#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbh n GLN 2 N 0.00 0.41 -2.11 1.61 3.00 -1.26 -5.11 117.38 113.92 2qbh n GLN 2 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2qbh n GLN 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 2qbh n GLN 2 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 2qbh n LYS 3 N 0.00 -5.04 -2.95 -1.09 5.02 -1.26 -4.97 118.16 107.87 2qbh n LYS 3 Ca 0.00 3.65 -0.34 0.00 -2.02 0.00 0.00 58.31 59.60 2qbh n LYS 3 Cb 0.00 -4.22 -0.07 0.00 -0.02 0.00 0.00 35.03 30.73 2qbh n LYS 3 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qbh s VAL 4 N -0.52 4.49 -0.29 -0.18 0.11 -1.26 -4.94 120.40 117.80 2qbh s VAL 4 Ca 0.00 1.32 -0.32 0.00 -2.93 0.00 0.00 61.98 60.04 2qbh s VAL 4 Cb 0.00 -3.67 -0.09 0.00 -1.53 0.00 0.00 36.38 31.09 2qbh s VAL 4 CO 0.00 -0.17 2.20 1.57 -3.33 0.00 0.00 175.10 175.37 2qbh n HIS 5 N -0.28 1.76 0.15 1.54 -0.00 -1.26 -4.82 115.22 112.31 2qbh n HIS 5 Ca 0.04 0.11 0.15 0.00 0.46 0.00 0.00 57.72 58.48 2qbh n HIS 5 Cb 0.53 -2.61 0.70 0.00 -0.12 0.00 0.00 29.99 28.49 2qbh n HIS 5 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2qbh h PRO 6 N 13.45 0.00 0.13 1.57 0.13 -1.92 0.61 132.00 145.97 2qbh h PRO 6 Ca -0.33 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.50 2qbh h PRO 6 Cb 1.29 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.42 2qbh h PRO 6 CO 0.99 0.00 -1.47 -0.97 -0.23 0.00 0.00 178.00 176.32 2qbh h ASN 7 N 0.00 0.43 -0.12 1.44 -1.24 -1.87 -3.21 115.58 111.01 2qbh h ASN 7 Ca 0.11 -0.55 -0.09 0.00 0.71 0.00 0.00 56.30 56.48 2qbh h ASN 7 Cb 0.47 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 39.39 2qbh h ASN 7 CO -0.00 1.45 -0.27 1.23 -1.29 0.00 0.00 177.43 178.55 2qbh h GLY 8 N 1.55 0.42 2.00 1.57 0.00 -1.76 -2.83 103.07 104.03 2qbh h GLY 8 Ca -0.22 -0.52 0.00 0.00 0.00 0.00 0.00 47.33 46.59 2qbh h GLY 8 CO 0.18 0.46 0.00 4.51 0.00 0.00 0.00 176.54 181.69 2qbh n ILE 9 N -4.44 1.08 -0.88 2.60 0.13 0.14 -1.22 119.36 116.76 2qbh n ILE 9 Ca -0.07 0.50 0.08 0.00 -1.10 0.00 0.00 62.75 62.16 2qbh n ILE 9 Cb 0.46 -1.45 0.26 0.00 -0.84 0.00 0.00 39.64 38.07 2qbh n ILE 9 CO 0.00 0.00 0.00 0.54 2.80 0.00 0.00 176.55 179.89 2qbh n ARG 10 N -2.10 3.12 0.21 9.51 1.74 -1.09 -4.58 116.66 123.46 2qbh n ARG 10 Ca 0.00 -2.78 0.15 0.00 -0.77 0.00 0.00 57.85 54.45 2qbh n ARG 10 Cb 0.11 -1.82 0.67 0.00 -1.02 0.00 0.00 32.46 30.40 2qbh n ARG 10 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2qbh h LEU 11 N 2.09 0.00 0.02 0.55 3.38 -0.93 -2.84 115.31 117.57 2qbh h LEU 11 Ca 0.00 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.67 2qbh h LEU 11 Cb 1.41 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.12 2qbh h LEU 11 CO 0.22 0.00 -1.71 1.23 0.09 0.00 0.00 178.44 178.27 2qbh h GLY 12 N 1.43 0.05 -2.78 0.83 0.00 -1.81 -3.44 103.07 97.35 2qbh h GLY 12 Ca 0.00 -0.12 -0.14 0.00 0.00 0.00 0.00 47.33 47.07 2qbh h GLY 12 CO 0.00 0.10 -0.45 -0.26 0.00 0.00 0.00 176.54 175.93 2qbh s ILE 13 N -2.60 0.08 0.00 2.60 -0.00 -1.08 -4.88 121.20 115.32 2qbh s ILE 13 Ca -0.07 -1.61 0.00 0.00 -0.00 0.00 0.00 60.65 58.97 2qbh s ILE 13 Cb 0.08 -1.95 0.00 0.00 -0.00 0.00 0.00 42.46 40.59 2qbh s ILE 13 CO 0.82 -0.35 0.00 1.33 -0.00 0.00 0.00 174.94 176.74 2qbh n VAL 14 N -0.17 0.00 -3.76 8.37 0.24 -1.26 -4.73 118.33 117.02 2qbh n VAL 14 Ca -0.06 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 62.02 2qbh n VAL 14 Cb 0.63 -0.05 -0.18 0.00 -1.47 0.00 0.00 33.84 32.78 2qbh n VAL 14 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2qbh s LYS 15 N -0.09 0.36 0.39 7.34 3.01 -1.20 -4.74 119.74 124.81 2qbh s LYS 15 Ca 0.00 0.19 -0.20 0.00 -1.01 0.00 0.00 55.97 54.96 2qbh s LYS 15 Cb 0.00 -0.77 -0.10 0.00 -1.01 0.00 0.00 37.83 35.95 2qbh s LYS 15 CO 0.00 -0.29 0.88 -1.25 0.51 0.00 0.00 175.35 175.20 2qbh s PRO 16 N 1.93 4.19 1.13 -1.68 0.04 -1.26 -4.51 135.00 134.84 2qbh s PRO 16 Ca 0.03 1.00 -0.19 0.00 0.04 0.00 0.00 61.00 61.88 2qbh s PRO 16 Cb -0.12 -2.31 0.28 0.00 0.04 0.00 0.00 34.50 32.39 2qbh s PRO 16 CO -0.04 0.05 0.90 0.91 0.04 0.00 0.00 177.00 178.86 2qbh n TRP 17 N -0.45 -3.72 -0.08 0.56 8.01 -1.26 -5.01 117.44 115.49 2qbh n TRP 17 Ca 0.05 -0.82 0.00 0.00 -1.31 0.00 0.00 57.50 55.42 2qbh n TRP 17 Cb 0.53 -1.02 0.00 0.00 -2.01 0.00 0.00 31.31 28.82 2qbh n TRP 17 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.69 176.77 2qbh n ASN 18 N -4.86 0.25 -3.01 -0.99 4.13 -1.26 -4.84 115.26 104.67 2qbh n ASN 18 Ca 0.13 -0.58 -0.15 0.00 1.68 0.00 0.00 54.58 55.66 2qbh n ASN 18 Cb 0.51 0.50 0.01 0.00 -1.54 0.00 0.00 39.78 39.26 2qbh n ASN 18 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2qbh n SER 19 N -0.50 -0.56 -4.58 6.41 7.64 -1.26 -0.49 113.62 120.28 2qbh n SER 19 Ca 0.00 -3.22 -0.42 0.00 1.01 0.00 0.00 58.87 56.24 2qbh n SER 19 Cb 0.02 0.39 -0.03 0.00 -1.01 0.00 0.00 64.21 63.58 2qbh n SER 19 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2qbh s THR 20 N -1.17 4.06 -0.29 0.44 -1.32 -1.25 -4.95 115.64 111.16 2qbh s THR 20 Ca 0.33 0.86 -0.24 0.00 -1.21 0.00 0.00 61.69 61.44 2qbh s THR 20 Cb 0.30 -4.70 0.14 0.00 -1.51 0.00 0.00 72.50 66.72 2qbh s THR 20 CO -0.09 -1.30 1.09 -1.66 -2.21 0.00 0.00 174.62 170.46 2qbh s TRP 21 N 4.83 -0.41 0.43 9.09 1.48 -1.26 -4.36 118.94 128.73 2qbh s TRP 21 Ca 0.42 0.97 -0.20 0.00 -1.06 0.00 0.00 56.10 56.24 2qbh s TRP 21 Cb -0.08 0.37 -0.10 0.00 -1.16 0.00 0.00 33.47 32.50 2qbh s TRP 21 CO 0.25 -0.20 0.93 0.12 -4.06 0.00 0.00 176.95 173.99 2qbh s PHE 22 N 0.37 3.34 -0.29 1.66 5.36 -1.26 -5.01 117.98 122.15 2qbh s PHE 22 Ca 0.02 1.54 -0.16 0.00 -0.96 0.00 0.00 56.93 57.37 2qbh s PHE 22 Cb -0.05 -2.80 0.14 0.00 -0.34 0.00 0.00 43.02 39.97 2qbh s PHE 22 CO -0.09 -0.12 0.93 0.00 -1.46 0.00 0.00 175.22 174.47 2qbh s ALA 23 N -2.22 -2.29 0.53 11.12 0.00 -1.26 -5.05 121.76 122.60 2qbh s ALA 23 Ca 0.61 2.22 -0.21 0.00 0.00 0.00 0.00 51.96 54.57 2qbh s ALA 23 Cb -0.09 -1.73 -0.06 0.00 0.00 0.00 0.00 23.12 21.24 2qbh s ALA 23 CO 0.16 -0.48 1.20 -0.80 0.00 0.00 0.00 175.76 175.84 2qbh s ASN 24 N 1.63 5.65 0.52 0.00 -0.87 -1.26 -4.70 114.94 115.92 2qbh s ASN 24 Ca -0.08 2.37 0.44 0.00 -1.57 0.00 0.00 52.86 54.02 2qbh s ASN 24 Cb -0.05 -2.60 1.65 0.00 -0.02 0.00 0.00 41.25 40.24 2qbh s ASN 24 CO -0.16 -1.28 1.59 0.74 -2.57 0.00 0.00 177.10 175.43 2qbh h THR 25 N 1.38 0.04 0.39 1.60 2.02 -2.01 -2.05 112.91 114.27 2qbh h THR 25 Ca -0.50 -0.00 -0.01 0.00 0.77 0.00 0.00 66.41 66.67 2qbh h THR 25 Cb 1.27 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 2qbh h THR 25 CO 0.58 0.00 -0.46 0.07 0.37 0.00 0.00 175.52 176.08 2qbh h LYS 26 N 0.01 -0.83 -0.04 6.66 2.10 -2.05 -3.27 116.57 119.14 2qbh h LYS 26 Ca 0.90 0.06 0.00 0.00 -2.00 0.00 0.00 60.65 59.60 2qbh h LYS 26 Cb 3.39 0.19 0.00 