#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbe n ARG 3 N 0.00 -2.27 -4.98 1.43 1.74 -1.26 -4.90 116.66 106.42 2qbe n ARG 3 Ca 0.00 0.55 -0.28 0.00 -0.77 0.00 0.00 57.85 57.35 2qbe n ARG 3 Cb 0.00 -4.65 -0.16 0.00 -1.02 0.00 0.00 32.46 26.62 2qbe n ARG 3 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2qbe s VAL 4 N -3.53 1.65 0.57 1.55 -7.23 -1.26 -4.30 120.40 107.85 2qbe s VAL 4 Ca 0.35 -0.83 0.33 0.00 -1.81 0.00 0.00 61.98 60.01 2qbe s VAL 4 Cb -0.11 -1.42 0.47 0.00 0.56 0.00 0.00 36.38 35.89 2qbe s VAL 4 CO 0.83 0.47 1.72 0.00 -0.31 0.00 0.00 175.10 177.81 2qbe n GLN 6 N -3.81 0.00 -0.08 0.00 7.27 -1.25 -3.81 117.38 115.70 2qbe n GLN 6 Ca 0.20 0.00 -0.08 0.00 0.07 0.00 0.00 57.00 57.19 2qbe n GLN 6 Cb 1.15 -0.83 -0.16 0.00 2.41 0.00 0.00 30.24 32.82 2qbe n GLN 6 CO 0.00 0.00 0.00 1.55 0.07 0.00 0.00 177.06 178.68 2qbe n VAL 7 N 0.00 1.33 -0.06 1.69 3.14 -1.26 -4.47 118.33 118.70 2qbe n VAL 7 Ca 0.00 -0.83 0.00 0.00 -2.96 0.00 0.00 64.34 60.55 2qbe n VAL 7 Cb 0.00 -0.52 0.00 0.00 -1.06 0.00 0.00 33.84 32.26 2qbe n VAL 7 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 2qbe n THR 8 N -2.76 0.16 -1.23 1.55 -2.24 -1.26 -5.00 114.28 103.50 2qbe n THR 8 Ca -0.28 -0.55 -0.08 0.00 -2.27 0.00 0.00 64.05 60.87 2qbe n THR 8 Cb 1.10 0.97 -0.03 0.00 -2.10 0.00 0.00 70.33 70.27 2qbe n THR 8 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qbe n GLY 9 N -0.08 0.89 3.67 3.38 0.00 -1.26 -4.93 105.19 106.86 2qbe n GLY 9 Ca 0.00 -0.22 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 2qbe n GLY 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qbe s LYS 10 N -2.36 4.15 0.46 1.61 1.02 -1.26 -4.67 119.74 118.68 2qbe s LYS 10 Ca 0.00 2.55 0.05 0.00 0.02 0.00 0.00 55.97 58.60 2qbe s LYS 10 Cb 0.00 -3.93 -0.04 0.00 -0.52 0.00 0.00 37.83 33.34 2qbe s LYS 10 CO 0.00 -0.90 0.11 1.03 -0.92 0.00 0.00 175.35 174.67 2qbe s ARG 11 N 3.77 2.14 -0.49 1.68 0.52 -1.26 -0.69 118.95 124.63 2qbe s ARG 11 Ca 0.84 -2.10 -0.28 0.00 -0.52 0.00 0.00 55.73 53.66 2qbe s ARG 11 Cb -0.43 -1.77 0.03 0.00 0.52 0.00 0.00 34.95 33.30 2qbe s ARG 11 CO 0.38 -0.23 1.11 -1.25 0.02 0.00 0.00 175.30 175.34 2qbe s PRO 12 N -3.89 3.68 0.65 3.54 0.04 -1.26 -4.44 135.00 133.32 2qbe s PRO 12 Ca 0.28 0.48 -0.09 0.00 0.04 0.00 0.00 61.00 61.71 2qbe s PRO 12 Cb 0.04 -3.92 0.01 0.00 0.04 0.00 0.00 34.50 30.67 2qbe s PRO 12 CO 0.15 -1.39 1.02 0.14 0.04 0.00 0.00 177.00 176.96 2qbe s VAL 13 N 4.41 3.67 -0.09 -0.36 -7.23 0.44 -4.82 120.40 116.41 2qbe s VAL 13 Ca 0.46 0.34 0.02 