#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbh h ARG 2 N 0.00 0.14 0.00 0.00 -0.00 -1.66 -3.23 114.38 109.63 2qbh h ARG 2 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.47 2qbh h ARG 2 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 29.97 29.94 2qbh h ARG 2 CO 0.00 0.09 0.00 -0.89 0.00 0.00 0.00 179.97 179.17 2qbh n ILE 3 N -5.12 0.00 0.00 2.04 5.41 -1.26 -3.05 119.36 117.38 2qbh n ILE 3 Ca 0.01 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.76 2qbh n ILE 3 Cb 0.15 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.08 2qbh n ILE 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2qbh n ALA 4 N 1.53 0.00 -3.49 -1.39 0.00 -1.26 -4.86 120.51 111.04 2qbh n ALA 4 Ca 0.00 -0.04 -0.28 0.00 0.00 0.00 0.00 53.44 53.12 2qbh n ALA 4 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 2qbh n ALA 4 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2qbh s GLY 5 N -1.40 1.31 0.00 0.00 0.00 -1.17 -4.95 107.32 101.11 2qbh s GLY 5 Ca 0.00 -2.43 0.00 0.00 0.00 0.00 0.00 44.72 42.29 2qbh s GLY 5 CO 0.00 1.95 0.00 1.39 0.00 0.00 0.00 173.10 176.44 2qbh n ILE 6 N 3.18 0.00 -0.70 0.90 5.41 -1.23 -4.90 119.36 122.02 2qbh n ILE 6 Ca 0.22 0.00 -0.29 0.00 1.00 0.00 0.00 62.75 63.67 2qbh n ILE 6 Cb 0.42 0.00 -0.05 0.00 -0.71 0.00 0.00 39.64 39.30 2qbh n ILE 6 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2qbh n ASN 7 N 1.94 0.46 -3.19 4.38 5.03 -1.24 -3.34 115.26 119.30 2qbh n ASN 7 Ca 0.00 0.44 -0.32 0.00 0.87 0.00 0.00 54.58 55.57 2qbh n ASN 7 Cb 0.00 -0.41 -0.02 0.00 -1.02 0.00 0.00 39.78 38.33 2qbh n ASN 7 CO 0.00 0.00 0.00 2.30 -1.83 0.00 0.00 177.26 177.73 2qbh n ILE 8 N 2.34 4.15 -1.90 2.41 -5.35 -1.22 -3.85 119.36 115.95 2qbh n ILE 8 Ca 0.19 -5.73 -0.23 0.00 -0.27 0.00 0.00 62.75 56.72 2qbh n ILE 8 Cb -0.02 -1.46 -0.06 0.00 -1.74 0.00 0.00 39.64 36.35 2qbh n ILE 8 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2qbh s PRO 9 N -3.77 2.17 0.44 6.28 0.04 -1.26 -4.53 135.00 134.38 2qbh s PRO 9 Ca 0.45 -0.36 0.00 0.00 0.04 0.00 0.00 61.00 61.13 2qbh s PRO 9 Cb 0.25 -5.04 0.00 0.00 0.04 0.00 0.00 34.50 29.75 2qbh s PRO 9 CO -0.13 -4.02 0.02 -0.25 0.04 0.00 0.00 177.00 172.66 2qbh n ASP 10 N 15.77 3.18 -3.00 6.66 8.00 -1.26 -4.67 116.55 141.23 2qbh n ASP 10 Ca 0.43 -2.91 -0.22 0.00 0.71 0.00 0.00 54.79 52.80 2qbh n ASP 10 Cb 0.46 0.29 0.03 0.00 -0.02 0.00 0.00 41.12 41.88 2qbh n ASP 10 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2qbh n HIS 11 N -1.13 -1.88 -2.23 1.24 8.25 -1.26 -4.82 115.22 113.39 2qbh n HIS 11 Ca -0.17 0.47 0.00 0.00 -0.26 0.00 0.00 57.72 57.76 2qbh n HIS 11 Cb 0.56 -4.30 0.00 0.00 1.12 0.00 0.00 29.99 27.37 2qbh n HIS 11 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2qbh n LYS 12 N -3.92 0.00 -3.99 -0.41 4.76 -1.26 -5.01 118.16 108.33 2qbh n LYS 12 Ca -0.12 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 54.98 2qbh n LYS 12 Cb 0.62 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.75 2qbh n LYS 12 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 2qbh s HIS 13 N -0.38 3.45 0.08 2.13 3.76 -1.26 -3.51 115.29 119.56 2qbh s HIS 13 Ca 0.00 0.34 -0.16 0.00 -0.15 0.00 0.00 55.06 55.09 2qbh s HIS 13 Cb 0.00 -1.82 -0.04 0.00 1.11 0.00 0.00 32.58 31.83 2qbh s HIS 13 CO 0.00 0.63 1.13 0.00 -0.85 0.00 0.00 174.74 175.65 2qbh n ALA 14 N 1.33 -0.33 -1.00 -1.40 0.00 -0.50 -0.90 120.51 117.71 2qbh n ALA 14 Ca -0.14 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.74 2qbh n ALA 14 Cb 0.53 0.09 0.00 0.00 0.00 0.00 0.00 19.45 20.08 2qbh n ALA 14 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2qbh n VAL 15 N -4.20 0.00 -0.15 0.00 0.31 -1.26 -1.19 118.33 111.85 2qbh n VAL 15 Ca 0.01 0.47 0.02 0.00 -0.01 0.00 0.00 64.34 64.83 2qbh n VAL 15 Cb 0.14 -1.36 0.05 0.00 -0.91 0.00 0.00 33.84 31.76 2qbh n