#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d5q n PRO 22 N 0.00 0.60 -0.61 2.61 -0.04 -1.23 -4.73 135.00 131.60 3d5q n PRO 22 Ca 0.00 -0.17 -0.26 0.00 -0.04 0.00 0.00 63.50 63.02 3d5q n PRO 22 Cb 0.00 -2.82 -0.06 0.00 -0.04 0.00 0.00 33.50 30.58 3d5q n PRO 22 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3d5q n LEU 23 N 14.27 0.31 -4.56 1.53 4.77 -1.11 -4.63 117.00 127.57 3d5q n LEU 23 Ca 0.49 0.27 -0.24 0.00 -0.03 0.00 0.00 56.01 56.50 3d5q n LEU 23 Cb 0.37 -0.43 -0.06 0.00 -2.33 0.00 0.00 43.42 40.97 3d5q n LEU 23 CO 0.77 -0.36 1.32 0.21 -1.33 0.00 0.00 177.39 178.00 3d5q s ASN 24 N 3.10 4.83 -0.09 -1.43 2.47 -1.26 -4.85 114.94 117.70 3d5q s ASN 24 Ca 0.58 -0.63 -0.30 0.00 0.42 0.00 0.00 52.86 52.92 3d5q s ASN 24 Cb -0.68 -2.56 0.09 0.00 -1.45 0.00 0.00 41.25 36.64 3d5q s ASN 24 CO 0.29 -3.07 0.77 -1.83 -3.72 0.00 0.00 177.10 169.55 3d5q s GLU 25 N 7.38 0.92 0.66 0.43 -1.05 -1.26 -5.16 118.70 120.62 3d5q s GLU 25 Ca 0.75 0.27 -0.17 0.00 -0.15 0.00 0.00 54.97 55.67 3d5q s GLU 25 Cb -0.07 0.43 0.00 0.00 -0.44 0.00 0.00 34.13 34.05 3d5q s GLU 25 CO 0.03 -0.28 1.24 -2.00 0.95 0.00 0.00 175.26 175.20 3d5q s GLU 26 N -1.07 2.52 0.81 -4.83 2.56 -1.26 -4.93 118.70 112.50 3d5q s GLU 26 Ca -0.08 1.88 -0.14 0.00 0.00 0.00 0.00 54.97 56.63 3d5q s GLU 26 Cb -0.00 -1.86 0.06 0.00 2.00 0.00 0.00 34.13 34.32 3d5q s GLU 26 CO 0.07 -1.58 1.01 0.34 -0.56 0.00 0.00 175.26 174.55 3d5q n PHE 27 N -2.13 0.66 -3.52 5.30 7.35 -1.26 -5.04 117.46 118.82 3d5q n PHE 27 Ca 0.14 0.38 -0.05 0.00 -0.76 0.00 0.00 57.45 57.16 3d5q n PHE 27 Cb 0.49 -2.04 -0.07 0.00 0.35 0.00 0.00 39.48 38.21 3d5q n PHE 27 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 3d5q s ARG 28 N -3.86 0.41 0.39 -4.13 0.52 -1.26 -5.03 118.95 106.00 3d5q s ARG 28 Ca 0.70 1.01 0.10 0.00 -0.52 0.00 0.00 55.73 57.02 3d5q s ARG 28 Cb -0.29 0.30 0.54 0.00 0.52 0.00 0.00 34.95 36.02 3d5q s ARG 28 CO 0.54 -0.37 1.17 -1.35 0.02 0.00 0.00 175.30 175.31 3d5q h PRO 29 N 8.12 0.00 -0.02 3.54 0.11 -2.00 0.91 132.00 142.66 3d5q h PRO 29 Ca -0.18 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.73 3d5q h PRO 29 Cb 1.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3d5q h PRO 29 CO 0.17 0.00 -0.85 0.93 -0.21 0.00 0.00 178.00 178.04 3d5q h GLU 30 N 0.00 0.31 -1.15 1.05 3.07 -1.96 -3.10 114.58 112.80 3d5q h GLU 30 Ca 0.00 -0.30 0.33 0.00 -0.50 0.00 0.00 59.36 58.89 3d5q h GLU 30 Cb 1.00 0.08 -0.05 0.00 -0.84 0.00 0.00 28.75 28.94 3d5q h GLU 30 CO 0.00 0.99 1.13 0.52 -1.40 0.00 0.00 179.01 180.25 3d5q h MET 31 N 0.18 0.00 -1.38 2.33 2.86 -1.20 -0.24 114.93 117.49 3d5q h MET 31 Ca -0.05 0.00 -0.70 0.00 -2.06 0.00 0.00 59.70 56.89 3d5q h MET 31 Cb 1.46 0.00 -0.30 0.00 0.06 0.00 0.00 31.60 32.82 3d5q h MET 31 CO 0.14 0.00 0.78 1.28 1.06 0.00 0.00 176.91 180.17 3d5q n LEU 32 N -3.52 7.35 -4.33 1.22 7.99 -1.17 -4.80 117.00 119.75 3d5q n LEU 32 Ca 0.26 -4.56 -0.37 0.00 -0.01 0.00 0.00 56.01 51.32 3d5q n LEU 32 Cb 1.48 -0.95 -0.13 0.00 -0.11 0.00 0.00 43.42 43.72 3d5q n LEU 32 CO 0.30 1.65 -0.28 -1.58 -1.51 0.00 0.00 177.39 175.96 3d5q s GLN 33 N -3.90 3.05 0.00 3.23 0.74 -0.10 -3.00 119.66 119.68 3d5q s GLN 33 Ca 0.59 -0.88 0.00 0.00 0.05 0.00 0.00 55.36 55.11 3d5q s GLN 33 Cb 0.47 -3.35 0.00 0.00 1.10 0.00 0.00 33.01 31.23 3d5q s GLN 33 CO -0.17 -0.45 0.00 0.41 -0.55 0.00 0.00 175.29 174.53 3d5q n GLY 34 N 4.85 0.19 3.69 2.59 0.00 -0.68 -4.96 105.19 110.88 3d5q n GLY 34 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 3d5q n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d5q s LYS 35 N -1.25 4.41 -0.20 1.61 -0.14 -1.26 -4.73 119.74 118.19 3d5q s LYS 35 Ca 0.00 1.56 -0.28 0.00 -1.36 0.00 0.00 55.97 55.88 3d5q s LYS 35 Cb 0.00 -3.51 0.00 0.00 -1.68 0.00 0.00 37.83 32.64 3d5q s LYS 35 CO 0.00 -0.32 0.98 0.15 -0.76 0.00 0.00 175.35 175.40 3d5q s LYS 36 N 1.84 4.28 -0.04 1.68 1.02 -1.26 -2.29 119.74 124.97 3d5q s LYS 36 Ca 0.53 1.27 -0.02 0.00 0.02 0.00 0.00 55.97 57.77 3d5q s LYS 36 Cb -0.23 -3.62 0.03 0.00 -0.52 0.00 0.00 37.83 33.50 3d5q s LYS 36 CO 0.22 -0.52 0.06 0.08 -0.92 0.00 0.00 175.35 174.27 3d5q s VAL 37 N 2.81 -0.11 0.01 3.17 1.01 0.16 0.14 120.40 127.60 3d5q s VAL 37 Ca 0.43 0.42 -0.13 0.00 0.00 0.00 0.00 61.98 62.70 3d5q s VAL 37 Cb -0.16 -0.15 -0.06 0.00 0.00 0.00 0.00 36.38 36.02 3d5q s VAL 37 CO 0.09 0.18 0.38 -0.63 0.00 0.00 0.00 175.10 175.12 3d5q s ILE 38 N 2.13 5.09 -0.11 2.22 1.01 -0.38 -1.31 121.20 129.85 3d5q s ILE 38 Ca 0.05 0.68 0.00 0.00 0.00 0.00 0.00 60.65 61.38 3d5q s ILE 38 Cb -0.12 -3.67 0.02 0.00 0.01 0.00 0.00 42.46 38.70 3d5q s ILE 38 CO -0.03 0.51 -0.11 -0.69 0.00 0.00 0.00 174.94 174.62 3d5q s VAL 39 N -1.16 1.21 0.58 2.92 1.01 -0.86 -1.47 120.40 122.64 3d5q s VAL 39 Ca 0.25 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.85 3d5q s VAL 39 Cb -0.16 -1.17 0.07 0.00 0.00 0.00 0.00 36.38 35.12 3d5q s VAL 39 CO 0.14 0.39 0.80 0.42 0.00 0.00 0.00 175.10 176.85 3d5q s THR 40 N 1.41 2.43 -1.02 3.92 -4.23 -0.41 -2.24 115.64 115.49 3d5q s THR 40 Ca 0.00 -0.82 -0.10 0.00 -1.18 0.00 0.00 61.69 59.59 3d5q s THR 40 Cb -0.13 -2.61 0.09 0.00 1.34 0.00 0.00 72.50 71.19 3d5q s THR 40 CO -0.06 0.00 0.33 0.61 -0.54 0.00 0.00 174.62 174.96 3d5q n GLY 41 N -2.34 -0.47 0.69 3.99 0.00 -1.19 -4.14 105.19 101.73 3d5q n GLY 41 Ca 0.12 0.05 0.10 0.00 0.00 0.00 0.00 46.02 46.30 3d5q n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d5q n ALA 42 N -3.27 2.49 0.09 4.61 0.00 -1.03 -3.62 120.51 119.78 3d5q n ALA 42 Ca 0.02 -0.63 -0.11 0.00 0.00 0.00 0.00 53.44 52.73 3d5q n ALA 42 Cb 0.50 -1.03 -0.08 0.00 0.00 0.00 0.00 19.45 18.84 3d5q n ALA 42 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3d5q h SER 43 N 2.66 0.27 -3.13 0.00 4.64 -1.86 -3.07 113.55 113.08 3d5q h SER 43 Ca 0.00 -0.26 -0.17 0.00 -0.47 0.00 0.00 61.79 60.89 3d5q h SER 43 Cb 0.59 -0.09 -0.04 0.00 -0.31 0.00 0.00 62.40 62.55 3d5q h SER 43 CO 0.00 1.15 -0.06 2.29 -0.87 0.00 0.00 176.83 179.34 3d5q n LYS 44 N -3.55 0.54 0.00 4.77 2.85 -1.26 -4.74 118.16 116.77 3d5q n LYS 44 Ca -0.05 -1.89 0.00 0.00 -1.05 0.00 0.00 58.31 55.32 3d5q n LYS 44 Cb 0.92 1.89 0.00 0.00 -0.65 0.00 0.00 35.03 37.19 3d5q n LYS 44 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3d5q n GLY 45 N -0.40 1.67 0.39 2.58 0.00 -1.26 -2.26 105.19 105.91 3d5q n GLY 45 Ca -0.01 -0.39 0.17 0.00 0.00 0.00 0.00 46.02 45.80 3d5q n GLY 45 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3d5q h ILE 46 N 0.00 0.67 -0.54 -0.61 2.04 -1.92 -1.91 117.51 115.24 3d5q h ILE 46 Ca 0.00 -0.18 0.02 0.00 1.00 0.00 0.00 64.86 65.70 3d5q h ILE 46 Cb 0.00 0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.13 3d5q h ILE 46 CO 0.00 0.10 0.33 1.23 0.00 0.00 0.00 178.15 179.81 3d5q h GLY 47 N 0.54 0.76 0.81 5.37 0.00 -1.51 -0.80 103.07 108.24 3d5q h GLY 47 Ca 0.53 -0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.61 3d5q h GLY 47 CO -0.26 0.22 -0.20 -0.09 0.00 0.00 0.00 176.54 176.20 3d5q h ARG 48 N 0.66 -0.45 0.00 4.80 2.43 -1.21 -2.89 114.38 117.71 3d5q h ARG 48 Ca 0.21 0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.38 3d5q h ARG 48 Cb 0.00 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 3d5q h ARG 48 CO -0.09 -0.30 -0.18 0.93 -1.51 0.00 0.00 179.97 178.82 3d5q h GLU 49 N -0.47 0.00 -0.30 0.20 4.39 -1.26 0.24 114.58 117.38 3d5q h GLU 49 Ca -0.01 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.65 3d5q h GLU 49 Cb 0.42 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 3d5q h GLU 49 CO -0.02 0.18 0.05 0.52 -1.16 0.00 0.00 179.01 178.58 3d5q h MET 50 N 0.00 0.49 0.35 2.33 2.86 -1.04 -2.65 114.93 117.28 3d5q h MET 50 Ca -0.00 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.49 3d5q h MET 50 Cb 0.46 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.06 3d5q h MET 50 CO 0.02 0.59 -0.25 0.00 1.06 0.00 0.00 176.91 178.34 3d5q h ALA 51 N 0.88 -1.05 -0.31 6.32 0.00 -0.78 -2.24 119.26 122.08 3d5q h ALA 51 Ca 0.09 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.91 3d5q h ALA 51 Cb 0.34 0.40 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 3d5q h ALA 51 CO 0.01 -1.04 -0.19 0.66 0.00 0.00 0.00 179.25 178.69 3d5q n TYR 52 N -3.85 -0.14 -0.26 0.00 4.02 -0.68 -0.40 117.16 115.85 3d5q n TYR 52 Ca -0.07 0.39 -0.09 0.00 -0.01 0.00 0.00 57.90 58.12 3d5q n TYR 52 Cb 0.24 -0.44 -0.08 0.00 -0.02 0.00 0.00 39.34 39.05 3d5q n TYR 52 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 3d5q h HIS 53 N 0.00 -1.44 -1.03 -0.72 3.86 -1.37 0.21 115.15 114.66 3d5q h HIS 53 Ca 0.05 0.09 0.27 0.00 -1.16 0.00 0.00 60.37 59.62 3d5q h HIS 53 Cb 0.13 0.71 -0.12 0.00 1.06 0.00 0.00 27.41 29.19 3d5q h HIS 53 CO -0.65 -0.32 0.62 -0.07 0.86 0.00 0.00 177.93 178.37 3d5q h LEU 54 N -0.09 0.58 0.32 2.43 3.38 -0.10 0.13 115.31 121.95 3d5q h LEU 54 Ca 0.10 