0.00 -0.90 0.00 0.00 32.23 34.91 2qbh h LYS 26 CO -0.14 -0.55 0.00 -0.85 -2.00 0.00 0.00 179.45 175.90 2qbh n GLU 27 N -5.17 2.07 -0.01 0.07 -0.00 -0.98 -4.53 120.64 112.08 2qbh n GLU 27 Ca -0.10 -1.82 -0.10 0.00 -0.00 0.00 0.00 57.16 55.13 2qbh n GLU 27 Cb 0.41 -1.42 -0.04 0.00 -0.00 0.00 0.00 31.44 30.38 2qbh n GLU 27 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 2qbh h PHE 28 N 4.33 -0.88 -0.80 -1.84 -0.00 -1.44 0.52 116.94 116.82 2qbh h PHE 28 Ca 0.00 0.04 0.19 0.00 -0.00 0.00 0.00 57.97 58.20 2qbh h PHE 28 Cb 0.92 0.41 -0.14 0.00 -0.00 0.00 0.00 35.95 37.15 2qbh h PHE 28 CO 0.01 -0.39 0.08 0.00 -0.00 0.00 0.00 178.31 178.00 2qbh h ALA 29 N 0.47 0.95 -0.16 2.41 0.00 -1.80 -0.12 119.26 121.01 2qbh h ALA 29 Ca 0.11 0.24 -0.06 0.00 0.00 0.00 0.00 54.91 55.19 2qbh h ALA 29 Cb 0.54 0.39 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 2qbh h ALA 29 CO -0.38 -0.43 -0.14 -0.44 0.00 0.00 0.00 179.25 177.86 2qbh h ASP 30 N 0.14 0.41 -1.00 0.00 3.45 -1.42 -3.21 116.42 114.78 2qbh h ASP 30 Ca 0.46 -0.46 0.23 0.00 0.43 0.00 0.00 57.03 57.69 2qbh h ASP 30 Cb 0.85 -0.11 -0.10 0.00 -0.56 0.00 0.00 39.33 39.41 2qbh h ASP 30 CO -0.67 0.78 0.63 0.78 -1.57 0.00 0.00 179.24 179.19 2qbh h ASN 31 N 0.03 0.60 -0.63 6.45 4.21 0.18 0.57 115.58 126.99 2qbh h ASN 31 Ca 0.03 0.09 -0.04 0.00 1.21 0.00 0.00 56.30 57.59 2qbh h ASN 31 Cb 0.66 -0.01 -0.03 0.00 -1.12 0.00 0.00 38.32 37.82 2qbh h ASN 31 CO 0.04 0.16 0.24 -0.07 -1.29 0.00 0.00 177.43 176.50 2qbh h LEU 32 N 0.55 0.89 -0.27 1.61 3.38 -1.36 -2.38 115.31 117.73 2qbh h LEU 32 Ca 0.59 -0.18 0.06 0.00 0.09 0.00 0.00 57.88 58.44 2qbh h LEU 32 Cb 1.22 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 41.66 2qbh h LEU 32 CO -0.35 0.83 -0.32 -0.78 0.09 0.00 0.00 178.44 177.91 2qbh h ASP 33 N 0.89 -1.04 -0.35 -0.43 -0.00 -0.95 0.11 116.42 114.65 2qbh h ASP 33 Ca 0.21 0.17 0.05 0.00 -0.00 0.00 0.00 57.03 57.45 2qbh h ASP 33 Cb 0.23 0.46 -0.04 0.00 -0.00 0.00 0.00 39.33 39.98 2qbh h ASP 33 CO -0.01 -0.34 0.10 0.77 -0.00 0.00 0.00 179.24 179.76 2qbh h SER 34 N -0.32 0.08 -1.03 2.28 4.64 -1.41 0.50 113.55 118.28 2qbh h SER 34 Ca 0.13 0.05 0.26 0.00 -0.47 0.00 0.00 61.79 61.76 2qbh h SER 34 Cb 0.54 0.05 -0.09 0.00 -0.31 0.00 0.00 62.40 62.58 2qbh h SER 34 CO -0.44 0.08 0.67 0.44 -0.87 0.00 0.00 176.83 176.70 2qbh h ASP 35 N 0.24 0.44 0.08 4.97 5.19 -0.61 -0.35 116.42 126.38 2qbh h ASP 35 Ca 0.16 0.08 -0.00 0.00 -0.62 0.00 0.00 57.03 56.65 2qbh h ASP 35 Cb 0.16 0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.68 2qbh h ASP 35 CO -0.19 0.09 -0.04 0.15 -3.12 0.00 0.00 179.24 176.14 2qbh h PHE 36 N 0.39 -0.10 -0.65 4.55 3.57 0.17 -3.15 116.94 121.73 2qbh h PHE 36 Ca 0.59 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 62.22 2qbh h PHE 36 Cb 1.49 0.03 -0.10 0.00 2.79 0.00 0.00 35.95 40.16 2qbh h PHE 36 CO -0.00 0.36 0.10 0.87 -2.23 0.00 0.00 178.31 177.41 2qbh h LYS 37 N -0.95 0.20 -0.08 1.11 1.57 0.78 -2.28 116.57 116.92 2qbh h LYS 37 Ca -0.01 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 2qbh h LYS 37 Cb 0.51 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.77 2qbh h LYS 37 CO 0.02 0.14 0.03 -0.39 -0.57 0.00 0.00 179.45 178.67 2qbh h VAL 38 N 0.21 1.15 0.03 0.50 -1.51 -1.25 -2.38 116.25 113.01 2qbh h VAL 38 Ca 0.35 -0.46 0.03 0.00 -1.23 0.00 0.00 66.70 65.39 2qbh h VAL 38 Cb 0.57 1.31 -0.05 0.00 -2.13 0.00 0.00 31.29 30.98 2qbh h VAL 38 CO -0.48 0.13 -0.34 0.03 -1.23 0.00 0.00 177.57 175.68 2qbh h ARG 39 N -0.04 -0.50 0.12 5.19 3.08 -1.38 0.78 114.38 121.64 2qbh h ARG 39 Ca 0.03 0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2qbh h ARG 39 Cb 0.18 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.35 2qbh h ARG 39 CO -0.00 -0.33 -0.06 -0.56 -1.07 0.00 0.00 179.97 177.95 2qbh h GLN 40 N -0.52 -0.16 -0.35 0.04 3.07 -1.49 -0.03 115.11 115.67 2qbh h GLN 40 Ca 0.05 0.01 0.08 0.00 0.09 0.00 0.00 58.65 58.88 2qbh h GLN 40 Cb 0.59 0.04 -0.08 0.00 0.08 0.00 0.00 27.48 28.10 2qbh h GLN 40 CO -0.26 -0.05 -0.16 -0.92 0.09 0.00 0.00 178.83 177.53 2qbh h TYR 41 N -0.22 -0.40 -0.46 0.06 5.03 -1.29 -0.40 116.97 119.30 2qbh h TYR 41 Ca -0.02 0.04 0.07 0.00 2.58 0.00 0.00 58.73 61.40 2qbh h TYR 41 Cb 0.17 0.23 -0.06 0.00 1.55 0.00 0.00 36.73 38.63 2qbh h TYR 41 CO -0.05 -0.24 0.14 -0.07 -1.32 0.00 0.00 178.16 176.62 2qbh h LEU 42 N -0.10 0.11 -0.27 2.82 -0.00 -0.63 -2.13 115.31 115.11 2qbh h LEU 42 Ca 0.18 0.06 0.06 0.00 -0.00 0.00 0.00 57.88 58.18 2qbh h LEU 42 Cb 0.37 0.06 -0.08 0.00 -0.00 0.00 0.00 40.66 41.02 2qbh h LEU 42 CO -0.42 0.10 -0.41 0.74 -0.00 0.00 0.00 178.44 178.45 2qbh h THR 43 N 0.30 0.15 0.63 0.22 2.02 0.67 0.42 112.91 117.32 2qbh h THR 43 Ca 0.22 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.38 2qbh h THR 43 Cb 0.24 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 2qbh h THR 43 CO -0.25 0.00 -0.51 0.11 0.37 0.00 0.00 175.52 175.25 2qbh h LYS 44 N -0.39 -1.06 -0.44 6.66 1.57 -1.04 -0.29 116.57 121.58 2qbh h LYS 44 Ca 0.11 0.07 0.13 0.00 -1.87 0.00 0.00 60.65 59.09 2qbh h LYS 44 Cb 0.59 0.24 -0.02 0.00 0.08 0.00 0.00 32.23 33.13 2qbh h LYS 44 CO -0.48 -0.71 0.45 0.93 -0.57 0.00 0.00 179.45 179.07 2qbh h GLU 45 N -1.10 0.00 -0.88 3.15 5.08 -1.07 0.89 114.58 120.65 2qbh h GLU 45 Ca -0.08 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.69 2qbh h GLU 45 Cb 0.92 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 29.78 2qbh h GLU 45 CO 0.01 0.00 -0.36 1.28 -1.00 0.00 0.00 179.01 178.94 2qbh n LEU 46 N -3.76 5.66 0.00 1.33 7.99 0.14 -4.89 117.00 123.47 2qbh n LEU 46 Ca 0.08 -4.66 0.00 0.00 -0.01 0.00 0.00 56.01 51.42 2qbh n LEU 46 Cb 0.64 -0.52 0.00 0.00 -0.11 0.00 0.00 43.42 43.43 2qbh n LEU 46 CO 0.28 1.95 0.23 0.00 -1.51 0.00 0.00 177.39 178.34 2qbh n ALA 47 N -0.75 0.00 0.82 -1.18 0.00 0.30 -2.40 120.51 117.31 2qbh n ALA 47 Ca 0.49 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.98 2qbh n ALA 47 Cb 0.86 0.08 0.30 0.00 0.00 0.00 0.00 19.45 20.70 2qbh n ALA 47 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2qbh n LYS 48 N -0.63 0.41 0.27 0.00 0.00 -1.26 -2.86 118.16 114.09 2qbh n LYS 48 Ca 0.00 0.00 0.18 0.00 -0.00 0.00 0.00 58.31 58.49 2qbh n LYS 48 Cb 0.00 -1.39 0.91 0.00 -0.00 0.00 0.00 35.03 34.55 2qbh n LYS 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2qbh h ALA 49 N 2.59 1.00 -5.52 0.58 0.00 -1.82 -3.47 119.26 112.63 2qbh h ALA 49 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.60 2qbh h ALA 49 Cb 0.00 0.00 0.17 0.00 0.00 0.00 0.00 17.79 17.96 2qbh h ALA 49 CO 0.00 0.00 -0.77 0.43 0.00 0.00 0.00 179.25 178.91 2qbh n SER 50 N -2.86 -2.91 -4.86 0.00 7.64 -1.14 -3.18 113.62 106.33 2qbh n SER 50 Ca -0.01 -0.62 -0.32 0.00 1.01 0.00 0.00 58.87 58.93 2qbh n SER 50 Cb 0.14 -5.02 -0.05 0.00 -1.01 0.00 0.00 64.21 58.27 2qbh n SER 50 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2qbh s VAL 51 N -3.36 4.71 0.00 0.44 0.11 -1.26 -1.27 120.40 119.77 2qbh s VAL 51 Ca 0.09 0.87 -0.03 0.00 -2.93 0.00 0.00 61.98 59.97 2qbh s VAL 51 Cb -0.01 -3.64 -0.02 0.00 -1.53 0.00 0.00 36.38 31.18 2qbh s VAL 51 CO 0.71 -0.27 -0.07 -1.54 -3.33 0.00 0.00 175.10 170.59 2qbh n SER 52 N -0.61 0.94 -3.68 3.54 3.41 -0.62 -4.72 113.62 111.87 2qbh n SER 52 Ca 0.03 0.14 -0.16 0.00 -0.26 0.00 0.00 58.87 58.62 2qbh n SER 52 Cb 0.53 -0.32 -0.00 0.00 -0.26 0.00 0.00 64.21 64.16 2qbh n SER 52 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2qbh n ARG 53 N -3.52 1.04 0.00 4.33 0.63 -1.21 -4.83 116.66 113.10 2qbh n ARG 53 Ca -0.06 -2.07 0.00 0.00 -0.92 0.00 0.00 57.85 54.80 2qbh n ARG 53 Cb 0.30 0.27 0.00 0.00 0.45 0.00 0.00 32.46 33.48 2qbh n ARG 53 CO 0.00 0.00 0.00 1.51 -2.51 0.00 0.00 177.63 176.63 2qbh n ILE 54 N -1.20 0.00 -0.72 5.15 3.06 -1.26 -3.32 119.36 121.07 2qbh n ILE 54 Ca -0.03 0.00 -0.32 0.00 -2.50 0.00 0.00 62.75 59.90 2qbh n ILE 54 Cb 0.37 0.00 0.15 0.00 0.54 0.00 0.00 39.64 40.71 2qbh n ILE 54 CO 0.00 0.00 0.00 0.52 -2.50 0.00 0.00 176.55 174.57 2qbh n VAL 55 N 0.00 0.00 -3.38 9.51 0.31 -0.75 -4.81 118.33 119.22 2qbh n VAL 55 Ca 0.00 -0.23 -0.17 0.00 -0.01 0.00 0.00 64.34 63.93 2qbh n VAL 55 Cb 0.00 -0.67 -0.08 0.00 -0.91 0.00 0.00 33.84 32.18 2qbh n VAL 55 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2qbh s ILE 56 N -2.36 -0.38 -0.09 2.52 1.01 0.36 -2.73 121.20 119.52 2qbh s ILE 56 Ca 0.58 -0.71 -0.17 0.00 0.00 0.00 0.00 60.65 60.35 2qbh s ILE 56 Cb -0.18 -0.85 -0.05 0.00 0.01 0.00 0.00 42.46 41.39 2qbh s ILE 56 CO 0.66 -0.51 0.44 -1.61 0.00 0.00 0.00 174.94 173.92 2qbh s GLU 57 N 1.95 4.23 -0.66 2.79 2.02 -1.26 -3.97 118.70 123.79 2qbh s GLU 57 Ca 0.13 0.40 0.04 0.00 0.02 0.00 0.00 54.97 55.56 2qbh s GLU 57 Cb -0.14 -3.38 0.16 0.00 0.10 0.00 0.00 34.13 30.87 2qbh s GLU 57 CO -0.19 0.31 0.45 1.03 0.02 0.00 0.00 175.26 176.87 2qbh s ARG 58 N 0.14 2.38 0.00 1.61 0.52 -1.26 0.61 118.95 122.95 2qbh s ARG 58 Ca 0.24 -3.14 0.00 0.00 -0.52 0.00 0.00 55.73 52.31 2qbh s ARG 58 Cb -0.15 -3.43 0.00 0.00 0.52 0.00 0.00 34.95 31.88 2qbh s ARG 58 CO 0.10 -1.24 0.00 -0.35 0.02 0.00 0.00 175.30 173.84 2qbh n PRO 59 N 2.31 3.09 -1.83 3.54 -0.04 -0.97 -4.75 135.00 136.35 2qbh n PRO 59 Ca 0.16 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.34 2qbh n PRO 59 Cb 0.34 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.76 2qbh n PRO 59 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qbh s ALA 60 N -3.27 1.51 -1.40 0.55 0.00 -1.26 -3.31 121.76 114.59 2qbh s ALA 60 Ca 0.00 -0.85 -0.07 0.00 0.00 0.00 0.00 51.96 51.04 2qbh s ALA 60 Cb 0.00 -4.47 0.04 0.00 0.00 0.00 0.00 23.12 18.70 2qbh s ALA 60 CO 0.00 -4.84 0.55 1.63 0.00 0.00 0.00 175.76 173.10 2qbh n LYS 61 N 8.95 -4.09 -4.16 0.00 4.76 -1.26 -4.95 118.16 117.42 2qbh n LYS 61 Ca 0.37 0.65 -0.14 0.00 -2.87 0.00 0.00 58.31 56.33 2qbh n LYS 61 Cb 0.49 -5.43 -0.07 0.00 -1.84 0.00 0.00 35.03 28.17 2qbh n LYS 61 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2qbh s SER 62 N -2.73 0.61 0.03 4.39 1.04 -1.21 -3.51 113.70 112.33 2qbh s SER 62 Ca 0.37 -1.41 -0.00 0.00 0.48 0.00 0.00 55.95 55.38 2qbh s SER 62 Cb -0.18 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.43 2qbh s SER 62 CO 0.45 -1.05 -0.03 -0.63 0.98 0.00 0.00 173.24 172.97 2qbh s ILE 63 N -3.72 0.14 -0.22 -1.02 1.01 -1.23 -2.30 121.20 113.85 2qbh s ILE 63 Ca 0.34 -1.17 -0.12 0.00 0.00 0.00 0.00 60.65 59.71 2qbh s ILE 63 Cb 0.03 -0.63 -0.18 0.00 0.01 0.00 0.00 42.46 41.69 2qbh s ILE 63 CO 0.17 -0.64 -0.03 -1.14 0.00 0.00 0.00 174.94 173.30 2qbh n ARG 64 N 1.16 0.62 -3.85 2.79 3.00 0.20 -1.46 116.66 119.12 2qbh n ARG 64 Ca -0.21 0.34 -0.24 0.00 -0.00 0.00 0.00 57.85 57.74 2qbh n ARG 64 Cb 0.57 -1.62 0.00 0.00 0.00 0.00 0.00 32.46 31.42 2qbh n ARG 64 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2qbh n VAL 65 N -3.98 -3.60 -2.22 5.15 0.31 -1.25 -3.08 118.33 109.65 2qbh n VAL 65 Ca -0.42 -0.47 -0.43 0.00 -0.01 0.00 0.00 64.34 63.01 2qbh n VAL 65 Cb 0.87 -3.13 -0.02 0.00 -0.91 0.00 0.00 33.84 30.65 2qbh n VAL 65 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2qbh s THR 66 N -3.80 3.86 0.03 2.52 2.01 -1.11 -3.96 115.64 115.20 2qbh s THR 66 Ca 0.04 0.98 -0.12 0.00 0.31 0.00 0.00 61.69 62.90 2qbh s THR 66 Cb -0.02 -3.84 -0.06 0.00 0.01 0.00 0.00 72.50 68.59 2qbh s THR 66 CO 0.85 -0.32 0.40 -0.63 -0.69 0.00 0.00 174.62 174.24 2qbh s ILE 67 N 4.76 5.06 -0.70 1.82 1.01 -0.29 -1.81 121.20 131.06 2qbh s ILE 67 Ca 0.66 0.66 0.05 0.00 0.00 0.00 0.00 60.65 62.02 2qbh s ILE 67 Cb -0.23 -3.68 0.23 0.00 0.01 0.00 0.00 42.46 38.79 2qbh s ILE 67 CO 0.26 0.45 0.71 1.41 0.00 0.00 0.00 174.94 177.77 2qbh n HIS 68 N 1.42 3.51 -3.92 3.97 8.25 -1.21 -0.49 115.22 126.75 2qbh n HIS 68 Ca -0.11 -4.14 -0.29 0.00 -0.26 0.00 0.00 57.72 52.92 2qbh n HIS 68 Cb 0.52 -0.64 -0.04 0.00 1.12 0.00 0.00 29.99 30.96 2qbh n HIS 68 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2qbh s THR 69 N -2.13 5.35 0.16 1.59 -1.32 -1.20 -1.60 115.64 116.50 2qbh s THR 69 Ca 0.34 -0.53 0.08 0.00 -1.21 0.00 0.00 61.69 60.37 2qbh s THR 69 Cb 0.07 -3.69 -0.16 0.00 -1.51 0.00 0.00 72.50 67.21 2qbh s THR 69 CO -0.06 0.02 1.37 0.00 -2.21 0.00 0.00 174.62 173.73 2qbh h ALA 70 N 2.59 0.51 -2.84 11.08 0.00 -1.35 -3.38 119.26 125.88 2qbh h ALA 70 Ca -0.47 -0.82 -0.70 0.00 0.00 0.00 0.00 54.91 52.93 2qbh h ALA 70 Cb 1.18 -0.14 -0.36 0.00 0.00 0.00 0.00 17.79 18.46 2qbh h ALA 70 CO 0.72 1.12 -0.13 0.54 0.00 0.00 0.00 179.25 181.50 2qbh n ARG 71 N -3.47 2.59 -0.07 0.00 1.74 -1.19 -4.81 116.66 111.44 2qbh n ARG 71 Ca -0.00 -4.49 -0.11 0.00 -0.77 0.00 0.00 57.85 52.48 2qbh n ARG 71 Cb 0.86 -2.40 -0.05 0.00 -1.02 0.00 0.00 32.46 29.85 2qbh n ARG 71 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2qbh h PRO 72 N 5.87 0.38 -0.68 5.56 0.13 -1.86 -3.10 132.00 138.30 2qbh h PRO 72 Ca 0.16 -0.12 0.13 0.00 -0.87 0.00 0.00 66.00 65.31 2qbh h PRO 72 Cb 0.80 -0.04 -0.13 0.00 0.13 0.00 0.00 31.00 31.76 2qbh h PRO 72 CO 0.85 0.56 -0.22 0.78 -0.23 0.00 0.00 178.00 179.74 2qbh h GLY 73 N 0.15 0.35 2.00 1.56 0.00 -1.97 0.38 103.07 105.54 2qbh h GLY 73 Ca 0.06 0.29 -0.06 0.00 0.00 0.00 0.00 47.33 47.62 2qbh h GLY 73 CO 0.01 -0.25 -0.28 1.19 0.00 0.00 0.00 176.54 177.20 2qbh h ILE 74 N -0.04 1.15 0.00 2.60 2.10 -1.93 0.78 117.51 122.17 2qbh h ILE 74 Ca 0.31 -0.99 -0.10 0.00 1.08 0.00 0.00 64.86 65.16 2qbh h ILE 74 Cb 0.53 1.54 -0.01 0.00 -1.09 0.00 0.00 36.82 37.79 2qbh h ILE 74 CO -0.72 0.28 -0.47 0.58 -1.08 0.00 0.00 178.15 176.73 2qbh h VAL 75 N 0.00 0.95 0.19 2.19 2.07 -0.36 -3.24 116.25 118.04 2qbh h VAL 