VAL 15 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qbh n ILE 16 N 0.00 -0.17 0.25 2.52 3.06 -1.23 0.11 119.36 123.90 2qbh n ILE 16 Ca 0.00 0.92 -0.16 0.00 -2.50 0.00 0.00 62.75 61.02 2qbh n ILE 16 Cb 0.00 -1.28 -0.08 0.00 0.54 0.00 0.00 39.64 38.82 2qbh n ILE 16 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2qbh h ALA 17 N 0.80 -0.61 -0.84 1.51 0.00 -1.07 -2.45 119.26 116.60 2qbh h ALA 17 Ca 0.19 -0.13 0.18 0.00 0.00 0.00 0.00 54.91 55.15 2qbh h ALA 17 Cb 0.29 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 2qbh h ALA 17 CO -0.41 -0.85 0.56 1.25 0.00 0.00 0.00 179.25 179.79 2qbh h LEU 18 N -0.61 0.40 -1.22 0.00 6.46 0.23 0.40 115.31 120.97 2qbh h LEU 18 Ca -0.05 0.03 0.00 0.00 -0.12 0.00 0.00 57.88 57.74 2qbh h LEU 18 Cb 0.49 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.37 2qbh h LEU 18 CO 0.07 0.18 0.14 0.35 -0.62 0.00 0.00 178.44 178.56 2qbh n THR 19 N -4.49 0.82 0.06 1.05 -2.24 -0.66 -0.89 114.28 107.92 2qbh n THR 19 Ca 0.17 0.75 0.03 0.00 -2.27 0.00 0.00 64.05 62.73 2qbh n THR 19 Cb 0.62 -1.75 0.17 0.00 -2.10 0.00 0.00 70.33 67.27 2qbh n THR 19 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2qbh n SER 20 N -2.19 0.16 -4.71 3.42 7.64 0.14 -4.57 113.62 113.52 2qbh n SER 20 Ca -0.01 0.57 -0.42 0.00 1.01 0.00 0.00 58.87 60.02 2qbh n SER 20 Cb 0.17 -0.59 -0.03 0.00 -1.01 0.00 0.00 64.21 62.74 2qbh n SER 20 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2qbh s ILE 21 N -3.15 4.00 -0.03 0.44 1.01 -0.07 -4.88 121.20 118.52 2qbh s ILE 21 Ca -0.00 1.42 0.07 0.00 0.00 0.00 0.00 60.65 62.13 2qbh s ILE 21 Cb 0.02 -3.91 0.07 0.00 0.01 0.00 0.00 42.46 38.65 2qbh s ILE 21 CO 0.06 0.08 1.04 -1.22 0.00 0.00 0.00 174.94 174.90 2qbh n TYR 22 N 4.31 0.24 -0.25 3.97 0.53 -1.26 -1.40 117.16 123.30 2qbh n TYR 22 Ca 0.10 0.13 0.00 0.00 -1.02 0.00 0.00 57.90 57.10 2qbh n TYR 22 Cb 0.46 -0.42 0.00 0.00 -1.03 0.00 0.00 39.34 38.35 2qbh n TYR 22 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2qbh n GLY 23 N -1.25 1.30 3.13 2.72 0.00 -1.26 -4.61 105.19 105.21 2qbh n GLY 23 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 2qbh n GLY 23 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qbh s VAL 24 N -0.69 1.45 0.48 1.61 -7.23 -0.49 -4.94 120.40 110.58 2qbh s VAL 24 Ca 0.00 -0.72 0.01 0.00 -1.81 0.00 0.00 61.98 59.46 2qbh s VAL 24 Cb 0.00 -1.26 0.01 0.00 0.56 0.00 0.00 36.38 35.69 2qbh s VAL 24 CO 0.00 0.42 0.08 0.61 -0.31 0.00 0.00 175.10 175.90 2qbh n GLY 25 N 3.25 3.43 0.37 2.32 0.00 -1.26 -4.49 105.19 108.81 2qbh n GLY 25 Ca -0.19 -2.35 0.32 0.00 0.00 0.00 0.00 46.02 43.81 2qbh n GLY 25 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qbh n LYS 26 N -1.28 -0.03 0.05 1.61 4.76 -1.26 -0.25 118.16 121.75 2qbh n LYS 26 Ca -0.16 1.07 -0.03 0.00 -2.87 0.00 0.00 58.31 56.33 2qbh n LYS 26 Cb 0.59 -2.07 -0.01 0.00 -1.84 0.00 0.00 35.03 31.70 2qbh n LYS 26 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 2qbh h THR 27 N 0.00 0.00 -0.61 -0.18 2.02 -1.99 -2.94 112.91 109.21 2qbh h THR 27 Ca 0.73 -0.49 0.08 0.00 0.77 0.00 0.00 66.41 67.51 2qbh h THR 27 Cb 2.27 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 68.64 2qbh h THR 27 CO -0.44 0.00 0.41 -0.09 0.37 0.00 0.00 175.52 175.76 2qbh h ARG 28 N -0.68 0.48 0.04 6.66 1.12 -1.63 -0.75 114.38 119.62 2qbh h ARG 28 Ca -0.02 -0.03 -0.00 0.00 -1.11 0.00 0.00 59.98 58.82 2qbh h ARG 28 Cb 0.15 -0.11 0.00 0.00 -0.01 0.00 0.00 29.97 30.00 2qbh h ARG 28 CO 0.03 0.32 -0.02 1.03 -3.11 0.00 0.00 179.97 178.22 2qbh h SER 29 N 0.50 -0.05 1.08 -3.80 0.87 -0.76 -1.03 113.55 110.37 2qbh h SER 29 Ca 0.28 -0.38 -0.03 0.00 -1.23 0.00 0.00 61.79 60.43 2qbh h SER 29 Cb 0.44 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.41 2qbh h SER 29 CO -0.08 0.36 -0.12 0.50 -0.53 0.00 0.00 176.83 176.95 2qbh