#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bqb s LYS 2 N 0.00 2.38 -0.18 2.12 1.02 -0.63 -0.42 119.74 124.03 3bqb s LYS 2 Ca 0.00 -0.61 -0.03 0.00 0.02 0.00 0.00 55.97 55.34 3bqb s LYS 2 Cb 0.00 -2.05 -0.02 0.00 -0.52 0.00 0.00 37.83 35.25 3bqb s LYS 2 CO 0.00 -0.10 -0.05 -1.17 -0.92 0.00 0.00 175.35 173.11 3bqb s LEU 3 N 1.09 3.04 0.21 3.17 2.96 0.12 -0.98 118.68 128.30 3bqb s LEU 3 Ca -0.03 -0.26 0.00 0.00 -0.22 0.00 0.00 54.13 53.62 3bqb s LEU 3 Cb -0.14 -1.74 -0.05 0.00 0.50 0.00 0.00 46.19 44.76 3bqb s LEU 3 CO -0.04 0.09 0.09 0.72 -1.32 0.00 0.00 176.35 175.89 3bqb s PHE 4 N 0.81 1.29 -0.07 5.38 -0.71 -0.22 -0.74 117.98 123.73 3bqb s PHE 4 Ca -0.02 -1.23 -0.06 0.00 -1.04 0.00 0.00 56.93 54.58 3bqb s PHE 4 Cb -0.15 -0.71 0.02 0.00 -1.21 0.00 0.00 43.02 40.97 3bqb s PHE 4 CO 0.02 -0.44 0.17 0.50 -1.34 0.00 0.00 175.22 174.13 3bqb s ARG 5 N -4.06 0.20 0.34 1.99 3.52 -1.26 -0.49 118.95 119.19 3bqb s ARG 5 Ca 0.35 0.25 0.10 0.00 -0.13 0.00 0.00 55.73 56.29 3bqb s ARG 5 Cb 0.07 0.09 -0.06 0.00 -1.56 0.00 0.00 34.95 33.49 3bqb s ARG 5 CO 0.10 -0.03 -0.10 0.14 -0.81 0.00 0.00 175.30 174.61 3bqb s VAL 6 N 0.12 2.23 -0.22 7.11 -7.23 -0.70 -1.53 120.40 120.19 3bqb s VAL 6 Ca -0.00 -2.21 -0.04 0.00 -1.81 0.00 0.00 61.98 57.91 3bqb s VAL 6 Cb -0.01 -2.62 -0.01 0.00 0.56 0.00 0.00 36.38 34.29 3bqb s VAL 6 CO 0.00 -0.21 -0.03 0.54 -0.31 0.00 0.00 175.10 175.08 3bqb s VAL 7 N -2.62 3.51 -0.18 1.32 0.11 0.46 -2.34 120.40 120.66 3bqb s VAL 7 Ca 0.32 -0.45 0.00 0.00 -2.93 0.00 0.00 61.98 58.92 3bqb s VAL 7 Cb 0.02 -2.59 0.04 0.00 -1.53 0.00 0.00 36.38 32.32 3bqb s VAL 7 CO 0.16 0.42 -0.08 -0.75 -3.33 0.00 0.00 175.10 171.53 3bqb s LYS 8 N 1.37 1.72 -1.53 1.54 2.20 -0.23 -2.23 119.74 122.59 3bqb s LYS 8 Ca 0.04 -0.64 -0.10 0.00 -0.36 0.00 0.00 55.97 54.92 3bqb s LYS 8 Cb -0.14 -2.16 0.08 0.00 -1.51 0.00 0.00 37.83 34.10 3bqb s LYS 8 CO -0.02 -0.41 0.74 0.54 -0.36 0.00 0.00 175.35 175.84 3bqb n ARG 9 N 4.80 -4.15 0.00 4.03 1.74 -1.26 -1.96 116.66 119.86 3bqb n ARG 9 Ca -0.13 0.48 0.00 0.00 -0.77 0.00 0.00 57.85 57.43 3bqb n ARG 9 Cb 0.47 -5.08 0.00 0.00 -1.02 0.00 0.00 32.46 26.84 3bqb n ARG 9 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3bqb n GLY 10 N -1.67 3.21 3.83 -0.13 0.00 -1.26 -5.02 105.19 104.15 3bqb n GLY 10 Ca -0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 3bqb n GLY 10 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3bqb s TYR 11 N -1.85 2.82 0.02 1.61 1.13 -0.83 -5.10 117.35 115.15 3bqb s TYR 11 Ca 0.00 -0.36 -0.04 0.00 -1.41 0.00 0.00 57.07 55.26 3bqb s TYR 11 Cb 0.00 -1.82 -0.04 0.00 -1.10 0.00 0.00 41.96 38.99 3bqb s TYR 11 CO 0.00 0.17 0.23 0.71 -2.51 0.00 0.00 175.55 174.15 3bqb s TYR 12 N -2.37 3.55 -0.04 -3.49 4.12 -1.26 -1.06 117.35 116.80 3bqb s TYR 12 Ca 0.41 0.44 0.00 0.00 0.02 0.00 0.00 57.07 57.94 3bqb s TYR 12 Cb -0.04 -1.89 0.03 0.00 -1.52 0.00 0.00 41.96 38.53 3bqb s TYR 12 CO 0.26 0.61 -0.00 0.42 0.02 0.00 0.00 175.55 176.86 3bqb s ILE 13 N -1.36 0.23 -0.15 2.71 1.01 -0.99 -4.95 121.20 117.70 3bqb s ILE 13 Ca 0.29 0.09 -0.07 0.00 0.00 0.00 0.00 60.65 60.96 3bqb s ILE 13 Cb -0.13 -0.34 -0.04 0.00 0.01 0.00 0.00 42.46 41.96 3bqb s ILE 13 CO 0.19 0.18 0.11 -0.44 0.00 0.00 0.00 174.94 174.98 3bqb s SER 14 N 1.25 6.08 0.04 3.58 0.01 -1.26 -1.72 113.70 121.67 3bqb s SER 14 Ca -0.06 0.30 0.07 0.00 1.31 0.00 0.00 55.95 57.57 3bqb s SER 14 Cb -0.13 -1.99 -0.02 0.00 0.21 0.00 0.00 66.02 64.08 3bqb s SER 14 CO -0.02 0.30 -0.20 -0.31 0.41 0.00 0.00 173.24 173.43 3bqb s TYR 15 N -0.40 1.72 -0.19 2.43 2.02 0.35 -1.80 117.35 121.49 3bqb s TYR 15 Ca 0.11 -0.37 -0.02 0.00 -0.37 0.00 0.00 57.07 56.42 3bqb s TYR 15 Cb -0.12 -1.03 -0.00 0.00 -0.40 0.00 0.00 41.96 40.41 3bqb s TYR 15 CO 0.01 0.08 -0.10 0.00 -1.57 0.00 0.00 175.55 173.98 3bqb s ALA 16 N -0.80 2.66 -0.23 3.71 0.00 0.15 -1.05 121.76 126.20 3bqb s ALA 16 Ca 0.07 -1.11 -0.09 0.00 0.00 0.00 0.00 51.96 50.83 3bqb s ALA 16 Cb -0.09 -1.47 -0.04 0.00 0.00 0.00 0.00 23.12 21.52 3bqb s ALA 16 CO 0.02 -0.25 0.11 -1.50 0.00 0.00 0.00 175.76 174.14 3bqb s ILE 17 N 1.16 4.94 0.29 0.00 2.07 -0.16 0.76 121.20 130.27 3bqb s ILE 17 Ca 0.02 0.03 -0.06 0.00 -1.41 0.00 0.00 60.65 59.22 3bqb s ILE 17 Cb -0.14 -3.29 -0.06 0.00 0.13 0.00 0.00 42.46 39.10 3bqb s ILE 17 CO -0.03 0.37 0.58 -0.76 -1.91 0.00 0.00 174.94 173.18 3bqb s LEU 18 N 1.07 4.05 0.28 8.50 1.02 -0.30 -1.60 118.68 131.70 3bqb s LEU 18 Ca 0.06 0.80 -0.04 0.00 0.02 0.00 0.00 54.13 54.97 3bqb s LEU 18 Cb -0.14 -3.62 0.56 0.00 0.02 0.00 0.00 46.19 43.01 3bqb s LEU 18 CO 0.04 -0.20 1.58 0.44 0.02 0.00 0.00 176.35 178.23 3bqb h ASP 19 N 1.77 -0.66 0.00 2.29 3.45 -1.98 0.78 116.42 122.08 3bqb h ASP 19 Ca -0.47 0.27 0.00 0.00 0.43 0.00 0.00 57.03 57.26 3bqb h ASP 19 Cb 1.19 0.52 0.00 0.00 -0.56 0.00 0.00 39.33 40.48 3bqb h ASP 19 CO 0.66 -0.31 0.00 -0.46 -1.57 0.00 0.00 179.24 177.56 3bqb n ASN 20 N -5.53 1.89 0.00 6.45 6.94 -1.26 -4.77 115.26 118.98 3bqb n ASN 20 Ca 0.18 -1.24 0.00 0.00 -0.02 0.00 0.00 54.58 53.50 3bqb n ASN 20 Cb 0.59 -0.36 0.00 0.00 -2.36 0.00 0.00 39.78 37.65 3bqb n ASN 20 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 3bqb n SER 21 N 1.11 0.00 -4.69 0.53 7.64 0.27 -4.94 113.62 113.54 3bqb n SER 21 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 3bqb n SER 21 Cb 0.25 -0.14 -0.03 0.00 -1.01 0.00 0.00 64.21 63.28 3bqb n SER 21 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3bqb s THR 22 N -0.29 2.93 -0.20 0.44 -4.23 -1.24 -4.71 115.64 108.35 3bqb s THR 22 Ca 0.00 0.40 -0.08 0.00 -1.18 0.00 0.00 61.69 60.83 3bqb s THR 22 Cb 0.00 -3.26 -0.04 0.00 1.34 0.00 0.00 72.50 70.54 3bqb s THR 22 CO 0.00 -0.00 0.07 -0.63 -0.54 0.00 0.00 174.62 173.52 3bqb s ILE 23 N 2.64 4.79 -0.13 2.99 1.01 -1.26 -1.15 121.20 130.09 3bqb s ILE 23 Ca 0.75 -0.03 -0.00 0.00 0.00 0.00 0.00 60.65 61.37 3bqb s ILE 23 Cb -0.41 -3.18 -0.02 0.00 0.01 0.00 0.00 42.46 38.87 3bqb s ILE 23 CO 0.33 0.43 -0.13 -0.63 0.00 0.00 0.00 174.94 174.95 3bqb s ILE 24 N 0.62 3.10 -0.12 2.92 1.01 0.23 -0.48 121.20 128.47 3bqb s ILE 24 Ca 0.04 -0.64 -0.24 0.00 0.00 0.00 0.00 60.65 59.80 3bqb s ILE 24 Cb -0.13 -2.30 -0.03 0.00 0.01 0.00 0.00 42.46 40.01 3bqb s ILE 24 CO 0.01 0.52 0.76 -0.60 0.00 0.00 0.00 174.94 175.63 3bqb s ARG 25 N 0.34 4.35 0.38 2.79 3.52 0.55 0.33 118.95 131.20 3bqb s ARG 25 Ca -0.10 0.92 -0.23 0.00 -0.13 0.00 0.00 55.73 56.18 3bqb s ARG 25 Cb -0.16 -3.52 -0.10 0.00 -1.56 0.00 0.00 34.95 29.61 3bqb s ARG 25 CO 0.06 -0.15 0.95 -0.51 -0.81 0.00 0.00 175.30 174.84 3bqb s LEU 26 N 1.52 4.13 -0.03 -0.88 1.43 -0.74 -2.27 118.68 121.84 3bqb s LEU 26 Ca 0.37 1.78 0.06 0.00 -1.03 0.00 0.00 54.13 55.31 3bqb s LEU 26 Cb -0.17 -4.28 -0.24 0.00 0.03 0.00 0.00 46.19 41.53 3bqb s LEU 26 CO 0.15 -0.24 0.73 0.44 0.23 0.00 0.00 176.35 177.66 3bqb h ASP 27 N 2.52 0.13 -1.99 2.29 3.32 -1.84 -3.46 116.42 117.40 3bqb h ASP 27 Ca -0.48 -0.24 -0.43 0.00 0.02 0.00 0.00 57.03 55.90 3bqb h ASP 27 Cb 1.19 -0.04 0.03 0.00 0.22 0.00 0.00 39.33 40.72 3bqb h ASP 27 CO 0.63 1.21 -0.19 -1.61 -1.72 0.00 0.00 179.24 177.56 3bqb s GLU 28 N -2.61 2.84 0.34 3.56 2.02 -1.26 -5.07 118.70 118.51 3bqb s GLU 28 Ca -0.07 -0.97 -0.29 0.00 0.02 0.00 0.00 54.97 53.66 3bqb s GLU 28 Cb 0.08 -2.67 -0.12 0.00 0.10 0.00 0.00 34.13 31.52 3bqb s GLU 28 CO 0.82 -0.32 1.46 -3.47 0.02 0.00 0.00 175.26 173.76 3bqb n ASP 29 N -1.97 3.47 -0.25 -0.19 2.03 -1.26 -4.84 116.55 113.53 3bqb n ASP 29 Ca 0.05 1.20 0.01 0.00 0.52 0.00 0.00 54.79 56.57 3bqb n ASP 29 Cb 0.59 -1.56 0.22 0.00 -0.72 0.00 0.00 41.12 39.65 3bqb n ASP 29 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3bqb h PRO 30 N 3.40 1.05 -0.21 -0.67 0.13 -1.98 -0.13 132.00 133.59 3bqb h PRO 30 Ca -0.48 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 64.59 3bqb h PRO 30 Cb 1.25 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 32.13 3bqb h PRO 30 CO 0.68 0.69 0.13 0.82 -0.23 0.00 0.00 178.00 180.10 3bqb h ILE 31 N 1.08 1.07 -0.83 -3.56 2.04 -1.93 -0.97 117.51 114.41 3bqb h ILE 31 Ca 0.30 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.97 3bqb h ILE 31 Cb -0.08 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 36.77 3bqb h ILE 31 CO -0.07 0.07 0.44 0.50 0.00 0.00 0.00 178.15 179.09 3bqb h LYS 32 N 0.27 1.16 -0.72 2.37 1.63 -1.84 -2.53 116.57 116.92 3bqb h LYS 32 Ca 0.08 -0.15 0.02 0.00 -0.85 0.00 0.00 60.65 59.75 3bqb h LYS 32 Cb 0.00 -0.22 -0.04 0.00 -0.60 0.00 0.00 32.23 31.37 3bqb h LYS 32 CO -0.02 0.87 0.46 0.00 -3.45 0.00 0.00 179.45 177.32 3bqb h ALA 33 N 1.23 0.93 -0.27 5.00 0.00 -0.71 -1.01 119.26 124.43 3bqb h ALA 33 Ca 0.29 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 3bqb h ALA 33 Cb 0.05 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3bqb h ALA 33 CO -0.04 0.28 -0.05 -0.07 0.00 0.00 0.00 179.25 179.36 3bqb h LEU 34 N 0.92 0.39 -0.45 0.00 3.38 -0.90 0.36 115.31 119.01 3bqb h LEU 34 Ca 0.28 -0.08 -0.17 0.00 0.09 0.00 0.00 57.88 58.00 3bqb h LEU 34 Cb -0.04 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 3bqb h LEU 34 CO -0.09 0.50 -0.63 0.24 0.09 0.00 0.00 178.44 178.55 3bqb h MET 35 N 0.40 0.52 -0.50 1.13 2.86 -1.01 -1.39 114.93 116.93 3bqb h MET 35 Ca 0.08 -0.36 -0.09 0.00 -2.06 0.00 0.00 59.70 57.27 3bqb h MET 35 Cb 0.35 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 3bqb h MET 35 CO 0.01 0.98 -0.06 -0.09 1.06 0.00 0.00 176.91 178.81 3bqb h ARG 36 N 0.38 0.89 -0.25 1.72 2.43 -0.70 -2.67 114.38 116.19 3bqb h ARG 36 Ca -0.01 -0.29 -0.17 0.00 -0.81 0.00 0.00 59.98 58.70 3bqb h ARG 36 Cb 1.19 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.66 