#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbe n ARG 2 N 0.00 0.00 -1.34 0.03 0.63 -1.26 -4.91 116.66 109.81 2qbe n ARG 2 Ca 0.00 0.00 -0.57 0.00 -0.92 0.00 0.00 57.85 56.36 2qbe n ARG 2 Cb 0.00 -2.98 -0.10 0.00 0.45 0.00 0.00 32.46 29.83 2qbe n ARG 2 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 2qbe n HIS 3 N -2.00 1.34 -1.99 -0.14 8.25 -1.26 -0.24 115.22 119.18 2qbe n HIS 3 Ca 0.00 0.63 -0.20 0.00 -0.26 0.00 0.00 57.72 57.89 2qbe n HIS 3 Cb 0.00 -2.37 -0.04 0.00 1.12 0.00 0.00 29.99 28.70 2qbe n HIS 3 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2qbe n ARG 4 N 7.51 -1.47 -3.51 -0.41 5.12 -1.26 -4.98 116.66 117.66 2qbe n ARG 4 Ca 0.49 1.06 -0.38 0.00 -1.93 0.00 0.00 57.85 57.10 2qbe n ARG 4 Cb 0.04 -5.53 -0.09 0.00 -1.16 0.00 0.00 32.46 25.72 2qbe n ARG 4 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2qbe s LYS 5 N -4.35 4.07 0.31 5.56 1.02 0.67 -5.08 119.74 121.94 2qbe s LYS 5 Ca 0.00 -0.07 -0.02 0.00 0.02 0.00 0.00 55.97 55.90 2qbe s LYS 5 Cb 0.00 -3.58 -0.04 0.00 -0.52 0.00 0.00 37.83 33.69 2qbe s LYS 5 CO 0.00 -0.07 0.54 0.45 -0.92 0.00 0.00 175.35 175.35 2qbe s SER 6 N 1.26 6.37 0.00 2.83 0.15 -1.26 -5.00 113.70 118.05 2qbe s SER 6 Ca 0.12 0.58 0.00 0.00 0.70 0.00 0.00 55.95 57.35 2qbe s SER 6 Cb -0.15 -2.09 0.00 0.00 -1.71 0.00 0.00 66.02 62.08 2qbe s SER 6 CO 0.07 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.89 2qbe n GLY 7 N -1.29 2.10 3.57 9.45 0.00 -1.26 -5.06 105.19 112.70 2qbe n GLY 7 Ca -0.03 -1.50 -0.34 0.00 0.00 0.00 0.00 46.02 44.14 2qbe n GLY 7 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2qbe s ARG 8 N -5.02 3.38 0.00 1.61 3.52 -1.26 -5.00 118.95 116.17 2qbe s ARG 8 Ca 0.00 -0.48 0.24 0.00 -0.13 0.00 0.00 55.73 55.36 2qbe s ARG 8 Cb 0.00 -2.86 0.31 0.00 -1.56 0.00 0.00 34.95 30.84 2qbe s ARG 8 CO 0.00 0.43 1.29 0.00 -0.81 0.00 0.00 175.30 176.21 2qbe n GLN 9 N 2.96 1.02 0.00 5.12 10.64 -1.26 -4.98 117.38 130.88 2qbe n GLN 9 Ca -0.18 -0.76 0.00 0.00 -1.83 0.00 0.00 57.00 54.23 2qbe n GLN 9 Cb 0.53 -1.48 0.00 0.00 -0.86 0.00 0.00 30.24 28.42 2qbe n GLN 9 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 2qbe n LEU 10 N -0.33 0.00 0.00 2.61 7.99 -1.26 -3.06 117.00 122.96 2qbe n LEU 10 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.10 2qbe n LEU 10 Cb 0.41 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.72 2qbe n LEU 10 CO 0.28 0.00 0.00 0.59 -1.51 0.00 0.00 177.39 176.75 2qbe n ASN 11 N 1.98 0.00 -3.58 -1.43 5.03 -1.26 -5.17 115.26 110.82 2qbe n ASN 11 Ca 0.00 0.00 -0.02 0.00 0.87 0.00 0.00 54.58 55.43 2qbe n ASN 11 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 2qbe n ASN 11 CO 0.00 0.00 0.00 -0.60 -1.83 0.00 0.00 177.26 174.83 2qbe s ARG 12 N 0.00 0.98 0.39 3.52 6.06 -1.17 -5.12 118.95 123.61 2qbe s ARG 12 Ca 0.00 -0.60 -0.26 0.00 -2.50 0.00 0.00 55.73 52.38 2qbe s ARG 12 Cb 0.00 0.30 -0.09 0.00 0.06 0.00 0.00 34.95 35.22 2qbe s ARG 12 CO 0.00 -0.46 1.19 0.54 -2.50 0.00 0.00 175.30 174.07 2qbe s ASN 13 N -3.23 6.58 0.33 -2.12 2.20 -1.26 -4.74 114.94 112.69 2qbe s ASN 13 Ca 0.18 2.40 0.12 0.00 -0.94 0.00 0.00 52.86 54.62 2qbe s ASN 13 Cb -0.00 -2.62 1.02 0.00 -2.00 0.00 0.00 41.25 37.64 2qbe s ASN 13 CO 0.02 -0.64 1.64 -1.28 -2.94 0.00 0.00 177.10 173.89 2qbe h SER 14 N 2.79 0.27 -0.35 3.54 0.87 -1.94 0.22 113.55 118.94 2qbe h SER 14 Ca -0.49 0.21 0.04 0.00 -1.23 0.00 0.00 61.79 60.33 2qbe h SER 14 Cb 1.23 0.22 -0.07 0.00 -0.44 0.00 0.00 62.40 63.34 2qbe h SER 14 CO 0.63 -0.21 -0.52 -1.28 -0.53 0.00 0.00 176.83 174.92 2qbe h SER 15 N 0.21 -1.73 0.43 6.23 0.87 -2.02 -2.07 113.55 115.47 2qbe h SER 15 Ca 0.70 0.22 -0.02 0.00 -1.23 0.00 0.00 61.79 61.46 2qbe h SER 15 Cb 1.60 0.71 0.00 0.00 -0.44 0.00 0.00 62.40 64.27 2qbe h SER 15 CO -0.67 -0.39 -0.21 -0.74 -0.53 0.00 0.00 176.83 174.29 2qbe h HIS 16 N -0.39 -0.54 0.00 2.24 6.17 -1.08 -3.27 115.15 118.28 2qbe h HIS 16 Ca 0.06 -0.01 -0.56 0.00 0.71 0.00 0.00 60.37 60.57 2qbe h HIS 16 Cb 0.56 0.18 0.07 0.00 2.52 0.00 0.00 27.41 30.74 2qbe h HIS 16 CO -0.71 -0.25 