h LYS 30 N -0.46 0.00 0.21 2.24 3.64 -1.30 -3.19 116.57 117.71 2qbh h LYS 30 Ca -0.01 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.05 2qbh h LYS 30 Cb 0.42 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.27 2qbh h LYS 30 CO 0.01 0.12 -1.53 0.00 -2.27 0.00 0.00 179.45 175.78 2qbh h ALA 31 N 1.88 -0.01 -0.23 5.00 0.00 -1.11 -3.34 119.26 121.45 2qbh h ALA 31 Ca -0.00 -0.98 -0.02 0.00 0.00 0.00 0.00 54.91 53.92 2qbh h ALA 31 Cb 0.70 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 2qbh h ALA 31 CO 0.02 0.81 0.07 0.97 0.00 0.00 0.00 179.25 181.11 2qbh h ILE 32 N 0.05 1.11 0.00 0.00 2.10 -1.18 -0.59 117.51 119.00 2qbh h ILE 32 Ca -0.29 -0.36 0.00 0.00 1.08 0.00 0.00 64.86 65.29 2qbh h ILE 32 Cb 2.07 0.87 0.00 0.00 -1.09 0.00 0.00 36.82 38.67 2qbh h ILE 32 CO 0.21 0.13 0.00 0.18 -1.08 0.00 0.00 178.15 177.59 2qbh n LEU 33 N -4.42 0.00 0.00 2.19 4.77 -1.21 -1.45 117.00 116.88 2qbh n LEU 33 Ca 0.00 0.34 -0.22 0.00 -0.03 0.00 0.00 56.01 56.11 2qbh n LEU 33 Cb 0.14 -0.34 -0.14 0.00 -2.33 0.00 0.00 43.42 40.75 2qbh n LEU 33 CO 0.36 -0.26 -0.77 0.00 -1.33 0.00 0.00 177.39 175.39 2qbh h ALA 34 N 2.32 0.41 0.00 -1.18 0.00 -1.28 0.67 119.26 120.21 2qbh h ALA 34 Ca 0.00 -1.37 -0.19 0.00 0.00 0.00 0.00 54.91 53.35 2qbh h ALA 34 Cb 0.08 0.70 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 2qbh h ALA 34 CO 0.00 1.25 -0.91 0.00 0.00 0.00 0.00 179.25 179.59 2qbh h ALA 35 N 0.04 0.42 -0.00 0.00 0.00 -1.45 -3.16 119.26 115.11 2qbh h ALA 35 Ca -0.41 -0.83 0.00 0.00 0.00 0.00 0.00 54.91 53.67 2qbh h ALA 35 Cb 1.99 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.63 2qbh h ALA 35 CO 0.07 1.14 -0.26 0.00 0.00 0.00 0.00 179.25 180.20 2qbh n ALA 36 N -2.33 3.02 -2.73 0.00 0.00 -0.53 -4.96 120.51 112.98 2qbh n ALA 36 Ca 0.00 -0.28 -0.09 0.00 0.00 0.00 0.00 53.44 53.07 2qbh n ALA 36 Cb 0.90 -1.25 0.05 0.00 0.00 0.00 0.00 19.45 19.14 2qbh n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qbh n GLY 37 N 1.43 -0.09 3.18 0.00 0.00 -1.15 -4.85 105.19 103.70 2qbh n GLY 37 Ca 0.09 -0.05 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 2qbh n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qbh s ILE 38 N -3.21 1.13 0.00 -0.61 -1.09 0.23 -5.02 121.20 112.64 2qbh s ILE 38 Ca 0.07 -1.35 0.00 0.00 -2.23 0.00 0.00 60.65 57.14 2qbh s ILE 38 Cb -0.01 -1.12 0.00 0.00 -1.58 0.00 0.00 42.46 39.75 2qbh s ILE 38 CO 0.42 -0.25 0.00 0.00 -1.23 0.00 0.00 174.94 173.88 2qbh n ALA 39 N 1.20 0.00 0.00 9.38 0.00 -1.26 -4.35 120.51 125.47 2qbh n ALA 39 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 2qbh n ALA 39 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 2qbh n ALA 39 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qbh n GLU 40 N 0.00 2.85 0.07 0.00 1.02 -1.26 -4.55 120.64 118.76 2qbh n GLU 40 Ca 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.09 2qbh n GLU 40 Cb 0.00 -0.91 0.14 0.00 -0.02 0.00 0.00 31.44 30.64 2qbh n GLU 40 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2qbh h ASP 41 N 0.00 0.34 -2.27 1.62 3.45 -1.96 -1.50 116.42 116.10 2qbh h ASP 41 Ca 0.00 -0.17 -0.62 0.00 0.43 0.00 0.00 57.03 56.67 2qbh h ASP 41 Cb 0.66 -0.10 0.09 0.00 -0.56 0.00 0.00 39.33 39.42 2qbh h ASP 41 CO 0.00 0.81 0.35 1.33 -1.57 0.00 0.00 179.24 180.15 2qbh n VAL 42 N -3.94 1.13 -2.84 -1.35 0.24 -1.26 -4.64 118.33 105.67 2qbh n VAL 42 Ca -0.02 -0.28 -0.43 0.00 -2.04 0.00 0.00 64.34 61.57 2qbh n VAL 42 Cb 0.57 -1.06 -0.04 0.00 -1.47 0.00 0.00 33.84 31.84 2qbh n VAL 42 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2qbh s LYS 43 N -0.63 3.73 0.33 7.34 3.01 -1.25 -1.40 119.74 130.86 2qbh s LYS 43 Ca 0.69 0.40 0.11 0.00 -1.01 0.00 0.00 55.97 56.16 2qbh s LYS 43 Cb -0.76 -3.84 0.98 0.00 -1.01 0.00 0.00 37.83 33.20 2qbh s LYS 43 CO 0.53 -1.01 1.67 0.82 0.51 