#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bqd n PHE 6 N 0.00 0.49 -0.22 2.03 3.72 -1.26 -4.71 117.46 117.51 1bqd n PHE 6 Ca 0.00 -0.44 -0.05 0.00 -0.05 0.00 0.00 57.45 56.91 1bqd n PHE 6 Cb 0.00 -0.02 0.06 0.00 -0.94 0.00 0.00 39.48 38.58 1bqd n PHE 6 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1bqd h GLU 7 N 2.41 0.79 -0.57 -1.08 3.07 -2.12 -3.15 114.58 113.92 1bqd h GLU 7 Ca 0.00 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1bqd h GLU 7 Cb 0.75 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.48 1bqd h GLU 7 CO 0.00 0.52 0.00 -1.71 -1.40 0.00 0.00 179.01 176.42 1bqd n ASN 8 N -4.68 5.37 -4.68 1.42 4.05 -1.26 -4.97 115.26 110.50 1bqd n ASN 8 Ca 0.06 -2.83 -0.42 0.00 0.45 0.00 0.00 54.58 51.84 1bqd n ASN 8 Cb 0.06 -0.65 -0.03 0.00 1.23 0.00 0.00 39.78 40.39 1bqd n ASN 8 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1bqd s ILE 9 N -2.56 4.06 0.21 -1.44 1.01 -1.20 -5.00 121.20 116.30 1bqd s ILE 9 Ca 0.53 1.39 -0.27 0.00 0.00 0.00 0.00 60.65 62.29 1bqd s ILE 9 Cb 0.39 -3.89 -0.09 0.00 0.01 0.00 0.00 42.46 38.88 1bqd s ILE 9 CO 0.17 -0.02 0.86 0.42 0.00 0.00 0.00 174.94 176.37 1bqd s THR 10 N 2.53 4.23 0.28 2.92 -4.23 -1.26 -5.00 115.64 115.10 1bqd s THR 10 Ca 0.59 1.87 -0.30 0.00 -1.18 0.00 0.00 61.69 62.67 1bqd s THR 10 Cb -0.27 -4.20 -0.11 0.00 1.34 0.00 0.00 72.50 69.26 1bqd s THR 10 CO 0.23 0.47 1.50 0.00 -0.54 0.00 0.00 174.62 176.28 1bqd s ALA 11 N -1.22 3.67 0.36 3.99 0.00 -1.26 -4.95 121.76 122.36 1bqd s ALA 11 Ca 0.40 1.44 -0.27 0.00 0.00 0.00 0.00 51.96 53.52 1bqd s ALA 11 Cb -0.24 -3.60 -0.10 0.00 0.00 0.00 0.00 23.12 19.19 1bqd s ALA 11 CO 0.28 -0.86 1.28 0.00 0.00 0.00 0.00 175.76 176.47 1bqd s ALA 12 N -0.09 3.38 1.38 0.00 0.00 -1.26 -4.99 121.76 120.17 1bqd s ALA 12 Ca 0.60 1.21 -0.23 0.00 0.00 0.00 0.00 51.96 53.54 1bqd s ALA 12 Cb -0.45 -3.47 0.35 0.00 0.00 0.00 0.00 23.12 19.56 1bqd s ALA 12 CO 0.46 -0.68 0.99 -1.25 0.00 0.00 0.00 175.76 175.28 1bqd s PRO 13 N -1.99 -2.62 0.73 0.00 0.04 -1.26 -5.02 135.00 124.89 1bqd s PRO 13 Ca 0.52 -0.02 -0.05 0.00 0.04 0.00 0.00 61.00 61.50 1bqd s PRO 13 Cb -0.38 -1.43 0.11 0.00 0.04 0.00 0.00 34.50 32.84 1bqd s PRO 13 CO 0.50 -4.64 1.03 0.00 0.04 0.00 0.00 177.00 173.92 1bqd s ALA 14 N -2.52 3.34 -0.54 8.56 0.00 -1.26 -5.06 121.76 124.29 1bqd s ALA 14 Ca 0.70 -1.38 0.04 0.00 0.00 0.00 0.00 51.96 51.32 1bqd s ALA 14 Cb -0.10 -2.30 0.16 0.00 0.00 0.00 0.00 23.12 20.88 1bqd s ALA 14 CO 0.57 -1.49 0.37 0.34 0.00 0.00 0.00 175.76 175.55 1bqd s ASP 15 N -4.66 3.45 0.14 0.00 -1.08 -1.26 -5.02 116.67 108.23 1bqd s ASP 15 Ca 0.65 -3.27 0.03 0.00 -0.52 0.00 0.00 52.55 49.44 1bqd s ASP 15 Cb -0.07 -1.11 0.40 0.00 -1.46 0.00 0.00 42.92 40.68 1bqd s ASP 15 CO 0.45 -0.16 0.66 -2.65 0.52 0.00 0.00 175.17 173.99 1bqd n PRO 16 N 2.68 -0.03 -0.16 4.34 -0.02 -1.26 0.11 135.00 140.66 1bqd n PRO 16 Ca 0.20 0.62 -0.03 0.00 -2.02 0.00 0.00 63.50 62.26 1bqd n PRO 16 Cb 0.39 -1.02 0.06 0.00 -0.02 0.00 0.00 33.50 32.91 1bqd n PRO 16 CO 0.00 0.00 0.00 -0.84 1.98 0.00 0.00 175.50 176.64 1bqd h ILE 17 N 0.00 0.81 0.00 4.25 3.07 -1.95 4.24 117.51 127.92 1bqd h ILE 17 Ca 0.29 -0.11 -0.07 0.00 1.55 0.00 0.00 64.86 66.52 1bqd h ILE 17 Cb 0.66 0.46 -0.01 0.00 -0.27 0.00 0.00 36.82 37.66 1bqd h ILE 17 CO -0.37 0.06 -0.31 -0.07 -1.05 0.00 0.00 178.15 176.40 1bqd h LEU 18 N 0.32 0.00 -0.00 0.16 4.07 0.36 0.66 115.31 120.87 1bqd h LEU 18 Ca 0.24 0.00 -0.26 0.00 0.08 0.00 0.00 57.88 57.94 1bqd h LEU 18 Cb 0.27 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.02 1bqd h LEU 18 CO -0.26 0.31 -1.12 1.23 -1.08 0.00 0.00 178.44 177.52 1bqd h GLY 19 N 2.01 0.46 0.87 0.83 0.00 0.27 -2.91 103.07 104.60 1bqd h GLY 19 Ca -0.00 -0.95 -0.04 0.00 0.00 0.00 0.00 47.33 46.33 1bqd h GLY 19 CO 0.04 0.84 0.00 -2.00 0.00 0.00 0.00 176.54 175.42 1bqd h LEU 20 N 0.18 0.48 -0.07 3.11 6.46 0.85 -2.43 115.31 123.90 1bqd h LEU 20 Ca -0.13 -0.31 0.03 0.00 -0.12 0.00 0.00 57.88 57.36 1bqd h LEU 20 Cb 1.80 -0.13 -0.04 0.00 -0.73 0.00 0.00 40.66 41.56 1bqd h LEU 20 CO 0.20 0.67 -0.16 0.00 -0.62 0.00 0.00 178.44 178.52 1bqd h ALA 21 N 0.83 -0.14 -0.99 1.25 0.00 -0.92 0.54 119.26 119.83 1bqd h ALA 21 Ca 0.08 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.09 1bqd h ALA 21 Cb 0.42 0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.45 1bqd h ALA 21 CO 0.01 -0.64 0.64 -0.44 0.00 0.00 0.00 179.25 178.82 1bqd h ASP 22 N -0.24 1.00 -0.44 0.00 3.32 -1.48 0.12 116.42 118.70 1bqd h ASP 22 Ca 0.07 0.01 -0.14 0.00 0.02 0.00 0.00 57.03 57.00 1bqd h ASP 22 Cb 0.34 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 1bqd h ASP 22 CO -0.21 0.62 -0.27 0.25 -1.72 0.00 0.00 179.24 177.92 1bqd h LEU 23 N 1.12 1.00 0.03 1.55 6.46 -0.84 -2.46 115.31 122.18 1bqd h LEU 23 Ca 0.43 -0.42 0.01 0.00 -0.12 0.00 0.00 57.88 57.78 1bqd h LEU 23 Cb 0.22 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 39.87 1bqd h LEU 23 CO -0.18 1.20 -0.05 0.15 -0.62 0.00 0.00 178.44 178.94 1bqd h PHE 24 N 0.80 -0.13 0.10 1.25 3.57 0.16 -3.08 116.94 119.61 1bqd h PHE 24 Ca 0.09 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.61 1bqd h PHE 24 Cb 0.86 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 39.61 1bqd h PHE 24 CO 0.06 -0.08 -0.27 -0.09 -2.23 0.00 0.00 178.31 175.69 1bqd h ARG 25 N -0.11 -0.46 -0.08 1.11 2.43 -0.79 -2.24 114.38 114.25 1bqd h ARG 25 Ca 0.01 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1bqd h ARG 25 Cb 0.12 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 1bqd h ARG 25 CO -0.03 -0.31 0.00 0.00 -1.51 0.00 0.00 179.97 178.12 1bqd n ALA 26 N -2.64 1.56 -2.49 2.80 0.00 -0.93 -4.66 120.51 114.15 1bqd n ALA 26 Ca -0.06 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.95 1bqd n ALA 26 Cb 0.30 -1.00 -0.09 0.00 0.00 0.00 0.00 19.45 18.66 1bqd n ALA 26 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1bqd s ASP 27 N -1.41 6.20 0.00 0.00 -1.08 -0.84 -4.94 116.67 114.60 1bqd s ASP 27 Ca 0.00 -0.65 0.15 0.00 -0.52 0.00 0.00 52.55 51.53 1bqd s ASP 27 Cb 0.00 -2.23 0.79 0.00 -1.46 0.00 0.00 42.92 40.02 1bqd s ASP 27 CO 0.00 -0.59 1.41 -0.62 0.52 0.00 0.00 175.17 175.89 1bqd n GLU 28 N 5.64 0.25 -1.47 4.34 1.02 -1.26 -4.85 120.64 124.31 1bqd n GLU 28 Ca -0.07 0.12 -0.34 0.00 -0.02 0.00 0.00 57.16 56.85 1bqd n GLU 28 Cb 0.47 -1.50 0.09 0.00 -0.02 0.00 0.00 31.44 30.48 1bqd n GLU 28 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1bqd s ARG 29 N -2.50 2.21 -0.12 3.49 3.00 -1.26 -5.01 118.95 118.77 1bqd s ARG 29 Ca 0.16 1.74 -0.07 0.00 0.00 0.00 0.00 55.73 57.56 1bqd s ARG 29 Cb 0.10 -1.84 -0.05 0.00 0.00 0.00 0.00 34.95 33.16 1bqd s ARG 29 CO 0.22 -1.77 0.05 -1.35 0.00 0.00 0.00 175.30 172.44 1bqd h PRO 30 N -0.23 0.00 -0.97 3.54 0.11 -1.99 -3.38 132.00 129.07 1bqd h PRO 30 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1bqd h PRO 30 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1bqd h PRO 30 CO 0.50 0.16 0.00 0.41 -0.21 0.00 0.00 178.00 178.86 1bqd n GLY 31 N 1.70 1.53 3.54 -0.55 0.00 -1.26 -4.94 105.19 105.21 1bqd n GLY 31 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 1bqd n GLY 31 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1bqd n LYS 32 N 0.12 0.78 -3.70 1.61 2.85 -1.26 -4.86 118.16 113.69 1bqd n LYS 32 Ca 0.00 0.30 -0.15 0.00 -1.05 0.00 0.00 58.31 57.40 1bqd n LYS 32 Cb 0.29 -1.91 -0.15 0.00 -0.65 0.00 0.00 35.03 32.61 1bqd n LYS 32 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1bqd s ILE 33 N -1.56 -0.17 -0.39 0.58 1.01 -0.86 -5.01 121.20 114.80 1bqd s ILE 33 Ca 0.70 0.28 -0.10 0.00 0.00 0.00 0.00 60.65 61.53 1bqd s ILE 33 Cb -0.46 -0.27 0.05 0.00 0.01 0.00 0.00 42.46 41.79 1bqd s ILE 33 CO 0.52 0.12 0.22 0.21 0.00 0.00 0.00 174.94 176.01 1bqd s ASN 34 N 1.79 5.65 0.00 3.58 3.84 -1.26 0.09 114.94 128.63 1bqd s ASN 34 Ca -0.02 -1.24 0.23 0.00 0.21 0.00 0.00 52.86 52.04 1bqd s ASN 34 Cb -0.12 -1.99 0.51 0.00 -0.55 0.00 0.00 41.25 39.10 1bqd s ASN 34 CO -0.06 -0.45 1.45 0.18 -2.79 0.00 0.00 177.10 175.43 1bqd n LEU 35 N 4.95 3.67 -0.82 3.21 4.77 0.14 -4.25 117.00 128.67 1bqd n LEU 35 Ca -0.11 -1.68 0.10 0.00 -0.03 0.00 0.00 56.01 54.29 1bqd n LEU 35 Cb 0.44 -0.34 0.28 0.00 -2.33 0.00 0.00 43.42 41.48 1bqd n LEU 35 CO 0.37 0.84 0.72 0.61 -1.33 0.00 0.00 177.39 178.60 1bqd n GLY 36 N 1.57 0.97 3.78 -0.72 0.00 -1.16 -1.31 105.19 108.32 1bqd n GLY 36 Ca 0.21 -0.53 -0.32 0.00 0.00 0.00 0.00 46.02 45.38 1bqd n GLY 36 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1bqd s ILE 37 N -1.58 3.39 -0.67 -0.61 -0.00 -1.26 -4.93 121.20 115.54 1bqd s ILE 37 Ca 0.34 0.59 0.10 0.00 -0.00 0.00 0.00 60.65 61.68 1bqd s ILE 37 Cb 0.19 -3.12 0.29 0.00 -0.00 0.00 0.00 42.46 39.82 1bqd s ILE 37 CO 0.26 -0.46 1.23 0.61 -0.00 0.00 0.00 174.94 176.59 1bqd n GLY 38 N -0.83 3.02 3.43 6.27 0.00 -1.26 -4.73 105.19 111.09 1bqd n GLY 38 Ca 0.10 -0.42 -0.21 0.00 0.00 0.00 0.00 46.02 45.48 1bqd n GLY 38 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1bqd s VAL 39 N -1.28 1.49 0.42 1.61 -7.23 -1.26 -5.13 120.40 109.02 1bqd s VAL 39 Ca 0.22 -2.08 -0.23 0.00 -1.81 0.00 0.00 61.98 58.08 1bqd s VAL 39 Cb 0.13 -2.53 -0.09 0.00 0.56 0.00 0.00 36.38 34.45 1bqd s VAL 39 CO 0.12 -0.23 1.06 -0.47 -0.31 0.00 0.00 175.10 175.27 1bqd s TYR 40 N -3.11 3.19 0.02 2.82 6.14 -1.26 -4.85 117.35 120.31 1bqd s TYR 40 Ca 0.31 1.62 0.00 0.00 0.64 0.00 0.00 57.07 59.65 1bqd s TYR 40 Cb 0.05 -3.13 -0.02 0.00 0.42 0.00 0.00 41.96 39.28 1bqd s TYR 40 CO 0.12 -0.72 -0.03 0.15 0.64 0.00 0.00 175.55 175.71 1bqd s LYS 41 N -2.64 0.31 0.68 4.97 1.02 -1.26 -4.48 119.74 118.35 1bqd s LYS 41 Ca 0.60 -0.55 0.02 0.00 0.02 0.00 0.00 55.97 56.05 1bqd s LYS 41 Cb -0.21 0.02 0.12 0.00 -0.52 0.00 0.00 37.83 37.23 1bqd s LYS 41 CO 0.27 -0.03 0.94 0.16 -0.92 0.00 0.00 175.35 175.77 1bqd s ASP 42 N -1.28 4.54 0.57 2.83 1.47 0.31 -4.83 116.67 120.28 1bqd s ASP 42 Ca -0.13 -0.47 0.26 0.00 1.18 0.00 0.00 52.55 53.39 1bqd s ASP 42 Cb -0.09 0.03 1.41 0.00 -0.34 0.00 0.00 42.92 43.93 1bqd s ASP 42 CO -0.01 -1.72 1.77 1.05 0.68 0.00 0.00 175.17 176.94 1bqd h GLU 43 N -0.35 0.00 -0.03 2.11 9.09 -1.91 0.77 114.58 124.27 1bqd h GLU 43 Ca -0.35 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.06 1bqd h GLU 43 Cb 1.27 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.37 1bqd h GLU 43 CO 0.41 0.00 -0.06 0.25 0.05 0.00 0.00 179.01 179.66 1bqd n THR 44 N -2.67 0.00 -1.49 -1.06 -2.24 -1.26 -4.88 114.28 100.68 1bqd n THR 44 Ca -0.02 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 1bqd n THR 44 Cb 0.35 1.33 0.00 0.00 -2.10 0.00 0.00 70.33 69.91 1bqd n THR 44 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bqd n GLY 45 N 1.34 0.50 3.36 3.38 0.00 0.27 -5.06 105.19 108.97 1bqd n GLY 45 Ca 0.14 -0.86 -0.19 0.00 0.00 0.00 0.00 46.02 45.10 1bqd n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bqd s LYS 46 N -3.05 1.38 -0.75 1.61 -2.85 -1.25 -4.78 119.74 110.05 1bqd s LYS 46 Ca 0.00 -1.62 -0.01 0.00 -1.00 0.00 0.00 55.97 53.34 1bqd s LYS 46 Cb 0.00 -1.18 0.19 0.00 -2.06 0.00 0.00 37.83 34.77 1bqd s LYS 46 CO 0.00 0.19 0.58 0.99 0.10 0.00 0.00 175.35 177.21 1bqd s THR 47 N -2.93 3.84 0.80 3.79 2.01 -1.26 -0.53 115.64 121.35 1bqd s THR 47 Ca 0.24 -3.54 -0.12 0.00 0.31 0.00 0.00 61.69 58.58 1bqd s THR 47 Cb -0.01 -3.45 0.07 0.00 0.01 0.00 0.00 72.50 69.12 1bqd s THR 47 CO 0.08 -0.98 1.12 -2.16 -0.69 0.00 0.00 174.62 171.99 1bqd s PRO 48 N -0.80 2.09 -0.11 4.92 0.05 -1.26 -5.04 135.00 134.85 1bqd s PRO 48 Ca 0.22 0.41 -0.21 0.00 0.05 0.00 0.00 61.00 61.47 1bqd s PRO 48 Cb -0.13 -1.94 -0.04 0.00 0.05 0.00 0.00 34.50 32.45 1bqd s PRO 48 CO -0.09 -1.57 0.61 0.08 0.05 0.00 0.00 177.00 176.09 1bqd s VAL 49 N -3.33 5.09 0.64 -0.36 1.01 -1.26 -4.95 120.40 117.24 1bqd s VAL 49 Ca 0.61 1.24 -0.18 0.00 0.00 0.00 0.00 61.98 63.64 1bqd s VAL 49 Cb -0.13 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 1bqd s VAL 49 CO 0.52 0.25 1.30 -0.76 0.00 0.00 0.00 175.10 176.41 1bqd s LEU 50 N 0.92 3.60 0.14 3.92 1.02 -1.26 -4.86 118.68 122.16 1bqd s LEU 50 Ca 0.32 2.62 -0.14 0.00 0.02 0.00 0.00 54.13 56.96 1bqd s LEU 50 Cb -0.16 -4.59 0.02 0.00 0.02 0.00 0.00 46.19 41.47 1bqd s LEU 50 CO 0.14 -1.95 1.64 0.74 0.02 0.00 0.00 176.35 176.94 1bqd h THR 51 N 0.63 1.24 -0.67 5.49 2.02 -1.96 -1.67 112.91 118.00 1bqd h THR 51 Ca -0.51 -0.87 0.03 0.00 0.77 0.00 0.00 66.41 65.83 1bqd h THR 51 Cb 1.33 0.90 -0.04 0.00 -1.74 0.00 0.00 68.15 68.60 1bqd h THR 51 CO 0.54 0.31 0.45 0.77 0.37 0.00 0.00 175.52 177.95 1bqd h SER 52 N 0.65 0.71 -0.09 4.18 4.64 -1.91 -1.36 113.55 120.38 1bqd h SER 52 Ca 0.15 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.44 1bqd h SER 52 Cb 0.35 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1bqd h SER 52 CO 0.00 0.50 -0.02 0.58 -0.87 0.00 0.00 176.83 177.02 1bqd h VAL 53 N 0.83 1.29 -0.81 0.95 2.07 -1.82 -1.42 116.25 117.34 1bqd h VAL 53 Ca 0.26 -0.92 0.04 0.00 0.82 0.00 0.00 66.70 66.90 1bqd h VAL 53 Cb 0.03 1.73 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 1bqd h VAL 53 CO -0.07 0.26 0.53 0.50 0.02 0.00 0.00 177.57 178.81 1bqd h LYS 54 N -0.16 0.96 -0.45 1.57 1.63 -0.95 0.70 116.57 119.86 1bqd h LYS 54 Ca 0.02 -0.06 -0.08 0.00 -0.85 0.00 0.00 60.65 59.69 1bqd h LYS 54 Cb 0.42 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 31.81 1bqd h LYS 54 CO 0.01 0.63 -0.02 0.87 -3.45 0.00 0.00 179.45 177.49 1bqd h LYS 55 N 0.99 0.82 -0.50 1.90 1.57 -1.11 -1.95 116.57 118.27 1bqd h LYS 55 Ca 0.32 -0.27 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 1bqd h LYS 55 Cb 0.05 