2.00 -2.13 0.71 0.00 0.00 177.93 177.55 2qbe n ARG 17 N -5.28 1.06 0.06 5.26 0.63 0.49 -1.81 116.66 117.07 2qbe n ARG 17 Ca -0.11 -1.48 0.00 0.00 -0.92 0.00 0.00 57.85 55.34 2qbe n ARG 17 Cb 0.28 -2.69 0.00 0.00 0.45 0.00 0.00 32.46 30.50 2qbe n ARG 17 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 2qbe n GLN 18 N 6.80 0.00 0.10 -0.14 6.02 -1.16 -4.69 117.38 124.32 2qbe n GLN 18 Ca 0.45 0.00 -0.02 0.00 -0.01 0.00 0.00 57.00 57.42 2qbe n GLN 18 Cb 0.35 0.00 -0.04 0.00 1.02 0.00 0.00 30.24 31.57 2qbe n GLN 18 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qbe h ALA 19 N 0.00 0.53 -0.04 -1.58 0.00 -1.46 0.73 119.26 117.44 2qbe h ALA 19 Ca 0.00 -0.66 -0.10 0.00 0.00 0.00 0.00 54.91 54.15 2qbe h ALA 19 Cb 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2qbe h ALA 19 CO 0.00 0.91 -0.43 0.00 0.00 0.00 0.00 179.25 179.74 2qbe h MET 20 N 0.00 0.09 0.06 0.00 -0.00 -1.80 0.27 114.93 113.55 2qbe h MET 20 Ca -0.01 -0.04 -0.29 0.00 -0.00 0.00 0.00 59.70 59.36 2qbe h MET 20 Cb 1.55 -0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 33.13 2qbe h MET 20 CO 0.09 0.51 -1.56 0.74 -0.00 0.00 0.00 176.91 176.69 2qbe h PHE 21 N 0.08 0.23 -0.33 -0.10 0.05 -1.80 -2.44 116.94 112.62 2qbe h PHE 21 Ca 0.00 -0.17 -0.04 0.00 3.82 0.00 0.00 57.97 61.59 2qbe h PHE 21 Cb 0.79 -0.01 -0.02 0.00 2.00 0.00 0.00 35.95 38.71 2qbe h PHE 21 CO 0.01 1.24 0.04 -0.09 -0.18 0.00 0.00 178.31 179.32 2qbe h ARG 22 N 0.03 0.50 0.04 1.51 2.43 -0.43 0.72 114.38 119.19 2qbe h ARG 22 Ca -0.24 -0.09 -0.06 0.00 -0.81 0.00 0.00 59.98 58.78 2qbe h ARG 22 Cb 1.98 -0.08 0.01 0.00 -0.42 0.00 0.00 29.97 31.45 2qbe h ARG 22 CO 0.12 0.50 -0.28 -0.91 -1.51 0.00 0.00 179.97 177.88 2qbe h ASN 23 N 0.49 0.14 0.12 -3.80 2.35 -1.04 -2.96 115.58 110.88 2qbe h ASN 23 Ca 0.11 -0.97 -0.01 0.00 -0.55 0.00 0.00 56.30 54.88 2qbe h ASN 23 Cb 0.25 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.58 2qbe h ASN 23 CO 0.00 1.13 -0.03 -0.03 -1.65 0.00 0.00 177.43 176.86 2qbe h MET 24 N -0.81 0.00 0.29 0.81 1.85 -1.19 0.14 114.93 116.01 2qbe h MET 24 Ca -0.05 0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 59.02 2qbe h MET 24 Cb 1.20 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.23 2qbe h MET 24 CO 0.04 0.03 -0.14 0.00 -0.40 0.00 0.00 176.91 176.44 2qbe h ALA 25 N 1.97 -0.40 -0.01 0.39 0.00 0.42 -2.76 119.26 118.88 2qbe h ALA 25 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2qbe h ALA 25 Cb 0.10 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2qbe h ALA 25 CO 0.00 -0.37 0.01 0.78 0.00 0.00 0.00 179.25 179.67 2qbe h GLY 26 N -1.07 0.00 1.13 0.00 0.00 -1.32 -0.35 103.07 101.45 2qbe h GLY 26 Ca -0.04 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.20 2qbe h GLY 26 CO 0.07 0.00 0.02 0.23 0.00 0.00 0.00 176.54 176.86 2qbe h SER 27 N 0.00 1.02 -0.08 0.19 0.87 -0.75 -1.93 113.55 112.86 2qbe h SER 27 Ca 0.00 -0.27 -0.06 0.00 -1.23 0.00 0.00 61.79 60.23 2qbe h SER 27 Cb 0.02 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 61.71 2qbe h SER 27 CO -0.00 1.05 -0.17 0.25 -0.53 0.00 0.00 176.83 177.44 2qbe h LEU 28 N 0.96 0.30 -2.15 2.23 7.12 -0.79 -2.66 115.31 120.32 2qbe h LEU 28 Ca 0.18 -0.56 0.06 0.00 0.13 0.00 0.00 57.88 57.68 2qbe h LEU 28 Cb 0.52 -0.08 -0.01 0.00 -0.53 0.00 0.00 40.66 40.56 2qbe h LEU 28 CO 0.03 0.80 0.29 0.58 -0.13 0.00 0.00 178.44 180.01 2qbe h VAL 29 N -0.20 0.30 0.00 1.05 2.07 -1.19 0.35 116.25 118.63 2qbe h VAL 29 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2qbe h VAL 29 Cb 0.75 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 2qbe h VAL 29 CO 0.04 0.00 0.00 0.54 0.02 0.00 0.00 177.57 178.17 2qbe n ARG 30 N -3.52 0.00 0.00 1.57 1.74 -0.74 -4.46 116.66 111.26 2qbe n ARG 30 Ca 0.02 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.20 2qbe n ARG 30 Cb 0.41 -0.45 0.50 0.00 -1.02 0.00 0.00 32.46 31.91 2qbe n ARG 30 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2qbe n HIS 31 N -0.61 0.00 -0.16 -1.55 8.25 -1.02 -4.85 115.22 115.27 2qbe n HIS 31 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2qbe