0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 3d5q h LEU 54 Cb 0.36 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3d5q h LEU 54 CO -0.65 0.04 -0.15 0.00 0.09 0.00 0.00 178.44 177.76 3d5q h ALA 55 N 1.72 -0.42 0.00 1.53 0.00 0.12 -1.85 119.26 120.35 3d5q h ALA 55 Ca 0.66 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.46 3d5q h ALA 55 Cb 1.44 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.39 3d5q h ALA 55 CO -0.46 -0.71 0.00 1.63 0.00 0.00 0.00 179.25 179.71 3d5q n LYS 56 N -5.25 0.42 0.00 0.00 5.02 0.41 0.60 118.16 119.37 3d5q n LYS 56 Ca -0.10 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.19 3d5q n LYS 56 Cb 0.21 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 34.04 3d5q n LYS 56 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3d5q n MET 57 N 0.16 -0.40 -2.33 1.97 2.81 -0.75 -5.03 117.12 113.56 3d5q n MET 57 Ca 0.00 -0.33 -0.06 0.00 -1.81 0.00 0.00 57.70 55.50 3d5q n MET 57 Cb 0.09 -0.78 0.01 0.00 -0.71 0.00 0.00 33.22 31.82 3d5q n MET 57 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3d5q n GLY 58 N -0.02 0.28 3.94 3.03 0.00 0.20 -3.81 105.19 108.81 3d5q n GLY 58 Ca 0.00 -0.59 -0.27 0.00 0.00 0.00 0.00 46.02 45.16 3d5q n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d5q s ALA 59 N -2.54 3.93 -0.30 4.61 0.00 -0.92 -1.69 121.76 124.86 3d5q s ALA 59 Ca 0.05 -0.94 -0.27 0.00 0.00 0.00 0.00 51.96 50.80 3d5q s ALA 59 Cb -0.02 -1.86 0.01 0.00 0.00 0.00 0.00 23.12 21.25 3d5q s ALA 59 CO 0.06 0.54 0.98 -1.01 0.00 0.00 0.00 175.76 176.33 3d5q s HIS 60 N -1.75 3.20 0.11 0.00 0.09 -0.97 -2.94 115.29 113.02 3d5q s HIS 60 Ca 0.36 1.13 0.06 0.00 -0.00 0.00 0.00 55.06 56.61 3d5q s HIS 60 Cb -0.11 -3.47 -0.04 0.00 -0.00 0.00 0.00 32.58 28.96 3d5q s HIS 60 CO 0.29 -0.65 -0.05 0.14 -0.00 0.00 0.00 174.74 174.46 3d5q s VAL 61 N 3.35 3.64 -0.16 -0.90 -7.23 -0.52 0.40 120.40 119.00 3d5q s VAL 61 Ca 0.41 -1.20 -0.02 0.00 -1.81 0.00 0.00 61.98 59.36 3d5q s VAL 61 Cb -0.13 -2.74 0.05 0.00 0.56 0.00 0.00 36.38 34.12 3d5q s VAL 61 CO 0.13 0.08 0.02 -0.69 -0.31 0.00 0.00 175.10 174.33 3d5q s VAL 62 N -1.32 0.52 -0.03 1.32 1.01 -0.43 -3.13 120.40 118.34 3d5q s VAL 62 Ca 0.24 -0.39 -0.03 0.00 0.00 0.00 0.00 61.98 61.80 3d5q s VAL 62 Cb -0.11 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.31 3d5q s VAL 62 CO 0.16 -0.07 0.15 0.68 0.00 0.00 0.00 175.10 176.03 3d5q s VAL 63 N 1.87 5.31 0.17 2.92 -7.23 -1.21 -2.02 120.40 120.23 3d5q s VAL 63 Ca 0.01 -0.13 0.03 0.00 -1.81 0.00 0.00 61.98 60.08 3d5q s VAL 63 Cb -0.16 -3.44 -0.05 0.00 0.56 0.00 0.00 36.38 33.30 3d5q s VAL 63 CO -0.07 0.39 -0.02 0.28 -0.31 0.00 0.00 175.10 175.37 3d5q s THR 64 N -1.24 0.84 -2.17 5.32 -1.32 -0.95 -3.02 115.64 113.11 3d5q s THR 64 Ca 0.24 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.72 3d5q s THR 64 Cb -0.12 -2.08 0.00 0.00 -1.51 0.00 0.00 72.50 68.79 3d5q s THR 64 CO 0.15 -0.53 0.00 0.00 -2.21 0.00 0.00 174.62 172.03 3d5q n ALA 65 N -0.25 0.00 -0.01 11.08 0.00 -1.25 -2.48 120.51 127.60 3d5q n ALA 65 Ca -0.07 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.35 3d5q n ALA 65 Cb 0.63 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.07 3d5q n ALA 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3d5q n ARG 66 N 0.00 0.07 -1.53 0.00 1.74 -1.24 0.54 116.66 116.25 3d5q n ARG 66 Ca 0.00 0.03 -0.31 0.00 -0.77 0.00 0.00 57.85 56.80 3d5q n ARG 66 Cb 0.00 -0.46 -0.10 0.00 -1.02 0.00 0.00 32.46 30.87 3d5q n ARG 66 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3d5q n SER 67 N -2.87 1.03 0.21 0.55 2.88 -1.26 -4.49 113.62 109.68 3d5q n SER 67 Ca -0.02 -0.52 0.05 0.00 -1.33 0.00 0.00 58.87 57.05 3d5q n SER 67 Cb 0.07 -1.25 0.47 0.00 -0.75 0.00 0.00 64.21 62.75 3d5q n SER 67 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 3d5q h LYS 68 N 14.72 0.00 0.59 -1.46 2.10 -1.96 -1.04 116.57 129.52 3d5q h LYS 68 Ca -0.09 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.53 3d5q h LYS 68 Cb 1.20 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.54 3d5q h LYS 68 CO 1.27 0.24 -0.28 0.93 -2.00 0.00 0.00 179.45 179.61 3d5q h GLU 69 N 0.00 -0.76 0.00 0.07 4.39 -2.00 -0.54 114.58 115.73 3d5q h GLU 69 Ca -0.00 0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.71 3d5q h GLU 69 Cb 0.43 0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.25 3d5q h GLU 69 CO 0.03 -0.51 -0.20 1.79 -1.16 0.00 0.00 179.01 178.96 3d5q h THR 70 N -0.79 0.65 0.00 1.13 1.35 -1.89 -2.42 112.91 110.94 3d5q h THR 70 Ca -0.08 -0.89 -0.17 0.00 -0.55 0.00 0.00 66.41 64.72 3d5q h THR 70 Cb 0.60 1.57 -0.02 0.00 -1.73 0.00 0.00 68.15 68.57 3d5q h THR 70 CO 0.13 0.20 -0.81 -0.07 -0.25 0.00 0.00 175.52 174.72 3d5q h LEU 71 N 0.00 0.00 -0.39 3.87 3.38 -0.97 -2.70 115.31 118.50 3d5q h LEU 71 Ca -0.00 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3d5q h LEU 71 Cb 0.55 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 3d5q h LEU 71 CO 0.03 0.81 0.07 -0.61 0.09 0.00 0.00 178.44 178.82 3d5q h GLN 72 N 0.00 0.64 0.00 1.13 5.75 -0.62 -1.77 115.11 120.25 3d5q h GLN 72 Ca -0.01 -0.17 0.00 0.00 -0.15 0.00 0.00 58.65 58.32 3d5q h GLN 72 Cb 1.43 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.90 3d5q h GLN 72 CO 0.11 0.69 0.00 1.63 -2.65 0.00 0.00 178.83 178.61 3d5q n LYS 73 N -4.54 0.34 -0.12 1.69 5.02 -1.03 -2.11 118.16 117.42 3d5q n LYS 73 Ca -0.01 0.08 -0.17 0.00 -2.02 0.00 0.00 58.31 56.19 3d5q n LYS 73 Cb 0.23 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.63 3d5q n LYS 73 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3d5q n VAL 74 N -1.19 1.32 -0.18 -0.18 0.31 -0.93 -4.15 118.33 113.34 3d5q n VAL 74 Ca 0.10 -0.48 -0.08 0.00 -0.01 0.00 0.00 64.34 63.86 3d5q n VAL 74 Cb 0.11 -1.38 0.02 0.00 -0.91 0.00 0.00 33.84 31.67 3d5q n VAL 74 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3d5q h VAL 75 N -0.11 1.22 -0.05 2.52 2.07 -0.99 -2.64 116.25 118.27 3d5q h VAL 75 Ca -0.53 -0.68 0.01 0.00 0.82 0.00 0.00 66.70 66.32 3d5q h VAL 75 Cb 1.76 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.20 3d5q h VAL 75 CO -0.12 0.26 -0.17 -1.28 0.02 0.00 0.00 177.57 176.28 3d5q h SER 76 N 0.71 -0.55 -0.26 0.57 0.87 -1.66 -2.13 113.55 111.10 3d5q h SER 76 Ca 0.17 0.07 0.08 0.00 -1.23 0.00 0.00 61.79 60.88 3d5q h SER 76 Cb 0.20 0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.37 3d5q h SER 76 CO -0.01 -0.15 0.29 -0.74 -0.53 0.00 0.00 176.83 175.69 3d5q h HIS 77 N -0.18 0.00 0.84 2.24 6.17 -1.71 -1.95 115.15 120.56 3d5q h HIS 77 Ca 0.01 0.00 -0.04 0.00 0.71 0.00 0.00 60.37 61.05 3d5q h HIS 77 Cb 0.21 0.00 0.01 0.00 2.52 0.00 0.00 27.41 30.15 3d5q h HIS 77 CO -0.49 0.00 -0.40 0.00 0.71 0.00 0.00 177.93 177.74 3d5q h LEU 79 N -1.20 -0.70 -1.41 0.00 3.38 -0.94 0.63 115.31 115.08 3d5q h LEU 79 Ca -0.12 0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3d5q h LEU 79 Cb 0.86 0.35 0.00 0.00 0.09 0.00 0.00 40.66 41.96 3d5q h LEU 79 CO 0.19 -0.25 0.00 -1.84 0.09 0.00 0.00 178.44 176.63 3d5q n GLU 80 N -5.37 0.69 0.00 1.13 -0.00 -1.12 0.60 120.64 116.57 3d5q n GLU 80 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.16 3d5q n GLU 80 Cb 0.28 -1.27 0.00 0.00 -0.00 0.00 0.00 31.44 30.45 3d5q n GLU 80 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 3d5q n LEU 81 N 0.36 0.68 -0.16 -1.84 4.77 0.19 -5.02 117.00 115.98 3d5q n LEU 81 Ca 0.00 -0.68 0.00 0.00 -0.03 0.00 0.00 56.01 55.30 3d5q n LEU 81 Cb 0.24 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 3d5q n LEU 81 CO 0.00 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 3d5q n GLY 82 N -0.15 1.00 3.74 -0.72 0.00 0.20 -3.29 105.19 105.98 3d5q n GLY 82 Ca 0.00 -0.23 -0.40 0.00 0.00 0.00 0.00 46.02 45.39 3d5q n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d5q s ALA 83 N -2.32 3.36 0.10 4.61 0.00 -1.14 -3.12 121.76 123.25 3d5q s ALA 83 Ca 0.00 0.30 -0.26 0.00 0.00 0.00 0.00 51.96 52.00 3d5q s ALA 83 Cb 0.00 -3.02 -0.12 0.00 0.00 0.00 0.00 23.12 19.98 3d5q s ALA 83 CO 0.00 0.05 1.68 0.00 0.00 0.00 0.00 175.76 177.49 3d5q h ALA 84 N 5.70 -0.29 -3.02 0.00 0.00 -1.67 -3.44 119.26 116.54 3d5q h ALA 84 Ca -0.44 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.27 3d5q h ALA 84 Cb 1.21 0.22 -0.24 0.00 0.00 0.00 0.00 17.79 18.97 3d5q h ALA 84 CO 0.71 -0.69 -0.47 -1.54 0.00 0.00 0.00 179.25 177.26 3d5q s SER 85 N -4.92 -0.12 -0.15 0.00 1.04 -1.26 -4.98 113.70 103.31 3d5q s SER 85 Ca -0.15 0.16 -0.04 0.00 0.48 0.00 0.00 55.95 56.40 3d5q s SER 85 Cb 0.07 0.33 0.06 0.00 0.10 0.00 0.00 66.02 66.57 3d5q s SER 85 CO 0.65 -0.20 0.08 0.00 0.98 0.00 0.00 173.24 174.75 3d5q s ALA 86 N -0.53 0.42 0.48 5.32 0.00 -1.26 -1.43 121.76 124.76 3d5q s ALA 86 Ca -0.06 -0.25 0.03 0.00 0.00 0.00 0.00 51.96 51.68 3d5q s ALA 86 Cb -0.04 -0.97 -0.03 0.00 0.00 0.00 0.00 23.12 22.08 3d5q s ALA 86 CO 0.01 -1.06 0.00 -1.01 0.00 