#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbj h ARG 2 N 0.00 0.20 0.00 0.00 -0.00 -1.66 -3.25 114.38 109.68 2qbj h ARG 2 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.47 2qbj h ARG 2 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 29.97 29.93 2qbj h ARG 2 CO 0.00 0.13 0.00 -0.89 0.00 0.00 0.00 179.97 179.21 2qbj n ILE 3 N -5.11 0.00 0.00 2.04 5.41 -1.26 -2.95 119.36 117.49 2qbj n ILE 3 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.78 2qbj n ILE 3 Cb 0.19 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.12 2qbj n ILE 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2qbj n ALA 4 N 2.33 0.00 -3.48 -1.39 0.00 -1.26 -4.87 120.51 111.84 2qbj n ALA 4 Ca 0.00 -0.04 -0.28 0.00 0.00 0.00 0.00 53.44 53.12 2qbj n ALA 4 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 2qbj n ALA 4 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2qbj s GLY 5 N -1.50 1.20 0.00 0.00 0.00 -1.15 -4.95 107.32 100.92 2qbj s GLY 5 Ca 0.00 -2.31 0.00 0.00 0.00 0.00 0.00 44.72 42.41 2qbj s GLY 5 CO 0.00 1.99 0.00 1.39 0.00 0.00 0.00 173.10 176.48 2qbj n ILE 6 N 3.35 0.00 -0.72 0.90 5.41 -1.23 -4.89 119.36 122.18 2qbj n ILE 6 Ca 0.20 0.00 -0.30 0.00 1.00 0.00 0.00 62.75 63.65 2qbj n ILE 6 Cb 0.41 0.00 -0.05 0.00 -0.71 0.00 0.00 39.64 39.29 2qbj n ILE 6 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2qbj n ASN 7 N 1.73 0.47 -3.17 4.38 5.03 -1.24 -3.36 115.26 119.10 2qbj n ASN 7 Ca 0.00 0.45 -0.32 0.00 0.87 0.00 0.00 54.58 55.59 2qbj n ASN 7 Cb 0.00 -0.42 -0.02 0.00 -1.02 0.00 0.00 39.78 38.32 2qbj n ASN 7 CO 0.00 0.00 0.00 2.30 -1.83 0.00 0.00 177.26 177.73 2qbj n ILE 8 N 2.41 4.12 -1.90 2.41 -5.35 -1.22 -3.84 119.36 115.98 2qbj n ILE 8 Ca 0.20 -5.72 -0.23 0.00 -0.27 0.00 0.00 62.75 56.73 2qbj n ILE 8 Cb -0.02 -1.45 -0.07 0.00 -1.74 0.00 0.00 39.64 36.36 2qbj n ILE 8 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2qbj s PRO 9 N -3.78 2.14 0.42 6.28 0.04 -1.26 -4.53 135.00 134.31 2qbj s PRO 9 Ca 0.46 -0.49 0.01 0.00 0.04 0.00 0.00 61.00 61.02 2qbj s PRO 9 Cb 0.25 -5.07 0.01 0.00 0.04 0.00 0.00 34.50 29.73 2qbj s PRO 9 CO -0.14 -4.13 0.07 -0.25 0.04 0.00 0.00 177.00 172.59 2qbj n ASP 10 N 15.87 2.99 -3.43 6.66 8.00 -1.26 -4.66 116.55 140.72 2qbj n ASP 10 Ca 0.43 -2.75 -0.25 0.00 0.71 0.00 0.00 54.79 52.93 2qbj n ASP 10 Cb 0.46 0.22 0.04 0.00 -0.02 0.00 0.00 41.12 41.83 2qbj n ASP 10 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2qbj n HIS 11 N -1.14 -2.33 -1.95 1.24 8.25 -1.26 -4.83 115.22 113.20 2qbj n HIS 11 Ca -0.14 0.76 0.00 0.00 -0.26 0.00 0.00 57.72 58.08 2qbj n HIS 11 Cb 0.52 -4.41 0.00 0.00 1.12 0.00 0.00 29.99 27.22 2qbj n HIS 11 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2qbj n LYS 12 N -4.46 0.00 -4.04 -0.41 4.76 -1.26 -5.01 118.16 107.73 2qbj n LYS 12 Ca -0.03 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 55.08 2qbj n LYS 12 Cb 0.57 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.70 2qbj n LYS 12 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2qbj s HIS 13 N -0.36 3.37 0.11 2.13 3.76 -1.26 -3.58 115.29 119.46 2qbj s HIS 13 Ca 0.00 0.27 -0.21 0.00 -0.15 0.00 0.00 55.06 54.97 2qbj s HIS 13 Cb 0.00 -1.78 -0.05 0.00 1.11 0.00 0.00 32.58 31.86 2qbj s HIS 13 CO 0.00 0.59 1.29 0.00 -0.85 0.00 0.00 174.74 175.77 2qbj n ALA 14 N 1.21 -0.43 -1.00 -1.40 0.00 -0.50 -0.93 120.51 117.46 2qbj n ALA 14 Ca -0.13 0.58 0.00 0.00 0.00 0.00 0.00 53.44 53.88 2qbj n ALA 14 Cb 0.53 0.03 0.00 0.00 0.00 0.00 0.00 19.45 20.01 2qbj n ALA 14 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2qbj n VAL 15 N -4.56 0.00 -0.16 0.00 0.31 -1.26 -1.27 118.33 111.39 2qbj n VAL 15 Ca 0.01 0.52 0.02 0.00 -0.01 0.00 0.00 64.34 64.88 2qbj n VAL 15 Cb 0.18 -1.43 0.05 0.00 -0.91 0.00 0.00 33.84 31.73 