n HIS 31 Cb 0.00 -0.29 0.00 0.00 1.12 0.00 0.00 29.99 30.82 2qbe n HIS 31 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2qbe n GLU 32 N -1.29 0.00 -3.91 -0.41 1.02 0.12 -4.87 120.64 111.30 2qbe n GLU 32 Ca 0.09 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.13 2qbe n GLU 32 Cb 0.16 -3.83 -0.13 0.00 -0.02 0.00 0.00 31.44 27.62 2qbe n GLU 32 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 2qbe s ILE 33 N -1.31 0.05 -0.07 -3.67 -5.25 -1.26 -2.33 121.20 107.36 2qbe s ILE 33 Ca 0.00 -0.37 -0.19 0.00 -0.99 0.00 0.00 60.65 59.11 2qbe s ILE 33 Cb 0.00 -0.11 0.04 0.00 2.95 0.00 0.00 42.46 45.34 2qbe s ILE 33 CO 0.00 -0.20 0.44 -0.63 -1.79 0.00 0.00 174.94 172.76 2qbe s ILE 34 N -0.59 0.03 -0.64 8.37 1.01 -0.10 -4.88 121.20 124.41 2qbe s ILE 34 Ca -0.06 -0.23 0.02 0.00 0.00 0.00 0.00 60.65 60.37 2qbe s ILE 34 Cb -0.04 -0.71 0.16 0.00 0.01 0.00 0.00 42.46 41.88 2qbe s ILE 34 CO -0.00 -0.13 0.42 -1.59 0.00 0.00 0.00 174.94 173.64 2qbe s LYS 35 N -0.84 2.40 0.00 2.79 0.00 -1.25 -1.07 119.74 121.76 2qbe s LYS 35 Ca -0.09 -2.86 0.00 0.00 0.00 0.00 0.00 55.97 53.02 2qbe s LYS 35 Cb -0.03 -3.52 0.00 0.00 0.00 0.00 0.00 37.83 34.27 2qbe s LYS 35 CO 0.04 -1.19 0.00 -2.37 0.00 0.00 0.00 175.35 171.84 2qbe n THR 36 N 2.83 0.00 -2.67 3.79 5.66 -0.86 -4.80 114.28 118.23 2qbe n THR 36 Ca 0.11 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.74 2qbe n THR 36 Cb 0.35 -0.34 -0.05 0.00 -1.55 0.00 0.00 70.33 68.73 2qbe n THR 36 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2qbe s THR 37 N 0.20 3.96 0.15 1.09 2.01 -1.26 0.78 115.64 122.56 2qbe s THR 37 Ca 0.00 1.67 -0.22 0.00 0.31 0.00 0.00 61.69 63.45 2qbe s THR 37 Cb 0.00 -3.95 0.03 0.00 0.01 0.00 0.00 72.50 68.60 2qbe s THR 37 CO 0.00 0.17 1.63 0.25 -0.69 0.00 0.00 174.62 175.98 2qbe h LEU 38 N 3.18 -0.76 -0.46 4.42 5.85 -0.79 0.22 115.31 126.97 2qbe h LEU 38 Ca -0.47 0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.37 2qbe h LEU 38 Cb 1.20 0.36 -0.02 0.00 0.37 0.00 0.00 40.66 42.57 2qbe h LEU 38 CO 0.65 -0.27 0.21 -0.65 -0.34 0.00 0.00 178.44 178.04 2qbe h PRO 39 N -0.24 0.66 0.00 5.25 0.11 -1.94 0.45 132.00 136.30 2qbe h PRO 39 Ca 0.14 -0.10 0.00 0.00 0.11 0.00 0.00 66.00 66.15 2qbe h PRO 39 Cb 0.45 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.45 2qbe h PRO 39 CO -0.39 0.57 0.00 1.63 -0.21 0.00 0.00 178.00 179.60 2qbe n LYS 40 N -4.63 0.17 -0.12 1.05 5.02 -0.78 -2.68 118.16 116.18 2qbe n LYS 40 Ca 0.01 0.17 -0.25 0.00 -2.02 0.00 0.00 58.31 56.22 2qbe n LYS 40 Cb 0.12 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.55 2qbe n LYS 40 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qbe n ALA 41 N -1.25 1.18 0.39 7.82 0.00 0.70 -3.30 120.51 126.05 2qbe n ALA 41 Ca 0.05 -1.01 0.01 0.00 0.00 0.00 0.00 53.44 52.49 2qbe n ALA 41 Cb 0.08 0.12 0.06 0.00 0.00 0.00 0.00 19.45 19.71 2qbe n ALA 41 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qbe n LYS 42 N -4.26 0.20 -0.04 0.00 5.02 -0.00 -1.55 118.16 117.51 2qbe n LYS 42 Ca -0.44 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 55.75 2qbe n LYS 42 Cb 0.79 -1.16 -0.03 0.00 -0.02 0.00 0.00 35.03 34.61 2qbe n LYS 42 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2qbe n GLU 43 N -0.66 0.24 0.10 1.97 -0.58 -1.09 -4.49 120.64 116.13 2qbe n GLU 43 Ca 0.02 0.10 0.20 0.00 -0.42 0.00 0.00 57.16 57.06 2qbe n GLU 43 Cb 0.01 -0.91 0.73 0.00 -0.57 0.00 0.00 31.44 30.69 2qbe n GLU 43 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2qbe h LEU 44 N -0.42 0.00 0.14 -4.62 5.85 -1.30 -1.98 115.31 112.98 2qbe h LEU 44 Ca -0.21 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 2qbe h LEU 44 Cb 1.02 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 2qbe h LEU 44 CO -0.13 0.00 -0.18 -0.09 -0.34 0.00 0.00 178.44 177.70 2qbe h ARG 45 N 0.00 -0.32 -2.38 1.25 2.43 -1.51 -2.64 114.38 111.21 2qbe h ARG 45 Ca 0.19 0.02 -0.27 0.00 -0.81 0.00 0.00 59.98 59.11 2qbe h ARG 45 Cb 1.17 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.76 2qbe h ARG 45 CO -0.00 -0.21 0.68 2.89 -1.51 0.00 0.00 179.97 181.81 2qbe n ARG 46 N -3.42 2.12 0.00 0.20 1.85 -0.74 -2.45 116.66 114.22 2qbe n ARG 46 Ca -0.04 -1.15 0.00 0.00 -1.00 0.00 0.00 57.85 55.66 2qbe n ARG 46 Cb 0.16 -2.13 0.00 0.00 -1.05 0.00 0.00 32.46 29.44 2qbe n ARG 46 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 2qbe n VAL 47 N 2.86 0.00 -0.13 8.89 0.31 -1.02 -4.87 118.33 124.38 2qbe n VAL 47 Ca 0.45 0.00 -0.25 0.00 -0.01 0.00 0.00 64.34 64.54 2qbe n VAL 47 Cb 0.65 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 33.48 2qbe n VAL 47 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2qbe n VAL 48 N -0.34 1.48 -0.24 2.52 0.31 -1.02 -4.14 118.33 116.90 2qbe n VAL 48 Ca 0.00 -0.45 0.04 0.00 -0.01 0.00 0.00 64.34 63.92 2qbe n VAL 48 Cb 0.00 -1.69 0.16 0.00 -0.91 0.00 0.00 33.84 31.39 2qbe n VAL 48 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2qbe h GLU 49 N -0.61 0.35 0.00 5.55 5.08 -1.81 0.75 114.58 123.89 2qbe h GLU 49 Ca -0.65 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 57.69 2qbe h GLU 49 Cb 1.71 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.88 2qbe h GLU 49 CO -0.30 0.23 -0.02 -1.35 -1.00 0.00 0.00 179.01 176.58 2qbe h PRO 50 N 0.36 0.00 0.03 2.33 0.11 -1.83 0.73 132.00 133.73 2qbe h PRO 50 Ca 0.38 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.33 2qbe h PRO 50 Cb 0.58 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.71 2qbe h PRO 50 CO -0.42 0.02 -0.64 -0.07 -0.21 0.00 0.00 178.00 176.68 2qbe h LEU 51 N 0.00 0.50 -0.31 2.35 4.07 0.13 -2.23 115.31 119.82 2qbe h LEU 51 Ca -0.00 -0.81 -0.05 0.00 0.08 0.00 0.00 57.88 57.11 2qbe h LEU 51 Cb 0.03 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 41.60 2qbe h LEU 51 CO 0.00 1.25 0.01 0.40 -1.08 0.00 0.00 178.44 179.02 2qbe h ILE 52 N -0.18 1.26 -0.23 1.22 2.04 0.46 0.59 117.51 122.66 2qbe h ILE 52 Ca -0.09 -0.93 0.07 0.00 1.00 0.00 0.00 64.86 64.90 2qbe h ILE 52 Cb 1.38 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 38.70 2qbe h ILE 52 CO 0.12 0.30 0.19 0.74 0.00 0.00 0.00 178.15 179.51 2qbe h THR 53 N 0.35 0.68 0.00 -0.27 2.02 0.37 0.80 112.91 116.85 2qbe h THR 53 Ca 0.09 0.00 -0.19 0.00 0.77 0.00 0.00 66.41 67.08 2qbe h THR 53 Cb 0.43 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.67 2qbe h THR 53 CO 0.01 0.00 -1.02 0.25 0.37 0.00 0.00 175.52 175.13 2qbe h LEU 54 N 0.00 0.00 -0.68 2.58 5.85 -0.55 -3.21 115.31 119.30 2qbe h LEU 54 Ca 0.11 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.83 2qbe h LEU 54 Cb 0.49 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.52 2qbe h LEU 54 CO -0.00 0.82 0.00 0.00 -0.34 0.00 0.00 178.44 178.92 2qbe h ALA 55 N 1.18 1.00 -0.97 1.25 0.00 0.60 -3.20 119.26 119.12 2qbe h ALA 55 Ca -0.07 0.00 0.22 0.00 0.00 0.00 0.00 54.91 55.07 2qbe h ALA 55 Cb 1.69 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 19.39 2qbe h ALA 55 CO 0.10 0.00 0.63 0.87 0.00 0.00 0.00 179.25 180.85 2qbe h LYS 56 N 0.00 0.45 -5.18 0.00 1.79 -1.17 -3.33 116.57 109.13 2qbe h LYS 56 Ca 0.00 -0.03 -0.63 0.00 -2.18 0.00 0.00 60.65 57.81 2qbe h LYS 56 Cb 0.50 -0.10 -0.20 0.00 -1.58 0.00 0.00 32.23 30.85 2qbe h LYS 56 CO 0.00 0.30 -0.63 0.99 -1.08 0.00 0.00 179.45 179.03 2qbe s THR 57 N -5.52 4.25 0.00 -0.16 2.01 -1.21 -4.87 115.64 110.14 2qbe s THR 57 Ca -0.09 -0.22 0.00 0.00 0.31 0.00 0.00 61.69 61.69 2qbe s THR 57 Cb 0.24 -2.92 0.00 0.00 0.01 0.00 0.00 72.50 69.83 2qbe s THR 57 CO 0.79 0.44 0.88 -0.67 -0.69 0.00 0.00 174.62 175.37 2qbe n ASP 58 N 3.98 0.00 -0.76 3.53 4.64 -1.26 -4.83 116.55 121.85 2qbe n ASP 58 Ca -0.17 0.88 0.00 0.00 -1.38 0.00 0.00 54.79 54.12 2qbe n ASP 58 Cb 0.52 -0.38 0.00 0.00 -1.04 0.00 0.00 41.12 40.22 2qbe n ASP 58 CO 0.00 0.00 0.00 -0.24 -0.82 0.00 0.00 177.20 176.14 2qbe n SER 59 N -1.96 -4.93 0.00 1.67 2.88 -1.26 -4.37 113.62 105.66 2qbe n SER 59 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2qbe n SER 59 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2qbe n SER 59 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2qbe n VAL 60 N -1.52 