#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 2.64 -0.18 2.12 1.02 -0.72 -0.85 119.74 123.77 3bqb s LYS 2 Ca 0.00 -0.74 -0.05 0.00 0.02 0.00 0.00 55.97 55.20 3bqb s LYS 2 Cb 0.00 -2.05 -0.03 0.00 -0.52 0.00 0.00 37.83 35.23 3bqb s LYS 2 CO 0.00 0.11 -0.00 -1.17 -0.92 0.00 0.00 175.35 173.37 3bqb s LEU 3 N 0.49 3.38 0.22 3.17 2.96 0.12 -1.31 118.68 127.71 3bqb s LEU 3 Ca -0.16 -0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.65 3bqb s LEU 3 Cb -0.17 -1.84 -0.05 0.00 0.50 0.00 0.00 46.19 44.63 3bqb s LEU 3 CO 0.06 0.13 0.06 0.72 -1.32 0.00 0.00 176.35 176.00 3bqb s PHE 4 N 0.62 1.39 -0.03 5.38 -0.71 -0.40 -0.41 117.98 123.81 3bqb s PHE 4 Ca -0.00 -1.12 -0.04 0.00 -1.04 0.00 0.00 56.93 54.73 3bqb s PHE 4 Cb -0.14 -0.80 0.01 0.00 -1.21 0.00 0.00 43.02 40.88 3bqb s PHE 4 CO 0.02 -0.29 0.11 0.50 -1.34 0.00 0.00 175.22 174.22 3bqb s ARG 5 N -3.99 0.21 0.28 1.99 3.52 -1.26 -0.82 118.95 118.88 3bqb s ARG 5 Ca 0.32 0.02 0.10 0.00 -0.13 0.00 0.00 55.73 56.04 3bqb s ARG 5 Cb 0.07 0.09 -0.05 0.00 -1.56 0.00 0.00 34.95 33.50 3bqb s ARG 5 CO 0.09 -0.04 -0.15 0.14 -0.81 0.00 0.00 175.30 174.54 3bqb s VAL 6 N -0.29 2.21 -0.07 7.11 -7.23 -0.37 -1.82 120.40 119.94 3bqb s VAL 6 Ca -0.04 -2.30 0.01 0.00 -1.81 0.00 0.00 61.98 57.84 3bqb s VAL 6 Cb -0.03 -2.34 -0.03 0.00 0.56 0.00 0.00 36.38 34.55 3bqb s VAL 6 CO 0.00 -0.39 -0.08 0.54 -0.31 0.00 0.00 175.10 174.87 3bqb s VAL 7 N -2.67 3.59 -0.25 1.32 0.11 0.14 -2.02 120.40 120.62 3bqb s VAL 7 Ca 0.29 -0.52 -0.02 0.00 -2.93 0.00 0.00 61.98 58.80 3bqb s VAL 7 Cb -0.02 -2.47 0.13 0.00 -1.53 0.00 0.00 36.38 32.50 3bqb s VAL 7 CO 0.13 0.59 0.36 -0.75 -3.33 0.00 0.00 175.10 172.10 3bqb s LYS 8 N -0.66 0.34 -1.42 1.54 2.20 0.07 -1.62 119.74 120.19 3bqb s LYS 8 Ca 0.10 0.40 -0.10 0.00 -0.36 0.00 0.00 55.97 56.01 3bqb s LYS 8 Cb -0.11 -0.55 0.03 0.00 -1.51 0.00 0.00 37.83 35.68 3bqb s LYS 8 CO 0.02 -0.72 1.07 0.54 -0.36 0.00 0.00 175.35 175.90 3bqb n ARG 9 N 5.35 -7.01 -0.68 4.03 1.74 -1.26 -2.22 116.66 116.62 3bqb n ARG 9 Ca -0.03 0.77 0.00 0.00 -0.77 0.00 0.00 57.85 57.82 3bqb n ARG 9 Cb 0.50 -5.76 0.00 0.00 -1.02 0.00 0.00 32.46 26.17 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 -1.88 1.51 3.52 -0.13 0.00 -1.26 -5.03 105.19 101.93 3bqb n GLY 10 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 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 -3.63 2.40 0.06 1.61 1.13 -0.94 -5.14 117.35 112.84 3bqb s TYR 11 Ca 0.00 -0.30 -0.07 0.00 -1.41 0.00 0.00 57.07 55.28 3bqb s TYR 11 Cb 0.00 -1.05 -0.05 0.00 -1.10 0.00 0.00 41.96 39.76 3bqb s TYR 11 CO 0.00 0.69 0.33 0.71 -2.51 0.00 0.00 175.55 174.77 3bqb s TYR 12 N -2.46 3.56 -0.04 -3.49 4.12 -1.26 -0.75 117.35 117.03 3bqb s TYR 12 Ca 0.30 0.64 0.03 0.00 0.02 0.00 0.00 57.07 58.06 3bqb s TYR 12 Cb -0.05 -2.05 0.01 0.00 -1.52 0.00 0.00 41.96 38.35 3bqb s TYR 12 CO 0.16 0.55 -0.10 0.42 0.02 0.00 0.00 175.55 176.60 3bqb s ILE 13 N -1.40 0.91 -0.03 2.71 1.01 -0.86 -4.97 121.20 118.58 3bqb s ILE 13 Ca 0.32 -0.41 -0.01 0.00 0.00 0.00 0.00 60.65 60.55 3bqb s ILE 13 Cb -0.13 -0.81 -0.04 0.00 0.01 0.00 0.00 42.46 41.49 3bqb s ILE 13 CO 0.19 0.28 0.06 -0.44 0.00 0.00 0.00 174.94 175.03 3bqb s SER 14 N 0.29 5.57 0.06 3.58 0.01 -1.26 -1.24 113.70 120.71 3bqb s SER 14 Ca -0.05 0.14 0.05 0.00 1.31 0.00 0.00 55.95 57.39 3bqb s SER 14 Cb -0.10 -1.59 -0.03 0.00 0.21 0.00 0.00 66.02 64.51 3bqb s SER 14 CO 0.01 0.30 -0.13 -0.31 0.41 0.00 0.00 173.24 173.52 3bqb s TYR 15 N -1.12 1.11 -0.31 2.43 2.02 -0.00 -2.02 117.35 119.46 3bqb s TYR 15 Ca 0.20 -0.46 0.02 0.00 -0.37 0.00 0.00 57.07 56.46 3bqb s TYR 15 Cb -0.12 -0.63 0.09 0.00 -0.40 0.00 0.00 41.96 40.90 3bqb s TYR 15 CO 0.11 0.03 0.05 0.00 -1.57 0.00 0.00 175.55 174.16 3bqb s ALA 16 N -1.26 2.21 -0.35 3.71 0.00 0.13 -1.27 121.76 124.93 3bqb s ALA 16 Ca -0.03 -1.99 -0.29 0.00 0.00 0.00 0.00 51.96 49.65 3bqb s ALA 16 Cb -0.10 -1.74 0.01 0.00 0.00 0.00 0.00 23.12 21.30 3bqb s ALA 16 CO 0.02 -1.58 1.22 -1.50 0.00 0.00 0.00 175.76 173.92 3bqb s ILE 17 N 1.26 4.22 0.83 0.00 2.07 -0.43 -1.35 121.20 127.80 3bqb s ILE 17 Ca 0.07 1.35 -0.12 0.00 -1.41 0.00 0.00 60.65 60.54 3bqb s ILE 17 Cb -0.18 -4.32 0.10 0.00 0.13 0.00 0.00 42.46 38.18 3bqb s ILE 17 CO -0.14 -0.62 1.20 -0.76 -1.91 0.00 0.00 174.94 172.71 3bqb s LEU 18 N 4.32 2.53 0.30 8.50 1.02 0.24 -1.75 118.68 133.84 3bqb s LEU 18 Ca 0.52 0.71 0.02 0.00 0.02 0.00 0.00 54.13 55.40 3bqb s LEU 18 Cb -0.13 -3.14 0.48 0.00 0.02 0.00 0.00 46.19 43.42 3bqb s LEU 18 CO 0.24 -2.02 1.80 0.44 0.02 0.00 0.00 176.35 176.83 3bqb h ASP 19 N -1.13 0.54 -0.01 2.29 5.19 -1.96 -1.41 116.42 119.93 3bqb h ASP 19 Ca -0.46 -0.14 -0.01 0.00 -0.62 0.00 0.00 57.03 55.81 3bqb h ASP 19 Cb 1.32 -0.14 -0.00 0.00 0.18 0.00 0.00 39.33 40.68 3bqb h ASP 19 CO 0.62 0.67 0.01 -0.46 -3.12 0.00 0.00 179.24 176.96 3bqb n ASN 20 N -4.21 3.16 -1.24 6.45 6.94 -1.26 -4.83 115.26 120.27 3bqb n ASN 20 Ca 0.01 -2.05 -0.13 0.00 -0.02 0.00 0.00 54.58 52.39 3bqb n ASN 20 Cb 0.31 -0.54 -0.06 0.00 -2.36 0.00 0.00 39.78 37.13 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 0.54 -4.23 -4.75 0.53 7.64 -0.53 -4.95 113.62 107.88 3bqb n SER 21 Ca 0.01 0.33 -0.39 0.00 1.01 0.00 0.00 58.87 59.83 3bqb n SER 21 Cb 0.51 -3.65 -0.05 0.00 -1.01 0.00 0.00 64.21 60.01 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 -2.11 4.87 -0.20 0.44 -4.23 -1.25 -4.87 115.64 108.29 3bqb s THR 22 Ca 0.00 1.43 -0.11 0.00 -1.18 0.00 0.00 61.69 61.83 3bqb s THR 22 Cb 0.00 -4.02 -0.05 0.00 1.34 0.00 0.00 72.50 69.77 3bqb s THR 22 CO 0.00 0.37 0.17 -0.63 -0.54 0.00 0.00 174.62 173.99 3bqb s ILE 23 N 0.05 5.37 -0.08 2.99 1.01 -1.26 -0.60 121.20 128.69 3bqb s ILE 23 Ca 0.35 0.26 0.02 0.00 0.00 0.00 0.00 60.65 61.28 3bqb s ILE 23 Cb -0.19 -3.51 -0.02 0.00 0.01 0.00 0.00 42.46 38.75 3bqb s ILE 23 CO 0.19 0.40 -0.13 -0.63 0.00 0.00 0.00 174.94 174.78 3bqb s ILE 24 N 0.58 3.17 -0.24 2.92 1.01 -0.46 -0.65 121.20 127.53 3bqb s ILE 24 Ca 0.10 -0.66 -0.16 0.00 0.00 0.00 0.00 60.65 59.93 3bqb s ILE 24 Cb -0.12 -2.29 -0.04 0.00 0.01 0.00 0.00 42.46 40.03 3bqb s ILE 24 CO 0.01 0.57 0.42 -0.60 0.00 0.00 0.00 174.94 175.33 3bqb s ARG 25 N -0.33 4.09 0.24 2.79 3.52 -0.54 0.20 118.95 128.93 3bqb s ARG 25 Ca 0.03 0.18 -0.30 0.00 -0.13 0.00 0.00 55.73 55.51 3bqb s ARG 25 Cb -0.13 -3.61 -0.09 0.00 -1.56 0.00 0.00 34.95 29.56 3bqb s ARG 25 CO 0.02 -0.21 1.29 -0.51 -0.81 0.00 0.00 175.30 175.08 3bqb s LEU 26 N 1.85 4.43 0.25 -0.88 1.43 -0.85 -3.30 118.68 121.61 3bqb s LEU 26 Ca 0.18 2.46 0.23 0.00 -1.03 0.00 0.00 54.13 55.97 3bqb s LEU 26 Cb -0.15 -3.62 0.23 0.00 0.03 0.00 0.00 46.19 42.67 3bqb s LEU 26 CO 0.09 -0.49 1.31 0.44 0.23 0.00 0.00 176.35 177.94 3bqb h ASP 27 N 4.70 0.00 -2.10 2.29 3.32 -1.71 -3.45 116.42 119.47 3bqb h ASP 27 Ca -0.46 -0.04 -0.50 0.00 0.02 0.00 0.00 57.03 56.05 3bqb h ASP 27 Cb 1.22 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.73 3bqb h ASP 27 CO 0.73 0.02 -0.50 -1.61 -1.72 0.00 0.00 179.24 176.17 3bqb s GLU 28 N -3.26 2.91 0.28 3.56 2.02 -1.26 -5.08 118.70 117.87 3bqb s GLU 28 Ca 0.04 -1.10 -0.30 0.00 0.02 0.00 0.00 54.97 53.63 3bqb s GLU 28 Cb 0.09 -2.57 -0.13 0.00 0.10 0.00 0.00 34.13 31.62 3bqb s GLU 28 CO 0.73 0.31 1.34 -3.47 0.02 0.00 0.00 175.26 174.20 3bqb n ASP 29 N -1.26 2.67 -0.09 -0.19 2.03 -1.26 -4.81 116.55 113.65 3bqb n ASP 29 Ca -0.06 1.17 0.01 0.00 0.52 0.00 0.00 54.79 56.43 3bqb n ASP 29 Cb 0.58 -1.44 0.32 0.00 -0.72 0.00 0.00 41.12 39.86 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 3.50 0.73 -0.50 -0.67 0.13 -1.98 0.35 132.00 133.56 3bqb h PRO 30 Ca -0.45 -0.07 -0.04 0.00 -0.87 0.00 0.00 66.00 64.57 3bqb h PRO 30 Cb 1.28 -0.15 -0.02 0.00 0.13 0.00 0.00 31.00 32.24 3bqb h PRO 30 CO 0.70 0.54 0.14 0.82 -0.23 0.00 0.00 178.00 179.97 3bqb h ILE 31 N 0.74 1.23 -0.93 -3.56 2.04 -1.94 0.12 117.51 115.22 3bqb h ILE 31 Ca 0.19 -0.80 0.04 0.00 1.00 0.00 0.00 64.86 65.29 3bqb h ILE 31 Cb 0.01 0.81 -0.06 0.00 -0.74 0.00 0.00 36.82 36.84 3bqb h ILE 31 CO -0.03 0.29 0.60 0.50 0.00 0.00 0.00 178.15 179.51 3bqb h LYS 32 N 0.68 1.12 -0.20 2.37 1.63 -1.75 -2.05 116.57 118.37 3bqb h LYS 32 Ca 0.16 -0.07 -0.13 0.00 -0.85 0.00 0.00 60.65 59.76 3bqb h LYS 32 Cb 0.30 -0.25 -0.01 0.00 -0.60 0.00 0.00 32.23 31.67 3bqb h LYS 32 CO -0.00 0.74 -0.43 0.00 -3.45 0.00 0.00 179.45 176.31 3bqb h ALA 33 N 1.39 0.88 -0.72 5.00 0.00 -0.34 -0.89 119.26 124.57 3bqb h ALA 33 Ca 0.37 -0.45 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3bqb h ALA 33 Cb 0.03 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3bqb h ALA 33 CO -0.13 0.64 0.25 -0.07 0.00 0.00 0.00 179.25 179.94 3bqb h LEU 34 N 0.40 1.02 -0.22 0.00 3.38 -0.41 -0.86 115.31 118.61 3bqb h LEU 34 Ca 0.03 -0.17 -0.15 0.00 0.09 0.00 0.00 57.88 57.67 3bqb h LEU 34 Cb 0.92 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.41 3bqb h LEU 34 CO 0.08 0.93 -0.46 0.24 0.09 0.00 0.00 178.44 179.32 3bqb h MET 35 N 1.06 0.71 0.20 1.13 2.86 -1.18 -0.83 114.93 118.88 3bqb h MET 35 Ca 0.24 -0.46 0.01 0.00 -2.06 0.00 0.00 59.70 57.42 3bqb h MET 35 Cb 0.26 0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.95 3bqb h MET 35 CO -0.01 1.09 -0.35 -0.09 1.06 0.00 0.00 176.91 178.60 3bqb h ARG 36 N 0.42 -0.61 -0.78 1.72 2.43 -1.06 -2.38 114.38 114.12 3bqb h ARG 36 Ca 0.01 0.04 0.08 0.00 -0.81 0.00 0.00 59.98 59.29 3bqb h ARG 36 Cb 1.07 0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 30.69 3bqb h ARG 36 CO 0.10 -0.40 0.45 -0.92 -1.51 0.00 0.00 179.97 177.69 3bqb h TYR 37 N -0.63 0.82 -0.50 2.20 5.03 -1.13 0.13 116.97 122.89 3bqb h TYR 37 Ca 0.01 0.03 0.13 0.00 2.58 0.00 0.00 58.73 61.48 3bqb h TYR 