0.00 0.00 175.35 177.87 2qbh h ILE 44 N 5.88 0.33 -0.60 2.17 5.03 -1.87 0.40 117.51 128.86 2qbh h ILE 44 Ca -0.24 -0.11 0.05 0.00 -0.12 0.00 0.00 64.86 64.44 2qbh h ILE 44 Cb 1.08 -0.03 -0.05 0.00 -3.03 0.00 0.00 36.82 34.80 2qbh h ILE 44 CO 0.98 0.06 0.33 0.77 -0.68 0.00 0.00 178.15 179.61 2qbh h SER 45 N 0.33 0.50 1.37 1.72 4.64 -1.86 -1.34 113.55 118.91 2qbh h SER 45 Ca 0.68 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 62.03 2qbh h SER 45 Cb 1.50 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.51 2qbh h SER 45 CO -0.60 0.34 0.00 -1.84 -0.87 0.00 0.00 176.83 173.85 2qbh n GLU 46 N -4.81 0.21 -1.53 4.77 -0.00 0.12 -4.90 120.64 114.51 2qbh n GLU 46 Ca 0.06 0.17 -0.49 0.00 -0.00 0.00 0.00 57.16 56.90 2qbh n GLU 46 Cb 0.14 -1.74 -0.04 0.00 -0.00 0.00 0.00 31.44 29.80 2qbh n GLU 46 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2qbh n LEU 47 N -2.10 0.68 -4.76 -1.84 4.77 -0.03 -4.94 117.00 108.78 2qbh n LEU 47 Ca 0.06 1.15 -0.30 0.00 -0.03 0.00 0.00 56.01 56.89 2qbh n LEU 47 Cb 0.41 -1.12 0.12 0.00 -2.33 0.00 0.00 43.42 40.50 2qbh n LEU 47 CO 0.29 -1.81 0.69 -0.44 -1.33 0.00 0.00 177.39 174.79 2qbh s SER 48 N -0.34 3.84 0.00 -1.43 0.01 -1.26 -4.82 113.70 109.71 2qbh s SER 48 Ca 0.71 1.30 0.00 0.00 1.31 0.00 0.00 55.95 59.27 2qbh s SER 48 Cb -0.91 -1.99 0.00 0.00 0.21 0.00 0.00 66.02 63.34 2qbh s SER 48 CO 0.55 -2.38 0.55 1.21 0.41 0.00 0.00 173.24 173.58 2qbh n GLU 49 N -3.70 0.00 -0.27 12.44 4.07 -1.26 -2.17 120.64 129.75 2qbh n GLU 49 Ca 0.07 0.33 0.27 0.00 -0.06 0.00 0.00 57.16 57.76 2qbh n GLU 49 Cb 0.56 -1.05 0.49 0.00 -0.06 0.00 0.00 31.44 31.39 2qbh n GLU 49 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2qbh n GLY 50 N -0.80 -0.65 0.38 8.31 0.00 -1.26 -0.91 105.19 110.26 2qbh n GLY 50 Ca 0.00 0.69 -0.13 0.00 0.00 0.00 0.00 46.02 46.58 2qbh n GLY 50 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2qbh h GLN 51 N 0.00 -0.64 -0.34 1.61 4.20 -1.80 0.37 115.11 118.51 2qbh h GLN 51 Ca 0.71 0.04 -0.04 0.00 0.06 0.00 0.00 58.65 59.43 2qbh h GLN 51 Cb 1.87 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 29.78 2qbh h GLN 51 CO -0.66 -0.43 0.05 0.97 -0.67 0.00 0.00 178.83 178.10 2qbh h ILE 52 N -0.66 1.18 -0.01 2.54 6.09 -0.75 -2.87 117.51 123.02 2qbh h ILE 52 Ca -0.02 -0.66 0.03 0.00 -1.37 0.00 0.00 64.86 62.84 2qbh h ILE 52 Cb 0.63 0.86 -0.04 0.00 0.47 0.00 0.00 36.82 38.74 2qbh h ILE 52 CO -0.16 0.23 -0.19 0.44 -3.07 0.00 0.00 178.15 175.41 2qbh h ASP 53 N 0.50 -0.55 -0.91 2.19 3.45 -0.11 -1.64 116.42 119.36 2qbh h ASP 53 Ca 0.11 0.08 0.13 0.00 0.43 0.00 0.00 57.03 57.78 2qbh h ASP 53 Cb 0.25 0.23 -0.07 0.00 -0.56 0.00 0.00 39.33 39.17 2qbh h ASP 53 CO 0.00 -0.25 0.59 0.71 -1.57 0.00 0.00 179.24 178.72 2qbh h THR 54 N -0.30 0.89 -0.20 0.35 1.35 -0.07 -1.01 112.91 113.92 2qbh h THR 54 Ca 0.06 -0.28 0.04 0.00 -0.55 0.00 0.00 66.41 65.68 2qbh h THR 54 Cb 0.37 0.01 -0.04 0.00 -1.73 0.00 0.00 68.15 66.77 2qbh h THR 54 CO -0.18 0.15 -0.06 -0.07 -0.25 0.00 0.00 175.52 175.11 2qbh h LEU 55 N 0.81 -0.22 -0.13 3.87 3.38 -1.22 -2.20 115.31 119.60 2qbh h LEU 55 Ca 0.45 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.52 2qbh h LEU 55 Cb 0.59 0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.41 2qbh h LEU 55 CO -0.21 -0.08 -0.52 -0.09 0.09 0.00 0.00 178.44 177.63 2qbh h ARG 56 N -0.02 -0.55 -0.71 1.13 2.43 -0.72 -0.93 114.38 115.01 2qbh h ARG 56 Ca 0.10 0.04 0.14 0.00 -0.81 0.00 0.00 59.98 59.44 2qbh h ARG 56 Cb 0.17 0.13 -0.10 0.00 -0.42 0.00 0.00 29.97 29.75 2qbh h ARG 56 CO -0.21 -0.37 0.23 -0.44 -1.51 0.00 0.00 179.97 177.67 2qbh h ASP 57 N -0.57 0.15 -0.20 -3.80 5.19 -1.26 -0.43 116.42 115.51 2qbh h ASP 57 Ca 0.04 0.12 -0.05 0.00 -0.62 0.00 0.00 57.03 56.52 2qbh h ASP 57 Cb 0.68 0.13 -0.01 0.00 0.18 0.00 0.00 39.33 40.31 2qbh