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 1bqd h LYS 55 CO -0.10 0.88 -0.01 0.00 -0.57 0.00 0.00 179.45 179.65 1bqd h ALA 56 N 0.90 1.03 -0.23 3.86 0.00 -0.23 -2.34 119.26 122.24 1bqd h ALA 56 Ca 0.13 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 1bqd h ALA 56 Cb 0.53 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1bqd h ALA 56 CO 0.03 0.60 -0.14 0.93 0.00 0.00 0.00 179.25 180.67 1bqd h GLU 57 N 0.79 0.39 -0.24 0.00 5.08 -0.69 -1.53 114.58 118.38 1bqd h GLU 57 Ca 0.15 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1bqd h GLU 57 Cb 0.49 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1bqd h GLU 57 CO 0.02 0.53 0.05 0.37 -1.00 0.00 0.00 179.01 178.99 1bqd h GLN 58 N 0.37 0.40 -0.73 2.33 5.75 -0.99 -1.65 115.11 120.58 1bqd h GLN 58 Ca 0.07 -0.10 0.05 0.00 -0.15 0.00 0.00 58.65 58.52 1bqd h GLN 58 Cb 0.47 -0.05 -0.05 0.00 1.07 0.00 0.00 27.48 28.92 1bqd h GLN 58 CO 0.03 0.51 0.44 -0.92 -2.65 0.00 0.00 178.83 176.24 1bqd h TYR 59 N 0.22 0.82 -0.39 3.99 3.20 -0.97 -2.30 116.97 121.54 1bqd h TYR 59 Ca 0.08 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.83 1bqd h TYR 59 Cb 0.30 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 1bqd h TYR 59 CO 0.02 0.43 -0.33 -0.07 -1.64 0.00 0.00 178.16 176.57 1bqd h LEU 60 N 0.83 0.93 -0.92 2.82 3.38 -1.10 -0.73 115.31 120.52 1bqd h LEU 60 Ca 0.31 -0.40 0.03 0.00 0.09 0.00 0.00 57.88 57.92 1bqd h LEU 60 Cb 0.11 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.55 1bqd h LEU 60 CO -0.15 1.17 0.60 0.25 0.09 0.00 0.00 178.44 180.40 1bqd h LEU 61 N 0.74 1.00 0.00 1.67 5.85 -0.96 0.20 115.31 123.81 1bqd h LEU 61 Ca 0.07 -0.01 -0.20 0.00 0.84 0.00 0.00 57.88 58.58 1bqd h LEU 61 Cb 0.90 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 1bqd h LEU 61 CO 0.08 0.69 -0.98 -0.33 -0.34 0.00 0.00 178.44 177.57 1bqd h GLU 62 N 1.17 0.00 0.00 1.25 5.08 -1.28 -3.38 114.58 117.42 1bqd h GLU 62 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 1bqd h GLU 62 Cb -0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1bqd h GLU 62 CO -0.12 0.94 -1.59 0.09 -1.00 0.00 0.00 179.01 177.34 1bqd n ASN 63 N -3.33 0.94 -4.72 1.42 3.02 -0.29 -4.98 115.26 107.31 1bqd n ASN 63 Ca -0.00 -0.20 -0.42 0.00 -0.03 0.00 0.00 54.58 53.93 1bqd n ASN 63 Cb 0.92 1.63 -0.03 0.00 -0.61 0.00 0.00 39.78 41.69 1bqd n ASN 63 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1bqd s GLU 64 N -3.09 4.26 0.00 3.52 2.02 0.67 -4.90 118.70 121.19 1bqd s GLU 64 Ca -0.04 2.26 0.02 0.00 0.02 0.00 0.00 54.97 57.23 1bqd s GLU 64 Cb 0.12 -3.17 -0.00 0.00 0.10 0.00 0.00 34.13 31.18 1bqd s GLU 64 CO 0.72 -0.50 0.31 0.25 0.02 0.00 0.00 175.26 176.06 1bqd n THR 66 N 3.51 0.00 -3.46 3.63 -2.24 -1.26 -5.00 114.28 109.46 1bqd n THR 66 Ca 0.11 -0.48 -0.12 0.00 -2.27 0.00 0.00 64.05 61.29 1bqd n THR 66 Cb 0.40 1.02 -0.03 0.00 -2.10 0.00 0.00 70.33 69.62 1bqd n THR 66 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1bqd s THR 67 N -0.65 0.00 -0.16 4.28 -1.32 -1.26 -5.03 115.64 111.50 1bqd s THR 67 Ca 0.01 0.00 0.14 0.00 -1.21 0.00 0.00 61.69 60.63 1bqd s THR 67 Cb 0.01 -1.00 0.38 0.00 -1.51 0.00 0.00 72.50 70.39 1bqd s THR 67 CO 0.04 0.00 1.19 0.29 -2.21 0.00 0.00 174.62 173.94 1bqd n LYS 68 N -0.07 1.30 -1.80 7.08 5.02 -1.26 -5.06 118.16 123.36 1bqd n LYS 68 Ca -0.16 -2.95 -0.40 0.00 -2.02 0.00 0.00 58.31 52.78 1bqd n LYS 68 Cb 0.63 -1.37 0.02 0.00 -0.02 0.00 0.00 35.03 34.28 1bqd n LYS 68 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1bqd s ASN 69 N -2.96 5.90 0.31 4.39 2.47 -1.26 -4.89 114.94 118.90 1bqd s ASN 69 Ca 0.35 2.92 -0.25 0.00 0.42 0.00 0.00 52.86 56.31 1bqd s ASN 69 Cb 0.34 -2.65 -0.16 0.00 -1.45 0.00 0.00 41.25 37.33 1bqd s ASN 69 CO -0.06 -1.16 0.35 -1.22 -3.72 0.00 0.00 177.10 171.29 1bqd n TYR 70 N -0.16 -1.12 -2.52 0.43 4.01 -1.26 -4.98 117.16 111.56 1bqd n TYR 70 Ca 0.05 0.78 -0.24 0.00 -0.16 0.00 0.00 57.90 58.33 1bqd n TYR 70 Cb 0.42 -1.89 0.04 0.00 -0.31 0.00 0.00 39.34 37.59 1bqd n TYR 70 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1bqd s LEU 71 N 3.38 3.21 1.00 7.72 1.43 -1.26 -5.06 118.68 129.10 1bqd s LEU 71 Ca 0.62 0.39 -0.12 0.00 -1.03 0.00 0.00 54.13 53.98 1bqd s LEU 71 Cb -0.77 -3.19 0.19 0.00 0.03 0.00 0.00 46.19 42.45 1bqd s LEU 71 CO 0.59 -1.15 1.08 -0.83 0.23 0.00 0.00 176.35 176.27 1bqd s GLY 72 N -4.37 1.59 0.29 -3.19 0.00 -1.26 -4.83 107.32 95.55 1bqd s GLY 72 Ca 0.55 -0.14 0.01 0.00 0.00 0.00 0.00 44.72 45.14 1bqd s GLY 72 CO 0.42 0.44 1.86 -2.22 0.00 0.00 0.00 173.10 173.60 1bqd h ILE 73 N -1.94 0.97 -0.00 0.90 2.04 -1.97 -0.34 117.51 117.16 1bqd h ILE 73 Ca -0.54 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 64.97 1bqd h ILE 73 Cb 1.31 -0.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.25 1bqd h ILE 73 CO 0.54 0.19 -0.06 -0.90 0.00 0.00 0.00 178.15 177.91 1bqd n ASP 74 N -4.57 0.22 0.00 1.72 5.75 -1.26 -4.42 116.55 113.99 1bqd n ASP 74 Ca 0.17 -0.33 0.00 0.00 -0.01 0.00 0.00 54.79 54.62 1bqd n ASP 74 Cb 0.31 -0.18 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 1bqd n ASP 74 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1bqd n GLY 75 N 1.29 -1.62 3.67 6.12 0.00 -0.14 -0.43 105.19 114.08 1bqd n GLY 75 Ca 0.14 -1.53 -0.42 0.00 0.00 0.00 0.00 46.02 44.21 1bqd n GLY 75 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bqd s ILE 76 N 0.00 3.36 0.24 -0.61 1.01 -1.26 -4.36 121.20 119.58 1bqd s ILE 76 Ca 0.00 0.54 -0.05 0.00 0.00 0.00 0.00 60.65 61.13 1bqd s ILE 76 Cb 0.00 -3.35 0.20 0.00 0.01 0.00 0.00 42.46 39.33 1bqd s ILE 76 CO 0.00 -0.04 1.83 -0.65 0.00 0.00 0.00 174.94 176.08 1bqd h PRO 77 N 9.45 0.83 -0.06 2.79 0.11 -1.98 -1.82 132.00 141.31 1bqd h PRO 77 Ca -0.42 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 1bqd h PRO 77 Cb 1.19 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 1bqd h PRO 77 CO 0.95 0.55 -0.37 0.93 -0.21 0.00 0.00 178.00 179.84 1bqd h GLU 78 N 0.86 0.12 -0.92 1.05 3.07 -2.00 -1.93 114.58 114.83 1bqd h GLU 78 Ca 0.37 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.17 1bqd h GLU 78 Cb 0.25 -0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.11 1bqd h GLU 78 CO -0.20 0.49 0.52 0.35 -1.40 0.00 0.00 179.01 178.77 1bqd h PHE 79 N 0.11 1.24 0.31 4.33 3.57 -1.68 -1.16 116.94 123.65 1bqd h PHE 79 Ca 0.01 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 1bqd h PHE 79 Cb 0.71 -0.40 0.00 0.00 2.79 0.00 0.00 35.95 39.06 1bqd h PHE 79 CO 0.01 0.84 -0.15 0.78 -2.23 0.00 0.00 178.31 177.56 1bqd h GLY 80 N 1.28 -0.43 1.55 2.40 0.00 -0.98 -1.37 103.07 105.51 1bqd h GLY 80 Ca 0.33 0.16 -0.04 0.00 0.00 0.00 0.00 47.33 47.77 1bqd h GLY 80 CO -0.06 -0.16 0.05 0.07 0.00 0.00 0.00 176.54 176.44 1bqd h ARG 81 N -0.65 0.57 -0.36 4.80 0.11 -1.31 -1.18 114.38 116.37 1bqd h ARG 81 Ca -0.04 -0.11 -0.13 0.00 0.10 0.00 0.00 59.98 59.80 1bqd h ARG 81 Cb 0.46 -0.09 -0.01 0.00 1.11 0.00 0.00 29.97 31.44 1bqd h ARG 81 CO 0.07 0.56 -0.31 0.00 0.10 0.00 0.00 179.97 180.39 1bqd h THR 83 N 0.65 1.27 -0.71 0.00 2.02 -0.75 -2.38 112.91 113.01 1bqd h THR 83 Ca 0.07 -1.13 -0.05 0.00 0.77 0.00 0.00 66.41 66.08 1bqd h THR 83 Cb 0.84 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 68.34 1bqd h THR 83 CO 0.07 0.38 0.24 1.56 0.37 0.00 0.00 175.52 178.15 1bqd h GLN 84 N 0.64 1.08 -0.66 6.66 4.20 -1.13 -1.53 115.11 124.37 1bqd h GLN 84 Ca 0.12 -0.21 -0.07 0.00 0.06 0.00 0.00 58.65 58.54 1bqd h GLN 84 Cb 0.57 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.15 1bqd h GLN 84 CO 0.03 0.90 0.12 0.93 -0.67 0.00 0.00 178.83 180.14 1bqd h GLU 85 N 1.04 1.07 -0.43 1.46 5.08 -1.33 0.11 114.58 121.59 1bqd h GLU 85 Ca 0.23 -0.27 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 1bqd h GLU 85 Cb 0.26 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1bqd h GLU 85 CO -0.01 0.98 -0.03 1.25 -1.00 0.00 0.00 179.01 180.20 1bqd h LEU 86 N 1.01 0.69 0.07 1.33 5.85 -1.05 0.56 115.31 123.77 1bqd h LEU 86 Ca 0.20 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 1bqd h LEU 86 Cb 0.41 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.26 1bqd h LEU 86 CO 0.01 0.78 -0.03 -0.07 -0.34 0.00 0.00 178.44 178.78 1bqd h LEU 87 N 0.67 -0.08 -0.75 2.25 4.07 -0.93 -3.39 115.31 117.15 1bqd h LEU 87 Ca 0.13 -0.14 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1bqd h LEU 87 Cb 0.46 0.02 0.00 0.00 1.08 0.00 0.00 40.66 42.22 1bqd h LEU 87 CO 0.02 0.48 -0.34 0.49 -1.08 0.00 0.00 178.44 178.00 1bqd n PHE 88 N -4.82 0.00 -0.29 1.13 3.72 0.35 -4.74 117.46 112.81 1bqd n PHE 88 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 1bqd n PHE 88 Cb 0.11 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 38.58 1bqd n PHE 88 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bqd n GLY 89 N 1.37 -3.22 3.76 1.37 0.00 0.20 -4.53 105.19 104.14 1bqd n GLY 89 Ca 0.11 -1.12 -0.38 0.00 0.00 0.00 0.00 46.02 44.64 1bqd n GLY 89 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bqd s LYS 90 N -5.28 3.58 0.00 1.61 2.20 -1.23 -2.41 119.74 118.22 1bqd s LYS 90 Ca 0.00 2.02 0.00 0.00 -0.36 0.00 0.00 55.97 57.63 1bqd s LYS 90 Cb 0.00 -2.43 0.00 0.00 -1.51 0.00 0.00 37.83 33.89 1bqd s LYS 90 CO 0.00 -0.77 0.00 0.41 -0.36 0.00 0.00 175.35 174.63 1bqd n GLY 91 N 0.59 0.73 3.76 5.54 0.00 -1.26 -5.01 105.19 109.54 1bqd n GLY 91 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1bqd n GLY 91 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1bqd s SER 92 N -2.42 6.71 0.42 1.61 0.15 -1.01 -4.88 113.70 114.27 1bqd s SER 92 Ca 0.00 2.67 0.09 0.00 0.70 0.00 0.00 55.95 59.41 1bqd s SER 92 Cb 0.00 -2.63 0.92 0.00 -1.71 0.00 0.00 66.02 62.59 1bqd s SER 92 CO 0.00 -0.63 2.06 0.00 1.20 0.00 0.00 173.24 175.88 1bqd h ALA 93 N 4.31 1.77 -1.00 5.45 0.00 -1.92 -0.97 119.26 126.91 1bqd h ALA 93 Ca -0.47 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.50 1bqd h ALA 93 Cb 1.22 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.80 1bqd h ALA 93 CO 0.72 0.21 0.64 -0.07 0.00 0.00 0.00 179.25 180.75 1bqd h LEU 94 N 0.49 0.99 0.16 0.00 4.07 -1.96 0.42 115.31 119.47 1bqd h LEU 94 Ca 0.15 0.02 -0.01 0.00 0.08 0.00 0.00 57.88 58.12 1bqd h LEU 94 Cb -0.00 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.56 1bqd h LEU 94 CO -0.03 0.59 -0.08 0.40 -1.08 0.00 0.00 178.44 178.24 1bqd h ILE 95 N 1.10 0.79 -0.06 1.22 2.04 -1.58 -0.90 117.51 120.11 1bqd h ILE 95 Ca 0.46 -1.15 0.00 0.00 1.00 0.00 0.00 64.86 65.17 1bqd h ILE 95 Cb 0.30 1.34 -0.00 0.00 -0.74 0.00 0.00 36.82 37.72 1bqd h ILE 95 CO -0.21 0.21 0.04 0.78 0.00 0.00 0.00 178.15 178.97 1bqd h ASN 96 N -0.90 0.06 0.10 1.72 2.35 -1.12 0.10 115.58 117.89 1bqd h ASN 96 Ca -0.02 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1bqd h ASN 96 Cb 0.51 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.87 1bqd h ASN 96 CO 0.04 0.04 -0.03 0.47 -1.65 0.00 0.00 177.43 176.30 1bqd n ASP 97 N -4.53 0.57 -3.83 5.81 8.00 0.15 -4.92 116.55 117.80 1bqd n ASP 97 Ca -0.02 -1.03 -0.24 0.00 0.71 0.00 0.00 54.79 54.21 1bqd n ASP 97 Cb 0.09 -0.02 0.01 0.00 -0.02 0.00 0.00 41.12 41.18 1bqd n ASP 97 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1bqd n LYS 98 N -0.64 -4.39 0.00 -1.24 5.02 0.36 -4.39 118.16 112.88 1bqd n LYS 98 Ca 0.20 0.54 0.11 0.00 -2.02 0.00 0.00 58.31 57.14 1bqd n LYS 98 Cb 0.23 -4.99 0.06 0.00 -0.02 0.00 0.00 35.03 30.30 1bqd n LYS 98 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1bqd n ARG 99 N -4.36 1.37 -4.80 1.97 1.74 -0.37 -3.78 116.66 108.42 1bqd n ARG 99 Ca -0.25 -1.11 -0.25 0.00 -0.77 0.00 0.00 57.85 55.47 1bqd n ARG 99 Cb 0.66 -1.48 -0.15 0.00 -1.02 0.00 0.00 32.46 30.47 1bqd n ARG 99 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1bqd s ALA 100 N -2.39 1.54 -0.05 7.54 0.00 -1.25 -1.87 121.76 125.27 1bqd s ALA 100 Ca 0.21 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 51.36 1bqd s ALA 100 Cb 0.19 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.94 1bqd s ALA 100 CO 0.52 0.37 -0.15 1.03 0.00 0.00 0.00 175.76 177.53 1bqd s ARG 101 N -0.62 1.67 -0.04 0.00 1.81 -0.80 -4.99 118.95 115.99 1bqd s ARG 101 Ca 0.07 -0.52 0.06 0.00 -1.72 0.00 0.00 55.73 53.62 1bqd s ARG 101 Cb -0.07 -1.43 -0.02 0.00 -0.45 0.00 0.00 34.95 32.97 1bqd s ARG 101 CO -0.00 0.16 -0.21 0.99 -0.68 0.00 0.00 175.30 175.56 1bqd s THR 102 N 0.24 2.45 -0.11 0.02 2.01 -1.26 -1.36 115.64 117.62 1bqd s THR 102 Ca -0.07 -0.95 0.03 0.00 0.31 0.00 0.00 61.69 61.02 1bqd s THR 102 Cb -0.12 -1.91 0.00 0.00 0.01 0.00 0.00 72.50 70.48 1bqd s THR 102 CO 0.03 0.58 -0.23 0.00 -0.69 0.00 0.00 174.62 174.30 1bqd s ALA 103 N -0.55 2.20 0.09 7.40 0.00 -0.53 -4.90 121.76 125.47 1bqd s ALA 103 Ca 0.08 -1.01 -0.31 0.00 0.00 0.00 0.00 51.96 50.72 1bqd s ALA 103 Cb -0.11 -0.88 -0.07 0.00 0.00 0.00 0.00 23.12 22.07 1bqd s ALA 103 CO 0.00 0.18 1.25 -1.14 0.00 0.00 0.00 175.76 176.05 1bqd s GLN 104 N 0.51 4.41 0.21 0.00 0.74 0.43 -1.10 119.66 124.87 1bqd s GLN 104 Ca -0.15 1.86 0.03 0.00 0.05 0.00 0.00 55.36 57.16 1bqd s GLN 104 Cb -0.17 -3.31 -0.05 0.00 1.10 0.00 0.00 33.01 30.58 1bqd s GLN 104 CO 0.05 -0.28 -0.01 0.95 -0.55 0.00 0.00 175.29 175.45 1bqd s THR 105 N 0.91 0.99 -1.13 -0.34 -4.23 -0.44 -4.66 115.64 106.74 1bqd s THR 105 Ca 0.59 -2.03 -0.20 0.00 -1.18 0.00 0.00 61.69 58.87 1bqd s THR 105 Cb -0.32 -2.26 -0.06 0.00 1.34 0.00 0.00 72.50 71.21 1bqd s THR 105 CO 0.30 -0.39 1.94 -0.81 -0.54 0.00 0.00 174.62 175.12 1bqd n PRO 106 N -0.37 2.12 0.00 3.99 -0.04 -1.26 -2.13 135.00 137.31 1bqd n PRO 106 Ca -0.06 -2.47 0.00 0.00 -0.04 0.00 0.00 63.50 60.93 1bqd n PRO 106 Cb 0.63 -3.36 0.00 0.00 -0.04 0.00 0.00 33.50 30.73 