37 Cb 0.63 -0.25 -0.02 0.00 1.55 0.00 0.00 36.73 38.63 3bqb h TYR 37 CO -0.27 0.36 0.35 1.03 -1.32 0.00 0.00 178.16 178.31 3bqb h SER 38 N 0.79 0.08 0.08 -2.11 0.87 -0.85 0.31 113.55 112.72 3bqb h SER 38 Ca 0.36 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.73 3bqb h SER 38 Cb 0.28 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.22 3bqb h SER 38 CO -0.22 0.05 -0.99 -0.08 -0.53 0.00 0.00 176.83 175.06 3bqb h GLU 39 N 0.09 0.18 0.00 2.24 4.81 -0.50 -3.44 114.58 117.96 3bqb h GLU 39 Ca 0.24 -0.30 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3bqb h GLU 39 Cb 0.82 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.31 3bqb h GLU 39 CO -0.02 1.14 -0.10 0.27 -0.73 0.00 0.00 179.01 179.57 3bqb n ASN 40 N -4.17 0.00 -2.71 1.04 0.23 -0.69 -5.04 115.26 103.91 3bqb n ASN 40 Ca -0.21 -1.20 -0.21 0.00 -0.53 0.00 0.00 54.58 52.43 3bqb n ASN 40 Cb 0.77 -0.04 0.01 0.00 -2.08 0.00 0.00 39.78 38.44 3bqb n ASN 40 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3bqb n LYS 41 N 0.00 -3.18 -4.13 -3.83 5.02 0.11 -4.98 118.16 107.17 3bqb n LYS 41 Ca 0.00 0.92 -0.32 0.00 -2.02 0.00 0.00 58.31 56.89 3bqb n LYS 41 Cb 0.54 -5.68 -0.07 0.00 -0.02 0.00 0.00 35.03 29.80 3bqb n LYS 41 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3bqb s GLU 42 N -5.37 2.96 -0.11 1.97 2.02 -1.26 -4.95 118.70 113.96 3bqb s GLU 42 Ca 0.15 -0.56 0.00 0.00 0.02 0.00 0.00 54.97 54.58 3bqb s GLU 42 Cb -0.07 -2.79 0.02 0.00 0.10 0.00 0.00 34.13 31.40 3bqb s GLU 42 CO 0.18 0.62 -0.10 0.08 0.02 0.00 0.00 175.26 176.07 3bqb s VAL 43 N -1.21 1.15 -0.12 2.63 1.01 -1.26 -3.83 120.40 118.76 3bqb s VAL 43 Ca 0.23 -0.39 -0.24 0.00 0.00 0.00 0.00 61.98 61.58 3bqb s VAL 43 Cb -0.12 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.11 3bqb s VAL 43 CO 0.15 0.38 0.77 -0.76 0.00 0.00 0.00 175.10 175.64 3bqb s LEU 44 N 1.49 4.24 0.00 3.92 1.43 -1.26 -4.98 118.68 123.53 3bqb s LEU 44 Ca 0.02 1.18 0.00 0.00 -1.03 0.00 0.00 54.13 54.30 3bqb s LEU 44 Cb -0.13 -3.17 0.00 0.00 0.03 0.00 0.00 46.19 42.92 3bqb s LEU 44 CO -0.07 -0.27 0.00 0.61 0.23 0.00 0.00 176.35 176.85 3bqb n GLY 45 N 3.32 2.70 3.86 -3.19 0.00 -1.26 -1.83 105.19 108.79 3bqb n GLY 45 Ca 0.02 -1.31 -0.36 0.00 0.00 0.00 0.00 46.02 44.37 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 0.00 6.66 0.19 1.61 1.01 -1.21 -4.84 116.67 120.09 3bqb s ASP 46 Ca 0.00 0.80 -0.31 0.00 0.71 0.00 0.00 52.55 53.75 3bqb s ASP 46 Cb 0.00 -2.18 -0.09 0.00 1.01 0.00 0.00 42.92 41.66 3bqb s ASP 46 CO 0.00 0.23 1.42 -0.60 0.21 0.00 0.00 175.17 176.43 3bqb s ARG 47 N -1.64 4.30 0.24 8.23 3.52 -1.26 -1.46 118.95 130.88 3bqb s ARG 47 Ca 0.29 2.20 0.10 0.00 -0.13 0.00 0.00 55.73 58.19 3bqb s ARG 47 Cb -0.14 -3.17 -0.05 0.00 -1.56 0.00 0.00 34.95 30.02 3bqb s ARG 47 CO 0.16 -0.42 -0.18 0.14 -0.81 0.00 0.00 175.30 174.19 3bqb s VAL 48 N 0.53 2.16 0.18 7.11 -7.23 0.17 -4.92 120.40 118.40 3bqb s VAL 48 Ca 0.62 -2.31 0.02 0.00 -1.81 0.00 0.00 61.98 58.50 3bqb s VAL 48 Cb -0.40 -2.18 -0.05 0.00 0.56 0.00 0.00 36.38 34.32 3bqb s VAL 48 CO 0.36 -0.47 -0.00 0.42 -0.31 0.00 0.00 175.10 175.10 3bqb s THR 49 N -2.66 0.73 0.00 5.32 -4.23 -1.26 -4.33 115.64 109.21 3bqb s THR 49 Ca 0.26 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.79 3bqb s THR 49 Cb -0.03 -2.12 0.00 0.00 1.34 0.00 0.00 72.50 71.69 3bqb s THR 49 CO 0.11 -0.48 0.00 0.61 -0.54 0.00 0.00 174.62 174.32 3bqb n GLY 50 N -0.25 1.56 3.48 3.99 0.00 -1.26 -4.99 105.19 107.72 3bqb n GLY 50 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.15 4.19 -1.29 -0.61 -1.09 -1.26 -4.95 121.20 113.03 3bqb s ILE 51 Ca 0.00 -0.23 -0.16 0.00 -2.23 0.00 0.00 60.65 58.03 3bqb s ILE 51 Cb 0.00 -4.75 0.10 0.00 -1.58 0.00 0.00 42.46 36.23 3bqb s ILE 51 CO 0.00 -1.57 1.71 -0.67 -1.23 0.00 0.00 174.94 173.19 3bqb n ASP 52 N 8.09 4.92 -0.16 3.58 -0.08 -1.26 -4.80 116.55 126.84 3bqb n ASP 52 Ca -0.01 -2.94 -0.06 0.00 -1.51 0.00 0.00 54.79 50.28 3bqb n ASP 52 Cb 0.46 -1.68 0.03 0.00 2.34 0.00 0.00 41.12 42.28 3bqb n ASP 52 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 3bqb h TYR 53 N 7.21 0.52 -0.08 -0.67 3.20 -1.99 -1.61 116.97 123.55 3bqb h TYR 53 Ca 0.42 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.28 3bqb h TYR 53 Cb 0.84 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.93 3bqb h TYR 53 CO 1.34 0.29 -0.08 1.96 -1.64 0.00 0.00 178.16 180.03 3bqb h GLN 54 N 0.56 0.11 -0.10 1.82 1.08 -2.00 -1.51 115.11 115.06 3bqb h GLN 54 Ca 0.20 -0.02 -0.21 0.00 -1.45 0.00 0.00 58.65 57.17 3bqb h GLN 54 Cb 0.04 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 3bqb h GLN 54 CO -0.10 0.20 -0.78 0.77 -0.95 0.00 0.00 178.83 177.97 3bqb h SER 55 N 0.11 0.71 -0.14 1.46 0.02 -1.82 -2.94 113.55 110.95 3bqb h SER 55 Ca 0.03 -0.48 -0.03 0.00 -0.84 0.00 0.00 61.79 60.46 3bqb h SER 55 Cb 0.22 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 3bqb h SER 55 CO 0.01 1.26 0.00 -0.07 -1.14 0.00 0.00 176.83 176.89 3bqb h LEU 56 N 0.40 0.33 -0.17 5.07 3.38 -0.58 0.31 115.31 124.05 3bqb h LEU 56 Ca -0.05 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 3bqb h LEU 56 Cb 1.39 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.05 3bqb h LEU 56 CO 0.15 0.39 0.01 -0.07 0.09 0.00 0.00 178.44 179.01 3bqb h LEU 57 N 0.35 0.29 0.00 1.67 3.38 -1.26 -1.82 115.31 117.92 3bqb h LEU 57 Ca 0.08 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 3bqb h LEU 57 Cb 0.24 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 3bqb h LEU 57 CO 0.01 0.50 -0.13 0.11 0.09 0.00 0.00 178.44 179.02 3bqb h LYS 58 N 0.06 0.00 0.00 1.13 1.57 -1.32 -3.39 116.57 114.62 3bqb h LYS 58 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3bqb h LYS 58 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 3bqb h LYS 58 CO 0.01 0.91 -1.06 0.43 -0.57 0.00 0.00 179.45 179.17 3bqb n SER 59 N -4.61 0.77 0.00 0.86 7.64 0.11 -4.98 113.62 113.41 3bqb n SER 59 Ca -0.11 0.27 0.00 0.00 1.01 0.00 0.00 58.87 60.03 3bqb n SER 59 Cb 0.46 0.56 0.00 0.00 -1.01 0.00 0.00 64.21 64.22 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 -2.58 0.00 -4.25 1.43 0.99 -0.68 -4.93 117.46 107.44 3bqb n PHE 60 Ca -0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.45 57.26 3bqb n PHE 60 Cb 0.54 0.00 -0.13 0.00 -1.00 0.00 0.00 39.48 38.89 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 0.87 -0.10 -1.08 0.74 -1.26 -2.04 119.66 116.79 3bqb s GLN 61 Ca 0.00 -0.87 -0.04 0.00 0.05 0.00 0.00 55.36 54.51 3bqb s GLN 61 Cb 0.00 -0.88 0.05 0.00 1.10 0.00 0.00 33.01 33.28 3bqb s GLN 61 CO 0.00 0.21 0.20 0.42 -0.55 0.00 0.00 175.29 175.56 3bqb s ILE 62 N -1.08 -0.28 0.00 -2.34 1.01 -0.60 -4.89 121.20 113.02 3bqb s ILE 62 Ca -0.00 0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.95 3bqb s ILE 62 Cb -0.09 -0.34 0.00 0.00 0.01 0.00 0.00 42.46 42.04 3bqb s ILE 62 CO 0.02 0.13 0.00 0.59 0.00 0.00 0.00 174.94 175.68 3bqb n ASN 63 N 5.17 0.00 -1.24 3.58 4.13 -1.26 -1.89 115.26 123.75 3bqb n ASN 63 Ca -0.08 0.00 0.10 0.00 1.68 0.00 0.00 54.58 56.27 3bqb n ASN 63 Cb 0.50 0.00 0.29 0.00 -1.54 0.00 0.00 39.78 39.03 3bqb n ASN 63 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 3bqb n ASP 64 N 5.08 3.62 -4.33 6.41 5.75 -1.26 -4.90 116.55 126.92 3bqb n ASP 64 Ca 0.00 -2.11 -0.32 0.00 -0.01 0.00 0.00 54.79 52.36 3bqb n ASP 64 Cb 0.00 -0.46 -0.15 0.00 -1.03 0.00 0.00 41.12 39.48 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 -1.33 2.40 -0.00 2.12 -4.36 -0.79 -4.09 121.20 115.14 3bqb s ILE 65 Ca 0.43 -0.95 0.02 0.00 -0.26 0.00 0.00 60.65 59.89 3bqb s ILE 65 Cb 0.24 -1.90 -0.01 0.00 1.25 0.00 0.00 42.46 42.05 3bqb s ILE 65 CO 0.27 0.57 -0.08 -0.60 0.24 0.00 0.00 174.94 175.34 3bqb s ARG 66 N -0.31 0.64 0.59 0.37 3.52 -0.64 -1.56 118.95 121.56 3bqb s ARG 66 Ca 0.01 -0.29 -0.16 0.00 -0.13 0.00 0.00 55.73 55.16 3bqb s ARG 66 Cb -0.13 -0.61 -0.04 0.00 -1.56 0.00 0.00 34.95 32.61 3bqb s ARG 66 CO 0.02 0.17 1.05 -1.50 -0.81 0.00 0.00 175.30 174.23 3bqb s ILE 67 N -0.21 3.89 0.00 4.11 2.07 -0.86 0.23 121.20 130.43 3bqb s ILE 67 Ca 0.03 0.88 0.00 0.00 -1.41 0.00 0.00 60.65 60.15 3bqb s ILE 67 Cb -0.03 -3.42 0.00 0.00 0.13 0.00 0.00 42.46 39.14 3bqb s ILE 67 CO -0.00 -0.54 0.00 1.07 -1.91 0.00 0.00 174.94 173.56 3bqb n THR 68 N -2.04 0.00 -1.64 4.00 5.66 -0.76 -4.79 114.28 114.71 3bqb n THR 68 Ca 0.08 0.00 -0.48 0.00 -3.05 0.00 0.00 64.05 60.61 3bqb n THR 68 Cb 0.53 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.26 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 1.82 0.28 1.09 5.02 -1.26 -4.26 118.16 120.85 3bqb n LYS 69 Ca 0.00 0.66 0.12 0.00 -2.02 0.00 0.00 58.31 57.06 3bqb n LYS 69 Cb 0.00 -2.38 0.79 0.00 -0.02 0.00 0.00 35.03 33.42 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 5.41 0.00 -4.38 1.97 0.13 -1.81 -3.42 132.00 129.90 3bqb h PRO 70 Ca -0.46 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.46 3bqb h PRO 70 Cb 1.28 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.28 3bqb h PRO 70 CO 0.85 0.00 -0.49 0.96 -0.23 0.00 0.00 178.00 179.09 3bqb s ILE 71 N -4.82 0.00 -0.54 -3.56 -4.36 -1.26 -4.42 121.20 102.24 3bqb s ILE 71 Ca -0.05 -1.86 -0.18 0.00 -0.26 0.00 0.00 60.65 58.30 3bqb s ILE 71 Cb 0.16 -2.44 0.09 0.00 1.25 0.00 0.00 42.46 41.52 3bqb s ILE 71 CO 0.60 0.00 0.62 -1.81 0.24 0.00 0.00 174.94 174.60 3bqb s ASP 72 N -3.14 6.19 -0.23 4.36 1.01 -1.26 -5.05 116.67 118.55 3bqb s ASP 72 Ca 0.35 -1.26 -0.29 0.00 0.71 0.00 0.00 52.55 52.06 3bqb s ASP 72 Cb 0.05 -2.28 0.01 0.00 1.01 0.00 0.00 42.92 41.71 3bqb s ASP 72 CO 0.12 -0.96 1.06 -2.16 0.21 0.00 0.00 175.17 173.45 3bqb s PRO 73 N 2.46 4.24 0.45 8.23 0.04 -1.26 -4.91 135.00 144.25 3bqb s PRO 73 Ca 