0.00 -1.81 0.00 0.00 61.98 60.99 2qbe s VAL 13 Cb -0.07 -3.51 -0.02 0.00 0.56 0.00 0.00 36.38 33.34 2qbe s VAL 13 CO 0.31 -0.62 -0.15 0.42 -0.31 0.00 0.00 175.10 174.75 2qbe s THR 14 N -3.21 2.96 0.00 5.32 -4.23 -1.26 1.00 115.64 116.22 2qbe s THR 14 Ca 0.56 -0.73 0.00 0.00 -1.18 0.00 0.00 61.69 60.34 2qbe s THR 14 Cb -0.11 -2.19 0.00 0.00 1.34 0.00 0.00 72.50 71.54 2qbe s THR 14 CO 0.49 0.56 0.00 0.61 -0.54 0.00 0.00 174.62 175.74 2qbe n GLY 15 N 2.93 5.38 3.15 3.99 0.00 -1.26 -4.81 105.19 114.57 2qbe n GLY 15 Ca -0.18 -1.20 -0.22 0.00 0.00 0.00 0.00 46.02 44.42 2qbe n GLY 15 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qbe s ASN 16 N 1.01 1.85 0.11 1.61 0.01 -1.26 -2.47 114.94 115.80 2qbe s ASN 16 Ca 0.00 -0.38 -0.14 0.00 -0.71 0.00 0.00 52.86 51.62 2qbe s ASN 16 Cb 0.00 -0.16 -0.06 0.00 0.41 0.00 0.00 41.25 41.44 2qbe s ASN 16 CO 0.00 0.12 1.48 0.78 -1.51 0.00 0.00 177.10 177.97 2qbe h ASN 17 N 5.30 0.77 -6.22 -1.22 2.35 -1.33 -3.45 115.58 111.77 2qbe h ASN 17 Ca -0.37 -0.42 -0.30 0.00 -0.55 0.00 0.00 56.30 54.66 2qbe h ASN 17 Cb 1.17 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 39.33 2qbe h ASN 17 CO 0.46 1.02 -0.77 -1.14 -1.65 0.00 0.00 177.43 175.35 2qbe n ARG 18 N -4.30 -1.63 -1.15 0.81 3.00 -0.99 -4.95 116.66 107.46 2qbe n ARG 18 Ca -0.02 1.19 -0.22 0.00 -0.00 0.00 0.00 57.85 58.79 2qbe n ARG 18 Cb 0.42 -3.47 0.17 0.00 0.00 0.00 0.00 32.46 29.57 2qbe n ARG 18 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2qbe n SER 19 N -1.79 -0.72 -4.43 6.15 3.41 -0.57 -4.71 113.62 110.97 2qbe n SER 19 Ca -0.16 -1.21 -0.31 0.00 -0.26 0.00 0.00 58.87 56.94 2qbe n SER 19 Cb 0.62 -0.75 0.19 0.00 -0.26 0.00 0.00 64.21 64.01 2qbe n SER 19 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2qbe n HIS 20 N -3.74 -1.02 -0.93 7.33 -0.00 -1.26 -1.55 115.22 114.04 2qbe n HIS 20 Ca 0.12 0.10 0.00 0.00 0.46 0.00 0.00 57.72 58.40 2qbe n HIS 20 Cb 0.43 -1.72 0.00 0.00 -0.12 0.00 0.00 29.99 28.58 2qbe n HIS 20 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2qbe n ALA 21 N -4.44 0.00 -3.49 1.57 0.00 -1.26 -3.21 120.51 109.68 2qbe n ALA 21 Ca 0.04 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.29 2qbe n ALA 21 Cb 0.56 -1.01 0.06 0.00 0.00 0.00 0.00 19.45 19.06 2qbe n ALA 21 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qbe n LEU 22 N 0.00 -4.11 -4.58 0.00 4.77 -0.60 -4.97 117.00 107.51 2qbe n LEU 22 Ca 0.00 -0.76 -0.40 0.00 -0.03 0.00 0.00 56.01 54.82 2qbe n LEU 22 Cb 0.29 -2.92 -0.08 0.00 -2.33 0.00 0.00 43.42 38.38 2qbe n