1bqd n PRO 106 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1bqd n GLY 107 N 5.04 -1.10 0.19 0.55 0.00 -1.10 -3.19 105.19 105.57 1bqd n GLY 107 Ca 0.48 -1.61 -0.11 0.00 0.00 0.00 0.00 46.02 44.79 1bqd n GLY 107 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1bqd h GLY 108 N 0.00 0.63 0.60 -0.02 0.00 -1.78 -2.20 103.07 100.29 1bqd h GLY 108 Ca 0.00 -0.44 0.06 0.00 0.00 0.00 0.00 47.33 46.94 1bqd h GLY 108 CO 0.00 0.41 0.17 -0.84 0.00 0.00 0.00 176.54 176.28 1bqd h THR 109 N 0.40 0.87 -0.85 4.70 2.02 -1.92 -0.82 112.91 117.30 1bqd h THR 109 Ca 0.10 -0.12 0.08 0.00 0.77 0.00 0.00 66.41 67.23 1bqd h THR 109 Cb 0.41 0.48 -0.07 0.00 -1.74 0.00 0.00 68.15 67.23 1bqd h THR 109 CO 0.01 0.06 0.52 1.23 0.37 0.00 0.00 175.52 177.72 1bqd h GLY 110 N 0.35 1.31 0.99 2.16 0.00 -1.48 0.08 103.07 106.48 1bqd h GLY 110 Ca 0.22 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 47.17 1bqd h GLY 110 CO -0.21 0.21 0.33 0.00 0.00 0.00 0.00 176.54 176.88 1bqd h ALA 111 N 1.43 0.76 0.00 3.60 0.00 -0.61 -0.70 119.26 123.75 1bqd h ALA 111 Ca 0.39 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 1bqd h ALA 111 Cb 0.25 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1bqd h ALA 111 CO -0.20 0.27 -0.00 -0.07 0.00 0.00 0.00 179.25 179.25 1bqd h LEU 112 N 0.81 -0.00 -0.71 0.00 4.07 -0.18 -1.35 115.31 117.94 1bqd h LEU 112 Ca 0.21 -0.01 0.06 0.00 0.08 0.00 0.00 57.88 58.22 1bqd h LEU 112 Cb 0.03 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 41.72 1bqd h LEU 112 CO -0.03 0.01 0.41 -0.09 -1.08 0.00 0.00 178.44 177.66 1bqd h ARG 113 N -0.02 0.74 -0.37 1.13 9.65 -0.76 -0.89 114.38 123.86 1bqd h ARG 113 Ca -0.00 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 58.81 1bqd h ARG 113 Cb 0.01 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.41 1bqd h ARG 113 CO 0.00 0.49 0.14 0.28 2.80 0.00 0.00 179.97 183.68 1bqd h VAL 114 N 0.76 1.20 -0.57 0.20 2.07 -0.86 -1.11 116.25 117.94 1bqd h VAL 114 Ca 0.31 -0.62 0.02 0.00 0.82 0.00 0.00 66.70 67.23 1bqd h VAL 114 Cb 0.17 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 1bqd h VAL 114 CO -0.17 0.22 0.36 0.00 0.02 0.00 0.00 177.57 178.00 1bqd h ALA 115 N 0.98 0.73 0.22 1.67 0.00 -0.89 -0.65 119.26 121.33 1bqd h ALA 115 Ca 0.12 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1bqd h ALA 115 Cb 0.21 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1bqd h ALA 115 CO -0.01 0.12 -0.26 0.00 0.00 0.00 0.00 179.25 179.10 1bqd h ALA 116 N 1.23 -0.52 -1.00 0.00 0.00 -0.85 0.18 119.26 118.30 1bqd h ALA 116 Ca 0.22 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.11 1bqd h ALA 116 Cb -0.03 0.39 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 1bqd h ALA 116 CO -0.07 -0.83 0.65 -0.44 0.00 0.00 0.00 179.25 178.56 1bqd h ASP 117 N -0.53 1.06 0.36 0.00 3.32 -0.99 0.18 116.42 119.82 1bqd h ASP 117 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1bqd h ASP 117 Cb 0.51 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1bqd h ASP 117 CO -0.09 0.70 -0.17 0.15 -1.72 0.00 0.00 179.24 178.11 1bqd h PHE 118 N 1.22 -0.45 -0.24 4.55 3.57 -0.67 -2.29 116.94 122.63 1bqd h PHE 118 Ca 0.42 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.93 1bqd h PHE 118 Cb 0.09 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.96 1bqd h PHE 118 CO -0.00 -0.23 0.10 -0.07 -2.23 0.00 0.00 178.31 175.88 1bqd h LEU 119 N -0.56 0.14 -1.07 0.59 3.38 -0.21 -0.16 115.31 117.41 1bqd h LEU 119 Ca -0.05 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.04 1bqd h LEU 119 Cb 0.42 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.09 1bqd h LEU 119 CO 0.08 0.11 0.62 0.00 0.09 0.00 0.00 178.44 179.34 1bqd h ALA 120 N 1.13 1.53 0.00 1.53 0.00 -0.60 -2.05 119.26 120.82 1bqd h ALA 120 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1bqd h ALA 120 Cb 0.05 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1bqd h ALA 120 CO -0.09 0.26 -1.62 1.63 0.00 0.00 0.00 179.25 179.44 1bqd n LYS 121 N -4.56 0.55 0.00 0.00 4.76 -0.87 -4.58 118.16 113.46 1bqd n LYS 121 Ca 0.17 -0.10 0.04 0.00 -2.87 0.00 0.00 58.31 55.54 1bqd n LYS 121 Cb 0.30 -1.58 -0.01 0.00 -1.84 0.00 0.00 35.03 31.90 1bqd n LYS 121 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1bqd n ASN 122 N -2.23 0.95 -3.63 4.39 3.02 -0.09 -5.05 115.26 112.61 1bqd n ASN 122 Ca -0.02 -0.97 -0.23 0.00 -0.03 0.00 0.00 54.58 53.33 1bqd n ASN 122 Cb 0.53 0.53 -0.08 0.00 -0.61 0.00 0.00 39.78 40.15 1bqd n ASN 122 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1bqd s THR 123 N -1.19 0.22 -1.81 3.41 -4.23 -0.78 -5.03 115.64 106.23 1bqd s THR 123 Ca 0.06 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 58.72 1bqd s THR 123 Cb 0.06 -2.40 0.48 0.00 1.34 0.00 0.00 72.50 71.98 1bqd s THR 123 CO 0.20 0.00 1.39 -1.54 -0.54 0.00 0.00 174.62 174.12 1bqd n SER 124 N -1.55 3.00 -4.77 3.99 3.41 -1.26 -4.78 113.62 111.65 1bqd n SER 124 Ca 0.01 -2.08 -0.41 0.00 -0.26 0.00 0.00 58.87 56.14 1bqd n SER 124 Cb 0.63 -0.39 0.01 0.00 -0.26 0.00 0.00 64.21 64.20 1bqd n SER 124 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1bqd s VAL 125 N -1.41 2.07 0.00 -3.33 1.01 -1.26 -4.88 120.40 112.60 1bqd s VAL 125 Ca 0.36 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.40 1bqd s VAL 125 Cb 0.20 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.53 1bqd s VAL 125 CO 0.22 0.01 0.00 0.29 0.00 0.00 0.00 175.10 175.63 1bqd n LYS 126 N 0.22 2.83 -4.43 2.72 4.76 -1.26 -4.79 118.16 118.21 1bqd n LYS 126 Ca 0.02 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.23 1bqd n LYS 126 Cb 0.40 -0.64 -0.13 0.00 -1.84 0.00 0.00 35.03 32.82 1bqd n LYS 126 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1bqd s ARG 129 N -0.89 1.16 -0.07 1.97 0.52 -1.26 -0.06 118.95 120.32 1bqd s ARG 129 Ca 0.00 -0.98 -0.00 0.00 -0.52 0.00 0.00 55.73 54.23 1bqd s ARG 129 Cb 0.00 -1.30 0.02 0.00 0.52 0.00 0.00 34.95 34.20 1bqd s ARG 129 CO 0.00 0.32 -0.04 0.54 0.02 0.00 0.00 175.30 176.14 1bqd s VAL 133 N -0.97 0.62 -0.23 3.52 0.11 0.18 -2.19 120.40 121.45 1bqd s VAL 133 Ca 0.05 -0.09 -0.17 0.00 -2.93 0.00 0.00 61.98 58.84 1bqd s VAL 133 Cb -0.09 -0.69 -0.03 0.00 -1.53 0.00 0.00 36.38 34.04 1bqd s VAL 133 CO 0.03 0.28 0.45 0.26 -3.33 0.00 0.00 175.10 172.79 1bqd s TRP 134 N 1.46 3.32 0.13 1.54 0.52 0.11 -1.14 118.94 124.88 1bqd s TRP 134 Ca -0.02 0.62 0.11 0.00 0.02 0.00 0.00 56.10 56.83 1bqd s TRP 134 Cb -0.13 -2.62 -0.04 0.00 -1.15 0.00 0.00 33.47 29.53 1bqd s TRP 134 CO -0.03 -0.14 -0.26 0.14 0.02 0.00 0.00 176.95 176.67 1bqd s VAL 135 N 1.77 2.22 0.69 4.03 -7.23 -0.15 -0.41 120.40 121.32 1bqd s VAL 135 Ca 0.20 -1.76 -0.13 0.00 -1.81 0.00 0.00 61.98 58.48 1bqd s VAL 135 Cb -0.15 -1.97 0.01 0.00 0.56 0.00 0.00 36.38 34.82 1bqd s VAL 135 CO 0.09 0.07 1.08 -0.94 -0.31 0.00 0.00 175.10 175.09 1bqd s SER 136 N -2.08 5.12 0.90 4.85 1.04 -1.26 -1.27 113.70 120.99 1bqd s SER 136 Ca 0.14 1.84 -0.13 0.00 0.48 0.00 0.00 55.95 58.27 1bqd s SER 136 Cb -0.10 -2.53 0.14 0.00 0.10 0.00 0.00 66.02 63.63 1bqd s SER 136 CO 0.06 -1.62 1.19 0.54 0.98 0.00 0.00 173.24 174.39 1bqd s ASN 137 N -3.09 3.67 -1.21 7.02 4.22 -0.68 -3.58 114.94 121.29 1bqd s ASN 137 Ca 0.63 0.73 0.00 0.00 -2.14 0.00 0.00 52.86 52.08 1bqd s ASN 137 Cb -0.17 -1.14 0.00 0.00 1.28 0.00 0.00 41.25 41.22 1bqd s ASN 137 CO 0.47 -2.42 0.00 0.00 -2.04 0.00 0.00 177.10 173.11 1bqd n ALA 138 N -3.65 -0.27 -1.97 3.54 0.00 -1.26 -4.70 120.51 112.21 1bqd n ALA 138 Ca 0.09 0.18 -0.10 0.00 0.00 0.00 0.00 53.44 53.61 1bqd n ALA 138 Cb 0.60 -1.29 0.07 0.00 0.00 0.00 0.00 19.45 18.83 1bqd n ALA 138 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1bqd n SER 139 N -0.54 0.36 -4.60 0.00 2.88 -1.23 -2.48 113.62 108.00 1bqd n SER 139 Ca -0.12 -1.38 -0.43 0.00 -1.33 0.00 0.00 58.87 55.61 1bqd n SER 139 Cb 0.42 -0.36 -0.02 0.00 -0.75 0.00 0.00 64.21 63.49 1bqd n SER 139 CO 0.00 0.00 0.00 0.86 -1.23 0.00 0.00 175.04 174.67 1bqd s TRP 140 N -1.70 2.20 0.35 0.66 -0.00 -1.10 -4.56 118.94 114.79 1bqd s TRP 140 Ca 0.31 0.65 0.12 0.00 -0.00 0.00 0.00 56.10 57.18 1bqd s TRP 140 Cb -0.01 -4.24 0.92 0.00 -0.00 0.00 0.00 33.47 30.13 1bqd s TRP 140 CO 0.21 -2.32 1.79 -1.35 -0.00 0.00 0.00 176.95 175.28 1bqd h PRO 141 N 11.39 0.57 0.00 5.86 0.11 -1.95 -1.86 132.00 146.12 1bqd h PRO 141 Ca -0.30 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1bqd h PRO 141 Cb 1.13 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1bqd h PRO 141 CO 1.07 0.37 0.15 -0.97 -0.21 0.00 0.00 178.00 178.41 1bqd h ASN 142 N 0.58 0.00 -0.91 -2.05 -1.24 -2.02 -2.01 115.58 107.93 1bqd h ASN 142 Ca 0.57 0.00 0.03 0.00 0.71 0.00 0.00 56.30 57.61 1bqd h ASN 142 Cb 1.14 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 40.14 1bqd h ASN 142 CO -0.33 0.00 0.59 0.45 -1.29 0.00 0.00 177.43 176.86 1bqd h HIS 143 N 0.00 1.12 0.32 0.67 3.86 -1.74 -2.41 115.15 116.96 1bqd h HIS 143 Ca 0.00 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1bqd h HIS 143 Cb 0.30 -0.37 0.00 0.00 1.06 0.00 0.00 27.41 28.39 1bqd h HIS 143 CO 0.00 0.66 -0.17 -0.22 0.86 0.00 0.00 177.93 179.06 1bqd h LYS 144 N 1.17 -0.43 -0.70 2.45 1.63 -1.58 -2.67 116.57 116.43 1bqd h LYS 144 Ca 0.36 0.03 0.04 0.00 -0.85 0.00 0.00 60.65 60.23 1bqd h LYS 144 Cb -0.03 0.10 -0.05 0.00 -0.60 0.00 0.00 32.23 31.65 1bqd h LYS 144 CO -0.11 -0.29 0.42 0.77 -3.45 0.00 0.00 179.45 176.79 1bqd h SER 145 N -0.45 0.67 0.24 4.20 0.02 -1.66 0.11 113.55 116.67 1bqd h SER 145 Ca -0.04 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 1bqd h SER 145 Cb 0.35 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.76 1bqd h SER 145 CO 0.06 0.45 -0.15 0.58 -1.14 0.00 0.00 176.83 176.63 1bqd h VAL 146 N 0.80 0.68 -0.44 2.27 2.07 -1.37 -0.53 116.25 119.74 1bqd h VAL 146 Ca 0.29 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.71 1bqd h VAL 146 Cb 0.09 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1bqd h VAL 146 CO -0.14 0.00 -0.12 -0.26 0.02 0.00 0.00 177.57 177.07 1bqd h PHE 147 N -0.38 0.97 -0.86 1.57 0.04 -1.28 -2.85 116.94 114.16 1bqd h PHE 147 Ca -0.02 -0.21 0.03 0.00 2.80 0.00 0.00 57.97 60.57 1bqd h PHE 147 Cb 0.32 -0.23 -0.05 0.00 2.20 0.00 0.00 35.95 38.18 1bqd h PHE 147 CO -0.09 0.97 0.55 -0.91 -0.60 0.00 0.00 178.31 178.23 1bqd h ASN 148 N 0.69 0.93 -0.95 2.17 -0.26 -0.73 -1.45 115.58 115.97 1bqd h ASN 148 Ca 0.11 -0.01 0.20 0.00 -0.56 0.00 0.00 56.30 56.04 1bqd h ASN 148 Cb 0.67 -0.21 -0.08 0.00 -1.06 0.00 0.00 38.32 37.63 1bqd h ASN 148 CO 0.05 0.64 0.61 0.28 -1.06 0.00 0.00 177.43 177.95 1bqd h SER 149 N 1.08 0.56 0.46 5.81 0.02 -0.85 0.95 113.55 121.58 1bqd h SER 149 Ca 0.34 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.35 1bqd h SER 149 Cb -0.01 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.50 1bqd h SER 149 CO -0.11 0.21 -0.04 0.00 -1.14 0.00 0.00 176.83 175.74 1bqd n ALA 150 N -2.44 2.60 -1.54 3.77 0.00 -0.64 -4.89 120.51 117.38 1bqd n ALA 150 Ca 0.21 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1bqd n ALA 150 Cb 0.66 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1bqd n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bqd n GLY 151 N 1.27 0.86 3.77 0.00 0.00 0.33 -4.87 105.19 106.54 1bqd n GLY 151 Ca 0.15 -0.60 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 1bqd n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bqd s LEU 152 N -0.18 3.82 0.19 0.99 1.02 -0.64 -5.00 118.68 118.86 1bqd s LEU 152 Ca 0.00 0.06 -0.27 0.00 0.02 0.00 0.00 54.13 53.94 1bqd s LEU 152 Cb 0.00 -2.36 -0.08 0.00 0.02 0.00 0.00 46.19 43.77 1bqd s LEU 152 CO 0.00 0.22 0.83 -0.70 0.02 0.00 0.00 176.35 176.72 1bqd s GLU 154 N -2.04 4.66 -0.18 1.70 2.12 0.91 -3.84 118.70 122.02 1bqd s GLU 154 Ca 0.26 1.26 0.01 0.00 0.36 0.00 0.00 54.97 56.85 1bqd s GLU 154 Cb -0.12 -3.27 0.02 0.00 0.26 0.00 0.00 34.13 31.02 1bqd s GLU 154 CO 0.18 0.56 -0.19 0.08 -0.54 0.00 0.00 175.26 175.34 1bqd s VAL 155 N -1.15 2.15 0.35 3.70 1.01 -1.26 0.49 120.40 125.69 1bqd s VAL 155 Ca 0.37 -0.91 0.08 0.00 0.00 0.00 0.00 61.98 61.52 1bqd s VAL 155 Cb -0.24 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 1bqd s VAL 155 CO 0.28 0.53 0.13 -0.13 0.00 0.00 0.00 175.10 175.91 1bqd s ARG 156 N 1.30 2.31 -0.05 2.72 1.81 -0.29 -4.96 118.95 121.79 1bqd s ARG 156 Ca 0.05 -1.62 0.06 0.00 -1.72 0.00 0.00 55.73 52.51 1bqd s ARG 156 Cb -0.13 -2.11 -0.01 0.00 -0.45 0.00 0.00 34.95 32.24 1bqd s ARG 156 CO -0.12 0.08 -0.25 -1.21 -0.68 0.00 0.00 175.30 173.12 1bqd s GLU 157 N -3.84 2.40 0.12 3.54 2.02 -1.26 -0.98 118.70 120.72 1bqd s GLU 157 Ca 0.38 -0.90 0.07 0.00 0.02 0.00 0.00 54.97 54.54 1bqd s GLU 157 Cb -0.01 -2.10 -0.04 0.00 0.10 0.00 0.00 34.13 32.08 1bqd s GLU 157 CO 0.22 0.42 -0.05 1.52 0.02 0.00 0.00 175.26 177.39 1bqd s TYR 158 N -0.26 2.82 0.24 1.61 -0.85 -0.39 -4.93 117.35 115.59 1bqd s TYR 158 Ca -0.00 -0.12 -0.30 0.00 -0.52 0.00 0.00 57.07 56.13 1bqd s TYR 158 Cb -0.13 -1.43 -0.09 0.00 0.38 0.00 0.00 41.96 40.69 1bqd s TYR 158 CO 0.03 0.47 1.20 0.00 -1.52 0.00 0.00 175.55 175.72 1bqd s ALA 159 N -1.40 3.45 0.26 9.51 0.00 -1.26 -1.69 121.76 130.62 1bqd s ALA 159 Ca 0.24 1.01 0.00 0.00 0.00 0.00 0.00 51.96 53.21 1bqd s ALA 159 Cb -0.11 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1bqd s ALA 159 CO 0.16 -0.37 0.00 0.98 0.00 0.00 0.00 175.76 176.53 1bqd n TYR 160 N 1.81 -2.48 -3.36 0.00 9.36 -1.26 -3.73 117.16 117.49 1bqd n TYR 160 Ca 0.02 0.55 -0.37 0.00 3.32 0.00 0.00 57.90 61.42 1bqd n TYR 160 Cb 0.44 1.17 -0.06 0.00 -0.63 0.00 0.00 39.34 40.26 1bqd n TYR 160 CO 0.00 0.00 0.00 -0.47 0.22 0.00 0.00 176.86 