0.11 1.37 0.12 0.00 0.04 0.00 0.00 61.00 62.64 3bqb s PRO 73 Cb -0.23 -3.66 1.04 0.00 0.04 0.00 0.00 34.50 31.69 3bqb s PRO 73 CO 0.08 -0.66 2.07 -1.35 0.04 0.00 0.00 177.00 177.18 3bqb h PRO 74 N 7.58 0.33 -4.10 0.56 0.11 -1.84 -3.12 132.00 131.51 3bqb h PRO 74 Ca -0.20 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 65.70 3bqb h PRO 74 Cb 1.06 -0.07 -0.21 0.00 0.11 0.00 0.00 31.00 31.89 3bqb h PRO 74 CO 0.98 0.22 -0.71 -1.21 -0.21 0.00 0.00 178.00 177.07 3bqb s GLU 75 N -5.33 0.36 -0.09 1.05 2.02 -1.26 -4.37 118.70 111.09 3bqb s GLU 75 Ca -0.07 -0.66 0.01 0.00 0.02 0.00 0.00 54.97 54.27 3bqb s GLU 75 Cb 0.18 0.04 0.02 0.00 0.10 0.00 0.00 34.13 34.46 3bqb s GLU 75 CO 0.72 -0.03 -0.11 0.08 0.02 0.00 0.00 175.26 175.93 3bqb s VAL 76 N -1.54 1.13 0.32 2.63 1.01 -0.03 -2.07 120.40 121.85 3bqb s VAL 76 Ca -0.14 -0.43 0.10 0.00 0.00 0.00 0.00 61.98 61.52 3bqb s VAL 76 Cb -0.09 -1.07 -0.06 0.00 0.00 0.00 0.00 36.38 35.15 3bqb s VAL 76 CO -0.01 0.37 -0.12 0.26 0.00 0.00 0.00 175.10 175.59 3bqb s TRP 77 N 1.07 2.38 0.08 5.22 0.52 -0.54 -0.31 118.94 127.36 3bqb s TRP 77 Ca -0.07 -0.42 0.01 0.00 0.02 0.00 0.00 56.10 55.64 3bqb s TRP 77 Cb -0.15 -1.24 -0.04 0.00 -1.15 0.00 0.00 33.47 30.89 3bqb s TRP 77 CO -0.01 0.63 -0.05 0.20 0.02 0.00 0.00 176.95 177.73 3bqb s GLY 78 N -3.58 0.67 -0.21 0.98 0.00 -0.00 -0.88 107.32 104.29 3bqb s GLY 78 Ca 0.32 -1.30 -0.03 0.00 0.00 0.00 0.00 44.72 43.71 3bqb s GLY 78 CO 0.16 -1.40 0.04 -0.45 0.00 0.00 0.00 173.10 171.45 3bqb s SER 79 N -2.99 3.04 0.68 1.64 0.15 -0.52 -1.31 113.70 114.40 3bqb s SER 79 Ca 0.10 -0.90 -0.07 0.00 0.70 0.00 0.00 55.95 55.78 3bqb s SER 79 Cb 0.06 -0.63 0.04 0.00 -1.71 0.00 0.00 66.02 63.78 3bqb s SER 79 CO -0.06 -0.31 1.01 -0.83 1.20 0.00 0.00 173.24 174.24 3bqb s GLY 80 N 1.83 1.65 -1.27 9.45 0.00 -1.24 -2.56 107.32 115.18 3bqb s GLY 80 Ca -0.00 -0.79 -0.04 0.00 0.00 0.00 0.00 44.72 43.89 3bqb s GLY 80 CO -0.09 -0.41 0.71 1.39 0.00 0.00 0.00 173.10 174.69 3bqb n ILE 81 N -2.88 -4.95 0.48 0.90 5.41 -1.26 -4.51 119.36 112.55 3bqb n ILE 81 Ca 0.07 -0.64 0.08 0.00 1.00 0.00 0.00 62.75 63.26 3bqb n ILE 81 Cb 0.59 -4.00 -0.10 0.00 -0.71 0.00 0.00 39.64 35.42 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 -3.01 0.93 -4.99 4.38 3.41 -1.26 -4.77 113.62 108.31 3bqb n SER 82 Ca -0.25 -0.57 -0.19 0.00 -0.26 0.00 0.00 58.87 57.60 3bqb n SER 82 Cb 0.66 1.26 0.01 0.00 -0.26 0.00 0.00 64.21 65.88 3bqb n SER 82 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3bqb s TYR 83 N -2.70 2.94 0.23 7.33 1.51 -1.26 0.13 117.35 125.53 3bqb s TYR 83 Ca 0.02 -0.24 -0.31 0.00 -1.01 0.00 0.00 57.07 55.53 3bqb s TYR 83 Cb 0.11 -2.31 -0.11 0.00 -0.11 0.00 0.00 41.96 39.54 3bqb s TYR 83 CO 0.65 -0.36 1.54 -1.21 -1.11 0.00 0.00 175.55 175.07 3bqb s GLU 84 N -4.37 4.20 -0.21 -0.62 0.41 -0.24 -4.67 118.70 113.21 3bqb s GLU 84 Ca 0.52 2.42 -0.16 0.00 -0.41 0.00 0.00 54.97 57.34 3bqb s GLU 84 Cb -0.10 -3.10 0.06 0.00 -1.78 0.00 0.00 34.13 29.21 3bqb s GLU 84 CO 0.34 -0.56 0.53 0.00 -0.49 0.00 0.00 175.26 175.07 3bqb s MET 85 N 0.17 0.57 0.44 1.61 0.23 -1.26 -5.05 119.30 116.01 3bqb s MET 85 Ca 0.65 0.84 -0.23 0.00 -1.03 0.00 0.00 55.69 55.92 3bqb s MET 85 Cb -0.45 0.19 -0.08 0.00 -1.53 0.00 0.00 34.83 32.96 3bqb s MET 85 CO 0.40 -0.11 1.10 0.00 -2.03 0.00 0.00 175.02 174.38 3bqb s ALA 86 N 0.82 3.00 -0.70 3.16 0.00 -1.26 -4.91 121.76 121.88 3bqb s ALA 86 Ca -0.04 0.80 -0.26 0.00 0.00 0.00 0.00 51.96 52.46 3bqb s ALA 86 Cb -0.05 -3.32 -0.09 0.00 0.00 0.00 0.00 23.12 19.65 3bqb s ALA 86 CO -0.07 -0.44 2.29 1.03 0.00 0.00 0.00 175.76 178.57 3bqb s ARG 87 N -2.69 1.98 -0.22 0.00 0.52 -1.26 -4.91 118.95 112.37 3bqb s ARG 87 Ca 0.62 0.67 -0.28 0.00 -0.52 0.00 0.00 55.73 56.21 3bqb s ARG 87 Cb -0.24 -4.73 0.01 0.00 0.52 0.00 0.00 34.95 30.50 3bqb s ARG 87 CO 0.30 -3.79 1.00 -1.21 0.02 0.00 0.00 175.30 171.62 3bqb s GLU 88 N 8.27 4.26 0.00 3.54 2.02 -1.26 -4.92 118.70 130.60 3bqb s GLU 88 Ca 0.88 1.29 0.29 0.00 0.02 0.00 0.00 54.97 57.45 3bqb s GLU 88 Cb -0.13 -3.63 1.47 0.00 0.10 0.00 0.00 34.13 31.94 3bqb s GLU 88 CO 0.13 -0.58 2.01 0.54 0.02 0.00 0.00 175.26 177.38 3bqb n ARG 89 N 6.15 0.42 -3.80 1.61 5.12 -1.26 -4.09 116.66 120.81 3bqb n ARG 89 Ca 0.11 0.01 -0.28 0.00 -1.93 0.00 0.00 57.85 55.76 3bqb n ARG 89 Cb 0.46 -1.50 -0.12 0.00 -1.16 0.00 0.00 32.46 30.15 3bqb n ARG 89 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 3bqb s TYR 90 N -2.56 2.96 0.11 -1.55 2.02 -1.26 -5.08 117.35 111.99 3bqb s TYR 90 Ca 0.28 -3.07 -0.35 0.00 -0.37 0.00 0.00 57.07 53.56 3bqb s TYR 90 Cb 0.19 -2.33 -0.14 0.00 -0.40 0.00 0.00 41.96 39.28 3bqb s TYR 90 CO 0.44 -0.63 1.55 0.43 -1.57 0.00 0.00 175.55 175.77 3bqb n SER 91 N 2.35 2.74 -4.59 2.29 7.64 -1.26 -4.87 113.62 117.92 3bqb n SER 91 Ca 0.19 1.08 -0.45 0.00 1.01 0.00 0.00 58.87 60.70 3bqb n SER 91 Cb 0.37 -1.35 -0.02 0.00 -1.01 0.00 0.00 64.21 62.19 3bqb n SER 91 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 3bqb n GLU 92 N 3.53 1.33 -1.38 1.43 2.13 -1.26 -4.79 120.64 121.63 3bqb n GLU 92 Ca 0.18 0.47 -0.39 0.00 0.66 0.00 0.00 57.16 58.08 3bqb n GLU 92 Cb 0.26 -1.87 -0.02 0.00 0.27 0.00 0.00 31.44 30.07 3bqb n GLU 92 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 3bqb n GLU 93 N 1.00 3.51 0.00 5.31 2.13 -1.26 -3.20 120.64 128.12 3bqb n GLU 93 Ca 0.11 -2.26 0.00 0.00 0.66 0.00 0.00 57.16 55.67 3bqb n GLU 93 Cb 0.30 -2.88 0.00 0.00 0.27 0.00 0.00 31.44 29.13 3bqb n GLU 93 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 3bqb n ASN 94 N 4.08 0.00 -4.74 4.31 2.85 -1.26 -5.13 115.26 115.36 3bqb n ASN 94 Ca 0.73 0.00 -0.40 0.00 -0.11 0.00 0.00 54.58 54.80 3bqb n ASN 94 Cb 0.26 0.00 0.02 0.00 1.24 0.00 0.00 39.78 41.30 3bqb n ASN 94 CO 0.00 0.00 0.00 1.33 -2.11 0.00 0.00 177.26 176.48 3bqb n VAL 95 N -0.23 2.98 -2.03 3.44 0.24 -1.20 -4.96 118.33 116.57 3bqb n VAL 95 Ca 0.00 -0.50 -0.40 0.00 -2.04 0.00 0.00 64.34 61.40 3bqb n VAL 95 Cb 0.00 -1.75 -0.01 0.00 -1.47 0.00 0.00 33.84 30.62 3bqb n VAL 95 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3bqb s ALA 96 N -1.22 3.35 0.08 2.33 0.00 -1.26 -4.97 121.76 120.06 3bqb s ALA 96 Ca 0.63 1.29 -0.10 0.00 0.00 0.00 0.00 51.96 53.78 3bqb s ALA 96 Cb -0.45 -3.50 0.01 0.00 0.00 0.00 0.00 23.12 19.17 3bqb s ALA 96 CO 0.56 -0.82 0.23 -1.59 0.00 0.00 0.00 175.76 174.13 3bqb s LYS 97 N -2.13 0.84 -0.17 0.00 -2.85 -1.26 -2.19 119.74 111.96 3bqb s LYS 97 Ca 0.55 -0.81 0.00 0.00 -1.00 0.00 0.00 55.97 54.70 3bqb s LYS 97 Cb -0.40 0.35 0.04 0.00 -2.06 0.00 0.00 37.83 35.76 3bqb s LYS 97 CO 0.52 -0.27 -0.08 0.42 0.10 0.00 0.00 175.35 176.04 3bqb s ILE 98 N -3.46 1.33 -1.48 3.79 1.01 -0.07 -4.68 121.20 117.65 3bqb s ILE 98 Ca 0.02 -0.76 -0.08 0.00 0.00 0.00 0.00 60.65 59.83 3bqb s ILE 98 Cb 0.03 -1.44 0.06 0.00 0.01 0.00 0.00 42.46 41.11 3bqb s ILE 98 CO -0.09 0.17 0.76 0.18 0.00 0.00 0.00 174.94 175.96 3bqb n LEU 99 N 4.80 -2.48 0.00 2.97 7.99 -1.26 -2.52 117.00 126.50 3bqb n LEU 99 Ca -0.13 -0.88 0.00 0.00 -0.01 0.00 0.00 56.01 54.99 3bqb n LEU 99 Cb 0.47 -2.43 0.00 0.00 -0.11 0.00 0.00 43.42 41.35 3bqb n LEU 99 CO 0.18 0.42 0.00 0.61 -1.51 0.00 0.00 177.39 177.09 3bqb n GLY 100 N -1.68 2.71 3.68 -0.72 0.00 -1.26 -4.98 105.19 102.94 3bqb n GLY 100 Ca -0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.04 4.31 0.58 1.61 2.20 -1.05 -4.97 119.74 122.39 3bqb s LYS 101 Ca 0.00 0.92 -0.19 0.00 -0.36 0.00 0.00 55.97 56.33 3bqb s LYS 101 Cb 0.00 -3.55 -0.04 0.00 -1.51 0.00 0.00 37.83 32.74 3bqb s LYS 101 CO 0.00 -0.22 1.23 -0.08 -0.36 0.00 0.00 175.35 175.92 3bqb s THR 102 N 1.80 2.52 0.38 3.43 -1.32 -1.26 -0.89 115.64 120.30 3bqb s THR 102 Ca 0.37 0.34 0.09 0.00 -1.21 0.00 0.00 61.69 61.28 3bqb s THR 102 Cb -0.17 -3.14 0.32 0.00 -1.51 0.00 0.00 72.50 68.00 3bqb s THR 102 CO 0.13 -0.06 1.93 0.16 -2.21 0.00 0.00 174.62 174.58 3bqb h ILE 103 N 0.99 0.91 -0.10 5.08 3.07 -1.79 -0.97 117.51 124.70 3bqb h ILE 103 Ca -0.50 -0.22 -0.12 0.00 1.55 0.00 0.00 64.86 65.57 3bqb h ILE 103 Cb 1.30 0.22 -0.01 0.00 -0.27 0.00 0.00 36.82 38.06 3bqb h ILE 103 CO 0.55 0.12 -0.46 1.88 -1.05 0.00 0.00 178.15 179.19 3bqb h TYR 104 N 0.64 0.30 -0.00 0.16 0.05 -1.91 -2.40 116.97 113.81 3bqb h TYR 104 Ca 0.36 -0.09 0.00 0.00 0.05 0.00 0.00 58.73 59.05 3bqb h TYR 104 Cb 0.53 -0.06 0.00 0.00 1.01 0.00 0.00 36.73 38.21 3bqb h TYR 104 CO -0.00 0.67 -0.61 -0.85 -1.05 0.00 0.00 178.16 176.32 3bqb n GLU 105 N -3.99 0.20 -0.01 4.88 0.28 -0.77 -2.82 120.64 118.41 3bqb n GLU 105 Ca -0.02 -0.14 -0.16 0.00 -0.16 0.00 0.00 57.16 56.68 3bqb n GLU 105 Cb 0.52 -1.50 -0.10 0.00 1.43 0.00 0.00 31.44 31.79 3bqb n GLU 105 CO 0.00 0.00 0.00 0.87 -0.16 0.00 0.00 177.13 177.84 3bqb h LYS 106 N 0.34 0.40 -0.58 3.44 1.57 -1.02 -3.24 116.57 117.48 3bqb h LYS 106 Ca 0.00 -0.39 0.06 0.00 -1.87 0.00 0.00 60.65 58.46 3bqb h LYS 106 Cb 0.52 0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.87 3bqb h LYS 106 CO 0.00 1.04 0.28 0.28 -0.57 0.00 0.00 179.45 180.48 3bqb h VAL 107 N -0.10 0.91 -0.86 0.50 2.07 -1.52 -0.70 116.25 116.54 3bqb h VAL 107 Ca -0.05 -0.18 0.22 0.00 0.82 0.00 0.00 66.70 67.51 3bqb h VAL 107 Cb 1.19 0.34 -0.13 0.00 -1.52 0.00 0.00 31.29 31.17 3bqb h VAL 107 CO 0.10 0.09 0.27 0.22 0.02 0.00 0.00 177.57 178.28 3bqb h TYR 108 N 0.52 0.42 -0.00 1.57 5.03 -1.58 -1.96 116.97 120.97 3bqb h TYR 108 Ca 0.27 0.05 0.00 0.00 2.58 0.00 0.00 58.73 61.62 3bqb h TYR 108 Cb 0.22 -0.05 0.00 0.00 1.55 0.00 0.00 36.73 38.45 3bqb h TYR 108 CO -0.11 -0.15 -0.80 -0.25 -1.32 0.00 0.00 178.16 175.52 3bqb n ASP 109 N -5.17 1.17 -4.79 -2.11 8.00 -1.02 -4.99 116.55 107.65 3bqb n ASP 109 Ca 0.21 -1.02 -0.32 