LEU 22 CO 0.00 0.31 0.16 0.20 -1.33 0.00 0.00 177.39 176.73 2qbe s ASN 23 N -3.94 6.31 0.23 -1.43 0.01 -1.05 -4.86 114.94 110.21 2qbe s ASN 23 Ca 0.21 0.18 -0.30 0.00 -0.71 0.00 0.00 52.86 52.24 2qbe s ASN 23 Cb -0.04 -2.25 -0.09 0.00 0.41 0.00 0.00 41.25 39.29 2qbe s ASN 23 CO 0.77 -0.33 0.96 0.00 -1.51 0.00 0.00 177.10 177.00 2qbe s ALA 24 N 2.23 3.34 -0.29 0.60 0.00 -1.26 -1.51 121.76 124.86 2qbe s ALA 24 Ca 0.17 0.64 0.02 0.00 0.00 0.00 0.00 51.96 52.79 2qbe s ALA 24 Cb -0.16 -3.23 0.20 0.00 0.00 0.00 0.00 23.12 19.93 2qbe s ALA 24 CO 0.11 0.15 0.70 0.95 0.00 0.00 0.00 175.76 177.67 2qbe s THR 25 N -1.03 -0.83 0.01 0.00 -4.23 -1.26 -4.86 115.64 103.44 2qbe s THR 25 Ca 0.42 0.00 -0.34 0.00 -1.18 0.00 0.00 61.69 60.59 2qbe s THR 25 Cb -0.26 -0.84 -0.17 0.00 1.34 0.00 0.00 72.50 72.56 2qbe s THR 25 CO 0.33 0.00 0.90 0.29 -0.54 0.00 0.00 174.62 175.59 2qbe n LYS 26 N 5.36 0.00 0.01 3.99 4.76 -1.26 -0.96 118.16 130.06 2qbe n LYS 26 Ca 0.05 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.49 2qbe n LYS 26 Cb 0.55 -1.28 0.00 0.00 -1.84 0.00 0.00 35.03 32.46 2qbe n LYS 26 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 2qbe n ARG 27 N 1.28 0.00 -0.85 1.97 1.85 -1.03 -4.75 116.66 115.13 2qbe n ARG 27 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.02 2qbe n ARG 27 Cb 0.08 -0.34 0.00 0.00 -1.05 0.00 0.00 32.46 31.15 2qbe n ARG 27 CO 0.00 0.00 0.00 -2.13 -0.01 0.00 0.00 177.63 175.49 2qbe n ARG 28 N -2.92 -2.18 -3.99 2.89 0.63 -1.26 -4.85 116.66 104.98 2qbe n ARG 28 Ca 0.00 1.63 -0.28 0.00 -0.92 0.00 0.00 57.85 58.29 2qbe n ARG 28 Cb 0.30 -1.72 -0.04 0.00 0.45 0.00 0.00 32.46 31.45 2qbe n ARG 28 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2qbe s PHE 29 N -1.15 3.37 0.02 -0.14 0.40 0.28 -4.85 117.98 115.91 2qbe s PHE 29 Ca 0.00 0.11 0.02 0.00 -0.60 0.00 0.00 56.93 56.46 2qbe s PHE 29 Cb 0.00 -1.64 -0.02 0.00 0.51 0.00 0.00 43.02 41.87 2qbe s PHE 29 CO 0.00 0.53 -0.07 -0.48 0.70 0.00 0.00 175.22 175.90 2qbe s LEU 30 N -2.92 2.15 1.17 -0.37 2.34 -1.26 -0.42 118.68 119.37 2qbe s LEU 30 Ca 0.33 -0.35 -0.17 0.00 0.06 0.00 0.00 54.13 53.99 2qbe s LEU 30 Cb -0.11 -0.25 0.20 0.00 -0.56 0.00 0.00 46.19 45.47 2qbe s LEU 30 CO 0.26 -0.07 0.39 -2.65 -1.06 0.00 0.00 176.35 173.22 2qbe n PRO 31 N 2.13 -2.51 0.01 1.48 -0.02 -1.26 -5.00 135.00 129.83 2qbe n PRO 31 Ca -0.18 -0.73 -0.01 0.00 -2.02 0.00 0.00 63.50 60.56 2qbe n PRO 31 Cb 0.56 -1.76 -0.01 0.00 -0.02 0.00 0.00 33.50 32.27 2qbe n PRO 31 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 