176.61 1bqd s TYR 161 N -2.00 3.73 -0.53 2.98 5.04 -1.26 -1.90 117.35 123.41 1bqd s TYR 161 Ca 0.00 1.13 -0.03 0.00 -2.44 0.00 0.00 57.07 55.73 1bqd s TYR 161 Cb 0.00 -2.40 0.14 0.00 0.35 0.00 0.00 41.96 40.05 1bqd s TYR 161 CO 0.00 0.56 0.34 0.34 -1.34 0.00 0.00 175.55 175.45 1bqd s ASP 162 N -1.28 5.31 0.00 4.32 2.15 0.16 -4.83 116.67 122.49 1bqd s ASP 162 Ca 0.30 -2.45 0.02 0.00 0.43 0.00 0.00 52.55 50.85 1bqd s ASP 162 Cb -0.17 -1.86 0.09 0.00 -0.30 0.00 0.00 42.92 40.67 1bqd s ASP 162 CO 0.18 -0.47 1.04 0.00 -0.17 0.00 0.00 175.17 175.75 1bqd n ALA 163 N 4.05 1.11 -0.08 3.66 0.00 -1.26 0.12 120.51 128.10 1bqd n ALA 163 Ca 0.03 -0.01 -0.11 0.00 0.00 0.00 0.00 53.44 53.35 1bqd n ALA 163 Cb 0.40 -1.03 -0.06 0.00 0.00 0.00 0.00 19.45 18.76 1bqd n ALA 163 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1bqd h GLU 164 N 0.00 0.00 -0.01 0.00 5.08 -1.95 -3.39 114.58 114.31 1bqd h GLU 164 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1bqd h GLU 164 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1bqd h GLU 164 CO 0.00 0.44 -0.33 0.09 -1.00 0.00 0.00 179.01 178.21 1bqd n ASN 165 N -4.57 1.30 -3.41 1.42 3.02 -1.12 -4.98 115.26 106.92 1bqd n ASN 165 Ca -0.15 -1.06 -0.18 0.00 -0.03 0.00 0.00 54.58 53.16 1bqd n ASN 165 Cb 0.40 0.24 0.04 0.00 -0.61 0.00 0.00 39.78 39.85 1bqd n ASN 165 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1bqd n HIS 166 N -0.49 -2.36 -3.83 3.10 8.25 0.32 -4.97 115.22 115.24 1bqd n HIS 166 Ca 0.11 0.78 -0.07 0.00 -0.26 0.00 0.00 57.72 58.29 1bqd n HIS 166 Cb 0.38 -3.74 0.01 0.00 1.12 0.00 0.00 29.99 27.76 1bqd n HIS 166 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1bqd s THR 167 N -3.28 0.00 -0.34 1.59 -1.32 -1.04 -4.95 115.64 106.31 1bqd s THR 167 Ca 0.30 -0.90 -0.26 0.00 -1.21 0.00 0.00 61.69 59.62 1bqd s THR 167 Cb -0.08 -2.60 0.01 0.00 -1.51 0.00 0.00 72.50 68.33 1bqd s THR 167 CO 0.80 0.00 0.94 -0.22 -2.21 0.00 0.00 174.62 173.93 1bqd s LEU 168 N -3.08 3.99 -1.18 9.08 0.20 -1.26 0.37 118.68 126.80 1bqd s LEU 168 Ca 0.15 0.74 -0.14 0.00 0.69 0.00 0.00 54.13 55.58 1bqd s LEU 168 Cb -0.05 -3.31 0.18 0.00 -0.43 0.00 0.00 46.19 42.59 1bqd s LEU 168 CO 0.08 -0.81 1.38 -0.62 -0.29 0.00 0.00 176.35 176.09 1bqd s ASP 169 N 1.76 7.07 0.38 3.68 2.15 -0.80 -4.85 116.67 126.06 1bqd s ASP 169 Ca 0.39 -3.01 0.15 0.00 0.43 0.00 0.00 52.55 50.51 1bqd s ASP 169 Cb -0.12 -2.38 1.01 0.00 -0.30 0.00 0.00 42.92 41.13 1bqd s ASP 169 CO 0.16 -0.71 1.79 0.15 -0.17 0.00 0.00 175.17 176.39 1bqd h PHE 170 N 7.19 0.74 0.27 -5.34 3.57 -1.93 -0.90 116.94 120.54 1bqd h PHE 170 Ca 0.29 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.80 1bqd h PHE 170 Cb 0.88 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.41 1bqd h PHE 170 CO 1.07 0.12 -0.13 -0.44 -2.23 0.00 0.00 178.31 176.69 1bqd h ASP 171 N 0.48 -0.31 -0.36 0.41 3.32 -1.98 -0.01 116.42 117.98 1bqd h ASP 171 Ca 0.57 -0.18 0.05 0.00 0.02 0.00 0.00 57.03 57.49 1bqd h ASP 171 Cb 1.29 0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.90 1bqd h ASP 171 CO -0.30 0.03 0.24 0.00 -1.72 0.00 0.00 179.24 177.50 1bqd h ALA 172 N -0.06 1.98 0.54 3.45 0.00 -1.77 -0.12 119.26 123.28 1bqd h ALA 172 Ca -0.04 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1bqd h ALA 172 Cb 0.47 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.20 1bqd h ALA 172 CO 0.06 -0.05 -0.26 1.25 0.00 0.00 0.00 179.25 180.25 1bqd h LEU 173 N 0.28 -0.61 -1.76 0.00 5.85 -0.96 -1.00 115.31 117.11 1bqd h LEU 173 Ca 0.16 0.02 0.22 0.00 0.84 0.00 0.00 57.88 59.11 1bqd h LEU 173 Cb 0.27 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.41 1bqd h LEU 173 CO -0.03 -0.31 0.58 0.40 -0.34 0.00 0.00 178.44 178.74 1bqd h ILE 174 N -0.98 0.64 -0.20 4.05 5.03 -0.71 -1.68 117.51 123.66 1bqd h ILE 174 Ca -0.07 -0.07 -0.17 0.00 -0.12 0.00 0.00 64.86 64.43 1bqd h ILE 174 Cb 0.56 0.43 0.00 0.00 -3.03 0.00 0.00 36.82 34.78 1bqd h ILE 174 CO 0.12 0.04 -0.53 0.78 -0.68 0.00 0.00 178.15 177.88 1bqd h ASN 175 N 0.20 0.81 -0.25 1.72 2.35 -0.88 -3.20 115.58 116.34 1bqd h ASN 175 Ca 0.42 -0.58 -0.17 0.00 -0.55 0.00 0.00 56.30 55.43 1bqd h ASN 175 Cb 1.34 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 39.47 1bqd h ASN 175 CO -0.09 1.24 -0.48 0.77 -1.65 0.00 0.00 177.43 177.22 1bqd h SER 176 N 0.42 0.90 0.11 5.81 4.64 -0.30 -2.96 113.55 122.17 1bqd h SER 176 Ca -0.01 -0.45 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1bqd h SER 176 Cb 1.15 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 62.98 1bqd h SER 176 CO 0.11 1.23 0.00 0.18 -0.87 0.00 0.00 176.83 177.48 1bqd n LEU 177 N -4.02 0.00 0.11 5.97 4.77 -0.81 -2.26 117.00 120.77 1bqd n LEU 177 Ca -0.03 0.15 -0.01 0.00 -0.03 0.00 0.00 56.01 56.09 1bqd n LEU 177 Cb 0.59 -0.15 -0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1bqd n LEU 177 CO 0.49 -0.09 0.37 0.78 -1.33 0.00 0.00 177.39 177.61 1bqd h ASN 178 N 0.00 0.00 0.33 -1.43 -0.26 -1.51 -3.08 115.58 109.63 1bqd h ASN 178 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1bqd h ASN 178 Cb 0.06 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.32 1bqd h ASN 178 CO 0.00 0.67 0.00 1.21 -1.06 0.00 0.00 177.43 178.25 1bqd n GLU 179 N -3.30 0.46 -3.19 0.81 2.13 -0.96 -4.70 120.64 111.89 1bqd n GLU 179 Ca 0.01 0.04 -0.39 0.00 0.66 0.00 0.00 57.16 57.49 1bqd n GLU 179 Cb 0.79 -1.50 -0.05 0.00 0.27 0.00 0.00 31.44 30.95 1bqd n GLU 179 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1bqd s ALA 180 N -2.42 3.44 0.49 4.31 0.00 -1.17 -5.06 121.76 121.35 1bqd s ALA 180 Ca 0.27 0.00 -0.00 0.00 0.00 0.00 0.00 51.96 52.23 1bqd s ALA 180 Cb 0.17 -2.78 0.01 0.00 0.00 0.00 0.00 23.12 20.51 1bqd s ALA 180 CO 0.35 0.05 0.73 1.14 0.00 0.00 0.00 175.76 178.02 1bqd s GLN 181 N 0.29 2.94 0.31 0.00 -2.07 -1.26 -5.02 119.66 114.85 1bqd s GLN 181 Ca 0.32 -0.47 -0.29 0.00 -1.82 0.00 0.00 55.36 53.10 1bqd s GLN 181 Cb -0.17 -2.50 -0.10 0.00 -1.09 0.00 0.00 33.01 29.14 1bqd s GLN 181 CO 0.16 -0.42 1.43 0.00 -1.32 0.00 0.00 175.29 175.13 1bqd s ALA 182 N -2.66 3.59 0.00 2.60 0.00 -1.23 -2.13 121.76 121.93 1bqd s ALA 182 Ca 0.51 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.86 1bqd s ALA 182 Cb -0.10 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.46 1bqd s ALA 182 CO 0.39 -0.81 0.00 0.41 0.00 0.00 0.00 175.76 175.75 1bqd n GLY 183 N 1.36 0.60 3.88 0.00 0.00 0.11 -4.99 105.19 106.15 1bqd n GLY 183 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 1bqd n GLY 183 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bqd s ASP 184 N -2.90 6.61 -0.14 1.61 1.11 -0.90 -4.47 116.67 117.59 1bqd s ASP 184 Ca 0.00 0.89 -0.08 0.00 0.18 0.00 0.00 52.55 53.54 1bqd s ASP 184 Cb 0.00 -2.21 -0.04 0.00 1.07 0.00 0.00 42.92 41.74 1bqd s ASP 184 CO 0.00 -0.06 0.14 0.68 1.18 0.00 0.00 175.17 177.11 1bqd s VAL 185 N -1.79 5.49 -0.16 -1.27 -7.23 -0.93 -1.61 120.40 112.89 1bqd s VAL 185 Ca 0.47 0.21 -0.00 0.00 -1.81 0.00 0.00 61.98 60.84 1bqd s VAL 185 Cb -0.11 -3.42 -0.00 0.00 0.56 0.00 0.00 36.38 33.41 1bqd s VAL 185 CO 0.21 0.58 -0.14 -0.69 -0.31 0.00 0.00 175.10 174.76 1bqd s VAL 186 N -0.74 2.81 -0.24 1.32 1.01 -0.84 0.05 120.40 123.77 1bqd s VAL 186 Ca 0.14 -0.72 -0.13 0.00 0.00 0.00 0.00 61.98 61.26 1bqd s VAL 186 Cb -0.12 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 1bqd s VAL 186 CO 0.03 0.51 0.29 -0.22 0.00 0.00 0.00 175.10 175.71 1bqd s LEU 187 N 0.82 4.09 0.02 3.92 0.20 0.45 -1.34 118.68 126.85 1bqd s LEU 187 Ca -0.05 0.26 0.06 0.00 0.69 0.00 0.00 54.13 55.10 1bqd s LEU 187 Cb -0.15 -2.31 -0.03 0.00 -0.43 0.00 0.00 46.19 43.26 1bqd s LEU 187 CO 0.00 -0.06 -0.17 -0.36 -0.29 0.00 0.00 176.35 175.47 1bqd s PHE 188 N 1.51 2.58 -0.28 5.38 0.08 -0.57 -4.42 117.98 122.26 1bqd s PHE 188 Ca 0.13 -0.24 -0.21 0.00 0.12 0.00 0.00 56.93 56.73 1bqd s PHE 188 Cb -0.15 -1.50 -0.01 0.00 -0.57 0.00 0.00 43.02 40.79 1bqd s PHE 188 CO 0.08 0.23 0.66 -1.01 -0.10 0.00 0.00 175.22 175.08 1bqd s HIS 189 N -0.88 3.25 0.25 0.36 3.76 -1.26 -0.44 115.29 120.33 1bqd s HIS 189 Ca 0.14 0.75 -0.03 0.00 -0.15 0.00 0.00 55.06 55.78 1bqd s HIS 189 Cb -0.11 -2.95 0.52 0.00 1.11 0.00 0.00 32.58 31.15 1bqd s HIS 189 CO 0.04 -0.41 1.70 0.78 -0.85 0.00 0.00 174.74 176.00 1bqd h GLY 190 N 9.09 1.17 -3.12 -2.22 0.00 -1.66 -3.45 103.07 102.88 1bqd h GLY 190 Ca -0.26 -0.10 0.11 0.00 0.00 0.00 0.00 47.33 47.08 1bqd h GLY 190 CO 0.80 -0.18 0.47 0.00 0.00 0.00 0.00 176.54 177.63 1bqd n HIS 193 N -3.70 1.27 -3.54 0.00 -0.00 -1.26 -4.74 115.22 103.25 1bqd n HIS 193 Ca -0.12 0.84 -0.39 0.00 0.46 0.00 0.00 57.72 58.51 1bqd n HIS 193 Cb 0.62 -2.24 -0.11 0.00 -0.12 0.00 0.00 29.99 28.14 1bqd n HIS 193 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1bqd s ASN 194 N 0.96 6.06 -0.22 0.26 3.84 -1.26 -0.28 114.94 124.30 1bqd s ASN 194 Ca 0.91 -0.16 0.11 0.00 0.21 0.00 0.00 52.86 53.93 1bqd s ASN 194 Cb -1.15 -2.14 0.43 0.00 -0.55 0.00 0.00 41.25 37.84 1bqd s ASN 194 CO 0.57 -0.15 1.21 0.00 -2.79 0.00 0.00 177.10 175.94 1bqd n ALA 195 N 5.12 3.91 0.05 1.71 0.00 -1.03 -2.73 120.51 127.54 1bqd n ALA 195 Ca -0.13 -3.37 -0.13 0.00 0.00 0.00 0.00 53.44 49.82 1bqd n ALA 195 Cb 0.51 -0.37 -0.14 0.00 0.00 0.00 0.00 19.45 19.45 1bqd n ALA 195 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1bqd h THR 196 N 1.67 1.26 0.00 0.00 1.35 -1.64 -3.08 112.91 112.46 1bqd h THR 196 Ca 0.08 -2.95 0.00 0.00 -0.55 0.00 0.00 66.41 62.99 1bqd h THR 196 Cb 1.18 2.73 0.00 0.00 -1.73 0.00 0.00 68.15 70.33 1bqd h THR 196 CO 0.19 0.80 0.00 0.61 -0.25 0.00 0.00 175.52 176.87 1bqd n GLY 197 N 1.56 0.75 3.57 5.82 0.00 0.62 -4.47 105.19 113.03 1bqd n GLY 197 Ca -0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 1bqd n GLY 197 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bqd s ILE 198 N -2.81 5.22 0.17 -0.61 1.01 -1.26 0.39 121.20 123.32 1bqd s ILE 198 Ca 0.00 0.18 0.09 0.00 0.00 0.00 0.00 60.65 60.91 1bqd s ILE 198 Cb 0.00 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 1bqd s ILE 198 CO 0.00 0.06 -0.11 -1.81 0.00 0.00 0.00 174.94 173.09 1bqd s ASP 199 N 1.71 4.20 0.74 3.58 1.01 -1.26 -4.37 116.67 122.28 1bqd s ASP 199 Ca 0.11 -0.58 -0.11 0.00 0.71 0.00 0.00 52.55 52.67 1bqd s ASP 199 Cb -0.16 -0.69 0.03 0.00 1.01 0.00 0.00 42.92 43.11 1bqd s ASP 199 CO 0.11 0.11 1.07 -2.84 0.21 0.00 0.00 175.17 173.83 1bqd s PRO 200 N -2.75 2.59 0.69 8.23 0.02 -1.26 -5.03 135.00 137.48 1bqd s PRO 200 Ca 0.24 0.90 -0.08 0.00 0.02 0.00 0.00 61.00 62.08 1bqd s PRO 200 Cb -0.09 -1.95 0.04 0.00 0.02 0.00 0.00 34.50 32.51 1bqd s PRO 200 CO 0.15 -1.33 1.03 0.95 -0.33 0.00 0.00 177.00 177.46 1bqd s THR 201 N -3.05 2.92 0.27 0.99 -4.23 -1.26 -4.78 115.64 106.50 1bqd s THR 201 Ca 0.59 0.03 -0.02 0.00 -1.18 0.00 0.00 61.69 61.12 1bqd s THR 201 Cb -0.15 -3.25 0.27 0.00 1.34 0.00 0.00 72.50 70.71 1bqd s THR 201 CO 0.55 -0.29 1.86 0.25 -0.54 0.00 0.00 174.62 176.45 1bqd h LEU 202 N -0.56 0.96 -0.80 4.79 6.46 -1.98 0.59 115.31 124.76 1bqd h LEU 202 Ca -0.45 0.03 -0.12 0.00 -0.12 0.00 0.00 57.88 57.22 1bqd h LEU 202 Cb 1.29 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 41.03 1bqd h LEU 202 CO 0.62 0.58 -0.37 -0.33 -0.62 0.00 0.00 178.44 178.32 1bqd h GLU 203 N 1.07 0.46 -0.32 1.25 5.08 -1.99 -1.02 114.58 119.11 1bqd h GLU 203 Ca 0.45 -0.22 -0.17 0.00 -1.00 0.00 0.00 59.36 58.42 1bqd h GLU 203 Cb 0.28 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1bqd h GLU 203 CO -0.21 0.77 -0.46 1.96 -1.00 0.00 0.00 179.01 180.07 1bqd h GLN 204 N 0.39 0.86 -0.42 2.33 4.20 -1.36 -2.24 115.11 118.86 1bqd h GLN 204 Ca 0.04 -0.49 0.00 0.00 0.06 0.00 0.00 58.65 58.27 1bqd h GLN 204 Cb 0.82 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.62 1bqd h GLN 204 CO 0.07 1.13 0.28 -1.49 -0.67 0.00 0.00 178.83 178.15 1bqd h TRP 205 N 0.68 0.53 -0.59 2.96 -0.00 0.40 -1.55 115.95 118.39 1bqd h TRP 205 Ca 0.04 0.01 -0.01 0.00 -0.00 0.00 0.00 58.89 58.93 1bqd h TRP 205 Cb 1.05 -0.18 -0.03 0.00 -0.00 0.00 0.00 29.16 30.00 1bqd h TRP 205 CO 0.06 0.34 0.34 1.96 -0.00 0.00 0.00 178.44 181.14 1bqd h GLN 206 N 0.57 0.80 -0.27 0.49 4.20 -1.10 -0.30 115.11 119.51 1bqd h GLN 206 Ca 0.15 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 1bqd h GLN 206 Cb -0.06 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.54 1bqd h GLN 206 CO -0.03 0.58 -0.05 1.15 -0.67 0.00 0.00 178.83 179.81 1bqd h THR 207 N 0.82 1.28 -0.47 -0.54 2.02 -0.89 -2.17 112.91 112.95 1bqd h THR 207 Ca 0.21 -1.04 -0.03 0.00 0.77 0.00 0.00 66.41 66.32 1bqd h THR 207 Cb -0.01 1.41 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 1bqd h THR 207 CO -0.04 0.33 0.15 -0.07 0.37 0.00 0.00 175.52 176.26 1bqd h LEU 208 N 0.27 0.63 -0.34 2.58 3.38 -0.79 -1.92 115.31 119.12 1bqd h LEU 208 Ca 0.07 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1bqd h LEU 208 Cb 0.51 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1bqd h LEU 208 CO 0.02 0.60 0.02 0.00 0.09 0.00 0.00 178.44 179.17 1bqd h ALA 209 N 1.49 0.45 -0.38 1.53 0.00 -0.87 0.27 119.26 121.75 1bqd h ALA 209 Ca 0.16 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1bqd h ALA 209 Cb 0.19 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1bqd h ALA 209 CO -0.01 0.19 0.18 1.96 0.00 0.00 0.00 179.25 181.57 1bqd h GLN 210 N 0.40 0.55 -0.52 0.00 4.20 -1.16 -2.65 115.11 115.94 1bqd h GLN 210 Ca 0.10 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 1bqd h GLN 210 Cb 0.41 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.07 1bqd h GLN 210 CO 0.01 0.49 0.26 1.25 -0.67 0.00 0.00 178.83 180.18 1bqd h LEU 211 N 0.48 0.67 -0.55 1.46 5.85 -1.27 -2.51 