2qbj n VAL 15 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qbj n ILE 16 N -0.02 -0.20 0.19 2.52 3.06 -1.23 0.11 119.36 123.79 2qbj n ILE 16 Ca 0.00 1.01 -0.15 0.00 -2.50 0.00 0.00 62.75 61.12 2qbj n ILE 16 Cb 0.00 -1.39 -0.07 0.00 0.54 0.00 0.00 39.64 38.72 2qbj n ILE 16 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2qbj h ALA 17 N 0.82 -0.48 -0.84 1.51 0.00 -1.09 -2.39 119.26 116.80 2qbj h ALA 17 Ca 0.20 -0.09 0.16 0.00 0.00 0.00 0.00 54.91 55.18 2qbj h ALA 17 Cb 0.31 0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 2qbj h ALA 17 CO -0.45 -0.78 0.55 1.25 0.00 0.00 0.00 179.25 179.82 2qbj h LEU 18 N -0.49 0.48 -1.50 0.00 6.46 0.21 0.34 115.31 120.82 2qbj h LEU 18 Ca -0.03 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2qbj h LEU 18 Cb 0.41 -0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.28 2qbj h LEU 18 CO 0.03 0.23 0.17 0.71 -0.62 0.00 0.00 178.44 178.96 2qbj h THR 19 N 0.50 0.00 0.00 1.05 1.35 -0.74 -0.07 112.91 115.00 2qbj h THR 19 Ca 0.42 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.28 2qbj h THR 19 Cb 0.89 0.50 0.00 0.00 -1.73 0.00 0.00 68.15 67.81 2qbj h THR 19 CO -0.16 0.00 0.02 -1.20 -0.25 0.00 0.00 175.52 173.93 2qbj n SER 20 N -2.38 0.08 -4.70 5.36 7.64 0.12 -4.54 113.62 115.19 2qbj n SER 20 Ca -0.01 0.52 -0.42 0.00 1.01 0.00 0.00 58.87 59.96 2qbj n SER 20 Cb 0.20 -0.53 -0.03 0.00 -1.01 0.00 0.00 64.21 62.85 2qbj n SER 20 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2qbj s ILE 21 N -3.04 4.11 0.17 0.44 1.01 -0.04 -4.88 121.20 118.96 2qbj s ILE 21 Ca -0.00 1.48 0.08 0.00 0.00 0.00 0.00 60.65 62.21 2qbj s ILE 21 Cb 0.01 -3.95 0.08 0.00 0.01 0.00 0.00 42.46 38.61 2qbj s ILE 21 CO 0.03 0.05 1.09 1.88 0.00 0.00 0.00 174.94 177.99 2qbj h TYR 22 N 7.20 0.00 0.00 3.97 0.99 -1.90 -0.89 116.97 126.34 2qbj h TYR 22 Ca -0.38 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.35 2qbj h TYR 22 Cb 1.19 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.92 2qbj h TYR 22 CO 0.70 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 179.27 2qbj n GLY 23 N -1.27 1.65 3.13 3.88 0.00 -1.26 -4.63 105.19 106.69 2qbj n GLY 23 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 2qbj n GLY 23 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qbj s VAL 24 N -0.76 1.45 0.39 1.61 -7.23 -0.34 -4.95 120.40 110.58 2qbj s VAL 24 Ca 0.00 -0.71 0.01 0.00 -1.81 0.00 0.00 61.98 59.47 2qbj s VAL 24 Cb 0.00 -1.26 0.01 0.00 0.56 0.00 0.00 36.38 35.69 2qbj s VAL 24 CO 0.00 0.42 0.08 0.61 -0.31 0.00 0.00 175.10 175.90 2qbj n GLY 25 N 3.27 3.47 0.46 2.32 0.00 -1.26 -4.48 105.19 108.97 2qbj n GLY 25 Ca -0.19 -2.31 0.39 0.00 0.00 0.00 0.00 46.02 43.90 2qbj n GLY 25 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qbj n LYS 26 N -1.09 -0.03 0.05 1.61 4.76 -1.26 -0.20 118.16 121.99 2qbj n LYS 26 Ca -0.12 1.20 -0.03 0.00 -2.87 0.00 0.00 58.31 56.49 2qbj n LYS 26 Cb 0.48 -2.37 -0.01 0.00 -1.84 0.00 0.00 35.03 31.29 2qbj n LYS 26 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 2qbj h THR 27 N 0.00 0.00 -0.50 -0.18 2.02 -1.99 -2.98 112.91 109.28 2qbj h THR 27 Ca 0.84 -0.51 0.07 0.00 0.77 0.00 0.00 66.41 67.59 2qbj h THR 27 Cb 2.73 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 69.11 2qbj h THR 27 CO -0.44 0.00 0.34 -0.09 0.37 0.00 0.00 175.52 175.70 2qbj h ARG 28 N -0.69 0.39 0.07 6.66 1.12 -1.71 -0.95 114.38 119.27 2qbj h ARG 28 Ca -0.02 -0.02 -0.00 0.00 -1.11 0.00 0.00 59.98 58.82 2qbj h ARG 28 Cb 0.14 -0.09 0.00 0.00 -0.01 0.00 0.00 29.97 30.01 2qbj h ARG 28 CO 0.03 0.25 -0.03 1.03 -3.11 0.00 0.00 179.97 178.14 2qbj h SER 29 N 0.40 -0.08 1.26 -3.80 0.87 -0.72 -1.05 113.55 110.43 2qbj h SER 29 Ca 0.22 -0.35 -0.00 0.00 -1.23 0.00 0.00 61.79 60.42 2qbj h SER 29 Cb 0.37 