2qbe h ASN 32 N -2.61 -0.07 -3.06 2.55 -0.73 -1.91 -3.51 115.58 106.25 2qbe h ASN 32 Ca -0.47 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.71 2qbe h ASN 32 Cb 1.22 0.02 0.00 0.00 0.27 0.00 0.00 38.32 39.82 2qbe h ASN 32 CO 0.33 0.16 -0.55 0.18 -0.37 0.00 0.00 177.43 177.18 2qbe n LEU 33 N -3.38 -1.08 0.00 0.34 4.32 -1.25 -4.89 117.00 111.07 2qbe n LEU 33 Ca -0.01 1.70 0.00 0.00 -0.02 0.00 0.00 56.01 57.68 2qbe n LEU 33 Cb 0.03 -2.49 0.00 0.00 -1.62 0.00 0.00 43.42 39.34 2qbe n LEU 33 CO 0.02 -0.19 0.00 1.41 -1.22 0.00 0.00 177.39 177.41 2qbe n HIS 34 N -1.82 0.00 -2.51 -1.77 8.25 -1.25 -4.87 115.22 111.24 2qbe n HIS 34 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.42 2qbe n HIS 34 Cb 0.17 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.25 2qbe n HIS 34 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2qbe n SER 35 N 0.00 -4.05 -4.99 0.41 3.41 -1.25 -4.95 113.62 102.21 2qbe n SER 35 Ca 0.00 1.58 -0.20 0.00 -0.26 0.00 0.00 58.87 59.99 2qbe n SER 35 Cb 0.00 -5.30 -0.00 0.00 -0.26 0.00 0.00 64.21 58.65 2qbe n SER 35 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2qbe s HIS 36 N -0.65 3.11 -0.90 7.33 2.46 0.92 -4.87 115.29 122.69 2qbe s HIS 36 Ca -0.18 -0.15 0.00 0.00 0.47 0.00 0.00 55.06 55.20 2qbe s HIS 36 Cb 0.01 -2.08 0.31 0.00 -0.13 0.00 0.00 32.58 30.69 2qbe s HIS 36 CO 0.48 -0.11 1.38 -2.13 -2.47 0.00 0.00 174.74 171.89 2qbe n ARG 37 N -1.74 4.25 -2.09 2.88 0.00 -1.26 -1.96 116.66 116.74 2qbe n ARG 37 Ca 0.01 -4.67 -0.38 0.00 -0.00 0.00 0.00 57.85 52.81 2qbe n ARG 37 Cb 0.58 -2.41 0.01 0.00 0.00 0.00 0.00 32.46 30.64 2qbe n ARG 37 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2qbe s PHE 38 N -3.38 2.67 -0.48 -0.14 0.08 -1.17 -4.88 117.98 110.69 2qbe s PHE 38 Ca 0.38 1.48 -0.07 0.00 0.12 0.00 0.00 56.93 58.85 2qbe s PHE 38 Cb 0.15 -3.53 0.12 0.00 -0.57 0.00 0.00 43.02 39.20 2qbe s PHE 38 CO -0.03 -1.99 0.32 -0.46 -0.10 0.00 0.00 175.22 172.96 2qbe s TRP 39 N -1.46 3.49 0.43 0.36 -0.11 -1.26 -1.83 118.94 118.57 2qbe s TRP 39 Ca 0.66 -2.15 0.17 0.00 1.22 0.00 0.00 56.10 56.00 2qbe s TRP 39 Cb -0.33 -3.39 1.09 0.00 -1.50 0.00 0.00 33.47 29.34 2qbe s TRP 39 CO 0.39 -0.97 1.91 -0.39 -4.62 0.00 0.00 176.95 173.27 2qbe h VAL 40 N 6.08 0.76 0.00 5.86 -1.51 -1.82 -3.45 116.25 122.18 2qbe h VAL 40 Ca -0.15 -0.13 0.00 0.00 -1.23 0.00 0.00 66.70 65.19 2qbe h VAL 40 Cb 1.05 0.35 0.00 0.00 -2.13 0.00 0.00 31.29 30.56 2qbe h VAL 40 CO 0.79 0.07 0.00 1.21 -1.23 0.00 0.00 177.57 178.41 2qbe n GLU 41 N -4.47 0.00 -0.23 5.19 0.00 -1.26 -4.00 120.64 115.87 2qbe n GLU 41 Ca 0.15 0.00 -0.03 0.00 0.00 0.00 0.00 57.16 57.29 2qbe n GLU 41 Cb 0.58 0.00 0.09 0.00 0.00 0.00 0.00 31.44 32.10 2qbe n GLU 41 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2qbe h SER 42 N 0.00 0.62 0.08 4.31 4.64 -1.94 0.34 113.55 121.59 2qbe h SER 42 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2qbe h SER 42 Cb 0.00 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 2qbe h SER 42 CO 0.00 0.41 -0.00 1.21 -0.87 0.00 0.00 176.83 177.58 2qbe n GLU 43 N -4.74 0.94 -3.90 4.77 2.13 -1.26 -4.92 120.64 113.68 2qbe n GLU 43 Ca 0.08 -0.03 -0.31 0.00 0.66 0.00 0.00 57.16 57.55 2qbe n GLU 43 Cb 0.13 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.35 2qbe n GLU 43 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2qbe n LYS 44 N -1.00 -1.99 -3.71 5.31 3.00 0.12 -4.97 118.16 114.93 2qbe n LYS 44 Ca 0.22 0.36 -0.09 0.00 -0.00 0.00 0.00 58.31 58.80 2qbe n LYS 44 Cb 0.14 -4.05 -0.03 0.00 0.00 0.00 0.00 35.03 31.09 2qbe n LYS 44 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 2qbe s ARG 45 N -6.52 1.47 -0.51 1.64 3.52 -1.26 -4.95 118.95 112.34 2qbe s ARG 45 Ca 0.24 -0.82 -0.06 0.00 -0.13 0.00 0.00 55.73 54.96 2qbe s ARG 45 Cb -0.10 0.56 0.13 0.00 -1.56 0.00 0.00 34.95 33.98 2qbe s ARG 45 CO 0.90 -0.64 0.35 -0.06 -0.81 0.00 0.00 175.30 175.03 2qbe s PHE 46 N -3.86 3.50 -0.41 5.12 2.99 -1.26 -2.30 117.98 121.75 2qbe s PHE 46 Ca 0.08 -2.25 -0.18 0.00 0.00 0.00 0.00 56.93 54.58 2qbe s PHE 46 Cb -0.02 -3.36 0.02 0.00 0.00 0.00 0.00 43.02 39.65 2qbe s PHE 46 CO -0.02 -0.95 0.48 0.14 -0.00 0.00 0.00 175.22 174.87 2qbe s VAL 47 N 0.89 5.03 -0.26 -0.44 -7.23 -0.76 -4.93 120.40 112.70 2qbe s VAL 47 Ca 0.10 -0.16 -0.23 0.00 -1.81 0.00 0.00 61.98 59.89 2qbe s VAL 47 Cb -0.23 -4.05 -0.01 0.00 0.56 0.00 0.00 36.38 32.65 2qbe s VAL 47 CO -0.03 -0.42 0.75 0.28 -0.31 0.00 0.00 175.10 175.37 2qbe s THR 48 N 2.30 4.88 0.06 5.32 -1.32 -1.26 -3.03 115.64 122.59 2qbe s THR 48 Ca 0.15 1.31 0.09 0.00 -1.21 0.00 0.00 61.69 62.04 2qbe s THR 48 Cb -0.16 -4.06 -0.03 0.00 -1.51 0.00 0.00 72.50 66.74 2qbe s THR 48 CO 0.15 -0.08 -0.25 -0.76 -2.21 0.00 0.00 174.62 171.47 2qbe s LEU 49 N 2.75 2.27 -1.48 9.08 1.43 -0.83 -4.91 118.68 126.98 2qbe s LEU 49 Ca 0.31 -0.59 -0.12 0.00 -1.03 0.00 0.00 54.13 52.70 2qbe s LEU 49 Cb -0.15 -1.32 0.02 0.00 0.03 0.00 0.00 46.19 44.77 2qbe s LEU 49 CO 0.09 0.25 2.39 -1.14 0.23 0.00 0.00 176.35 178.16 2qbe n ARG 50 N 1.60 3.19 0.00 1.70 3.00 -1.26 -0.06 116.66 124.82 