75 Ca -0.00 -1.94 -0.33 0.00 0.82 0.00 0.00 66.70 65.26 2qbh h VAL 75 Cb 0.52 2.19 0.01 0.00 -1.52 0.00 0.00 31.29 32.49 2qbh h VAL 75 CO 0.04 0.46 -1.58 0.40 0.02 0.00 0.00 177.57 176.91 2qbh h ILE 76 N 0.00 1.06 -0.32 4.57 1.08 0.30 -2.85 117.51 121.34 2qbh h ILE 76 Ca -0.00 -2.53 0.00 0.00 -0.39 0.00 0.00 64.86 61.94 2qbh h ILE 76 Cb 1.15 2.84 0.00 0.00 -3.07 0.00 0.00 36.82 37.74 2qbh h ILE 76 CO 0.06 0.81 0.00 0.61 -0.69 0.00 0.00 178.15 178.94 2qbh n GLY 77 N 1.80 -1.46 3.57 5.37 0.00 0.19 -0.84 105.19 113.83 2qbh n GLY 77 Ca -0.23 -1.28 -0.40 0.00 0.00 0.00 0.00 46.02 44.11 2qbh n GLY 77 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2qbh s LYS 78 N 0.00 2.86 -1.39 1.61 -2.85 -1.26 -3.27 119.74 115.44 2qbh s LYS 78 Ca 0.00 1.10 -0.08 0.00 -1.00 0.00 0.00 55.97 56.00 2qbh s LYS 78 Cb 0.00 -4.34 0.03 0.00 -2.06 0.00 0.00 37.83 31.47 2qbh s LYS 78 CO 0.00 -2.43 0.99 1.63 0.10 0.00 0.00 175.35 175.64 2qbh n LYS 79 N 8.84 -6.31 -0.95 1.78 5.02 -1.26 -1.69 118.16 123.59 2qbh n LYS 79 Ca 0.24 0.71 0.00 0.00 -2.02 0.00 0.00 58.31 57.24 2qbh n LYS 79 Cb 0.50 -5.60 0.00 0.00 -0.02 0.00 0.00 35.03 29.91 2qbh n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qbh n GLY 80 N -1.69 0.48 0.00 0.72 0.00 -1.17 -4.98 105.19 98.54 2qbh n GLY 80 Ca -0.08 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.51 2qbh n GLY 80 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2qbh n GLU 81 N -2.95 0.00 -0.32 1.61 4.07 -0.02 -1.48 120.64 121.57 2qbh n GLU 81 Ca 0.00 0.56 0.15 0.00 -0.06 0.00 0.00 57.16 57.81 2qbh n GLU 81 Cb 0.00 -1.44 0.33 0.00 -0.06 0.00 0.00 31.44 30.27 2qbh n GLU 81 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 2qbh h ASP 82 N 0.00 0.42 0.09 4.31 3.32 -1.37 -1.14 116.42 122.04 2qbh h ASP 82 Ca 0.00 0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.20 2qbh h ASP 82 Cb 0.00 0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2qbh h ASP 82 CO 0.00 0.02 -0.19 0.58 -1.72 0.00 0.00 179.24 177.93 2qbh h VAL 83 N 0.44 0.00 -0.93 -1.35 2.07 -1.25 -1.71 116.25 113.52 2qbh h VAL 83 Ca 0.59 0.00 0.22 0.00 0.82 0.00 0.00 66.70 68.33 2qbh h VAL 83 Cb 1.12 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.77 2qbh h VAL 83 CO -0.52 0.00 0.47 -0.33 0.02 0.00 0.00 177.57 177.21 2qbh h GLU 84 N -0.31 0.47 0.04 1.57 4.39 -0.49 -1.43 114.58 118.82 2qbh h GLU 84 Ca -0.01 -0.03 0.03 0.00 0.34 0.00 0.00 59.36 59.69 2qbh h GLU 84 Cb 0.29 -0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 28.79 2qbh h GLU 84 CO -0.08 0.31 -0.37 -0.22 -1.16 0.00 0.00 179.01 177.49 2qbh h LYS 85 N 0.49 -0.53 -0.79 2.33 3.64 -0.67 -1.85 116.57 119.19 2qbh h LYS 85 Ca 0.58 0.04 0.06 0.00 -1.27 0.00 0.00 60.65 60.06 2qbh h LYS 85 Cb 1.08 0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.97 2qbh h LYS 85 CO -0.49 -0.36 0.52 -0.07 -2.27 0.00 0.00 179.45 176.78 2qbh h LEU 86 N -0.55 0.76 -0.53 5.20 3.38 -0.40 -2.88 115.31 120.29 2qbh h LEU 86 Ca 0.05 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.12 2qbh h LEU 86 Cb 0.62 -0.16 -0.10 0.00 0.09 0.00 0.00 40.66 41.10 2qbh h LEU 86 CO -0.27 0.50 -0.14 -0.09 0.09 0.00 0.00 178.44 178.53 2qbh h ARG 87 N 0.87 -0.01 -0.21 1.13 2.43 -0.65 -1.59 114.38 116.35 2qbh h ARG 87 Ca 0.33 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.52 2qbh h ARG 87 Cb 0.20 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 2qbh h ARG 87 CO -0.11 -0.01 0.09 -0.22 -1.51 0.00 0.00 179.97 178.21 2qbh h LYS 88 N -0.01 0.19 0.14 0.20 3.11 -1.39 -1.61 116.57 117.21 2qbh h LYS 88 Ca 0.25 -0.01 0.02 0.00 -2.81 0.00 0.00 60.65 58.10 2qbh h LYS 88 Cb 0.40 -0.04 -0.04 0.00 -1.00 0.00 0.00 32.23 31.54 2qbh h LYS 88 CO -0.55 0.13 -0.37 0.28 -2.81 0.00 0.00 179.45 176.12 2qbh h VAL 89 N 0.20 0.23 -0.02 2.00 2.07 -1.43 0.17 116.25 119.47 2qbh h VAL 89 Ca 0.09 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.64 2qbh h VAL 89 Cb 0.03 0.23 -0.06 0.00 -1.52 0.00 0.00 31.29 29.97 2qbh h VAL 89 CO -0.07 0.00 -0.42 0.58 0.02 0.00 0.00 177.57 177.68 2qbh h VAL 90 N -0.62 0.15 -0.98 2.57 2.07 -1.18 0.58 116.25 118.84 2qbh h VAL 90 Ca 0.02 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.69 2qbh h VAL 90 Cb 0.64 0.15 -0.09 0.00 -1.52 0.00 0.00 31.29 30.47 2qbh h VAL 90 CO -0.21 0.00 0.62 0.00 0.02 0.00 0.00 177.57 178.00 2qbh h ALA 91 N -0.02 1.65 0.05 1.67 0.00 -1.06 -0.35 119.26 121.21 2qbh h ALA 91 Ca 0.05 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2qbh h ALA 91 Cb 0.65 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2qbh h ALA 91 CO -0.33 0.07 -0.03 0.22 0.00 0.00 0.00 179.25 179.19 2qbh h ASP 92 N 0.86 -0.06 -0.83 0.00 1.82 0.57 0.66 116.42 119.44 2qbh h ASP 92 Ca 0.51 -0.43 0.12 0.00 -0.39 0.00 0.00 57.03 56.84 2qbh h ASP 92 Cb 0.67 0.02 -0.08 0.00 0.68 0.00 0.00 39.33 40.61 2qbh h ASP 92 CO -0.28 0.41 0.44 0.40 -1.61 0.00 0.00 179.24 178.60 2qbh h ILE 93 N -0.55 0.81 0.00 2.25 2.04 0.78 0.12 117.51 122.95 2qbh h ILE 93 Ca -0.01 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.62 2qbh h ILE 93 Cb 0.49 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.63 2qbh h ILE 93 CO 0.01 0.13 -0.49 0.00 0.00 0.00 0.00 178.15 177.80 2qbh n ALA 94 N -2.41 3.49 -0.91 1.87 0.00 -0.20 -4.94 120.51 117.41 2qbh n ALA 94 Ca 0.15 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2qbh n ALA 94 Cb 0.36 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.68 2qbh n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qbh n GLY 95 N 1.49 0.34 3.30 0.00 0.00 0.21 -4.98 105.19 105.56 2qbh n GLY 95 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 2qbh n GLY 95 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qbh s VAL 96 N -1.85 1.52 -0.36 1.61 -7.23 -0.20 -4.94 120.40 108.95 2qbh s VAL 96 Ca 0.00 -2.10 -0.27 0.00 -1.81 0.00 0.00 61.98 57.79 2qbh s VAL 96 Cb 0.00 -1.92 -0.05 0.00 0.56 0.00 0.00 36.38 34.97 2qbh s VAL 96 CO 0.00 -0.61 2.22 -2.16 -0.31 0.00 0.00 175.10 174.24 2qbh s PRO 97 N -3.54 2.73 -0.07 4.82 0.04 -1.23 -4.15 135.00 133.60 2qbh s PRO 97 Ca 0.19 1.64 0.02 0.00 0.04 0.00 0.00 61.00 62.88 2qbh s PRO 97 Cb -0.00 -4.43 -0.03 0.00 0.04 0.00 0.00 34.50 30.08 2qbh s PRO 97 CO 0.04 -2.56 -0.11 0.00 0.04 0.00 0.00 177.00 174.41 2qbh s ALA 98 N 9.66 2.78 0.17 8.56 0.00 -1.26 -3.47 121.76 138.19 2qbh s ALA 98 Ca 0.95 -0.93 0.02 0.00 0.00 0.00 0.00 51.96 52.00 2qbh s ALA 98 Cb -0.25 -1.12 0.02 0.00 0.00 0.00 0.00 23.12 21.78 2qbh s ALA 98 CO 0.31 0.50 0.19 1.04 0.00 0.00 0.00 175.76 177.79 2qbh n GLN 99 N 2.53 1.03 -3.15 0.00 3.00 -0.54 -4.51 117.38 115.75 2qbh n GLN 99 Ca -0.18 -0.96 0.05 0.00 -0.01 0.00 0.00 57.00 55.90 2qbh n GLN 99 Cb 0.52 0.00 -0.01 0.00 0.00 0.00 0.00 30.24 30.76 2qbh n GLN 99 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.06 