0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 62.35 2qbj h SER 29 CO -0.06 0.32 -0.02 0.50 -0.53 0.00 0.00 176.83 177.05 2qbj h LYS 30 N -0.50 0.00 0.19 2.24 3.64 -1.34 -3.19 116.57 117.61 2qbj h LYS 30 Ca -0.01 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.03 2qbj h LYS 30 Cb 0.43 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.26 2qbj h LYS 30 CO 0.02 0.02 -1.65 0.00 -2.27 0.00 0.00 179.45 175.56 2qbj h ALA 31 N 1.98 0.12 -0.13 5.00 0.00 -1.14 -3.34 119.26 121.74 2qbj h ALA 31 Ca -0.00 -1.08 -0.04 0.00 0.00 0.00 0.00 54.91 53.79 2qbj h ALA 31 Cb 0.65 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2qbj h ALA 31 CO 0.00 0.99 -0.11 0.97 0.00 0.00 0.00 179.25 181.09 2qbj h ILE 32 N 0.11 1.16 0.00 0.00 2.10 -1.18 -1.33 117.51 118.36 2qbj h ILE 32 Ca -0.30 -0.69 0.00 0.00 1.08 0.00 0.00 64.86 64.95 2qbj h ILE 32 Cb 2.10 1.19 0.00 0.00 -1.09 0.00 0.00 36.82 39.02 2qbj h ILE 32 CO 0.19 0.21 0.00 0.18 -1.08 0.00 0.00 178.15 177.66 2qbj n LEU 33 N -4.31 0.00 -0.01 2.19 4.77 -1.21 -1.43 117.00 117.01 2qbj n LEU 33 Ca -0.01 0.41 -0.22 0.00 -0.03 0.00 0.00 56.01 56.17 2qbj n LEU 33 Cb 0.25 -0.41 -0.14 0.00 -2.33 0.00 0.00 43.42 40.79 2qbj n LEU 33 CO 0.37 -0.31 -0.56 0.00 -1.33 0.00 0.00 177.39 175.57 2qbj h ALA 34 N 2.30 0.27 0.00 -1.18 0.00 -1.42 0.83 119.26 120.06 2qbj h ALA 34 Ca 0.00 -1.20 -0.15 0.00 0.00 0.00 0.00 54.91 53.55 2qbj h ALA 34 Cb 0.11 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2qbj h ALA 34 CO 0.00 0.97 -0.74 0.00 0.00 0.00 0.00 179.25 179.48 2qbj h ALA 35 N -0.07 0.61 -0.00 0.00 0.00 -1.50 -3.07 119.26 115.23 2qbj h ALA 35 Ca -0.35 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 53.89 2qbj h ALA 35 Cb 1.79 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.47 2qbj h ALA 35 CO 0.03 0.92 -0.21 0.00 0.00 0.00 0.00 179.25 180.00 2qbj n ALA 36 N -2.32 2.96 -2.94 0.00 0.00 -0.51 -4.96 120.51 112.74 2qbj n ALA 36 Ca 0.00 -0.33 -0.12 0.00 0.00 0.00 0.00 53.44 53.00 2qbj n ALA 36 Cb 0.78 -1.23 0.06 0.00 0.00 0.00 0.00 19.45 19.06 2qbj n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qbj n GLY 37 N 1.34 -0.29 3.14 0.00 0.00 -1.13 -4.84 105.19 103.41 2qbj n GLY 37 Ca 0.12 0.07 -0.18 0.00 0.00 0.00 0.00 46.02 46.04 2qbj n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qbj s ILE 38 N -3.27 1.01 0.00 -0.61 -1.09 0.29 -5.02 121.20 112.51 2qbj s ILE 38 Ca 0.11 -1.19 0.00 0.00 -2.23 0.00 0.00 60.65 57.34 2qbj s ILE 38 Cb -0.01 -0.97 0.00 0.00 -1.58 0.00 0.00 42.46 39.89 2qbj s ILE 38 CO 0.53 -0.20 0.00 0.00 -1.23 0.00 0.00 174.94 174.04 2qbj n ALA 39 N 1.45 0.00 0.00 9.38 0.00 -1.26 -4.34 120.51 125.74 2qbj n ALA 39 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 2qbj n ALA 39 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 2qbj n ALA 39 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qbj n GLU 40 N 0.00 2.73 0.11 0.00 1.02 -1.26 -4.56 120.64 118.68 2qbj n GLU 40 Ca 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.11 2qbj n GLU 40 Cb 0.00 -0.90 0.16 0.00 -0.02 0.00 0.00 31.44 30.69 2qbj n GLU 40 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2qbj h ASP 41 N 0.00 0.17 -2.47 1.62 3.45 -1.96 -1.57 116.42 115.66 2qbj h ASP 41 Ca 0.00 -0.09 -0.60 0.00 0.43 0.00 0.00 57.03 56.76 2qbj h ASP 41 Cb 0.61 -0.05 0.09 0.00 -0.56 0.00 0.00 39.33 39.42 2qbj h ASP 41 CO 0.00 0.70 0.43 1.33 -1.57 0.00 0.00 179.24 180.13 2qbj n VAL 42 N -3.89 1.17 -2.84 -1.35 0.24 -1.26 -4.66 118.33 105.74 2qbj n VAL 42 Ca -0.02 -0.29 -0.43 0.00 -2.04 0.00 0.00 64.34 61.56 2qbj n VAL 42 Cb 0.58 -1.22 -0.04 0.00 -1.47 0.00 0.00 33.84 31.69 2qbj n VAL 42 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2qbj s LYS 43 N -0.68 3.77 0.33 7.34 3.01 -1.25 -1.41 119.74 130.85 2qbj s LYS 43 Ca 0.67 0.45 0.13 0.00 -1.01 0.00 0.00 55.97 56.21 2qbj s LYS 43 Cb -0.71 -3.83 1.02 0.00 -1.01 0.00 0.00 37.83 33.30 2qbj s LYS 43 CO 0.53 -0.98 1.69 0.82 0.51 0.00 0.00 175.35 177.92 2qbj h ILE 44 N 5.85 0.38 -0.53 2.17 5.03 -1.87 0.33 117.51 128.88 2qbj h ILE 44 Ca -0.24 -0.14 0.03 0.00 -0.12 0.00 0.00 64.86 64.39 2qbj h ILE 44 Cb 1.08 -0.07 -0.04 0.00 -3.03 0.00 0.00 36.82 34.76 2qbj h ILE 44 CO 0.98 0.08 0.30 0.77 -0.68 0.00 0.00 178.15 179.59 2qbj h SER 45 N 0.41 0.47 1.32 1.72 4.64 -1.86 -1.62 113.55 118.64 2qbj h SER 45 Ca 0.70 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 62.04 2qbj h SER 45 Cb 1.52 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.53 2qbj h SER 45 CO -0.56 0.33 0.00 -1.84 -0.87 0.00 0.00 176.83 173.89 2qbj n GLU 46 N -4.81 0.19 -1.53 4.77 -0.00 0.96 -4.90 120.64 115.32 2qbj n GLU 46 Ca 0.04 0.17 -0.49 0.00 -0.00 0.00 0.00 57.16 56.88 2qbj n GLU 46 Cb 0.10 -1.73 -0.04 0.00 -0.00 0.00 0.00 31.44 29.77 2qbj n GLU 46 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2qbj n LEU 47 N -2.06 0.77 -4.77 -1.84 4.77 -0.03 -4.94 117.00 108.90 2qbj n LEU 47 Ca 0.06 1.15 -0.30 0.00 -0.03 0.00 0.00 56.01 56.89 2qbj n LEU 47 Cb 0.40 -1.13 0.11 0.00 -2.33 0.00 0.00 43.42 40.46 2qbj n LEU 47 CO 0.29 -1.76 0.70 -0.44 -1.33 0.00 0.00 177.39 174.85 2qbj s SER 48 N -0.30 4.16 0.00 -1.43 0.01 -1.26 -4.82 113.70 110.05 2qbj s SER 48 Ca 0.71 1.40 0.00 0.00 1.31 0.00 0.00 55.95 59.37 2qbj s SER 48 Cb -0.90 -2.12 0.00 0.00 0.21 0.00 0.00 66.02 63.21 2qbj s SER 48 CO 0.55 -2.20 0.53 1.21 0.41 0.00 0.00 173.24 173.74 2qbj n GLU 49 N -3.59 0.00 -0.26 12.44 4.07 -1.26 -2.08 120.64 129.97 2qbj n GLU 49 Ca 0.07 0.33 0.23 0.00 -0.06 0.00 0.00 57.16 57.73 2qbj n GLU 49 Cb 0.56 -1.03 0.42 0.00 -0.06 0.00 0.00 31.44 31.33 2qbj n GLU 49 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2qbj n GLY 50 N -0.82 -0.69 0.38 8.31 0.00 -1.26 -0.80 105.19 110.31 2qbj n GLY 50 Ca 0.00 0.67 -0.13 0.00 0.00 0.00 0.00 46.02 46.56 2qbj n GLY 50 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2qbj h GLN 51 N 0.00 -0.60 -0.43 1.61 4.20 -1.78 0.37 115.11 118.48 2qbj h GLN 51 Ca 0.64 0.04 -0.03 0.00 0.06 0.00 0.00 58.65 59.36 2qbj h GLN 51 Cb 1.64 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 29.54 2qbj h GLN 51 CO -0.64 -0.40 0.12 0.97 -0.67 0.00 0.00 178.83 178.20 2qbj h ILE 52 N -0.63 1.19 -0.20 2.54 6.09 -0.69 -2.80 117.51 123.00 2qbj h ILE 52 Ca -0.01 -0.64 0.05 0.00 -1.37 0.00 0.00 64.86 62.88 2qbj h ILE 52 Cb 0.61 0.73 -0.05 0.00 0.47 0.00 0.00 36.82 38.59 2qbj h ILE 52 CO -0.19 0.24 -0.10 0.44 -3.07 0.00 0.00 178.15 175.46 2qbj h ASP 53 N 0.62 -0.35 -0.91 2.19 3.45 -0.06 -1.36 116.42 120.01 2qbj h ASP 53 Ca 0.14 0.08 0.09 0.00 0.43 0.00 0.00 57.03 57.77 2qbj h ASP 53 Cb 0.21 0.19 -0.06 0.00 -0.56 0.00 0.00 39.33 39.11 2qbj h ASP 53 CO -0.01 -0.14 0.59 0.71 -1.57 0.00 0.00 179.24 178.82 2qbj h THR 54 N -0.08 1.00 -0.21 0.35 1.35 -0.03 -1.54 112.91 113.74 2qbj h THR 54 Ca 0.11 -0.33 0.04 0.00 -0.55 0.00 0.00 66.41 65.69 2qbj h THR 54 Cb 0.25 -0.03 -0.04 0.00 -1.73 0.00 0.00 68.15 66.60 2qbj h THR 54 CO -0.26 0.17 -0.05 -0.07 -0.25 0.00 0.00 175.52 175.06 2qbj h LEU 55 N 0.95 -0.19 -0.14 3.87 3.38 -1.17 -2.15 115.31 119.86 2qbj h LEU 55 Ca 0.41 0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.48 2qbj h LEU 55 Cb 0.33 0.13 -0.07 0.00 0.09 0.00 0.00 40.66 41.15 2qbj h LEU 55 CO -0.17 -0.07 -0.51 -0.09 0.09 0.00 0.00 178.44 177.69 2qbj h ARG 56 N 0.00 -0.54 -0.71 1.13 2.43 -0.77 -0.87 114.38 115.05 2qbj h ARG 56 Ca 0.10 0.04 0.13 0.00 -0.81 0.00 0.00 59.98 59.44 2qbj h ARG 56 Cb 0.15 0.12 -0.09 0.00 -0.42 0.00 0.00 29.97 29.74 2qbj h ARG 56 CO -0.22 -0.36 0.25 -0.44 -1.51 0.00 0.00 179.97 177.70 2qbj h ASP 57 N -0.56 0.21 -0.21 -3.80 5.19 -1.26 -0.43 116.42 115.57 2qbj h ASP 57 Ca 0.05 0.11 -0.05 0.00 -0.62 0.00 0.00 57.03 56.51 2qbj h ASP 57 Cb 0.67 0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.27 2qbj h ASP 57 CO -0.43 0.09 -0.06 -0.08 -3.12 0.00 0.00 179.24 175.64 2qbj h GLU 58 N 0.40 0.42 0.00 3.56 4.57 -0.89 -2.82 114.58 119.83 2qbj h GLU 58 Ca 0.38 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.39 2qbj h GLU 58 Cb 0.56 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.13 2qbj h GLU 58 CO -0.39 0.67 0.00 -0.24 -1.18 0.00 0.00 179.01 177.87 2qbj h VAL 59 N 0.14 0.00 0.00 0.32 3.04 -0.84 -2.76 116.25 116.16 2qbj h VAL 59 Ca 0.05 -0.28 0.00 0.00 -1.01 0.00 0.00 66.70 65.47 2qbj h VAL 59 Cb 0.53 1.05 0.00 0.00 -2.01 0.00 0.00 31.29 30.86 2qbj h VAL 59 CO 0.02 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.58 2qbj h ALA 60 N 2.25 1.00 0.01 3.17 0.00 -0.81 -3.15 119.26 121.72 2qbj h ALA 60 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qbj h ALA 60 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2qbj h ALA 60 CO 0.00 0.00 -0.00 0.87 0.00 0.00 0.00 179.25 180.12 2qbj h LYS 61 N 0.00 -0.01 -6.45 0.00 1.79 -1.63 -3.45 116.57 106.82 2qbj h LYS 61 Ca 0.00 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.91 2qbj h LYS 61 Cb 0.09 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 30.78 2qbj h LYS 61 CO 0.00 -0.01 1.05 0.34 -1.08 0.00 0.00 179.45 179.75 2qbj n PHE 62 N -2.32 2.48 -1.71 -1.35 7.35 -1.19 -4.89 117.46 115.84 2qbj n PHE 62 Ca -0.00 -0.04 -0.43 0.00 -0.76 0.00 0.00 57.45 56.22 2qbj n PHE 62 Cb 0.00 -2.68 -0.03 0.00 0.35 0.00 0.00 39.48 37.12 2qbj n PHE 62 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 2qbj n VAL 63 N 4.56 0.08 -4.35 -2.13 0.31 -1.26 -4.95 118.33 110.58 2qbj n VAL 63 Ca 0.19 -0.02 -0.19 0.00 -0.01 0.00 0.00 64.34 64.31 2qbj n VAL 63 Cb 0.34 -1.89 -0.09 0.00 -0.91 0.00 0.00 33.84 31.28 2qbj n VAL 63 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2qbj s VAL 64 N 1.03 0.42 0.00 2.52 -7.23 -1.26 -4.81 120.40 111.07 2qbj s VAL 64 Ca 0.75 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.92 2qbj s VAL 64 Cb -0.54 -2.54 0.00 0.00 0.56 0.00 0.00 36.38 33.86 2qbj s VAL 64 CO 0.34 0.00 0.00 -0.62 -0.31 0.00 0.00 175.10 174.51 2qbj n GLU 65 N -0.58 0.00 0.00 4.82 -0.58 -1.26 -3.09 120.64 119.95 2qbj n GLU 65 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2qbj n GLU 65 Cb 0.65 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.52 2qbj n GLU 65 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qbj n GLY 66 N 0.00 -1.17 0.33 0.62 0.00 -1.26 0.59 105.19 104.31 2qbj n GLY 66 Ca 0.00 0.23 0.26 0.00 0.00 0.00 0.00 46.02 46.51 2qbj n GLY 66 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2qbj h ASP 67 N 0.00 0.20 0.00 1.61 3.32 -1.96 0.54 116.42 120.13 2qbj h ASP 67 Ca 0.00 0.25 0.00 0.00 0.02 0.00 0.00 57.03 57.30 2qbj h ASP 67 Cb 0.00 0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2qbj h ASP 67 CO 0.00 -0.35 0.00 0.18 -1.72 0.00 0.00 179.24 177.35 2qbj n LEU 68 N -5.26 0.27 -0.34 1.55 4.77 0.20 0.70 117.00 118.88 2qbj n LEU 68 Ca 0.33 0.69 0.37 0.00 -0.03 0.00 0.00 56.01 57.37 2qbj n LEU 68 Cb 1.11 -0.37 0.74 0.00 -2.33 0.00 0.00 43.42 42.57 2qbj n LEU 68 CO 0.01 -0.37 1.34 0.03 -1.33 0.00 0.00 177.39 177.07 2qbj h ARG 69 N 0.00 0.00 0.00 3.23 2.47 -0.95 0.52 114.38 119.66 2qbj h ARG 69 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2qbj h ARG 69 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 2qbj h ARG 69 CO 0.00 0.00 0.00 -2.13 0.56 0.00 0.00 179.97 178.40 2qbj n ARG 70 N -4.05 0.00 -0.34 0.04 3.00 0.18 -3.54 116.66 111.96 2qbj n ARG 70 Ca 0.27 0.08 0.22 0.00 -0.00 0.00 0.00 57.85 58.42 2qbj n ARG 70 Cb 1.34 -0.63 0.44 0.00 0.00 0.00 0.00 32.46 33.61 2qbj n ARG 70 