0.00 0.00 175.76 173.70 3d5q s HIS 87 N 2.13 2.05 0.00 0.00 3.76 -1.18 -4.97 115.29 117.08 3d5q s HIS 87 Ca 0.02 -0.88 -0.09 0.00 -0.15 0.00 0.00 55.06 53.97 3d5q s HIS 87 Cb -0.15 -1.66 0.01 0.00 1.11 0.00 0.00 32.58 31.88 3d5q s HIS 87 CO -0.08 0.29 0.17 1.52 -0.85 0.00 0.00 174.74 175.79 3d5q s TYR 88 N -2.83 0.00 0.11 1.40 -0.85 -1.26 -3.28 117.35 110.64 3d5q s TYR 88 Ca 0.14 -0.07 0.06 0.00 -0.52 0.00 0.00 57.07 56.68 3d5q s TYR 88 Cb 0.04 -0.02 -0.04 0.00 0.38 0.00 0.00 41.96 42.32 3d5q s TYR 88 CO 0.07 -0.31 -0.14 0.42 -1.52 0.00 0.00 175.55 174.06 3d5q s ILE 89 N -1.42 1.32 -0.09 -3.49 1.01 -1.17 -5.01 121.20 112.36 3d5q s ILE 89 Ca -0.14 -1.64 -0.00 0.00 0.00 0.00 0.00 60.65 58.86 3d5q s ILE 89 Cb -0.07 -1.46 0.02 0.00 0.01 0.00 0.00 42.46 40.96 3d5q s ILE 89 CO 0.02 -0.37 -0.05 0.00 0.00 0.00 0.00 174.94 174.54 3d5q s ALA 90 N -1.95 1.04 0.01 9.38 0.00 -1.26 -3.93 121.76 125.05 3d5q s ALA 90 Ca 0.07 -0.34 -0.01 0.00 0.00 0.00 0.00 51.96 51.68 3d5q s ALA 90 Cb -0.06 -0.78 0.00 0.00 0.00 0.00 0.00 23.12 22.29 3d5q s ALA 90 CO 0.03 -0.34 0.04 0.41 0.00 0.00 0.00 175.76 175.90 3d5q n GLY 91 N 4.82 1.58 3.12 0.00 0.00 0.19 -4.94 105.19 109.96 3d5q n GLY 91 Ca -0.13 -0.97 -0.31 0.00 0.00 0.00 0.00 46.02 44.61 3d5q n GLY 91 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d5q s THR 92 N -2.74 1.81 -1.93 2.61 2.01 -1.26 -3.60 115.64 112.55 3d5q s THR 92 Ca 0.01 -0.83 0.00 0.00 0.31 0.00 0.00 61.69 61.18 3d5q s THR 92 Cb -0.00 -1.62 0.00 0.00 0.01 0.00 0.00 72.50 70.89 3d5q s THR 92 CO 0.00 0.50 0.65 0.23 -0.69 0.00 0.00 174.62 175.32 3d5q n MET 93 N 4.13 0.68 0.11 4.92 0.00 -1.26 0.51 117.12 126.21 3d5q n MET 93 Ca -0.20 0.00 -0.02 0.00 0.00 0.00 0.00 57.70 57.49 3d5q n MET 93 Cb 0.51 -1.02 0.04 0.00 0.00 0.00 0.00 33.22 32.75 3d5q n MET 93 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 3d5q h GLU 94 N 0.02 0.00 -5.38 0.03 5.08 -1.93 -3.41 114.58 109.00 3d5q h GLU 94 Ca 0.00 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.72 3d5q h GLU 94 Cb 0.02 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.12 3d5q h GLU 94 CO 0.00 0.70 0.52 0.34 -1.00 0.00 0.00 179.01 179.58 3d5q s ASP 95 N -6.63 6.19 0.07 1.42 -1.08 0.18 -4.88 116.67 111.95 3d5q s ASP 95 Ca 0.01 -1.05 -0.22 0.00 -0.52 0.00 0.00 52.55 50.77 3d5q s ASP 95 Cb 0.10 -2.41 -0.13 0.00 -1.46 0.00 0.00 42.92 39.02 3d5q s ASP 95 CO 0.77 -1.41 1.62 0.24 0.52 0.00 0.00 175.17 176.91 3d5q h MET 96 N 9.52 0.14 -0.79 4.34 2.86 -1.81 -1.07 114.93 128.12 3d5q h MET 96 Ca -0.28 -0.02 0.19 0.00 -2.06 0.00 0.00 59.70 57.53 3d5q h MET 96 Cb 1.07 -0.02 -0.14 0.00 0.06 0.00 0.00 31.60 32.57 3d5q h MET 96 CO 1.18 0.24 0.04 1.15 1.06 0.00 0.00 176.91 180.57 3d5q h THR 97 N 0.01 0.31 0.72 2.22 2.02 -1.94 -0.62 112.91 115.64 3d5q h THR 97 Ca 0.03 -0.04 -0.03 0.00 0.77 0.00 0.00 66.41 67.14 3d5q h THR 97 Cb 0.15 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 66.75 3d5q h THR 97 CO -0.00 0.02 -0.40 0.15 0.37 0.00 0.00 175.52 175.66 3d5q h PHE 98 N 0.11 -1.06 -0.73 3.16 3.57 -1.68 -2.87 116.94 117.43 3d5q h PHE 98 Ca 0.44 -0.02 0.16 0.00 3.53 0.00 0.00 57.97 62.09 3d5q h PHE 98 Cb 0.81 0.37 -0.13 0.00 2.79 0.00 0.00 35.95 39.79 3d5q h PHE 98 CO -0.41 -0.62 0.00 0.00 -2.23 0.00 0.00 178.31 175.06 3d5q h ALA 99 N -1.38 0.75 -1.00 2.41 0.00 -0.41 0.26 119.26 119.89 3d5q h ALA 99 Ca -0.10 0.23 0.12 0.00 0.00 0.00 0.00 54.91 55.17 3d5q h ALA 99 Cb 0.82 0.41 -0.08 0.00 0.00 0.00 0.00 17.79 18.93 3d5q h ALA 99 CO 0.13 -0.42 0.63 1.49 0.00 0.00 0.00 179.25 181.08 3d5q h GLU 100 N 0.10 0.96 0.13 0.00 4.81 -1.03 -2.27 114.58 117.28 3d5q h GLU 100 Ca 0.40 -0.06 -0.28 0.00 -0.13 0.00 0.00 59.36 59.29 3d5q h GLU 100 Cb 0.69 -0.22 0.01 0.00 0.63 0.00 0.00 28.75 29.86 3d5q h GLU 100 CO -0.65 0.64 -1.24 1.96 -0.73 0.00 0.00 179.01 178.99 3d5q h GLN 101 N 0.99 0.31 -0.56 1.92 4.20 -0.41 -3.17 115.11 118.39 3d5q h GLN 101 Ca 0.50 -0.51 0.12 0.00 0.06 0.00 0.00 58.65 58.82 3d5q h GLN 101 Cb 0.49 0.19 -0.03 0.00 0.30 0.00 0.00 27.48 28.43 3d5q h GLN 101 CO -0.27 1.23 0.38 0.35 -0.67 0.00 0.00 178.83 179.86 3d5q h PHE 102 N 0.10 0.24 -0.01 2.96 3.57 -0.22 -0.82 116.94 122.77 3d5q h PHE 102 Ca -0.14 0.01 -0.21 0.00 3.53 0.00 0.00 57.97 61.16 3d5q h PHE 102 Cb 1.96 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 40.61 3d5q h PHE 102 CO 0.07 0.11 -0.89 0.28 -2.23 0.00 0.00 178.31 175.65 3d5q h VAL 103 N 0.22 1.44 0.27 1.41 2.07 -1.46 -1.20 116.25 119.00 3d5q h VAL 103 Ca 0.26 -2.48 -0.01 0.00 0.82 0.00 0.00 66.70 65.29 3d5q h VAL 103 Cb 0.74 2.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.91 3d5q h VAL 103 CO -0.05 0.73 -0.13 0.00 0.02 0.00 0.00 177.57 178.14 3d5q h ALA 104 N 0.86 -0.62 -1.00 1.67 0.00 -1.41 -1.54 119.26 117.21 3d5q h ALA 104 Ca -0.06 -0.08 0.38 0.00 0.00 0.00 0.00 54.91 55.15 3d5q h ALA 104 Cb 1.52 0.14 -0.17 0.00 0.00 0.00 0.00 17.79 19.28 3d5q h ALA 104 CO 0.15 -0.60 0.52 0.37 0.00 0.00 0.00 179.25 179.69 3d5q h GLN 105 N -0.61 0.10 -0.31 0.00 5.75 -1.27 0.58 115.11 119.34 3d5q h GLN 105 Ca -0.04 -0.01 -0.16 0.00 -0.15 0.00 0.00 58.65 58.30 3d5q h GLN 105 Cb 0.28 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.80 3d5q h GLN 105 CO 0.06 0.06 -0.43 0.00 -2.65 0.00 0.00 178.83 175.88 3d5q h ALA 106 N 1.95 0.66 -0.00 3.38 0.00 -1.24 0.13 119.26 124.14 3d5q h ALA 106 Ca 0.80 -0.46 -0.20 0.00 0.00 0.00 0.00 54.91 55.04 3d5q h ALA 106 Cb 2.01 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.69 3d5q h ALA 106 CO -0.73 0.67 -0.88 0.78 0.00 0.00 0.00 179.25 179.09 3d5q h GLY 107 N 0.88 0.30 0.94 0.00 0.00 0.96 -2.33 103.07 103.82 3d5q h GLY 107 Ca 0.04 -0.52 -0.05 0.00 0.00 0.00 0.00 47.33 46.81 3d5q h GLY 107 CO 0.09 0.46 0.04 1.70 0.00 0.00 0.00 176.54 178.83 3d5q h LYS 108 N 0.15 0.68 0.00 4.80 1.63 -0.13 0.69 116.57 124.39 3d5q h LYS 108 Ca -0.05 -0.20 -0.00 0.00 -0.85 0.00 0.00 60.65 59.55 3d5q h LYS 108 Cb 1.51 -0.07 -0.00 0.00 -0.60 0.00 0.00 32.23 33.06 3d5q h LYS 108 CO 0.14 0.74 -0.02 -0.07 -3.45 0.00 0.00 179.45 176.79 3d5q h LEU 109 N 0.52 0.00 -0.29 5.20 4.07 -0.59 -3.15 115.31 121.07 3d5q h LEU 109 Ca 0.12 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.08 3d5q h LEU 109 Cb 0.41 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.15 3d5q h LEU 109 CO 0.01 0.02 0.00 0.23 -1.08 0.00 0.00 178.44 177.62 3d5q n MET 110 N -3.22 3.23 -3.60 1.13 2.81 -0.89 -5.03 117.12 111.56 3d5q n MET 110 Ca -0.02 -0.15 -0.22 0.00 -1.81 0.00 0.00 57.70 55.51 3d5q n MET 110 Cb 0.16 -0.58 0.07 0.00 -0.71 0.00 0.00 33.22 32.16 3d5q n MET 110 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3d5q n GLY 111 N 0.50 -0.42 0.00 3.03 0.00 0.23 -4.91 105.19 103.63 3d5q n GLY 111 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.18 3d5q n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d5q n GLY 112 N -1.55 2.09 3.36 -0.02 0.00 -0.80 -5.03 105.19 103.23 3d5q n GLY 112 Ca -0.16 -1.70 -0.11 0.00 0.00 0.00 0.00 46.02 44.04 3d5q n GLY 112 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3d5q s LEU 113 N 0.00 -0.06 0.00 0.99 2.96 -1.26 -4.72 118.68 116.58 3d5q s LEU 113 Ca 0.00 1.00 0.00 0.00 -0.22 0.00 0.00 54.13 54.91 3d5q s LEU 113 Cb 0.00 1.61 0.00 0.00 0.50 0.00 0.00 46.19 48.30 3d5q s LEU 113 CO 0.00 -0.19 0.00 0.47 -1.32 0.00 0.00 176.35 175.31 3d5q n ASP 114 N 3.56 4.02 -3.70 3.68 8.00 0.12 -4.24 116.55 127.99 3d5q n ASP 114 Ca -0.18 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.15 3d5q n ASP 114 Cb 0.56 0.54 -0.16 0.00 -0.02 0.00 0.00 41.12 42.05 3d5q n ASP 114 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 3d5q s MET 115 N -1.74 0.01 -0.30 -1.24 1.75 -0.73 0.54 119.30 117.60 3d5q s MET 115 Ca 0.00 0.43 -0.06 0.00 -1.25 0.00 0.00 55.69 54.81 3d5q s MET 115 Cb 0.00 -0.30 0.02 0.00 2.84 0.00 0.00 34.83 37.39 3d5q s MET 115 CO 0.00 -0.26 0.07 -1.17 -0.65 0.00 0.00 175.02 173.00 3d5q s LEU 116 N 1.84 3.91 -0.67 4.11 2.96 -0.15 -1.24 118.68 129.45 3d5q s LEU 116 Ca -0.01 -0.90 -0.03 0.00 -0.22 0.00 0.00 54.13 52.97 3d5q s LEU 116 Cb -0.12 -1.84 0.17 0.00 0.50 0.00 0.00 46.19 44.90 3d5q s LEU 116 CO -0.05 -0.23 0.49 -0.63 -1.32 0.00 0.00 176.35 174.62 3d5q s ILE 117 N 1.43 3.87 0.06 6.68 1.01 -0.54 0.66 121.20 134.38 3d5q s ILE 117 Ca 0.00 -3.05 -0.30 0.00 0.00 0.00 0.00 60.65 57.30 3d5q s ILE 117 Cb -0.18 -3.50 -0.05 0.00 0.01 0.00 0.00 42.46 38.74 3d5q s ILE 117 CO 0.01 -0.91 1.11 -0.76 0.00 0.00 0.00 174.94 174.39 3d5q s LEU 118 N -0.22 4.39 0.00 2.97 1.43 -0.40 -1.29 118.68 125.57 3d5q s LEU 118 Ca 0.18 1.91 0.00 0.00 -1.03 0.00 0.00 54.13 55.19 3d5q s LEU 118 Cb -0.18 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.46 3d5q s LEU 118 CO -0.04 -0.35 0.00 -3.20 0.23 0.00 0.00 176.35 172.99 3d5q n ASN 119 N 3.62 0.00 -4.74 2.29 2.85 -1.26 -2.43 115.26 115.60 3d5q