175.56 2qbh s ILE 100 N -0.36 -0.63 0.10 5.09 2.07 -1.18 -4.19 121.20 122.10 2qbh s ILE 100 Ca 0.14 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.41 2qbh s ILE 100 Cb -0.01 -0.92 -0.04 0.00 0.13 0.00 0.00 42.46 41.62 2qbh s ILE 100 CO 0.09 0.00 0.14 0.20 -1.91 0.00 0.00 174.94 173.46 2qbh s ASN 101 N 2.91 5.79 -0.06 4.50 0.01 -1.25 -4.99 114.94 121.85 2qbh s ASN 101 Ca 0.11 0.04 0.00 0.00 -0.71 0.00 0.00 52.86 52.30 2qbh s ASN 101 Cb -0.11 -1.62 -0.03 0.00 0.41 0.00 0.00 41.25 39.90 2qbh s ASN 101 CO -0.17 0.13 -0.05 -0.63 -1.51 0.00 0.00 177.10 174.87 2qbh s ILE 102 N -1.54 3.87 -0.05 0.60 1.09 -1.26 -1.13 121.20 122.78 2qbh s ILE 102 Ca 0.31 -0.45 0.06 0.00 -1.10 0.00 0.00 60.65 59.48 2qbh s ILE 102 Cb -0.12 -2.61 -0.01 0.00 -1.06 0.00 0.00 42.46 38.67 2qbh s ILE 102 CO 0.24 0.58 -0.24 0.00 -0.10 0.00 0.00 174.94 175.42 2qbh s ALA 103 N -0.85 2.08 1.00 9.38 0.00 0.36 -4.95 121.76 128.78 2qbh s ALA 103 Ca 0.13 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 51.08 2qbh s ALA 103 Cb -0.11 -0.64 0.00 0.00 0.00 0.00 0.00 23.12 22.37 2qbh s ALA 103 CO 0.02 0.41 0.00 -1.91 0.00 0.00 0.00 175.76 174.28 2qbh n GLU 104 N 2.92 0.54 -3.69 0.00 2.13 -1.26 -3.23 120.64 118.05 2qbh n GLU 104 Ca -0.17 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 57.51 2qbh n GLU 104 Cb 0.52 0.00 -0.14 0.00 0.27 0.00 0.00 31.44 32.09 2qbh n GLU 104 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 2qbh s VAL 105 N -0.19 -0.24 -0.86 6.31 -7.23 -1.26 -4.55 120.40 112.38 2qbh s VAL 105 Ca 0.00 0.25 -0.20 0.00 -1.81 0.00 0.00 61.98 60.22 2qbh s VAL 105 Cb 0.00 -0.38 -0.13 0.00 0.56 0.00 0.00 36.38 36.43 2qbh s VAL 105 CO 0.00 0.10 1.98 -2.11 -0.31 0.00 0.00 175.10 174.76 2qbh n ARG 106 N 4.92 1.70 -1.83 4.82 0.00 -1.26 -4.57 116.66 120.43 2qbh n ARG 106 Ca -0.13 -1.91 0.00 0.00 -0.00 0.00 0.00 57.85 55.81 2qbh n ARG 106 Cb 0.51 -2.93 0.00 0.00 -0.00 0.00 0.00 32.46 30.04 2qbh n ARG 106 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2qbh n LYS 107 N 6.72 -3.63 0.29 2.89 5.02 -1.26 -4.65 118.16 123.55 2qbh n LYS 107 Ca 0.50 2.77 0.17 0.00 -2.02 0.00 0.00 58.31 59.73 2qbh n LYS 107 Cb 0.39 -3.26 0.90 0.00 -0.02 0.00 0.00 35.03 33.03 2qbh n LYS 107 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2qbh h PRO 108 N 2.92 0.00 0.00 1.97 0.13 -1.96 -2.49 132.00 132.57 2qbh h PRO 108 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2qbh h PRO 108 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2qbh h PRO 108 CO 0.00 0.04 0.00 0.39 -0.23 0.00 0.00 178.00 178.20 2qbh n GLU 109 N -3.34 0.02 0.00 0.86 1.02 -1.26 -1.66 120.64 116.28 2qbh n GLU 109 Ca -0.02 0.35 0.01 0.00 -0.02 0.00 0.00 57.16 57.49 2qbh n GLU 109 Cb 0.19 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.11 2qbh n GLU 109 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2qbh n LEU 110 N -1.40 1.06 -4.72 -4.62 4.77 -0.94 -3.95 117.00 107.20 2qbh n LEU 110 Ca 0.01 -0.95 -0.38 0.00 -0.03 0.00 0.00 56.01 54.66 2qbh n LEU 110 Cb 0.03 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.06 2qbh n LEU 110 CO 0.03 0.25 0.18 -0.62 -1.33 0.00 0.00 177.39 175.89 2qbh s ASP 111 N -0.26 6.67 0.00 -1.43 2.15 -0.67 -4.96 116.67 118.17 2qbh s ASP 111 Ca 0.02 0.80 0.00 0.00 0.43 0.00 0.00 52.55 53.80 2qbh s ASP 111 Cb 0.02 -2.29 0.00 0.00 -0.30 0.00 0.00 42.92 40.35 2qbh s ASP 111 CO 0.03 -0.02 0.75 0.00 -0.17 0.00 0.00 175.17 175.76 2qbh n ALA 112 N 3.80 -0.17 -0.26 3.66 0.00 -1.26 -1.02 120.51 125.25 2qbh n ALA 112 Ca -0.07 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.30 2qbh n ALA 112 Cb 0.51 0.12 -0.06 0.00 0.00 0.00 0.00 19.45 20.02 2qbh n ALA 112 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2qbh n LYS 113 N -1.48 -0.27 0.05 0.00 3.00 -1.26 -0.25 118.16 117.94 2qbh n LYS 113 Ca 0.00 0.99 -0.03 0.00 -0.00 0.00 0.00 58.31 59.27 2qbh n LYS 113 Cb 0.00 -1.46 -0.02 0.00 0.00 0.00 0.00 35.03 33.55 2qbh n LYS 113 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 2qbh h LEU 114 N 0.00 -0.24 -1.67 3.14 3.38 -1.84 0.96 115.31 119.04 2qbh h LEU 114 Ca 0.10 0.02 0.49 0.00 0.09 0.00 0.00 57.88 58.58 2qbh h LEU 114 Cb 0.25 0.08 -0.11 0.00 0.09 0.00 0.00 40.66 40.98 2qbh h LEU 114 CO -0.58 -0.12 1.07 0.58 0.09 0.00 0.00 178.44 179.49 2qbh h VAL 115 N -0.17 0.08 0.02 1.22 2.07 -0.15 0.68 116.25 120.01 2qbh h VAL 115 Ca -0.01 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 2qbh h VAL 115 Cb 0.15 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 29.97 2qbh h VAL 115 CO -0.01 0.01 -0.01 0.00 0.02 0.00 0.00 177.57 177.57 2qbh h ALA 116 N 1.36 -0.05 -1.03 1.67 0.00 0.16 -3.16 119.26 118.21 2qbh h ALA 116 Ca 0.86 -0.01 0.27 0.00 0.00 0.00 0.00 54.91 56.03 2qbh h ALA 116 Cb 3.05 0.01 -0.12 0.00 0.00 0.00 0.00 17.79 20.73 2qbh h ALA 116 CO -0.24 -0.04 0.63 -0.44 0.00 0.00 0.00 179.25 179.15 2qbh h ASP 117 N -0.67 0.57 -0.62 0.00 3.45 0.25 0.26 116.42 119.66 2qbh h ASP 117 Ca -0.00 0.13 0.04 0.00 0.43 0.00 0.00 57.03 57.63 2qbh h ASP 117 Cb 0.03 0.05 -0.05 0.00 -0.56 0.00 0.00 39.33 38.80 2qbh h ASP 117 CO 0.01 0.04 0.36 0.77 -1.57 0.00 0.00 179.24 178.85 2qbh h SER 118 N 0.46 0.56 0.21 6.45 4.64 0.18 -2.63 113.55 123.43 2qbh h SER 118 Ca 0.66 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.98 2qbh h SER 118 Cb 1.45 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 2qbh h SER 118 CO -0.45 0.38 -0.10 0.40 -0.87 0.00 0.00 176.83 176.20 2qbh h ILE 119 N 0.69 0.83 -0.75 0.95 2.04 -0.46 -2.32 117.51 118.49 2qbh h ILE 119 Ca 0.26 -0.15 0.16 0.00 1.00 0.00 0.00 64.86 66.13 2qbh h ILE 119 Cb 0.09 0.92 -0.11 0.00 -0.74 0.00 0.00 36.82 36.98 2qbh h ILE 119 CO -0.14 0.03 0.22 0.71 0.00 0.00 0.00 178.15 178.98 2qbh h THR 120 N -0.35 0.55 -0.55 -0.27 1.35 -1.30 0.08 112.91 112.42 2qbh h THR 120 Ca -0.03 -0.11 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 2qbh h THR 120 Cb 0.27 0.20 -0.03 0.00 -1.73 0.00 0.00 68.15 66.86 2qbh h THR 120 CO 0.05 0.06 0.35 0.28 -0.25 0.00 0.00 175.52 176.00 2qbh h SER 121 N 0.32 0.64 -0.58 5.36 0.02 -1.31 -2.69 113.55 115.32 2qbh h SER 121 Ca 0.42 -0.04 0.07 0.00 -0.84 0.00 0.00 61.79 61.41 2qbh h SER 121 Cb 0.71 -0.16 -0.06 0.00 0.14 0.00 0.00 62.40 63.02 2qbh h SER 121 CO -0.48 0.49 0.25 1.56 -1.14 0.00 0.00 176.83 177.51 2qbh h GLN 122 N 0.74 0.45 -0.12 3.45 4.20 -0.44 -1.97 115.11 121.42 2qbh h GLN 122 Ca 0.20 -0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.91 2qbh h GLN 122 Cb -0.05 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.59 2qbh h GLN 122 CO -0.04 0.30 -0.08 -0.07 -0.67 0.00 0.00 178.83 178.27 2qbh h LEU 123 N 0.47 -0.26 -2.18 1.46 3.38 -1.04 0.10 115.31 117.23 2qbh h LEU 123 Ca 0.28 0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.37 2qbh