h ASP 57 CO -0.43 0.05 -0.06 -0.08 -3.12 0.00 0.00 179.24 175.60 2qbh h GLU 58 N 0.36 0.39 0.00 3.56 4.57 -0.89 -2.81 114.58 119.76 2qbh h GLU 58 Ca 0.39 -0.16 0.00 0.00 -1.18 0.00 0.00 59.36 58.41 2qbh h GLU 58 Cb 0.60 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 2qbh h GLU 58 CO -0.42 0.65 0.00 1.55 -1.18 0.00 0.00 179.01 179.61 2qbh n VAL 59 N -4.61 0.83 0.32 0.32 3.14 -0.40 -2.46 118.33 115.48 2qbh n VAL 59 Ca -0.05 0.22 0.21 0.00 -2.96 0.00 0.00 64.34 61.77 2qbh n VAL 59 Cb 0.29 -1.14 1.08 0.00 -1.06 0.00 0.00 33.84 33.01 2qbh n VAL 59 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2qbh h ALA 60 N 2.29 1.00 0.00 1.55 0.00 -0.80 -3.18 119.26 120.11 2qbh h ALA 60 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qbh h ALA 60 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2qbh h ALA 60 CO 0.00 0.00 -0.00 0.87 0.00 0.00 0.00 179.25 180.12 2qbh h LYS 61 N 0.00 -0.00 -6.46 0.00 1.79 -1.62 -3.45 116.57 106.83 2qbh h LYS 61 Ca 0.00 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 57.90 2qbh h LYS 61 Cb 0.12 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 30.82 2qbh h LYS 61 CO 0.00 -0.00 0.98 0.34 -1.08 0.00 0.00 179.45 179.68 2qbh n PHE 62 N -2.05 2.42 -1.74 -1.35 7.35 -1.20 -4.89 117.46 116.01 2qbh n PHE 62 Ca -0.00 0.06 -0.42 0.00 -0.76 0.00 0.00 57.45 56.34 2qbh n PHE 62 Cb 0.00 -2.64 -0.03 0.00 0.35 0.00 0.00 39.48 37.17 2qbh n PHE 62 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 2qbh s VAL 63 N 2.23 2.02 0.28 -2.13 1.01 -1.26 -4.95 120.40 117.60 2qbh s VAL 63 Ca 0.83 0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.85 2qbh s VAL 63 Cb -0.61 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 32.71 2qbh s VAL 63 CO 0.41 0.00 0.14 0.68 0.00 0.00 0.00 175.10 176.33 2qbh s VAL 64 N 0.88 0.34 0.00 2.92 -7.23 -1.26 -4.81 120.40 111.25 2qbh s VAL 64 Ca 0.72 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.89 2qbh s VAL 64 Cb -0.49 -2.54 0.00 0.00 0.56 0.00 0.00 36.38 33.90 2qbh s VAL 64 CO 0.36 0.00 0.00 -0.62 -0.31 0.00 0.00 175.10 174.53 2qbh n GLU 65 N -0.51 0.00 0.00 4.82 -0.58 -1.26 -3.10 120.64 120.01 2qbh n GLU 65 Ca 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 2qbh n GLU 65 Cb 0.65 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.52 2qbh n GLU 65 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qbh n GLY 66 N 0.00 -1.25 0.33 0.62 0.00 -1.26 0.53 105.19 104.15 2qbh n GLY 66 Ca 0.00 0.24 0.25 0.00 0.00 0.00 0.00 46.02 46.51 2qbh n GLY 66 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2qbh h ASP 67 N 0.00 0.19 0.00 1.61 3.32 -1.96 0.55 116.42 120.14 2qbh h ASP 67 Ca 0.00 0.24 0.00 0.00 0.02 0.00 0.00 57.03 57.29 2qbh h ASP 67 Cb 0.00 0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2qbh h ASP 67 CO 0.00 -0.32 0.00 0.18 -1.72 0.00 0.00 179.24 177.38 2qbh n LEU 68 N -5.25 0.22 -0.35 1.55 4.77 0.19 0.70 117.00 118.83 2qbh n LEU 68 Ca 0.32 0.72 0.37 0.00 -0.03 0.00 0.00 56.01 57.39 2qbh n LEU 68 Cb 1.06 -0.39 0.75 0.00 -2.33 0.00 0.00 43.42 42.51 2qbh n LEU 68 CO 0.02 -0.39 1.34 0.03 -1.33 0.00 0.00 177.39 177.06 2qbh h ARG 69 N 0.00 0.00 0.00 3.23 2.47 -0.96 0.58 114.38 119.70 2qbh h ARG 69 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2qbh h ARG 69 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 2qbh h ARG 69 CO 0.00 0.00 0.00 -2.13 0.56 0.00 0.00 179.97 178.40 2qbh n ARG 70 N -4.11 0.00 -0.35 0.04 3.00 0.19 -3.48 116.66 111.96 2qbh n ARG 70 Ca 0.27 0.09 0.23 0.00 -0.00 0.00 0.00 57.85 58.44 2qbh n ARG 70 Cb 1.32 -0.65 0.48 0.00 0.00 0.00 0.00 32.46 33.62 2qbh n ARG 70 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 2qbh h GLU 71 N 0.00 0.38 -0.12 -0.14 4.81 0.53 0.83 114.58 120.88 2qbh h GLU 71 Ca 0.00 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.24 