n ASN 119 Ca 0.07 0.00 -0.29 0.00 -0.11 0.00 0.00 54.58 54.24 3d5q n ASN 119 Cb 0.48 0.00 0.14 0.00 1.24 0.00 0.00 39.78 41.63 3d5q n ASN 119 CO 0.00 0.00 0.00 -1.38 -2.11 0.00 0.00 177.26 173.77 3d5q s HIS 120 N 0.00 2.41 -0.22 1.20 -3.43 -1.26 -4.72 115.29 109.28 3d5q s HIS 120 Ca 0.00 1.11 -0.27 0.00 -0.80 0.00 0.00 55.06 55.10 3d5q s HIS 120 Cb 0.00 -3.21 0.10 0.00 -1.43 0.00 0.00 32.58 28.04 3d5q s HIS 120 CO 0.00 -2.37 0.90 0.96 -2.00 0.00 0.00 174.74 172.24 3d5q s ILE 121 N -3.05 0.00 1.35 -5.38 -5.25 -1.26 -4.77 121.20 102.84 3d5q s ILE 121 Ca 0.63 0.00 -0.21 0.00 -0.99 0.00 0.00 60.65 60.08 3d5q s ILE 121 Cb -0.17 -1.00 0.33 0.00 2.95 0.00 0.00 42.46 44.57 3d5q s ILE 121 CO 0.56 0.00 0.76 1.07 -1.79 0.00 0.00 174.94 175.54 3d5q n THR 122 N 1.82 0.00 -3.25 8.37 5.66 -1.26 -4.96 114.28 120.65 3d5q n THR 122 Ca -0.13 -0.07 -0.39 0.00 -3.05 0.00 0.00 64.05 60.41 3d5q n THR 122 Cb 0.56 -0.88 -0.06 0.00 -1.55 0.00 0.00 70.33 68.41 3d5q n THR 122 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 3d5q s ASN 123 N -2.75 6.99 0.05 1.09 0.01 -1.26 -5.07 114.94 114.00 3d5q s ASN 123 Ca 0.61 1.17 -0.01 0.00 -0.71 0.00 0.00 52.86 53.92 3d5q s ASN 123 Cb -0.12 -2.35 -0.04 0.00 0.41 0.00 0.00 41.25 39.14 3d5q s ASN 123 CO 0.53 0.18 -0.03 0.42 -1.51 0.00 0.00 177.10 176.68 3d5q s THR 124 N -0.55 0.24 0.47 1.60 -4.23 -1.26 -5.07 115.64 106.83 3d5q s THR 124 Ca 0.30 -1.81 0.03 0.00 -1.18 0.00 0.00 61.69 59.02 3d5q s THR 124 Cb -0.18 -1.52 -0.03 0.00 1.34 0.00 0.00 72.50 72.10 3d5q s THR 124 CO 0.17 -0.99 0.02 -0.94 -0.54 0.00 0.00 174.62 172.34 3d5q s SER 125 N -2.92 3.87 -0.24 3.99 1.04 -1.26 -5.08 113.70 113.10 3d5q s SER 125 Ca 0.07 -1.59 -0.25 0.00 0.48 0.00 0.00 55.95 54.65 3d5q s SER 125 Cb 0.08 0.32 -0.00 0.00 0.10 0.00 0.00 66.02 66.52 3d5q s SER 125 CO -0.10 -0.78 0.87 -0.76 0.98 0.00 0.00 173.24 173.45 3d5q s LEU 126 N -3.80 4.09 -0.18 2.42 1.43 -1.26 -4.83 118.68 116.55 3d5q s LEU 126 Ca 0.14 1.10 -0.27 0.00 -1.03 0.00 0.00 54.13 54.08 3d5q s LEU 126 Cb 0.04 -3.25 0.07 0.00 0.03 0.00 0.00 46.19 43.07 3d5q s LEU 126 CO 0.08 -0.54 0.69 0.20 0.23 0.00 0.00 176.35 177.00 3d5q s ASN 127 N 1.31 -0.70 0.24 2.29 0.01 -0.70 -5.07 114.94 112.31 3d5q s ASN 127 Ca 0.37 1.13 -0.31 0.00 -0.71 0.00 0.00 52.86 53.34 3d5q s ASN 127 Cb -0.15 1.08 -0.11 0.00 0.41 0.00 0.00 41.25 42.48 3d5q s ASN 127 CO 0.07 -0.39 1.54 -0.76 -1.51 0.00 0.00 177.10 176.06 3d5q s LEU 128 N -0.25 4.37 0.50 0.60 1.43 -1.26 -3.90 118.68 120.17 3d5q s LEU 128 Ca -0.04 2.76 -0.19 0.00 -1.03 0.00 0.00 54.13 55.62 3d5q s LEU 128 Cb -0.03 -3.62 -0.08 0.00 0.03 0.00 0.00 46.19 42.49 3d5q s LEU 128 CO 0.04 -0.82 1.03 0.12 0.23 0.00 0.00 176.35 176.95 3d5q s PHE 129 N 0.37 3.06 0.00 0.29 5.36 -1.26 -4.88 117.98 120.92 3d5q s PHE 129 Ca 0.64 1.56 0.00 0.00 -0.96 0.00 0.00 56.93 58.18 3d5q s PHE 129 Cb -0.45 -3.01 0.00 0.00 -0.34 0.00 0.00 43.02 39.22 3d5q s PHE 129 CO 0.41 -0.76 0.00 1.58 -1.46 0.00 0.00 175.22 174.98 3d5q n HIS 130 N -1.14 0.00 -0.33 10.12 -0.00 -1.26 -5.02 115.22 117.58 3d5q n HIS 130 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.81 3d5q n HIS 130 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.52 3d5q n HIS 130 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 3d5q n ASP 131 N -0.37 0.00 -4.14 0.26 2.03 -1.26 -5.05 116.55 108.02 3d5q n ASP 131 Ca 0.00 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.88 3d5q n ASP 131 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 3d5q n ASP 131 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 3d5q n ASP 132 N 0.00 4.57 -0.14 1.67 -0.08 -1.26 -4.68 116.55 116.63 3d5q n ASP 132 Ca 0.00 -2.92 -0.08 0.00 -1.51 0.00 0.00 54.79 50.28 3d5q n ASP 132 Cb 0.00 -1.66 0.07 0.00 2.34 0.00 0.00 41.12 41.87 3d5q n ASP 132 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 3d5q h ILE 133 N 4.62 1.26 -0.95 5.18 2.04 -1.99 -2.30 117.51 125.37 3d5q h ILE 133 Ca 0.48 -1.22 0.18 0.00 1.00 0.00 0.00 64.86 65.29 3d5q h ILE 133 Cb 0.75 1.00 -0.17 0.00 -0.74 0.00 0.00 36.82 37.66 3d5q h ILE 133 CO 1.63 0.42 -0.29 -0.74 0.00 0.00 0.00 178.15 179.17 3d5q h HIS 134 N 0.81 -0.70 -0.26 1.37 2.76 -1.99 0.37 115.15 117.51 3d5q h HIS 134 Ca 0.13 0.09 -0.18 0.00 -2.20 0.00 0.00 60.37 58.21 3d5q h HIS 134 Cb 0.63 0.45 0.00 0.00 1.55 0.00 0.00 27.41 30.05 3d5q h HIS 134 CO 0.04 -0.41 -0.55 1.25 -1.30 0.00 0.00 177.93 176.96 3d5q h HIS 135 N -0.01 1.06 -0.81 5.26 -0.00 -1.81 0.15 115.15 118.99 3d5q h HIS 135 Ca 0.42 -0.39 0.08 0.00 -0.00 0.00 0.00 60.37 60.47 3d5q h HIS 135 Cb 0.66 -0.19 -0.07 0.00 -0.00 0.00 0.00 27.41 27.81 3d5q h HIS 135 CO -0.77 1.21 0.47 0.28 -0.00 0.00 0.00 177.93 179.12 3d5q h VAL 136 N 0.60 0.96 -0.06 5.26 2.07 -0.88 -0.74 116.25 123.46 3d5q h VAL 136 Ca 0.00 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 3d5q h VAL 136 Cb 1.16 0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.99 3d5q h VAL 136 CO 0.12 0.15 -0.06 -0.09 0.02 0.00 0.00 177.57 177.71 3d5q h ARG 137 N 0.83 0.14 -0.92 1.57 2.43 0.54 -2.02 114.38 116.96 3d5q h ARG 137 Ca 0.37 -0.08 0.06 0.00 -0.81 0.00 0.00 59.98 59.53 3d5q h ARG 137 Cb 0.27 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.76 3d5q h ARG 137 CO -0.21 0.60 0.58 -0.22 -1.51 0.00 0.00 179.97 179.21 3d5q h LYS 138 N -0.31 1.03 -0.17 0.20 1.63 -0.48 -1.75 116.57 116.72 3d5q h LYS 138 Ca 0.01 -0.06 -0.02 0.00 -0.85 0.00 0.00 60.65 59.72 3d5q h LYS 138 Cb 0.58 -0.23 -0.01 0.00 -0.60 0.00 0.00 32.23 31.97 3d5q h LYS 138 CO 0.02 0.68 0.02 0.77 -3.45 0.00 0.00 179.45 177.48 3d5q h SER 139 N 1.06 0.28 0.26 4.20 0.02 -1.04 0.29 113.55 118.63 3d5q h SER 139 Ca 0.40 -0.28 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 3d5q h SER 139 Cb 0.16 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.62 3d5q h SER 139 CO -0.17 0.49 -0.08 -0.03 -1.14 0.00 0.00 176.83 175.90 3d5q h MET 140 N 0.07 0.00 0.12 3.45 1.85 -0.95 0.12 114.93 119.58 3d5q h MET 140 Ca 0.05 0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 59.14 3d5q h MET 140 Cb 0.34 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.37 3d5q h MET 140 CO 0.01 0.08 -0.06 0.93 -0.40 0.00 0.00 176.91 177.47 3d5q h GLU 141 N 0.00 -0.16 0.21 0.39 4.39 -0.61 -0.78 114.58 118.02 3d5q h GLU 141 Ca -0.00 0.01 -0.32 0.00 0.34 0.00 0.00 59.36 59.39 3d5q h GLU 141 Cb 0.23 0.04 0.03 0.00 -0.10 0.00 0.00 28.75 28.94 3d5q h GLU 141 CO 0.01 0.09 -1.39 0.28 -1.16 0.00 0.00 179.01 176.84 3d5q h VAL 142 N -1.01 1.35 0.01 3.13 2.07 -0.89 0.38 116.25 121.30 3d5q h VAL 142 Ca -0.02 -2.79 -0.26 0.00 0.82 0.00 0.00 66.70 64.45 3d5q h VAL 142 Cb 0.32 2.99 0.02 0.00 -1.52 0.00 0.00 31.29 33.09 3d5q h VAL 142 CO 0.03 0.83 -1.04 0.78 0.02 0.00 0.00 177.57 178.19 3d5q h ASN 143 N 0.14 0.86 0.00 0.57 4.21 -0.97 -3.39 115.58 116.99 3d5q h ASN 143 Ca -0.21 -0.69 0.00 0.00 1.21 0.00 0.00 56.30 56.60 3d5q h ASN 143 Cb 2.09 -0.26 0.00 0.00 -1.12 0.00 0.00 38.32 39.03 3d5q h ASN 143 CO 0.25 1.49 -0.36 0.33 -1.29 0.00 0.00 177.43 177.86 3d5q n PHE 144 N -3.83 0.00 -0.10 1.19 7.35 -1.14 -4.47 117.46 116.46 3d5q n PHE 144 Ca -0.10 0.00 -0.06 0.00 -0.76 0.00 0.00 57.45 56.52 3d5q n PHE 144 Cb 0.88 -0.18 0.01 0.00 0.35 0.00 0.00 39.48 40.54 3d5q n PHE 144 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 3d5q h LEU 145 N -0.36 0.04 -0.47 -2.13 4.07 -0.96 -1.71 115.31 113.79 3d5q h LEU 145 Ca 0.00 0.05 0.09 0.00 0.08 0.00 0.00 57.88 58.10 3d5q h LEU 145 Cb 0.36 0.06 -0.10 0.00 1.08 0.00 0.00 40.66 42.06 3d5q h LEU 145 CO 0.00 0.06 -0.30 0.77 -1.08 0.00 0.00 178.44 177.89 3d5q h SER 146 N 0.20 -1.03 -0.29 -0.43 4.64 -0.43 0.54 113.55 116.76 3d5q h SER 146 Ca 0.16 0.20 0.08 0.00 -0.47 0.00 0.00 61.79 61.76 3d5q h SER 146 Cb 0.16 0.51 -0.01 0.00 -0.31 0.00 0.00 62.40 62.75 3d5q h SER 146 CO -0.19 -0.30 0.30 1.88 -0.87 0.00 0.00 176.83 177.65 3d5q h TYR 147 N -0.20 0.00 0.00 4.77 -1.99 -1.55 0.40 116.97 118.41 3d5q h TYR 147 Ca 0.20 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.88 3d5q h TYR 147 Cb 0.53 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.25 3d5q h TYR 147 CO -0.56 0.00 -0.58 0.28 -0.00 0.00 0.00 178.16 177.31 3d5q h VAL 148 N 0.00 0.28 0.07 -2.88 2.07 0.49 -2.84 116.25 113.44 3d5q h VAL 148 Ca 0.14 -1.44 -0.09 0.00 0.82 0.00 0.00 66.70 66.13 3d5q h VAL 148 Cb 0.74 1.98 0.01 0.00 -1.52 0.00 0.00 31.29 32.50 3d5q h VAL 148 CO -0.00 0.16 -0.40 0.58 0.02 0.00 0.00 177.57 177.93 3d5q h VAL 149 N 0.00 1.65 -0.53 2.57 2.07 0.86 -2.56 116.25 120.32 3d5q h VAL 149 Ca -0.02 -2.41 0.11 0.00 0.82 0.00 0.00 66.70 65.19 3d5q h VAL 149 Cb 1.18 3.26 -0.10 0.00 -1.52 0.00 0.00 31.29 34.11 3d5q h VAL 149 CO 0.02 0.66 -0.12 -0.07 0.02 0.00 0.00 177.57 178.08 3d5q h LEU 150 N -0.67 -0.47 0.39 2.57 3.38 -1.48 -0.96 115.31 118.08 3d5q h LEU 150 Ca -0.07 