115.31 119.44 1bqd h LEU 211 Ca 0.13 -0.12 0.07 0.00 0.84 0.00 0.00 57.88 58.81 1bqd h LEU 211 Cb 0.12 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 40.92 1bqd h LEU 211 CO -0.02 0.60 0.21 -1.28 -0.34 0.00 0.00 178.44 177.62 1bqd h SER 212 N 0.69 0.24 -0.58 1.25 0.87 -0.73 0.22 113.55 115.50 1bqd h SER 212 Ca 0.18 0.06 -0.04 0.00 -1.23 0.00 0.00 61.79 60.76 1bqd h SER 212 Cb 0.10 0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.07 1bqd h SER 212 CO -0.02 0.16 0.20 0.58 -0.53 0.00 0.00 176.83 177.21 1bqd h VAL 213 N 0.41 1.24 -0.61 2.23 2.07 -1.34 -1.58 116.25 118.66 1bqd h VAL 213 Ca 0.27 -0.78 -0.06 0.00 0.82 0.00 0.00 66.70 66.94 1bqd h VAL 213 Cb 0.29 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1bqd h VAL 213 CO -0.26 0.30 0.15 -0.08 0.02 0.00 0.00 177.57 177.70 1bqd h GLU 214 N 0.82 0.95 0.00 1.57 4.81 -0.96 -3.08 114.58 118.69 1bqd h GLU 214 Ca 0.19 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1bqd h GLU 214 Cb 0.26 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1bqd h GLU 214 CO -0.01 0.85 -0.39 1.63 -0.73 0.00 0.00 179.01 180.36 1bqd n LYS 215 N -4.26 0.21 -2.57 1.92 4.01 0.01 -4.97 118.16 112.52 1bqd n LYS 215 Ca 0.04 0.10 -0.06 0.00 -0.51 0.00 0.00 58.31 57.89 1bqd n LYS 215 Cb 0.24 -1.67 0.01 0.00 -0.51 0.00 0.00 35.03 33.10 1bqd n LYS 215 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1bqd n GLY 216 N 1.37 0.47 3.90 0.72 0.00 -0.64 -3.53 105.19 107.48 1bqd n GLY 216 Ca 0.05 -0.52 -0.28 0.00 0.00 0.00 0.00 46.02 45.27 1bqd n GLY 216 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1bqd s TRP 217 N -2.83 3.55 -0.36 1.61 0.51 -0.96 0.03 118.94 120.49 1bqd s TRP 217 Ca 0.10 0.85 -0.03 0.00 -2.12 0.00 0.00 56.10 54.90 1bqd s TRP 217 Cb -0.04 -2.32 0.08 0.00 -0.81 0.00 0.00 33.47 30.37 1bqd s TRP 217 CO 0.12 -0.26 0.11 -1.17 -0.51 0.00 0.00 176.95 175.24 1bqd s LEU 218 N -4.64 4.62 0.20 2.99 2.96 -0.63 -4.85 118.68 119.32 1bqd s LEU 218 Ca 0.48 -1.63 -0.30 0.00 -0.22 0.00 0.00 54.13 52.46 1bqd s LEU 218 Cb -0.10 -1.79 -0.08 0.00 0.50 0.00 0.00 46.19 44.71 1bqd s LEU 218 CO 0.43 -0.41 1.27 -2.16 -1.32 0.00 0.00 176.35 174.17 1bqd s PRO 219 N 1.22 4.42 -0.23 0.98 0.05 -1.26 -1.99 135.00 138.19 1bqd s PRO 219 Ca 0.02 1.99 -0.00 0.00 0.05 0.00 0.00 61.00 63.06 1bqd s PRO 219 Cb -0.21 -3.21 0.06 0.00 0.05 0.00 0.00 34.50 31.19 1bqd s PRO 219 CO -0.02 -0.20 -0.02 -1.17 0.05 0.00 0.00 177.00 175.64 1bqd s LEU 220 N -0.19 2.21 -0.12 -3.56 0.20 -0.45 -2.09 118.68 114.69 1bqd s LEU 220 Ca 0.55 -1.12 -0.17 0.00 0.69 0.00 0.00 54.13 54.09 1bqd s LEU 220 Cb -0.35 -1.01 -0.04 0.00 -0.43 0.00 0.00 46.19 44.35 1bqd s LEU 220 CO 0.38 -0.26 0.43 -0.36 -0.29 0.00 0.00 176.35 176.24 1bqd s PHE 221 N 1.52 3.52 -0.44 5.38 0.40 0.59 -1.52 117.98 127.43 1bqd s PHE 221 Ca -0.04 0.82 -0.10 0.00 -0.60 0.00 0.00 56.93 57.02 1bqd s PHE 221 Cb -0.18 -2.48 0.09 0.00 0.51 0.00 0.00 43.02 40.96 1bqd s PHE 221 CO -0.07 0.22 0.30 0.34 0.70 0.00 0.00 175.22 176.71 1bqd s ASP 222 N 0.45 5.71 -0.71 1.36 -1.08 0.42 -0.37 116.67 122.44 1bqd s ASP 222 Ca 0.23 -1.63 -0.04 0.00 -0.52 0.00 0.00 52.55 50.60 1bqd s ASP 222 Cb -0.15 -2.01 0.18 0.00 -1.46 0.00 0.00 42.92 39.48 1bqd s ASP 222 CO 0.09 -0.60 0.55 0.12 0.52 0.00 0.00 175.17 175.84 1bqd s PHE 223 N 1.42 3.54 -1.04 -5.34 5.36 -0.42 -1.58 117.98 119.92 1bqd s PHE 223 Ca 0.04 -2.73 0.12 0.00 -0.96 0.00 0.00 56.93 53.40 1bqd s PHE 223 Cb -0.24 -3.26 -0.01 0.00 -0.34 0.00 0.00 43.02 39.16 1bqd s PHE 223 CO 0.01 -0.83 0.68 0.00 -1.46 0.00 0.00 175.22 173.63 1bqd n ALA 224 N 3.25 2.97 -2.08 11.12 0.00 -1.26 -2.22 120.51 132.28 1bqd n ALA 224 Ca 0.12 -0.45 -0.02 0.00 0.00 0.00 0.00 53.44 53.08 1bqd n ALA 224 Cb 0.38 -0.41 0.10 0.00 0.00 0.00 0.00 19.45 19.52 1bqd n ALA 224 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1bqd n TYR 225 N -0.29 0.80 -1.68 0.00 4.02 -1.26 -4.64 117.16 114.11 1bqd n TYR 225 Ca 0.05 -1.51 -0.44 0.00 -0.01 0.00 0.00 57.90 55.98 1bqd n TYR 225 Cb 0.24 -0.24 -0.04 0.00 -0.02 0.00 0.00 39.34 39.28 1bqd n TYR 225 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 1bqd n GLN 226 N -0.56 2.53 -0.17 -0.72 7.27 -1.26 -1.09 117.38 123.37 1bqd n GLN 226 Ca 0.20 0.92 0.00 0.00 0.07 0.00 0.00 57.00 58.19 1bqd n GLN 226 Cb 0.88 -2.79 0.00 0.00 2.41 0.00 0.00 30.24 30.74 1bqd n GLN 226 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1bqd n GLY 227 N 4.15 0.64 0.02 1.69 0.00 -1.25 -4.79 105.19 105.66 1bqd n GLY 227 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.32 1bqd n GLY 227 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1bqd n PHE 228 N -2.03 0.13 -0.02 1.61 3.72 -0.25 -4.47 117.46 116.15 1bqd n PHE 228 Ca 0.00 0.04 -0.01 0.00 -0.05 0.00 0.00 57.45 57.43 1bqd n PHE 228 Cb 0.00 -0.42 -0.00 0.00 -0.94 0.00 0.00 39.48 38.12 1bqd n PHE 228 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1bqd n ALA 229 N -2.00 0.13 0.00 4.37 0.00 -1.26 -4.18 120.51 117.57 1bqd n ALA 229 Ca -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1bqd n ALA 229 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 1bqd n ALA 229 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1bqd n ARG 230 N -2.93 0.00 0.00 0.00 1.74 -1.26 -4.91 116.66 109.30 1bqd n ARG 230 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 1bqd n ARG 230 Cb 0.08 -0.79 0.00 0.00 -1.02 0.00 0.00 32.46 30.73 1bqd n ARG 230 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1bqd n GLY 231 N 3.03 -0.22 0.48 -0.13 0.00 -1.26 -4.97 105.19 102.11 1bqd n GLY 231 Ca 0.00 -0.99 -0.17 0.00 0.00 0.00 0.00 46.02 44.86 1bqd n GLY 231 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1bqd h LEU 233 N 0.00 -1.32 -0.55 0.99 4.07 -1.90 -1.97 115.31 114.64 1bqd h LEU 233 Ca 0.00 0.10 -0.13 0.00 0.08 0.00 0.00 57.88 57.93 1bqd h LEU 233 Cb 0.00 0.43 -0.01 0.00 1.08 0.00 0.00 40.66 42.16 1bqd h LEU 233 CO 0.00 -0.64 -0.27 -0.33 -1.08 0.00 0.00 178.44 176.12 1bqd h GLU 234 N -0.97 0.88 0.52 1.13 4.39 -1.97 -3.28 114.58 115.29 1bqd h GLU 234 Ca -0.06 -0.40 -0.02 0.00 0.34 0.00 0.00 59.36 59.22 1bqd h GLU 234 Cb 0.84 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.47 1bqd h GLU 234 CO -0.05 1.04 -0.28 0.93 -1.16 0.00 0.00 179.01 179.49 1bqd h GLU 235 N 0.75 -0.71 0.00 2.33 3.07 -1.93 -2.32 114.58 115.78 1bqd h GLU 235 Ca 0.09 0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 1bqd h GLU 235 Cb 0.83 0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.90 1bqd h GLU 235 CO 0.07 -0.47 0.25 -0.25 -1.40 0.00 0.00 179.01 177.21 1bqd n ASP 236 N -5.42 0.28 -0.51 1.42 8.00 -0.74 -0.94 116.55 118.64 1bqd n ASP 236 Ca -0.12 0.52 0.12 0.00 0.71 0.00 0.00 54.79 56.02 1bqd n ASP 236 Cb 0.31 -0.49 0.11 0.00 -0.02 0.00 0.00 41.12 41.04 1bqd n ASP 236 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bqd n ALA 237 N -1.53 3.28 -0.13 2.24 0.00 -0.87 -4.54 120.51 118.95 1bqd n ALA 237 Ca -0.01 -0.59 -0.05 0.00 0.00 0.00 0.00 53.44 52.79 1bqd n ALA 237 Cb 0.27 -0.88 0.02 0.00 0.00 0.00 0.00 19.45 18.85 1bqd n ALA 237 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1bqd h GLU 238 N 2.48 -0.11 0.07 0.00 5.08 -1.08 0.11 114.58 121.12 1bqd h GLU 238 Ca 0.00 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1bqd h GLU 238 Cb 0.73 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.98 1bqd h GLU 238 CO 0.00 -0.07 -0.28 0.78 -1.00 0.00 0.00 179.01 178.43 1bqd h GLY 239 N -0.12 -1.19 0.27 -3.84 0.00 -1.82 0.63 103.07 97.01 1bqd h GLY 239 Ca 0.21 0.59 0.14 0.00 0.00 0.00 0.00 47.33 48.27 1bqd h GLY 239 CO -0.51 -0.36 0.42 -2.00 0.00 0.00 0.00 176.54 174.09 1bqd h LEU 240 N -0.41 0.52 -1.32 3.11 5.85 -1.82 0.18 115.31 121.42 1bqd h LEU 240 Ca -0.00 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 1bqd h LEU 240 Cb 0.41 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1bqd h LEU 240 CO -0.15 0.23 0.10 0.03 -0.34 0.00 0.00 178.44 178.31 1bqd h ARG 241 N 0.63 0.56 -0.58 1.25 -0.00 -0.11 0.85 114.38 116.97 1bqd h ARG 241 Ca 0.44 -0.09 -0.08 0.00 -0.50 0.00 0.00 59.98 59.75 1bqd h ARG 241 Cb 0.59 -0.10 -0.02 0.00 0.00 0.00 0.00 29.97 30.45 1bqd h ARG 241 CO -0.34 0.51 0.06 0.00 0.00 0.00 0.00 179.97 180.20 1bqd h ALA 242 N 1.56 0.78 -0.19 0.04 0.00 0.32 -2.65 119.26 119.11 1bqd h ALA 242 Ca 0.13 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 1bqd h ALA 242 Cb 0.21 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1bqd h ALA 242 CO -0.00 0.56 -0.10 0.74 0.00 0.00 0.00 179.25 180.45 1bqd h PHE 243 N 0.88 0.47 -0.58 0.00 -1.00 -0.49 -3.18 116.94 113.04 1bqd h PHE 243 Ca 0.17 -0.12 0.11 0.00 2.81 0.00 0.00 57.97 60.95 1bqd h PHE 243 Cb 0.47 -0.11 -0.03 0.00 3.61 0.00 0.00 35.95 39.89 1bqd h PHE 243 CO 0.03 0.71 0.39 0.00 -1.61 0.00 0.00 178.31 177.84 1bqd h ALA 244 N 0.69 2.14 0.00 2.45 0.00 -0.78 -0.41 119.26 123.35 1bqd h ALA 244 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1bqd h ALA 244 Cb 0.59 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1bqd h ALA 244 CO 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.00 1bqd h ALA 245 N 1.71 1.00 0.00 0.00 0.00 -1.45 -3.30 119.26 117.21 1bqd h ALA 245 Ca 0.27 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.09 1bqd h ALA 245 Cb 0.67 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1bqd h ALA 245 CO -0.06 0.00 -1.69 -1.33 0.00 0.00 0.00 179.25 176.17 1bqd n MET 246 N -2.65 1.14 -3.58 0.00 2.81 -0.31 -5.04 117.12 109.49 1bqd n MET 246 Ca 0.03 -0.07 -0.25 0.00 -1.81 0.00 0.00 57.70 55.60 1bqd n MET 246 Cb 0.36 -1.30 -0.02 0.00 -0.71 0.00 0.00 33.22 31.54 1bqd n MET 246 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 1bqd s HIS 247 N -2.62 3.48 -0.16 2.03 3.76 -0.38 -4.99 115.29 116.41 1bqd s HIS 247 Ca -0.05 0.33 -0.05 0.00 -0.15 0.00 0.00 55.06 55.13 1bqd s HIS 247 Cb 0.06 -1.86 -0.23 0.00 1.11 0.00 0.00 32.58 31.66 1bqd s HIS 247 CO 0.51 0.27 0.19 1.63 -0.85 0.00 0.00 174.74 176.49 1bqd n LYS 248 N -1.21 0.72 -4.79 1.40 4.76 -1.26 -4.90 118.16 112.88 1bqd n LYS 248 Ca -0.05 0.24 -0.30 0.00 -2.87 0.00 0.00 58.31 55.33 1bqd n LYS 248 Cb 0.55 -1.66 -0.14 0.00 -1.84 0.00 0.00 35.03 31.94 1bqd n LYS 248 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1bqd s GLU 249 N -2.54 1.77 -0.15 1.97 2.02 -1.26 -2.63 118.70 117.88 1bqd s GLU 249 Ca -0.26 -1.14 -0.30 0.00 0.02 0.00 0.00 54.97 53.29 1bqd s GLU 249 Cb 0.07 -1.99 0.13 0.00 0.10 0.00 0.00 34.13 32.44 1bqd s GLU 249 CO 0.71 0.51 1.03 -1.17 0.02 0.00 0.00 175.26 176.36 1bqd s LEU 250 N -1.41 -0.33 -0.04 1.80 0.20 -0.63 -4.64 118.68 113.65 1bqd s LEU 250 Ca 0.13 0.29 0.03 0.00 0.69 0.00 0.00 54.13 55.27 1bqd s LEU 250 Cb -0.10 1.79 0.01 0.00 -0.43 0.00 0.00 46.19 47.45 1bqd s LEU 250 CO 0.03 -0.34 -0.11 -0.63 -0.29 0.00 0.00 176.35 175.01 1bqd s ILE 251 N -1.45 0.94 -0.09 6.68 1.01 -0.89 -0.01 121.20 127.39 1bqd s ILE 251 Ca 0.01 -0.42 0.02 0.00 0.00 0.00 0.00 60.65 60.26 1bqd s ILE 251 Cb -0.01 -0.84 0.01 0.00 0.01 0.00 0.00 42.46 41.64 1bqd s ILE 251 CO -0.01 0.29 -0.15 -0.69 0.00 0.00 0.00 174.94 174.38 1bqd s VAL 252 N 0.29 1.38 -0.37 2.92 1.01 0.50 -0.30 120.40 125.85 1bqd s VAL 252 Ca -0.06 -0.60 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 1bqd s VAL 252 Cb -0.11 -1.25 0.08 0.00 0.00 0.00 0.00 36.38 35.10 1bqd s VAL 252 CO 0.01 0.41 0.13 0.00 0.00 0.00 0.00 175.10 175.65 1bqd s ALA 253 N 0.76 3.03 0.18 5.51 0.00 0.50 0.42 121.76 132.16 1bqd s ALA 253 Ca -0.12 -2.23 0.06 0.00 0.00 0.00 0.00 51.96 49.67 1bqd s ALA 253 Cb -0.16 -2.23 -0.04 0.00 0.00 0.00 0.00 23.12 20.69 1bqd s ALA 253 CO 0.02 -1.59 0.13 -1.54 0.00 0.00 0.00 175.76 172.78 1bqd s SER 254 N 1.57 5.43 0.03 0.00 1.04 0.54 -1.30 113.70 121.02 1bqd s SER 254 Ca 0.03 -0.19 0.03 0.00 0.48 0.00 0.00 55.95 56.30 1bqd s SER 254 Cb -0.21 -1.38 -0.02 0.00 0.10 0.00 0.00 66.02 64.51 1bqd s SER 254 CO -0.03 0.05 -0.09 -0.55 0.98 0.00 0.00 173.24 173.60 1bqd s SER 255 N -3.23 1.09 -0.00 7.02 0.15 -0.94 -0.17 113.70 117.61 1bqd s SER 255 Ca 0.31 -0.41 0.05 0.00 0.70 0.00 0.00 55.95 56.60 1bqd s SER 255 Cb -0.09 -0.04 0.13 0.00 -1.71 0.00 0.00 66.02 64.31 1bqd s SER 255 CO 0.23 -0.05 1.11 -1.22 1.20 0.00 0.00 173.24 174.51 1bqd n TYR 256 N 1.98 0.20 0.15 3.44 4.01 -0.14 -4.72 117.16 122.07 1bqd n TYR 256 Ca -0.19 -0.51 0.01 0.00 -0.16 0.00 0.00 57.90 57.05 1bqd n TYR 256 Cb 0.56 -0.04 0.03 0.00 -0.31 0.00 0.00 39.34 39.57 1bqd n TYR 256 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1bqd n SER 257 N -0.09 0.00 0.00 7.72 7.64 -1.25 -2.38 113.62 125.25 1bqd n SER 257 Ca 0.05 -0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.82 1bqd n SER 257 Cb 0.33 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 1bqd n SER 257 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1bqd n ASN 259 N -0.74 0.00 -0.08 6.43 0.23 -1.26 -1.73 115.26 118.11 1bqd n ASN 259 Ca 0.01 0.00 0.01 0.00 -0.53 0.00 0.00 54.58 54.07 1bqd n ASN 259 Cb 0.00 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 37.71 1bqd n ASN 259 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1bqd n PHE 260 N 0.00 0.00 -2.43 -2.53 3.01 -1.00 -4.82 117.46 109.69 1bqd n PHE 260 Ca 0.00 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.26 1bqd n PHE 260 Cb 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.46 1bqd n PHE 260 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1bqd n GLY 261 N 0.19 -0.50 2.23 1.37 0.00 -1.08 -4.67 105.19 102.73 1bqd n GLY 261 Ca 0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.77 1bqd n GLY 261 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1bqd n LEU 262 N -3.03 