.32 1gqc h LEU 236 N 0.80 -0.19 -1.33 0.00 3.38 -0.97 -2.56 115.31 114.44 1gqc h LEU 236 Ca 0.45 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 58.11 1gqc h LEU 236 Cb 0.51 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1gqc h LEU 236 CO -0.29 0.16 -0.33 0.24 0.09 0.00 0.00 178.44 178.31 1gqc h MET 237 N -0.57 0.00 0.57 1.13 2.86 -0.18 -1.97 114.93 116.77 1gqc h MET 237 Ca -0.02 -0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.59 1gqc h MET 237 Cb 0.43 -0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.10 1gqc h MET 237 CO 0.04 0.33 -0.27 0.00 1.06 0.00 0.00 176.91 178.07 1gqc h ALA 238 N 1.67 -0.76 -0.52 6.32 0.00 -0.84 -3.06 119.26 122.07 1gqc h ALA 238 Ca -0.00 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.78 1gqc h ALA 238 Cb 0.59 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 1gqc h ALA 238 CO 0.04 -0.76 0.35 -0.56 0.00 0.00 0.00 179.25 178.32 1gqc h GLN 239 N -1.09 0.41 0.00 0.00 3.07 -1.43 0.53 115.11 116.59 1gqc h GLN 239 Ca -0.08 -0.02 0.00 0.00 0.09 0.00 0.00 58.65 58.64 1gqc h GLN 239 Cb 0.64 -0.09 0.00 0.00 0.08 0.00 0.00 27.48 28.11 1gqc h GLN 239 CO 0.13 0.27 0.20 1.49 0.09 0.00 0.00 178.83 181.01 1gqc h GLU 240 N 0.42 0.00 -0.01 0.06 4.81 -1.25 -3.52 114.58 115.10 1gqc h GLU 240 Ca 0.23 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1gqc h GLU 240 Cb 0.36 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.74 1gqc h GLU 240 CO -0.06 0.00 0.00 1.28 -0.73 0.00 0.00 179.01 179.50