2qbe n ARG 50 Ca -0.17 -2.61 0.00 0.00 -0.00 0.00 0.00 57.85 55.07 2qbe n ARG 50 Cb 0.52 -3.12 0.00 0.00 0.00 0.00 0.00 32.46 29.87 2qbe n ARG 50 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2qbe n VAL 51 N 4.46 0.00 0.00 5.15 0.31 -1.25 -3.93 118.33 123.07 2qbe n VAL 51 Ca 0.58 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.91 2qbe n VAL 51 Cb 0.34 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.27 2qbe n VAL 51 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2qbe n SER 52 N 0.00 0.00 -4.29 4.52 3.41 -1.26 -3.80 113.62 112.20 2qbe n SER 52 Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.20 2qbe n SER 52 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2qbe n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qbe n ALA 53 N -0.40 -2.94 0.00 7.33 0.00 -1.26 -0.38 120.51 122.86 2qbe n ALA 53 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2qbe n ALA 53 Cb 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 17.98 2qbe n ALA 53 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2qbe n LYS 54 N 1.34 0.00 0.20 0.00 0.00 -1.26 -4.25 118.16 114.19 2qbe n LYS 54 Ca 0.10 0.00 0.13 0.00 0.00 0.00 0.00 58.31 58.54 2qbe n LYS 54 Cb 0.43 0.00 0.70 0.00 0.00 0.00 0.00 35.03 36.16 2qbe n LYS 54 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 2qbe h GLY 55 N 0.00 0.00 0.96 3.14 0.00 -1.12 0.51 103.07 106.55 2qbe h GLY 55 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.00 2qbe h GLY 55 CO 0.00 0.00 -1.74 -0.33 0.00 0.00 0.00 176.54 174.47 2qbe h MET 56 N 0.00 0.21 -0.06 4.80 2.86 -1.31 -3.26 114.93 118.17 2qbe h MET 56 Ca 0.00 -0.36 0.02 0.00 -2.06 0.00 0.00 59.70 57.30 2qbe h MET 56 Cb 0.02 0.13 -0.00 0.00 0.06 0.00 0.00 31.60 31.81 2qbe h MET 56 CO 0.00 1.03 0.08 0.00 1.06 0.00 0.00 176.91 179.07 2qbe h ARG 57 N 0.06 0.00 0.02 1.72 3.08 -0.29 -1.03 114.38 117.94 2qbe h ARG 57 Ca -0.32 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.73 2qbe h ARG 57 Cb 2.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.08 2qbe h ARG 57 CO 0.12 0.00 -0.01 0.28 -1.07 0.00 0.00 179.97 179.29 2qbe h VAL 58 N 0.00 1.30 -1.02 2.04 2.07 -1.39 -0.31 116.25 118.94 2qbe h VAL 58 Ca 0.03 -1.02 0.28 0.00 0.82 0.00 0.00 66.70 66.81 2qbe h VAL 58 Cb 0.18 1.98 -0.06 0.00 -1.52 0.00 0.00 31.29 31.87 2qbe h VAL 58 CO -0.00 0.26 0.70 0.40 0.02 0.00 0.00 177.57 178.95 2qbe h ILE 59 N -0.47 0.52 0.04 4.57 1.08 -1.27 0.12 117.51 122.09 2qbe h ILE 59 Ca -0.00 -0.07 -0.08 0.00 -0.39 0.00 0.00 64.86 64.32 2qbe h ILE 59 Cb 0.45 0.31 0.01 