0.00 -0.05 2.46 0.31 -1.26 -4.75 118.33 113.52 2qbe n VAL 60 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.24 2qbe n VAL 60 Cb 0.00 1.25 -0.04 0.00 -0.91 0.00 0.00 33.84 34.14 2qbe n VAL 60 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qbe n ALA 61 N 0.00 2.13 0.15 3.52 0.00 -1.26 -3.97 120.51 121.09 2qbe n ALA 61 Ca 0.00 -0.40 0.10 0.00 0.00 0.00 0.00 53.44 53.13 2qbe n ALA 61 Cb 0.10 0.34 0.51 0.00 0.00 0.00 0.00 19.45 20.40 2qbe n ALA 61 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2qbe n ASN 62 N -3.20 0.49 -0.07 0.00 5.03 -1.26 0.12 115.26 116.37 2qbe n ASN 62 Ca -0.19 0.73 -0.13 0.00 0.87 0.00 0.00 54.58 55.86 2qbe n ASN 62 Cb 0.66 -0.79 -0.10 0.00 -1.02 0.00 0.00 39.78 38.53 2qbe n ASN 62 CO 0.00 0.00 0.00 -0.09 -1.83 0.00 0.00 177.26 175.34 2qbe h ARG 63 N 0.00 0.00 -0.33 3.52 9.65 -1.77 -2.17 114.38 123.29 2qbe h ARG 63 Ca 0.00 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.86 2qbe h ARG 63 Cb 0.02 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.58 2qbe h ARG 63 CO 0.00 0.77 0.14 0.00 2.80 0.00 0.00 179.97 183.69 2qbe h ARG 64 N -1.00 0.48 -0.18 0.20 3.08 -0.97 0.64 114.38 116.64 2qbe h ARG 64 Ca -0.06 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 2qbe h ARG 64 Cb 0.86 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 2qbe h ARG 64 CO -0.04 0.47 0.08 1.25 -1.07 0.00 0.00 179.97 180.65 2qbe h LEU 65 N 0.39 0.21 -1.13 3.04 5.85 0.82 0.66 115.31 125.14 2qbe h LEU 65 Ca 0.11 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.76 2qbe h LEU 65 Cb 0.16 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 2qbe h LEU 65 CO -0.01 0.19 -0.29 0.00 -0.34 0.00 0.00 178.44 177.99 2qbe h ALA 66 N 1.84 1.06 0.00 1.25 0.00 -0.51 -2.35 119.26 120.55 2qbe h ALA 66 Ca 0.06 -0.27 -0.24 0.00 0.00 0.00 0.00 54.91 54.46 2qbe h ALA 66 Cb 0.04 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 2qbe h ALA 66 CO -0.01 0.37 -1.29 0.35 0.00 0.00 0.00 179.25 178.66 2qbe h PHE 67 N 0.00 0.00 0.28 0.00 3.57 0.22 -3.33 116.94 117.69 2qbe h PHE 67 Ca -0.00 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 2qbe h PHE 67 Cb 0.76 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.47 2qbe h PHE 67 CO 0.00 0.99 -0.47 0.00 -2.23 0.00 0.00 178.31 176.60 2qbe h ALA 68 N 1.01 -1.04 -2.19 2.41 0.00 0.56 -3.29 119.26 116.72 2qbe h ALA 68 Ca -0.12 -0.14 -0.47 0.00 0.00 0.00 0.00 54.91 54.18 2qbe h ALA 68 Cb 1.87 0.78 -0.01 0.00 0.00 0.00 0.00 17.79 20.43 2qbe h ALA 68 CO 0.11 -1.12 0.25 -0.98 0.00 0.00 0.00 179.25 177.51 2qbe s ARG 69 N -5.55 4.04 -0.53 0.00 3.03 -1.10 -4.27 118.95 114.58 2qbe s ARG 69 Ca -0.16 0.87 -0.20 0.00 2.03 0.00 0.00 55.73 58.28 2qbe s ARG 69 Cb 0.05 -2.27 0.03 0.00 -1.03 0.00 0.00 34.95 31.73 2qbe s ARG 69 CO 0.55 -0.03 0.64 0.25 -1.13 0.00 0.00 175.30 175.58 2qbe n THR 70 N -0.86 -7.57 -0.84 4.99 -2.24 -1.26 -4.66 114.28 101.84 2qbe n THR 70 Ca 0.05 0.34 -0.42 0.00 -2.27 0.00 0.00 64.05 61.76 2qbe n THR 70 Cb 0.54 -5.43 -0.08 0.00 -2.10 0.00 0.00 70.33 63.26 2qbe n THR 70 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2qbe n ARG 71 N -0.76 0.86 -3.36 -0.78 3.00 -1.24 -4.62 116.66 109.76 2qbe n ARG 71 Ca -0.02 -1.45 -0.15 0.00 -0.00 0.00 0.00 57.85 56.23 2qbe n ARG 71 Cb 0.57 -2.70 -0.08 0.00 0.00 0.00 0.00 32.46 30.25 2qbe n ARG 71 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2qbe s ASP 72 N 5.77 1.14 0.39 6.15 3.68 -1.26 -4.97 116.67 127.58 2qbe s ASP 72 Ca 0.60 -1.10 0.24 0.00 2.13 0.00 0.00 52.55 54.41 2qbe s ASP 72 Cb 0.14 0.66 1.30 0.00 -1.45 0.00 0.00 42.92 43.57 2qbe s ASP 72 CO 0.21 -0.31 1.71 0.78 0.13 0.00 0.00 175.17 177.68 2qbe h ASN 73 N 7.63 0.00 0.48 -0.34 4.21 -1.94 -1.20 115.58 124.42 2qbe h ASN 73 Ca -0.03 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.45 2qbe h ASN 73 Cb 1.07 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.28 2qbe h ASN 73 CO 0.25 0.00 -0.23 -0.08 -1.29 0.00 0.00 177.43 176.08 2qbe h GLU 74 N 0.00 -0.62 -0.06 0.81 4.57 -1.95 -2.86 114.58 114.46 2qbe h GLU 74 Ca 0.00 0.04 -0.17 0.00 -1.18 