3bqb h ARG 36 CO 0.12 0.93 -0.53 -0.92 -1.51 0.00 0.00 179.97 178.05 3bqb h TYR 37 N 0.81 0.90 -0.21 2.20 5.03 -0.85 -2.53 116.97 122.32 3bqb h TYR 37 Ca 0.14 -0.32 0.05 0.00 2.58 0.00 0.00 58.73 61.19 3bqb h TYR 37 Cb 0.57 -0.17 -0.01 0.00 1.55 0.00 0.00 36.73 38.67 3bqb h TYR 37 CO 0.03 1.10 0.15 1.03 -1.32 0.00 0.00 178.16 179.15 3bqb h SER 38 N 0.56 0.03 0.01 -2.11 0.87 -1.20 -0.91 113.55 110.80 3bqb h SER 38 Ca 0.02 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.57 3bqb h SER 38 Cb 1.11 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 3bqb h SER 38 CO 0.11 0.02 -0.00 -0.08 -0.53 0.00 0.00 176.83 176.35 3bqb h GLU 39 N 0.04 -0.01 0.00 2.24 4.57 -1.10 -3.44 114.58 116.88 3bqb h GLU 39 Ca 0.10 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 3bqb h GLU 39 Cb 0.35 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.94 3bqb h GLU 39 CO -0.01 -0.01 -0.05 0.27 -1.18 0.00 0.00 179.01 178.03 3bqb n ASN 40 N -2.13 0.91 -2.38 1.04 6.94 -1.02 -5.01 115.26 113.60 3bqb n ASN 40 Ca -0.00 -1.64 -0.20 0.00 -0.02 0.00 0.00 54.58 52.72 3bqb n ASN 40 Cb 0.01 -0.06 -0.01 0.00 -2.36 0.00 0.00 39.78 37.36 3bqb n ASN 40 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3bqb n LYS 41 N -0.30 -1.73 -3.51 -3.83 5.02 -0.35 -4.99 118.16 108.48 3bqb n LYS 41 Ca 0.01 0.98 -0.38 0.00 -2.02 0.00 0.00 58.31 56.91 3bqb n LYS 41 Cb 0.44 -5.63 -0.06 0.00 -0.02 0.00 0.00 35.03 29.76 3bqb n LYS 41 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3bqb s GLU 42 N -5.01 3.90 -0.13 1.97 2.12 -1.26 -4.95 118.70 115.34 3bqb s GLU 42 Ca 0.00 0.39 -0.01 0.00 0.36 0.00 0.00 54.97 55.71 3bqb s GLU 42 Cb 0.00 -3.19 0.03 0.00 0.26 0.00 0.00 34.13 31.23 3bqb s GLU 42 CO 0.00 0.68 -0.04 0.08 -0.54 0.00 0.00 175.26 175.43 3bqb s VAL 43 N -1.12 0.89 -0.02 3.70 1.01 -1.26 -4.12 120.40 119.48 3bqb s VAL 43 Ca 0.25 -0.34 -0.22 0.00 0.00 0.00 0.00 61.98 61.67 3bqb s VAL 43 Cb -0.16 -1.02 -0.05 0.00 0.00 0.00 0.00 36.38 35.14 3bqb s VAL 43 CO 0.14 0.23 0.64 -0.76 0.00 0.00 0.00 175.10 175.34 3bqb s LEU 44 N 1.75 4.38 0.00 3.92 1.43 -1.26 -4.98 118.68 123.92 3bqb s LEU 44 Ca 0.03 1.18 0.00 0.00 -1.03 0.00 0.00 54.13 54.31 3bqb s LEU 44 Cb -0.14 -2.99 0.00 0.00 0.03 0.00 0.00 46.19 43.10 3bqb s LEU 44 CO -0.07 0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.14 3bqb n GLY 45 N 2.67 -2.24 3.35 -3.19 0.00 -1.26 -2.53 105.19 101.99 3bqb n GLY 45 Ca -0.05 -1.44 -0.31 0.00 0.00 0.00 0.00 46.02 44.23 3bqb n GLY 45 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3bqb s ASP 46 N -0.06 3.20 0.31 1.61 1.01 -0.96 -4.93 116.67 116.84 3bqb s ASP 46 Ca 0.00 -0.52 -0.29 0.00 0.71 0.00 0.00 52.55 52.45 3bqb s ASP 46 Cb 0.00 -0.35 -0.10 0.00 1.01 0.00 0.00 42.92 43.47 3bqb s ASP 46 CO 0.00 0.29 1.33 -0.60 0.21 0.00 0.00 175.17 176.40 3bqb s ARG 47 N -1.00 4.34 0.19 8.23 3.52 -1.26 -0.33 118.95 132.63 3bqb s ARG 47 Ca 0.11 2.23 0.05 0.00 -0.13 0.00 0.00 55.73 57.99 3bqb s ARG 47 Cb -0.10 -3.08 -0.05 0.00 -1.56 0.00 0.00 34.95 30.16 3bqb s ARG 47 CO 0.01 -0.24 -0.09 0.14 -0.81 0.00 0.00 175.30 174.31 3bqb s VAL 48 N -0.86 1.35 0.14 7.11 -7.23 0.37 -4.87 120.40 116.40 3bqb s VAL 48 Ca 0.51 -2.11 0.06 0.00 -1.81 0.00 0.00 61.98 58.63 3bqb s VAL 48 Cb -0.40 -2.03 -0.04 0.00 0.56 0.00 0.00 36.38 34.47 3bqb s VAL 48 CO 0.50 -0.60 -0.13 0.42 -0.31 0.00 0.00 175.10 174.98 3bqb s THR 49 N -3.21 1.34 0.00 5.32 -4.23 -1.26 -4.44 115.64 109.16 3bqb s THR 49 Ca 0.21 -1.84 0.00 0.00 -1.18 0.00 0.00 61.69 58.89 3bqb s THR 49 Cb 0.02 -1.65 0.00 0.00 1.34 0.00 0.00 72.50 72.22 3bqb s THR 49 CO 0.05 -0.50 0.00 0.61 -0.54 0.00 0.00 174.62 174.24 3bqb n GLY 50 N 0.30 0.80 3.40 3.99 0.00 -1.26 -5.01 105.19 107.41 3bqb n GLY 50 Ca -0.14 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.44 3bqb n GLY 50 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3bqb s ILE 51 N -2.43 4.78 -0.94 -0.61 -1.09 -1.26 -4.99 121.20 114.66 3bqb s ILE 51 Ca 0.00 -1.15 -0.24 0.00 -2.23 0.00 0.00 60.65 57.03 3bqb s ILE 51 Cb 0.00 -4.59 0.04 0.00 -1.58 0.00 0.00 42.46 36.33 3bqb s ILE 51 CO 0.00 -1.27 1.42 -0.62 -1.23 0.00 0.00 174.94 173.25 3bqb s ASP 52 N 3.50 6.36 0.13 3.58 -1.08 -1.26 -4.84 116.67 123.06 3bqb s ASP 52 Ca 0.19 -1.15 -0.16 0.00 -0.52 0.00 0.00 52.55 50.91 3bqb s ASP 52 Cb -0.17 -2.57 -0.01 0.00 -1.46 0.00 0.00 42.92 38.72 3bqb s ASP 52 CO 0.02 -1.64 1.66 0.22 0.52 0.00 0.00 175.17 175.96 3bqb h TYR 53 N 9.95 0.64 -0.51 -5.34 3.20 -1.99 -2.19 116.97 120.72 3bqb h TYR 53 Ca 0.07 -0.06 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 3bqb h TYR 53 Cb 1.02 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.08 3bqb h TYR 53 CO 1.24 0.58 0.06 1.96 -1.64 0.00 0.00 178.16 180.35 3bqb h GLN 54 N 0.51 0.83 0.00 1.82 1.08 -2.01 -2.14 115.11 115.20 3bqb h GLN 54 Ca 0.13 -0.20 -0.12 0.00 -1.45 0.00 0.00 58.65 57.01 3bqb h GLN 54 Cb 0.23 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.53 3bqb h GLN 54 CO -0.01 0.79 -0.57 0.77 -0.95 0.00 0.00 178.83 178.86 3bqb h SER 55 N 0.78 0.00 -0.20 1.46 0.02 -1.95 -3.05 113.55 110.61 3bqb h SER 55 Ca 0.16 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 61.00 3bqb h SER 55 Cb 0.39 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.92 3bqb h SER 55 CO 0.01 0.57 -0.27 -0.07 -1.14 0.00 0.00 176.83 175.94 3bqb h LEU 56 N 0.00 0.69 -1.32 5.07 3.38 -0.87 0.26 115.31 122.52 3bqb h LEU 56 Ca -0.01 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.71 3bqb h LEU 56 Cb 1.03 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.56 3bqb h LEU 56 CO 0.07 0.93 0.41 -0.07 0.09 0.00 0.00 178.44 179.87 3bqb h LEU 57 N 0.58 0.76 0.05 1.67 3.38 -1.32 -0.34 115.31 120.10 3bqb h LEU 57 Ca 0.08 -0.03 -0.33 0.00 0.09 0.00 0.00 57.88 57.69 3bqb h LEU 57 Cb 0.76 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 3bqb h LEU 57 CO 0.06 0.57 -1.85 0.29 0.09 0.00 0.00 178.44 177.60 3bqb n LYS 58 N -4.42 0.69 -0.01 1.13 5.02 -1.05 -4.46 118.16 115.06 3bqb n LYS 58 Ca 0.07 0.27 0.09 0.00 -2.02 0.00 0.00 58.31 56.72 3bqb n LYS 58 Cb 0.05 -1.75 -0.14 0.00 -0.02 0.00 0.00 35.03 33.18 3bqb n LYS 58 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3bqb n SER 59 N -3.22 0.70 0.00 4.39 7.64 0.88 -5.01 113.62 119.00 3bqb n SER 59 Ca -0.24 -0.24 0.00 0.00 1.01 0.00 0.00 58.87 59.40 3bqb n SER 59 Cb 1.05 1.65 0.00 0.00 -1.01 0.00 0.00 64.21 65.90 3bqb n SER 59 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3bqb n PHE 60 N -1.98 0.00 -3.94 1.43 0.99 -0.14 -4.71 117.46 109.11 3bqb n PHE 60 Ca -0.02 0.00 -0.35 0.00 -0.00 0.00 0.00 57.45 57.09 3bqb n PHE 60 Cb 0.44 0.00 -0.14 0.00 -1.00 0.00 0.00 39.48 38.78 3bqb n PHE 60 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.76 175.62 3bqb s GLN 61 N 0.00 3.01 -0.16 -1.08 0.74 -1.26 -1.77 119.66 119.14 3bqb s GLN 61 Ca 0.00 -0.86 -0.02 0.00 0.05 0.00 0.00 55.36 54.52 3bqb s GLN 61 Cb 0.00 -3.00 -0.02 0.00 1.10 0.00 0.00 33.01 31.09 3bqb s GLN 61 CO 0.00 -0.34 -0.07 0.42 -0.55 0.00 0.00 175.29 174.75 3bqb s ILE 62 N 1.38 3.52 0.00 -2.34 -1.09 -0.37 -4.99 121.20 117.31 3bqb s ILE 62 Ca 0.02 -0.49 0.00 0.00 -2.23 0.00 0.00 60.65 57.96 3bqb s ILE 62 Cb -0.16 -2.53 0.00 0.00 -1.58 0.00 0.00 42.46 38.19 3bqb s ILE 62 CO -0.04 0.49 0.00 0.59 -1.23 0.00 0.00 174.94 174.75 3bqb n ASN 63 N 3.71 0.00 -0.53 3.58 5.03 -1.26 -1.39 115.26 124.40 3bqb n ASN 63 Ca -0.18 0.00 0.05 0.00 0.87 0.00 0.00 54.58 55.32 3bqb n ASN 63 Cb 0.52 0.00 0.14 0.00 -1.02 0.00 0.00 39.78 39.42 3bqb n ASN 63 CO 0.00 0.00 0.00 -0.90 -1.83 0.00 0.00 177.26 174.53 3bqb n ASP 64 N 5.57 2.88 -4.64 6.41 5.75 -1.26 -4.94 116.55 126.32 3bqb n ASP 64 Ca 0.00 -2.21 -0.34 0.00 -0.01 0.00 0.00 54.79 52.23 3bqb n ASP 64 Cb 0.00 -0.25 -0.10 0.00 -1.03 0.00 0.00 41.12 39.74 3bqb n ASP 64 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 3bqb s ILE 65 N -1.37 4.01 -0.05 2.12 -4.36 -0.48 -4.11 121.20 116.95 3bqb s ILE 65 Ca 0.22 -0.40 -0.01 0.00 -0.26 0.00 0.00 60.65 60.20 3bqb s ILE 65 Cb 0.14 -2.68 0.03 0.00 1.25 0.00 0.00 42.46 41.20 3bqb s ILE 65 CO 0.11 0.57 0.01 -0.60 0.24 0.00 0.00 174.94 175.27 3bqb s ARG 66 N -0.94 0.42 0.60 0.37 3.52 -0.95 -1.23 118.95 120.74 3bqb s ARG 66 Ca 0.14 0.15 -0.19 0.00 -0.13 0.00 0.00 55.73 55.69 3bqb s ARG 66 Cb -0.11 -0.77 -0.03 0.00 -1.56 0.00 0.00 34.95 32.48 3bqb s ARG 66 CO 0.03 -0.26 1.25 -1.50 -0.81 0.00 0.00 175.30 174.01 3bqb s ILE 67 N 1.76 2.40 0.00 4.11 2.07 -0.73 -0.40 121.20 130.40 3bqb s ILE 67 Ca 0.01 0.25 0.00 0.00 -1.41 0.00 0.00 60.65 59.50 3bqb s ILE 67 Cb -0.13 -3.11 0.00 0.00 0.13 0.00 0.00 42.46 39.36 3bqb s ILE 67 CO -0.04 -0.05 0.00 1.07 -1.91 0.00 0.00 174.94 174.02 3bqb n THR 68 N -1.58 0.00 -1.68 4.00 5.66 -0.58 -4.80 114.28 115.29 3bqb n THR 68 Ca 0.14 0.00 -0.45 0.00 -3.05 0.00 0.00 64.05 60.69 3bqb n THR 68 Cb 0.49 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.23 3bqb n THR 68 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 3bqb n LYS 69 N 0.00 2.23 0.23 1.09 5.02 -1.26 -4.44 118.16 121.03 3bqb n LYS 69 Ca 0.00 0.80 0.06 0.00 -2.02 0.00 0.00 58.31 57.15 3bqb n LYS 69 Cb 0.00 -2.54 0.51 0.00 -0.02 0.00 0.00 35.03 32.98 3bqb n LYS 69 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 3bqb h PRO 70 N 5.33 0.00 -4.39 1.97 0.13 -1.84 -3.41 132.00 129.78 3bqb h PRO 70 Ca -0.45 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.48 3bqb h PRO 70 Cb 1.25 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.24 3bqb h PRO 70 CO 0.84 0.17 -0.53 0.96 -0.23 0.00 0.00 178.00 179.21 3bqb s ILE 71 N -4.67 0.02 -0.49 -3.56 -4.36 -1.26 -4.45 121.20 102.42 3bqb s