0.00 0.71 0.00 0.00 54.79 54.36 3bqb n ASP 109 Cb 0.65 0.77 0.05 0.00 -0.02 0.00 0.00 41.12 42.56 3bqb n ASP 109 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3bqb s ALA 110 N -2.87 2.52 0.12 2.24 0.00 -0.30 -4.97 121.76 118.51 3bqb s ALA 110 Ca 0.11 0.38 -0.13 0.00 0.00 0.00 0.00 51.96 52.32 3bqb s ALA 110 Cb 0.17 -3.26 -0.06 0.00 0.00 0.00 0.00 23.12 19.96 3bqb s ALA 110 CO 0.77 -1.26 1.46 -0.39 0.00 0.00 0.00 175.76 176.34 3bqb h VAL 111 N -0.24 1.29 -3.26 0.00 -1.51 -1.91 -3.43 116.25 107.19 3bqb h VAL 111 Ca -0.46 -1.44 -0.56 0.00 -1.23 0.00 0.00 66.70 63.02 3bqb h VAL 111 Cb 1.23 1.45 -0.04 0.00 -2.13 0.00 0.00 31.29 31.80 3bqb h VAL 111 CO 0.55 0.47 0.56 -0.60 -1.23 0.00 0.00 177.57 177.32 3bqb s ARG 112 N -4.45 4.43 0.56 5.19 3.52 -1.26 -5.05 118.95 121.89 3bqb s ARG 112 Ca -0.12 1.41 -0.04 0.00 -0.13 0.00 0.00 55.73 56.84 3bqb s ARG 112 Cb 0.10 -3.54 0.01 0.00 -1.56 0.00 0.00 34.95 29.96 3bqb s ARG 112 CO 0.85 -0.30 0.84 -1.25 -0.81 0.00 0.00 175.30 174.63 3bqb s PRO 113 N 1.95 2.94 -0.02 5.12 0.04 -1.26 -4.90 135.00 138.86 3bqb s PRO 113 Ca 0.49 -0.15 -0.30 0.00 0.04 0.00 0.00 61.00 61.08 3bqb s PRO 113 Cb -0.19 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 31.96 3bqb s PRO 113 CO 0.19 -0.60 1.27 -2.00 0.04 0.00 0.00 177.00 175.90 3bqb s GLU 114 N -4.88 4.34 -0.07 4.56 2.12 -1.26 -5.03 118.70 118.48 3bqb s GLU 114 Ca 0.53 1.79 0.00 0.00 0.36 0.00 0.00 54.97 57.65 3bqb s GLU 114 Cb -0.10 -3.54 0.02 0.00 0.26 0.00 0.00 34.13 30.77 3bqb s GLU 114 CO 0.43 -0.47 -0.04 0.42 -0.54 0.00 0.00 175.26 175.05 3bqb s ILE 115 N 2.14 0.64 0.05 -3.70 -1.09 -1.26 -3.60 121.20 114.38 3bqb s ILE 115 Ca 0.59 -0.12 0.02 0.00 -2.23 0.00 0.00 60.65 58.91 3bqb s ILE 115 Cb -0.28 -0.69 -0.03 0.00 -1.58 0.00 0.00 42.46 39.89 3bqb s ILE 115 CO 0.24 0.27 -0.08 0.72 -1.23 0.00 0.00 174.94 174.87 3bqb s PHE 116 N 1.33 0.70 -0.00 3.97 -0.12 -0.43 -4.99 117.98 118.44 3bqb s PHE 116 Ca -0.04 -0.54 -0.30 0.00 -0.05 0.00 0.00 56.93 56.00 3bqb s PHE 116 Cb -0.14 -0.42 -0.03 0.00 -0.63 0.00 0.00 43.02 41.81 3bqb s PHE 116 CO -0.02 -0.09 1.01 0.12 -0.05 0.00 0.00 175.22 176.19 3bqb s PHE 117 N -1.58 3.61 -0.17 3.49 2.19 -1.26 -0.82 117.98 123.44 3bqb s PHE 117 Ca -0.08 1.64 -0.04 0.00 0.33 0.00 0.00 56.93 58.77 3bqb s PHE 117 Cb -0.09 -3.16 -0.09 0.00 -1.31 0.00 0.00 43.02 38.37 3bqb s PHE 117 CO -0.00 -0.19 -0.19 1.17 1.83 0.00 0.00 175.22 177.84 3bqb n LYS 118 N 4.03 0.38 -3.58 10.12 3.00 0.57 -4.85 118.16 127.83 3bqb n LYS 118 Ca 0.07 0.13 -0.08 0.00 -0.00 0.00 0.00 58.31 58.43 3bqb n LYS 118 Cb 0.50 -1.20 -0.02 0.00 0.00 0.00 0.00 35.03 34.31 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 -1.70 0.37 3.14 0.00 -0.85 -4.31 121.76 116.08 3bqb s ALA 119 Ca -0.23 0.61 0.07 0.00 0.00 0.00 0.00 51.96 52.41 3bqb s ALA 119 Cb 0.08 0.58 -0.01 0.00 0.00 0.00 0.00 23.12 23.77 3bqb s ALA 119 CO 0.33 -0.82 0.44 0.95 0.00 0.00 0.00 175.76 176.67 3bqb s THR 120 N -3.32 3.48 0.20 0.00 -4.23 -1.26 -0.85 115.64 109.66 3bqb s THR 120 Ca 0.07 -1.13 -0.11 0.00 -1.18 0.00 0.00 61.69 59.34 3bqb s THR 120 Cb -0.01 -3.20 0.12 0.00 1.34 0.00 0.00 72.50 70.75 3bqb s THR 120 CO -0.06 -0.10 1.79 1.55 -0.54 0.00 0.00 174.62 177.27 3bqb h PRO 121 N 0.92 0.57 0.00 3.99 0.13 -1.74 -2.07 132.00 133.80 3bqb h PRO 121 Ca -0.43 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3bqb h PRO 121 Cb 1.26 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3bqb h PRO 121 CO 0.53 0.37 0.00 0.27 -0.23 0.00 0.00 178.00 178.94 3bqb n ASN 122 N -4.85 0.35 -0.37 1.44 6.94 -1.26 -0.76 115.26 116.75 3bqb n ASN 122 Ca 0.07 0.62 0.13 0.00 -0.02 0.00 0.00 54.58 55.38 3bqb n ASN 122 Cb 0.17 -0.68 0.34 0.00 -2.36 0.00 0.00 39.78 37.25 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 -1.92 1.15 -3.98 -3.83 1.74 -0.78 -4.77 116.66 104.27 3bqb n ARG 123 Ca 0.01 -0.75 -0.33 0.00 -0.77 0.00 0.00 57.85 56.02 3bqb n ARG 123 Cb 0.12 -1.48 -0.06 0.00 -1.02 0.00 0.00 32.46 30.02 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 -1.30 1.40 0.00 0.00 -7.23 -0.23 -4.94 120.40 108.10 3bqb s VAL 125 Ca 0.26 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.34 3bqb s VAL 125 Cb -0.12 -2.36 0.00 0.00 0.56 0.00 0.00 36.38 34.45 3bqb s VAL 125 CO 0.18 -0.34 0.00 0.61 -0.31 0.00 0.00 175.10 175.23 3bqb n GLY 126 N -0.49 4.36 3.68 2.32 0.00 -1.26 -2.33 105.19 111.46 3bqb n GLY 126 Ca -0.06 -2.17 -0.46 0.00 0.00 0.00 0.00 46.02 43.34 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 -0.14 2.36 -0.25 1.61 -0.00 -1.26 -1.46 115.22 116.09 3bqb n HIS 127 Ca 0.00 0.11 0.00 0.00 0.46 0.00 0.00 57.72 58.29 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 3.88 1.89 3.94 1.57 0.00 0.41 -4.48 105.19 112.40 3bqb n GLY 128 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.21 3.44 -0.10 1.61 2.02 -0.53 -4.76 118.70 120.16 3bqb s GLU 129 Ca 0.00 -0.55 -0.28 0.00 0.02 0.00 0.00 54.97 54.16 3bqb s GLU 129 Cb 0.00 -2.98 -0.02 0.00 0.10 0.00 0.00 34.13 31.23 3bqb s GLU 129 CO 0.00 0.54 0.93 0.00 0.02 0.00 0.00 175.26 176.75 3bqb s ALA 130 N -1.69 3.39 0.63 5.21 0.00 -1.26 -4.06 121.76 123.99 3bqb s ALA 130 Ca 0.35 0.29 -0.09 0.00 0.00 0.00 0.00 51.96 52.50 3bqb s ALA 130 Cb -0.12 -3.32 -0.01 0.00 0.00 0.00 0.00 23.12 19.68 3bqb s ALA 130 CO 0.28 -0.50 1.00 0.96 0.00 0.00 0.00 175.76 177.50 3bqb s ILE 131 N 1.76 3.99 0.10 0.00 -4.36 -0.67 -4.83 121.20 117.19 3bqb s ILE 131 Ca 0.45 0.45 0.10 0.00 -0.26 0.00 0.00 60.65 61.39 3bqb s ILE 131 Cb -0.18 -3.62 -0.04 0.00 1.25 0.00 0.00 42.46 39.88 3bqb s ILE 131 CO 0.18 -0.75 -0.26 0.00 0.24 0.00 0.00 174.94 174.35 3bqb s ALA 132 N -3.17 2.23 -0.17 2.27 0.00 -0.25 -1.21 121.76 121.46 3bqb s ALA 132 Ca 0.55 -1.37 -0.08 0.00 0.00 0.00 0.00 51.96 51.06 3bqb s ALA 132 Cb -0.11 -0.38 -0.04 0.00 0.00 0.00 0.00 23.12 22.59 3bqb s ALA 132 CO 0.50 0.50 0.11 0.08 0.00 0.00 0.00 175.76 176.95 3bqb s VAL 133 N -1.01 5.23 0.66 0.00 1.01 0.37 -4.73 120.40 121.93 3bqb s VAL 133 Ca 0.12 0.12 -0.18 0.00 0.00 0.00 0.00 61.98 62.04 3bqb s VAL 133 Cb -0.10 -3.35 -0.01 0.00 0.00 0.00 0.00 36.38 32.92 3bqb s VAL 133 CO 0.05 0.49 1.28 0.54 0.00 0.00 0.00 175.10 177.46 3bqb n ARG 134 N 3.10 1.07 0.30 2.72 1.74 -1.26 -1.97 116.66 122.35 3bqb n ARG 134 Ca -0.17 0.42 0.17 0.00 -0.77 0.00 0.00 57.85 57.50 3bqb n ARG 134 Cb 0.53 -2.52 0.93 0.00 -1.02 0.00 0.00 32.46 30.38 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 0.46 0.00 -0.32 0.55 4.64 -1.91 -2.90 113.55 114.07 3bqb h SER 135 Ca -0.51 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.67 3bqb h SER 135 Cb 1.34 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.34 3bqb h SER 135 CO 0.53 0.04 -0.07 -0.90 -0.87 0.00 0.00 176.83 175.55 3bqb n ASP 136 N -3.44 2.68 -4.27 4.97 3.85 -1.26 -4.90 116.55 114.17 3bqb n ASP 136 Ca -0.02 -3.64 -0.32 0.00 -0.71 0.00 0.00 54.79 50.10 3bqb n ASP 136 Cb 0.15 -0.61 -0.16 0.00 -1.35 0.00 0.00 41.12 39.14 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 -2.46 3.15 -0.03 -1.12 0.15 -1.09 -4.96 113.70 107.33 3bqb s SER 137 Ca 0.44 -0.50 0.10 0.00 0.70 0.00 0.00 55.95 56.68 3bqb s SER 137 Cb 0.39 -0.99 0.28 0.00 -1.71 0.00 0.00 66.02 63.99 3bqb s SER 137 CO 0.01 0.23 1.23 -0.62 1.20 0.00 0.00 173.24 175.29 3bqb n GLU 138 N 3.06 2.85 -2.82 5.44 4.71 -1.26 -4.79 120.64 127.83 3bqb n GLU 138 Ca -0.18 -2.07 -0.08 0.00 -0.01 0.00 0.00 57.16 54.83 3bqb n GLU 138 Cb 0.52 -1.30 0.01 0.00 -1.01 0.00 0.00 31.44 29.66 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 0.12 -3.37 -3.84 -0.32 -0.00 -1.26 -4.89 117.44 103.87 3bqb n TRP 139 Ca 0.11 -1.69 -0.35 0.00 -0.00 0.00 0.00 57.50 55.57 3bqb n TRP 139 Cb 0.46 1.36 -0.09 0.00 -0.00 0.00 0.00 31.31 33.04 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 0.69 5.06 0.01 5.87 2.01 -1.26 -1.55 115.64 126.47 3bqb s THR 140 Ca 0.31 0.07 0.09 0.00 0.31 0.00 0.00 61.69 62.46 3bqb s THR 140 Cb 0.07 -3.31 -0.02 0.00 0.01 0.00 0.00 72.50 69.25 3bqb s THR 140 CO -0.12 0.42 -0.26 -0.76 -0.69 0.00 0.00 174.62 173.21 3bqb s LEU 141 N 0.58 2.12 0.36 4.42 1.43 -0.21 -1.32 118.68 126.06 3bqb s LEU 141 Ca 0.06 -0.52 -0.25 0.00 -1.03 0.00 0.00 54.13 52.38 3bqb s LEU 141 Cb -0.12 -1.32 -0.09 0.00 0.03 0.00 0.00 46.19 44.68 3bqb s LEU 141 CO 0.01 0.29 1.03 -2.16 0.23 0.00 0.00 176.35 175.75 3bqb s PRO 142 N -0.91 4.33 -0.30 1.29 0.04 -1.26 -1.19 135.00 137.00 3bqb s PRO 142 Ca 0.11 1.52 0.03 0.00 0.04 0.00 0.00 61.00 62.70 3bqb s PRO 142 Cb -0.10 -2.70 0.08 0.00 0.04 0.00 0.00 34.50 31.82 3bqb s PRO 142 CO 0.00 0.01 -0.02 -1.21 0.04 0.00 0.00 177.00 175.83 3bqb s GLU 143 N -2.23 1.77 -0.11 4.56 2.02 -1.11 -4.86 118.70 118.74 3bqb s GLU 143 Ca 0.54 -1.62 -0.30 0.00 0.02 0.00 0.00 54.97 53.62 3bqb s GLU 143 Cb -0.23 -3.03 -0.02 0.00 0.10 0.00 0.00 34.13 30.95 3bqb s GLU 143 CO 0.29 -0.78 1.23 -1.25 0.02 0.00 0.00 175.26 174.76 3bqb s PRO 144 N 1.02 4.30 0.02 0.39 0.04 -1.26 -1.36 135.00 138.14 3bqb s PRO 144 Ca 0.02 1.66 0.00 0.00 0.04 0.00 0.00 61.00 62.73 3bqb s PRO 144 Cb -0.19 -3.65 -0.02 0.00 0.04 0.00 0.00 34.50 30.67 3bqb s PRO 144 CO -0.07 -0.57 -0.04 -1.21 0.04 0.00 0.00 177.00 175.15 3bqb s GLU 145 N 2.82 0.35 0.13 4.56 2.02 -0.16 -4.41 118.70 124.02 3bqb s GLU 145 Ca 0.55 -0.66 -0.30 0.00 0.02 0.00 0.00 54.97 54.58 3bqb s GLU 145 Cb -0.23 0.06 -0.07 0.00 0.10 0.00 0.00 34.13 33.99 3bqb s GLU 145 CO 0.18 -0.04 1.09 -1.17 0.02 0.00 0.00 175.26 175.34 3bqb s LEU 146 N -1.54 4.46 0.11 1.80 2.96 -1.26 -1.46 118.68 123.75 3bqb s LEU 146 Ca -0.14 2.00 0.09 0.00 -0.22 0.00 0.00 54.13 55.86 3bqb s LEU 146 Cb -0.09 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 3bqb s LEU 146 