0.00 0.00 59.36 58.05 2qbe h GLU 74 Cb 0.14 0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.87 2qbe h GLU 74 CO 0.00 -0.32 -0.69 -0.84 -1.18 0.00 0.00 179.01 175.98 2qbe h ILE 75 N -0.99 1.40 -0.03 2.32 3.07 -1.69 -2.50 117.51 119.10 2qbe h ILE 75 Ca -0.07 -2.14 0.01 0.00 1.55 0.00 0.00 64.86 64.21 2qbe h ILE 75 Cb 0.59 2.11 -0.00 0.00 -0.27 0.00 0.00 36.82 39.26 2qbe h ILE 75 CO 0.11 0.64 0.03 -0.37 -1.05 0.00 0.00 178.15 177.51 2qbe h VAL 76 N 0.20 0.47 0.09 0.16 -1.51 -1.34 0.75 116.25 115.08 2qbe h VAL 76 Ca -0.02 0.00 -0.25 0.00 -1.23 0.00 0.00 66.70 65.20 2qbe h VAL 76 Cb 1.24 0.97 0.02 0.00 -2.13 0.00 0.00 31.29 31.40 2qbe h VAL 76 CO 0.11 0.00 -1.03 0.00 -1.23 0.00 0.00 177.57 175.42 2qbe h ALA 77 N 1.96 0.00 -0.85 5.19 0.00 -1.22 -3.08 119.26 121.26 2qbe h ALA 77 Ca 0.01 -0.71 0.03 0.00 0.00 0.00 0.00 54.91 54.24 2qbe h ALA 77 Cb 0.07 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 2qbe h ALA 77 CO -0.00 0.56 0.56 -0.22 0.00 0.00 0.00 179.25 180.15 2qbe h LYS 78 N 0.10 1.06 -7.35 0.00 1.63 0.18 -3.21 116.57 108.97 2qbe h LYS 78 Ca -0.15 -0.06 -0.50 0.00 -0.85 0.00 0.00 60.65 59.08 2qbe h LYS 78 Cb 1.73 -0.24 0.06 0.00 -0.60 0.00 0.00 32.23 33.19 2qbe h LYS 78 CO 0.20 0.70 0.38 -0.51 -3.45 0.00 0.00 179.45 176.77 2qbe s LEU 79 N -9.95 3.17 0.00 5.20 1.43 0.21 -0.24 118.68 118.51 2qbe s LEU 79 Ca -0.12 1.27 0.00 0.00 -1.03 0.00 0.00 54.13 54.25 2qbe s LEU 79 Cb 0.18 -4.23 0.00 0.00 0.03 0.00 0.00 46.19 42.17 2qbe s LEU 79 CO 0.79 -0.99 0.00 0.49 0.23 0.00 0.00 176.35 176.88 2qbe n PHE 80 N -2.78 0.00 -0.09 0.29 3.72 -1.25 -4.36 117.46 113.00 2qbe n PHE 80 Ca 0.06 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.32 2qbe n PHE 80 Cb 0.55 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 39.02 2qbe n PHE 80 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 2qbe h ASN 81 N 0.00 0.00 0.00 4.37 4.21 -1.64 -3.35 115.58 119.18 2qbe h ASN 81 Ca 0.00 -0.35 0.00 0.00 1.21 0.00 0.00 56.30 57.16 2qbe h ASN 81 Cb 0.00 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.20 2qbe h ASN 81 CO 0.00 1.12 0.00 -0.62 -1.29 0.00 0.00 177.43 176.64 2qbe n GLU 82 N -4.54 0.00 -0.43 0.81 4.71 0.67 -4.25 120.64 117.61 2qbe n GLU 82 Ca -0.19 0.00 0.40 0.00 -0.01 0.00 0.00 57.16 57.36 2qbe n GLU 82 Cb 0.47 0.00 0.71 0.00 -1.01 0.00 0.00 31.44 31.61 2qbe n GLU 82 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 2qbe h LEU 83 N 0.00 0.00 0.00 -4.62 4.07 -1.88 0.28 115.31 113.16 2qbe h LEU 83 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2qbe h LEU 83 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 2qbe h LEU 83 CO 0.00 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.97 2qbe n GLY 84 N -1.80 -2.92 0.22 0.83 0.00 -1.26 -1.13 105.19 99.13 2qbe n GLY 84 Ca 0.32 0.24 0.07 0.00 0.00 0.00 0.00 46.02 46.66 2qbe n GLY 84 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2qbe h PRO 85 N 0.00 0.00 -0.97 1.61 0.11 -1.36 -1.66 132.00 129.73 2qbe h PRO 85 Ca 0.00 0.00 0.18 0.00 0.11 0.00 0.00 66.00 66.29 2qbe h PRO 85 Cb 0.00 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 31.01 2qbe h PRO 85 CO 0.00 0.25 0.57 0.00 -0.21 0.00 0.00 178.00 178.61 2qbe h ARG 86 N 0.00 0.72 -0.07 1.05 2.47 -0.25 -1.10 114.38 117.20 2qbe h ARG 86 Ca -0.00 -0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 58.65 2qbe h ARG 86 Cb 0.56 -0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 28.70 2qbe h ARG 86 CO 0.03 0.48 -0.27 1.19 0.56 0.00 0.00 179.97 181.96 2qbe n PHE 87 N -4.79 0.23 0.25 3.04 3.72 -0.28 -4.71 117.46 114.91 2qbe n PHE 87 Ca 0.22 -1.34 0.16 0.00 -0.05 0.00 0.00 57.45 56.43 2qbe n PHE 87 Cb 0.53 -0.26 0.83 0.00 -0.94 0.00 0.00 39.48 39.64 2qbe n PHE 87 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2qbe h ALA 88 N 0.77 1.05 0.00 4.37 0.00 -0.23 -1.63 119.26 123.59 2qbe h ALA 88 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2qbe h ALA 88 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2qbe h ALA 88 CO 0.07 -0.05 -0.60 -1.13 0.00 0.00 0.00 179.25 177.54 2qbe