ILE 71 Ca -0.04 -1.87 -0.16 0.00 -0.26 0.00 0.00 60.65 58.32 3bqb s ILE 71 Cb 0.16 -2.37 0.08 0.00 1.25 0.00 0.00 42.46 41.58 3bqb s ILE 71 CO 0.69 -0.07 0.46 -1.81 0.24 0.00 0.00 174.94 174.46 3bqb s ASP 72 N -3.12 6.17 -0.11 4.36 1.01 -1.26 -5.06 116.67 118.66 3bqb s ASP 72 Ca 0.34 -1.35 -0.30 0.00 0.71 0.00 0.00 52.55 51.95 3bqb s ASP 72 Cb 0.06 -2.21 -0.01 0.00 1.01 0.00 0.00 42.92 41.77 3bqb s ASP 72 CO 0.10 -0.74 1.02 -2.16 0.21 0.00 0.00 175.17 173.59 3bqb s PRO 73 N 1.84 4.41 0.43 8.23 0.04 -1.26 -4.92 135.00 143.76 3bqb s PRO 73 Ca 0.06 1.41 0.08 0.00 0.04 0.00 0.00 61.00 62.59 3bqb s PRO 73 Cb -0.24 -3.55 0.92 0.00 0.04 0.00 0.00 34.50 31.67 3bqb s PRO 73 CO 0.07 -0.34 2.07 -1.35 0.04 0.00 0.00 177.00 177.49 3bqb h PRO 74 N 7.13 0.46 -3.93 0.56 0.11 -1.85 -3.17 132.00 131.33 3bqb h PRO 74 Ca -0.31 -0.03 -0.18 0.00 0.11 0.00 0.00 66.00 65.60 3bqb h PRO 74 Cb 1.14 -0.10 -0.22 0.00 0.11 0.00 0.00 31.00 31.93 3bqb h PRO 74 CO 0.86 0.31 -0.70 -1.21 -0.21 0.00 0.00 178.00 177.05 3bqb s GLU 75 N -5.44 0.27 -0.10 1.05 2.02 -1.26 -4.27 118.70 110.97 3bqb s GLU 75 Ca -0.08 -0.52 0.01 0.00 0.02 0.00 0.00 54.97 54.40 3bqb s GLU 75 Cb 0.17 0.10 0.02 0.00 0.10 0.00 0.00 34.13 34.52 3bqb s GLU 75 CO 0.72 -0.05 -0.12 0.08 0.02 0.00 0.00 175.26 175.92 3bqb s VAL 76 N -1.26 1.27 0.25 2.63 1.01 0.21 -2.05 120.40 122.45 3bqb s VAL 76 Ca -0.14 -0.49 0.10 0.00 0.00 0.00 0.00 61.98 61.45 3bqb s VAL 76 Cb -0.09 -1.20 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 3bqb s VAL 76 CO -0.01 0.40 -0.08 0.26 0.00 0.00 0.00 175.10 175.67 3bqb s TRP 77 N 1.17 2.58 0.40 5.22 0.52 -0.10 0.18 118.94 128.90 3bqb s TRP 77 Ca -0.04 -0.25 0.04 0.00 0.02 0.00 0.00 56.10 55.87 3bqb s TRP 77 Cb -0.14 -1.17 -0.06 0.00 -1.15 0.00 0.00 33.47 30.95 3bqb s TRP 77 CO -0.03 0.61 0.04 0.20 0.02 0.00 0.00 176.95 177.79 3bqb s GLY 78 N -3.39 2.46 -0.25 0.98 0.00 0.13 -1.24 107.32 106.00 3bqb s GLY 78 Ca 0.29 -1.75 -0.02 0.00 0.00 0.00 0.00 44.72 43.25 3bqb s GLY 78 CO 0.17 -1.98 0.38 -0.45 0.00 0.00 0.00 173.10 171.22 3bqb s SER 79 N -3.65 0.31 0.48 1.64 0.15 -0.65 -1.92 113.70 110.06 3bqb s SER 79 Ca 0.29 0.10 -0.08 0.00 0.70 0.00 0.00 55.95 56.96 3bqb s SER 79 Cb 0.07 1.10 -0.05 0.00 -1.71 0.00 0.00 66.02 65.43 3bqb s SER 79 CO 0.14 -0.31 0.83 -0.83 1.20 0.00 0.00 173.24 174.26 3bqb s GLY 80 N 2.54 1.67 -1.15 9.45 0.00 -1.21 -1.86 107.32 116.76 3bqb s GLY 80 Ca 0.12 -0.33 -0.05 0.00 0.00 0.00 0.00 44.72 44.46 3bqb s GLY 80 CO -0.19 -0.14 0.90 1.39 0.00 0.00 0.00 173.10 175.06 3bqb n ILE 81 N -2.04 -7.12 0.89 0.90 5.41 -1.26 -4.32 119.36 111.82 3bqb n ILE 81 Ca 0.02 -0.91 0.09 0.00 1.00 0.00 0.00 62.75 62.95 3bqb n ILE 81 Cb 0.55 -5.41 -0.06 0.00 -0.71 0.00 0.00 39.64 34.01 3bqb n ILE 81 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3bqb n SER 82 N -3.12 1.32 -2.80 4.38 3.41 -1.26 -4.66 113.62 110.89 3bqb n SER 82 Ca -0.18 -1.16 -0.07 0.00 -0.26 0.00 0.00 58.87 57.20 3bqb n SER 82 Cb 0.64 0.77 0.00 0.00 -0.26 0.00 0.00 64.21 65.36 3bqb n SER 82 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3bqb n TYR 83 N -0.84 -1.29 -1.85 7.33 4.02 -1.26 -0.32 117.16 122.95 3bqb n TYR 83 Ca 0.06 -0.66 -0.40 0.00 -0.01 0.00 0.00 57.90 56.89 3bqb n TYR 83 Cb 0.35 -0.13 0.01 0.00 -0.02 0.00 0.00 39.34 39.55 3bqb n TYR 83 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 3bqb s GLU 84 N -2.64 3.91 1.47 -0.72 0.41 -1.26 -4.83 118.70 115.04 3bqb s GLU 84 Ca 0.09 2.43 0.00 0.00 -0.41 0.00 0.00 54.97 57.08 3bqb s GLU 84 Cb -0.01 -2.80 0.00 0.00 -1.78 0.00 0.00 34.13 29.54 3bqb s GLU 84 CO 0.06 -0.64 0.00 0.27 -0.49 0.00 0.00 175.26 174.45 3bqb n ASN 94 N 0.13 0.00 -4.65 -0.19 2.04 -1.26 -5.12 115.26 106.21 3bqb n ASN 94 Ca 0.03 0.00 -0.29 0.00 -0.44 0.00 0.00 54.58 53.88 3bqb n ASN 94 Cb 0.41 0.00 0.17 0.00 -2.53 0.00 0.00 39.78 37.83 3bqb n ASN 94 CO 0.00 0.00 0.00 0.68 -0.44 0.00 0.00 177.26 177.50 3bqb s VAL 95 N 0.00 2.34 0.50 3.53 -7.23 -1.26 -5.02 120.40 113.26 3bqb s VAL 95 Ca 0.00 0.11 -0.17 0.00 -1.81 0.00 0.00 61.98 60.10 3bqb s VAL 95 Cb 0.00 -2.45 -0.08 0.00 0.56 0.00 0.00 36.38 34.41 3bqb s VAL 95 CO 0.00 -0.14 0.99 0.00 -0.31 0.00 0.00 175.10 175.63 3bqb s ALA 96 N -2.80 3.02 -0.13 1.32 0.00 -1.26 -5.02 121.76 116.88 3bqb s ALA 96 Ca 0.65 0.26 -0.22 0.00 0.00 0.00 0.00 51.96 52.66 3bqb s ALA 96 Cb -0.20 -3.14 0.05 0.00 0.00 0.00 0.00 23.12 19.83 3bqb s ALA 96 CO 0.59 -0.22 0.55 -1.59 0.00 0.00 0.00 175.76 175.09 3bqb s LYS 97 N -3.86 0.77 -0.34 0.00 -2.85 -1.26 -2.46 119.74 109.74 3bqb s LYS 97 Ca 0.60 0.47 -0.07 0.00 -1.00 0.00 0.00 55.97 55.97 3bqb s LYS 97 Cb -0.11 0.37 0.04 0.00 -2.06 0.00 0.00 37.83 36.07 3bqb s LYS 97 CO 0.28 -0.17 0.11 0.42 0.10 0.00 0.00 175.35 176.09 3bqb s ILE 98 N -0.41 3.80 -1.08 3.79 1.01 0.20 -4.62 121.20 123.90 3bqb s ILE 98 Ca -0.05 -1.13 -0.07 0.00 0.00 0.00 0.00 60.65 59.39 3bqb s ILE 98 Cb -0.03 -3.16 -0.06 0.00 0.01 0.00 0.00 42.46 39.23 3bqb s ILE 98 CO 0.04 -0.19 0.91 0.18 0.00 0.00 0.00 174.94 175.89 3bqb n LEU 99 N 4.81 -5.18 0.00 2.97 4.77 -1.26 -2.88 117.00 120.24 3bqb n LEU 99 Ca -0.12 -0.73 0.00 0.00 -0.03 0.00 0.00 56.01 55.13 3bqb n LEU 99 Cb 0.45 -3.12 0.00 0.00 -2.33 0.00 0.00 43.42 38.41 3bqb n LEU 99 CO 0.32 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 3bqb n GLY 100 N -1.27 0.78 3.74 -0.72 0.00 -1.26 -4.92 105.19 101.54 3bqb n GLY 100 Ca -0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 3bqb n GLY 100 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3bqb s LYS 101 N 0.00 4.61 0.45 1.61 2.20 -1.14 -4.93 119.74 122.54 3bqb s LYS 101 Ca 0.00 1.72 -0.22 0.00 -0.36 0.00 0.00 55.97 57.11 3bqb s LYS 101 Cb 0.00 -3.26 -0.08 0.00 -1.51 0.00 0.00 37.83 32.97 3bqb s LYS 101 CO 0.00 0.12 1.07 -0.08 -0.36 0.00 0.00 175.35 176.10 3bqb s THR 102 N -0.43 3.58 0.48 3.43 -1.32 -1.26 0.60 115.64 120.72 3bqb s THR 102 Ca 0.48 1.12 0.17 0.00 -1.21 0.00 0.00 61.69 62.25 3bqb s THR 102 Cb -0.30 -3.53 0.24 0.00 -1.51 0.00 0.00 72.50 67.40 3bqb s THR 102 CO 0.36 -0.08 2.08 0.16 -2.21 0.00 0.00 174.62 174.92 3bqb h ILE 103 N 1.87 0.99 -0.18 5.08 3.07 -1.83 -2.41 117.51 124.10 3bqb h ILE 103 Ca -0.49 -0.34 -0.14 0.00 1.55 0.00 0.00 64.86 65.45 3bqb h ILE 103 Cb 1.23 1.18 0.00 0.00 -0.27 0.00 0.00 36.82 38.96 3bqb h ILE 103 CO 0.60 0.09 -0.43 1.88 -1.05 0.00 0.00 178.15 179.25 3bqb h TYR 104 N 0.00 0.78 0.00 0.16 0.05 -1.92 -2.76 116.97 113.28 3bqb h TYR 104 Ca -0.00 -0.30 -0.01 0.00 0.05 0.00 0.00 58.73 58.48 3bqb h TYR 104 Cb 0.18 -0.14 -0.00 0.00 1.01 0.00 0.00 36.73 37.77 3bqb h TYR 104 CO 0.00 1.06 -0.04 1.05 -1.05 0.00 0.00 178.16 179.18 3bqb h GLU 105 N 0.29 0.00 -0.41 4.88 4.11 -1.91 -1.93 114.58 119.60 3bqb h GLU 105 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 3bqb h GLU 105 Cb 1.04 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.27 3bqb h GLU 105 CO 0.09 0.04 0.22 0.87 0.07 0.00 0.00 179.01 180.30 3bqb h LYS 106 N 0.00 0.57 -0.53 1.06 1.57 -1.41 -2.61 116.57 115.23 3bqb h LYS 106 Ca -0.00 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 3bqb h LYS 106 Cb 0.94 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 3bqb h LYS 106 CO 0.01 0.46 0.01 0.28 -0.57 0.00 0.00 179.45 179.63 3bqb h VAL 107 N 0.52 1.25 -0.42 0.50 2.07 -1.26 -0.75 116.25 118.16 3bqb h VAL 107 Ca 0.14 -1.05 0.02 0.00 0.82 0.00 0.00 66.70 66.63 3bqb h VAL 107 Cb 0.06 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 3bqb h VAL 107 CO -0.02 0.37 0.25 0.22 0.02 0.00 0.00 177.57 178.41 3bqb h TYR 108 N 0.82 0.46 0.04 1.57 5.03 -1.22 -3.13 116.97 120.54 3bqb h TYR 108 Ca 0.16 0.01 -0.15 0.00 2.58 0.00 0.00 58.73 61.33 3bqb h TYR 108 Cb 0.48 -0.15 0.01 0.00 1.55 0.00 0.00 36.73 38.63 3bqb h TYR 108 CO 0.03 0.27 -0.62 -0.44 -1.32 0.00 0.00 178.16 176.08 3bqb h ASP 109 N 0.50 0.48 -3.22 -2.11 3.32 -1.41 -3.48 116.42 110.50 3bqb h ASP 109 Ca 0.17 -0.82 -0.56 0.00 0.02 0.00 0.00 57.03 55.84 3bqb h ASP 109 Cb 0.01 -0.15 0.19 0.00 0.22 0.00 0.00 39.33 39.59 3bqb h ASP 109 CO -0.07 1.24 -0.38 0.00 -1.72 0.00 0.00 179.24 178.31 3bqb n ALA 110 N -2.60 -1.46 0.15 3.45 0.00 -0.30 -4.91 120.51 114.85 3bqb n ALA 110 Ca -0.11 -0.23 0.01 0.00 0.00 0.00 0.00 53.44 53.10 3bqb n ALA 110 Cb 0.69 -1.86 0.29 0.00 0.00 0.00 0.00 19.45 18.57 3bqb n ALA 110 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 3bqb h VAL 111 N -0.35 1.31 -3.52 0.00 -1.51 -1.90 -3.41 116.25 106.88 3bqb h VAL 111 Ca -0.45 -1.51 -0.61 0.00 -1.23 0.00 0.00 66.70 62.90 3bqb h VAL 111 Cb 1.35 1.78 -0.12 0.00 -2.13 0.00 0.00 31.29 32.17 3bqb h VAL 111 CO 0.43 0.43 0.04 -0.60 -1.23 0.00 0.00 177.57 176.64 3bqb s ARG 112 N -4.06 4.12 0.76 5.19 3.52 -1.26 -5.08 118.95 122.13 3bqb s ARG 112 Ca -0.03 0.43 -0.10 0.00 -0.13 0.00 0.00 55.73 55.90 3bqb s ARG 112 Cb 0.14 -3.63 0.06 0.00 -1.56 0.00 0.00 34.95 29.97 3bqb s ARG 112 CO 0.74 -0.32 1.10 -1.25 -0.81 0.00 0.00 175.30 174.77 3bqb s PRO 113 N 2.19 2.16 -0.06 5.12 0.04 -1.26 -4.87 135.00 138.32 3bqb s PRO 113 Ca 0.24 0.01 -0.30 0.00 0.04 0.00 0.00 61.00 60.99 3bqb s PRO 113 Cb -0.16 -2.04 -0.03 0.00 0.04 0.00 0.00 34.50 32.31 3bqb s PRO 113 CO 0.09 -1.39 1.17 -2.00 0.04 0.00 0.00 177.00 174.91 3bqb s GLU 114 N -5.42 4.37 -0.08 4.56 2.12 -1.26 -5.03 118.70 117.96 3bqb s GLU 114 Ca 0.61 1.63 0.02 0.00 0.36 0.00 0.00 54.97 57.59 3bqb s GLU 114 Cb -0.11 -3.55 0.01 0.00 0.26 0.00 0.00 34.13 30.75 3bqb s GLU 114 CO 0.48 -0.42 -0.12 0.42 -0.54 0.00 0.00 175.26 175.07 3bqb s ILE 115 N 2.15 1.19 0.03 -3.70 -1.09 -1.26 -3.32 121.20 115.20 3bqb s ILE 115 Ca 0.55 -0.49 -0.03 0.00 -2.23 0.00 0.00 60.65 58.45 3bqb s ILE 