h LEU 123 Cb 0.27 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2qbh h LEU 123 CO -0.24 -0.11 0.22 -0.33 0.09 0.00 0.00 178.44 178.07 2qbh h GLU 124 N -0.08 0.00 0.00 1.13 5.08 -1.17 0.42 114.58 119.96 2qbh h GLU 124 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2qbh h GLU 124 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2qbh h GLU 124 CO -0.18 0.00 0.00 -2.13 -1.00 0.00 0.00 179.01 175.70 2qbh n ARG 125 N -3.89 0.82 -2.52 2.33 0.63 0.01 -4.86 116.66 109.18 2qbh n ARG 125 Ca 0.02 0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 56.90 2qbh n ARG 125 Cb 0.35 -1.50 0.01 0.00 0.45 0.00 0.00 32.46 31.77 2qbh n ARG 125 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2qbh n ARG 126 N -1.01 -1.42 -3.81 -0.14 5.12 0.15 -5.04 116.66 110.50 2qbh n ARG 126 Ca 0.20 0.23 -0.35 0.00 -1.93 0.00 0.00 57.85 56.00 2qbh n ARG 126 Cb 0.09 -3.62 -0.05 0.00 -1.16 0.00 0.00 32.46 27.72 2qbh n ARG 126 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 2qbh s VAL 127 N -2.78 5.37 0.05 1.55 -7.23 -1.15 -5.03 120.40 111.19 2qbh s VAL 127 Ca 0.09 0.13 -0.35 0.00 -1.81 0.00 0.00 61.98 60.05 2qbh s VAL 127 Cb -0.04 -3.53 -0.14 0.00 0.56 0.00 0.00 36.38 33.24 2qbh s VAL 127 CO 0.12 0.43 1.66 0.23 -0.31 0.00 0.00 175.10 177.22 2qbh n MET 128 N 1.32 1.99 -0.18 4.82 2.81 -1.26 -4.62 117.12 122.01 2qbh n MET 128 Ca -0.13 0.72 -0.01 0.00 -1.81 0.00 0.00 57.70 56.46 2qbh n MET 128 Cb 0.53 -2.50 0.06 0.00 -0.71 0.00 0.00 33.22 30.61 2qbh n MET 128 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 2qbh h PHE 129 N 6.90 -0.14 -0.38 2.03 -0.00 -1.96 -1.91 116.94 121.47 2qbh h PHE 129 Ca -0.46 0.04 0.07 0.00 -0.00 0.00 0.00 57.97 57.62 2qbh h PHE 129 Cb 1.27 0.15 -0.07 0.00 -0.00 0.00 0.00 35.95 37.30 2qbh h PHE 129 CO 0.71 -0.18 -0.03 -0.09 -0.00 0.00 0.00 178.31 178.72 2qbh h ARG 130 N 0.06 0.06 0.05 6.09 9.65 -2.00 -2.36 114.38 125.93 2qbh h ARG 130 Ca 0.27 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.15 2qbh h ARG 130 Cb 0.43 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.98 2qbh h ARG 130 CO -0.51 0.04 -0.17 -0.09 2.80 0.00 0.00 179.97 182.04 2qbh h ARG 131 N 0.06 -0.24 -0.75 0.20 9.65 -1.72 -1.25 114.38 120.34 2qbh h ARG 131 Ca 0.19 0.02 0.16 0.00 -1.10 0.00 0.00 59.98 59.25 2qbh h ARG 131 Cb 0.27 0.06 -0.13 0.00 -1.39 0.00 0.00 29.97 28.77 2qbh h ARG 131 CO -0.34 -0.16 -0.06 0.00 2.80 0.00 0.00 179.97 182.20 2qbh h ALA 132 N -1.23 0.68 -1.06 2.80 0.00 -1.48 0.14 119.26 119.11 2qbh h ALA 132 Ca -0.00 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2qbh h ALA 132 Cb 0.25 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2qbh h ALA 132 CO -0.09 -0.42 0.00 -0.12 0.00 0.00 0.00 179.25 178.61 2qbh n MET 133 N -5.40 0.00 -0.31 0.00 0.00 -0.89 -1.49 117.12 109.02 2qbh n MET 133 Ca 0.12 0.60 0.20 0.00 0.00 0.00 0.00 57.70 58.62 2qbh n MET 133 Cb 0.44 -1.32 0.47 0.00 0.00 0.00 0.00 33.22 32.81 2qbh n MET 133 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 175.97 175.75 2qbh h LYS 134 N 0.00 0.46 0.72 2.12 3.64 -0.86 -2.47 116.57 120.18 2qbh h LYS 134 Ca 0.00 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 2qbh h LYS 134 Cb 0.00 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 31.72 2qbh h LYS 134 CO 0.00 0.30 -0.42 -0.09 -2.27 0.00 0.00 179.45 176.98 2qbh h ARG 135 N 0.47 -1.02 -0.80 1.90 9.65 -0.28 -2.35 114.38 121.95 2qbh h ARG 135 Ca 0.57 0.07 0.15 0.00 -1.10 0.00 0.00 59.98 59.66 2qbh h ARG 135 Cb 1.31 0.23 -0.09 0.00 -1.39 0.00 0.00 29.97 30.03 2qbh h ARG 135 CO -0.30 -0.68 0.37 0.00 2.80 0.00 0.00 179.97 182.17 2qbh h ALA 136 N -1.33 1.18 0.07 2.80 0.00 -0.83 -2.33 119.26 118.82 2qbh h ALA 136 Ca -0.10 0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2qbh h ALA 136 Cb 0.84 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.61 2qbh h ALA 136 CO 0.11 -0.15 -0.51 0.28 0.00 0.00 0.00 179.25 178.99 2qbh h VAL 137 N 0.54 0.00 -0.11 0.00 2.07 -1.27 -0.38 116.25 117.09 2qbh h VAL 137 Ca 0.44 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.98 2qbh h VAL 137 Cb 0.65 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 2qbh h VAL 137 CO -0.38 0.00 -0.37 1.56 0.02 0.00 0.00 177.57 178.40 2qbh h GLN 138 N -0.69 -0.37 -0.69 1.57 7.50 -0.89 -0.78 115.11 120.76 2qbh h GLN 138 Ca 0.00 0.03 0.15 0.00 0.50 0.00 0.00 58.65 59.33 2qbh h GLN 138 Cb 0.71 0.08 -0.12 0.00 0.05 0.00 0.00 27.48 28.21 2qbh h GLN 138 CO -0.30 -0.25 0.01 -0.91 -1.50 0.00 0.00 178.83 175.88 2qbh h ASN 139 N -0.39 -0.30 -0.70 1.46 -0.26 -1.35 0.32 115.58 114.36 2qbh h ASN 139 Ca 0.02 0.17 0.01 0.00 -0.56 0.00 0.00 56.30 55.94 2qbh h ASN 139 Cb 0.46 0.30 -0.03 0.00 -1.06 0.00 0.00 38.32 37.99 2qbh h ASN 139 CO -0.31 -0.14 0.46 0.00 -1.06 0.00 0.00 177.43 176.38 2qbh h ALA 140 N 1.64 0.89 -0.01 -0.83 0.00 -0.57 -0.10 119.26 120.28 2qbh h ALA 140 Ca 0.37 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 55.09 2qbh h ALA 140 Cb 0.62 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2qbh h ALA 140 CO -0.59 0.32 -0.61 1.98 0.00 0.00 0.00 179.25 180.35 2qbh h MET 141 N 0.95 0.02 -0.01 0.00 1.85 0.36 -3.27 114.93 114.84 2qbh h MET 141 Ca 0.26 -0.02 -0.01 0.00 -0.61 0.00 0.00 59.70 59.32 2qbh h MET 141 Cb -0.10 0.00 0.00 0.00 0.43 0.00 0.00 31.60 31.94 2qbh h MET 141 CO -0.05 0.62 -0.03 -0.09 -0.40 0.00 0.00 176.91 176.96 2qbh h ARG 142 N 0.02 0.03 -0.12 0.39 2.43 0.11 -3.12 114.38 114.12 2qbh h ARG 142 Ca -0.01 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2qbh h ARG 142 Cb 1.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 2qbh h ARG 142 CO 0.08 0.69 0.00 1.28 -1.51 0.00 0.00 179.97 180.51 2qbh n LEU 143 N -4.74 0.12 0.00 3.80 7.99 -0.10 -4.91 117.00 119.16 2qbh n LEU 143 Ca -0.09 -0.06 0.00 0.00 -0.01 0.00 0.00 56.01 55.85 2qbh n LEU 143 Cb 0.35 -0.06 0.00 0.00 -0.11 0.00 0.00 43.42 43.60 2qbh n LEU 143 CO 0.34 0.03 0.00 0.61 -1.51 0.00 0.00 177.39 176.86 2qbh n GLY 144 N 0.04 0.11 1.45 -0.72 0.00 -1.18 -5.02 105.19 99.86 2qbh n GLY 144 Ca 0.00 -1.52 0.18 0.00 0.00 0.00 0.00 46.02 44.68 2qbh n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbh n ALA 145 N -1.00 -3.80 -0.01 4.61 0.00 -1.26 -4.20 120.51 114.86 2qbh n ALA 145 Ca 0.00 0.89 -0.01 0.00 0.00 0.00 0.00 53.44 54.32 2qbh n ALA 145 Cb 0.00 -1.56 -0.02 0.00 0.00 0.00 0.00 19.45 17.87 2qbh n ALA 145 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qbh n LYS 146 N -4.34 2.78 -3.68 0.00 5.02 -0.47 -4.93 118.16 112.53 2qbh n LYS 146 Ca -0.08 -0.01 -0.14 0.00 -2.02 0.00 0.00 58.31 56.06 2qbh n LYS 146 Cb 0.69 -1.06 -0.08 0.00 -0.02 0.00 0.00 35.03 34.55 2qbh n LYS 146 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2qbh s GLY 147 N -3.08 -0.42 0.01 0.72 0.00 -0.83 -3.48 107.32 100.25 2qbh s GLY 