n SER 89 N -2.61 3.01 -4.69 0.00 3.41 -1.26 -5.03 113.62 106.45 2qbe n SER 89 Ca -0.02 -0.18 -0.45 0.00 -0.26 0.00 0.00 58.87 57.96 2qbe n SER 89 Cb 0.11 0.97 -0.04 0.00 -0.26 0.00 0.00 64.21 64.99 2qbe n SER 89 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2qbe n ARG 90 N -1.27 2.38 0.08 4.33 3.00 -0.61 -4.92 116.66 119.64 2qbe n ARG 90 Ca 0.00 0.86 -0.04 0.00 -0.00 0.00 0.00 57.85 58.66 2qbe n ARG 90 Cb 0.00 -2.65 -0.02 0.00 0.00 0.00 0.00 32.46 29.78 2qbe n ARG 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2qbe h ALA 91 N 6.19 -0.89 0.00 5.13 0.00 -1.96 -3.47 119.26 124.26 2qbe h ALA 91 Ca -0.44 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2qbe h ALA 91 Cb 1.23 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2qbe h ALA 91 CO 0.91 -0.89 0.00 0.41 0.00 0.00 0.00 179.25 179.68 2qbe n GLY 92 N -1.14 -0.11 3.57 0.00 0.00 -1.26 -5.04 105.19 101.20 2qbe n GLY 92 Ca -0.03 -0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.70 2qbe n GLY 92 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qbe s GLY 93 N -1.44 -0.28 0.00 -0.02 0.00 -1.26 -4.68 107.32 99.64 2qbe s GLY 93 Ca 0.00 -1.42 0.20 0.00 0.00 0.00 0.00 44.72 43.50 2qbe s GLY 93 CO 0.00 3.82 1.44 -1.72 0.00 0.00 0.00 173.10 176.64 2qbe n TYR 94 N 16.14 0.56 -4.26 1.90 4.01 -1.26 -4.82 117.16 129.43 2qbe n TYR 94 Ca 0.43 -0.28 -0.16 0.00 -0.16 0.00 0.00 57.90 57.73 2qbe n TYR 94 Cb 0.46 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.38 2qbe n TYR 94 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2qbe s THR 95 N -1.44 1.29 0.25 -0.72 -1.32 -1.26 -1.78 115.64 110.66 2qbe s THR 95 Ca 0.37 -1.96 0.07 0.00 -1.21 0.00 0.00 61.69 58.96 2qbe s THR 95 Cb 0.20 -1.75 -0.05 0.00 -1.51 0.00 0.00 72.50 69.39 2qbe s THR 95 CO 0.28 -0.62 -0.09 -0.60 -2.21 0.00 0.00 174.62 171.38 2qbe s ARG 96 N -3.35 1.45 0.00 7.08 6.06 0.12 -4.74 118.95 125.57 2qbe s ARG 96 Ca 0.15 -1.70 0.00 0.00 -2.50 0.00 0.00 55.73 51.67 2qbe s ARG 96 Cb -0.01 -1.12 0.00 0.00 0.06 0.00 0.00 34.95 33.88 2qbe s ARG 96 CO 0.02 0.09 0.00 0.44 -2.50 0.00 0.00 175.30 173.36 2qbe n ILE 97 N -0.50 0.00 -2.71 4.11 -6.64 -1.24 -1.68 119.36 110.70 2qbe n ILE 97 Ca -0.06 0.00 -0.12 0.00 -1.77 0.00 0.00 62.75 60.79 2qbe n ILE 97 Cb 0.62 -0.91 0.01 0.00 -1.44 0.00 0.00 39.64 37.92 2qbe n ILE 97 CO 0.00 0.00 0.00 0.18 -1.77 0.00 0.00 176.55 174.96 2qbe n LEU 98 N -1.95 -2.38 -4.50 7.28 7.99 -1.15 0.13 117.00 122.42 2qbe n LEU 98 Ca 0.00 0.13 -0.29 0.00 -0.01 0.00 0.00 56.01 55.84 2qbe n LEU 98 Cb 0.47 -1.21 0.25 0.00 -0.11 0.00 0.00 43.42 42.82 2qbe n LEU 98 CO 0.00 -0.64 0.53 -0.54 -1.51 0.00 0.00 177.39 175.23 2qbe s LYS 99 N -1.21 -1.28 0.00 3.23 1.02 -1.26 0.84 119.74 121.08 2qbe s LYS 99 Ca 0.12 0.40 0.00 0.00 0.02 0.00 0.00 55.97 56.51 2qbe s LYS 99 Cb -0.01 -1.55 0.00 0.00 -0.52 0.00 0.00 37.83 35.75 2qbe s LYS 99 CO 0.27 -3.85 0.00 0.00 -0.92 0.00 0.00 175.35 170.85 2qbe n GLY 101 N -0.49 0.00 2.19 0.00 0.00 -0.18 -4.78 105.19 101.92 2qbe n GLY 101 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 2qbe n GLY 101 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2qbe n PHE 102 N -0.21 -2.41 -3.64 1.61 3.01 -1.04 -4.36 117.46 110.42 2qbe n PHE 102 Ca 0.00 1.15 -0.20 0.00 1.01 0.00 0.00 57.45 59.41 2qbe n PHE 102 Cb 0.00 -2.96 -0.01 0.00 -0.01 0.00 0.00 39.48 36.50 2qbe n PHE 102 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 2qbe s ARG 103 N -0.92 3.25 0.00 -1.08 3.52 -0.36 -4.84 118.95 118.53 2qbe s ARG 103 Ca -0.04 -0.87 0.00 0.00 -0.13 0.00 0.00 55.73 54.69 2qbe s ARG 103 Cb 0.00 -2.83 0.00 0.00 -1.56 0.00 0.00 34.95 30.56 2qbe s ARG 103 CO 0.46 0.19 0.37 0.00 -0.81 0.00 0.00 175.30 175.51 2qbe n ALA 104 N -1.58 -0.13 -0.28 6.12 0.00 -1.26 -4.05 120.51 119.34 2qbe n ALA 104 Ca -0.04 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.35 2qbe n ALA 104 Cb 0.58 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.02 2qbe n ALA 104 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2qbe h GLY 105 N 0.00 -0.24 -4.55 0.00 0.00 -1.99 -3.40 