6.93 -0.05 0.99 4.32 -0.71 -4.83 117.00 120.63 1bqd n LEU 262 Ca -0.23 -3.75 -0.01 0.00 -0.02 0.00 0.00 56.01 52.00 1bqd n LEU 262 Cb 0.68 -0.87 -0.01 0.00 -1.62 0.00 0.00 43.42 41.59 1bqd n LEU 262 CO 0.28 1.15 0.35 -1.22 -1.22 0.00 0.00 177.39 176.73 1bqd n TYR 263 N -1.05 -0.06 0.85 -1.77 4.01 -1.14 -1.60 117.16 116.40 1bqd n TYR 263 Ca 0.60 0.16 0.09 0.00 -0.16 0.00 0.00 57.90 58.59 1bqd n TYR 263 Cb 1.39 -0.39 0.46 0.00 -0.31 0.00 0.00 39.34 40.49 1bqd n TYR 263 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1bqd n ASN 264 N -3.10 0.00 -0.31 7.72 0.23 -1.26 -3.05 115.26 115.50 1bqd n ASN 264 Ca 0.00 0.09 0.14 0.00 -0.53 0.00 0.00 54.58 54.27 1bqd n ASN 264 Cb 0.03 -0.32 0.48 0.00 -2.08 0.00 0.00 39.78 37.89 1bqd n ASN 264 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1bqd n GLU 265 N -1.32 1.12 -3.24 -3.83 -0.58 -0.63 -4.99 120.64 107.17 1bqd n GLU 265 Ca 0.08 -0.61 -0.18 0.00 -0.42 0.00 0.00 57.16 56.03 1bqd n GLU 265 Cb 0.16 -1.49 0.01 0.00 -0.57 0.00 0.00 31.44 29.56 1bqd n GLU 265 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1bqd n ARG 266 N -0.40 -1.90 -4.06 3.49 5.12 -1.17 -4.48 116.66 113.25 1bqd n ARG 266 Ca 0.15 1.57 -0.32 0.00 -1.93 0.00 0.00 57.85 57.32 1bqd n ARG 266 Cb 0.33 -4.09 -0.15 0.00 -1.16 0.00 0.00 32.46 27.39 1bqd n ARG 266 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1bqd s VAL 267 N -2.43 2.06 0.34 1.55 1.01 -1.26 -2.71 120.40 118.96 1bqd s VAL 267 Ca 0.20 -1.42 -0.08 0.00 0.00 0.00 0.00 61.98 60.67 1bqd s VAL 267 Cb -0.04 -2.12 0.03 0.00 0.00 0.00 0.00 36.38 34.26 1bqd s VAL 267 CO 0.82 0.09 0.60 0.61 0.00 0.00 0.00 175.10 177.21 1bqd n GLY 268 N 4.51 1.57 3.25 4.51 0.00 -0.91 -0.97 105.19 117.15 1bqd n GLY 268 Ca -0.15 -1.40 -0.12 0.00 0.00 0.00 0.00 46.02 44.35 1bqd n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bqd s ALA 269 N -2.30 -0.71 -0.22 4.61 0.00 0.77 -1.33 121.76 122.57 1bqd s ALA 269 Ca 0.20 0.08 0.01 0.00 0.00 0.00 0.00 51.96 52.25 1bqd s ALA 269 Cb -0.03 0.27 0.05 0.00 0.00 0.00 0.00 23.12 23.41 1bqd s ALA 269 CO 0.15 -0.38 -0.08 0.00 0.00 0.00 0.00 175.76 175.45 1bqd s THR 271 N 1.37 4.43 -0.16 0.00 2.01 0.17 -1.46 115.64 122.00 1bqd s THR 271 Ca -0.04 -0.17 -0.05 0.00 0.31 0.00 0.00 61.69 61.74 1bqd s THR 271 Cb -0.18 -2.97 -0.03 0.00 0.01 0.00 0.00 72.50 69.33 1bqd s THR 271 CO -0.07 0.48 -0.00 -0.22 -0.69 0.00 0.00 174.62 174.12 1bqd s LEU 272 N 0.29 3.47 -0.11 4.42 0.20 -0.46 -0.37 118.68 126.11 1bqd s LEU 272 Ca 0.01 -0.03 0.02 0.00 0.69 0.00 0.00 54.13 54.82 1bqd s LEU 272 Cb -0.13 -1.85 0.01 0.00 -0.43 0.00 0.00 46.19 43.79 1bqd s LEU 272 CO 0.01 0.19 -0.19 -0.69 -0.29 0.00 0.00 176.35 175.39 1bqd s VAL 273 N 0.25 1.74 0.51 1.68 1.01 0.98 -1.90 120.40 124.68 1bqd s VAL 273 Ca -0.00 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.18 1bqd s VAL 273 Cb -0.13 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.69 1bqd s VAL 273 CO 0.02 0.49 0.01 0.00 0.00 0.00 0.00 175.10 175.62 1bqd s ALA 274 N 0.76 4.14 0.17 5.51 0.00 -0.78 -1.60 121.76 129.95 1bqd s ALA 274 Ca -0.10 -0.26 -0.10 0.00 0.00 0.00 0.00 51.96 51.50 1bqd s ALA 274 Cb -0.16 0.05 0.05 0.00 0.00 0.00 0.00 23.12 23.07 1bqd s ALA 274 CO 0.01 -0.03 1.62 0.00 0.00 0.00 0.00 175.76 177.37 1bqd h ALA 275 N 1.34 0.78 -2.86 0.00 0.00 -1.81 -3.43 119.26 113.27 1bqd h ALA 275 Ca -0.44 -0.31 -0.34 0.00 0.00 0.00 0.00 54.91 53.82 1bqd h ALA 275 Cb 1.32 -0.21 -0.11 0.00 0.00 0.00 0.00 17.79 18.79 1bqd h ALA 275 CO 0.73 0.63 -0.37 0.16 0.00 0.00 0.00 179.25 180.39 1bqd s ASP 276 N -6.54 1.06 0.08 0.00 1.47 -1.26 -4.99 116.67 106.50 1bqd s ASP 276 Ca -0.12 -1.56 -0.21 0.00 1.18 0.00 0.00 52.55 51.84 1bqd s ASP 276 Cb 0.13 0.57 -0.11 0.00 -0.34 0.00 0.00 42.92 43.17 1bqd s ASP 276 CO 0.85 -1.12 1.63 -1.28 0.68 0.00 0.00 175.17 175.93 1bqd h SER 277 N 2.20 0.17 -0.84 2.11 0.87 -1.77 -1.83 113.55 114.48 1bqd h SER 277 Ca -0.28 -0.14 0.04 0.00 -1.23 0.00 0.00 61.79 60.18 1bqd h SER 277 Cb 1.24 -0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 63.10 1bqd h SER 277 CO 0.40 0.27 0.53 -0.08 -0.53 0.00 0.00 176.83 177.42 1bqd h GLU 278 N 0.07 1.00 -0.17 2.24 4.22 -1.96 -1.41 114.58 118.57 1bqd h GLU 278 Ca 0.04 -0.06 -0.03 0.00 0.08 0.00 0.00 59.36 59.39 1bqd h GLU 278 Cb 0.14 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1bqd h GLU 278 CO -0.00 0.66 -0.01 1.15 -2.18 0.00 0.00 179.01 178.63 1bqd h THR 279 N 1.03 1.26 -0.54 0.32 2.02 -1.95 -2.04 112.91 113.01 1bqd h THR 279 Ca 0.34 -0.89 -0.06 0.00 0.77 0.00 0.00 66.41 66.57 1bqd h THR 279 Cb 0.03 1.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.94 1bqd h THR 279 CO -0.12 0.27 0.08 1.62 0.37 0.00 0.00 175.52 177.73 1bqd h VAL 280 N 0.04 1.24 -0.05 3.16 3.04 -1.14 -0.80 116.25 121.72 1bqd h VAL 280 Ca 0.05 -0.91 -0.00 0.00 -1.01 0.00 0.00 66.70 64.82 1bqd h VAL 280 Cb 0.41 0.74 -0.00 0.00 -2.01 0.00 0.00 31.29 30.42 1bqd h VAL 280 CO 0.01 0.33 0.02 0.44 -1.01 0.00 0.00 177.57 177.36 1bqd h ASP 281 N 0.81 0.07 -0.71 3.17 3.32 -1.23 0.35 116.42 122.20 1bqd h ASP 281 Ca 0.17 -0.19 0.01 0.00 0.02 0.00 0.00 57.03 57.04 1bqd h ASP 281 Cb 0.37 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.86 1bqd h ASP 281 CO 0.01 0.24 0.47 -0.09 -1.72 0.00 0.00 179.24 178.15 1bqd h ARG 282 N -0.10 0.93 -0.20 3.56 2.43 -1.20 -2.35 114.38 117.45 1bqd h ARG 282 Ca 0.02 -0.06 -0.15 0.00 -0.81 0.00 0.00 59.98 58.98 1bqd h ARG 282 Cb 0.19 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1bqd h ARG 282 CO -0.00 0.61 -0.50 0.00 -1.51 0.00 0.00 179.97 178.58 1bqd h ALA 283 N 1.26 0.75 -0.30 2.80 0.00 -0.97 -3.14 119.26 119.67 1bqd h ALA 283 Ca 0.26 -0.49 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 1bqd h ALA 283 Cb -0.10 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1bqd h ALA 283 CO -0.06 0.67 -0.00 0.35 0.00 0.00 0.00 179.25 180.21 1bqd h PHE 284 N 0.44 0.47 -0.54 0.00 3.57 0.02 -2.50 116.94 118.40 1bqd h PHE 284 Ca 0.02 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 1bqd h PHE 284 Cb 1.02 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.60 1bqd h PHE 284 CO 0.04 0.47 0.30 0.66 -2.23 0.00 0.00 178.31 177.55 1bqd h SER 285 N 0.44 0.65 1.34 0.41 4.64 -1.38 0.64 113.55 120.30 1bqd h SER 285 Ca 0.10 -0.04 -0.04 0.00 -0.47 0.00 0.00 61.79 61.33 1bqd h SER 285 Cb 0.30 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 1bqd h SER 285 CO 0.01 0.53 -0.21 1.56 -0.87 0.00 0.00 176.83 177.85 1bqd h GLN 286 N 0.75 0.00 -0.01 4.77 1.08 -1.54 -1.71 115.11 118.45 1bqd h GLN 286 Ca 0.19 0.00 -0.21 0.00 -1.45 0.00 0.00 58.65 57.18 1bqd h GLN 286 Cb 0.01 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.44 1bqd h GLN 286 CO -0.03 0.21 -0.90 1.98 -0.95 0.00 0.00 178.83 179.14 1bqd h MET 287 N 0.00 0.37 -0.31 1.46 4.05 -0.77 -2.54 114.93 117.18 1bqd h MET 287 Ca -0.00 -0.38 -0.16 0.00 -0.28 0.00 0.00 59.70 58.88 1bqd h MET 287 Cb 0.93 0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 31.83 1bqd h MET 287 CO 0.03 1.05 -0.44 0.87 0.23 0.00 0.00 176.91 178.65 1bqd h LYS 288 N 0.21 0.81 -0.96 0.39 1.57 -0.72 -2.38 116.57 115.50 1bqd h LYS 288 Ca -0.06 -0.45 0.03 0.00 -1.87 0.00 0.00 60.65 58.29 1bqd h LYS 288 Cb 1.52 0.03 -0.05 0.00 0.08 0.00 0.00 32.23 33.81 1bqd h LYS 288 CO 0.15 1.08 0.63 0.00 -0.57 0.00 0.00 179.45 180.75 1bqd h ALA 289 N 0.84 1.36 -0.27 3.86 0.00 -1.26 0.86 119.26 124.66 1bqd h ALA 289 Ca 0.04 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1bqd h ALA 289 Cb 1.02 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1bqd h ALA 289 CO 0.10 0.56 -0.15 0.00 0.00 0.00 0.00 179.25 179.76 1bqd h ALA 290 N 1.43 1.24 -0.11 0.00 0.00 -1.17 -2.41 119.26 118.24 1bqd h ALA 290 Ca 0.37 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 1bqd h ALA 290 Cb -0.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1bqd h ALA 290 CO -0.10 0.49 -0.29 0.82 0.00 0.00 0.00 179.25 180.17 1bqd h ILE 291 N 0.42 1.38 -0.71 0.00 2.04 -0.75 -2.97 117.51 116.93 1bqd h ILE 291 Ca 0.08 -1.60 0.10 0.00 1.00 0.00 0.00 64.86 64.44 1bqd h ILE 291 Cb 0.52 2.12 -0.05 0.00 -0.74 0.00 0.00 36.82 38.67 1bqd h ILE 291 CO 0.03 0.47 0.47 -0.09 0.00 0.00 0.00 178.15 179.03 1bqd h ARG 292 N -0.03 0.55 -0.00 2.37 9.65 -0.71 0.14 114.38 126.35 1bqd h ARG 292 Ca -0.00 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 1bqd h ARG 292 Cb 0.90 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 29.35 1bqd h ARG 292 CO 0.06 0.36 -0.07 0.00 2.80 0.00 0.00 179.97 183.13 1bqd n ALA 293 N -2.48 2.67 -1.18 2.80 0.00 -0.92 -3.76 120.51 117.63 1bqd n ALA 293 Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1bqd n ALA 293 Cb 0.37 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1bqd n ALA 293 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1bqd n ASN 294 N -1.07 0.00 -0.23 0.00 2.85 0.44 -4.92 115.26 112.33 1bqd n ASN 294 Ca 0.15 0.00 0.02 0.00 -0.11 0.00 0.00 54.58 54.64 1bqd n ASN 294 Cb 0.26 0.00 0.04 0.00 1.24 0.00 0.00 39.78 41.32 1bqd n ASN 294 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1bqd n TYR 295 N -1.15 0.11 0.00 1.20 0.18 -0.90 -5.04 117.16 111.56 1bqd n TYR 295 Ca 0.00 -0.29 0.00 0.00 1.88 0.00 0.00 57.90 59.49 1bqd n TYR 295 Cb 0.00 -0.02 0.00 0.00 -0.38 0.00 0.00 39.34 38.94 1bqd n TYR 295 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 1bqd n SER 296 N 0.07 0.00 -3.55 9.48 2.88 -0.89 -4.77 113.62 116.83 1bqd n SER 296 Ca 0.04 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.46 1bqd n SER 296 Cb 0.23 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.65 1bqd n SER 296 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1bqd s ASN 297 N 0.00 -0.39 0.55 -3.46 2.20 -1.26 -4.26 114.94 108.32 1bqd s ASN 297 Ca 0.00 -0.09 -0.09 0.00 -0.94 0.00 0.00 52.86 51.74 1bqd s ASN 297 Cb 0.00 0.52 -0.04 0.00 -2.00 0.00 0.00 41.25 39.72 1bqd s ASN 297 CO 0.00 -0.85 0.92 -2.16 -2.94 0.00 0.00 177.10 172.07 1bqd s PRO 298 N -3.41 3.60 -0.04 3.55 0.04 -1.26 -5.03 135.00 132.45 1bqd s PRO 298 Ca 0.00 0.53 -0.30 0.00 0.04 0.00 0.00 61.00 61.27 1bqd s PRO 298 Cb 0.00 -2.22 -0.05 0.00 0.04 0.00 0.00 34.50 32.28 1bqd s PRO 298 CO -0.09 -0.38 1.38 -1.25 0.04 0.00 0.00 177.00 176.69 1bqd s PRO 299 N -4.88 4.27 -0.02 0.56 0.04 -1.26 -4.76 135.00 128.96 1bqd s PRO 299 Ca 0.52 1.90 -0.24 0.00 0.04 0.00 0.00 61.00 63.22 1bqd s PRO 299 Cb -0.11 -3.65 -0.20 0.00 0.04 0.00 0.00 34.50 30.59 1bqd s PRO 299 CO 0.48 -0.61 1.20 0.00 0.04 0.00 0.00 177.00 178.11 1bqd h ALA 300 N 8.03 0.08 -0.90 8.56 0.00 -1.96 -3.38 119.26 129.68 1bqd h ALA 300 Ca -0.36 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1bqd h ALA 300 Cb 1.16 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1bqd h ALA 300 CO 0.92 -0.03 0.00 1.58 0.00 0.00 0.00 179.25 181.72 1bqd n HIS 301 N -4.64 0.00 -0.16 0.00 -0.00 -1.26 -0.26 115.22 108.90 1bqd n HIS 301 Ca -0.08 0.00 -0.04 0.00 -0.00 0.00 0.00 57.72 57.60 1bqd n HIS 301 Cb 0.37 -0.24 0.03 0.00 -0.00 0.00 0.00 29.99 30.15 1bqd n HIS 301 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.34 177.12 1bqd h GLY 302 N 0.00 0.19 1.75 1.57 0.00 -1.78 -1.18 103.07 103.62 1bqd h GLY 302 Ca 0.00 0.26 -0.05 0.00 0.00 0.00 0.00 47.33 47.53 1bqd h GLY 302 CO 0.00 -0.21 -0.12 0.00 0.00 0.00 0.00 176.54 176.21 1bqd h ALA 303 N 1.30 1.44 -0.54 3.60 0.00 -1.64 -1.88 119.26 121.54 1bqd h ALA 303 Ca 0.24 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 1bqd h ALA 303 Cb 0.45 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1bqd h ALA 303 CO -0.56 0.39 -0.11 0.77 0.00 0.00 0.00 179.25 179.74 1bqd h SER 304 N 0.30 1.02 -0.41 0.00 0.02 0.37 -1.08 113.55 113.76 1bqd h SER 304 Ca 0.06 -0.33 -0.02 0.00 -0.84 0.00 0.00 61.79 60.66 1bqd h SER 304 Cb 0.39 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.64 1bqd h SER 304 CO 0.02 1.13 0.20 0.58 -1.14 0.00 0.00 176.83 177.61 1bqd h VAL 305 N 0.90 1.18 -0.55 2.27 2.07 -0.72 -1.38 116.25 120.02 1bqd h VAL 305 Ca 0.14 -0.50 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 1bqd h VAL 305 Cb 0.67 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 1bqd h VAL 305 CO 0.05 0.19 0.30 0.58 0.02 0.00 0.00 177.57 178.71 1bqd h VAL 306 N 0.52 1.18 -0.22 2.57 2.07 -1.09 -2.19 116.25 119.10 1bqd h VAL 306 Ca 0.14 -0.47 -0.09 0.00 0.82 0.00 0.00 66.70 67.11 1bqd h VAL 306 Cb 0.12 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1bqd h VAL 306 CO -0.02 0.20 -0.24 0.00 0.02 0.00 0.00 177.57 177.53 1bqd h ALA 307 N 1.13 1.19 -0.08 1.67 0.00 -1.02 -1.28 119.26 120.87 1bqd h ALA 307 Ca 0.19 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1bqd h ALA 307 Cb 0.05 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1bqd h ALA 307 CO -0.03 0.52 -0.03 1.15 0.00 0.00 0.00 179.25 180.86 1bqd h THR 308 N 0.36 1.30 0.49 0.00 2.02 -1.02 -2.28 112.91 113.78 1bqd h THR 308 Ca 0.06 -0.97 -0.02 0.00 0.77 0.00 0.00 66.41 66.24 1bqd h THR 308 Cb 0.62 1.78 0.00 0.00 -1.74 0.00 0.00 68.15 68.81 1bqd h THR 308 CO 0.04 0.27 -0.23 0.40 0.37 0.00 0.00 175.52 176.37 1bqd h ILE 309 N -0.18 0.49 -0.09 3.11 2.04 -1.33 -2.37 117.51 119.18 1bqd h ILE 309 Ca 0.02 -0.24 0.03 0.00 1.00 0.00 0.00 64.86 65.67 1bqd h ILE 309 Cb 0.44 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 37.11 1bqd h ILE 309 CO 0.01 0.04 0.11 -0.07 0.00 0.00 0.00 178.15 178.24 1bqd h LEU 310 N -0.80 0.00 -0.78 1.44 3.38 -1.30 -1.96 115.31 115.29 1bqd h LEU 310 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1bqd h LEU 310 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1bqd h LEU 310 CO 0.11 0.00 -0.58 -1.54 0.09 0.00 0.00 178.44 176.51 1bqd n SER 311 N -3.73 1.79 -4.34 -0.43 3.41 -0.86 -4.84 113.62 104.62 1bqd n SER 311 Ca -0.01 -1.39 -0.37 0.00 -0.26 0.00 0.00 58.87 56.84 1bqd n SER 311 Cb 0.21 0.58 -0.12 0.00 -0.26 0.00 0.00 64.21 64.62 1bqd n SER 311 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1bqd s ASN 312 N -2.59 5.17 0.24 4.04 3.84 -0.74 -5.00 114.94 119.89 1bqd s ASN 312 Ca 0.16 -0.73 -0.08 0.00 0.21 0.00 0.00 52.86 52.43 1bqd s ASN 312 Cb 0.18 -1.89 0.41 0.00 -0.55 0.00 0.00 41.25 39.40 1bqd s ASN 312 CO 0.64 -0.20 1.65 0.44 -2.79 0.00 0.00 177.10 176.83 1bqd h ASP 313 N 8.24 -0.27 0.20 -4.21 3.32 -1.88 0.37 116.42 122.19 1bqd h ASP 313 Ca -0.31 0.18 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 1bqd h ASP 313 Cb 1.12 0.30 0.00 0.00 0.22 0.00 0.00 39.33 40.98 1bqd h ASP 313 CO 0.60 -0.14 -0.09 0.00 -1.72 0.00 0.00 179.24 177.89 1bqd h ALA 314 N 1.65 -0.26 -0.93 3.45 0.00 -1.94 -2.57 119.26 118.65 1bqd h ALA 314 Ca 0.39 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1bqd h ALA 314 Cb 0.67 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 1bqd h ALA 314 CO -0.60 -0.54 0.57 -0.07 0.00 0.00 0.00 179.25 178.60 1bqd h LEU 315 N -0.47 1.11 -1.18 0.00 3.38 -1.73 -2.27 115.31 114.14 1bqd h LEU 315 Ca -0.03 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1bqd h LEU 315 Cb 0.36 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1bqd h LEU 315 CO 0.04 0.85 0.34 -0.09 0.09 0.00 0.00 178.44 179.68 1bqd h ARG 316 N 1.28 0.91 -0.24 1.13 2.43 -0.85 -0.02 114.38 119.02 1bqd h ARG 316 Ca 0.34 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.39 1bqd h ARG 316 Cb -0.07 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.29 1bqd h ARG 316 CO -0.06 0.68 0.10 0.00 -1.51 0.00 0.00 179.97 179.17 1bqd h ALA 317 N 1.47 0.31 -0.81 2.80 0.00 -1.00 -0.27 119.26 121.76 1bqd h ALA 317 Ca 0.23 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1bqd h ALA 317 Cb 0.05 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1bqd h ALA 317 CO -0.04 -0.09 0.47 0.82 0.00 0.00 0.00 179.25 180.41 1bqd h ILE 318 N 0.24 1.23 -0.37 0.00 2.04 -0.96 -2.46 117.51 117.24 1bqd h ILE 318 Ca 0.08 -0.54 -0.08 0.00 1.00 0.00 0.00 64.86 65.32 1bqd h ILE 318 Cb 0.18 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.37 1bqd h ILE 318 CO -0.01 0.25 -0.07 -0.25 0.00 0.00 0.00 178.15 178.08 1bqd h TRP 319 N 1.12 0.78 -0.86 1.37 7.01 -0.75 -1.91 115.95 122.71 1bqd h TRP 319 Ca 0.29 -0.16 0.07 0.00 2.11 0.00 0.00 58.89 61.19 1bqd h TRP 319 Cb -0.01 -0.19 -0.06 0.00 -2.10 0.00 0.00 29.16 26.80 1bqd h TRP 319 CO -0.00 0.84 0.56 0.93 -2.79 0.00 0.00 178.44 177.97 1bqd h GLU 320 N 0.50 0.92 -0.34 2.65 5.08 -0.87 0.25 114.58 122.77 1bqd h GLU 320 Ca 0.10 -0.06 -0.16 0.00 -1.00 0.00 0.00 59.36 58.24 1bqd h GLU 320 Cb 0.57 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1bqd h GLU 320 CO 0.03 0.61 -0.42 0.37 -1.00 0.00 0.00 179.01 178.60 1bqd h GLN 321 N 0.95 0.84 -0.62 2.33 5.75 -1.26 -0.82 115.11 122.28 1bqd h GLN 321 Ca 0.37 -0.45 -0.08 0.00 -0.15 0.00 0.00 58.65 58.34 1bqd h GLN 321 Cb 0.23 0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.78 1bqd h GLN 321 CO -0.14 1.09 0.07 0.93 -2.65 0.00 0.00 178.83 178.14 1bqd h GLU 322 N 0.68 1.02 -0.49 1.69 5.08 -0.37 -0.92 114.58 121.27 1bqd h GLU 322 Ca 0.05 -0.28 -0.05 0.00 -1.00 0.00 0.00 59.36 58.08 1bqd h GLU 322 Cb 0.99 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 1bqd h GLU 322 CO 0.10 0.96 0.10 1.25 -1.00 0.00 0.00 179.01 180.41 1bqd h LEU 323 N 0.95 0.76 -0.75 1.33 5.85 -0.39 -2.29 115.31 120.78 1bqd h LEU 323 Ca 0.19 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.67 1bqd h LEU 323 Cb 0.46 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 1bqd h LEU 323 CO 0.02 0.82 0.49 0.74 -0.34 0.00 0.00 178.44 180.16 1bqd h THR 324 N 0.68 1.17 -0.84 1.05 2.02 -0.80 -1.11 112.91 115.08 1bqd h THR 324 Ca 0.15 -0.34 -0.00 0.00 0.77 0.00 0.00 66.41 66.99 1bqd h THR 324 Cb 0.36 0.10 -0.04 0.00 -1.74 0.00 0.00 68.15 66.83 1bqd h THR 324 CO 0.01 0.18 0.50 0.44 0.37 0.00 0.00 175.52 177.02 1bqd h ASP 325 N 0.99 1.00 0.13 4.18 3.32 -0.91 0.40 116.42 125.53 1bqd h ASP 325 Ca 0.28 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.27 1bqd h ASP 325 Cb -0.08 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.22 1bqd h ASP 325 CO -0.07 0.77 -0.06 0.24 -1.72 0.00 0.00 179.24 178.39 1bqd h MET 326 N 1.15 -0.17 -0.72 3.56 2.86 -0.82 -1.30 114.93 119.48 1bqd h MET 326 Ca 0.30 0.01 0.08 0.00 -2.06 0.00 0.00 59.70 58.03 1bqd h MET 326 Cb -0.05 0.04 -0.06 0.00 0.06 0.00 0.00 31.60 31.59 1bqd h MET 326 CO -0.06 0.13 0.39 -0.09 1.06 0.00 0.00 176.91 178.35 1bqd h ARG 327 N -0.49 0.67 -0.21 1.72 2.43 -0.95 -1.95 114.38 115.60 1bqd h ARG 327 Ca -0.02 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.01 1bqd h ARG 327 Cb 0.39 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1bqd h ARG 327 CO 0.03 0.44 -0.30 1.96 -1.51 0.00 0.00 179.97 180.59 1bqd h GLN 328 N 0.69 0.41 -0.64 0.20 4.20 -0.86 -2.19 115.11 116.92 1bqd h GLN 328 Ca 0.34 -0.16 0.01 0.00 0.06 0.00 0.00 58.65 58.89 1bqd h GLN 328 Cb 0.28 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 1bqd h GLN 328 CO -0.22 0.67 0.42 0.00 -0.67 0.00 0.00 178.83 179.03 1bqd h ARG 329 N 0.36 0.83 0.16 1.46 2.47 -0.47 -1.19 114.38 118.00 1bqd h ARG 329 Ca 0.05 -0.05 -0.01 0.00 -1.26 0.00 0.00 59.98 58.71 1bqd h ARG 329 Cb 0.71 -0.19 0.00 0.00 -1.65 0.00 0.00 29.97 28.84 1bqd h ARG 329 CO 0.05 0.55 -0.08 0.82 0.56 0.00 0.00 179.97 181.88 1bqd h ILE 330 N 0.86 0.92 -0.38 2.04 2.04 -1.16 -0.49 117.51 121.34 1bqd h ILE 330 Ca 0.24 -0.35 0.02 0.00 1.00 0.00 0.00 64.86 65.77 1bqd h ILE 330 Cb -0.09 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 1bqd h ILE 330 CO -0.06 0.08 0.25 1.56 0.00 0.00 0.00 178.15 179.99 1bqd h GLN 331 N -0.39 0.41 -0.19 2.37 4.20 -1.27 -1.02 115.11 119.22 1bqd h GLN 331 Ca -0.02 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.62 1bqd h GLN 331 Cb 0.30 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1bqd h GLN 331 CO 0.04 0.27 -0.06 0.00 -0.67 0.00 0.00 178.83 178.41 1bqd h ARG 332 N 0.42 0.38 -0.66 1.46 -0.00 -0.95 -2.51 114.38 112.51 1bqd h ARG 332 Ca 0.15 -0.15 -0.03 0.00 -0.50 0.00 0.00 59.98 59.45 1bqd h ARG 332 Cb 0.09 -0.02 -0.03 0.00 0.00 0.00 0.00 29.97 30.00 1bqd h ARG 332 CO -0.03 0.64 0.30 0.52 0.00 0.00 0.00 179.97 181.40 1bqd h MET 333 N 0.09 0.95 -0.28 0.04 2.86 -0.14 0.66 114.93 119.11 1bqd h MET 333 Ca 0.05 -0.13 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1bqd h MET 333 Cb 0.51 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 1bqd h MET 333 CO 0.02 0.75 0.10 0.00 1.06 0.00 0.00 176.91 178.83 1bqd h ARG 334 N 0.94 0.44 -0.05 1.72 3.08 -1.18 0.96 114.38 120.29 1bqd h ARG 334 Ca 0.23 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 1bqd h ARG 334 Cb 0.12 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 1bqd h ARG 334 CO -0.03 0.49 0.02 0.37 -1.07 0.00 0.00 179.97 179.75 1bqd h GLN 335 N 0.30 0.08 -0.29 0.04 -0.00 -1.11 -2.15 115.11 111.98 1bqd h GLN 335 Ca 0.09 -0.01 -0.03 0.00 -0.00 0.00 0.00 58.65 58.70 1bqd h GLN 335 Cb 0.23 -0.01 -0.02 0.00 0.00 0.00 0.00 27.48 27.68 1bqd h GLN 335 CO -0.00 0.18 0.06 1.25 0.00 0.00 0.00 178.83 180.31 1bqd h LEU 336 N -0.04 0.38 0.14 -2.39 5.85 -0.77 -1.88 115.31 116.58 1bqd h LEU 336 Ca 0.02 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 1bqd h LEU 336 Cb 0.13 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1bqd h LEU 336 CO -0.00 0.40 -0.07 0.15 -0.34 0.00 0.00 178.44 178.58 1bqd h PHE 337 N 0.41 -0.17 -0.54 1.25 3.57 -0.52 -0.81 116.94 120.13 1bqd h PHE 337 Ca 0.10 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.61 1bqd h PHE 337 Cb 0.19 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.95 1bqd h PHE 337 CO 0.01 0.11 0.35 0.28 -2.23 0.00 0.00 178.31 176.82 1bqd h VAL 338 N -0.45 1.11 -0.07 1.41 2.07 -1.20 -2.24 116.25 116.88 1bqd h VAL 338 Ca -0.02 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 1bqd h VAL 338 Cb 0.36 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1bqd h VAL 338 CO 0.03 0.13 0.03 0.78 0.02 0.00 0.00 177.57 178.56 1bqd h ASN 339 N 0.70 0.09 0.12 0.57 -0.26 -1.31 -1.72 115.58 113.78 1bqd h ASN 339 Ca 0.21 -0.12 -0.03 0.00 -0.56 0.00 0.00 56.30 55.80 1bqd h ASN 339 Cb -0.04 -0.02 -0.00 0.00 -1.06 0.00 0.00 38.32 37.19 1bqd h ASN 339 CO -0.06 0.18 -0.13 0.74 -1.06 0.00 0.00 177.43 177.10 1bqd h THR 340 N -0.01 1.09 0.16 2.81 2.02 -1.03 -0.79 112.91 117.17 1bqd h THR 340 Ca 0.02 -0.44 -0.01 0.00 0.77 0.00 0.00 66.41 66.76 1bqd h THR 340 Cb 0.12 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1bqd h THR 340 CO -0.00 0.12 -0.08 -0.07 0.37 0.00 0.00 175.52 175.86 1bqd h LEU 341 N 0.00 -0.18 -0.77 2.58 4.07 -1.25 -1.02 115.31 118.74 1bqd h LEU 341 Ca -0.00 -0.33 0.15 0.00 0.08 0.00 0.00 57.88 57.78 1bqd h LEU 341 Cb 0.22 0.05 -0.10 0.00 1.08 0.00 0.00 40.66 41.91 1bqd h LEU 341 CO 0.02 0.28 0.31 1.56 -1.08 0.00 0.00 178.44 179.54 1bqd h GLN 342 N -0.71 0.44 0.00 1.13 7.50 -0.84 0.63 115.11 123.26 1bqd h GLN 342 Ca -0.02 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.10 1bqd h GLN 342 Cb 0.51 -0.10 0.00 0.00 0.05 0.00 0.00 27.48 27.94 1bqd h GLN 342 CO 0.04 0.29 -0.13 1.05 -1.50 0.00 0.00 178.83 178.57 1bqd h GLU 343 N 0.45 0.00 -0.00 1.46 4.11 -1.15 -3.17 114.58 116.28 1bqd h GLU 343 Ca 0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.86 1bqd h GLU 343 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1bqd h GLU 343 CO -0.41 0.00 -0.03 1.63 0.07 0.00 0.00 179.01 180.27 1bqd n LYS 344 N -2.29 0.85 -0.39 1.06 4.01 0.12 -4.86 118.16 116.66 1bqd n LYS 344 Ca 0.05 -0.16 0.00 0.00 -0.51 0.00 0.00 58.31 57.69 1bqd n LYS 344 Cb 0.44 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.46 1bqd n LYS 344 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1bqd n GLY 345 N 1.16 1.37 3.69 0.72 0.00 -1.03 -4.99 105.19 106.11 1bqd n GLY 345 Ca 0.19 -0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1bqd n GLY 345 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bqd s ALA 346 N -2.08 3.73 0.03 4.61 0.00 -0.60 -4.93 121.76 122.52 1bqd s ALA 346 Ca 0.00 1.33 -0.25 0.00 0.00 0.00 0.00 51.96 53.04 1bqd s ALA 346 Cb 0.00 -3.72 -0.14 0.00 0.00 0.00 0.00 23.12 19.27 1bqd s ALA 346 CO 0.00 -1.12 1.29 -0.97 0.00 0.00 0.00 175.76 174.96 1bqd h ASN 347 N 8.26 -0.75 -3.71 0.00 -1.24 -1.94 -3.47 115.58 112.73 1bqd h ASN 347 Ca -0.44 0.03 -0.46 0.00 0.71 0.00 0.00 56.30 56.14 1bqd h ASN 347 Cb 1.21 0.19 0.08 0.00 0.73 0.00 0.00 38.32 40.53 1bqd h ASN 347 CO 0.94 -0.51 0.22 -0.13 -1.29 0.00 0.00 177.43 176.66 1bqd s ARG 348 N -4.81 2.21 -0.34 6.67 0.52 -1.26 -5.06 118.95 116.88 1bqd s ARG 348 Ca -0.13 -0.27 -0.17 0.00 -0.52 0.00 0.00 55.73 54.64 1bqd s ARG 348 Cb 0.01 -2.18 -0.01 0.00 0.52 0.00 0.00 34.95 33.29 1bqd s ARG 348 CO 0.39 -1.22 0.44 0.34 0.02 0.00 0.00 175.30 175.27 1bqd s ASP 349 N -4.51 6.26 0.00 0.23 2.15 -1.26 -4.92 116.67 114.62 1bqd s ASP 349 Ca 0.60 -0.10 0.19 0.00 0.43 0.00 0.00 52.55 53.67 1bqd s ASP 349 Cb -0.11 -2.24 0.28 0.00 -0.30 0.00 0.00 42.92 40.56 1bqd s ASP 349 CO 0.44 -0.41 1.22 0.49 -0.17 0.00 0.00 175.17 176.75 1bqd n PHE 350 N 5.57 0.27 0.31 -5.34 3.01 -1.26 -4.61 117.46 115.41 1bqd n PHE 350 Ca -0.07 -0.17 0.09 0.00 1.01 0.00 0.00 57.45 58.31 1bqd n PHE 350 Cb 0.49 -0.00 0.47 0.00 -0.01 0.00 0.00 39.48 40.42 1bqd n PHE 350 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1bqd h SER 351 N 3.68 0.00 0.64 4.37 4.64 -1.93 0.26 113.55 125.20 1bqd h SER 351 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1bqd h SER 351 Cb 0.83 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.92 1bqd h SER 351 CO 0.00 0.00 -0.03 2.19 -0.87 0.00 0.00 176.83 178.12 1bqd h PHE 352 N 0.00 0.00 -0.04 4.77 -5.15 -1.96 -2.38 116.94 112.18 1bqd h PHE 352 Ca 0.00 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.76 1bqd h PHE 352 Cb 1.15 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.32 1bqd h PHE 352 CO 0.00 0.03 -0.00 0.82 -2.00 0.00 0.00 178.31 177.16 1bqd h ILE 353 N 0.00 1.03 0.00 0.88 1.08 -0.86 -1.44 117.51 118.21 1bqd h ILE 353 Ca -0.00 -0.11 0.00 0.00 -0.39 0.00 0.00 64.86 64.36 1bqd h ILE 353 Cb 0.36 1.