147 Ca -0.01 1.51 0.00 0.00 0.00 0.00 0.00 44.72 46.22 2qbh s GLY 147 CO 0.10 1.29 -0.02 -1.50 0.00 0.00 0.00 173.10 172.97 2qbh s ILE 148 N 0.15 0.07 -0.32 0.90 2.07 0.67 0.13 121.20 124.88 2qbh s ILE 148 Ca -0.01 -0.41 -0.01 0.00 -1.41 0.00 0.00 60.65 58.81 2qbh s ILE 148 Cb -0.04 -0.14 0.12 0.00 0.13 0.00 0.00 42.46 42.54 2qbh s ILE 148 CO 0.01 -0.21 0.22 -0.75 -1.91 0.00 0.00 174.94 172.30 2qbh s LYS 149 N -0.64 0.37 0.09 3.50 2.20 0.11 -1.54 119.74 123.82 2qbh s LYS 149 Ca -0.07 -0.71 -0.23 0.00 -0.36 0.00 0.00 55.97 54.61 2qbh s LYS 149 Cb -0.04 -1.04 -0.07 0.00 -1.51 0.00 0.00 37.83 35.17 2qbh s LYS 149 CO -0.00 -1.10 0.69 0.08 -0.36 0.00 0.00 175.35 174.66 2qbh s VAL 150 N 1.80 4.63 -0.16 4.02 1.01 -1.08 -1.91 120.40 128.70 2qbh s VAL 150 Ca 0.12 1.49 -0.04 0.00 0.00 0.00 0.00 61.98 63.55 2qbh s VAL 150 Cb -0.17 -4.04 0.07 0.00 0.00 0.00 0.00 36.38 32.24 2qbh s VAL 150 CO -0.22 0.48 0.14 -0.70 0.00 0.00 0.00 175.10 174.81 2qbh s GLU 151 N -0.77 0.09 -0.16 2.72 2.12 -1.02 -4.23 118.70 117.44 2qbh s GLU 151 Ca 0.34 0.15 -0.13 0.00 0.36 0.00 0.00 54.97 55.69 2qbh s GLU 151 Cb -0.21 -1.28 -0.05 0.00 0.26 0.00 0.00 34.13 32.86 2qbh s GLU 151 CO 0.22 -0.58 0.27 0.08 -0.54 0.00 0.00 175.26 174.71 2qbh s VAL 152 N 2.23 5.32 0.00 3.70 1.01 -1.24 -1.73 120.40 129.68 2qbh s VAL 152 Ca 0.04 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.52 2qbh s VAL 152 Cb -0.15 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.62 2qbh s VAL 152 CO -0.09 0.41 0.00 -1.54 0.00 0.00 0.00 175.10 173.88 2qbh n SER 153 N 3.45 -0.40 -2.77 3.32 3.41 0.25 -0.21 113.62 120.67 2qbh n SER 153 Ca -0.13 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.39 2qbh n SER 153 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 2qbh n SER 153 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qbh n GLY 154 N 1.57 -2.85 2.53 5.00 0.00 -1.24 -4.03 105.19 106.17 2qbh n GLY 154 Ca 0.00 -1.37 -0.19 0.00 0.00 0.00 0.00 46.02 44.46 2qbh n GLY 154 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qbh n ARG 155 N -1.51 -1.45 -1.57 1.61 5.12 -1.26 -4.61 116.66 112.98 2qbh n ARG 155 Ca 0.00 1.15 -0.52 0.00 -1.93 0.00 0.00 57.85 56.54 2qbh n ARG 155 Cb 0.00 -5.51 -0.06 0.00 -1.16 0.00 0.00 32.46 25.73 2qbh n ARG 155 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2qbh n LEU 156 N -2.23 1.38 -1.87 0.55 4.77 -1.25 0.11 117.00 118.46 2qbh n LEU 156 Ca -0.19 1.13 -0.16 0.00 -0.03 0.00 0.00 56.01 56.75 2qbh n LEU 156 Cb 0.64 -1.16 -0.04 0.00 -2.33 0.00 0.00 43.42 40.53 2qbh n LEU 156 CO 0.29 -1.22 -0.18 0.61 -1.33 0.00 0.00 177.39 175.56 2qbh n GLY 157 N 2.31 0.70 2.32 -0.72 0.00 -1.26 -1.38 105.19 107.15 2qbh n GLY 157 Ca 0.18 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 2qbh n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qbh n GLY 158 N -0.55 1.32 3.42 -0.02 0.00 0.30 -4.92 105.19 104.73 2qbh n GLY 158 Ca -0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 2qbh n GLY 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbh n ALA 159 N 0.51 -2.82 -0.13 4.61 0.00 -0.48 -4.91 120.51 117.29 2qbh n ALA 159 Ca -0.17 -0.87 -0.10 0.00 0.00 0.00 0.00 53.44 52.30 2qbh n ALA 159 Cb 0.57 -1.80 -0.01 0.00 0.00 0.00 0.00 19.45 18.20 2qbh n ALA 159 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2qbh h GLU 160 N -1.90 0.65 -4.77 0.00 5.08 -1.91 -3.40 114.58 108.33 2qbh h GLU 160 Ca -0.49 -0.17 -0.68 0.00 -1.00 0.00 0.00 59.36 57.03 2qbh h GLU 160 Cb 1.31 -0.08 -0.23 0.00 0.50 0.00 0.00 28.75 30.25 2qbh h GLU 160 CO 0.38 0.70 -0.56 0.42 -1.00 0.00 0.00 179.01 178.95 2qbh s ILE 161 N -5.20 4.54 0.64 3.13 1.01 -1.26 -5.05 121.20 119.01 2qbh s ILE 161 Ca -0.13 -0.48 -0.18 0.00 0.00 0.00 0.00 60.65 59.86 2qbh s ILE 161 Cb 0.10 -3.34 -0.03 0.00 0.01 0.00 0.00 42.46 39.21 2qbh s ILE 161 CO 0.77 0.04 1.07 0.00 0.00 0.00 0.00 174.94 176.83 2qbh n ALA 162 N 4.97 0.44 -3.61 9.38 0.00 -1.26 -4.70 120.51 125.73 2qbh n ALA 162 Ca -0.14 -0.03 -0.12 0.00 0.00 0.00 0.00 53.44 53.16 2qbh n ALA 162 Cb 0.49 -2.18 -0.07 0.00 0.00 0.00 0.00 19.45 17.68 2qbh n ALA 162 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2qbh s ARG 163 N -3.06 0.75 0.31 0.00 1.70 -1.26 -4.65 118.95 112.73 2qbh s ARG 163 Ca 0.78 1.02 -0.18 0.00 -0.47 0.00 0.00 55.73 56.88 2qbh s ARG 163 Cb -0.39 0.30 -0.09 0.00 -0.57 0.00 0.00 34.95 34.19 2qbh s ARG 163 CO 0.45 -0.11 0.78 0.99 -1.08 0.00 0.00 175.30 176.32 2qbh s THR 164 N 0.77 4.57 0.31 4.99 2.01 -1.26 -3.69 115.64 123.34 2qbh s THR 164 Ca -0.03 1.19 0.07 0.00 0.31 0.00 0.00 61.69 63.23 2qbh s THR 164 Cb -0.05 -3.72 -0.03 0.00 0.01 0.00 0.00 72.50 68.72 2qbh s THR 164 CO -0.06 -0.06 0.29 -0.70 -0.69 0.00 0.00 174.62 173.40 2qbh s GLU 165 N -2.63 2.83 0.00 4.92 2.56 0.70 -4.98 118.70 122.10 2qbh s GLU 165 Ca 0.51 -1.20 0.00 0.00 0.00 0.00 0.00 54.97 54.29 2qbh s GLU 165 Cb -0.13 -2.54 0.00 0.00 2.00 0.00 0.00 34.13 33.47 2qbh s GLU 165 CO 0.18 0.17 0.00 1.87 -0.56 0.00 0.00 175.26 176.93 2qbh n TRP 166 N -1.35 0.00 -0.14 5.30 -0.00 -1.26 -3.72 117.44 116.27 2qbh n TRP 166 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.47 2qbh n TRP 166 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.90 2qbh n TRP 166 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 177.69 178.67 2qbh n TYR 167 N 0.00 0.00 -3.58 5.87 9.36 -1.26 -4.56 117.16 122.99 2qbh n TYR 167 Ca 0.00 0.00 -0.00 0.00 3.32 0.00 0.00 57.90 61.22 2qbh n TYR 167 Cb 0.00 -0.97 -0.06 0.00 -0.63 0.00 0.00 39.34 37.68 2qbh n TYR 167 CO 0.00 0.00 0.00 0.50 0.22 0.00 0.00 176.86 177.58 2qbh s ARG 168 N -3.72 0.28 0.21 2.98 3.00 -1.26 -2.65 118.95 117.78 2qbh s ARG 168 Ca 0.00 0.52 0.10 0.00 -1.00 0.00 0.00 55.73 55.35 2qbh s ARG 168 Cb 0.00 0.13 -0.04 0.00 0.00 0.00 0.00 34.95 35.03 2qbh s ARG 168 CO 0.00 -0.07 -0.15 -1.21 0.00 0.00 0.00 175.30 173.88 2qbh s GLU 169 N 1.52 1.86 0.11 5.12 2.02 -0.59 -4.97 118.70 123.77 2qbh s GLU 169 Ca -0.07 -1.45 0.00 0.00 0.02 0.00 0.00 54.97 53.47 2qbh s GLU 169 Cb -0.04 -2.00 0.00 0.00 0.10 0.00 0.00 34.13 32.19 2qbh s GLU 169 CO -0.14 0.40 0.00 0.41 0.02 0.00 0.00 175.26 175.94 2qbh n GLY 170 N -0.11 -3.44 3.65 -1.39 0.00 -1.26 -0.24 105.19 102.40 2qbh n GLY 170 Ca -0.10 -1.01 -0.50 0.00 0.00 0.00 0.00 46.02 44.41 2qbh n GLY 170 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2qbh n ARG 171 N -0.79 1.71 -3.73 1.61 1.85 -1.23 -4.04 116.66 112.04 2qbh n ARG 171 Ca 0.00 0.62 -0.28 0.00 -1.00 0.00 0.00 57.85 57.19 2qbh n ARG 171 Cb 0.00 -2.35 -0.11 0.00 -1.05 0.00 0.00 32.46 28.95 2qbh n ARG 171 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 2qbh n VAL 172 N 3.61 1.19 -2.39 8.89 0.31 -1.26 -3.98 118.33 124.69 2qbh n VAL 172 Ca 0.20 -4.65 -0.37 0.00 -0.01 0.00 0.00 64.34 59.51 2qbh n