0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 3d5q h LEU 150 Cb 1.30 0.32 -0.01 0.00 0.09 0.00 0.00 40.66 42.36 3d5q h LEU 150 CO 0.08 -0.17 -0.27 0.74 0.09 0.00 0.00 178.44 178.91 3d5q h THR 151 N 0.01 0.43 -0.68 0.22 2.02 -1.55 0.15 112.91 113.51 3d5q h THR 151 Ca 0.25 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.54 3d5q h THR 151 Cb 0.39 0.43 -0.08 0.00 -1.74 0.00 0.00 68.15 67.15 3d5q h THR 151 CO -0.53 0.00 0.29 0.58 0.37 0.00 0.00 175.52 176.22 3d5q h VAL 152 N -0.65 0.76 0.00 3.16 2.07 -1.17 0.15 116.25 120.57 3d5q h VAL 152 Ca -0.04 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 3d5q h VAL 152 Cb 0.55 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 30.56 3d5q h VAL 152 CO 0.02 0.09 -0.07 0.00 0.02 0.00 0.00 177.57 177.62 3d5q h ALA 153 N 1.46 1.06 0.00 1.67 0.00 -0.66 -2.63 119.26 120.16 3d5q h ALA 153 Ca 0.35 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3d5q h ALA 153 Cb 0.44 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3d5q h ALA 153 CO -0.32 0.09 -1.03 0.00 0.00 0.00 0.00 179.25 177.98 3d5q n ALA 154 N -2.15 4.22 0.00 0.00 0.00 0.49 -4.63 120.51 118.44 3d5q n ALA 154 Ca -0.00 -0.53 -0.10 0.00 0.00 0.00 0.00 53.44 52.81 3d5q n ALA 154 Cb 0.29 -0.84 -0.04 0.00 0.00 0.00 0.00 19.45 18.86 3d5q n ALA 154 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3d5q h LEU 155 N 0.00 -0.30 -0.17 0.00 5.85 -0.62 -1.35 115.31 118.72 3d5q h LEU 155 Ca 0.00 0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.83 3d5q h LEU 155 Cb 0.58 0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.70 3d5q h LEU 155 CO 0.00 -0.13 -0.20 -0.65 -0.34 0.00 0.00 178.44 177.12 3d5q h PRO 156 N -0.11 -0.23 -0.28 5.25 0.11 -1.82 0.26 132.00 135.17 3d5q h PRO 156 Ca 0.07 0.02 0.04 0.00 0.11 0.00 0.00 66.00 66.24 3d5q h PRO 156 Cb 0.22 0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.35 3d5q h PRO 156 CO -0.18 -0.15 0.07 0.52 -0.21 0.00 0.00 178.00 178.05 3d5q h MET 157 N -0.24 0.18 -0.13 1.05 2.86 -1.81 -1.63 114.93 115.21 3d5q h MET 157 Ca 0.11 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.71 3d5q h MET 157 Cb 0.41 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 3d5q h MET 157 CO -0.31 0.12 -0.06 -0.07 1.06 0.00 0.00 176.91 177.65 3d5q h LEU 158 N 0.18 0.17 -0.17 1.22 3.38 -1.01 -1.02 115.31 118.06 3d5q h LEU 158 Ca 0.13 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 3d5q h LEU 158 Cb 0.12 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3d5q h LEU 158 CO -0.16 0.26 -0.04 0.11 0.09 0.00 0.00 178.44 178.70 3d5q h LYS 159 N 0.18 0.33 -0.97 1.13 1.57 0.43 0.25 116.57 119.49 3d5q h LYS 159 Ca 0.04 -0.12 0.02 0.00 -1.87 0.00 0.00 60.65 58.72 3d5q h LYS 159 Cb 0.22 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.46 3d5q h LYS 159 CO 0.01 0.59 0.64 1.96 -0.57 0.00 0.00 179.45 182.07 3d5q h GLN 160 N 0.04 1.24 -0.01 3.15 4.20 -1.19 -3.16 115.11 119.38 3d5q h GLN 160 Ca 0.04 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3d5q h GLN 160 Cb 0.46 -0.28 0.00 0.00 0.30 0.00 0.00 27.48 27.96 3d5q h GLN 160 CO 0.02 0.82 -0.16 0.45 -0.67 0.00 0.00 178.83 179.29 3d5q n SER 161 N -4.43 0.80 -4.10 1.46 2.88 -0.41 -4.95 113.62 104.88 3d5q n SER 161 Ca 0.12 -0.81 -0.29 0.00 -1.33 0.00 0.00 58.87 56.55 3d5q n SER 161 Cb 0.04 0.03 -0.04 0.00 -0.75 0.00 0.00 64.21 63.49 3d5q n SER 161 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3d5q n ASN 162 N -0.71 -0.71 -0.17 -3.46 3.02 0.05 -4.95 115.26 108.33 3d5q n ASN 162 Ca 0.14 -1.07 0.00 0.00 -0.03 0.00 0.00 54.58 53.62 3d5q n ASN 162 Cb 0.31 -2.66 0.00 0.00 -0.61 0.00 0.00 39.78 36.82 3d5q n ASN 162 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d5q n GLY 163 N -1.96 1.71 3.00 7.41 0.00 -1.05 -4.82 105.19 109.47 3d5q n GLY 163 Ca -0.22 -1.71 -0.11 0.00 0.00 0.00 0.00 46.02 43.97 3d5q n GLY 163 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3d5q s SER 164 N -1.00 0.45 -0.06 1.61 0.01 0.19 -1.17 113.70 113.72 3d5q s SER 164 Ca 0.00 -0.45 0.05 0.00 1.31 0.00 0.00 55.95 56.86 3d5q s SER 164 Cb 0.00 0.06 -0.00 0.00 0.21 0.00 0.00 66.02 66.29 3d5q s SER 164 CO 0.00 -0.22 -0.22 -0.63 0.41 0.00 0.00 173.24 172.58 3d5q s ILE 165 N -1.24 1.80 -0.08 1.44 1.01 0.19 -0.97 121.20 123.35 3d5q s ILE 165 Ca -0.12 -0.91 0.04 0.00 0.00 0.00 0.00 60.65 59.66 3d5q s ILE 165 Cb -0.09 -1.55 0.00 0.00 0.01 0.00 0.00 42.46 40.84 3d5q s ILE 165 CO -0.00 0.51 -0.20 -0.69 0.00 0.00 0.00 174.94 174.55 3d5q s VAL 166 N 0.07 1.74 -0.16 2.92 1.01 0.21 -0.33 120.40 125.87 3d5q s VAL 166 Ca -0.08 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.07 3d5q s VAL 166 Cb -0.14 -1.52 0.02 0.00 0.00 0.00 0.00 36.38 34.74 3d5q s VAL 166 CO 0.04 0.49 -0.19 -0.69 0.00 0.00 0.00 175.10 174.76 3d5q s VAL 167 N 0.37 1.90 0.22 2.92 1.01 0.37 -1.27 120.40 125.91 3d5q s VAL 167 Ca -0.15 -0.86 -0.18 0.00 0.00 0.00 0.00 61.98 60.79 3d5q s VAL 167 Cb -0.16 -1.72 -0.08 0.00 0.00 0.00 0.00 36.38 34.41 3d5q s VAL 167 CO 0.06 0.52 0.70 -0.69 0.00 0.00 0.00 175.10 175.69 3d5q s VAL 168 N 1.18 4.63 0.00 2.92 1.01 -1.02 -1.51 120.40 127.62 3d5q s VAL 168 Ca 0.01 1.17 0.00 0.00 0.00 0.00 0.00 61.98 63.15 3d5q s VAL 168 Cb -0.14 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.43 3d5q s VAL 168 CO -0.09 0.17 0.00 -0.24 0.00 0.00 0.00 175.10 174.94 3d5q n SER 169 N 0.61 0.00 -3.67 3.32 2.88 -0.30 -4.84 113.62 111.62 3d5q n SER 169 Ca -0.02 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.42 3d5q n SER 169 Cb 0.51 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.93 3d5q n SER 169 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3d5q s SER 170 N 1.44 -0.28 0.31 -3.46 0.15 -1.25 -3.52 113.70 107.09 3d5q s SER 170 Ca 0.00 -0.37 0.06 0.00 0.70 0.00 0.00 55.95 56.34 3d5q s SER 170 Cb 0.00 0.54 0.84 0.00 -1.71 0.00 0.00 66.02 65.68 3d5q s SER 170 CO 0.00 -0.96 1.64 -0.07 1.20 0.00 0.00 173.24 175.05 3d5q h LEU 171 N 2.25 0.12 0.00 3.45 3.38 -1.78 1.47 115.31 124.20 3d5q h LEU 171 Ca -0.31 0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3d5q h LEU 171 Cb 1.26 0.25 0.00 0.00 0.09 0.00 0.00 40.66 42.26 3d5q h LEU 171 CO 0.41 -0.17 0.00 0.00 0.09 0.00 0.00 178.44 178.77 3d5q n ALA 172 N -2.61 1.93 0.29 1.53 0.00 -1.26 -0.92 120.51 119.48 3d5q n ALA 172 Ca 0.25 -0.04 0.06 0.00 0.00 0.00 0.00 53.44 53.71 3d5q n ALA 172 Cb 0.79 -1.11 0.09 0.00 0.00 0.00 0.00 19.45 19.22 3d5q n ALA 172 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d5q n GLY 173 N -0.16 0.74 0.00 0.00 0.00 0.50 -4.35 105.19 101.92 3d5q n GLY 173 Ca 0.05 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.69 3d5q n GLY 173 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3d5q n LYS 174 N 0.69 1.60 -4.24 1.61 4.76 -0.13 -4.24 118.16 118.21 3d5q n LYS 174 Ca 0.09 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.40 3d5q n LYS 174 Cb 0.36 -0.81 -0.10 0.00 -1.84 0.00 0.00 35.03 32.63 3d5q n LYS 174 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3d5q s VAL 175 N -1.63 0.97 0.32 -0.18 -7.23 -0.09 -5.14 120.40 107.42 3d5q s VAL 175 Ca 0.00 -2.02 -0.26 0.00 -1.81 0.00 0.00 61.98 57.89 3d5q s VAL 175 Cb 0.00 -1.90 -0.10 0.00 0.56 0.00 0.00 36.38 34.95 3d5q s VAL 175 CO 0.00 -0.70 0.95 0.00 -0.31 0.00 0.00 175.10 175.04 3d5q s ALA 176 N -3.46 3.21 -0.25 1.32 0.00 -1.26 -4.33 121.76 117.00 3d5q s ALA 176 Ca 0.18 0.55 -0.21 0.00 0.00 0.00 0.00 51.96 52.48 3d5q s ALA 176 Cb 0.04 -3.19 0.07 0.00 0.00 0.00 0.00 23.12 20.03 3d5q s ALA 176 CO 0.01 0.15 0.65 -0.47 0.00 0.00 0.00 175.76 176.09 3d5q s TYR 177 N -1.58 -0.78 0.84 0.00 6.14 -1.26 -5.04 117.35 115.67 3d5q s TYR 177 Ca 0.50 1.80 -0.12 0.00 0.64 0.00 0.00 57.07 59.89 3d5q s TYR 177 Cb -0.19 0.32 0.10 0.00 0.42 0.00 0.00 41.96 42.60 3d5q s TYR 177 CO 0.25 -0.38 1.14 -1.25 0.64 0.00 0.00 175.55 175.95 3d5q s PRO 178 N 0.64 1.70 0.00 4.97 0.04 -1.26 -4.24 135.00 136.85 3d5q s PRO 178 Ca -0.02 0.32 0.00 0.00 0.04 0.00 0.00 61.00 61.33 3d5q s PRO 178 Cb -0.05 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.59 3d5q s PRO 178 CO -0.04 -1.82 0.00 -1.33 0.04 0.00 0.00 177.00 173.86 3d5q n MET 179 N -3.51 0.00 -2.74 4.56 2.81 -1.25 -4.84 117.12 112.15 3d5q n MET 179 Ca 0.07 0.00 -0.05 0.00 -1.81 0.00 0.00 57.70 55.91 3d5q n MET 179 Cb 0.59 -1.49 0.05 0.00 -0.71 0.00 0.00 33.22 31.66 3d5q n MET 179 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 3d5q n VAL 180 N -2.00 0.98 -0.10 2.03 0.24 -1.26 -1.73 118.33 116.49 3d5q n VAL 180 Ca 0.00 -2.77 -0.10 0.00 -2.04 0.00 0.00 64.34 59.43 3d5q n VAL 180 Cb 0.00 0.98 -0.03 0.00 -1.47 0.00 0.00 33.84 33.32 3d5q n VAL 180 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3d5q h ALA 181 N 2.65 0.41 -0.49 2.33 0.00 -1.86 -0.05 119.26 122.24 3d5q h ALA 181 Ca -0.15 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 54.67 3d5q h