115 Cb -0.24 -1.10 -0.02 0.00 -1.58 0.00 0.00 42.46 39.53 3bqb s ILE 115 CO 0.22 0.37 0.04 0.72 -1.23 0.00 0.00 174.94 175.06 3bqb s PHE 116 N 0.82 0.26 0.01 3.97 -0.12 -0.81 -4.99 117.98 117.12 3bqb s PHE 116 Ca -0.11 -0.58 -0.30 0.00 -0.05 0.00 0.00 56.93 55.88 3bqb s PHE 116 Cb -0.15 -0.19 -0.03 0.00 -0.63 0.00 0.00 43.02 42.01 3bqb s PHE 116 CO 0.02 -0.31 1.01 0.12 -0.05 0.00 0.00 175.22 176.01 3bqb s PHE 117 N -2.40 3.63 -0.15 3.49 2.19 -1.26 0.19 117.98 123.66 3bqb s PHE 117 Ca -0.07 1.65 -0.08 0.00 0.33 0.00 0.00 56.93 58.75 3bqb s PHE 117 Cb -0.03 -3.16 -0.07 0.00 -1.31 0.00 0.00 43.02 38.46 3bqb s PHE 117 CO -0.04 -0.18 -0.21 1.17 1.83 0.00 0.00 175.22 177.79 3bqb n LYS 118 N 3.86 0.34 -3.53 10.12 3.00 0.13 -4.84 118.16 127.24 3bqb n LYS 118 Ca 0.06 0.15 -0.12 0.00 -0.00 0.00 0.00 58.31 58.40 3bqb n LYS 118 Cb 0.50 -1.07 -0.04 0.00 0.00 0.00 0.00 35.03 34.42 3bqb n LYS 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3bqb s ALA 119 N -2.32 -1.34 0.33 3.14 0.00 -0.60 -4.35 121.76 116.63 3bqb s ALA 119 Ca -0.22 0.42 0.03 0.00 0.00 0.00 0.00 51.96 52.19 3bqb s ALA 119 Cb 0.08 0.63 -0.02 0.00 0.00 0.00 0.00 23.12 23.81 3bqb s ALA 119 CO 0.28 -0.63 0.49 0.95 0.00 0.00 0.00 175.76 176.85 3bqb s THR 120 N -3.22 4.74 0.26 0.00 -4.23 -1.26 -0.62 115.64 111.31 3bqb s THR 120 Ca -0.01 -0.76 -0.02 0.00 -1.18 0.00 0.00 61.69 59.72 3bqb s THR 120 Cb -0.00 -3.70 0.25 0.00 1.34 0.00 0.00 72.50 70.39 3bqb s THR 120 CO -0.08 -0.36 1.83 1.55 -0.54 0.00 0.00 174.62 177.02 3bqb h PRO 121 N 0.86 0.89 0.00 3.99 0.13 -1.73 -1.36 132.00 134.78 3bqb h PRO 121 Ca -0.49 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 3bqb h PRO 121 Cb 1.24 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 32.17 3bqb h PRO 121 CO 0.59 0.59 0.00 0.27 -0.23 0.00 0.00 178.00 179.22 3bqb n ASN 122 N -4.66 0.70 0.02 1.44 6.94 -1.26 -1.58 115.26 116.85 3bqb n ASN 122 Ca 0.16 0.67 0.12 0.00 -0.02 0.00 0.00 54.58 55.51 3bqb n ASN 122 Cb 0.30 -0.82 0.25 0.00 -2.36 0.00 0.00 39.78 37.14 3bqb n ASN 122 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3bqb n ARG 123 N -2.27 0.10 -3.28 -3.83 1.74 -0.52 -4.80 116.66 103.81 3bqb n ARG 123 Ca 0.02 0.03 -0.33 0.00 -0.77 0.00 0.00 57.85 56.80 3bqb n ARG 123 Cb 0.23 -1.56 -0.06 0.00 -1.02 0.00 0.00 32.46 30.05 3bqb n ARG 123 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3bqb s VAL 125 N -1.83 0.95 0.00 0.00 -7.23 -0.06 -4.91 120.40 107.32 3bqb s VAL 125 Ca 0.49 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.66 3bqb s VAL 125 Cb -0.12 -2.46 0.00 0.00 0.56 0.00 0.00 36.38 34.37 3bqb s VAL 125 CO 0.19 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.59 3bqb n GLY 126 N -0.94 5.04 3.68 2.32 0.00 -1.26 -2.23 105.19 111.79 3bqb n GLY 126 Ca -0.08 -1.81 -0.47 0.00 0.00 0.00 0.00 46.02 43.66 3bqb n GLY 126 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3bqb n HIS 127 N 0.00 2.32 0.00 1.61 -0.00 -1.26 -1.40 115.22 116.50 3bqb n HIS 127 Ca 0.00 0.10 0.00 0.00 0.46 0.00 0.00 57.72 58.28 3bqb n HIS 127 Cb 0.00 -2.62 0.00 0.00 -0.12 0.00 0.00 29.99 27.25 3bqb n HIS 127 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3bqb n GLY 128 N 3.97 2.41 3.92 1.57 0.00 0.46 -4.53 105.19 112.99 3bqb n GLY 128 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 3bqb n GLY 128 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3bqb s GLU 129 N -0.46 3.55 -0.12 1.61 2.02 -0.49 -4.61 118.70 120.19 3bqb s GLU 129 Ca 0.00 -0.25 -0.29 0.00 0.02 0.00 0.00 54.97 54.45 3bqb s GLU 129 Cb 0.00 -2.83 -0.01 0.00 0.10 0.00 0.00 34.13 31.39 3bqb s GLU 129 CO 0.00 0.41 0.99 0.00 0.02 0.00 0.00 175.26 176.67 3bqb s ALA 130 N -1.82 3.44 0.83 5.21 0.00 -1.26 -3.90 121.76 124.26 3bqb s ALA 130 Ca 0.39 0.32 -0.12 0.00 0.00 0.00 0.00 51.96 52.55 3bqb s ALA 130 Cb -0.11 -3.42 0.09 0.00 0.00 0.00 0.00 23.12 19.68 3bqb s ALA 130 CO 0.28 -0.65 1.13 0.96 0.00 0.00 0.00 175.76 177.48 3bqb s ILE 131 N 2.13 2.49 0.12 0.00 -4.36 -0.67 -4.83 121.20 116.07 3bqb s ILE 131 Ca 0.47 0.16 0.08 0.00 -0.26 0.00 0.00 60.65 61.09 3bqb s ILE 131 Cb -0.18 -3.00 -0.04 0.00 1.25 0.00 0.00 42.46 40.50 3bqb s ILE 131 CO 0.16 -0.21 -0.18 0.00 0.24 0.00 0.00 174.94 174.95 3bqb s ALA 132 N -3.33 1.73 -0.17 2.27 0.00 0.13 -1.09 121.76 121.30 3bqb s ALA 132 Ca 0.62 -1.29 -0.04 0.00 0.00 0.00 0.00 51.96 51.25 3bqb s ALA 132 Cb -0.13 -0.18 -0.03 0.00 0.00 0.00 0.00 23.12 22.78 3bqb s ALA 132 CO 0.52 0.26 -0.03 0.08 0.00 0.00 0.00 175.76 176.59 3bqb s VAL 133 N -1.58 3.86 0.54 0.00 1.01 0.45 -4.73 120.40 119.95 3bqb s VAL 133 Ca 0.08 -0.36 -0.22 0.00 0.00 0.00 0.00 61.98 61.48 3bqb s VAL 133 Cb -0.08 -2.71 -0.05 0.00 0.00 0.00 0.00 36.38 33.54 3bqb s VAL 133 CO 0.04 0.47 1.36 0.54 0.00 0.00 0.00 175.10 177.52 3bqb n ARG 134 N 3.78 1.74 -0.03 2.72 1.74 -1.26 -1.65 116.66 123.69 3bqb n ARG 134 Ca -0.17 0.64 0.16 0.00 -0.77 0.00 0.00 57.85 57.70 3bqb n ARG 134 Cb 0.52 -2.58 0.60 0.00 -1.02 0.00 0.00 32.46 29.98 3bqb n ARG 134 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3bqb h SER 135 N 1.50 0.18 -0.68 0.55 4.64 -1.86 -2.50 113.55 115.38 3bqb h SER 135 Ca -0.51 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 3bqb h SER 135 Cb 1.30 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 3bqb h SER 135 CO 0.57 0.10 0.00 -0.90 -0.87 0.00 0.00 176.83 175.74 3bqb n ASP 136 N -4.44 4.43 -4.47 4.97 3.85 -1.26 -4.91 116.55 114.73 3bqb n ASP 136 Ca 0.10 -2.27 -0.34 0.00 -0.71 0.00 0.00 54.79 51.57 3bqb n ASP 136 Cb 0.48 -0.54 -0.13 0.00 -1.35 0.00 0.00 41.12 39.59 3bqb n ASP 136 CO 0.00 0.00 0.00 -0.55 -1.01 0.00 0.00 177.20 175.64 3bqb s SER 137 N -0.96 4.65 0.00 -1.12 0.15 -0.94 -4.98 113.70 110.50 3bqb s SER 137 Ca 0.50 -0.17 0.17 0.00 0.70 0.00 0.00 55.95 57.15 3bqb s SER 137 Cb 0.30 -1.75 0.22 0.00 -1.71 0.00 0.00 66.02 63.08 3bqb s SER 137 CO 0.28 0.16 1.14 -0.62 1.20 0.00 0.00 173.24 175.40 3bqb n GLU 138 N 3.57 1.76 -2.94 5.44 4.71 -1.26 -4.74 120.64 127.16 3bqb n GLU 138 Ca -0.17 -1.74 -0.12 0.00 -0.01 0.00 0.00 57.16 55.12 3bqb n GLU 138 Cb 0.52 -1.35 -0.02 0.00 -1.01 0.00 0.00 31.44 29.59 3bqb n GLU 138 CO 0.00 0.00 0.00 1.87 0.09 0.00 0.00 177.13 179.09 3bqb n TRP 139 N 1.00 -2.82 -3.80 -0.32 -0.00 -1.26 -4.87 117.44 105.36 3bqb n TRP 139 Ca 0.12 -2.05 -0.35 0.00 -0.00 0.00 0.00 57.50 55.22 3bqb n TRP 139 Cb 0.45 1.07 -0.09 0.00 -0.00 0.00 0.00 31.31 32.75 3bqb n TRP 139 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 177.69 178.68 3bqb s THR 140 N 0.51 5.21 0.01 5.87 2.01 -1.26 -1.05 115.64 126.94 3bqb s THR 140 Ca 0.31 0.12 0.08 0.00 0.31 0.00 0.00 61.69 62.51 3bqb s THR 140 Cb 0.05 -3.38 -0.02 0.00 0.01 0.00 0.00 72.50 69.16 3bqb s THR 140 CO -0.12 0.44 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.24 3bqb s LEU 141 N 0.44 2.11 0.22 4.42 1.43 -0.49 -0.65 118.68 126.17 3bqb s LEU 141 Ca 0.06 -0.50 -0.30 0.00 -1.03 0.00 0.00 54.13 52.36 3bqb s LEU 141 Cb -0.12 -1.23 -0.09 0.00 0.03 0.00 0.00 46.19 44.79 3bqb s LEU 141 CO -0.01 0.27 0.94 -2.16 0.23 0.00 0.00 176.35 175.62 3bqb s PRO 142 N -0.89 4.84 -0.39 1.29 0.04 -1.26 -1.56 135.00 137.07 3bqb s PRO 142 Ca 0.10 1.49 -0.00 0.00 0.04 0.00 0.00 61.00 62.62 3bqb s PRO 142 Cb -0.10 -3.29 0.11 0.00 0.04 0.00 0.00 34.50 31.26 3bqb s PRO 142 CO 0.00 0.48 0.15 -1.21 0.04 0.00 0.00 177.00 176.47 3bqb s GLU 143 N -1.04 1.82 -0.04 4.56 2.02 -1.17 -4.89 118.70 119.96 3bqb s GLU 143 Ca 0.42 -1.85 -0.30 0.00 0.02 0.00 0.00 54.97 53.26 3bqb s GLU 143 Cb -0.26 -3.45 -0.04 0.00 0.10 0.00 0.00 34.13 30.48 3bqb s GLU 143 CO 0.32 -1.03 1.25 -1.25 0.02 0.00 0.00 175.26 174.57 3bqb s PRO 144 N 1.04 4.34 0.03 0.39 0.04 -1.26 -1.68 135.00 137.90 3bqb s PRO 144 Ca 0.09 1.75 -0.05 0.00 0.04 0.00 0.00 61.00 62.83 3bqb s PRO 144 Cb -0.21 -3.55 -0.01 0.00 0.04 0.00 0.00 34.50 30.76 3bqb s PRO 144 CO -0.06 -0.47 0.08 -1.21 0.04 0.00 0.00 177.00 175.38 3bqb s GLU 145 N 2.20 0.52 0.40 4.56 2.02 -0.28 -4.45 118.70 123.67 3bqb s GLU 145 Ca 0.58 -0.67 -0.23 0.00 0.02 0.00 0.00 54.97 54.67 3bqb s GLU 145 Cb -0.27 0.20 -0.10 0.00 0.10 0.00 0.00 34.13 34.07 3bqb s GLU 145 CO 0.23 -0.12 0.98 -1.17 0.02 0.00 0.00 175.26 175.20 3bqb s LEU 146 N -1.88 4.08 -0.00 1.80 2.96 -1.26 -1.35 118.68 123.03 3bqb s LEU 146 Ca -0.09 1.83 -0.04 0.00 -0.22 0.00 0.00 54.13 55.62 3bqb s LEU 146 Cb -0.04 -4.32 -0.00 0.00 0.50 0.00 0.00 46.19 42.33 3bqb s LEU 146 CO -0.03 -0.35 0.07 0.00 -1.32 0.00 0.00 176.35 174.72 3bqb s ALA 147 N -1.89 -0.14 0.03 5.97 0.00 -0.58 -1.50 121.76 123.65 3bqb s ALA 147 Ca 0.58 -0.16 0.07 0.00 0.00 0.00 0.00 51.96 52.45 3bqb s ALA 147 Cb -0.15 0.04 -0.03 0.00 0.00 0.00 0.00 23.12 22.98 3bqb s ALA 147 CO 0.20 -0.14 -0.17 0.14 0.00 0.00 0.00 175.76 175.79 3bqb s VAL 148 N -0.95 2.88 -0.18 0.00 -7.23 -0.06 -1.13 120.40 113.73 3bqb s VAL 148 Ca -0.10 -1.12 -0.16 0.00 -1.81 0.00 0.00 61.98 58.78 3bqb s VAL 148 Cb -0.06 -2.21 -0.04 0.00 0.56 0.00 0.00 36.38 34.63 3bqb s VAL 148 CO 0.00 0.36 0.39 -0.69 -0.31 0.00 0.00 175.10 174.85 3bqb s VAL 149 N -0.92 5.22 0.13 1.32 1.01 -0.24 -0.89 120.40 126.03 3bqb s VAL 149 Ca 0.15 0.72 0.06 0.00 0.00 0.00 0.00 61.98 62.91 3bqb s VAL 149 Cb -0.11 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 3bqb s VAL 149 CO 0.05 0.29 -0.02 -0.76 0.00 0.00 0.00 175.10 174.66 3bqb s LEU 150 N 1.03 3.31 0.65 3.92 1.02 0.17 0.48 118.68 129.26 3bqb s LEU 150 Ca 0.20 -0.31 0.02 0.00 0.02 0.00 0.00 54.13 54.06 3bqb s LEU 150 Cb -0.14 -2.03 0.09 0.00 0.02 0.00 0.00 46.19 44.13 3bqb s LEU 150 CO 0.08 0.14 0.89 1.51 0.02 0.00 0.00 176.35 178.99 3bqb s ASP 151 N -2.55 4.74 0.30 2.29 -4.77 -0.83 -0.74 116.67 115.10 3bqb s ASP 151 Ca 0.26 -0.38 0.24 0.00 -3.30 0.00 0.00 52.55 49.36 3bqb s ASP 151 Cb -0.11 -0.17 1.09 0.00 -1.09 0.00 0.00 42.92 42.64 3bqb s ASP 151 CO 0.17 -1.57 1.71 -1.54 0.70 0.00 0.00 175.17 174.65 3bqb n SER 152 N -2.58 0.67 -0.24 2.11 3.41 -1.26 -0.78 113.62 114.94 3bqb n SER 152 Ca 0.13 0.71 0.14 0.00 -0.26 0.00 0.00 58.87 59.59 3bqb n SER 152 Cb 0.60 -0.84 0.50 0.00 -0.26 0.00 0.00 64.21 64.22 3bqb n SER 152 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3bqb n ASN 153 N -2.29 0.91 0.00 4.04 3.02 -1.26 -4.57 115.26 115.11 3bqb n ASN 153 Ca 0.01 -0.92 0.00 0.00 -0.03 0.00 0.00 54.58 53.63 3bqb n ASN 153 Cb 0.16 0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.37 3bqb n ASN 153 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3bqb n GLY 154 N 1.27 0.79 3.73 7.41 0.00 0.04 -5.04 105.19 113.39 3bqb n GLY 154 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 3bqb n GLY 154 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3bqb s LYS 155 N -0.39 4.38 -0.01 1.61 2.20 -1.26 -4.77 119.74 121.49 3bqb s LYS 155 Ca 0.00 2.01 -0.30 0.00 -0.36 0.00 0.00 55.97 57.32 3bqb s LYS 155 Cb 0.00 -3.24 -0.05 0.00 -1.51 0.00 0.00 37.83 33.03 3bqb s LYS 155 CO 0.00 -0.31 1.42 0.42 -0.36 0.00 0.00 175.35 176.53 3bqb s ILE 156 N 0.56 3.72 -1.36 5.43 1.01 -1.26 -1.96 121.20 127.35 3bqb s ILE 156 Ca 0.59 1.07 0.22 0.00 0.00 0.00 0.00 60.65 62.53 3bqb s ILE 156 Cb -0.35 -3.69 -0.16 0.00 0.01 0.00 0.00 42.46 38.27 3bqb s ILE 156 CO 0.34 -0.02 0.96 0.18 0.00 0.00 0.00 174.94 176.41 3bqb n LEU 157 N 5.62 1.36 0.00 2.97 4.77 0.18 -4.88 117.00 127.01 3bqb n LEU 157 Ca 0.14 -0.59 0.00 0.00 -0.03 0.00 0.00 56.01 55.53 3bqb n LEU 157 Cb 0.44 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 3bqb n LEU 157 CO 0.59 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 177.55 3bqb n GLY 158 N 1.47 0.62 3.39 -0.72 0.00 -1.24 -3.94 105.19 104.77 3bqb n GLY 158 Ca 0.06 -1.28 -0.20 0.00 0.00 0.00 0.00 46.02 44.60 3bqb n GLY 158 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3bqb s TYR 159 N -1.95 1.90 0.17 1.61 2.02 0.95 -1.07 117.35 120.96 3bqb s TYR 159 Ca 0.00 -0.55 -0.24 0.00 -0.37 0.00 0.00 57.07 55.91 3bqb s TYR 159 Cb 0.00 -0.92 0.06 0.00 -0.40 0.00 0.00 41.96 40.69 3bqb s TYR 159 CO 0.00 0.42 0.83 -0.08 -1.57 0.00 0.00 175.55 175.14 3bqb s THR 160 N -2.88 0.00 0.07 -0.71 -1.32 -0.29 -0.75 115.64 109.76 3bqb s THR 160 Ca 0.26 -0.56 -0.23 0.00 -1.21 0.00 0.00 61.69 59.95 3bqb s THR 160 Cb -0.00 -1.69 -0.06 0.00 -1.51 0.00 0.00 72.50 69.23 3bqb s THR 160 CO 0.10 0.00 0.70 -0.63 -2.21 0.00 0.00 174.62 172.58 3bqb s ILE 161 N -3.51 4.69 -0.02 5.08 1.01 -1.25 -1.52 121.20 125.68 3bqb s ILE 161 Ca 0.09 1.50 0.02 0.00 0.00 0.00 0.00 60.65 62.26 3bqb s ILE 161 Cb -0.03 -4.05 0.00 0.00 0.01 0.00 0.00 42.46 38.40 3bqb s ILE 161 CO -0.00 0.44 -0.06 -0.32 0.00 0.00 0.00 174.94 175.00 3bqb s MET 162 N -0.50 0.58 -0.44 2.79 1.75 -0.45 -2.19 119.30 120.84 3bqb s MET 162 Ca 0.35 -0.18 -0.12 0.00 -1.25 0.00 0.00 55.69 54.49 3bqb s MET 162 Cb -0.20 -0.58 0.07 0.00 2.84 0.00 0.00 34.83 36.96 3bqb s MET 162 CO 0.22 0.07 0.31 0.34 -0.65 0.00 0.00 175.02 175.30 3bqb s ASP 163 N 0.16 5.84 -1.09 1.11 -1.08 0.89 -1.12 116.67 121.38 3bqb s ASP 163 Ca -0.02 -1.40 -0.19 0.00 -0.52 0.00 0.00 52.55 50.42 3bqb s ASP 163 Cb -0.06 -2.06 0.10 0.00 -1.46 0.00 0.00 42.92 39.44 3bqb s ASP 163 CO -0.00 -0.57 1.42 -0.62 0.52 0.00 0.00 175.17 175.92 3bqb s ASP 164 N 2.25 6.71 -0.10 -0.34 -1.08 -0.68 -2.38 116.67 121.05 3bqb s ASP 164 Ca 0.03 -2.10 -0.29 0.00 -0.52 0.00 0.00 52.55 49.67 3bqb s ASP 164 Cb -0.23 -2.49 -0.04 0.00 -1.46 0.00 0.00 42.92 38.70 3bqb s ASP 164 CO 0.04 -1.18 1.50 -0.69 0.52 0.00 0.00 175.17 175.36 3bqb s VAL 165 N 3.57 3.86 -0.12 1.11 1.01 -0.45 -3.02 120.40 126.35 3bqb s VAL 165 Ca 0.43 1.04 0.01 0.00 0.00 0.00 0.00 61.98 63.46 3bqb s VAL 165 Cb -0.01 -3.67 0.02 0.00 0.00 0.00 0.00 36.38 32.72 3bqb s VAL 165 CO -0.04 -0.10 -0.14 -0.44 0.00 0.00 0.00 175.10 174.38 3bqb s SER 166 N 2.82 2.48 -0.82 3.32 0.01 -0.60 -4.66 113.70 116.25 3bqb s SER 166 Ca 0.66 -0.43 -0.26 0.00 1.31 0.00 0.00 55.95 57.23 3bqb s SER 166 Cb -0.29 -1.09 0.03 0.00 0.21 0.00 0.00 66.02 64.89 3bqb s SER 166 CO 0.24 -0.02 1.37 0.00 0.41 0.00 0.00 173.24 175.23 3bqb s ALA 167 N 1.23 2.69 0.14 1.44 0.00 -0.68 -1.39 121.76 125.19 3bqb s ALA 167 Ca -0.01 -1.59 -0.00 0.00 0.00 0.00 0.00 51.96 50.35 3bqb s ALA 167 Cb -0.14 -4.35 -0.07 0.00 0.00 0.00 0.00 23.12 18.57 3bqb s ALA 167 CO -0.05 -3.45 1.33 0.00 0.00 0.00 0.00 175.76 173.59 3bqb h ARG 168 N 10.23 0.26 -0.70 0.00 2.47 -1.43 -3.01 114.38 122.20 3bqb h ARG 168 Ca -0.13 -0.30 0.04 0.00 -1.26 0.00 0.00 59.98 58.33 3bqb h ARG 168 Cb 1.04 0.09 -0.04 0.00 -1.65 0.00 0.00 29.97 29.41 3bqb h ARG 168 CO 1.32 1.02 0.46 0.38 0.56 0.00 0.00 179.97 183.71 3bqb h ASP 169 N 0.14 0.71 -0.08 7.04 2.03 -1.89 -0.17 116.42 124.19 3bqb h ASP 169 Ca -0.06 -0.01 -0.12 0.00 -0.73 0.00 0.00 57.03 56.11 3bqb h ASP 169 Cb 1.58 -0.16 0.01 0.00 -0.83 0.00 0.00 39.33 39.92 3bqb h ASP 169 CO 0.15 0.48 -0.43 -0.07 -1.03 0.00 0.00 179.24 178.34 3bqb h LEU 170 N 0.82 0.52 -1.28 0.15 3.38 -1.88 -2.08 115.31 114.95 3bqb h LEU 170 Ca 0.28 -0.65 0.05 0.00 0.09 0.00 0.00 57.88 57.65 3bqb h LEU 170 Cb 0.10 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 3bqb h LEU 170 CO -0.08 1.09 0.52 -0.08 0.09 0.00 0.00 178.44 179.97 3bqb h GLU 171 N -0.01 0.88 -0.09 1.13 4.81 -1.37 -2.78 114.58 117.14 3bqb h GLU 171 Ca -0.03 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 3bqb h GLU 171 Cb 1.08 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.26 3bqb h GLU 171 CO 0.09 0.58 -0.03 0.00 -0.73 0.00 0.00 179.01 178.92 3bqb h ALA 172 N 1.56 0.13 -0.80 2.92 0.00 -0.94 -3.17 119.26 118.96 3bqb h ALA 172 Ca 0.33 -0.22 0.14 0.00 0.00 0.00 0.00 54.91 55.16 3bqb h ALA 172 Cb 0.15 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.82 3bqb h ALA 172 CO -0.11 -0.14 0.38 0.93 0.00 0.00 0.00 179.25 180.31 3bqb h GLU 173 N -0.16 0.53 -1.75 0.00 5.08 -1.18 -3.43 114.58 113.68 3bqb h GLU 173 Ca 0.02 -0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.43 3bqb h GLU 173 Cb 0.44 -0.12 -0.22 0.00 0.50 0.00 0.00 28.75 29.35 3bqb h GLU 173 CO 0.01 0.35 0.07 1.21 -1.00 0.00 0.00 179.01 179.66 3bqb s ASN 174 N -5.40 -0.87 0.25 1.42 3.84 -1.07 -5.01 114.94 108.10 3bqb s ASN 174 Ca -0.12 1.29 0.19 0.00 0.21 0.00 0.00 52.86 54.43 3bqb s ASN 174 Cb 0.21 1.70 0.96 0.00 -0.55 0.00 0.00 41.25 43.57 3bqb s ASN 174 CO 0.77 -0.19 1.59 -0.81 -2.79 0.00 0.00 177.10 175.67 3bqb n PRO 175 N 4.68 0.13 0.04 0.43 -0.04 -1.21 -0.70 135.00 138.34 3bqb n PRO 175 Ca -0.15 0.55 0.10 0.00 -0.04 0.00 0.00 63.50 63.96 3bqb n PRO 175 Cb 0.54 -1.86 0.43 0.00 -0.04 0.00 0.00 33.50 32.57 3bqb n PRO 175 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3bqb n LEU 176 N -2.13 0.26 -0.59 1.53 4.77 -1.26 -2.11 117.00 117.48 3bqb n LEU 176 Ca -0.00 0.55 0.10 0.00 -0.03 0.00 0.00 56.01 56.63 3bqb n LEU 176 Cb 0.09 -0.50 0.34 0.00 -2.33 0.00 0.00 43.42 41.02 3bqb n LEU 176 CO 0.11 -0.27 0.75 -1.22 -1.33 0.00 0.00 177.39 175.43 3bqb n TYR 177 N -1.77 0.26 -0.11 -1.77 4.01 0.13 -4.56 117.16 113.33 3bqb n TYR 177 Ca 0.04 -0.13 -0.05 0.00 -0.16 0.00 0.00 57.90 57.60 3bqb n TYR 177 Cb 0.25 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.30 3bqb n TYR 177 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 3bqb h LEU 178 N 2.28 -0.05 -1.29 7.72 5.85 -1.54 -1.62 115.31 126.65 3bqb h LEU 178 Ca 0.00 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 3bqb h LEU 178 Cb 0.50 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 3bqb h LEU 178 CO 0.00 0.01 0.39 -0.65 -0.34 0.00 0.00 178.44 177.85 3bqb h PRO 179 N 0.17 0.87 -0.05 5.25 0.11 -1.84 -1.13 132.00 135.38 3bqb h PRO 179 Ca 0.19 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 66.18 3bqb h PRO 179 Cb 0.24 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.16 3bqb h PRO 179 CO -0.27 0.61 -0.20 1.96 -0.21 0.00 0.00 178.00 179.88 3bqb h GLN 180 N 0.89 0.07 0.00 1.05 4.20 -1.68 -0.90 115.11 118.73 3bqb h GLN 180 Ca 0.23 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.90 3bqb h GLN 180 Cb -0.04 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 27.73 3bqb h GLN 180 CO -0.04 0.28 -0.13 0.66 -0.67 0.00 0.00 178.83 178.93 3bqb h SER 181 N 0.07 0.00 0.00 1.46 4.64 -0.33 -3.37 113.55 116.02 3bqb h SER 181 Ca 0.01 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.11 3bqb h SER 181 Cb 0.40 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.45 3bqb h SER 181 CO 0.03 0.13 -1.99 0.29 -0.87 0.00 0.00 176.83 174.42 3bqb n LYS 182 N -3.13 1.34 -4.03 4.77 4.76 -0.63 -1.68 118.16 119.55 3bqb n LYS 182 Ca 0.03 -0.03 -0.31 0.00 -2.87 0.00 0.00 58.31 55.13 3bqb n LYS 182 Cb 0.57 -1.39 -0.15 0.00 -1.84 0.00 0.00 35.03 32.23 3bqb n LYS 182 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3bqb s ILE 183 N -2.50 2.18 0.27 -0.18 1.01 -0.36 -4.82 121.20 116.80 3bqb s ILE 183 Ca -0.07 -1.99 -0.19 0.00 0.00 0.00 0.00 60.65 58.40 3bqb s ILE 183 Cb 0.06 -2.46 0.07 0.00 0.01 0.00 0.00 42.46 40.13 3bqb s ILE 183 CO 0.63 -0.34 0.93 -0.72 0.00 0.00 0.00 174.94 175.44 3bqb s TYR 184 N 1.02 0.09 -0.05 3.97 -0.85 -1.26 -4.76 117.35 115.51 3bqb s TYR 184 Ca 0.02 -0.62 -0.30 0.00 -0.52 0.00 0.00 57.07 55.65 3bqb s TYR 184 Cb -0.19 0.76 -0.06 0.00 0.38 0.00 0.00 41.96 42.85 3bqb s TYR 184 CO -0.07 -1.21 1.67 0.00 -1.52 0.00 0.00 175.55 174.42 3bqb s ALA 185 N -2.23 3.62 -0.24 9.51 0.00 -1.26 -2.62 121.76 128.54 3bqb s ALA 