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 2qbj h GLU 71 N 0.00 0.41 -0.29 -0.14 4.81 0.54 0.83 114.58 120.74 2qbj h GLU 71 Ca 0.00 -0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.29 2qbj h GLU 71 Cb 0.00 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 2qbj h GLU 71 CO 0.00 0.27 0.23 0.97 -0.73 0.00 0.00 179.01 179.74 2qbj h ILE 72 N 0.42 0.75 -0.14 2.32 2.10 -0.08 0.99 117.51 123.86 2qbj h ILE 72 Ca 0.70 0.00 -0.20 0.00 1.08 0.00 0.00 64.86 66.44 2qbj h ILE 72 Cb 1.52 0.84 0.00 0.00 -1.09 0.00 0.00 36.82 38.09 2qbj h ILE 72 CO -0.56 0.00 -0.72 0.28 -1.08 0.00 0.00 178.15 176.07 2qbj h SER 73 N 0.00 0.77 -0.49 2.19 0.02 0.65 -3.12 113.55 113.56 2qbj h SER 73 Ca 0.14 -0.48 0.07 0.00 -0.84 0.00 0.00 61.79 60.67 2qbj h SER 73 Cb 0.59 -0.23 -0.06 0.00 0.14 0.00 0.00 62.40 62.84 2qbj h SER 73 CO -0.00 1.26 0.16 0.24 -1.14 0.00 0.00 176.83 177.34 2qbj h MET 74 N 0.46 0.32 -0.01 3.45 2.86 -0.66 0.22 114.93 121.56 2qbj h MET 74 Ca -0.03 -0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.61 2qbj h MET 74 Cb 1.32 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 32.87 2qbj h MET 74 CO 0.14 0.21 -0.18 0.66 1.06 0.00 0.00 176.91 178.80 2qbj h SER 75 N 0.33 -0.54 0.27 1.22 4.64 -1.47 0.78 113.55 118.78 2qbj h SER 75 Ca 0.24 0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 61.64 2qbj h SER 75 Cb 0.26 0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.56 2qbj h SER 75 CO -0.26 -0.25 -0.24 0.40 -0.87 0.00 0.00 176.83 175.61 2qbj h ILE 76 N -0.30 0.48 -0.82 0.95 2.04 -1.35 -2.33 117.51 116.18 2qbj h ILE 76 Ca 0.06 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.12 2qbj h ILE 76 Cb 0.37 0.48 -0.14 0.00 -0.74 0.00 0.00 36.82 36.80 2qbj h ILE 76 CO -0.18 0.00 0.11 0.50 0.00 0.00 0.00 178.15 178.58 2qbj h LYS 77 N -0.54 0.15 -0.04 2.37 3.64 -0.23 -2.50 116.57 119.42 2qbj h LYS 77 Ca -0.01 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2qbj h LYS 77 Cb 0.49 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 2qbj h LYS 77 CO -0.04 0.10 -0.05 0.00 -2.27 0.00 0.00 179.45 177.20 2qbj h ARG 78 N 0.16 -0.03 -1.26 1.90 3.08 -0.27 0.32 114.38 118.28 2qbj h ARG 78 Ca 0.48 0.00 0.37 0.00 0.07 0.00 0.00 59.98 60.90 2qbj h ARG 78 Cb 0.90 0.01 -0.10 0.00 0.08 0.00 0.00 29.97 30.86 2qbj h ARG 78 CO -0.66 -0.02 0.84 -0.07 -1.07 0.00 0.00 179.97 178.99 2qbj h LEU 79 N -0.03 0.24 0.05 3.04 3.38 -1.42 0.42 115.31 120.99 2qbj h LEU 79 Ca 0.01 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2qbj h LEU 79 Cb 0.05 0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2qbj h LEU 79 CO -0.05 -0.04 -0.02 0.24 0.09 0.00 0.00 178.44 178.66 2qbj h MET 80 N 0.16 -0.06 -0.16 1.13 2.86 -0.62 -2.07 114.93 116.17 2qbj h MET 80 Ca 0.70 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.35 2qbj h MET 80 Cb 2.26 0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.93 2qbj h MET 80 CO -0.26 -0.04 0.00 -0.40 1.06 0.00 0.00 176.91 177.27 2qbj n ASP 81 N -2.26 0.16 -0.10 1.22 3.85 0.89 -2.28 116.55 118.03 2qbj n ASP 81 Ca -0.01 -0.65 -0.21 0.00 -0.71 0.00 0.00 54.79 53.21 2qbj n ASP 81 Cb 0.03 -0.08 -0.07 0.00 -1.35 0.00 0.00 41.12 39.64 2qbj n ASP 81 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.20 176.08 2qbj n LEU 82 N -0.08 1.56 0.00 -2.12 0.00 0.14 -5.00 117.00 111.50 2qbj n LEU 82 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 56.01 56.28 2qbj n LEU 82 Cb 0.04 -0.64 0.00 0.00 0.00 0.00 0.00 43.42 42.82 2qbj n LEU 82 CO 0.00 0.32 0.00 0.61 0.00 0.00 0.00 177.39 178.32 2qbj n GLY 83 N 1.68 1.51 3.92 -3.96 0.00 -0.79 -5.06 105.19 102.49 2qbj n GLY 83 Ca -0.38 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.36 2qbj n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbj h TYR 85 N 2.21 0.22 0.00 0.00 3.20 -1.99 -1.45 116.97 119.17 2qbj h TYR 85 Ca -0.47 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.45 2qbj h TYR 85 Cb 1.18 0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.50 2qbj h TYR 85 CO 0.56 -0.28 0.00 0.54 -1.64 0.00 0.00 178.16 177.34 2qbj n ARG 86 N -5.31 0.00 -0.22 1.82 1.74 -1.26 -0.97 116.66 112.46 2qbj n ARG 86 Ca 0.22 0.77 0.02 0.00 -0.77 0.00 0.00 57.85 58.08 2qbj n ARG 86 Cb 0.70 -1.46 0.11 0.00 -1.02 0.00 0.00 32.46 30.80 2qbj n ARG 86 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 2qbj h GLY 87 N 0.00 0.68 -0.19 -0.13 0.00 -1.48 0.24 103.07 102.19 2qbj h GLY 87 Ca 0.00 0.10 0.27 0.00 0.00 0.00 0.00 47.33 47.70 2qbj h GLY 87 CO 0.00 -0.22 0.65 1.41 0.00 0.00 0.00 176.54 178.38 2qbj h LEU 88 N 0.10 0.51 -1.31 3.11 3.38 -0.74 0.58 115.31 120.95 2qbj h LEU 88 Ca 0.34 0.10 -0.07 0.00 0.09 0.00 0.00 57.88 58.35 2qbj h LEU 88 Cb 0.56 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2qbj h LEU 88 CO -0.57 0.08 -0.33 0.03 0.09 0.00 0.00 178.44 177.73 2qbj h ARG 89 N 0.44 0.00 0.04 1.13 2.47 0.13 -2.84 114.38 115.75 2qbj h ARG 89 Ca 0.62 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 59.34 2qbj h ARG 89 Cb 1.47 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.79 2qbj h ARG 89 CO -0.37 0.33 -0.02 0.45 0.56 0.00 0.00 179.97 180.93 2qbj h HIS 90 N 0.00 -0.05 -0.35 3.04 3.86 0.36 0.20 115.15 122.21 2qbj h HIS 90 Ca -0.00 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 2qbj h HIS 90 Cb 0.64 0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.11 2qbj h HIS 90 CO 0.00 0.59 0.19 0.07 0.86 0.00 0.00 177.93 179.64 2qbj h ARG 91 N -0.79 0.48 0.00 2.45 -0.00 -1.49 0.14 114.38 115.16 2qbj h ARG 91 Ca -0.01 -0.04 0.00 0.00 -0.00 0.00 0.00 59.98 59.93 2qbj h ARG 91 Cb 0.66 -0.10 0.00 0.00 -0.00 0.00 0.00 29.97 30.53 2qbj h ARG 91 CO 0.01 0.35 -0.16 0.54 -0.00 0.00 0.00 179.97 180.71 2qbj n ARG 92 N -4.45 0.04 -1.24 0.08 5.12 -1.07 -4.92 116.66 110.23 2qbj n ARG 92 Ca 0.02 0.03 -0.08 0.00 -1.93 0.00 0.00 57.85 55.89 2qbj n ARG 92 Cb 0.09 -1.54 -0.03 0.00 -1.16 0.00 0.00 32.46 29.82 2qbj n ARG 92 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qbj n GLY 93 N 1.47 0.99 3.95 -0.13 0.00 0.03 -5.02 105.19 106.49 2qbj n GLY 93 Ca 0.06 -0.49 -0.23 0.00 0.00 0.00 0.00 46.02 45.36 2qbj n GLY 93 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qbj s LEU 94 N -1.85 4.16 -0.02 0.99 1.43 0.61 -3.23 118.68 120.79 2qbj s LEU 94 Ca 0.00 0.28 -0.32 0.00 -1.03 0.00 0.00 54.13 53.06 2qbj s LEU 94 Cb 0.00 -3.11 -0.11 0.00 0.03 0.00 0.00 46.19 43.01 2qbj s LEU 94 CO 0.00 -0.18 1.92 -0.81 0.23 0.00 0.00 176.35 177.51 2qbj n PRO 95 N -1.53 2.53 0.13 1.29 -0.04 -1.26 -4.39 135.00 131.72 2qbj n PRO 95 Ca -0.07 0.93 -0.22 0.00 -0.04 0.00 0.00 63.50 64.10 2qbj n PRO 95 Cb 0.56 -2.82 -0.15 0.00 -0.04 0.00 0.00 33.50 31.05 2qbj n PRO 95 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2qbj h VAL 96 N 5.47 1.34 0.00 0.52 2.07 -1.90 -3.20 116.25 120.54 2qbj h VAL 96 Ca -0.49 -2.77 0.00 0.00 0.82 0.00 0.00 66.70 64.26 2qbj h VAL 96 Cb 1.25 2.98 0.00 0.00 -1.52 0.00 0.00 31.29 34.00 2qbj h VAL 96 CO 0.94 0.82 0.00 0.54 0.02 0.00 0.00 177.57 179.90 2qbj n ARG 97 N -3.68 0.00 -1.76 1.57 3.00 -1.26 -4.84 116.66 109.70 2qbj n ARG 97 Ca -0.14 0.28 -0.01 0.00 -0.01 0.00 0.00 57.85 57.97 2qbj n ARG 97 Cb 1.07 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 32.03 2qbj n ARG 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2qbj n GLY 98 N -1.26 -0.64 0.00 -0.13 0.00 -1.21 -5.11 105.19 96.85 2qbj n GLY 98 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2qbj n GLY 98 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qbj n GLN 99 N -0.79 2.90 -3.33 1.61 3.00 -1.26 -5.08 117.38 114.43 2qbj n GLN 99 Ca 0.01 