ALA 181 Cb 1.23 -0.12 -0.08 0.00 0.00 0.00 0.00 17.79 18.83 3d5q h ALA 181 CO 0.29 0.08 0.02 0.00 0.00 0.00 0.00 179.25 179.64 3d5q h ALA 182 N 0.90 0.48 0.17 0.00 0.00 -1.93 -1.03 119.26 117.84 3d5q h ALA 182 Ca 0.10 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3d5q h ALA 182 Cb 0.31 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3d5q h ALA 182 CO 0.00 -0.37 -0.11 -0.92 0.00 0.00 0.00 179.25 177.85 3d5q h TYR 183 N 0.14 -0.31 -0.83 0.00 3.20 -1.88 -2.13 116.97 115.16 3d5q h TYR 183 Ca 0.25 -0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.32 3d5q h TYR 183 Cb 0.36 0.11 -0.14 0.00 1.54 0.00 0.00 36.73 38.60 3d5q h TYR 183 CO -0.29 -0.17 0.10 0.77 -1.64 0.00 0.00 178.16 176.94 3d5q h SER 184 N -0.27 -0.21 -0.02 -2.11 0.02 -0.86 0.36 113.55 110.45 3d5q h SER 184 Ca -0.02 0.20 0.03 0.00 -0.84 0.00 0.00 61.79 61.16 3d5q h SER 184 Cb 0.22 0.32 -0.04 0.00 0.14 0.00 0.00 62.40 63.04 3d5q h SER 184 CO 0.02 -0.18 -0.19 0.00 -1.14 0.00 0.00 176.83 175.33 3d5q h ALA 185 N 1.76 -0.23 -0.34 3.77 0.00 -1.15 0.60 119.26 123.68 3d5q h ALA 185 Ca 0.48 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.45 3d5q h ALA 185 Cb 0.92 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 19.01 3d5q h ALA 185 CO -0.68 -0.68 0.08 0.66 0.00 0.00 0.00 179.25 178.62 3d5q h SER 186 N -0.30 0.03 -0.62 0.00 4.64 0.33 0.05 113.55 117.68 3d5q h SER 186 Ca 0.06 0.05 -0.04 0.00 -0.47 0.00 0.00 61.79 61.39 3d5q h SER 186 Cb 0.39 0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 62.51 3d5q h SER 186 CO -0.19 0.05 0.23 0.11 -0.87 0.00 0.00 176.83 176.16 3d5q h LYS 187 N 0.20 0.98 -0.42 4.77 1.79 -0.74 -2.24 116.57 120.91 3d5q h LYS 187 Ca 0.16 -0.18 -0.07 0.00 -2.18 0.00 0.00 60.65 58.38 3d5q h LYS 187 Cb 0.17 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 30.64 3d5q h LYS 187 CO -0.20 0.82 -0.03 0.74 -1.08 0.00 0.00 179.45 179.70 3d5q h PHE 188 N 0.95 0.73 -0.72 -1.35 0.04 0.62 -2.79 116.94 114.43 3d5q h PHE 188 Ca 0.22 -0.10 -0.02 0.00 2.80 0.00 0.00 57.97 60.86 3d5q h PHE 188 Cb 0.23 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.15 3d5q h PHE 188 CO 0.02 0.71 0.35 0.00 -0.60 0.00 0.00 178.31 178.79 3d5q h ALA 189 N 1.33 1.27 0.43 2.45 0.00 -0.42 -2.46 119.26 121.86 3d5q h ALA 189 Ca 0.13 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3d5q h ALA 189 Cb 0.45 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3d5q h ALA 189 CO 0.02 0.57 -0.21 -0.07 0.00 0.00 0.00 179.25 179.56 3d5q h LEU 190 N 1.01 -0.49 -0.12 0.00 3.38 -1.17 0.14 115.31 118.05 3d5q h LEU 190 Ca 0.25 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.22 3d5q h LEU 190 Cb 0.09 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 3d5q h LEU 190 CO -0.03 -0.30 -0.34 -0.78 0.09 0.00 0.00 178.44 177.08 3d5q h ASP 191 N -0.66 -1.11 -0.89 -0.43 1.82 -1.53 0.81 116.42 114.44 3d5q h ASP 191 Ca -0.06 0.13 0.22 0.00 -0.39 0.00 0.00 57.03 56.94 3d5q h ASP 191 Cb 0.49 0.44 -0.13 0.00 0.68 0.00 0.00 39.33 40.81 3d5q h ASP 191 CO 0.10 -0.29 0.36 1.23 -1.61 0.00 0.00 179.24 179.02 3d5q h GLY 192 N -0.34 1.49 0.08 -0.78 0.00 -1.32 -0.48 103.07 101.73 3d5q h GLY 192 Ca 0.03 -0.14 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 3d5q h GLY 192 CO -0.30 -0.29 -0.04 -2.75 0.00 0.00 0.00 176.54 173.17 3d5q h PHE 193 N 0.36 -0.10 0.00 5.60 3.04 0.70 -3.05 116.94 123.48 3d5q h PHE 193 Ca 0.55 -0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.48 3d5q h PHE 193 Cb 1.07 0.03 -0.00 0.00 2.56 0.00 0.00 35.95 39.61 3d5q h PHE 193 CO -0.16 -0.06 -0.08 0.74 -2.02 0.00 0.00 178.31 176.72 3d5q h PHE 194 N -0.17 0.00 0.00 0.41 -1.00 0.88 0.40 116.94 117.47 3d5q h PHE 194 Ca -0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.77 3d5q h PHE 194 Cb 0.09 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.65 3d5q h PHE 194 CO 0.12 0.08 0.00 0.77 -1.61 0.00 0.00 178.31 177.67 3d5q h SER 195 N 0.00 0.00 0.17 2.17 0.02 -1.23 0.12 113.55 114.80 3d5q h SER 195 Ca -0.00 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.68 3d5q h SER 195 Cb 0.21 0.00 0.03 0.00 0.14 0.00 0.00 62.40 62.78 3d5q h SER 195 CO 0.01 0.00 -1.15 -1.28 -1.14 0.00 0.00 176.83 173.27 3d5q h SER 196 N 0.00 0.72 -0.06 3.07 0.87 -0.10 -3.11 113.55 114.93 3d5q h SER 196 Ca 0.00 -0.89 -0.17 0.00 -1.23 0.00 0.00 61.79 59.50 3d5q h SER 196 Cb 0.89 -0.23 0.01 0.00 -0.44 0.00 0.00 62.40 62.63 3d5q h SER 196 CO 0.00 1.55 -0.63 0.16 -0.53 0.00 0.00 176.83 177.39 3d5q h ILE 197 N 0.01 1.37 -0.72 2.23 3.07 -1.30 -2.76 117.51 119.40 3d5q h ILE 197 Ca -0.19 -1.97 0.11 0.00 1.55 0.00 0.00 64.86 64.36 3d5q h ILE 197 Cb 1.87 2.33 -0.11 0.00 -0.27 0.00 0.00 36.82 40.64 3d5q h ILE 197 CO 0.22 0.59 -0.29 -1.14 -1.05 0.00 0.00 178.15 176.48 3d5q n ARG 198 N -4.15 -0.18 0.18 0.16 0.63 0.43 0.32 116.66 114.05 3d5q n ARG 198 Ca -0.09 1.11 0.03 0.00 -0.92 0.00 0.00 57.85 57.97 3d5q n ARG 198 Cb 0.67 -1.64 0.35 0.00 0.45 0.00 0.00 32.46 32.29 3d5q n ARG 198 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 3d5q h LYS 199 N 0.00 0.00 -0.07 -0.14 1.57 -1.47 -1.37 116.57 115.10 3d5q h LYS 199 Ca 0.24 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.02 3d5q h LYS 199 Cb 0.42 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 3d5q h LYS 199 CO -0.71 0.39 0.02 0.93 -0.57 0.00 0.00 179.45 179.51 3d5q h GLU 200 N 0.00 0.10 -0.11 3.15 5.08 0.55 -2.15 114.58 121.21 3d5q h GLU 200 Ca -0.00 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.38 3d5q h GLU 200 Cb 0.72 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.89 3d5q h GLU 200 CO 0.05 0.25 -0.33 1.88 -1.00 0.00 0.00 179.01 179.86 3d5q h TYR 201 N -0.06 -0.92 -0.88 4.33 0.05 0.21 -1.90 116.97 117.81 3d5q h TYR 201 Ca 0.02 0.04 0.19 0.00 0.05 0.00 0.00 58.73 59.03 3d5q h TYR 201 Cb 0.19 0.42 -0.16 0.00 1.01 0.00 0.00 36.73 38.18 3d5q h TYR 201 CO -0.01 -0.41 -0.13 0.77 -1.05 0.00 0.00 178.16 177.33 3d5q h SER 202 N -0.42 -0.66 -0.56 3.88 0.02 -1.09 0.49 113.55 115.22 3d5q h SER 202 Ca 0.09 0.25 -0.30 0.00 -0.84 0.00 0.00 61.79 60.99 3d5q h SER 202 Cb 0.56 0.49 -0.17 0.00 0.14 0.00 0.00 62.40 63.42 3d5q h SER 202 CO -0.34 -0.28 0.38 1.33 -1.14 0.00 0.00 176.83 176.78 3d5q n VAL 203 N -5.51 2.30 -1.13 2.27 0.24 -0.77 -2.94 118.33 112.80 3d5q n VAL 203 Ca 0.15 -1.14 0.00 0.00 -2.04 0.00 0.00 64.34 61.31 3d5q n VAL 203 Cb 0.51 -0.76 0.00 0.00 -1.47 0.00 0.00 33.84 32.13 3d5q n VAL 203 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3d5q n SER 204 N -0.37 0.16 0.00 -1.34 7.64 0.16 -4.97 113.62 114.89 3d5q n SER 204 Ca 0.34 -1.28 0.00 0.00 1.01 0.00 0.00 58.87 58.93 3d5q n SER 204 Cb 1.11 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 64.27 3d5q n SER 204 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3d5q n ARG 205 N -0.05 0.00 -1.65 1.43 5.12 -0.60 -4.84 116.66 116.07 3d5q n ARG 205 Ca 0.00 0.00 -0.55 0.00 -1.93 0.00 0.00 57.85 55.38 3d5q n ARG 205 Cb 0.53 -2.36 -0.07 0.00 -1.16 0.00 0.00 32.46 29.40 3d5q n ARG 205 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 3d5q n VAL 206 N -0.62 0.14 -1.18 1.55 0.31 -1.07 -4.84 118.33 112.62 3d5q n VAL 206 Ca 0.00 -0.03 -0.25 0.00 -0.01 0.00 0.00 64.34 64.06 3d5q n VAL 206 Cb 0.00 -0.99 0.04 0.00 -0.91 0.00 0.00 33.84 31.97 3d5q n VAL 206 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 3d5q n ASN 207 N 3.83 6.89 -4.41 4.52 3.02 -1.26 -4.45 115.26 123.40 3d5q n ASN 207 Ca 0.22 -3.34 -0.35 0.00 -0.03 0.00 0.00 54.58 51.08 3d5q n ASN 207 Cb 0.16 -1.06 -0.13 0.00 -0.61 0.00 0.00 39.78 38.14 3d5q n ASN 207 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3d5q s VAL 208 N -3.18 3.83 0.14 2.41 1.01 -1.26 -4.10 120.40 119.25 3d5q s VAL 208 Ca 0.46 -0.35 -0.31 0.00 0.00 0.00 0.00 61.98 61.78 3d5q s VAL 208 Cb 0.35 -2.74 -0.09 0.00 0.00 0.00 0.00 36.38 33.91 3d5q s VAL 208 CO -0.07 0.42 1.42 -0.55 0.00 0.00 0.00 175.10 176.32 3d5q s SER 209 N 1.14 6.77 -0.23 3.32 0.15 -0.32 -4.91 113.70 119.63 3d5q s SER 209 Ca 0.03 2.41 -0.02 0.00 0.70 0.00 0.00 55.95 59.07 3d5q s SER 209 Cb -0.14 -2.59 0.02 0.00 -1.71 0.00 0.00 66.02 61.59 3d5q s SER 209 CO 0.01 -0.68 -0.08 -0.63 1.20 0.00 0.00 173.24 173.06 3d5q s ILE 210 N 0.93 2.82 -0.18 6.45 1.01 -1.26 0.55 121.20 131.52 3d5q s ILE 210 Ca 0.64 -0.93 0.01 0.00 0.00 0.00 0.00 60.65 60.38 3d5q s ILE 210 Cb -0.38 -2.37 0.03 0.00 0.01 0.00 0.00 42.46 39.74 3d5q s ILE 210 CO 0.32 0.29 -0.14 -0.89 0.00 0.00 0.00 174.94 174.52 3d5q s THR 211 N 1.34 1.74 -0.18 2.92 2.01 0.55 -4.41 115.64 119.62 3d5q s THR 211 Ca 0.02 -0.89 -0.07 0.00 0.31 0.00 0.00 61.69 61.06 3d5q s THR 211 Cb -0.16 -1.69 -0.04 0.00 0.01 0.00 0.00 72.50 70.62 3d5q s THR 211 CO -0.06 0.35 0.04 -0.22 -0.69 0.00 0.00 174.62 174.04 3d5q s LEU 212 N 1.39 3.66 -0.22 4.42 2.96 -1.08 0.14 118.68 129.95 3d5q s LEU 212 Ca 0.02 0.01 -0.03 0.00 -0.22 0.00 0.00 54.13 53.91 3d5q s LEU 212 Cb -0.14 -1.92 -0.00 0.00 0.50 0.00 0.00 46.19 44.62 3d5q s LEU 212 CO -0.10 0.16 -0.06 0.00 -1.32 0.00 0.00 176.35 175.03 3d5q s VAL 214 N 1.46 4.95 -0.14 0.00 1.01 0.79 -1.14 120.40 127.32 3d5q s VAL 214 Ca 0.06 0.44 0.02 0.00 0.00 0.00 0.00 61.98 62.49 3d5q s VAL 214 Cb -0.14 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.22 3d5q s VAL 214 CO -0.04 -0.27 -0.19 -0.76 0.00 0.00 0.00 175.10 173.83 3d5q s LEU 215 N 2.55 2.28 0.00 3.92 1.43 -1.23 -1.15 118.68 126.48 3d5q s LEU 215 Ca 0.21 -0.54 -0.06 0.00 -1.03 0.00 0.00 54.13 52.71 3d5q s LEU 215 Cb -0.15 -1.49 0.09 0.00 0.03 0.00 0.00 46.19 44.67 3d5q s LEU 215 CO 0.14 0.09 0.42 0.61 0.23 0.00 0.00 176.35 177.84 3d5q n GLY 216 N 3.99 -1.92 3.45 -3.19 0.00 -0.57 -2.33 105.19 104.62 3d5q n GLY 216 Ca -0.19 -1.57 -0.62 0.00 0.00 0.00 0.00 46.02 43.63 3d5q n GLY 216 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3d5q n LEU 217 N 0.00 1.00 -4.36 0.99 7.94 -1.26 -4.90 117.00 116.42 3d5q n LEU 217 Ca 0.05 1.10 -0.30 0.00 -1.11 0.00 0.00 56.01 55.75 3d5q n LEU 217 Cb 0.20 -0.82 -0.14 0.00 0.53 0.00 0.00 43.42 43.19 3d5q n LEU 217 CO 0.14 -0.88 -0.56 -0.63 -1.11 0.00 0.00 177.39 174.35 3d5q s ILE 218 N 2.49 2.22 -2.00 1.96 -1.09 -1.26 -2.43 121.20 121.08 3d5q s ILE 218 Ca 0.96 -1.37 0.02 0.00 -2.23 0.00 0.00 60.65 58.04 3d5q s ILE 218 Cb -1.37 -1.87 0.07 0.00 -1.58 0.00 0.00 42.46 37.71 3d5q s ILE 218 CO 0.73 0.36 0.56 -0.90 -1.23 0.00 0.00 174.94 174.47 3d5q n ASP 219 N 1.75 0.00 -4.38 3.58 5.75 -0.33 -4.65 116.55 118.27 3d5q n ASP 219 Ca -0.17 -0.75 -0.37 0.00 -0.01 0.00 0.00 54.79 53.49 3d5q n ASP 219 Cb 0.52 0.00 0.06 0.00 -1.03 0.00 0.00 41.12 40.67 3d5q n ASP 219 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 3d5q n THR 220 N -0.59 1.23 -0.01 2.12 -2.24 -1.26 -4.53 114.28 109.01 3d5q n THR 220 Ca 0.02 -0.42 -0.12 0.00 -2.27 0.00 0.00 64.05 61.25 3d5q n THR 220 Cb 0.01 -0.53 -0.08 0.00 -2.10 0.00 0.00 70.33 67.63 3d5q n THR 220 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 3d5q h GLU 221 N -0.40 -0.46 -0.27 -0.78 4.81 -1.98 -0.28 114.58 115.22 3d5q h GLU 221 Ca -0.44 0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 58.78 3d5q h GLU 221 Cb 1.36 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.83 3d5q h GLU 221 CO 0.40 -0.31 0.00 1.15 -0.73 0.00 0.00 179.01 179.53 3d5q h THR 222 N -0.48 1.16 -0.17 0.32 2.02 -1.98 -2.64 112.91 111.15 3d5q h THR 222 Ca 0.03 -0.64 -0.21 0.00 0.77 0.00 0.00 66.41 66.36 3d5q h THR 222 Cb 0.56 0.96 0.01 0.00 -1.74 0.00 0.00 68.15 67.94 3d5q h THR 222 CO -0.36 0.22 -0.70 0.00 0.37 0.00 0.00 175.52 175.05 3d5q h ALA 223 N 1.62 0.32 0.00 6.16 0.00 -1.81 -3.18 119.26 122.36 3d5q h ALA 223 Ca 0.09 -0.57 -0.10 0.00 0.00 0.00 0.00 54.91 54.33 3d5q h ALA 223 Cb 0.26 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3d5q h ALA 223 CO 0.01 0.63 -0.46 0.52 0.00 0.00 0.00 179.25 179.95 3d5q h MET 224 N 0.50 0.00 0.27 0.00 2.07 -0.93 -3.23 114.93 113.61 3d5q h MET 224 Ca -0.04 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.60 3d5q h MET 224 Cb 1.33 0.00 -0.04 0.00 -1.87 0.00 0.00 31.60 31.02 3d5q h MET 224 CO 0.15 0.46 -0.49 -0.22 1.07 0.00 0.00 176.91 177.88 3d5q h LYS 225 N 0.00 -0.79 -2.47 1.72 3.11 -1.44 -3.21 116.57 113.48 3d5q h LYS 225 Ca -0.00 0.05 -0.77 0.00 -2.81 0.00 0.00 60.65 57.12 3d5q h LYS 225 Cb 0.82 0.18 -0.30 0.00 -1.00 0.00 0.00 32.23 31.93 3d5q h LYS 225 CO 0.06 -0.53 0.61 0.00 -2.81 0.00 0.00 179.45 176.78 3d5q n ALA 226 N -2.85 5.44 -0.41 5.00 0.00 -1.22 -4.05 120.51 122.42 3d5q n ALA 226 Ca -0.10 -4.70 0.00 0.00 0.00 0.00 0.00 53.44 48.64 3d5q n ALA 226 Cb 0.42 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.91 3d5q n ALA 226 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3d5q n VAL 227 N 0.46 0.00 -0.78 0.00 0.24 -1.21 -4.68 118.33 112.35 3d5q n VAL 227 Ca 0.37 -0.09 -0.20 0.00 -2.04 0.00 0.00 64.34 62.37 3d5q n VAL 227 Cb 0.31 1.41 -0.06 0.00 -1.47 0.00 0.00 33.84 34.04 3d5q n VAL 227 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3d5q n SER 228 N -0.09 -0.08 0.00 -1.34 3.41 -1.26 -5.15 113.62 109.11 3d5q n SER 228 Ca 0.00 -1.45 0.00 0.00 -0.26 0.00 0.00 58.87 57.16 3d5q n SER 228 Cb 0.10 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 63.79 3d5q n SER 228 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3d5q n MET 233 N 5.62 0.15 -2.21 4.33 2.81 -1.26 -5.23 117.12 121.33 3d5q n MET 233 Ca 0.22 0.00 -0.43 0.00 -1.81 0.00 0.00 57.70 55.68 3d5q n MET 233 Cb 0.33 0.00 -0.02 0.00 -0.71 0.00 0.00 33.22 32.82 3d5q n MET 233 CO 0.00 0.00 0.00 -1.14 1.51 0.00 0.00 175.97 176.34 3d5q s GLN 234 N 4.23 4.06 -0.41 0.03 2.00 -1.26 -4.97 119.66 123.35 3d5q s GLN 234 Ca 0.00 1.78 -0.14 0.00 -2.00 0.00 0.00 55.36 54.99 3d5q s GLN 234 Cb 0.00 -3.92 0.03 0.00 0.80 0.00 0.00 33.01 29.92 3d5q s GLN 234 CO 0.00 -0.95 0.30 0.00 -0.50 0.00 0.00 175.29 174.14 3d5q s ALA 235 N 4.22 3.46 0.14 1.58 0.00 -1.26 -4.61 121.76 125.29 3d5q s ALA 235 Ca 0.65 -1.77 -0.30 0.00 0.00 0.00 0.00 51.96 50.54 3d5q s ALA 235 Cb -0.26 -2.87 -0.06 0.00 0.00 0.00 0.00 23.12 19.93 3d5q s ALA 235 CO 0.24 -1.48 1.00 0.00 0.00 0.00 0.00 175.76 175.52 3d5q s ALA 236 N 1.66 3.28 0.26 0.00 0.00 -1.02 -4.70 121.76 121.24 3d5q s ALA 236 Ca 0.04 0.64 -0.29 0.00 0.00 0.00 0.00 51.96 52.35 3d5q s ALA 236 Cb -0.20 -3.30 -0.09 0.00 0.00 0.00 0.00 23.12 19.53 3d5q s ALA 236 CO 0.09 -0.06 1.19 -1.25 0.00 0.00 0.00 175.76 175.73 3d5q s PRO 237 N -0.15 4.51 0.37 0.00 0.04 -1.26 -1.19 135.00 137.33 3d5q s PRO 237 Ca 0.47 1.94 0.17 0.00 0.04 0.00 0.00 61.00 63.62 3d5q s PRO 237 Cb -0.25 -3.17 1.07 0.00 0.04 0.00 0.00 34.50 32.19 3d5q s PRO 237 CO 0.31 -0.00 1.74 1.57 0.04 0.00 0.00 177.00 180.66 3d5q h LYS 238 N 4.22 0.40 0.21 4.56 2.10 -1.94 -3.17 116.57 122.95 3d5q h LYS 238 Ca -0.46 -0.02 -0.01 0.00 -2.00 0.00 0.00 60.65 58.15 3d5q h LYS 238 Cb 1.22 -0.09 -0.00 0.00 -0.90 0.00 0.00 32.23 32.45 3d5q h LYS 238 CO 0.69 0.27 -0.14 0.93 -2.00 0.00 0.00 179.45 179.20 3d5q h GLU 239 N 0.41 -0.32 -0.09 0.07 3.07 -1.97 -1.67 114.58 114.09 3d5q h GLU 239 Ca 0.64 0.02 0.03 0.00 -0.50 0.00 0.00 59.36 59.55 3d5q h GLU 239 Cb 1.54 0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 29.52 3d5q h GLU 239 CO -0.38 -0.21 0.07 0.93 -1.40 0.00 0.00 179.01 178.02 3d5q h GLU 240 N -0.33 0.00 0.51 2.33 5.08 -1.98 -2.13 114.58 118.06 3d5q h GLU 240 Ca -0.03 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 3d5q h GLU 240 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 3d5q h GLU 240 CO 0.02 0.00 -0.24 0.00 -1.00 0.00 0.00 179.01 177.79 3d5q h ALA 242 N -0.52 0.49 -0.46 0.00 0.00 -0.92 0.44 119.26 118.28 3d5q h ALA 242 Ca -0.07 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.85 3d5q h ALA 242 Cb 0.60 -0.15 -0.10 0.00 0.00 0.00 0.00 17.79 18.14 3d5q h ALA 242 CO 0.11 -0.00 -0.43 1.25 0.00 0.00 0.00 179.25 180.18 3d5q h LEU 243 N 0.49 -1.44 -0.69 0.00 5.85 -1.37 -0.31 115.31 117.83 3d5q h LEU 243 Ca 0.14 0.23 0.10 0.00 0.84 0.00 0.00 57.88 59.18 3d5q h LEU 243 Cb 0.03 0.64 -0.08 0.00 0.37 0.00 0.00 40.66 41.63 3d5q h LEU 243 CO -0.02 -0.36 0.31 -0.33 -0.34 0.00 0.00 178.44 177.71 3d5q h GLU 244 N -0.29 0.51 0.01 1.25 4.39 0.17 0.19 114.58 120.81 3d5q h GLU 244 Ca 0.15 -0.03 0.03 0.00 0.34 0.00 0.00 59.36 59.85 3d5q h GLU 244 Cb 0.58 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 29.07 3d5q h GLU 244 CO -0.61 0.34 -0.20 0.82 -1.16 0.00 0.00 179.01 178.19 3d5q h ILE 245 N 0.53 0.52 0.27 3.13 2.04 0.95 -1.90 117.51 123.05 3d5q h ILE 245 Ca 0.35 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.20 3d5q h ILE 245 Cb 0.42 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.02 3d5q h ILE 245 CO -0.30 0.00 -0.13 0.40 0.00 0.00 0.00 178.15 178.12 3d5q h ILE 246 N -0.33 0.74 -0.72 -0.67 2.04 0.53 -0.94 117.51 118.16 3d5q h ILE 246 Ca 0.06 -0.08 0.07 0.00 1.00 0.00 0.00 64.86 65.91 3d5q h ILE 246 Cb 0.40 0.79 -0.10 0.00 -0.74 0.00 0.00 36.82 37.18 3d5q h ILE 246 CO -0.18 0.02 -0.51 0.11 0.00 0.00 0.00 178.15 177.59 3d5q h LYS 247 N -0.41 -0.10 -0.71 2.37 1.57 -0.58 0.15 116.57 118.87 3d5q h LYS 247 Ca -0.04 0.01 0.12 0.00 -1.87 0.00 0.00 60.65 58.87 3d5q h LYS 247 Cb 0.31 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.56 3d5q h LYS 247 CO 0.06 -0.07 0.29 0.78 -0.57 0.00 0.00 179.45 179.94 3d5q h GLY 248 N -0.11 1.04 0.97 3.86 0.00 -1.02 0.90 103.07 108.72 3d5q h GLY 248 Ca 0.12 -0.15 -0.00 0.00 0.00 0.00 0.00 47.33 47.29 3d5q h GLY 248 CO -0.73 -0.05 0.21 -1.33 0.00 0.00 0.00 176.54 174.63 3d5q h GLY 249 N 0.46 0.53 0.51 4.60 0.00 0.55 0.28 103.07 110.00 3d5q h GLY 249 Ca 0.37 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.46 3d5q h GLY 249 CO -0.36 0.22 -0.03 0.00 0.00 0.00 0.00 176.54 176.38 3d5q h