185 Ca 0.19 0.95 0.00 0.00 0.00 0.00 0.00 51.96 53.10 3bqb s ALA 185 Cb -0.04 -3.75 0.00 0.00 0.00 0.00 0.00 23.12 19.33 3bqb s ALA 185 CO 0.08 -1.40 0.00 0.41 0.00 0.00 0.00 175.76 174.84 3bqb n GLY 186 N 4.15 0.36 0.12 0.00 0.00 -0.86 -4.44 105.19 104.51 3bqb n GLY 186 Ca 0.17 -0.84 0.13 0.00 0.00 0.00 0.00 46.02 45.49 3bqb n GLY 186 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bqb s ALA 189 N -0.17 -0.21 0.25 0.00 0.00 -1.00 -0.88 121.76 119.74 3bqb s ALA 189 Ca -0.00 -0.04 -0.19 0.00 0.00 0.00 0.00 51.96 51.73 3bqb s ALA 189 Cb -0.02 -0.01 0.02 0.00 0.00 0.00 0.00 23.12 23.12 3bqb s ALA 189 CO -0.00 -0.13 0.63 -0.59 0.00 0.00 0.00 175.76 175.67 3bqb s PHE 190 N -0.78 -0.12 0.00 0.00 -0.12 -0.95 -0.08 117.98 115.94 3bqb s PHE 190 Ca -0.09 -0.28 0.00 0.00 -0.05 0.00 0.00 56.93 56.51 3bqb s PHE 190 Cb -0.05 0.55 0.00 0.00 -0.63 0.00 0.00 43.02 42.88 3bqb s PHE 190 CO 0.00 -1.10 0.00 0.41 -0.05 0.00 0.00 175.22 174.49 3bqb n GLY 191 N -0.42 -0.21 0.11 1.99 0.00 -0.93 -4.02 105.19 101.71 3bqb n GLY 191 Ca -0.06 -2.04 0.12 0.00 0.00 0.00 0.00 46.02 44.03 3bqb n GLY 191 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3bqb n PRO 192 N 0.00 0.18 -4.37 1.61 -0.04 -1.26 -3.76 135.00 127.36 3bqb n PRO 192 Ca 0.00 0.36 -0.19 0.00 -0.04 0.00 0.00 63.50 63.63 3bqb n PRO 192 Cb 0.00 -1.81 -0.10 0.00 -0.04 0.00 0.00 33.50 31.55 3bqb n PRO 192 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3bqb s VAL 193 N -3.24 1.61 -0.22 0.52 -7.23 -1.26 -4.49 120.40 106.09 3bqb s VAL 193 Ca 0.06 -2.16 -0.04 0.00 -1.81 0.00 0.00 61.98 58.03 3bqb s VAL 193 Cb 0.10 -2.20 -0.01 0.00 0.56 0.00 0.00 36.38 34.83 3bqb s VAL 193 CO 0.42 -0.48 -0.03 -0.63 -0.31 0.00 0.00 175.10 174.08 3bqb s ILE 194 N -3.04 3.51 -0.05 -0.62 1.01 0.08 -4.55 121.20 117.54 3bqb s ILE 194 Ca 0.25 -0.44 -0.16 0.00 0.00 0.00 0.00 60.65 60.30 3bqb s ILE 194 Cb 0.02 -2.61 -0.05 0.00 0.01 0.00 0.00 42.46 39.83 3bqb s ILE 194 CO 0.08 0.41 0.43 0.68 0.00 0.00 0.00 174.94 176.55 3bqb s VAL 195 N 1.48 5.10 1.03 2.92 -7.23 0.07 0.16 120.40 123.93 3bqb s VAL 195 Ca 0.06 0.87 -0.12 0.00 -1.81 0.00 0.00 61.98 60.98 3bqb s VAL 195 Cb -0.14 -3.75 0.21 0.00 0.56 0.00 0.00 36.38 33.25 3bqb s VAL 195 CO -0.02 0.47 1.08 0.42 -0.31 0.00 0.00 175.10 176.73 3bqb s THR 196 N -0.31 2.17 0.16 5.32 -4.23 0.43 -0.04 115.64 119.15 3bqb s THR 196 Ca 0.24 0.06 -0.15 0.00 -1.18 0.00 0.00 61.69 60.66 3bqb s THR 196 Cb -0.16 -2.20 0.03 0.00 1.34 0.00 0.00 72.50 71.51 3bqb s THR 196 CO 0.12 -0.07 1.77 -1.28 -0.54 0.00 0.00 174.62 174.62 3bqb h SER 197 N -2.17 0.58 0.25 3.99 0.87 -1.90 -2.30 113.55 112.87 3bqb h SER 197 Ca -0.54 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 59.95 3bqb h SER 197 Cb 1.30 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 63.12 3bqb h SER 197 CO 0.49 0.49 0.00 -2.24 -0.53 0.00 0.00 176.83 175.03 3bqb h ASP 198 N 0.62 0.00 0.73 6.23 -0.00 -1.94 -2.00 116.42 120.05 3bqb h ASP 198 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.20 3bqb h ASP 198 Cb 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.36 3bqb h ASP 198 CO -0.03 0.00 0.00 -0.62 -0.00 0.00 0.00 179.24 178.59 3bqb n GLU 199 N -2.40 0.05 -3.82 4.15 -0.58 -0.86 -4.51 120.64 112.67 3bqb n GLU 199 Ca -0.01 0.21 -0.29 0.00 -0.42 0.00 0.00 57.16 56.66 3bqb n GLU 199 Cb 0.10 -1.57 -0.16 0.00 -0.57 0.00 0.00 31.44 29.24 3bqb n GLU 199 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 3bqb s ILE 200 N -3.05 0.92 0.11 -3.67 1.01 -0.75 -4.97 121.20 110.79 3bqb s ILE 200 Ca 0.09 -0.81 -0.06 0.00 0.00 0.00 0.00 60.65 59.87 3bqb s ILE 200 Cb 0.12 -1.32 -0.21 0.00 0.01 0.00 0.00 42.46 41.06 3bqb s ILE 200 CO 0.37 -0.16 1.26 0.11 0.00 0.00 0.00 174.94 176.53 3bqb h LYS 201 N 8.13 0.43 -3.25 2.79 1.79 -1.81 -3.43 116.57 121.23 3bqb h LYS 201 Ca -0.17 -0.50 -0.48 0.00 -2.18 0.00 0.00 60.65 57.33 3bqb h LYS 201 Cb 1.10 0.15 -0.40 0.00 -1.58 0.00 0.00 32.23 31.50 3bqb h LYS 201 CO 0.37 1.16 -0.76 1.21 -1.08 0.00 0.00 179.45 180.35 3bqb s ASN 202 N -7.13 2.50 0.33 0.86 2.47 -1.26 -5.00 114.94 107.71 3bqb s ASN 202 Ca -0.06 -0.66 0.26 0.00 0.42 0.00 0.00 52.86 52.82 3bqb s ASN 202 Cb 0.08 -0.37 0.96 0.00 -1.45 0.00 0.00 41.25 40.47 3bqb s ASN 202 CO 0.88 -0.33 1.78 1.55 -3.72 0.00 0.00 177.10 177.26 3bqb h PRO 203 N 8.35 0.00 -0.50 0.43 0.13 -1.99 -2.88 132.00 135.54 3bqb h PRO 203 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 3bqb h PRO 203 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3bqb h PRO 203 CO 0.30 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 178.73 3bqb n TYR 204 N -2.53 0.71 -3.39 1.56 4.02 -1.26 -4.24 117.16 112.02 3bqb n TYR 204 Ca 0.03 -0.31 -0.26 0.00 -0.01 0.00 0.00 57.90 57.34 3bqb n TYR 204 Cb 0.33 -0.08 -0.09 0.00 -0.02 0.00 0.00 39.34 39.47 3bqb n TYR 204 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 3bqb n SER 205 N 0.63 0.39 -3.81 7.72 2.88 -1.09 -1.31 113.62 119.04 3bqb n SER 205 Ca 0.14 -2.63 -0.13 0.00 -1.33 0.00 0.00 58.87 54.92 3bqb n SER 205 Cb 0.46 -0.61 -0.13 0.00 -0.75 0.00 0.00 64.21 63.18 3bqb n SER 205 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3bqb s LEU 206 N -0.65 1.36 -0.28 2.46 1.43 -1.26 -4.89 118.68 116.85 3bqb s LEU 206 Ca 0.33 0.27 -0.20 0.00 -1.03 0.00 0.00 54.13 53.51 3bqb s LEU 206 Cb 0.08 0.44 -0.02 0.00 0.03 0.00 0.00 46.19 46.72 3bqb s LEU 206 CO -0.16 -0.06 0.60 -1.81 0.23 0.00 0.00 176.35 175.15 3bqb s ASP 207 N 0.26 6.50 -0.19 2.29 1.01 -1.26 -1.21 116.67 124.06 3bqb s ASP 207 Ca -0.02 0.51 -0.05 0.00 0.71 0.00 0.00 52.55 53.70 3bqb s ASP 207 Cb -0.03 -2.32 -0.03 0.00 1.01 0.00 0.00 42.92 41.56 3bqb s ASP 207 CO -0.01 -0.40 0.01 -0.63 0.21 0.00 0.00 175.17 174.35 3bqb s ILE 208 N 2.50 4.16 -0.04 0.77 1.01 -0.62 -2.80 121.20 126.18 3bqb s ILE 208 Ca 0.24 -0.25 0.02 0.00 0.00 0.00 0.00 60.65 60.67 3bqb s ILE 208 Cb -0.15 -2.87 0.01 0.00 0.01 0.00 0.00 42.46 39.45 3bqb s ILE 208 CO 0.10 0.44 -0.09 -0.89 0.00 0.00 0.00 174.94 174.50 3bqb s THR 209 N 0.75 0.85 -0.24 2.92 2.01 0.07 -1.59 115.64 120.40 3bqb s THR 209 Ca 0.01 -0.37 0.02 0.00 0.31 0.00 0.00 61.69 61.66 3bqb s THR 209 Cb -0.14 -0.77 0.05 0.00 0.01 0.00 0.00 72.50 71.65 3bqb s THR 209 CO 0.02 0.27 -0.11 -0.22 -0.69 0.00 0.00 174.62 173.89 3bqb s LEU 210 N 0.37 2.97 -0.10 4.42 2.96 0.34 -0.96 118.68 128.68 3bqb s LEU 210 Ca -0.06 -1.20 -0.02 0.00 -0.22 0.00 0.00 54.13 52.63 3bqb s LEU 210 Cb -0.11 -1.43 -0.03 0.00 0.50 0.00 0.00 46.19 45.12 3bqb s LEU 210 CO 0.01 -0.17 -0.01 -0.54 -1.32 0.00 0.00 176.35 174.32 3bqb s LYS 211 N 1.22 3.09 -0.08 1.98 1.02 -0.49 -2.31 119.74 124.17 3bqb s LYS 211 Ca -0.06 -0.45 0.05 0.00 0.02 0.00 0.00 55.97 55.53 3bqb s LYS 211 Cb -0.18 -2.79 -0.00 0.00 -0.52 0.00 0.00 37.83 34.33 3bqb s LYS 211 CO -0.07 0.61 -0.23 0.42 -0.92 0.00 0.00 175.35 175.16 3bqb s ILE 212 N -0.63 1.96 -0.30 2.17 1.01 -0.35 -0.60 121.20 124.46 3bqb s ILE 212 Ca 0.10 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 59.78 3bqb s ILE 212 Cb -0.12 -1.68 0.07 0.00 0.01 0.00 0.00 42.46 40.74 3bqb s ILE 212 CO 0.02 0.54 -0.02 -0.69 0.00 0.00 0.00 174.94 174.79 3bqb s VAL 213 N 0.16 2.57 -0.13 2.92 1.01 -0.50 -0.25 120.40 126.19 3bqb s VAL 213 Ca -0.12 -1.68 -0.02 0.00 0.00 0.00 0.00 61.98 60.16 3bqb s VAL 213 Cb -0.16 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 3bqb s VAL 213 CO 0.06 -0.19 -0.06 -0.60 0.00 0.00 0.00 175.10 174.32 3bqb s ARG 214 N 1.13 3.36 -0.86 2.72 3.52 -0.23 -2.44 118.95 126.15 3bqb s ARG 214 Ca -0.04 -0.55 -0.23 0.00 -0.13 0.00 0.00 55.73 54.78 3bqb s ARG 214 Cb -0.20 -2.78 0.03 0.00 -1.56 0.00 0.00 34.95 30.45 3bqb s ARG 214 CO -0.04 0.36 0.49 0.39 -0.81 0.00 0.00 175.30 175.69 3bqb n GLU 215 N 3.14 -0.51 0.00 5.12 1.02 -1.26 -0.88 120.64 127.28 3bqb n GLU 215 Ca -0.18 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 56.94 3bqb n GLU 215 Cb 0.53 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 30.42 3bqb n GLU 215 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3bqb n GLY 216 N -1.74 3.01 3.54 0.62 0.00 -1.26 -4.99 105.19 104.37 3bqb n GLY 216 Ca -0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.64 3bqb n GLY 216 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3bqb s ARG 217 N -0.24 1.97 -0.32 1.61 1.81 -0.05 -5.06 118.95 118.66 3bqb s ARG 217 Ca 0.00 -1.24 -0.28 0.00 -1.72 0.00 0.00 55.73 52.49 3bqb s ARG 217 Cb 0.00 -2.14 -0.03 0.00 -0.45 0.00 0.00 34.95 32.33 3bqb s ARG 217 CO 0.00 0.45 1.91 0.08 -0.68 0.00 0.00 175.30 177.06 3bqb s VAL 218 N -1.52 3.35 -0.14 3.52 1.01 -1.26 -1.06 120.40 124.30 3bqb s VAL 218 Ca 0.23 0.35 0.18 0.00 0.00 0.00 0.00 61.98 62.73 3bqb s VAL 218 Cb -0.09 -3.49 -0.11 0.00 0.00 0.00 0.00 36.38 32.68 3bqb s VAL 218 CO 0.13 -0.33 0.87 0.15 0.00 0.00 0.00 175.10 175.93 3bqb h PHE 219 N 13.62 0.00 -2.43 5.22 3.04 -0.92 -3.47 116.94 132.00 3bqb h PHE 219 Ca -0.35 0.00 -0.09 0.00 3.98 0.00 0.00 57.97 61.52 3bqb h PHE 219 Cb 1.19 0.00 -0.23 0.00 2.56 0.00 0.00 35.95 39.47 3bqb h PHE 219 CO 0.96 0.48 -0.08 0.12 -2.02 0.00 0.00 178.31 177.77 3bqb s PHE 220 N -3.00 -0.59 0.06 0.41 5.36 -1.18 -4.99 117.98 114.06 3bqb s PHE 220 Ca -0.02 1.41 0.02 0.00 -0.96 0.00 0.00 56.93 57.38 3bqb s PHE 220 Cb 0.09 0.21 -0.03 0.00 -0.34 0.00 0.00 43.02 42.94 3bqb s PHE 220 CO 0.81 -0.30 -0.07 -2.00 -1.46 0.00 0.00 175.22 172.19 3bqb s GLU 221 N 0.20 0.65 0.00 10.12 2.12 -1.26 -1.21 118.70 129.32 3bqb s GLU 221 Ca -0.01 -0.99 0.00 0.00 0.36 0.00 0.00 54.97 54.33 3bqb s GLU 221 Cb -0.04 -0.26 0.00 0.00 0.26 0.00 0.00 34.13 34.10 3bqb s GLU 221 CO 0.01 0.02 0.00 0.41 -0.54 0.00 0.00 175.26 