CO -0.01 -0.25 -0.23 0.00 -1.32 0.00 0.00 176.35 174.54 3bqb s ALA 147 N 0.11 1.99 0.01 5.97 0.00 -0.69 -1.11 121.76 128.05 3bqb s ALA 147 Ca 0.51 -1.30 0.07 0.00 0.00 0.00 0.00 51.96 51.23 3bqb s ALA 147 Cb -0.28 -0.30 -0.03 0.00 0.00 0.00 0.00 23.12 22.51 3bqb s ALA 147 CO 0.33 0.42 -0.20 0.14 0.00 0.00 0.00 175.76 176.45 3bqb s VAL 148 N -1.09 2.61 -0.16 0.00 -7.23 -0.26 -1.17 120.40 113.08 3bqb s VAL 148 Ca 0.09 -1.11 -0.16 0.00 -1.81 0.00 0.00 61.98 58.99 3bqb s VAL 148 Cb -0.10 -2.04 -0.04 0.00 0.56 0.00 0.00 36.38 34.76 3bqb s VAL 148 CO 0.05 0.44 0.39 -0.69 -0.31 0.00 0.00 175.10 174.98 3bqb s VAL 149 N -0.81 5.23 0.10 1.32 1.01 0.23 -0.67 120.40 126.81 3bqb s VAL 149 Ca 0.13 0.74 0.07 0.00 0.00 0.00 0.00 61.98 62.93 3bqb s VAL 149 Cb -0.10 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 3bqb s VAL 149 CO 0.03 0.31 -0.13 -0.76 0.00 0.00 0.00 175.10 174.55 3bqb s LEU 150 N 0.85 2.93 0.00 3.92 1.02 0.13 0.83 118.68 128.35 3bqb s LEU 150 Ca 0.21 -0.43 -0.03 0.00 0.02 0.00 0.00 54.13 53.89 3bqb s LEU 150 Cb -0.14 -1.74 0.16 0.00 0.02 0.00 0.00 46.19 44.49 3bqb s LEU 150 CO 0.07 0.18 1.08 -0.90 0.02 0.00 0.00 176.35 176.81 3bqb n ASP 151 N 0.79 1.16 0.27 2.29 5.68 -0.85 -0.53 116.55 125.35 3bqb n ASP 151 Ca -0.14 -2.05 0.15 0.00 -0.50 0.00 0.00 54.79 52.25 3bqb n ASP 151 Cb 0.52 -0.73 0.74 0.00 -1.14 0.00 0.00 41.12 40.52 3bqb n ASP 151 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 3bqb h SER 152 N -0.82 0.00 0.16 -1.12 4.64 -1.77 -2.14 113.55 112.50 3bqb h SER 152 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 3bqb h SER 152 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3bqb h SER 152 CO 0.35 0.10 -0.04 0.59 -0.87 0.00 0.00 176.83 176.96 3bqb n ASN 153 N -3.40 0.55 0.00 4.97 3.02 -1.26 -4.47 115.26 114.67 3bqb n ASN 153 Ca -0.01 -0.93 0.00 0.00 -0.03 0.00 0.00 54.58 53.61 3bqb n ASN 153 Cb 0.26 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.39 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 1.16 0.77 3.75 7.41 0.00 -0.81 -5.04 105.19 112.43 3bqb n GLY 154 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 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 4.44 -0.36 1.61 2.20 -1.26 -4.79 119.74 121.20 3bqb s LYS 155 Ca 0.00 2.04 -0.29 0.00 -0.36 0.00 0.00 55.97 57.36 3bqb s LYS 155 Cb 0.00 -3.16 0.01 0.00 -1.51 0.00 0.00 37.83 33.18 3bqb s LYS 155 CO 0.00 -0.12 1.20 0.42 -0.36 0.00 0.00 175.35 176.49 3bqb s ILE 156 N -0.57 4.25 -0.39 5.43 1.01 -1.26 -2.01 121.20 127.67 3bqb s ILE 156 Ca 0.51 1.39 0.23 0.00 0.00 0.00 0.00 60.65 62.78 3bqb s ILE 156 Cb -0.36 -4.34 0.10 0.00 0.01 0.00 0.00 42.46 37.86 3bqb s ILE 156 CO 0.43 -0.62 1.26 -0.07 0.00 0.00 0.00 174.94 175.94 3bqb h LEU 157 N 10.82 0.00 0.00 2.97 3.38 0.09 -3.45 115.31 129.12 3bqb h LEU 157 Ca -0.24 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3bqb h LEU 157 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 3bqb h LEU 157 CO 1.06 0.02 0.00 0.61 0.09 0.00 0.00 178.44 180.22 3bqb n GLY 158 N 1.20 -0.81 3.38 0.83 0.00 -1.21 -3.78 105.19 104.80 3bqb n GLY 158 Ca 0.02 -1.19 -0.22 0.00 0.00 0.00 0.00 46.02 44.63 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 -2.00 1.96 0.31 1.61 2.02 0.47 -0.60 117.35 121.13 3bqb s TYR 159 Ca 0.00 -0.45 -0.12 0.00 -0.37 0.00 0.00 57.07 56.14 3bqb s TYR 159 Cb 0.00 -0.94 0.02 0.00 -0.40 0.00 0.00 41.96 40.64 3bqb s TYR 159 CO 0.00 0.44 0.59 -0.08 -1.57 0.00 0.00 175.55 174.93 3bqb s THR 160 N -2.28 0.00 -0.06 -0.71 -1.32 -0.32 -0.67 115.64 110.29 3bqb s THR 160 Ca 0.21 -1.31 -0.16 0.00 -1.21 0.00 0.00 61.69 59.22 3bqb s THR 160 Cb -0.05 -2.47 -0.05 0.00 -1.51 0.00 0.00 72.50 68.42 3bqb s THR 160 CO 0.09 0.00 0.43 -0.63 -2.21 0.00 0.00 174.62 172.30 3bqb s ILE 161 N -3.31 5.10 -0.02 5.08 1.01 -1.18 -1.70 121.20 126.18 3bqb s ILE 161 Ca 0.22 0.88 0.03 0.00 0.00 0.00 0.00 60.65 61.78 3bqb s ILE 161 Cb -0.02 -3.76 -0.00 0.00 0.01 0.00 0.00 42.46 38.69 3bqb s ILE 161 CO 0.13 0.46 -0.11 -0.32 0.00 0.00 0.00 174.94 175.10 3bqb s MET 162 N -0.28 1.02 -0.35 2.79 1.75 -0.53 -2.23 119.30 121.47 3bqb s MET 162 Ca 0.24 -0.37 -0.10 0.00 -1.25 0.00 0.00 55.69 54.21 3bqb s MET 162 Cb -0.16 -0.96 0.02 0.00 2.84 0.00 0.00 34.83 36.57 3bqb s MET 162 CO 0.12 0.18 0.18 0.34 -0.65 0.00 0.00 175.02 175.18 3bqb s ASP 163 N 0.00 5.62 -0.98 1.11 2.15 0.16 -0.99 116.67 123.75 3bqb s ASP 163 Ca -0.00 -0.84 -0.15 0.00 0.43 0.00 0.00 52.55 51.98 3bqb s ASP 163 Cb -0.07 -2.00 0.19 0.00 -0.30 0.00 0.00 42.92 40.74 3bqb s ASP 163 CO 0.00 -0.31 1.08 -0.62 -0.17 0.00 0.00 175.17 175.15 3bqb s ASP 164 N 1.56 6.86 -0.05 -0.34 2.15 -0.47 -2.25 116.67 124.13 3bqb s ASP 164 Ca 0.03 -2.66 -0.30 0.00 0.43 0.00 0.00 52.55 50.05 3bqb s ASP 164 Cb -0.18 -2.31 -0.05 0.00 -0.30 0.00 0.00 42.92 40.08 3bqb s ASP 164 CO 0.06 -0.74 1.41 -0.69 -0.17 0.00 0.00 175.17 175.05 3bqb s VAL 165 N 1.12 3.83 -0.14 1.11 1.01 -0.87 -2.74 120.40 123.71 3bqb s VAL 165 Ca 0.30 1.13 0.00 0.00 0.00 0.00 0.00 61.98 63.41 3bqb s VAL 165 Cb -0.07 -3.73 0.03 0.00 0.00 0.00 0.00 36.38 32.61 3bqb s VAL 165 CO -0.07 -0.04 -0.11 -0.44 0.00 0.00 0.00 175.10 174.44 3bqb s SER 166 N 2.18 2.56 -1.17 3.32 0.01 -0.33 -4.66 113.70 115.60 3bqb s SER 166 Ca 0.63 -0.46 -0.21 0.00 1.31 0.00 0.00 55.95 57.23 3bqb s SER 166 Cb -0.29 -1.04 0.02 0.00 0.21 0.00 0.00 66.02 64.92 3bqb s SER 166 CO 0.24 -0.09 1.73 0.00 0.41 0.00 0.00 173.24 175.53 3bqb s ALA 167 N 1.57 2.72 0.40 1.44 0.00 -0.98 -1.04 121.76 125.87 3bqb s ALA 167 Ca 0.04 -2.48 0.17 0.00 0.00 0.00 0.00 51.96 49.69 3bqb s ALA 167 Cb -0.13 -4.62 1.00 0.00 0.00 0.00 0.00 23.12 19.37 3bqb s ALA 167 CO -0.09 -3.90 1.95 0.00 0.00 0.00 0.00 175.76 173.71 3bqb h ARG 168 N 8.88 0.00 -0.55 0.00 2.47 -1.62 -2.44 114.38 121.11 3bqb h ARG 168 Ca 0.31 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 59.00 3bqb h ARG 168 Cb 0.93 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.22 3bqb h ARG 168 CO 1.38 0.24 0.24 0.38 0.56 0.00 0.00 179.97 182.77 3bqb h ASP 169 N 0.00 0.75 -0.76 7.04 2.03 -1.86 -0.32 116.42 123.30 3bqb h ASP 169 Ca -0.00 -0.15 -0.03 0.00 -0.73 0.00 0.00 57.03 56.11 3bqb h ASP 169 Cb 0.46 -0.19 -0.03 0.00 -0.83 0.00 0.00 39.33 38.73 3bqb h ASP 169 CO 0.03 0.70 0.34 -0.07 -1.03 0.00 0.00 179.24 179.21 3bqb h LEU 170 N 0.75 1.01 -1.28 0.15 3.38 -1.77 -0.96 115.31 116.59 3bqb h LEU 170 Ca 0.19 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 3bqb h LEU 170 Cb 0.17 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3bqb h LEU 170 CO -0.02 0.88 -0.08 -0.08 0.09 0.00 0.00 178.44 179.22 3bqb h GLU 171 N 1.07 0.39 -0.12 1.13 4.81 -1.39 -2.94 114.58 117.53 3bqb h GLU 171 Ca 0.26 -0.09 -0.05 0.00 -0.13 0.00 0.00 59.36 59.35 3bqb h GLU 171 Cb 0.15 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.48 3bqb h GLU 171 CO -0.03 0.49 -0.11 0.00 -0.73 0.00 0.00 179.01 178.63 3bqb h ALA 172 N 1.55 0.17 -0.68 2.92 0.00 -0.49 -3.21 119.26 119.53 3bqb h ALA 172 Ca 0.08 -0.30 0.14 0.00 0.00 0.00 0.00 54.91 54.83 3bqb h ALA 172 Cb 0.38 -0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.02 3bqb h ALA 172 CO 0.02 0.02 0.07 0.93 0.00 0.00 0.00 179.25 180.29 3bqb h GLU 173 N -0.10 0.17 -1.88 0.00 5.08 -1.11 -3.44 114.58 113.30 3bqb h GLU 173 Ca 0.02 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.42 3bqb h GLU 173 Cb 0.62 -0.04 -0.22 0.00 0.50 0.00 0.00 28.75 29.61 3bqb h GLU 173 CO 0.03 0.11 0.09 1.21 -1.00 0.00 0.00 179.01 179.45 3bqb s ASN 174 N -5.23 -0.87 0.63 1.42 3.84 -1.12 -5.02 114.94 108.59 3bqb s ASN 174 Ca -0.13 1.36 0.41 0.00 0.21 0.00 0.00 52.86 54.71 3bqb s ASN 174 Cb 0.20 1.44 2.25 0.00 -0.55 0.00 0.00 41.25 44.59 3bqb s ASN 174 CO 0.75 -0.21 2.27 1.55 -2.79 0.00 0.00 177.10 178.66 3bqb h PRO 175 N 6.91 0.00 0.00 0.43 0.13 -1.84 -1.14 132.00 136.49 3bqb h PRO 175 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3bqb h PRO 175 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3bqb h PRO 175 CO 0.16 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.21 3bqb n LEU 176 N -2.97 0.11 -0.34 1.56 4.77 -1.26 -1.94 117.00 116.93 3bqb n LEU 176 Ca -0.03 0.52 0.14 0.00 -0.03 0.00 0.00 56.01 56.62 3bqb n LEU 176 Cb 0.09 -0.49 0.61 0.00 -2.33 0.00 0.00 43.42 41.30 3bqb n LEU 176 CO 0.18 -0.18 0.91 -1.22 -1.33 0.00 0.00 177.39 175.76 3bqb n TYR 177 N -1.62 0.00 -0.23 -1.77 4.01 -0.43 -4.47 117.16 112.65 3bqb n TYR 177 Ca 0.05 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.80 3bqb n TYR 177 Cb 0.26 -0.02 0.09 0.00 -0.31 0.00 0.00 39.34 39.36 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 1.67 -0.52 -1.02 7.72 5.85 -1.52 -0.37 115.31 127.12 3bqb h LEU 178 Ca 0.00 0.19 0.03 0.00 0.84 0.00 0.00 57.88 58.94 3bqb h LEU 178 Cb 0.38 0.38 -0.06 0.00 0.37 0.00 0.00 40.66 41.74 3bqb h LEU 178 CO 0.00 -0.20 0.66 -0.65 -0.34 0.00 0.00 178.44 177.91 3bqb h PRO 179 N 0.03 1.26 -0.12 5.25 0.11 -1.84 -0.77 132.00 135.93 3bqb h PRO 179 Ca 0.34 -0.08 -0.07 0.00 0.11 0.00 0.00 66.00 66.30 3bqb h PRO 179 Cb 0.55 -0.28 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 3bqb h PRO 179 CO -0.67 0.83 -0.26 1.96 -0.21 0.00 0.00 178.00 179.66 3bqb h GLN 180 N 1.30 0.22 -0.01 1.05 4.20 -1.42 -0.59 115.11 119.86 3bqb h GLN 180 Ca 0.39 -0.07 -0.16 0.00 0.06 0.00 0.00 58.65 58.86 3bqb h GLN 180 Cb -0.05 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 3bqb h GLN 180 CO -0.11 0.47 -0.76 0.66 -0.67 0.00 0.00 178.83 178.43 3bqb h SER 181 N 0.20 0.08 0.19 1.46 4.64 -0.27 -3.36 113.55 116.49 3bqb h SER 181 Ca 0.03 -0.06 -0.26 0.00 -0.47 0.00 0.00 61.79 61.03 3bqb h SER 181 Cb 0.58 -0.02 -0.05 0.00 -0.31 0.00 0.00 62.40 62.59 3bqb h