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.11 1bqd h ILE 353 CO 0.00 0.04 0.00 0.40 -0.69 0.00 0.00 178.15 177.90 1bqd h ILE 354 N 0.05 0.00 -0.02 -0.67 1.08 -1.62 -3.16 117.51 113.18 1bqd h ILE 354 Ca 0.01 -0.57 0.00 0.00 -0.39 0.00 0.00 64.86 63.92 1bqd h ILE 354 Cb 0.04 1.51 0.00 0.00 -3.07 0.00 0.00 36.82 35.30 1bqd h ILE 354 CO 0.00 0.00 -0.17 0.29 -0.69 0.00 0.00 178.15 177.58 1bqd n LYS 355 N -2.60 1.50 -3.92 2.37 5.02 -0.54 -4.92 118.16 115.07 1bqd n LYS 355 Ca 0.04 -1.06 -0.35 0.00 -2.02 0.00 0.00 58.31 54.92 1bqd n LYS 355 Cb 0.40 -1.48 -0.05 0.00 -0.02 0.00 0.00 35.03 33.87 1bqd n LYS 355 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1bqd s GLN 356 N -2.23 3.41 -0.07 1.97 -0.21 -1.20 -4.90 119.66 116.44 1bqd s GLN 356 Ca 0.28 -0.25 -0.05 0.00 0.02 0.00 0.00 55.36 55.36 1bqd s GLN 356 Cb 0.20 -3.11 -0.04 0.00 1.00 0.00 0.00 33.01 31.05 1bqd s GLN 356 CO 0.43 0.72 0.15 -0.80 -2.12 0.00 0.00 175.29 173.66 1bqd s ASN 357 N -1.54 6.28 0.00 5.90 0.01 0.16 -5.00 114.94 120.76 1bqd s ASN 357 Ca 0.22 0.38 0.00 0.00 -0.71 0.00 0.00 52.86 52.75 1bqd s ASN 357 Cb -0.12 -1.98 0.00 0.00 0.41 0.00 0.00 41.25 39.55 1bqd s ASN 357 CO 0.12 0.34 0.00 0.61 -1.51 0.00 0.00 177.10 176.66 1bqd n GLY 358 N 1.53 -1.79 0.16 0.66 0.00 -1.26 -4.39 105.19 100.11 1bqd n GLY 358 Ca -0.16 -1.93 0.07 0.00 0.00 0.00 0.00 46.02 44.00 1bqd n GLY 358 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1bqd h MET 359 N 0.00 0.00 -6.29 1.61 2.86 -1.93 -3.47 114.93 107.71 1bqd h MET 359 Ca 0.00 0.00 -0.64 0.00 -2.06 0.00 0.00 59.70 57.00 1bqd h MET 359 Cb 0.00 0.00 -0.11 0.00 0.06 0.00 0.00 31.60 31.55 1bqd h MET 359 CO 0.00 0.23 -0.64 -0.06 1.06 0.00 0.00 176.91 177.50 1bqd s PHE 360 N -3.10 3.05 -0.12 -0.22 0.08 -1.26 -1.19 117.98 115.22 1bqd s PHE 360 Ca 0.04 -0.00 -0.30 0.00 0.12 0.00 0.00 56.93 56.79 1bqd s PHE 360 Cb 0.07 -1.55 0.10 0.00 -0.57 0.00 0.00 43.02 41.07 1bqd s PHE 360 CO 0.73 0.50 0.87 -1.12 -0.10 0.00 0.00 175.22 176.09 1bqd s SER 361 N -2.39 -0.49 -0.42 1.36 0.01 -1.12 -3.67 113.70 106.97 1bqd s SER 361 Ca 0.27 0.57 -0.20 0.00 1.31 0.00 0.00 55.95 57.90 1bqd s SER 361 Cb -0.12 0.44 0.02 0.00 0.21 0.00 0.00 66.02 66.57 1bqd s SER 361 CO 0.20 -0.44 0.61 -0.36 0.41 0.00 0.00 173.24 173.66 1bqd s PHE 362 N -1.06 3.10 -0.08 2.43 0.08 -1.26 -0.98 117.98 120.21 1bqd s PHE 362 Ca -0.05 -0.02 0.27 0.00 0.12 0.00 0.00 56.93 57.25 1bqd s PHE 362 Cb -0.01 -3.24 1.37 0.00 -0.57 0.00 0.00 43.02 40.58 1bqd s PHE 362 CO 0.05 -0.79 1.83 0.66 -0.10 0.00 0.00 175.22 176.86 1bqd h SER 363 N 8.77 0.00 0.00 1.36 4.64 -1.57 -3.46 113.55 123.30 1bqd h SER 363 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1bqd h SER 363 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1bqd h SER 363 CO 0.86 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.43 1bqd n GLY 364 N -0.87 0.44 3.85 -0.77 0.00 -1.26 -5.03 105.19 101.54 1bqd n GLY 364 Ca -0.01 -0.75 -0.32 0.00 0.00 0.00 0.00 46.02 44.94 1bqd n GLY 364 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bqd s LEU 365 N 0.00 3.95 0.37 0.99 1.02 -1.26 -5.06 118.68 118.70 1bqd s LEU 365 Ca 0.00 1.38 -0.13 0.00 0.02 0.00 0.00 54.13 55.40 1bqd s LEU 365 Cb 0.00 -4.22 -0.08 0.00 0.02 0.00 0.00 46.19 41.91 1bqd s LEU 365 CO 0.00 -0.31 0.77 0.42 0.02 0.00 0.00 176.35 177.25 1bqd s THR 366 N -2.16 4.72 0.33 5.49 -4.23 -1.26 -4.50 115.64 114.04 1bqd s THR 366 Ca 0.56 0.81 0.13 0.00 -1.18 0.00 0.00 61.69 62.01 1bqd s THR 366 Cb -0.10 -3.67 0.32 0.00 1.34 0.00 0.00 72.50 70.39 1bqd s THR 366 CO 0.20 -0.37 1.68 0.50 -0.54 0.00 0.00 174.62 176.09 1bqd h LYS 367 N 1.71 0.39 -0.02 3.99 3.11 -1.94 0.81 116.57 124.61 1bqd h LYS 367 Ca -0.47 -0.02 -0.15 0.00 -2.81 0.00 0.00 60.65 57.19 1bqd h LYS 367 Cb 1.18 -0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 32.31 1bqd h LYS 367 CO 0.64 0.26 -0.66 0.93 -2.81 0.00 0.00 179.45 177.81 1bqd h GLU 368 N 0.40 0.11 -0.25 1.90 3.07 -1.92 -2.24 114.58 115.65 1bqd h GLU 368 Ca 0.71 -0.09 -0.18 0.00 -0.50 0.00 0.00 59.36 59.30 1bqd h GLU 368 Cb 1.53 0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 29.46 1bqd h GLU 368 CO -0.57 0.73 -0.55 1.96 -1.40 0.00 0.00 179.01 179.19 1bqd h GLN 369 N 0.08 0.77 -0.13 2.33 4.20 0.14 -1.93 115.11 120.56 1bqd h GLN 369 Ca -0.01 -0.49 -0.00 0.00 0.06 0.00 0.00 58.65 58.21 1bqd h GLN 369 Cb 1.18 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 29.01 1bqd h GLN 369 CO 0.09 1.11 0.07 0.28 -0.67 0.00 0.00 178.83 179.71 1bqd h VAL 370 N 0.59 1.11 -0.99 -0.54 2.07 -0.64 -0.96 116.25 116.89 1bqd h VAL 370 Ca 0.01 -0.32 0.03 0.00 0.82 0.00 0.00 66.70 67.25 1bqd h VAL 370 Cb 1.14 1.09 -0.06 0.00 -1.52 0.00 0.00 31.29 31.94 1bqd h VAL 370 CO 0.12 0.10 0.65 0.25 0.02 0.00 0.00 177.57 178.71 1bqd h LEU 371 N 0.09 1.08 -0.37 2.57 6.46 -1.37 -2.61 115.31 121.17 1bqd h LEU 371 Ca 0.04 -0.01 -0.13 0.00 -0.12 0.00 0.00 57.88 57.66 1bqd h LEU 371 Cb 0.10 -0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 39.78 1bqd h LEU 371 CO -0.01 0.75 -0.30 -0.09 -0.62 0.00 0.00 178.44 178.17 1bqd h ARG 372 N 1.26 0.85 -0.54 1.25 2.43 -1.07 -1.97 114.38 116.59 1bqd h ARG 372 Ca 0.39 -0.42 0.08 0.00 -0.81 0.00 0.00 59.98 59.22 1bqd h ARG 372 Cb -0.01 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.47 1bqd h ARG 372 CO -0.12 1.06 0.16 -0.07 -1.51 0.00 0.00 179.97 179.50 1bqd h LEU 373 N 0.65 0.12 -0.13 3.80 3.38 -0.80 0.24 115.31 122.56 1bqd h LEU 373 Ca 0.07 0.08 -0.11 0.00 0.09 0.00 0.00 57.88 58.01 1bqd h LEU 373 Cb 0.87 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1bqd h LEU 373 CO 0.08 0.09 -0.35 0.08 0.09 0.00 0.00 178.44 178.42 1bqd h ARG 374 N 0.32 0.47 -0.55 1.13 0.11 -1.24 0.82 114.38 115.44 1bqd h ARG 374 Ca 0.27 -0.33 -0.08 0.00 0.10 0.00 0.00 59.98 59.94 1bqd h ARG 374 Cb 0.33 0.05 -0.02 0.00 1.11 0.00 0.00 29.97 31.45 1bqd h ARG 374 CO -0.30 0.94 0.02 1.49 0.10 0.00 0.00 179.97 182.22 1bqd h GLU 375 N 0.07 0.95 0.02 0.08 4.57 -1.08 -2.40 114.58 116.79 1bqd h GLU 375 Ca -0.01 -0.29 -0.36 0.00 -1.18 0.00 0.00 59.36 57.53 1bqd h GLU 375 Cb 0.96 -0.09 -0.06 0.00 -0.16 0.00 0.00 28.75 29.40 1bqd h GLU 375 CO 0.08 0.95 -2.21 0.39 -1.18 0.00 0.00 179.01 177.03 1bqd n GLU 376 N -4.28 0.68 -0.00 1.92 1.02 0.83 -4.70 120.64 116.10 1bqd n GLU 376 Ca 0.02 0.13 0.03 0.00 -0.02 0.00 0.00 57.16 57.32 1bqd n GLU 376 Cb 0.32 -1.60 -0.04 0.00 -0.02 0.00 0.00 31.44 30.09 1bqd n GLU 376 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1bqd n PHE 377 N -3.02 0.00 -0.79 -0.32 3.72 0.27 -5.00 117.46 112.32 1bqd n PHE 377 Ca -0.32 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.08 1bqd n PHE 377 Cb 1.08 -0.07 0.00 0.00 -0.94 0.00 0.00 39.48 39.55 1bqd n PHE 377 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bqd n GLY 378 N 1.61 0.67 3.71 1.37 0.00 -0.16 -4.77 105.19 107.61 1bqd n GLY 378 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1bqd n GLY 378 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bqd s VAL 379 N -2.33 5.01 -0.14 1.61 1.01 -1.10 -2.03 120.40 122.43 1bqd s VAL 379 Ca 0.00 1.54 -0.02 0.00 0.00 0.00 0.00 61.98 63.50 1bqd s VAL 379 Cb 0.00 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.27 1bqd s VAL 379 CO 0.00 0.21 -0.07 -0.31 0.00 0.00 0.00 175.10 174.93 1bqd s TYR 380 N 1.00 2.95 0.21 5.22 1.51 0.11 -2.39 117.35 125.97 1bqd s TYR 380 Ca 0.39 -0.38 -0.11 0.00 -1.01 0.00 0.00 57.07 55.96 1bqd s TYR 380 Cb -0.18 -1.91 -0.01 0.00 -0.11 0.00 0.00 41.96 39.76 1bqd s TYR 380 CO 0.19 -0.07 0.40 0.00 -1.11 0.00 0.00 175.55 174.96 1bqd s ALA 381 N 0.28 -0.12 0.48 3.71 0.00 -1.26 0.25 121.76 125.11 1bqd s ALA 381 Ca -0.05 -0.89 -0.21 0.00 0.00 0.00 0.00 51.96 50.81 1bqd s ALA 381 Cb -0.15 1.02 -0.08 0.00 0.00 0.00 0.00 23.12 23.91 1bqd s ALA 381 CO 0.04 -0.77 1.05 0.08 0.00 0.00 0.00 175.76 176.16 1bqd s VAL 382 N -4.00 3.68 0.59 0.00 1.01 -1.18 -4.89 120.40 115.60 1bqd s VAL 382 Ca 0.21 1.08 0.28 0.00 0.00 0.00 0.00 61.98 63.55 1bqd s VAL 382 Cb 0.01 -3.45 0.36 0.00 0.00 0.00 0.00 36.38 33.30 1bqd s VAL 382 CO 0.06 -0.20 2.07 0.00 0.00 0.00 0.00 175.10 177.03 1bqd h ALA 383 N 1.63 1.88 0.00 5.51 0.00 -1.94 0.11 119.26 126.46 1bqd h ALA 383 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1bqd h ALA 383 Cb 1.23 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1bqd h ALA 383 CO 0.59 -0.36 0.00 -1.13 0.00 0.00 0.00 179.25 178.35 1bqd n SER 384 N -3.83 0.00 0.00 0.00 3.41 -1.26 -4.12 113.62 107.82 1bqd n SER 384 Ca 0.03 -0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 1bqd n SER 384 Cb 0.38 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 1bqd n SER 384 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bqd n GLY 385 N 0.54 0.72 3.73 5.00 0.00 0.39 -4.83 105.19 110.74 1bqd n GLY 385 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1bqd n GLY 385 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bqd s ARG 386 N -0.27 4.43 0.12 1.61 3.52 -1.25 -1.43 118.95 125.67 1bqd s ARG 386 Ca 0.00 1.94 0.08 0.00 -0.13 0.00 0.00 55.73 57.62 1bqd s ARG 386 Cb 0.00 -3.25 -0.04 0.00 -1.56 0.00 0.00 34.95 30.11 1bqd s ARG 386 CO 0.00 -0.21 -0.19 0.14 -0.81 0.00 0.00 175.30 174.22 1bqd s VAL 387 N 0.34 1.68 -0.38 7.11 -7.23 -0.15 -3.13 120.40 118.65 1bqd s VAL 387 Ca 0.56 -1.64 -0.09 0.00 -1.81 0.00 0.00 61.98 59.01 1bqd s VAL 387 Cb -0.34 -1.60 0.05 0.00 0.56 0.00 0.00 36.38 35.05 1bqd s VAL 387 CO 0.35 -0.16 0.19 0.21 -0.31 0.00 0.00 175.10 175.38 1bqd s ASN 388 N -2.13 5.56 0.51 4.85 3.84 -0.43 -2.81 114.94 124.33 1bqd s ASN 388 Ca 0.08 -1.22 0.20 0.00 0.21 0.00 0.00 52.86 52.13 1bqd s ASN 388 Cb -0.09 -1.96 1.30 0.00 -0.55 0.00 0.00 41.25 39.96 1bqd s ASN 388 CO 0.05 -0.41 2.10 -0.37 -2.79 0.00 0.00 177.10 175.67 1bqd h VAL 389 N 6.05 0.90 0.00 -5.21 -1.51 -1.49 -0.33 116.25 114.67 1bqd h VAL 389 Ca -0.24 -0.31 0.00 0.00 -1.23 0.00 0.00 66.70 64.93 1bqd h VAL 389 Cb 1.09 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 31.42 1bqd h VAL 389 CO 0.67 0.08 0.00 0.00 -1.23 0.00 0.00 177.57 177.10 1bqd n ALA 390 N -2.45 1.27 1.16 5.19 0.00 -1.26 -0.16 120.51 124.25 1bqd n ALA 390 Ca -0.03 -0.02 0.13 0.00 0.00 0.00 0.00 53.44 53.53 1bqd n ALA 390 Cb 0.17 -1.09 0.45 0.00 0.00 0.00 0.00 19.45 18.98 1bqd n ALA 390 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bqd n GLY 391 N -0.93 -1.12 3.89 0.00 0.00 -0.13 -4.09 105.19 102.81 1bqd n GLY 391 Ca 0.01 -0.28 -0.32 0.00 0.00 0.00 0.00 46.02 45.43 1bqd n GLY 391 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1bqd s MET 392 N -2.77 3.66 0.02 1.61 -1.94 0.78 -4.83 119.30 115.83 1bqd s MET 392 Ca 0.19 0.00 -0.02 0.00 -1.71 0.00 0.00 55.69 54.15 1bqd s MET 392 Cb 0.19 -2.86 -0.02 0.00 2.01 0.00 0.00 34.83 34.15 1bqd s MET 392 CO 0.57 0.48 0.02 0.95 -0.01 0.00 0.00 175.02 177.02 1bqd s THR 393 N -1.61 0.12 0.57 2.05 -4.23 -1.26 -4.91 115.64 106.37 1bqd s THR 393 Ca 0.40 -0.98 0.30 0.00 -1.18 0.00 0.00 61.69 60.22 1bqd s THR 393 Cb -0.12 -0.50 0.42 0.00 1.34 0.00 0.00 72.50 73.63 1bqd s THR 393 CO 0.23 -0.54 1.87 -0.65 -0.54 0.00 0.00 174.62 174.99 1bqd h PRO 394 N 4.30 0.00 -0.03 3.99 0.11 -1.99 -0.77 132.00 137.61 1bqd h PRO 394 Ca -0.32 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.73 1bqd h PRO 394 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1bqd h PRO 394 CO 0.45 0.00 -0.20 -0.44 -0.21 0.00 0.00 178.00 177.59 1bqd h ASP 395 N 0.00 0.23 -0.14 -2.05 3.32 -1.95 -3.33 116.42 112.50 1bqd h ASP 395 Ca 0.30 -0.69 0.00 0.00 0.02 0.00 0.00 57.03 56.65 1bqd h ASP 395 Cb 1.42 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.90 1bqd h ASP 395 CO -0.00 0.88 0.00 -0.46 -1.72 0.00 0.00 179.24 177.94 1bqd n ASN 396 N -4.55 1.83 0.22 6.45 0.23 -0.48 -4.49 115.26 114.47 1bqd n ASN 396 Ca -0.09 -1.69 -0.15 0.00 -0.53 0.00 0.00 54.58 52.12 1bqd n ASN 396 Cb 0.45 -0.08 -0.07 0.00 -2.08 0.00 0.00 39.78 37.99 1bqd n ASN 396 CO 0.00 0.00 0.00 -0.03 -0.93 0.00 0.00 177.26 176.30 1bqd h MET 397 N 2.55 -0.58 0.02 -3.83 4.05 -1.31 -2.16 114.93 113.68 1bqd h MET 397 Ca 0.00 0.04 0.03 0.00 -0.28 0.00 0.00 59.70 59.49 1bqd h MET 397 Cb 0.55 0.13 -0.05 0.00 -0.80 0.00 0.00 31.60 31.43 1bqd h MET 397 CO 0.00 -0.39 -0.46 0.00 0.23 0.00 0.00 176.91 176.29 1bqd h ALA 398 N -0.01 -0.78 -0.54 0.39 0.00 -1.83 -0.44 119.26 116.06 1bqd h ALA 398 Ca -0.03 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1bqd h ALA 398 Cb 0.52 0.81 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 1bqd h ALA 398 CO 0.01 -1.02 0.33 -1.35 0.00 0.00 0.00 179.25 177.22 1bqd h PRO 399 N -0.63 0.64 -0.54 0.00 0.11 -1.87 -0.50 132.00 129.22 1bqd h PRO 399 Ca 0.03 -0.04 0.09 0.00 0.11 0.00 0.00 66.00 66.19 1bqd h PRO 399 Cb 0.69 -0.14 -0.07 0.00 0.11 0.00 0.00 31.00 31.58 1bqd h PRO 399 CO -0.32 0.42 0.14 1.25 -0.21 0.00 0.00 178.00 179.28 1bqd h LEU 400 N 0.66 0.07 -0.63 2.35 5.85 -1.02 -1.02 115.31 121.57 1bqd h LEU 400 Ca 0.21 0.09 -0.14 0.00 0.84 0.00 0.00 57.88 58.88 1bqd h LEU 400 Cb 0.01 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 1bqd h LEU 400 CO -0.09 0.06 -0.51 0.00 -0.34 0.00 0.00 178.44 177.56 1bqd h GLU 402 N 0.36 0.84 -0.27 0.00 5.08 -0.54 -0.30 114.58 119.76 1bqd h GLU 402 Ca 0.01 -0.27 -0.03 0.00 -1.00 0.00 0.00 59.36 58.07 1bqd h GLU 402 Cb 1.02 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 1bqd h GLU 402 CO 0.09 0.89 0.05 0.00 -1.00 0.00 0.00 179.01 179.04 1bqd h ALA 403 N 1.14 0.36 -0.43 3.43 0.00 -1.10 -1.30 119.26 121.36 1bqd h ALA 403 Ca 0.13 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1bqd h ALA 403 Cb 0.57 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1bqd h ALA 403 CO 0.03 0.04 0.27 0.82 0.00 0.00 0.00 179.25 180.41 1bqd h ILE 404 N 0.26 1.13 -0.90 0.00 2.04 -1.14 -2.24 117.51 116.67 1bqd h ILE 404 Ca 0.08 -0.28 0.03 0.00 1.00 0.00 0.00 64.86 65.69 1bqd h ILE 404 Cb 0.33 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 36.90 1bqd h ILE 404 CO 0.00 0.13 0.59 0.58 0.00 0.00 0.00 178.15 179.45 1bqd h VAL 405 N 0.57 1.17 0.00 1.67 2.07 -0.91 -1.27 116.25 119.55 1bqd h VAL 405 Ca 0.16 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1bqd h VAL 405 Cb -0.02 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.67 1bqd h VAL 405 CO -0.03 0.21 0.00 0.00 0.02 0.00 0.00 177.57 177.77 1bqd n ALA 407 N -2.40 1.45 0.23 1.67 0.00 -0.50 -2.62 120.51 118.34 1bqd n ALA 407 Ca 0.12 -0.03 0.02 0.00 0.00 0.00 0.00 53.44 53.55 1bqd n ALA 407 Cb 0.09 -1.15 -0.01 0.00 0.00 0.00 0.00 19.45 18.38 1bqd n ALA 407 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1bqd n VAL 408 N -1.46 0.00 1.24 0.00 0.24 -0.50 -5.09 118.33 112.76 1bqd n VAL 408 Ca 0.03 -0.43 0.10 0.00 -2.04 0.00 0.00 64.34 61.99 1bqd n VAL 408 Cb 0.10 1.04 0.59 0.00 -1.47 0.00 0.00 33.84 34.11 1bqd n VAL 408 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87