175.16 3bqb n GLY 222 N 0.85 1.32 3.53 -1.50 0.00 -0.98 -5.00 105.19 103.41 3bqb n GLY 222 Ca -0.18 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.36 3bqb n GLY 222 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3bqb s SER 223 N 0.00 0.34 -0.26 1.61 1.04 -1.26 -0.51 113.70 114.67 3bqb s SER 223 Ca 0.00 -1.21 -0.28 0.00 0.48 0.00 0.00 55.95 54.95 3bqb s SER 223 Cb 0.00 0.62 0.16 0.00 0.10 0.00 0.00 66.02 66.90 3bqb s SER 223 CO 0.00 -1.22 1.24 0.54 0.98 0.00 0.00 173.24 174.79 3bqb s VAL 224 N -3.53 0.00 0.34 5.02 0.11 -0.62 -4.97 120.40 116.75 3bqb s VAL 224 Ca 0.27 0.00 -0.05 0.00 -2.93 0.00 0.00 61.98 59.26 3bqb s VAL 224 Cb -0.00 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.80 3bqb s VAL 224 CO 0.14 0.00 0.62 0.21 -3.33 0.00 0.00 175.10 172.74 3bqb s ASN 225 N -0.57 6.42 0.00 3.54 3.84 -1.26 -1.59 114.94 125.32 3bqb s ASN 225 Ca 0.05 0.78 0.16 0.00 0.21 0.00 0.00 52.86 54.06 3bqb s ASN 225 Cb -0.03 -2.18 0.93 0.00 -0.55 0.00 0.00 41.25 39.43 3bqb s ASN 225 CO -0.07 -0.29 1.48 0.35 -2.79 0.00 0.00 177.10 175.77 3bqb n THR 226 N -1.28 0.00 0.59 -5.21 -2.24 -0.35 -2.41 114.28 103.37 3bqb n THR 226 Ca -0.01 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.89 3bqb n THR 226 Cb 0.54 -0.38 0.46 0.00 -2.10 0.00 0.00 70.33 68.85 3bqb n THR 226 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3bqb n ASN 227 N -0.79 0.55 -0.01 3.42 0.23 -0.43 -2.88 115.26 115.34 3bqb n ASN 227 Ca 0.12 0.59 0.14 0.00 -0.53 0.00 0.00 54.58 54.89 3bqb n ASN 227 Cb 0.05 -0.72 0.57 0.00 -2.08 0.00 0.00 39.78 37.60 3bqb n ASN 227 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3bqb n LYS 228 N -2.05 0.14 -2.32 -3.83 4.76 -1.01 -4.82 118.16 109.02 3bqb n LYS 228 Ca 0.04 -0.03 -0.43 0.00 -2.87 0.00 0.00 58.31 55.03 3bqb n LYS 228 Cb 0.32 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.98 3bqb n LYS 228 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 3bqb s MET 229 N -2.88 4.10 -0.22 1.97 1.75 -1.14 -4.00 119.30 118.89 3bqb s MET 229 Ca 0.17 1.65 -0.06 0.00 -1.25 0.00 0.00 55.69 56.20 3bqb s MET 229 Cb 0.19 -3.85 -0.19 0.00 2.84 0.00 0.00 34.83 33.81 3bqb s MET 229 CO 0.55 -0.89 -0.02 0.54 -0.65 0.00 0.00 175.02 174.55 3bqb n ARG 230 N 6.97 0.66 -2.22 4.11 5.12 0.56 -4.81 116.66 127.05 3bqb n ARG 230 Ca 0.15 0.25 -0.43 0.00 -1.93 0.00 0.00 57.85 55.90 3bqb n ARG 230 Cb 0.45 -1.60 -0.02 0.00 -1.16 0.00 0.00 32.46 30.13 3bqb n ARG 230 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 3bqb s ARG 231 N -2.51 3.75 0.46 5.56 6.06 -0.79 -4.99 118.95 126.48 3bqb s ARG 231 Ca -0.31 1.43 -0.22 0.00 -2.50 0.00 0.00 55.73 54.13 3bqb s ARG 231 Cb 0.09 -4.01 -0.08 0.00 0.06 0.00 0.00 34.95 31.01 3bqb s ARG 231 CO 0.63 -1.34 1.06 -1.59 -2.50 0.00 0.00 175.30 171.56 3bqb s LYS 232 N 4.67 3.91 0.12 5.12 -2.85 -1.26 -4.96 119.74 124.49 3bqb s LYS 232 Ca 0.67 1.46 -0.15 0.00 -1.00 0.00 0.00 55.97 56.95 3bqb s LYS 232 Cb -0.21 -2.28 -0.02 0.00 -2.06 0.00 0.00 37.83 33.26 3bqb s LYS 232 CO 0.28 -0.36 1.59 0.82 0.10 0.00 0.00 175.35 177.79 3bqb h ILE 233 N 1.79 1.25 -0.85 3.79 2.04 -1.98 -2.72 117.51 120.82 3bqb h ILE 233 Ca -0.49 -0.90 0.17 0.00 1.00 0.00 0.00 64.86 64.64 3bqb h ILE 233 Cb 1.22 1.08 -0.06 0.00 -0.74 0.00 0.00 36.82 38.31 3bqb h ILE 233 CO 0.60 0.31 0.56 -0.08 0.00 0.00 0.00 178.15 179.54 3bqb h GLU 234 N 0.50 0.48 -0.31 2.37 4.81 -1.99 -0.54 114.58 119.89 3bqb h GLU 234 Ca 0.12 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 59.21 3bqb h GLU 234 Cb 0.39 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 3bqb h GLU 234 CO 0.01 0.32 -0.24 1.49 -0.73 0.00 0.00 179.01 179.86 3bqb h GLU 235 N 0.50 0.71 -0.60 1.92 4.81 -1.88 -2.41 114.58 117.62 3bqb h GLU 235 Ca 0.43 -0.35 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 3bqb h GLU 235 Cb 0.94 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.29 3bqb h GLU 235 CO -0.17 0.96 0.31 1.96 -0.73 0.00 0.00 179.01 181.34 3bqb h GLN 236 N 0.46 0.83 -0.16 1.92 4.20 -0.95 -2.16 115.11 119.25 3bqb h GLN 236 Ca 0.06 -0.09 -0.15 0.00 0.06 0.00 0.00 58.65 58.53 3bqb h GLN 236 Cb 0.79 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 3bqb h GLN 236 CO 0.06 0.62 -0.53 0.82 -0.67 0.00 0.00 178.83 179.14 3bqb h ILE 237 N 0.84 1.33 -0.38 2.54 2.04 -1.21 -1.92 117.51 120.74 3bqb h ILE 237 Ca 0.21 -1.78 -0.01 0.00 1.00 0.00 0.00 64.86 64.28 3bqb h ILE 237 Cb 0.05 1.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 3bqb h ILE 237 CO -0.03 0.55 0.20 -0.61 0.00 0.00 0.00 178.15 178.26 3bqb h GLN 238 N 0.35 0.54 0.00 2.37 4.15 -0.88 -2.24 115.11 119.40 3bqb h GLN 238 Ca 0.01 -0.07 -0.14 0.00 0.77 0.00 0.00 58.65 59.22 3bqb h GLN 238 Cb 1.04 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.61 3bqb h GLN 238 CO 0.09 0.45 -0.67 1.88 -1.93 0.00 0.00 178.83 178.65 3bqb h TYR 239 N 0.49 0.00 0.22 3.99 -1.99 -1.42 -2.77 116.97 115.48 3bqb h TYR 239 Ca 0.13 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.85 3bqb h TYR 239 Cb 0.08 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.81 3bqb h TYR 239 CO -0.02 0.67 -0.11 1.25 -0.00 0.00 0.00 178.16 179.95 3bqb h LEU 240 N 0.00 -0.25 -0.70 3.88 5.85 -1.17 -3.22 115.31 119.69 3bqb h LEU 240 Ca -0.01 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.66 3bqb h LEU 240 Cb 1.23 0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.32 3bqb h LEU 240 CO 0.09 -0.11 0.00 2.30 -0.34 0.00 0.00 178.44 180.38 3bqb n ILE 241 N -5.18 0.04 -2.00 4.05 -5.35 -0.86 -4.63 119.36 105.43 3bqb n ILE 241 Ca -0.09 -0.19 -0.43 0.00 -0.27 0.00 0.00 62.75 61.77 3bqb n ILE 241 Cb 0.17 0.19 -0.03 0.00 -1.74 0.00 0.00 39.64 38.23 3bqb n ILE 241 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 3bqb s ARG 242 N -1.96 3.81 -1.50 6.28 3.52 -1.05 -2.32 118.95 125.74 3bqb s ARG 242 Ca 0.39 1.87 0.00 0.00 -0.13 0.00 0.00 55.73 57.86 3bqb s ARG 242 Cb 0.20 -4.08 0.00 0.00 -1.56 0.00 0.00 34.95 29.51 3bqb s ARG 242 CO 0.32 -1.28 0.00 -0.25 -0.81 0.00 0.00 175.30 173.28 3bqb n ASP 243 N 8.51 -4.32 -3.28 -2.12 10.43 -1.26 -4.88 116.55 119.63 3bqb n ASP 243 Ca 0.20 0.26 -0.20 0.00 2.57 0.00 0.00 54.79 57.63 3bqb n ASP 243 Cb 0.44 -3.80 -0.07 0.00 1.84 0.00 0.00 41.12 39.53 3bqb n ASP 243 CO 0.00 0.00 0.00 0.21 -1.07 0.00 0.00 177.20 176.34 3bqb s ASN 244 N -2.19 0.96 0.29 -2.24 2.47 -0.98 -5.13 114.94 108.13 3bqb s ASN 244 Ca 0.00 -2.25 -0.29 0.00 0.42 0.00 0.00 52.86 50.74 3bqb s ASN 244 Cb 0.00 0.32 -0.10 0.00 -1.45 0.00 0.00 41.25 40.03 3bqb s ASN 244 CO 0.00 -0.19 1.27 -2.16 -3.72 0.00 0.00 177.10 172.30 3bqb s PRO 245 N 0.76 4.42 0.05 0.43 0.04 -1.26 -4.28 135.00 135.15 3bqb s PRO 245 Ca 0.26 2.10 0.09 0.00 0.04 0.00 0.00 61.00 63.49 3bqb s PRO 245 Cb -0.06 -3.12 -0.03 0.00 0.04 0.00 0.00 34.50 31.33 3bqb s PRO 245 CO -0.09 -0.12 -0.24 0.96 0.04 0.00 0.00 177.00 177.54 3bqb s ILE 246 N -0.88 2.33 0.80 0.56 -4.36 -1.26 -5.09 121.20 113.29 3bqb s ILE 246 Ca 0.50 -1.38 -0.11 0.00 -0.26 0.00 0.00 60.65 59.39 3bqb s ILE 246 Cb -0.38 -1.94 0.07 0.00 1.25 0.00 0.00 42.46 41.46 3bqb s ILE 246 CO 0.47 0.33 1.09 -2.16 0.24 0.00 0.00 174.94 174.91 3bqb s PRO 247 N -1.39 2.09 0.19 0.37 0.04 -1.26 -4.11 135.00 130.93 3bqb s PRO 247 Ca 0.13 0.73 -0.31 0.00 0.04 0.00 0.00 61.00 61.59 3bqb s PRO 247 Cb -0.10 -1.91 -0.10 0.00 0.04 0.00 0.00 34.50 32.43 3bqb s PRO 247 CO 0.03 -1.64 1.49 -0.51 0.04 0.00 0.00 177.00 176.41 3bqb s ASP 248 N -3.80 6.65 0.00 6.66 1.01 -1.26 -2.81 116.67 123.12 3bqb s ASP 248 Ca 0.61 2.59 0.00 0.00 0.71 0.00 0.00 52.55 56.46 3bqb s ASP 248 Cb -0.15 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.18 3bqb s ASP 248 CO 0.55 -0.75 0.00 0.61 0.21 0.00 0.00 175.17 175.79 3bqb n GLY 249 N 3.07 0.84 3.77 0.21 0.00 0.08 -4.71 105.19 108.44 3bqb n GLY 249 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 3bqb n GLY 249 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3bqb s THR 250 N -2.08 2.63 -0.12 2.61 2.01 -1.12 -4.25 115.64 115.32 3bqb s THR 250 Ca 0.00 0.62 -0.03 0.00 0.31 0.00 0.00 61.69 62.59 3bqb s THR 250 Cb 0.00 -3.40 -0.03 0.00 0.01 0.00 0.00 72.50 69.08 3bqb s THR 250 CO 0.00 0.14 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.44 3bqb s ILE 251 N -1.02 4.21 -0.23 1.82 1.01 -0.87 0.45 121.20 126.56 3bqb s ILE 251 Ca 0.50 -0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.89 3bqb s ILE 251 Cb -0.41 -2.81 0.03 0.00 0.01 0.00 0.00 42.46 39.29 3bqb s ILE 251 CO 0.53 0.55 -0.11 -0.22 0.00 0.00 0.00 174.94 175.69 3bqb s LEU 252 N -0.30 2.98 -0.00 2.97 2.96 -0.07 -0.93 118.68 126.29 3bqb s LEU 252 Ca 0.06 -0.96 -0.16 0.00 -0.22 0.00 0.00 54.13 52.85 3bqb s LEU 252 Cb -0.12 -1.58 -0.06 0.00 0.50 0.00 0.00 46.19 44.93 3bqb s LEU 252 CO 0.02 -0.11 0.45 0.28 -1.32 0.00 0.00 176.35 175.67 3bqb s THR 253 N 1.25 4.99 -0.36 3.68 -1.32 -0.37 -0.88 115.64 122.63 3bqb s THR 253 Ca -0.01 0.92 0.07 0.00 -1.21 0.00 0.00 61.69 61.46 3bqb s THR 253 Cb -0.17 -3.76 0.57 0.00 -1.51 0.00 0.00 72.50 67.64 3bqb s THR 253 CO -0.07 0.54 1.65 0.35 -2.21 0.00 0.00 174.62 174.89 3bqb n THR 254 N 2.02 2.83 0.00 5.08 -2.24 -0.56 -1.64 114.28 119.77 3bqb n THR 254 Ca -0.12 -2.44 0.00 0.00 -2.27 0.00 0.00 64.05 59.22 3bqb n THR 254 Cb 0.52 -0.39 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 3bqb n THR 254 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3bqb n GLY 255 N -1.14 -2.00 3.59 3.38 0.00 -0.78 -4.66 105.19 103.59 3bqb n GLY 255 Ca 0.44 -1.50 -0.29 0.00 0.00 0.00 0.00 46.02 44.67 3bqb n GLY 255 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3bqb s THR 256 N -3.03 3.41 -0.04 2.61 -1.32 -1.26 -4.41 115.64 111.60 