SER 181 CO 0.04 0.80 -2.06 0.29 -0.87 0.00 0.00 176.83 175.03 3bqb n LYS 182 N -3.68 0.66 -3.96 4.77 4.76 -0.38 -2.31 118.16 118.03 3bqb n LYS 182 Ca -0.02 0.04 -0.33 0.00 -2.87 0.00 0.00 58.31 55.14 3bqb n LYS 182 Cb 0.73 -1.61 -0.14 0.00 -1.84 0.00 0.00 35.03 32.17 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 -2.75 2.62 0.18 -0.18 1.01 -0.24 -4.83 121.20 117.01 3bqb s ILE 183 Ca -0.08 -1.93 -0.24 0.00 0.00 0.00 0.00 60.65 58.40 3bqb s ILE 183 Cb 0.08 -2.73 0.06 0.00 0.01 0.00 0.00 42.46 39.89 3bqb s ILE 183 CO 0.84 -0.39 0.96 -0.72 0.00 0.00 0.00 174.94 175.62 3bqb s TYR 184 N 1.07 -0.08 0.05 3.97 -0.85 -1.26 -4.74 117.35 115.51 3bqb s TYR 184 Ca 0.03 -0.28 -0.32 0.00 -0.52 0.00 0.00 57.07 55.98 3bqb s TYR 184 Cb -0.20 0.67 -0.11 0.00 0.38 0.00 0.00 41.96 42.70 3bqb s TYR 184 CO -0.05 -0.91 1.88 0.00 -1.52 0.00 0.00 175.55 174.95 3bqb n ALA 185 N -0.52 1.62 -1.69 9.51 0.00 -1.26 -1.82 120.51 126.35 3bqb n ALA 185 Ca -0.05 0.28 -0.07 0.00 0.00 0.00 0.00 53.44 53.59 3bqb n ALA 185 Cb 0.60 -2.59 -0.02 0.00 0.00 0.00 0.00 19.45 17.45 3bqb n ALA 185 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3bqb n GLY 186 N 4.33 0.50 0.24 0.00 0.00 -1.08 -4.49 105.19 104.69 3bqb n GLY 186 Ca 0.20 -0.64 0.15 0.00 0.00 0.00 0.00 46.02 45.72 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 0.02 -0.67 0.22 0.00 0.00 -0.96 -1.07 121.76 119.30 3bqb s ALA 189 Ca -0.02 0.99 -0.07 0.00 0.00 0.00 0.00 51.96 52.87 3bqb s ALA 189 Cb -0.03 -0.61 -0.02 0.00 0.00 0.00 0.00 23.12 22.46 3bqb s ALA 189 CO 0.01 -0.18 0.29 -0.59 0.00 0.00 0.00 175.76 175.29 3bqb s PHE 190 N 0.86 0.77 0.00 0.00 -0.12 -0.99 0.40 117.98 118.91 3bqb s PHE 190 Ca -0.06 -1.06 0.00 0.00 -0.05 0.00 0.00 56.93 55.76 3bqb s PHE 190 Cb -0.07 -0.21 0.00 0.00 -0.63 0.00 0.00 43.02 42.11 3bqb s PHE 190 CO -0.06 -0.80 0.00 0.41 -0.05 0.00 0.00 175.22 174.73 3bqb n GLY 191 N -0.31 0.35 0.30 1.99 0.00 -0.95 -3.99 105.19 102.58 3bqb n GLY 191 Ca -0.00 -2.18 0.19 0.00 0.00 0.00 0.00 46.02 44.03 3bqb n GLY 191 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3bqb h PRO 192 N 0.00 0.00 -5.10 1.61 0.13 -1.88 -3.12 132.00 123.64 3bqb h PRO 192 Ca 0.00 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.75 3bqb h PRO 192 Cb 0.00 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 30.99 3bqb h PRO 192 CO 0.00 0.00 -0.67 0.14 -0.23 0.00 0.00 178.00 177.24 3bqb s VAL 193 N -3.80 1.09 -0.29 1.56 -7.23 -1.26 -4.56 120.40 105.91 3bqb s VAL 193 Ca -0.01 -2.04 -0.07 0.00 -1.81 0.00 0.00 61.98 58.05 3bqb s VAL 193 Cb 0.10 -2.26 0.00 0.00 0.56 0.00 0.00 36.38 34.78 3bqb s VAL 193 CO 0.51 -0.40 0.07 -0.63 -0.31 0.00 0.00 175.10 174.34 3bqb s ILE 194 N -3.38 3.97 -0.01 -0.62 1.01 0.45 -4.48 121.20 118.13 3bqb s ILE 194 Ca 0.26 -0.63 -0.17 0.00 0.00 0.00 0.00 60.65 60.12 3bqb s ILE 194 Cb 0.05 -3.02 -0.06 0.00 0.01 0.00 0.00 42.46 39.45 3bqb s ILE 194 CO 0.07 0.12 0.47 0.68 0.00 0.00 0.00 174.94 176.29 3bqb s VAL 195 N 1.51 4.99 0.78 2.92 -7.23 0.16 0.13 120.40 123.66 3bqb s VAL 195 Ca 0.03 0.98 -0.12 0.00 -1.81 0.00 0.00 61.98 61.06 3bqb s VAL 195 Cb -0.17 -3.79 0.06 0.00 0.56 0.00 0.00 36.38 33.04 3bqb s VAL 195 CO 0.02 0.50 1.12 0.42 -0.31 0.00 0.00 175.10 176.86 3bqb s THR 196 N -0.60 2.87 0.21 5.32 -4.23 -0.03 -0.39 115.64 118.79 3bqb s THR 196 Ca 0.26 0.32 -0.09 0.00 -1.18 0.00 0.00 61.69 61.00 3bqb s THR 196 Cb -0.17 -2.72 0.17 0.00 1.34 0.00 0.00 72.50 71.12 3bqb s THR 196 CO 0.14 -0.33 1.70 -1.28 -0.54 0.00 0.00 174.62 174.32 3bqb h SER 197 N -0.95 0.00 0.12 3.99 0.87 -1.87 -0.41 113.55 115.30 3bqb h SER 197 Ca -0.45 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.23 3bqb h SER 197 Cb 1.25 0.16 0.00 0.00 -0.44 0.00 0.00 62.40 63.37 3bqb h SER 197 CO 0.49 0.01 0.00 -0.90 -0.53 0.00 0.00 176.83 175.90 3bqb n ASP 198 N -5.13 0.39 0.04 6.23 3.85 -1.26 -1.46 116.55 119.21 3bqb n ASP 198 Ca 0.09 0.67 0.11 0.00 -0.71 0.00 0.00 54.79 54.96 3bqb n ASP 198 Cb 0.34 -0.72 0.47 0.00 -1.35 0.00 0.00 41.12 39.85 3bqb n ASP 198 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 3bqb n GLU 199 N -2.01 0.08 -3.76 0.11 -0.58 -0.16 -4.55 120.64 109.76 3bqb n GLU 199 Ca -0.00 0.18 -0.29 0.00 -0.42 0.00 0.00 57.16 56.62 3bqb n GLU 199 Cb 0.06 -1.62 -0.15 0.00 -0.57 0.00 0.00 31.44 29.15 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 -3.07 0.88 0.07 -3.67 1.01 -0.54 -4.98 121.20 110.90 3bqb s ILE 200 Ca 0.10 -1.17 -0.17 0.00 0.00 0.00 0.00 60.65 59.41 3bqb s ILE 200 Cb 0.13 -1.53 -0.11 0.00 0.01 0.00 0.00 42.46 40.97 3bqb s ILE 200 CO 0.44 -0.48 1.38 0.11 0.00 0.00 0.00 174.94 176.39 3bqb h LYS 201 N 8.11 0.56 -4.11 2.79 1.79 -1.80 -3.40 116.57 120.52 3bqb h LYS 201 Ca -0.15 -0.31 -0.61 0.00 -2.18 0.00 0.00 60.65 57.41 3bqb h LYS 201 Cb 1.05 0.02 -0.39 0.00 -1.58 0.00 0.00 32.23 31.32 3bqb h LYS 201 CO 0.43 0.90 -0.76 1.21 -1.08 0.00 0.00 179.45 180.15 3bqb s ASN 202 N -6.40 4.09 0.55 0.86 2.47 -1.26 -4.99 114.94 110.25 3bqb s ASN 202 Ca -0.13 -1.56 0.36 0.00 0.42 0.00 0.00 52.86 51.95 3bqb s ASN 202 Cb 0.07 -1.14 1.74 0.00 -1.45 0.00 0.00 41.25 40.47 3bqb s ASN 202 CO 0.80 -0.34 2.08 1.55 -3.72 0.00 0.00 177.10 177.48 3bqb h PRO 203 N 7.93 0.00 -1.02 0.43 0.13 -1.99 -2.73 132.00 134.76 3bqb h PRO 203 Ca -0.13 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.66 3bqb h PRO 203 Cb 1.04 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 31.97 3bqb h PRO 203 CO 0.46 0.00 0.43 0.66 -0.23 0.00 0.00 178.00 179.32 3bqb n TYR 204 N -2.92 1.98 -2.74 1.56 4.02 -1.26 -4.19 117.16 113.61 3bqb n TYR 204 Ca -0.01 -1.41 -0.00 0.00 -0.01 0.00 0.00 57.90 56.47 3bqb n TYR 204 Cb 0.18 -0.72 0.06 0.00 -0.02 0.00 0.00 39.34 38.84 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 -0.54 0.72 -4.38 7.72 2.88 -1.03 -1.58 113.62 117.41 3bqb n SER 205 Ca 0.39 -2.06 -0.31 0.00 -1.33 0.00 0.00 58.87 55.55 3bqb n SER 205 Cb 1.23 -0.16 -0.14 0.00 -0.75 0.00 0.00 64.21 64.38 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 -3.41 2.33 -0.19 2.46 1.43 -1.26 -4.90 118.68 115.14 3bqb s LEU 206 Ca 0.23 -0.42 -0.20 0.00 -1.03 0.00 0.00 54.13 52.70 3bqb s LEU 206 Cb 0.35 -1.41 -0.03 0.00 0.03 0.00 0.00 46.19 45.13 3bqb s LEU 206 CO -0.07 0.30 0.58 -1.81 0.23 0.00 0.00 176.35 175.58 3bqb s ASP 207 N -0.91 6.65 -0.16 2.29 1.01 -1.26 -0.98 116.67 123.30 3bqb s ASP 207 Ca 0.12 0.78 -0.06 0.00 0.71 0.00 0.00 52.55 54.10 3bqb s ASP 207 Cb -0.10 -2.33 -0.04 0.00 1.01 0.00 0.00 42.92 41.47 3bqb s ASP 207 CO 0.01 -0.22 0.04 -0.63 0.21 0.00 0.00 175.17 174.58 3bqb s ILE 208 N 1.70 4.58 -0.03 0.77 1.01 0.67 -2.23 121.20 127.67 3bqb s ILE 208 Ca 0.27 -0.12 0.02 0.00 0.00 0.00 0.00 60.65 60.82 3bqb s ILE 208 Cb -0.16 -3.03 0.01 0.00 0.01 0.00 0.00 42.46 39.29 3bqb s ILE 208 CO 0.10 0.49 -0.07 -0.89 0.00 0.00 0.00 174.94 174.57 3bqb s THR 209 N 0.18 0.66 -0.09 2.92 2.01 0.28 -0.80 115.64 120.81 3bqb s THR 209 Ca 0.03 -0.25 0.03 0.00 0.31 0.00 0.00 61.69 61.80 3bqb s THR 209 Cb -0.13 -0.63 -0.02 0.00 0.01 0.00 0.00 72.50 71.74 3bqb s THR 209 CO 0.01 0.23 -0.16 -0.22 -0.69 0.00 0.00 174.62 173.79 3bqb s LEU 210 N 0.51 2.56 -0.07 4.42 2.96 0.04 -1.00 118.68 128.10 3bqb s LEU 210 Ca -0.07 -0.33 0.01 0.00 -0.22 0.00 0.00 54.13 53.51 3bqb s LEU 210 Cb -0.11 -1.53 0.02 0.00 0.50 0.00 0.00 46.19 45.07 3bqb s LEU 210 CO 0.01 0.24 -0.07 -0.54 -1.32 0.00 0.00 176.35 174.67 3bqb s LYS 211 N -0.11 1.18 -0.20 1.98 1.02 -0.13 -2.09 119.74 121.39 3bqb s LYS 211 Ca -0.03 -0.19 -0.05 0.00 0.02 0.00 0.00 55.97 55.72 3bqb s LYS 211 Cb -0.14 -1.17 -0.03 0.00 -0.52 0.00 0.00 37.83 35.97 3bqb s LYS 211 CO 0.04 -0.12 0.01 0.42 -0.92 0.00 0.00 175.35 174.77 3bqb s ILE 212 N 1.17 4.00 -0.15 2.17 1.01 -0.64 -0.94 121.20 127.82 3bqb s ILE 212 Ca -0.06 -0.30 -0.00 0.00 0.00 0.00 0.00 60.65 60.29 3bqb s ILE 212 Cb -0.14 -2.81 -0.01 0.00 0.01 0.00 0.00 42.46 39.51 3bqb s ILE 212 CO -0.02 0.43 -0.13 -0.69 0.00 0.00 0.00 174.94 174.53 3bqb s VAL 213 N 1.00 2.89 -0.25 2.92 1.01 0.02 0.48 120.40 128.46 3bqb s VAL 213 Ca 0.02 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.31 3bqb s VAL 213 Cb -0.14 -2.22 0.07 0.00 0.00 0.00 0.00 36.38 34.08 3bqb s VAL 213 CO 0.02 0.51 -0.05 -0.60 0.00 0.00 0.00 175.10 174.98 3bqb s ARG 214 N 0.66 1.67 -1.29 2.72 3.52 0.89 -1.45 118.95 125.67 3bqb s ARG 214 Ca -0.07 -1.14 -0.04 0.00 -0.13 0.00 0.00 55.73 54.35 3bqb s ARG 214 Cb -0.16 -2.67 0.01 0.00 -1.56 0.00 0.00 34.95 30.58 3bqb s ARG 214 CO 0.02 -0.65 1.07 0.39 -0.81 0.00 0.00 175.30 175.32 3bqb n GLU 215 N 4.60 -7.10 0.00 5.12 1.02 -1.26 -2.44 120.64 120.58 3bqb n GLU 215 Ca -0.10 0.82 0.00 0.00 -0.02 0.00 0.00 57.16 57.86 3bqb n GLU 215 Cb 0.43 -5.83 0.00 0.00 -0.02 0.00 0.00 31.44 26.02 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 -1.56 1.91 3.74 0.62 0.00 -1.26 -4.98 105.19 103.65 3bqb n GLY 216 Ca -0.15 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 3bqb n GLY 216 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3bqb s ARG 217 N 0.00 4.51 -0.56 1.61 3.00 -1.02 -4.98 118.95 121.51 3bqb s ARG 217 Ca 0.00 1.82 -0.28 0.00 -1.00 0.00 0.00 55.73 56.27 3bqb s ARG 217 Cb 0.00 -3.26 0.01 0.00 0.00 0.00 0.00 34.95 31.70 3bqb s ARG 217 CO 0.00 -0.06 1.46 0.08 0.00 0.00 0.00 175.30 176.78 3bqb s VAL 218 N 0.00 3.74 0.04 7.11 1.01 -1.26 -0.07 120.40 130.97 3bqb s VAL 218 Ca 0.52 0.62 -0.17 0.00 0.00 0.00 0.00 61.98 62.96 3bqb s VAL 218 Cb -0.31 -4.39 -0.26 0.00 0.00 0.00 0.00 36.38 31.42 3bqb s VAL 218 CO 0.35 -1.15 1.11 0.15 0.00 0.00 0.00 175.10 175.57 3bqb h PHE 219 N 11.37 0.87 -4.03 5.22 -0.00 -0.30 -3.46 116.94 126.61 3bqb h PHE 219 Ca -0.27 -0.50 -0.15 0.00 -0.00 0.00 0.00 