0.00 -0.45 0.00 -0.01 0.00 0.00 57.00 56.55 2qbj n GLN 99 Cb 0.29 0.00 -0.06 0.00 0.00 0.00 0.00 30.24 30.46 2qbj n GLN 99 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.06 176.08 2qbj s ARG 100 N 0.80 3.00 0.39 -1.09 1.70 -1.26 -4.91 118.95 117.58 2qbj s ARG 100 Ca 0.00 -1.42 0.21 0.00 -0.47 0.00 0.00 55.73 54.05 2qbj s ARG 100 Cb 0.00 -4.19 0.52 0.00 -0.57 0.00 0.00 34.95 30.71 2qbj s ARG 100 CO 0.00 -1.17 1.65 1.79 -1.08 0.00 0.00 175.30 176.49 2qbj h THR 101 N 5.82 0.51 -0.01 4.99 1.35 -1.98 -3.13 112.91 120.46 2qbj h THR 101 Ca -0.29 -1.46 0.00 0.00 -0.55 0.00 0.00 66.41 64.12 2qbj h THR 101 Cb 1.10 2.04 -0.00 0.00 -1.73 0.00 0.00 68.15 69.56 2qbj h THR 101 CO 0.95 0.26 0.15 0.07 -0.25 0.00 0.00 175.52 176.70 2qbj h LYS 102 N 0.00 0.00 -1.66 4.72 2.10 -2.06 -3.43 116.57 116.25 2qbj h LYS 102 Ca -0.00 0.00 0.05 0.00 -2.00 0.00 0.00 60.65 58.69 2qbj h LYS 102 Cb 1.02 0.00 -0.23 0.00 -0.90 0.00 0.00 32.23 32.12 2qbj h LYS 102 CO 0.03 0.00 0.45 0.95 -2.00 0.00 0.00 179.45 178.88 2qbj s THR 103 N -4.15 0.00 -0.13 0.07 -4.23 -1.18 -5.10 115.64 100.92 2qbj s THR 103 Ca -0.04 0.00 -0.09 0.00 -1.18 0.00 0.00 61.69 60.38 2qbj s THR 103 Cb 0.11 -1.00 0.03 0.00 1.34 0.00 0.00 72.50 72.99 2qbj s THR 103 CO 0.36 0.00 0.18 0.59 -0.54 0.00 0.00 174.62 175.21 2qbj n ASN 104 N 1.17 -1.32 -0.05 3.99 4.13 -1.26 -4.66 115.26 117.27 2qbj n ASN 104 Ca -0.12 1.08 0.00 0.00 1.68 0.00 0.00 54.58 57.22 2qbj n ASN 104 Cb 0.57 -4.31 0.00 0.00 -1.54 0.00 0.00 39.78 34.50 2qbj n ASN 104 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2qbj n ALA 105 N 1.34 0.63 -0.14 5.41 0.00 -1.26 -4.68 120.51 121.81 2qbj n ALA 105 Ca -0.30 0.00 0.28 0.00 0.00 0.00 0.00 53.44 53.41 2qbj n ALA 105 Cb 0.47 0.00 0.72 0.00 0.00 0.00 0.00 19.45 20.64 2qbj n ALA 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qbj h ARG 106 N 0.00 0.00 0.02 0.00 2.47 -1.80 0.21 114.38 115.28 2qbj h ARG 106 Ca 0.00 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.64 2qbj h ARG 106 Cb 0.53 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.86 2qbj h ARG 106 CO 0.00 0.00 -0.32 1.15 0.56 0.00 0.00 179.97 181.36 2qbj h THR 107 N 0.00 1.57 0.50 2.04 2.02 -1.94 -3.38 112.91 113.73 2qbj h THR 107 Ca 0.40 -2.11 -0.02 0.00 0.77 0.00 0.00 66.41 65.44 2qbj h THR 107 Cb 1.73 2.92 0.00 0.00 -1.74 0.00 0.00 68.15 71.07 2qbj h THR 107 CO -0.00 0.58 -0.24 -0.09 0.37 0.00 0.00 175.52 176.13 2qbj h ARG 108 N -0.53 -0.65 -6.51 6.66 9.65 -1.45 -3.46 114.38 118.08 2qbj h ARG 108 Ca -0.05 0.04 -0.47 0.00 -1.10 0.00 0.00 59.98 58.41 2qbj h ARG 108 Cb 1.12 0.15 0.02 0.00 -1.39 0.00 0.00 29.97 29.87 2qbj h ARG 108 CO 0.06 -0.37 -0.18 -1.59 2.80 0.00 0.00 179.97 180.69 2qbj s LYS 109 N -4.16 2.50 0.98 0.20 -2.85 0.59 -4.79 119.74 112.21 2qbj s LYS 109 Ca -0.12 -1.51 -0.13 0.00 -1.00 0.00 0.00 55.97 53.21 2qbj s LYS 109 Cb 0.01 -2.65 0.09 0.00 -2.06 0.00 0.00 37.83 33.22 2qbj s LYS 109 CO 0.39 -0.60 0.58 0.41 0.10 0.00 0.00 175.35 176.23 2qbj n GLY 110 N -2.04 -1.67 0.00 0.59 0.00 -1.26 -4.32 105.19 96.48 2qbj n GLY 110 Ca 0.11 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.36 2qbj n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qbj n PRO 111 N -2.59 0.00 -2.61 1.61 -0.04 -1.26 -4.55 135.00 125.56 2qbj n PRO 111 Ca 0.07 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.11 2qbj n PRO 111 Cb 0.54 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.97 2qbj n PRO 111 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2qbj s ARG 112 N 0.00 3.38 0.00 0.54 1.81 -1.26 -4.89 118.95 118.53 2qbj s ARG 112 Ca 0.00 -0.00 0.23 0.00 -1.72 0.00 0.00 55.73 54.24 2qbj s ARG 112 Cb 0.00 -4.08 0.18 0.00 -0.45 0.00 0.00 34.95 30.60 2qbj s ARG 112 CO 0.00 -1.81 1.22 1.63 -0.68 0.00 0.00 175.30 175.66