2qbh h GLU 71 Cb 0.00 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.29 2qbh h GLU 71 CO 0.00 0.25 0.10 0.97 -0.73 0.00 0.00 179.01 179.60 2qbh h ILE 72 N 0.39 0.73 -0.05 2.32 2.10 0.03 0.31 117.51 123.34 2qbh h ILE 72 Ca 0.68 0.00 -0.21 0.00 1.08 0.00 0.00 64.86 66.40 2qbh h ILE 72 Cb 1.60 0.92 0.00 0.00 -1.09 0.00 0.00 36.82 38.26 2qbh h ILE 72 CO -0.45 0.00 -0.84 0.28 -1.08 0.00 0.00 178.15 176.06 2qbh h SER 73 N 0.00 0.61 -0.46 2.19 0.02 0.67 -3.15 113.55 113.42 2qbh h SER 73 Ca 0.06 -0.44 0.06 0.00 -0.84 0.00 0.00 61.79 60.63 2qbh h SER 73 Cb 0.26 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 62.57 2qbh h SER 73 CO -0.00 1.21 0.17 0.24 -1.14 0.00 0.00 176.83 177.31 2qbh h MET 74 N 0.31 0.34 -0.06 3.45 2.86 -0.78 0.19 114.93 121.24 2qbh h MET 74 Ca -0.06 -0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.59 2qbh h MET 74 Cb 1.46 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 33.00 2qbh h MET 74 CO 0.15 0.22 -0.14 0.66 1.06 0.00 0.00 176.91 178.86 2qbh h SER 75 N 0.35 -0.43 0.29 1.22 4.64 -1.50 0.84 113.55 118.95 2qbh h SER 75 Ca 0.21 0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 61.60 2qbh h SER 75 Cb 0.21 0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 2qbh h SER 75 CO -0.21 -0.20 -0.23 0.40 -0.87 0.00 0.00 176.83 175.72 2qbh h ILE 76 N -0.21 0.50 -0.83 0.95 2.04 -1.39 -2.34 117.51 116.23 2qbh h ILE 76 Ca 0.07 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.13 2qbh h ILE 76 Cb 0.31 0.50 -0.13 0.00 -0.74 0.00 0.00 36.82 36.76 2qbh h ILE 76 CO -0.18 0.00 0.20 0.50 0.00 0.00 0.00 178.15 178.66 2qbh h LYS 77 N -0.53 0.21 -0.05 2.37 3.64 -0.29 -2.51 116.57 119.41 2qbh h LYS 77 Ca -0.02 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2qbh h LYS 77 Cb 0.47 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 2qbh h LYS 77 CO -0.02 0.14 -0.08 0.00 -2.27 0.00 0.00 179.45 177.23 2qbh h ARG 78 N 0.22 -0.05 -1.21 1.90 3.08 -0.27 0.32 114.38 118.37 2qbh h ARG 78 Ca 0.50 0.00 0.35 0.00 0.07 0.00 0.00 59.98 60.91 2qbh h ARG 78 Cb 0.96 0.01 -0.10 0.00 0.08 0.00 0.00 29.97 30.92 2qbh h ARG 78 CO -0.62 -0.04 0.80 -0.07 -1.07 0.00 0.00 179.97 178.98 2qbh h LEU 79 N -0.06 0.27 0.07 3.04 3.38 -1.42 0.35 115.31 120.94 2qbh h LEU 79 Ca 0.01 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2qbh h LEU 79 Cb 0.08 0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2qbh h LEU 79 CO -0.08 -0.02 -0.03 0.24 0.09 0.00 0.00 178.44 178.63 2qbh h MET 80 N 0.20 -0.09 -0.20 1.13 2.86 -0.69 -2.02 114.93 116.11 2qbh h MET 80 Ca 0.68 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 58.33 2qbh h MET 80 Cb 2.11 0.02 0.00 0.00 0.06 0.00 0.00 31.60 33.80 2qbh h MET 80 CO -0.26 -0.06 0.00 -0.40 1.06 0.00 0.00 176.91 177.24 2qbh n ASP 81 N -2.37 0.20 -0.09 1.22 3.85 0.92 -2.29 116.55 117.98 2qbh n ASP 81 Ca -0.01 -0.68 -0.20 0.00 -0.71 0.00 0.00 54.79 53.19 2qbh n ASP 81 Cb 0.04 -0.10 -0.07 0.00 -1.35 0.00 0.00 41.12 39.64 2qbh n ASP 81 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.20 176.08 2qbh n LEU 82 N -0.01 1.44 0.00 -2.12 0.00 0.11 -5.00 117.00 111.43 2qbh n LEU 82 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 56.01 56.26 2qbh n LEU 82 Cb 0.05 -0.59 0.00 0.00 0.00 0.00 0.00 43.42 42.88 2qbh n LEU 82 CO 0.00 0.31 0.00 0.61 0.00 0.00 0.00 177.39 178.31 2qbh n GLY 83 N 1.79 1.47 3.91 -3.96 0.00 -0.78 -5.06 105.19 102.56 2qbh n GLY 83 Ca -0.36 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.38 2qbh n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbh h TYR 85 N 1.97 0.46 0.00 0.00 3.20 -1.99 -1.52 116.97 119.09 2qbh h TYR 85 Ca -0.48 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.44 2qbh h TYR 85 Cb 1.19 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 39.40 2qbh h TYR 85 CO 0.57 -0.20 0.00 