57.97 57.04 3bqb h PHE 219 Cb 1.10 -0.09 -0.19 0.00 -0.00 0.00 0.00 35.95 36.77 3bqb h PHE 219 CO 1.04 1.34 -0.68 0.12 -0.00 0.00 0.00 178.31 180.13 3bqb s PHE 220 N -3.12 0.32 -0.09 0.41 5.36 -0.77 -4.97 117.98 115.12 3bqb s PHE 220 Ca -0.11 -0.67 -0.18 0.00 -0.96 0.00 0.00 56.93 55.01 3bqb s PHE 220 Cb 0.05 -0.24 0.04 0.00 -0.34 0.00 0.00 43.02 42.53 3bqb s PHE 220 CO 0.89 -0.26 0.44 -2.00 -1.46 0.00 0.00 175.22 172.83 3bqb s GLU 221 N -2.21 0.68 0.05 10.12 2.12 -1.26 -1.62 118.70 126.57 3bqb s GLU 221 Ca -0.09 0.24 -0.27 0.00 0.36 0.00 0.00 54.97 55.21 3bqb s GLU 221 Cb -0.04 0.32 0.09 0.00 0.26 0.00 0.00 34.13 34.75 3bqb s GLU 221 CO -0.04 -0.16 0.91 0.20 -0.54 0.00 0.00 175.26 175.64 3bqb s GLY 222 N -0.63 -0.39 0.23 -1.50 0.00 -0.89 -5.02 107.32 99.12 3bqb s GLY 222 Ca -0.07 0.69 -0.10 0.00 0.00 0.00 0.00 44.72 45.24 3bqb s GLY 222 CO 0.04 0.21 0.38 -1.35 0.00 0.00 0.00 173.10 172.38 3bqb s SER 223 N -2.65 -0.03 -0.14 1.64 1.04 -1.26 -0.78 113.70 111.52 3bqb s SER 223 Ca 0.07 -1.01 -0.30 0.00 0.48 0.00 0.00 55.95 55.20 3bqb s SER 223 Cb -0.01 0.52 0.11 0.00 0.10 0.00 0.00 66.02 66.74 3bqb s SER 223 CO -0.05 -1.04 0.88 0.54 0.98 0.00 0.00 173.24 174.55 3bqb s VAL 224 N -4.04 0.00 0.06 5.02 0.11 0.02 -4.94 120.40 116.63 3bqb s VAL 224 Ca 0.25 0.00 -0.03 0.00 -2.93 0.00 0.00 61.98 59.26 3bqb s VAL 224 Cb 0.01 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.82 3bqb s VAL 224 CO 0.08 0.00 0.26 0.21 -3.33 0.00 0.00 175.10 172.33 3bqb s ASN 225 N -0.96 6.43 0.00 3.54 3.84 -1.26 -0.23 114.94 126.29 3bqb s ASN 225 Ca -0.04 0.44 0.24 0.00 0.21 0.00 0.00 52.86 53.70 3bqb s ASN 225 Cb -0.01 -2.03 1.21 0.00 -0.55 0.00 0.00 41.25 39.87 3bqb s ASN 225 CO 0.04 0.18 1.78 0.35 -2.79 0.00 0.00 177.10 176.65 3bqb n THR 226 N 0.55 0.24 0.30 -5.21 -2.24 -0.15 -1.94 114.28 105.83 3bqb n THR 226 Ca -0.07 0.06 0.10 0.00 -2.27 0.00 0.00 64.05 61.87 3bqb n THR 226 Cb 0.52 -0.67 0.44 0.00 -2.10 0.00 0.00 70.33 68.52 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 -1.27 0.46 -0.08 3.42 0.23 -0.61 -1.90 115.26 115.51 3bqb n ASN 227 Ca 0.12 0.65 0.14 0.00 -0.53 0.00 0.00 54.58 54.96 3bqb n ASN 227 Cb 0.18 -0.73 0.62 0.00 -2.08 0.00 0.00 39.78 37.77 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 0.55 -2.42 -3.83 4.76 -0.82 -4.89 118.16 109.46 3bqb n LYS 228 Ca 0.01 -0.16 -0.42 0.00 -2.87 0.00 0.00 58.31 54.87 3bqb n LYS 228 Cb 0.14 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 31.80 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 -2.56 4.41 -0.28 1.97 1.75 -0.80 -1.08 119.30 122.73 3bqb s MET 229 Ca 0.27 1.76 -0.14 0.00 -1.25 0.00 0.00 55.69 56.32 3bqb s MET 229 Cb 0.20 -3.39 -0.12 0.00 2.84 0.00 0.00 34.83 34.35 3bqb s MET 229 CO 0.49 -0.30 -0.34 0.54 -0.65 0.00 0.00 175.02 174.76 3bqb n ARG 230 N 4.20 0.59 -2.26 4.11 5.12 0.12 -4.79 116.66 123.75 3bqb n ARG 230 Ca 0.09 0.27 -0.35 0.00 -1.93 0.00 0.00 57.85 55.93 3bqb n ARG 230 Cb 0.46 -1.50 -0.04 0.00 -1.16 0.00 0.00 32.46 30.23 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 2.94 0.60 5.56 6.06 0.25 -4.97 118.95 126.89 3bqb s ARG 231 Ca -0.38 -0.28 -0.18 0.00 -2.50 0.00 0.00 55.73 52.38 3bqb s ARG 231 Cb 0.14 -4.83 -0.03 0.00 0.06 0.00 0.00 34.95 30.29 3bqb s ARG 231 CO 0.49 -2.73 1.18 -1.59 -2.50 0.00 0.00 175.30 170.16 3bqb s LYS 232 N 6.29 2.96 0.24 5.12 -2.85 -1.26 -4.82 119.74 125.42 3bqb s LYS 232 Ca 0.57 1.73 -0.06 0.00 -1.00 0.00 0.00 55.97 57.21 3bqb s LYS 232 Cb -0.07 -1.94 0.23 0.00 -2.06 0.00 0.00 37.83 33.99 3bqb s LYS 232 CO 0.05 -1.19 1.83 0.82 0.10 0.00 0.00 175.35 176.95 3bqb h ILE 233 N 0.76 1.25 -0.90 3.79 2.04 -1.97 -1.81 117.51 120.68 3bqb h ILE 233 Ca -0.50 -0.72 0.11 0.00 1.00 0.00 0.00 64.86 64.76 3bqb h ILE 233 Cb 1.29 0.21 -0.08 0.00 -0.74 0.00 0.00 36.82 37.49 3bqb h ILE 233 CO 0.55 0.31 0.53 -0.08 0.00 0.00 0.00 178.15 179.46 3bqb h GLU 234 N 1.17 0.82 -0.25 2.37 4.81 -2.00 -0.76 114.58 120.75 3bqb h GLU 234 Ca 0.28 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.40 3bqb h GLU 234 Cb 0.12 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 3bqb h GLU 234 CO -0.04 0.54 -0.08 1.49 -0.73 0.00 0.00 179.01 180.20 3bqb h GLU 235 N 0.84 0.49 -0.76 1.92 4.81 -1.71 -1.67 114.58 118.50 3bqb h GLU 235 Ca 0.45 -0.20 0.10 0.00 -0.13 0.00 0.00 59.36 59.58 3bqb h GLU 235 Cb 0.47 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.75 3bqb h GLU 235 CO -0.27 0.72 0.39 1.96 -0.73 0.00 0.00 179.01 181.08 3bqb h GLN 236 N 0.22 0.63 -0.32 1.92 4.20 -0.87 -2.06 115.11 118.83 3bqb h GLN 236 Ca 0.06 -0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.66 3bqb h GLN 236 Cb 0.56 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 3bqb h GLN 236 CO 0.03 0.42 -0.09 0.82 -0.67 0.00 0.00 178.83 179.34 3bqb h ILE 237 N 0.65 1.28 -0.55 2.54 2.04 -1.11 -1.69 117.51 120.67 3bqb h ILE 237 Ca 0.37 -1.15 0.11 0.00 1.00 0.00 0.00 64.86 65.19 3bqb h ILE 237 Cb 0.40 1.36 -0.08 0.00 -0.74 0.00 0.00 36.82 37.76 3bqb h ILE 237 CO -0.27 0.37 0.07 -0.61 0.00 0.00 0.00 178.15 177.70 3bqb h GLN 238 N 0.40 0.19 -0.01 2.37 4.15 -0.69 -1.48 115.11 120.04 3bqb h GLN 238 Ca 0.08 -0.01 -0.16 0.00 0.77 0.00 0.00 58.65 59.33 3bqb h GLN 238 Cb 0.59 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.22 3bqb h GLN 238 CO 0.03 0.12 -0.72 1.88 -1.93 0.00 0.00 178.83 178.22 3bqb h TYR 239 N 0.19 0.09 -0.33 3.99 -1.99 -1.36 -2.78 116.97 114.78 3bqb h TYR 239 Ca 0.29 -0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.98 3bqb h TYR 239 Cb 0.43 -0.01 -0.02 0.00 2.00 0.00 0.00 36.73 39.13 3bqb h TYR 239 CO -0.28 0.76 0.21 1.25 -0.00 0.00 0.00 178.16 180.09 3bqb h LEU 240 N 0.04 0.39 0.00 3.88 5.85 -0.39 -3.26 115.31 121.81 3bqb h LEU 240 Ca -0.01 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.67 3bqb h LEU 240 Cb 1.27 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.20 3bqb h LEU 240 CO 0.10 0.31 -0.68 2.30 -0.34 0.00 0.00 178.44 180.13 3bqb n ILE 241 N -4.84 0.03 -1.60 4.05 -5.35 -0.65 -4.60 119.36 106.41 3bqb n ILE 241 Ca -0.01 -0.03 -0.47 0.00 -0.27 0.00 0.00 62.75 61.97 3bqb n ILE 241 Cb 0.04 0.41 -0.05 0.00 -1.74 0.00 0.00 39.64 38.31 3bqb n ILE 241 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 3bqb n ARG 242 N -1.57 1.94 -1.24 6.28 0.63 -1.05 -1.32 116.66 120.33 3bqb n ARG 242 Ca 0.05 0.63 -0.11 0.00 -0.92 0.00 0.00 57.85 57.50 3bqb n ARG 242 Cb 0.35 -2.81 -0.05 0.00 0.45 0.00 0.00 32.46 30.40 3bqb n ARG 242 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3bqb n ASP 243 N 8.94 -4.51 -3.50 6.15 10.43 -1.26 -4.88 116.55 127.91 3bqb n ASP 243 Ca 0.29 0.27 -0.29 0.00 2.57 0.00 0.00 54.79 57.62 3bqb n ASP 243 Cb 0.34 -3.58 -0.12 0.00 1.84 0.00 0.00 41.12 39.60 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 -2.12 3.01 0.18 -2.24 2.47 -0.43 -5.11 114.94 110.70 3bqb s ASN 244 Ca 0.00 -2.31 -0.30 0.00 0.42 0.00 0.00 52.86 50.67 3bqb s ASN 244 Cb 0.00 -0.51 -0.08 0.00 -1.45 0.00 0.00 41.25 39.21 3bqb s ASN 244 CO 0.00 -0.29 1.16 -2.16 -3.72 0.00 0.00 177.10 172.09 3bqb s PRO 245 N 0.89 4.52 0.05 0.43 0.04 -1.26 -4.31 135.00 135.37 3bqb s PRO 245 Ca 0.19 1.82 0.06 0.00 0.04 0.00 0.00 61.00 63.11 3bqb s PRO 245 Cb -0.22 -3.26 -0.03 0.00 0.04 0.00 0.00 34.50 31.03 3bqb s PRO 245 CO -0.00 -0.04 -0.14 0.96 0.04 0.00 0.00 177.00 177.82 3bqb s ILE 246 N -0.09 3.12 0.63 0.56 -4.36 -1.26 -5.11 121.20 114.69 3bqb s ILE 246 Ca 0.52 -1.14 -0.15 0.00 -0.26 0.00 0.00 60.65 59.62 3bqb s ILE 246 Cb -0.31 -2.37 -0.02 0.00 1.25 0.00 0.00 42.46 41.00 3bqb s ILE 246 CO 0.36 0.28 1.07 -2.16 0.24 0.00 0.00 174.94 174.72 3bqb s PRO 247 N -1.68 3.14 0.29 0.37 0.04 -1.26 -4.13 135.00 131.78 3bqb s PRO 247 Ca 0.17 1.19 -0.30 0.00 0.04 0.00 0.00 61.00 62.10 3bqb s PRO 247 Cb -0.11 -2.01 -0.11 0.00 0.04 0.00 0.00 34.50 32.31 3bqb s PRO 247 CO 0.08 -0.95 1.59 -0.51 0.04 0.00 0.00 177.00 177.25 3bqb s ASP 248 N -2.93 6.37 0.00 6.66 1.01 -1.26 -2.37 116.67 124.15 3bqb s ASP 248 Ca 0.63 2.95 0.00 0.00 0.71 0.00 0.00 52.55 56.84 3bqb s ASP 248 Cb -0.16 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 41.13 3bqb s ASP 248 CO 0.41 -0.91 0.00 0.61 0.21 0.00 0.00 175.17 175.49 3bqb n GLY 249 N 2.12 0.75 3.77 0.21 0.00 0.31 -4.68 105.19 107.67 3bqb n GLY 249 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.59 2.08 -0.12 2.61 2.01 -1.00 -4.18 115.64 114.46 3bqb s THR 250 Ca 0.00 0.07 0.01 0.00 0.31 0.00 0.00 61.69 62.08 3bqb s THR 250 Cb 0.00 -3.04 -0.02 0.00 0.01 0.00 0.00 72.50 69.45 3bqb s THR 250 CO 0.00 0.01 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.17 3bqb s ILE 251 N -1.21 2.98 -0.30 1.82 1.01 -0.88 0.17 121.20 124.79 3bqb s ILE 251 Ca 0.61 -0.69 -0.05 0.00 0.00 0.00 0.00 60.65 60.52 3bqb s ILE 251 Cb -0.43 -2.24 0.03 0.00 0.01 0.00 0.00 42.46 39.83 3bqb s ILE 251 CO 0.56 0.53 0.04 -0.22 0.00 0.00 0.00 174.94 175.85 3bqb s LEU 252 N 0.23 3.84 -0.06 2.97 2.96 0.15 -1.46 118.68 127.31 3bqb s LEU 252 Ca -0.09 -0.96 -0.24 0.00 -0.22 0.00 0.00 54.13 52.62 3bqb s LEU 252 Cb -0.15 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.70 3bqb s LEU 252 CO 0.05 -0.23 0.71 0.28 -1.32 0.00 0.00 176.35 175.85 3bqb s THR 253 N 1.39 5.02 -1.69 3.68 -1.32 -0.06 -1.11 115.64 121.55 3bqb s THR 253 Ca -0.00 1.47 0.19 0.00 -1.21 0.00 0.00 61.69 62.14 3bqb s THR 253 Cb -0.18 -4.05 0.63 0.00 -1.51 0.00 0.00 72.50 67.39 3bqb s THR 253 CO 0.00 0.26 1.53 0.35 -2.21 0.00 0.00 174.62 174.55 3bqb n THR 254 N 3.68 1.21 0.00 5.08 -2.24 -0.27 -1.44 114.28 120.31 3bqb n THR 254 Ca -0.01 -0.98 0.00 0.00 -2.27 0.00 0.00 64.05 60.79 3bqb n THR 254 Cb 0.51 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 