3bqb s THR 256 Ca 0.00 -1.35 0.16 0.00 -1.21 0.00 0.00 61.69 59.29 3bqb s THR 256 Cb 0.00 -2.63 -0.25 0.00 -1.51 0.00 0.00 72.50 68.11 3bqb s THR 256 CO 0.00 0.04 0.31 0.00 -2.21 0.00 0.00 174.62 172.76 3bqb n ALA 257 N 0.45 2.44 -2.67 11.08 0.00 -1.26 -4.64 120.51 125.91 3bqb n ALA 257 Ca -0.12 -0.50 -0.38 0.00 0.00 0.00 0.00 53.44 52.43 3bqb n ALA 257 Cb 0.53 -0.49 -0.07 0.00 0.00 0.00 0.00 19.45 19.43 3bqb n ALA 257 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3bqb s ILE 258 N -3.02 5.17 -0.30 0.00 1.01 -1.26 -5.03 121.20 117.76 3bqb s ILE 258 Ca -0.06 0.79 -0.02 0.00 0.00 0.00 0.00 60.65 61.36 3bqb s ILE 258 Cb 0.10 -3.77 0.12 0.00 0.01 0.00 0.00 42.46 38.92 3bqb s ILE 258 CO 0.68 0.24 0.19 -0.69 0.00 0.00 0.00 174.94 175.35 3bqb s VAL 259 N 1.36 -0.12 1.15 2.92 1.01 -1.26 -4.67 120.40 120.77 3bqb s VAL 259 Ca 0.21 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 61.20 3bqb s VAL 259 Cb -0.15 -0.99 0.23 0.00 0.00 0.00 0.00 36.38 35.47 3bqb s VAL 259 CO 0.09 -0.70 0.73 -2.65 0.00 0.00 0.00 175.10 172.56 3bqb n PRO 260 N 5.04 -2.12 -1.82 2.72 -0.02 -1.26 -5.04 135.00 132.50 3bqb n PRO 260 Ca -0.02 -0.59 -0.18 0.00 -2.02 0.00 0.00 63.50 60.70 3bqb n PRO 260 Cb 0.42 -2.04 0.10 0.00 -0.02 0.00 0.00 33.50 31.96 3bqb n PRO 260 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3bqb n GLY 261 N 1.28 0.09 0.30 -1.23 0.00 -1.26 -4.94 105.19 99.42 3bqb n GLY 261 Ca 0.03 -1.92 0.07 0.00 0.00 0.00 0.00 46.02 44.20 3bqb n GLY 261 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3bqb h ARG 262 N 0.00 0.34 0.00 1.61 2.47 -2.02 -2.43 114.38 114.35 3bqb h ARG 262 Ca -0.26 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.44 3bqb h ARG 262 Cb 0.87 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 29.11 3bqb h ARG 262 CO 0.24 0.23 0.00 0.38 0.56 0.00 0.00 179.97 181.38 3bqb h ASP 263 N 0.35 0.00 -0.92 7.04 -0.00 -1.99 -3.36 116.42 117.55 3bqb h ASP 263 Ca 0.13 0.00 -0.53 0.00 -0.00 0.00 0.00 57.03 56.63 3bqb h ASP 263 Cb 0.09 0.00 -0.22 0.00 -0.00 0.00 0.00 39.33 39.20 3bqb h ASP 263 CO -0.03 0.00 0.66 0.29 -0.00 0.00 0.00 179.24 180.17 3bqb n LYS 264 N -2.96 2.33 -2.66 4.15 4.76 -0.92 -4.97 118.16 117.89 3bqb n LYS 264 Ca 0.03 -2.55 -0.41 0.00 -2.87 0.00 0.00 58.31 52.51 3bqb n LYS 264 Cb 0.46 -2.02 -0.04 0.00 -1.84 0.00 0.00 35.03 31.60 3bqb n LYS 264 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3bqb s GLY 265 N -0.72 2.92 0.68 0.72 0.00 -1.26 -4.85 107.32 104.81 3bqb s GLY 265 Ca 0.50 0.64 -0.17 0.00 0.00 0.00 0.00 44.72 45.69 3bqb s GLY 265 CO -0.08 1.57 1.00 1.04 0.00 0.00 0.00 173.10 176.63 3bqb n LEU 266 N 2.95 3.83 -3.95 0.66 4.32 0.18 -4.87 117.00 120.12 3bqb n LEU 266 Ca 0.03 0.72 -0.09 0.00 -0.02 0.00 0.00 56.01 56.65 3bqb n LEU 266 Cb 0.49 -1.42 -0.03 0.00 -1.62 0.00 0.00 43.42 40.84 3bqb n LEU 266 CO 0.52 -1.89 0.30 -1.59 -1.22 0.00 0.00 177.39 173.51 3bqb s LYS 267 N -3.16 1.78 0.26 3.23 -2.85 -1.26 -4.67 119.74 113.07 3bqb s LYS 267 Ca 0.75 -1.31 -0.29 0.00 -1.00 0.00 0.00 55.97 54.13 3bqb s LYS 267 Cb -0.37 0.52 -0.14 0.00 -2.06 0.00 0.00 37.83 35.78 3bqb s LYS 267 CO 0.48 -0.78 1.01 -3.47 0.10 0.00 0.00 175.35 172.69 3bqb n ASP 268 N -0.74 1.15 0.00 0.03 4.64 -1.26 -2.12 116.55 118.25 3bqb n ASP 268 Ca -0.03 1.17 0.00 0.00 -1.38 0.00 0.00 54.79 54.55 3bqb n ASP 268 Cb 0.61 -1.25 0.00 0.00 -1.04 0.00 0.00 41.12 39.43 3bqb n ASP 268 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 3bqb n GLU 269 N 0.93 -0.04 -1.05 -0.67 -0.58 -0.74 -5.00 120.64 113.50 3bqb n GLU 269 Ca 0.11 0.01 -0.29 0.00 -0.42 0.00 0.00 57.16 56.57 3bqb n GLU 269 Cb 0.30 -2.89 0.19 0.00 -0.57 0.00 0.00 31.44 28.47 3bqb n GLU 269 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3bqb s ASP 270 N -2.74 2.36 -0.02 1.62 1.01 -0.90 -4.77 116.67 113.22 3bqb s ASP 270 Ca 0.00 1.29 0.03 0.00 0.71 0.00 0.00 52.55 54.57 3bqb s ASP 270 Cb 0.00 -1.97 -0.00 0.00 1.01 0.00 0.00 42.92 41.95 3bqb s ASP 270 CO 0.00 -3.31 -0.10 -0.63 0.21 0.00 0.00 175.17 171.34 3bqb s ILE 271 N -2.86 0.81 -0.25 0.77 -1.09 -1.02 -1.72 121.20 115.82 3bqb s ILE 271 Ca 0.66 -0.40 0.00 0.00 -2.23 0.00 0.00 60.65 58.68 3bqb s ILE 271 Cb -0.20 -0.70 0.04 0.00 -1.58 0.00 0.00 42.46 40.02 3bqb s ILE 271 CO 0.59 0.24 -0.08 -0.69 -1.23 0.00 0.00 174.94 173.77 3bqb s VAL 272 N 0.00 2.59 -0.16 2.92 1.01 -0.52 -1.41 120.40 124.83 3bqb s VAL 272 Ca -0.00 -1.27 -0.07 0.00 0.00 0.00 0.00 61.98 60.63 3bqb s VAL 272 Cb -0.07 -2.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.88 3bqb s VAL 272 CO 0.00 0.11 0.09 -1.61 0.00 0.00 0.00 175.10 173.69 3bqb s GLU 273 N 1.24 3.80 -0.04 2.72 2.02 0.23 -2.04 118.70 126.62 3bqb s GLU 273 Ca -0.03 -0.27 0.01 0.00 0.02 0.00 0.00 54.97 54.70 3bqb s GLU 273 Cb -0.18 -3.22 0.02 0.00 0.10 0.00 0.00 34.13 30.86 3bqb s GLU 273 CO -0.05 0.45 -0.05 0.42 0.02 0.00 0.00 175.26 176.05 3bqb s ILE 274 N -0.11 0.54 -0.03 -1.63 1.01 -0.30 -1.40 121.20 119.29 3bqb s ILE 274 Ca 0.08 -0.13 0.06 0.00 0.00 0.00 0.00 60.65 60.66 3bqb s ILE 274 Cb -0.12 -0.56 -0.01 0.00 0.01 0.00 0.00 42.46 41.78 3bqb s ILE 274 CO 0.01 0.22 -0.20 -0.89 0.00 0.00 0.00 174.94 174.08 3bqb s THR 275 N 0.90 1.62 -0.01 2.92 2.01 -0.13 -0.22 115.64 122.73 3bqb s THR 275 Ca -0.11 -0.85 0.01 0.00 0.31 0.00 0.00 61.69 61.04 3bqb s THR 275 Cb -0.14 -1.37 0.01 0.00 0.01 0.00 0.00 72.50 71.01 3bqb s THR 275 CO 0.00 0.46 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.74 3bqb s ILE 276 N -0.24 0.25 0.20 1.82 1.01 -0.82 -0.75 121.20 122.66 3bqb s ILE 276 Ca 0.02 -0.06 -0.32 0.00 0.00 0.00 0.00 60.65 60.28 3bqb s ILE 276 Cb -0.10 -0.26 -0.14 0.00 0.01 0.00 0.00 42.46 41.96 3bqb s ILE 276 CO 0.01 0.11 1.33 -1.20 0.00 0.00 0.00 174.94 175.18 3bqb n SER 277 N 3.46 2.18 0.00 3.58 7.64 -1.12 -2.23 113.62 127.13 3bqb n SER 277 Ca -0.19 1.14 0.00 0.00 1.01 0.00 0.00 58.87 60.83 3bqb n SER 277 Cb 0.55 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.42 3bqb n SER 277 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3bqb n ASN 278 N 2.24 0.00 -0.03 6.43 3.02 -1.26 -4.74 115.26 120.93 3bqb n ASN 278 Ca 0.14 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.67 3bqb n ASN 278 Cb 0.28 -0.35 -0.01 0.00 -0.61 0.00 0.00 39.78 39.09 3bqb n ASN 278 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3bqb n ILE 279 N -1.89 0.46 0.00 2.41 5.41 -0.95 -4.98 119.36 119.81 3bqb n ILE 279 Ca 0.00 0.40 0.00 0.00 1.00 0.00 0.00 62.75 64.15 3bqb n ILE 279 Cb 0.00 -1.77 0.00 0.00 -0.71 0.00 0.00 39.64 37.16 3bqb n ILE 279 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3bqb n GLY 280 N 1.58 0.07 2.95 7.39 0.00 -0.99 -4.83 105.19 111.35 3bqb n GLY 280 Ca -0.03 -1.09 -0.24 0.00 0.00 0.00 0.00 46.02 44.65 3bqb n GLY 280 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3bqb s THR 281 N -4.00 0.93 -0.20 2.61 2.01 -1.26 -1.95 115.64 113.78 3bqb s THR 281 Ca 0.00 -0.32 -0.09 0.00 0.31 0.00 0.00 61.69 61.60 3bqb s THR 281 Cb 0.00 -0.91 -0.04 0.00 0.01 0.00 0.00 72.50 71.55 3bqb s THR 281 CO 0.00 0.33 0.10 -0.22 -0.69 0.00 0.00 174.62 174.13 3bqb s LEU 282 N 1.09 3.95 -0.08 4.42 2.96 0.69 -4.53 118.68 127.18 3bqb s LEU 282 Ca -0.07 0.11 0.03 0.00 -0.22 0.00 0.00 54.13 53.98 3bqb s LEU 282 Cb -0.14 -2.02 0.00 0.00 0.50 0.00 0.00 46.19 44.53 3bqb s LEU 282 CO -0.01 0.14 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.35 3bqb s ILE 283 N 0.57 1.63 -0.05 6.68 1.01 -1.26 -1.14 121.20 128.63 3bqb s ILE 283 Ca 0.05 -0.78 -0.02 0.00 0.00 0.00 0.00 60.65 59.91 3bqb s ILE 283 Cb -0.12 -1.42 0.04 0.00 0.01 0.00 0.00 42.46 40.96 3bqb s ILE 283 CO 0.01 0.46 0.10 0.42 0.00 0.00 0.00 174.94 175.92 3bqb s THR 284 N 0.41 -0.08 1.11 2.92 -4.23 -0.87 -0.40 115.64 114.51 3bqb s THR 284 Ca -0.15 0.23 -0.13 0.00 -1.18 0.00 0.00 61.69 60.47 3bqb s THR 284 Cb -0.16 -0.18 0.25 0.00 1.34 0.00 0.00 72.50 73.75 3bqb s THR 284 CO 0.06 0.10 1.05 -2.16 -0.54 0.00 0.00 174.62 173.12 3bqb s PRO 285 N 1.32 -0.48 -0.11 3.99 0.04 -1.25 -1.43 135.00 137.07 3bqb s PRO 285 Ca -0.07 0.74 0.02 0.00 0.04 0.00 0.00 61.00 61.73 3bqb s PRO 285 Cb -0.12 -1.61 0.01 0.00 0.04 0.00 0.00 34.50 32.82 3bqb s PRO 285 CO -0.05 -3.41 -0.16 0.08 0.04 0.00 0.00 177.00 173.51 3bqb s VAL 286 N -2.63 1.56 -0.11 -0.36 1.01 -0.70 -1.67 120.40 117.50 3bqb s VAL 286 Ca 0.67 -0.69 -0.00 0.00 0.00 0.00 0.00 61.98 61.96 3bqb s VAL 286 Cb -0.23 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.71 3bqb s VAL 286 CO 0.62 0.45 -0.11 -0.75 0.00 0.00 0.00 175.10 175.31 3bqb s LYS 287 N 0.90 3.23 -0.22 2.72 2.47 -0.25 -1.79 119.74 126.80 3bqb s LYS 287 Ca -0.08 -0.65 -0.12 0.00 -1.56 0.00 0.00 55.97 53.57 3bqb s LYS 287 Cb -0.15 -2.63 -0.05 0.00 -1.46 0.00 0.00 37.83 33.54 3bqb s LYS 287 CO -0.01 0.33 0.22 0.21 0.16 0.00 0.00 175.35 176.26 3bqb s LYS 288 N 0.06 4.13 0.34 4.03 2.47 -1.26 -0.41 119.74 129.10 3bqb s LYS 288 Ca -0.04 -0.13 -0.26 0.00 -1.56 0.00 0.00 55.97 53.97 3bqb s LYS 288 Cb -0.14 -3.51 -0.09 0.00 -1.46 0.00 0.00 37.83 32.62 3bqb s LYS 288 CO 0.04 0.09 1.03 1.03 0.16 0.00 0.00 175.35 177.71 3bqb s ARG 289 N 0.95 4.41 0.71 4.03 1.81 -0.66 -4.95 118.95 125.25 3bqb s ARG 289 Ca 0.11 1.55 -0.02 0.00 -1.72 0.00 0.00 55.73 55.65 3bqb s ARG 289 Cb -0.13 -2.81 0.12 0.00 -0.45 0.00 0.00 34.95 31.68 3bqb s ARG 289 CO 0.04 0.07 0.99 0.50 -0.68 0.00 0.00 175.30 176.22 3bqb s ARG 290 N -2.05 1.74 0.00 3.54 3.52 -1.26 -4.01 118.95 120.43 3bqb s ARG 290 Ca 0.52 -1.01 0.02 0.00 -0.13 0.00 0.00 55.73 55.13 3bqb s ARG 290 Cb -0.24 -2.32 0.01 0.00 -1.56 0.00 0.00 34.95 30.84 3bqb s ARG 290 CO 0.31 -1.41 0.55 1.63 -0.81 0.00 0.00 175.30 175.56