103.07 92.88 2qbe h GLY 105 Ca 0.00 0.54 -0.69 0.00 0.00 0.00 0.00 47.33 47.18 2qbe h GLY 105 CO 0.00 -0.17 -0.84 0.51 0.00 0.00 0.00 176.54 176.05 2qbe s ASP 106 N -5.25 3.51 0.00 0.19 1.47 -1.26 -4.97 116.67 110.36 2qbe s ASP 106 Ca -0.14 -0.43 0.00 0.00 1.18 0.00 0.00 52.55 53.17 2qbe s ASP 106 Cb 0.16 -0.52 0.00 0.00 -0.34 0.00 0.00 42.92 42.22 2qbe s ASP 106 CO 0.68 0.29 0.27 -3.20 0.68 0.00 0.00 175.17 173.89 2qbe n ASN 107 N 1.99 0.11 -4.70 2.11 4.05 -1.26 -3.05 115.26 114.51 2qbe n ASN 107 Ca -0.16 -0.65 -0.43 0.00 0.45 0.00 0.00 54.58 53.78 2qbe n ASN 107 Cb 0.52 -0.05 -0.02 0.00 1.23 0.00 0.00 39.78 41.45 2qbe n ASN 107 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2qbe n ALA 108 N -0.22 1.60 -2.64 5.20 0.00 -1.26 -4.43 120.51 118.77 2qbe n ALA 108 Ca 0.00 0.39 -0.43 0.00 0.00 0.00 0.00 53.44 53.40 2qbe n ALA 108 Cb 0.03 -2.33 -0.02 0.00 0.00 0.00 0.00 19.45 17.12 2qbe n ALA 108 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2qbe s PRO 109 N -0.63 4.04 0.83 0.00 0.04 -1.26 -1.22 135.00 136.80 2qbe s PRO 109 Ca 0.65 1.02 -0.07 0.00 0.04 0.00 0.00 61.00 62.65 2qbe s PRO 109 Cb -0.59 -3.74 0.18 0.00 0.04 0.00 0.00 34.50 30.38 2qbe s PRO 109 CO 0.51 -0.91 1.13 -1.33 0.04 0.00 0.00 177.00 176.44 2qbe n MET 110 N 6.87 -0.57 -3.53 4.56 2.81 -1.26 -0.27 117.12 125.73 2qbe n MET 110 Ca 0.12 -2.47 -0.09 0.00 -1.81 0.00 0.00 57.70 53.45 2qbe n MET 110 Cb 0.47 -0.94 -0.02 0.00 -0.71 0.00 0.00 33.22 32.03 2qbe n MET 110 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2qbe s ALA 111 N -3.49 -1.72 -0.65 3.04 0.00 0.23 -1.02 121.76 118.16 2qbe s ALA 111 Ca 0.70 0.71 -0.03 0.00 0.00 0.00 0.00 51.96 53.35 2qbe s ALA 111 Cb -0.03 0.58 0.17 0.00 0.00 0.00 0.00 23.12 23.84 2qbe s ALA 111 CO 0.47 -0.77 0.47 0.71 0.00 0.00 0.00 175.76 176.65 2qbe s TYR 112 N -3.33 3.43 0.11 0.00 2.02 0.35 -2.02 117.35 117.91 2qbe s TYR 112 Ca 0.05 -2.76 -0.30 0.00 -0.37 0.00 0.00 57.07 53.69 2qbe s TYR 112 Cb -0.01 -3.19 -0.06 0.00 -0.40 0.00 0.00 41.96 38.30 2qbe s TYR 112 CO -0.08 -0.82 1.06 -1.50 -1.57 0.00 0.00 175.55 172.63 2qbe s ILE 113 N -0.22 4.25 -0.10 2.71 1.10 -0.23 -2.95 121.20 125.76 2qbe s ILE 113 Ca 0.18 1.80 -0.30 0.00 -0.51 0.00 0.00 60.65 61.82 2qbe s ILE 113 Cb -0.19 -4.15 0.07 0.00 0.15 0.00 0.00 42.46 38.34 2qbe s ILE 113 CO -0.04 0.24 0.71 -0.70 -2.11 0.00 0.00 174.94 173.04 2qbe s GLU 114 N 0.22 0.98 0.41 3.50 2.12 -0.68 -0.92 118.70 124.33 2qbe s GLU 114 Ca 0.51 0.40 -0.27 0.00 0.36 0.00 0.00 54.97 55.97 2qbe s GLU 114 Cb -0.26 0.47 -0.09 0.00 0.26 0.00 0.00 34.13 34.50 2qbe s GLU 114 CO 0.31 -0.27 1.41 -0.51 -0.54 0.00 0.00 175.26 175.65 2qbe s LEU 115 N -0.86 4.23 0.45 2.70 1.43 -0.98 0.12 118.68 125.77 2qbe s LEU 115 Ca -0.08 2.88 0.11 0.00 -1.03 0.00 0.00 54.13 56.01 2qbe s LEU 115 Cb -0.01 -3.82 1.02 0.00 0.03 0.00 0.00 46.19 43.41 2qbe s LEU 115 CO 0.08 -0.95 2.09 1.62 0.23 0.00 0.00 176.35 179.41 2qbe h VAL 116 N 2.61 1.05 -2.03 -1.59 3.04 -1.64 -2.74 116.25 114.95 2qbe h VAL 116 Ca -0.50 -0.12 -0.74 0.00 -1.01 0.00 0.00 66.70 64.33 2qbe h VAL 116 Cb 1.25 0.68 -0.30 0.00 -2.01 0.00 0.00 31.29 30.90 2qbe h VAL 116 CO 0.63 0.06 0.67 -0.90 -1.01 0.00 0.00 177.57 177.02 2qbe n ASP 117 N -4.50 6.85 -0.11 3.17 3.85 -1.26 -4.59 116.55 119.97 2qbe n ASP 117 Ca 0.01 -3.77 -0.15 0.00 -0.71 0.00 0.00 54.79 50.18 2qbe n ASP 117 Cb 0.09 -0.97 -0.14 0.00 -1.35 0.00 0.00 41.12 38.75 2qbe n ASP 117 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.20 175.05 2qbe n ARG 118 N -0.37 0.67 -1.55 0.11 0.00 -1.04 -4.83 116.66 109.65 2qbe n ARG 118 Ca 0.48 0.09 -0.20 0.00 -0.00 0.00 0.00 57.85 58.23 2qbe n ARG 118 Cb 0.31 -1.53 -0.07 0.00 0.00 0.00 0.00 32.46 31.17 2qbe n ARG 118 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2qbe n SER 119 N -3.06 1.70 0.00 6.15 7.64 -1.26 -5.10 113.62 119.69 2qbe n SER 119 Ca -0.40 -1.16 0.00 0.00 1.01 0.00 0.00 58.87 58.32 2qbe n SER 119 Cb 1.06 -1.56 0.00 0.00 -1.01 0.00 0.00 64.21 62.70 2qbe n SER 119 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41