0.54 -1.64 0.00 0.00 178.16 177.43 2qbh n ARG 86 N -5.19 0.00 -0.21 1.82 1.74 -1.26 -1.07 116.66 112.48 2qbh n ARG 86 Ca 0.23 0.77 0.02 0.00 -0.77 0.00 0.00 57.85 58.10 2qbh n ARG 86 Cb 0.74 -1.48 0.11 0.00 -1.02 0.00 0.00 32.46 30.81 2qbh n ARG 86 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 2qbh h GLY 87 N 0.00 0.70 -0.18 -0.13 0.00 -1.50 0.22 103.07 102.18 2qbh h GLY 87 Ca 0.00 0.08 0.27 0.00 0.00 0.00 0.00 47.33 47.68 2qbh h GLY 87 CO 0.00 -0.21 0.66 1.41 0.00 0.00 0.00 176.54 178.40 2qbh h LEU 88 N 0.13 0.48 -1.28 3.11 3.38 -0.83 0.60 115.31 120.90 2qbh h LEU 88 Ca 0.34 0.10 -0.07 0.00 0.09 0.00 0.00 57.88 58.34 2qbh h LEU 88 Cb 0.56 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2qbh h LEU 88 CO -0.55 0.08 -0.34 0.03 0.09 0.00 0.00 178.44 177.75 2qbh h ARG 89 N 0.42 0.00 0.05 1.13 2.47 0.11 -2.85 114.38 115.70 2qbh h ARG 89 Ca 0.62 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 59.33 2qbh h ARG 89 Cb 1.50 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.82 2qbh h ARG 89 CO -0.34 0.34 -0.02 0.45 0.56 0.00 0.00 179.97 180.95 2qbh h HIS 90 N 0.00 -0.06 -0.36 3.04 3.86 0.39 0.18 115.15 122.20 2qbh h HIS 90 Ca -0.00 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 2qbh h HIS 90 Cb 0.67 0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.15 2qbh h HIS 90 CO 0.00 0.58 0.20 0.07 0.86 0.00 0.00 177.93 179.64 2qbh h ARG 91 N -0.82 0.49 0.00 2.45 -0.00 -1.50 0.09 114.38 115.10 2qbh h ARG 91 Ca -0.01 -0.04 0.00 0.00 -0.00 0.00 0.00 59.98 59.93 2qbh h ARG 91 Cb 0.66 -0.10 0.00 0.00 -0.00 0.00 0.00 29.97 30.53 2qbh h ARG 91 CO 0.01 0.36 -0.14 0.54 -0.00 0.00 0.00 179.97 180.75 2qbh n ARG 92 N -4.44 0.04 -1.21 0.08 5.12 -1.08 -4.92 116.66 110.25 2qbh n ARG 92 Ca 0.02 0.03 -0.07 0.00 -1.93 0.00 0.00 57.85 55.90 2qbh n ARG 92 Cb 0.10 -1.54 -0.03 0.00 -1.16 0.00 0.00 32.46 29.82 2qbh n ARG 92 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qbh n GLY 93 N 1.47 0.91 3.95 -0.13 0.00 0.02 -5.02 105.19 106.39 2qbh n GLY 93 Ca 0.06 -0.44 -0.24 0.00 0.00 0.00 0.00 46.02 45.40 2qbh n GLY 93 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qbh s LEU 94 N -1.63 4.13 -0.01 0.99 1.43 0.56 -3.25 118.68 120.89 2qbh s LEU 94 Ca 0.00 0.35 -0.32 0.00 -1.03 0.00 0.00 54.13 53.13 2qbh s LEU 94 Cb 0.00 -3.18 -0.11 0.00 0.03 0.00 0.00 46.19 42.94 2qbh s LEU 94 CO 0.00 -0.20 1.91 -0.81 0.23 0.00 0.00 176.35 177.48 2qbh n PRO 95 N -1.50 2.52 0.13 1.29 -0.04 -1.26 -4.39 135.00 131.75 2qbh n PRO 95 Ca -0.06 0.92 -0.22 0.00 -0.04 0.00 0.00 63.50 64.10 2qbh n PRO 95 Cb 0.56 -2.82 -0.15 0.00 -0.04 0.00 0.00 33.50 31.05 2qbh n PRO 95 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2qbh h VAL 96 N 5.39 1.34 0.00 0.52 2.07 -1.90 -3.20 116.25 120.46 2qbh h VAL 96 Ca -0.49 -2.77 0.00 0.00 0.82 0.00 0.00 66.70 64.27 2qbh h VAL 96 Cb 1.25 2.98 0.00 0.00 -1.52 0.00 0.00 31.29 34.01 2qbh h VAL 96 CO 0.94 0.82 0.00 0.54 0.02 0.00 0.00 177.57 179.90 2qbh n ARG 97 N -3.68 0.01 -1.82 1.57 3.00 -1.26 -4.84 116.66 109.64 2qbh n ARG 97 Ca -0.14 0.22 -0.01 0.00 -0.01 0.00 0.00 57.85 57.91 2qbh n ARG 97 Cb 1.07 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 32.03 2qbh n ARG 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2qbh n GLY 98 N -1.16 -0.68 0.00 -0.13 0.00 -1.21 -5.10 105.19 96.91 2qbh n GLY 98 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2qbh n GLY 98 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qbh n GLN 99 N -0.79 2.59 -3.28 1.61 3.00 -1.26 -5.08 117.38 114.17 2qbh n GLN 99 Ca 0.01 0.00 -0.45 0.00 -0.01 0.00 0.00 57.00 56.56 2qbh n GLN 99 Cb 0.29 0.00 -0.06 0.00 0.00 0.00 0.00 30.24 30.46 2qbh n GLN 99 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.06 176.08 2qbh s ARG 100 N 0.12 3.03 0.37 -1.09 1.70 -1.26 -4.91 118.95 116.91 