0.00 -3.07 0.00 0.00 36.82 34.52 2qbe h ILE 59 CO 0.01 0.04 -0.33 0.44 -0.69 0.00 0.00 178.15 177.61 2qbe h ASP 60 N 0.19 0.22 -0.33 1.72 3.32 -1.23 -2.15 116.42 118.18 2qbe h ASP 60 Ca 0.53 -0.89 -0.02 0.00 0.02 0.00 0.00 57.03 56.66 2qbe h ASP 60 Cb 1.71 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 41.17 2qbe h ASP 60 CO -0.13 1.10 0.11 0.50 -1.72 0.00 0.00 179.24 179.10 2qbe h LYS 61 N -0.62 0.50 0.00 3.56 3.64 0.67 -3.39 116.57 120.93 2qbe h LYS 61 Ca -0.05 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2qbe h LYS 61 Cb 1.18 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 2qbe h LYS 61 CO 0.06 0.52 0.00 1.63 -2.27 0.00 0.00 179.45 179.40 2qbe n LYS 62 N -4.69 0.00 0.00 1.90 5.02 0.24 -5.09 118.16 115.53 2qbe n LYS 62 Ca -0.02 0.18 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 2qbe n LYS 62 Cb 0.16 -0.64 0.00 0.00 -0.02 0.00 0.00 35.03 34.53 2qbe n LYS 62 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qbe n GLY 63 N 1.84 3.80 0.07 0.72 0.00 -0.82 -4.74 105.19 106.06 2qbe n GLY 63 Ca 0.00 -0.20 0.04 0.00 0.00 0.00 0.00 46.02 45.85 2qbe n GLY 63 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2qbe n ILE 64 N -0.68 1.27 -0.07 -0.61 -0.00 -1.16 0.86 119.36 118.95 2qbe n ILE 64 Ca 0.00 0.60 -0.08 0.00 -0.00 0.00 0.00 62.75 63.27 2qbe n ILE 64 Cb 0.00 -1.60 -0.09 0.00 -0.00 0.00 0.00 39.64 37.95 2qbe n ILE 64 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 2qbe n ASP 65 N -1.71 2.12 0.11 4.38 8.00 -1.26 -3.44 116.55 124.75 2qbe n ASP 65 Ca -0.00 -0.03 -0.01 0.00 0.71 0.00 0.00 54.79 55.45 2qbe n ASP 65 Cb 0.14 0.45 0.25 0.00 -0.02 0.00 0.00 41.12 41.94 2qbe n ASP 65 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2qbe h THR 66 N 0.00 1.31 0.30 -3.53 2.02 -0.87 1.32 112.91 113.47 2qbe h THR 66 Ca -0.36 -1.50 -0.01 0.00 0.77 0.00 0.00 66.41 65.31 2qbe h THR 66 Cb 1.72 1.70 0.00 0.00 -1.74 0.00 0.00 68.15 69.84 2qbe h THR 66 CO -0.01 0.44 -0.15 0.58 0.37 0.00 0.00 175.52 176.76 2qbe h VAL 67 N 0.15 0.40 0.00 3.16 2.07 0.26 -2.91 116.25 119.38 2qbe h VAL 67 Ca 0.01 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.73 2qbe h VAL 67 Cb 0.80 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 2qbe h VAL 67 CO 0.06 0.10 0.00 -0.07 0.02 0.00 0.00 177.57 177.68 2qbe h LEU 68 N -1.00 0.00 0.13 2.57 3.38 -1.55 -0.00 115.31 118.84 2qbe h LEU 68 Ca -0.04 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.94 2qbe h LEU 68 Cb 0.47 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 2qbe h LEU 68 CO 