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 1.40 2.39 3.54 3.38 0.00 -1.06 -4.72 105.19 110.11 3bqb n GLY 255 Ca 0.23 -1.93 -0.24 0.00 0.00 0.00 0.00 46.02 44.08 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 -2.89 2.89 0.00 2.61 -1.32 -1.26 -4.38 115.64 111.30 3bqb s THR 256 Ca 0.00 -2.11 0.00 0.00 -1.21 0.00 0.00 61.69 58.37 3bqb s THR 256 Cb 0.00 -2.51 0.00 0.00 -1.51 0.00 0.00 72.50 68.48 3bqb s THR 256 CO 0.00 -0.33 0.00 0.00 -2.21 0.00 0.00 174.62 172.08 3bqb n ALA 257 N -0.55 1.62 -2.53 11.08 0.00 -1.26 -4.66 120.51 124.20 3bqb n ALA 257 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.94 3bqb n ALA 257 Cb 0.59 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.94 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 -0.99 5.24 -0.37 0.00 1.01 -1.26 -5.02 121.20 119.80 3bqb s ILE 258 Ca 0.00 -0.70 0.02 0.00 0.00 0.00 0.00 60.65 59.97 3bqb s ILE 258 Cb 0.00 -3.98 0.11 0.00 0.01 0.00 0.00 42.46 38.60 3bqb s ILE 258 CO 0.00 -0.37 0.11 -0.69 0.00 0.00 0.00 174.94 173.99 3bqb s VAL 259 N 1.72 1.81 0.94 2.92 1.01 -1.26 -4.64 120.40 122.90 3bqb s VAL 259 Ca 0.05 -2.23 -0.12 0.00 0.00 0.00 0.00 61.98 59.69 3bqb s VAL 259 Cb -0.20 -2.33 0.06 0.00 0.00 0.00 0.00 36.38 33.92 3bqb s VAL 259 CO 0.10 -0.68 0.56 -2.65 0.00 0.00 0.00 175.10 172.43 3bqb n PRO 260 N 4.19 -0.31 -1.85 2.72 -0.02 -1.26 -5.01 135.00 133.46 3bqb n PRO 260 Ca 0.03 -0.04 -0.29 0.00 -2.02 0.00 0.00 63.50 61.17 3bqb n PRO 260 Cb 0.40 -1.96 0.13 0.00 -0.02 0.00 0.00 33.50 32.05 3bqb n PRO 260 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3bqb s GLY 261 N -2.13 1.66 0.41 -1.23 0.00 -1.26 -4.90 107.32 99.87 3bqb s GLY 261 Ca 0.59 -0.84 0.11 0.00 0.00 0.00 0.00 44.72 44.57 3bqb s GLY 261 CO 0.65 -0.23 1.99 3.21 0.00 0.00 0.00 173.10 178.72 3bqb h ARG 262 N -1.36 0.50 0.00 2.90 2.47 -2.03 -0.69 114.38 116.17 3bqb h ARG 262 Ca -0.46 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 3bqb h ARG 262 Cb 1.30 -0.11 0.00 0.00 -1.65 0.00 0.00 29.97 29.50 3bqb h ARG 262 CO 0.55 0.33 0.00 -0.40 0.56 0.00 0.00 179.97 181.01 3bqb n ASP 263 N -4.48 0.28 -2.21 7.04 3.85 -1.26 -4.08 116.55 115.70 3bqb n ASP 263 Ca 0.09 0.54 -0.29 0.00 -0.71 0.00 0.00 54.79 54.42 3bqb n ASP 263 Cb 0.28 -0.61 0.10 0.00 -1.35 0.00 0.00 41.12 39.55 3bqb n ASP 263 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 3bqb n LYS 264 N -1.78 2.41 -2.31 0.11 4.76 -0.27 -4.99 118.16 116.09 3bqb n LYS 264 Ca 0.06 -2.91 -0.35 0.00 -2.87 0.00 0.00 58.31 52.24 3bqb n LYS 264 Cb 0.33 -2.14 -0.01 0.00 -1.84 0.00 0.00 35.03 31.37 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 -1.36 2.64 0.41 0.72 0.00 -1.26 -4.82 107.32 103.66 3bqb s GLY 265 Ca 0.57 0.80 -0.23 0.00 0.00 0.00 0.00 44.72 45.86 3bqb s GLY 265 CO 0.02 1.17 1.04 1.08 0.00 0.00 0.00 173.10 176.41 3bqb s LEU 266 N -3.62 4.10 0.23 0.66 1.02 -0.43 -4.94 118.68 115.69 3bqb s LEU 266 Ca 0.70 2.00 -0.06 0.00 0.02 0.00 0.00 54.13 56.80 3bqb s LEU 266 Cb -0.23 -4.25 -0.02 0.00 0.02 0.00 0.00 46.19 41.71 3bqb s LEU 266 CO 0.27 -0.51 0.30 -1.59 0.02 0.00 0.00 176.35 174.83 3bqb s LYS 267 N -2.61 1.39 0.53 1.70 -2.85 -1.26 -4.70 119.74 111.93 3bqb s LYS 267 Ca 0.59 -1.48 -0.22 0.00 -1.00 0.00 0.00 55.97 53.87 3bqb s LYS 267 Cb -0.21 0.37 -0.06 0.00 -2.06 0.00 0.00 37.83 35.87 3bqb s LYS 267 CO 0.26 -0.52 1.18 -3.47 0.10 0.00 0.00 175.35 172.89 3bqb n ASP 268 N -0.39 1.88 0.00 0.03 -0.08 -1.26 -2.29 116.55 114.45 3bqb n ASP 268 Ca 0.01 0.95 0.00 0.00 -1.51 0.00 0.00 54.79 54.24 3bqb n ASP 268 Cb 0.64 -1.48 0.00 0.00 2.34 0.00 0.00 41.12 42.62 3bqb n ASP 268 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 3bqb n GLU 269 N -0.71 0.00 -1.29 -0.67 -0.58 -1.06 -5.00 120.64 111.33 3bqb n GLU 269 Ca 0.11 0.00 -0.34 0.00 -0.42 0.00 0.00 57.16 56.50 3bqb n GLU 269 Cb 0.44 -1.61 0.11 0.00 -0.57 0.00 0.00 31.44 29.81 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 -3.05 3.87 -0.05 1.62 1.11 -0.97 -4.65 116.67 114.54 3bqb s ASP 270 Ca 0.00 2.43 0.05 0.00 0.18 0.00 0.00 52.55 55.21 3bqb s ASP 270 Cb 0.00 -2.60 -0.02 0.00 1.07 0.00 0.00 42.92 41.37 3bqb s ASP 270 CO 0.00 -2.49 -0.19 -0.63 1.18 0.00 0.00 175.17 173.04 3bqb s ILE 271 N -1.95 2.64 -0.21 0.77 -1.09 -0.53 0.23 121.20 121.06 3bqb s ILE 271 Ca 0.76 -0.87 0.02 0.00 -2.23 0.00 0.00 60.65 58.32 3bqb s ILE 271 Cb -0.31 -2.00 0.04 0.00 -1.58 0.00 0.00 42.46 38.61 3bqb s ILE 271 CO 0.48 0.58 -0.13 -0.69 -1.23 0.00 0.00 174.94 173.94 3bqb s VAL 272 N -0.48 1.93 -0.12 2.92 1.01 0.11 -0.80 120.40 124.96 3bqb s VAL 272 Ca 0.06 -1.20 -0.02 0.00 0.00 0.00 0.00 61.98 60.82 3bqb s VAL 272 Cb -0.12 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 3bqb s VAL 272 CO 0.01 0.20 -0.06 -1.61 0.00 0.00 0.00 175.10 173.64 3bqb s GLU 273 N 1.27 3.31 -0.04 2.72 2.02 -0.12 -1.06 118.70 126.80 3bqb s GLU 273 Ca -0.02 -0.55 0.02 0.00 0.02 0.00 0.00 54.97 54.44 3bqb s GLU 273 Cb -0.17 -2.76 0.01 0.00 0.10 0.00 0.00 34.13 31.31 3bqb s GLU 273 CO -0.08 0.39 -0.10 0.42 0.02 0.00 0.00 175.26 175.90 3bqb s ILE 274 N -0.05 0.95 -0.05 -1.63 1.01 0.96 -0.96 121.20 121.43 3bqb s ILE 274 Ca 0.00 -0.41 0.05 0.00 0.00 0.00 0.00 60.65 60.29 3bqb s ILE 274 Cb -0.13 -0.86 -0.00 0.00 0.01 0.00 0.00 42.46 41.47 3bqb s ILE 274 CO 0.03 0.30 -0.19 -0.89 0.00 0.00 0.00 174.94 174.19 3bqb s THR 275 N 0.46 1.55 0.00 2.92 2.01 -0.17 0.30 115.64 122.70 3bqb s THR 275 Ca -0.09 -0.78 0.04 0.00 0.31 0.00 0.00 61.69 61.17 3bqb s THR 275 Cb -0.13 -1.32 -0.01 0.00 0.01 0.00 0.00 72.50 71.05 3bqb s THR 275 CO 0.02 0.44 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.64 3bqb s ILE 276 N -0.00 0.96 0.34 1.82 1.01 -0.90 -0.56 121.20 123.87 3bqb s ILE 276 Ca -0.04 -0.61 -0.29 0.00 0.00 0.00 0.00 60.65 59.71 3bqb s ILE 276 Cb -0.12 -0.82 -0.11 0.00 0.01 0.00 0.00 42.46 41.43 3bqb s ILE 276 CO 0.02 0.20 1.46 -0.44 0.00 0.00 0.00 174.94 176.18 3bqb s SER 277 N -0.47 6.48 0.00 3.58 0.01 -0.95 -2.43 113.70 119.92 3bqb s SER 277 Ca 0.04 2.91 0.00 0.00 1.31 0.00 0.00 55.95 60.21 3bqb s SER 277 Cb -0.05 -2.65 0.00 0.00 0.21 0.00 0.00 66.02 63.52 3bqb s SER 277 CO -0.00 -0.78 0.00 0.59 0.41 0.00 0.00 173.24 173.45 3bqb n ASN 278 N 1.02 -1.04 0.00 2.44 3.02 -1.26 -4.76 115.26 114.68 3bqb n ASN 278 Ca 0.03 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.55 3bqb n ASN 278 Cb 0.40 -1.37 -0.01 0.00 -0.61 0.00 0.00 39.78 38.19 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 -2.12 0.54 0.00 2.41 5.41 -1.05 -4.96 119.36 119.59 3bqb n ILE 279 Ca 0.00 0.11 0.00 0.00 1.00 0.00 0.00 62.75 63.86 3bqb n ILE 279 Cb 0.06 -1.58 0.00 0.00 -0.71 0.00 0.00 39.64 37.40 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 3.00 0.66 2.83 7.39 0.00 -1.02 -4.74 105.19 113.31 3bqb n GLY 280 Ca -0.04 -1.53 -0.26 0.00 0.00 0.00 0.00 46.02 44.19 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 0.76 -0.06 2.61 2.01 -1.26 -2.12 115.64 113.58 3bqb s THR 281 Ca 0.00 -0.33 -0.21 0.00 0.31 0.00 0.00 61.69 61.46 3bqb s THR 281 Cb 0.00 -0.97 -0.04 0.00 0.01 0.00 0.00 72.50 71.50 3bqb s THR 281 CO 0.00 0.15 0.60 -0.22 -0.69 0.00 0.00 174.62 174.45 3bqb s LEU 282 N 1.79 4.33 -0.07 4.42 2.96 0.15 -4.58 118.68 127.68 3bqb s LEU 282 Ca 0.02 1.06 0.02 0.00 -0.22 0.00 0.00 54.13 55.01 3bqb s LEU 282 Cb -0.14 -2.91 0.02 0.00 0.50 0.00 0.00 46.19 43.66 3bqb s LEU 282 CO -0.07 -0.01 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.21 3bqb s ILE 283 N 0.44 1.09 -0.03 6.68 1.01 -1.26 -0.03 121.20 129.11 3bqb s ILE 283 Ca 0.32 -0.43 0.00 0.00 0.00 0.00 0.00 60.65 60.53 3bqb s ILE 283 Cb -0.17 -1.02 0.03 0.00 0.01 0.00 0.00 42.46 41.31 3bqb s ILE 283 CO 0.15 0.35 0.01 0.42 0.00 0.00 0.00 174.94 175.88 3bqb s THR 284 N 0.84 0.11 0.66 2.92 -4.23 -0.22 -0.44 115.64 115.27 3bqb s THR 284 Ca -0.11 0.14 -0.13 0.00 -1.18 0.00 0.00 61.69 60.41 3bqb s THR 284 Cb -0.15 -0.23 -0.01 0.00 1.34 0.00 0.00 72.50 73.45 3bqb s THR 284 CO 0.02 0.14 1.06 -2.16 -0.54 0.00 0.00 174.62 173.14 3bqb s PRO 285 N 1.15 3.01 0.03 3.99 0.04 -1.26 -0.71 135.00 141.25 3bqb s PRO 285 Ca -0.08 1.10 -0.00 0.00 0.04 0.00 0.00 61.00 62.06 3bqb s PRO 285 Cb -0.13 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 3bqb s PRO 285 CO -0.02 -1.05 0.15 0.08 0.04 0.00 0.00 177.00 176.20 3bqb s VAL 286 N -2.75 5.08 -0.07 -0.36 1.01 0.14 -1.67 120.40 121.77 3bqb s VAL 286 Ca 0.61 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.19 3bqb s VAL 286 Cb -0.15 -3.40 0.02 0.00 0.00 0.00 0.00 36.38 32.84 3bqb s VAL 286 CO 0.47 0.24 -0.06 -0.75 0.00 0.00 0.00 175.10 175.00 3bqb s LYS 287 N -2.13 1.15 -0.02 2.72 2.47 -0.35 -2.57 119.74 121.01 3bqb s LYS 287 Ca 0.29 -0.16 -0.22 0.00 -1.56 0.00 0.00 55.97 54.32 3bqb s LYS 287 Cb -0.12 -1.20 -0.05 0.00 -1.46 0.00 0.00 37.83 35.00 3bqb s LYS 287 CO 0.21 -0.17 0.64 0.21 0.16 0.00 0.00 175.35 176.40 3bqb s LYS 288 N 1.34 4.38 0.02 4.03 2.47 -1.26 -0.48 119.74 130.24 3bqb s LYS 288 Ca -0.03 0.81 -0.25 0.00 -1.56 0.00 0.00 55.97 54.93 3bqb s LYS 288 Cb -0.14 -3.38 -0.05 0.00 -1.46 0.00 0.00 37.83 32.81 3bqb s LYS 288 CO -0.03 0.26 0.78 1.03 0.16 0.00 0.00 175.35 177.55 3bqb s ARG 289 N 0.15 4.50 0.31 4.03 1.81 -0.83 -4.94 118.95 123.97 3bqb s ARG 289 Ca 0.34 1.08 -0.16 0.00 -1.72 0.00 0.00 55.73 55.26 3bqb s ARG 289 Cb -0.18 -3.39 -0.09 0.00 -0.45 0.00 0.00 34.95 30.84 3bqb s ARG 289 CO 0.18 0.20 0.74 0.50 -0.68 0.00 0.00 175.30 176.24 3bqb s ARG 290 N 0.23 4.06 0.00 3.54 3.52 -1.26 -3.94 118.95 125.10 3bqb s ARG 290 Ca 0.40 0.72 0.30 0.00 -0.13 0.00 0.00 55.73 57.02 3bqb s ARG 290 Cb -0.20 -2.51 1.40 0.00 -1.56 0.00 0.00 34.95 32.08 3bqb s ARG 290 CO 0.23 0.19 1.94 1.63 -0.81 0.00 0.00 175.30 178.48