2qbh s ARG 100 Ca 0.00 -1.28 0.20 0.00 -0.47 0.00 0.00 55.73 54.18 2qbh s ARG 100 Cb 0.00 -4.17 0.44 0.00 -0.57 0.00 0.00 34.95 30.65 2qbh s ARG 100 CO 0.00 -1.20 1.62 1.79 -1.08 0.00 0.00 175.30 176.43 2qbh h THR 101 N 5.83 0.61 -0.00 4.99 1.35 -1.98 -3.14 112.91 120.57 2qbh h THR 101 Ca -0.29 -1.61 0.00 0.00 -0.55 0.00 0.00 66.41 63.96 2qbh h THR 101 Cb 1.10 2.11 -0.00 0.00 -1.73 0.00 0.00 68.15 69.63 2qbh h THR 101 CO 0.96 0.31 0.18 0.07 -0.25 0.00 0.00 175.52 176.79 2qbh h LYS 102 N 0.00 0.00 -1.63 4.72 2.10 -2.06 -3.42 116.57 116.28 2qbh h LYS 102 Ca -0.00 0.00 0.06 0.00 -2.00 0.00 0.00 60.65 58.70 2qbh h LYS 102 Cb 1.08 0.00 -0.23 0.00 -0.90 0.00 0.00 32.23 32.18 2qbh h LYS 102 CO 0.04 0.00 0.47 0.95 -2.00 0.00 0.00 179.45 178.91 2qbh s THR 103 N -4.12 0.00 -0.15 0.07 -4.23 -1.19 -5.10 115.64 100.92 2qbh s THR 103 Ca -0.04 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.39 2qbh s THR 103 Cb 0.11 -1.00 0.03 0.00 1.34 0.00 0.00 72.50 72.98 2qbh s THR 103 CO 0.33 0.00 0.16 0.59 -0.54 0.00 0.00 174.62 175.16 2qbh n ASN 104 N 1.19 -1.64 -0.07 3.99 4.13 -1.26 -4.66 115.26 116.94 2qbh n ASN 104 Ca -0.12 1.01 0.00 0.00 1.68 0.00 0.00 54.58 57.15 2qbh n ASN 104 Cb 0.57 -4.17 0.00 0.00 -1.54 0.00 0.00 39.78 34.64 2qbh n ASN 104 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2qbh n ALA 105 N 1.14 0.79 -0.15 5.41 0.00 -1.26 -4.69 120.51 121.75 2qbh n ALA 105 Ca -0.27 0.00 0.28 0.00 0.00 0.00 0.00 53.44 53.45 2qbh n ALA 105 Cb 0.41 0.00 0.72 0.00 0.00 0.00 0.00 19.45 20.58 2qbh n ALA 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qbh h ARG 106 N 0.00 0.00 0.02 0.00 2.47 -1.80 0.25 114.38 115.31 2qbh h ARG 106 Ca 0.00 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.66 2qbh h ARG 106 Cb 0.66 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.98 2qbh h ARG 106 CO 0.00 0.00 -0.25 1.15 0.56 0.00 0.00 179.97 181.43 2qbh h THR 107 N 0.00 1.60 0.49 2.04 2.02 -1.93 -3.38 112.91 113.75 2qbh h THR 107 Ca 0.40 -2.09 -0.02 0.00 0.77 0.00 0.00 66.41 65.47 2qbh h THR 107 Cb 1.72 2.95 0.00 0.00 -1.74 0.00 0.00 68.15 71.08 2qbh h THR 107 CO -0.00 0.57 -0.24 -0.09 0.37 0.00 0.00 175.52 176.12 2qbh h ARG 108 N -0.61 -0.64 -6.43 6.66 9.65 -1.49 -3.46 114.38 118.07 2qbh h ARG 108 Ca -0.04 0.04 -0.47 0.00 -1.10 0.00 0.00 59.98 58.42 2qbh h ARG 108 Cb 1.06 0.14 0.01 0.00 -1.39 0.00 0.00 29.97 29.80 2qbh h ARG 108 CO 0.05 -0.34 -0.22 -1.59 2.80 0.00 0.00 179.97 180.66 2qbh s LYS 109 N -4.33 2.54 0.97 0.20 -2.85 0.73 -4.79 119.74 112.21 2qbh s LYS 109 Ca -0.13 -1.50 -0.13 0.00 -1.00 0.00 0.00 55.97 53.21 2qbh s LYS 109 Cb 0.01 -2.60 0.06 0.00 -2.06 0.00 0.00 37.83 33.25 2qbh s LYS 109 CO 0.43 -0.50 0.48 0.41 0.10 0.00 0.00 175.35 176.26 2qbh n GLY 110 N -1.94 -1.85 0.00 0.59 0.00 -1.26 -4.29 105.19 96.44 2qbh n GLY 110 Ca 0.09 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.35 2qbh n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qbh n PRO 111 N -2.14 0.00 -2.76 1.61 -0.04 -1.26 -4.54 135.00 125.86 2qbh n PRO 111 Ca 0.07 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.10 2qbh n PRO 111 Cb 0.54 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.97 2qbh n PRO 111 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2qbh s ARG 112 N 0.00 3.99 -0.58 0.54 1.81 -1.26 -4.88 118.95 118.57 2qbh s ARG 112 Ca 0.00 0.84 0.06 0.00 -1.72 0.00 0.00 55.73 54.90 2qbh s ARG 112 Cb 0.00 -3.75 0.32 0.00 -0.45 0.00 0.00 34.95 31.08 2qbh s ARG 112 CO 0.00 -0.85 0.90 1.17 -0.68 0.00 0.00 175.30 175.84 2qbh n LYS 113 N 6.66 2.97 0.00 3.54 4.81 -1.26 -5.27 118.16 129.61 2qbh n LYS 113 Ca 0.09 -4.73 0.07 0.00 -0.87 0.00 0.00 58.31 52.86 2qbh n LYS 113 Cb 0.48 -2.20 0.42 0.00 0.02 0.00 0.00 35.03 33.75 2qbh n LYS 113 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22