0.07 0.00 -0.27 0.00 0.09 0.00 0.00 178.44 178.33 2qbe h ALA 69 N 2.04 -0.47 -3.00 1.53 0.00 0.19 -3.29 119.26 116.27 2qbe h ALA 69 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2qbe h ALA 69 Cb 0.12 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2qbe h ALA 69 CO 0.00 -0.81 0.00 0.39 0.00 0.00 0.00 179.25 178.83 2qbe n GLU 70 N -5.39 3.52 0.00 0.00 1.02 -0.02 -3.23 120.64 116.55 2qbe n GLU 70 Ca -0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 2qbe n GLU 70 Cb 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.72 2qbe n GLU 70 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2qbe n LEU 71 N 0.00 0.00 0.27 -4.62 7.99 -1.23 -1.23 117.00 118.17 2qbe n LEU 71 Ca 0.00 0.00 0.18 0.00 -0.01 0.00 0.00 56.01 56.18 2qbe n LEU 71 Cb 0.00 0.00 0.87 0.00 -0.11 0.00 0.00 43.42 44.18 2qbe n LEU 71 CO 0.00 0.00 1.15 0.08 -1.51 0.00 0.00 177.39 177.11 2qbe h ARG 72 N 0.00 0.00 -0.05 3.23 0.11 -1.75 0.45 114.38 116.36 2qbe h ARG 72 Ca 0.00 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.07 2qbe h ARG 72 Cb 0.00 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.08 2qbe h ARG 72 CO 0.00 0.00 0.01 0.00 0.10 0.00 0.00 179.97 180.08 2qbe h ALA 73 N 1.56 0.07 -0.13 0.08 0.00 -1.14 -1.98 119.26 117.72 2qbe h ALA 73 Ca 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2qbe h ALA 73 Cb 0.60 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2qbe h ALA 73 CO -0.00 -0.30 0.00 2.89 0.00 0.00 0.00 179.25 181.84 2qbe n ARG 74 N -4.92 1.38 -2.57 0.00 1.85 0.13 -4.93 116.66 107.60 2qbe n ARG 74 Ca -0.07 -0.58 -0.01 0.00 -1.00 0.00 0.00 57.85 56.19 2qbe n ARG 74 Cb 0.15 -1.23 0.00 0.00 -1.05 0.00 0.00 32.46 30.33 2qbe n ARG 74 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2qbe n GLY 75 N 0.86 -0.99 2.75 2.89 0.00 0.13 -5.02 105.19 105.80 2qbe n GLY 75 Ca 0.10 0.37 -0.23 0.00 0.00 0.00 0.00 46.02 46.26 2qbe n GLY 75 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2qbe n GLU 76 N -1.34 1.01 0.00 1.61 2.13 -1.02 -4.95 120.64 118.09 2qbe n GLU 76 Ca 0.01 -2.69 0.00 0.00 0.66 0.00 0.00 57.16 55.14 2qbe n GLU 76 Cb 0.47 0.58 0.00 0.00 0.27 0.00 0.00 31.44 32.76 2qbe n GLU 76 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 2qbe n LYS 77 N -1.12 2.80 -0.72 5.31 2.85 -1.26 -4.70 118.16 121.32 2qbe n LYS 77 Ca -0.11 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.15 2qbe n LYS 77 Cb 0.47 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.85 2qbe n LYS 77 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 177.40 178.33