ALA 250 N 1.08 0.03 0.00 3.60 0.00 -0.13 -2.87 119.26 120.96 3d5q h ALA 250 Ca 0.13 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3d5q h ALA 250 Cb 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3d5q h ALA 250 CO -0.02 -0.18 0.02 1.28 0.00 0.00 0.00 179.25 180.36 3d5q n LEU 251 N -4.78 0.00 -2.47 0.00 4.77 0.31 -4.78 117.00 110.05 3d5q n LEU 251 Ca -0.08 0.11 -0.19 0.00 -0.03 0.00 0.00 56.01 55.82 3d5q n LEU 251 Cb 0.29 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.26 3d5q n LEU 251 CO 0.35 -0.11 -0.22 0.54 -1.33 0.00 0.00 177.39 176.61 3d5q n ARG 252 N -1.05 -2.06 -2.46 3.23 1.74 -0.42 -2.77 116.66 112.88 3d5q n ARG 252 Ca 0.00 0.90 -0.40 0.00 -0.77 0.00 0.00 57.85 57.57 3d5q n ARG 252 Cb 0.02 -5.56 -0.04 0.00 -1.02 0.00 0.00 32.46 25.86 3d5q n ARG 252 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3d5q s GLN 253 N -5.10 4.61 0.19 5.56 -0.21 -0.05 -3.54 119.66 121.13 3d5q s GLN 253 Ca 0.03 1.82 -0.12 0.00 0.02 0.00 0.00 55.36 57.10 3d5q s GLN 253 Cb -0.01 -3.20 0.18 0.00 1.00 0.00 0.00 33.01 30.98 3d5q s GLN 253 CO 0.03 0.16 1.78 0.93 -2.12 0.00 0.00 175.29 176.07 3d5q h GLU 254 N 4.07 0.48 -4.22 2.91 5.08 -1.90 -3.38 114.58 117.62 3d5q h GLU 254 Ca -0.46 -0.03 -0.19 0.00 -1.00 0.00 0.00 59.36 57.68 3d5q h GLU 254 Cb 1.21 -0.11 -0.12 0.00 0.50 0.00 0.00 28.75 30.23 3d5q h GLU 254 CO 0.68 0.32 -0.40 -1.21 -1.00 0.00 0.00 179.01 177.40 3d5q s GLU 255 N -6.12 1.41 -0.26 2.33 2.02 -1.26 -2.63 118.70 114.19 3d5q s GLU 255 Ca -0.13 -1.52 -0.01 0.00 0.02 0.00 0.00 54.97 53.33 3d5q s GLU 255 Cb 0.15 0.36 0.15 0.00 0.10 0.00 0.00 34.13 34.89 3d5q s GLU 255 CO 0.74 -0.52 0.43 0.08 0.02 0.00 0.00 175.26 176.01 3d5q s VAL 256 N -3.99 -0.69 0.42 2.63 1.01 -0.51 -4.90 120.40 114.36 3d5q s VAL 256 Ca 0.32 -0.09 -0.02 0.00 0.00 0.00 0.00 61.98 62.19 3d5q s VAL 256 Cb 0.03 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.50 3d5q s VAL 256 CO 0.12 -0.12 0.67 -0.31 0.00 0.00 0.00 175.10 175.46 3d5q s TYR 257 N 2.61 3.53 -0.30 5.22 1.51 -1.26 -0.15 117.35 128.51 3d5q s TYR 257 Ca 0.14 0.59 -0.12 0.00 -1.01 0.00 0.00 57.07 56.67 3d5q s TYR 257 Cb -0.15 -2.11 0.18 0.00 -0.11 0.00 0.00 41.96 39.78 3d5q s TYR 257 CO -0.19 -0.09 1.06 -0.47 -1.11 0.00 0.00 175.55 174.75 3d5q s TYR 258 N -2.54 -0.43 0.12 2.71 6.14 -0.30 -4.88 117.35 118.17 3d5q s TYR 258 Ca 0.44 0.24 0.05 0.00 0.64 0.00 0.00 57.07 58.44 3d5q s TYR 258 Cb -0.10 0.07 -0.04 0.00 0.42 0.00 0.00 41.96 42.32 3d5q s TYR 258 CO 0.41 -0.25 -0.11 0.34 0.64 0.00 0.00 175.55 176.57 3d5q s ASP 259 N 2.91 1.72 0.00 4.32 3.68 -1.26 -1.51 116.67 126.52 3d5q s ASP 259 Ca 0.28 -0.87 0.00 0.00 2.13 0.00 0.00 52.55 54.08 3d5q s ASP 259 Cb -0.01 -0.02 0.00 0.00 -1.45 0.00 0.00 42.92 41.44 3d5q s ASP 259 CO -0.22 -0.25 0.79 -1.54 0.13 0.00 0.00 175.17 174.08 3d5q n SER 260 N 0.32 0.00 -4.04 -0.34 3.41 -1.26 -4.36 113.62 107.35 3d5q n SER 260 Ca -0.14 0.30 -0.31 0.00 -0.26 0.00 0.00 58.87 58.45 3d5q n SER 260 Cb 0.58 -0.30 -0.15 0.00 -0.26 0.00 0.00 64.21 64.08 3d5q n SER 260 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3d5q s SER 261 N -2.58 4.49 0.23 4.04 0.15 -1.26 -4.96 113.70 113.81 3d5q s SER 261 Ca 0.00 -1.63 -0.08 0.00 0.70 0.00 0.00 55.95 54.94 3d5q s SER 261 Cb 0.00 -1.53 0.20 0.00 -1.71 0.00 0.00 66.02 62.98 3d5q s SER 261 CO 0.00 -0.26 1.90 -0.07 1.20 0.00 0.00 173.24 176.01 3d5q h LEU 262 N 7.74 0.97 -0.55 3.45 3.38 -2.01 -2.38 115.31 125.91 3d5q h LEU 262 Ca -0.14 -0.02 0.11 0.00 0.09 0.00 0.00 57.88 57.92 3d5q h LEU 262 Cb 1.04 -0.24 -0.10 0.00 0.09 0.00 0.00 40.66 41.45 3d5q h LEU 262 CO 0.48 0.70 -0.07 -0.50 0.09 0.00 0.00 178.44 179.14 3d5q h TRP 263 N 1.14 -0.16 -0.08 1.13 4.06 -1.96 -2.08 115.95 118.01 3d5q h TRP 263 Ca 0.32 0.04 -0.07 0.00 2.06 0.00 0.00 58.89 61.24 3d5q h TRP 263 Cb -0.12 0.16 0.00 0.00 -1.00 0.00 0.00 29.16 28.20 3d5q h TRP 263 CO -0.01 -0.19 -0.22 1.79 -3.56 0.00 0.00 178.44 176.25 3d5q h THR 264 N 0.06 1.42 -1.13 1.49 1.35 -1.96 -3.37 112.91 110.76 3d5q h THR 264 Ca 0.27 -1.58 0.36 0.00 -0.55 0.00 0.00 66.41 64.91 3d5q h THR 264 Cb 0.43 2.24 -0.13 0.00 -1.73 0.00 0.00 68.15 68.95 3d5q h THR 264 CO -0.51 0.45 0.70 0.71 -0.25 0.00 0.00 175.52 176.61 3d5q h THR 265 N -0.19 0.26 0.00 6.82 1.35 -0.84 -1.04 112.91 119.27 3d5q h THR 265 Ca -0.01 -0.08 -0.19 0.00 -0.55 0.00 0.00 66.41 65.59 3d5q h THR 265 Cb 0.84 0.01 -0.03 0.00 -1.73 0.00 0.00 68.15 67.24 3d5q h THR 265 CO 0.05 0.04 -0.96 0.25 -0.25 0.00 0.00 175.52 174.65 3d5q h LEU 266 N 0.23 0.00 0.00 3.87 6.46 -1.73 -3.13 115.31 121.02 3d5q h LEU 266 Ca 0.74 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 58.50 3d5q h LEU 266 Cb 2.02 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.95 3d5q h LEU 266 CO -0.48 0.84 -0.41 0.17 -0.62 0.00 0.00 178.44 177.94 3d5q h LEU 267 N 0.00 0.00 -0.44 2.25 8.10 -1.48 -3.22 115.31 120.52 3d5q h LEU 267 Ca -0.05 -0.05 0.00 0.00 0.11 0.00 0.00 57.88 57.89 3d5q h LEU 267 Cb 1.68 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.90 3d5q h LEU 267 CO 0.10 0.03 0.00 2.30 -4.11 0.00 0.00 178.44 176.76 3d5q n ILE 268 N -2.59 0.75 -0.57 0.15 -6.64 -0.51 -4.36 119.36 105.59 3d5q n ILE 268 Ca 0.03 0.10 -0.29 0.00 -1.77 0.00 0.00 62.75 60.82 3d5q n ILE 268 Cb 0.49 -0.98 0.26 0.00 -1.44 0.00 0.00 39.64 37.97 3d5q n ILE 268 CO 0.00 0.00 0.00 -0.60 -1.77 0.00 0.00 176.55 174.18 3d5q s ARG 269 N -3.22 -1.29 -0.43 6.28 3.52 -1.19 -5.03 118.95 117.59 3d5q s ARG 269 Ca 0.06 0.64 0.05 0.00 -0.13 0.00 0.00 55.73 56.35 3d5q s ARG 269 Cb 0.10 -1.53 0.19 0.00 -1.56 0.00 0.00 34.95 32.16 3d5q s ARG 269 CO 0.43 -3.91 0.46 -1.71 -0.81 0.00 0.00 175.30 169.76 3d5q n ASN 270 N -5.02 -0.92 -0.22 -2.12 4.05 -1.26 -4.98 115.26 104.78 3d5q n ASN 270 Ca 0.04 -2.56 -0.06 0.00 0.45 0.00 0.00 54.58 52.45 3d5q n ASN 270 Cb 0.56 -0.11 0.04 0.00 1.23 0.00 0.00 39.78 41.49 3d5q n ASN 270 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 177.26 173.56 3d5q h PRO 271 N 5.14 0.87 -0.56 1.20 0.11 -1.94 -1.51 132.00 135.31 3d5q h PRO 271 Ca 0.18 -0.10 0.09 0.00 0.11 0.00 0.00 66.00 66.28 3d5q h PRO 271 Cb 0.94 -0.17 -0.09 0.00 0.11 0.00 0.00 31.00 31.79 3d5q h PRO 271 CO 0.33 0.66 -0.20 0.43 -0.21 0.00 0.00 178.00 179.01 3d5q n SER 272 N -4.56 -0.33 0.05 -2.05 7.64 -1.26 -1.76 113.62 111.36 3d5q n SER 272 Ca 0.04 0.97 -0.20 0.00 1.01 0.00 0.00 58.87 60.69 3d5q n SER 272 Cb 0.09 -0.24 -0.14 0.00 -1.01 0.00 0.00 64.21 62.91 3d5q n SER 272 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 3d5q h ARG 273 N 0.00 0.40 -0.54 1.43 2.43 -1.71 -3.28 114.38 113.11 3d5q h ARG 273 Ca 0.21 -0.58 0.16 0.00 -0.81 0.00 0.00 59.98 58.96 3d5q h ARG 273 Cb 0.35 0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 3d5q h ARG 273 CO -0.56 1.24 0.55 0.87 -1.51 0.00 0.00 179.97 180.57 3d5q h LYS 274 N -0.17 0.00 0.00 0.20 1.57 -1.21 -2.81 116.57 114.15 3d5q h LYS 274 Ca -0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 3d5q h LYS 274 Cb 1.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.95 3d5q h LYS 274 CO 0.17 0.00 0.00 -0.89 -0.57 0.00 0.00 179.45 178.16 3d5q n ILE 275 N -3.72 0.00 -0.11 1.86 2.08 -1.16 -3.00 119.36 115.31 3d5q n ILE 275 Ca 0.10 0.38 0.07 0.00 0.56 0.00 0.00 62.75 63.86 3d5q n ILE 275 Cb 0.76 -0.94 0.13 0.00 -0.75 0.00 0.00 39.64 38.83 3d5q n ILE 275 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3d5q n LEU 276 N -0.16 0.01 0.12 1.39 -0.00 -1.16 0.17 117.00 117.36 3d5q n LEU 276 Ca 0.00 0.57 -0.05 0.00 -0.00 0.00 0.00 56.01 56.53 3d5q n LEU 276 Cb 0.00 -0.23 -0.02 0.00 -0.00 0.00 0.00 43.42 43.17 3d5q n LEU 276 CO 0.00 -0.60 0.47 -0.33 -0.00 0.00 0.00 177.39 176.93 3d5q h GLU 277 N 0.00 -0.30 -0.92 1.47 5.08 -1.65 0.49 114.58 118.75 3d5q h GLU 277 Ca 0.23 0.02 0.25 0.00 -1.00 0.00 0.00 59.36 58.86 3d5q h GLU 277 Cb 0.52 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.79 3d5q h GLU 277 CO -0.30 -0.20 0.64 0.35 -1.00 0.00 0.00 179.01 178.50 3d5q h PHE 278 N -0.33 0.23 0.69 4.33 3.57 -0.60 0.18 116.94 125.01 3d5q h PHE 278 Ca -0.03 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 3d5q h PHE 278 Cb 0.24 -0.07 0.01 0.00 2.79 0.00 0.00 35.95 38.91 3d5q h PHE 278 CO 0.16 0.05 -0.33 -0.07 -2.23 0.00 0.00 178.31 175.88 3d5q h LEU 279 N 0.16 -0.79 -0.93 0.59 3.38 0.19 -3.29 115.31 114.63 3d5q h LEU 279 Ca 0.46 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.42 3d5q h LEU 279 Cb 1.55 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 42.47 3d5q h LEU 279 CO -0.09 -0.47 0.28 1.88 0.09 0.00 0.00 178.44 180.13 3d5q h TYR 280 N -1.12 1.07 0.00 1.13 -1.99 0.66 -3.49 116.97 113.22 3d5q h TYR 280 Ca -0.10 -0.07 0.00 0.00 2.00 0.00 0.00 58.73 60.56 3d5q h TYR 280 Cb 0.72 -0.32 0.00 0.00 2.00 0.00 0.00 36.73 39.12 3d5q h TYR 280 CO 0.02 0.82 0.00 -1.13 -0.00 0.00 0.00 178.16 177.87