VAL 172 Cb 0.24 -2.08 -0.03 0.00 -0.91 0.00 0.00 33.84 31.06 2qbh n VAL 172 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2qbh s PRO 173 N -1.35 3.33 0.51 5.55 0.04 -1.26 -4.79 135.00 137.03 2qbh s PRO 173 Ca 0.29 -1.16 0.32 0.00 0.04 0.00 0.00 61.00 60.49 2qbh s PRO 173 Cb 0.01 -5.33 1.33 0.00 0.04 0.00 0.00 34.50 30.55 2qbh s PRO 173 CO -0.15 -2.70 1.95 -0.07 0.04 0.00 0.00 177.00 176.07 2qbh h LEU 174 N 14.46 0.00 0.01 -3.56 4.07 -2.00 -3.15 115.31 125.14 2qbh h LEU 174 Ca 0.24 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.17 2qbh h LEU 174 Cb 0.97 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.71 2qbh h LEU 174 CO 1.36 0.00 -0.11 0.45 -1.08 0.00 0.00 178.44 179.06 2qbh h HIS 175 N 0.00 0.09 -0.88 1.13 3.86 -2.01 -3.43 115.15 113.91 2qbh h HIS 175 Ca 0.00 -0.06 -0.38 0.00 -1.16 0.00 0.00 60.37 58.77 2qbh h HIS 175 Cb 0.48 -0.01 -0.03 0.00 1.06 0.00 0.00 27.41 28.91 2qbh h HIS 175 CO 0.00 0.95 1.40 2.41 0.86 0.00 0.00 177.93 183.56 2qbh n THR 176 N -4.58 -0.05 -0.14 2.45 -1.04 -1.19 -4.80 114.28 104.93 2qbh n THR 176 Ca -0.10 -0.54 -0.09 0.00 -2.04 0.00 0.00 64.05 61.27 2qbh n THR 176 Cb 0.49 -1.90 -0.07 0.00 -1.82 0.00 0.00 70.33 67.02 2qbh n THR 176 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2qbh h LEU 177 N 17.75 -1.38 -7.48 -4.42 3.38 -1.87 -2.84 115.31 118.45 2qbh h LEU 177 Ca -0.13 0.19 -0.43 0.00 0.09 0.00 0.00 57.88 57.59 2qbh h LEU 177 Cb 1.22 0.57 -0.00 0.00 0.09 0.00 0.00 40.66 42.54 2qbh h LEU 177 CO 1.22 -0.26 1.44 -1.14 0.09 0.00 0.00 178.44 179.80 2qbh n ARG 178 N -4.60 1.49 0.00 1.13 0.63 -1.26 -3.88 116.66 110.16 2qbh n ARG 178 Ca -0.02 -2.21 0.00 0.00 -0.92 0.00 0.00 57.85 54.70 2qbh n ARG 178 Cb 0.23 -3.44 0.00 0.00 0.45 0.00 0.00 32.46 29.70 2qbh n ARG 178 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2qbh n ALA 179 N 12.19 0.00 -2.92 5.13 0.00 -0.93 -4.18 120.51 129.80 2qbh n ALA 179 Ca 0.46 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.89 2qbh n ALA 179 Cb 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.88 2qbh n ALA 179 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2qbh n ASP 180 N 0.00 -5.65 -3.97 0.00 -0.08 -1.23 -3.77 116.55 101.86 2qbh n ASP 180 Ca 0.00 1.01 -0.30 0.00 -1.51 0.00 0.00 54.79 53.99 2qbh n ASP 180 Cb 0.00 -3.16 -0.16 0.00 2.34 0.00 0.00 41.12 40.13 2qbh n ASP 180 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 2qbh s ILE 181 N -0.71 1.48 -0.72 5.18 1.09 -1.26 -2.31 121.20 123.94 2qbh s ILE 181 Ca -0.07 -0.85 -0.27 0.00 -1.10 0.00 0.00 60.65 58.36 2qbh s ILE 181 Cb 0.00 -1.56 0.01 0.00 -1.06 0.00 0.00 42.46 39.86 2qbh s ILE 181 CO 0.34 0.19 1.49 -0.62 -0.10 0.00 0.00 174.94 176.25 2qbh s ASP 182 N 1.48 5.87 -0.05 3.58 3.68 -0.00 -4.78 116.67 126.44 2qbh s ASP 182 Ca 0.00 -0.28 0.01 0.00 2.13 0.00 0.00 52.55 54.41 2qbh s ASP 182 Cb -0.15 -2.55 -0.03 0.00 -1.45 0.00 0.00 42.92 38.73 2qbh s ASP 182 CO -0.08 -2.02 -0.04 -0.47 0.13 0.00 0.00 175.17 172.69 2qbh s TYR 183 N 6.88 3.01 0.01 -5.34 5.04 -1.26 -2.76 117.35 122.93 2qbh s TYR 183 Ca 0.47 0.07 -0.29 0.00 -2.44 0.00 0.00 57.07 54.87 2qbh s TYR 183 Cb -0.09 -1.71 0.10 0.00 0.35 0.00 0.00 41.96 40.61 2qbh s TYR 183 CO 0.15 0.39 1.05 1.21 -1.34 0.00 0.00 175.55 177.01 2qbh s ASN 184 N -1.03 -0.20 0.29 4.32 3.04 -1.13 -4.76 114.94 115.47 2qbh s ASN 184 Ca 0.14 -0.16 0.03 0.00 0.04 0.00 0.00 52.86 52.91 2qbh s ASN 184 Cb -0.11 0.33 -0.04 0.00 -1.54 0.00 0.00 41.25 39.89 2qbh s ASN 184 CO 0.04 -0.58 0.16 0.42 -3.04 0.00 0.00 177.10 174.10 2qbh s THR 185 N -2.90 0.30 -0.25 -5.21 -4.23 -1.26 -1.11 115.64 100.98 2qbh s THR 185 Ca 0.10 -2.00 -0.22 0.00 -1.18 0.00 0.00 61.69 58.39 2qbh s THR 185 Cb 0.00 -2.52 0.06 0.00 1.34 0.00 0.00 72.50 71.39 2qbh s THR 185 CO -0.03 0.00 0.65 -0.94 -0.54 0.00 0.00 174.62 173.76 2qbh s SER 186 N -3.35 -0.70 -0.15 3.99 1.04 -0.84 -4.68 113.70 109.01 2qbh s SER 186 Ca 0.36 1.33 -0.11 0.00 0.48 0.00 0.00 55.95 58.01 2qbh s SER 186 Cb 0.05 1.34 -0.05 0.00 0.10 0.00 0.00 66.02 67.46 2qbh s SER 186 CO 0.17 -0.23 0.21 -1.61 0.98 0.00 0.00 173.24 172.76 2qbh s GLU 187 N 0.43 4.00 -0.37 4.02 2.02 -1.26 -2.07 118.70 125.47 2qbh s GLU 187 Ca -0.01 -0.05 0.00 0.00 0.02 0.00 0.00 54.97 54.94 2qbh s GLU 187 Cb -0.05 -3.35 0.10 0.00 0.10 0.00 0.00 34.13 30.94 2qbh s GLU 187 CO -0.00 0.43 0.12 0.00 0.02 0.00 0.00 175.26 175.83 2qbh s ALA 188 N -0.07 3.02 -0.90 5.21 0.00 -0.97 -4.89 121.76 123.17 2qbh s ALA 188 Ca 0.14 -2.48 -0.23 0.00 0.00 0.00 0.00 51.96 49.39 2qbh s ALA 188 Cb -0.12 -2.19 0.06 0.00 0.00 0.00 0.00 23.12 20.86 2qbh s ALA 188 CO 0.03 -1.71 1.30 -1.01 0.00 0.00 0.00 175.76 174.36 2qbh s HIS 189 N 1.05 2.58 0.96 0.00 0.09 -1.26 0.15 115.29 118.86 2qbh s HIS 189 Ca 0.08 -0.70 -0.15 0.00 -0.00 0.00 0.00 55.06 54.29 2qbh s HIS 189 Cb -0.21 -4.57 0.20 0.00 -0.00 0.00 0.00 32.58 28.00 2qbh s HIS 189 CO -0.06 -1.87 1.31 0.99 -0.00 0.00 0.00 174.74 175.12 2qbh s THR 190 N 4.70 2.00 0.48 1.30 2.01 0.15 -4.89 115.64 121.38 2qbh s THR 190 Ca 0.38 -0.03 0.24 0.00 0.31 0.00 0.00 61.69 62.60 2qbh s THR 190 Cb -0.05 -2.98 0.24 0.00 0.01 0.00 0.00 72.50 69.73 2qbh s THR 190 CO -0.01 0.00 1.72 0.71 -0.69 0.00 0.00 174.62 176.35 2qbh h THR 191 N -1.61 0.00 -1.88 -0.82 1.35 -1.96 -3.20 112.91 104.79 2qbh h THR 191 Ca -0.44 0.00 -0.46 0.00 -0.55 0.00 0.00 66.41 64.97 2qbh h THR 191 Cb 1.23 0.54 -0.31 0.00 -1.73 0.00 0.00 68.15 67.88 2qbh h THR 191 CO 0.37 0.00 -0.84 0.00 -0.25 0.00 0.00 175.52 174.80 2qbh n TYR 192 N -2.64 -1.77 0.00 4.73 0.18 -1.26 -5.13 117.16 111.26 2qbh n TYR 192 Ca -0.02 -2.74 0.00 0.00 1.88 0.00 0.00 57.90 57.02 2qbh n TYR 192 Cb 0.37 0.60 0.00 0.00 -0.38 0.00 0.00 39.34 39.93 2qbh n TYR 192 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2qbh n GLY 193 N 2.70 -2.43 3.70 -7.48 0.00 -1.21 -5.00 105.19 95.47 2qbh n GLY 193 Ca 0.25 -2.13 -0.23 0.00 0.00 0.00 0.00 46.02 43.91 2qbh n GLY 193 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qbh s VAL 194 N -0.51 3.55 -0.32 1.61 1.01 -1.26 0.29 120.40 124.79 2qbh s VAL 194 Ca 0.00 -1.77 -0.02 0.00 0.00 0.00 0.00 61.98 60.18 2qbh s VAL 194 Cb 0.00 -2.98 0.12 0.00 0.00 0.00 0.00 36.38 33.52 2qbh s VAL 194 CO 0.00 -0.33 0.16 -0.63 0.00 0.00 0.00 175.10 174.30 2qbh s ILE 195 N -2.31 0.04 0.64 2.22 1.01 0.12 -4.82 121.20 118.11 2qbh s ILE 195 Ca 0.33 -1.19 -0.16 0.00 0.00 0.00 0.00 60.65 59.63 2qbh s ILE 195 Cb -0.06 -1.05 -0.01 0.00 0.01 0.00 0.00 42.46 41.35 2qbh s ILE 195 CO 0.21 -0.84 1.15 -0.83 0.00 0.00 0.00 174.94 174.63 2qbh s GLY 196 N 1.64 2.38 -0.12 6.18 0.00 -1.26 -2.30 107.32 113.84 2qbh s GLY 196 Ca 0.13 0.74 -0.05 0.00 0.00 0.00 0.00 44.72 45.54 2qbh s GLY 196 CO -0.20 1.11 0.27 0.14 0.00 0.00 0.00 173.10 174.42 2qbh s VAL 197 N -2.04 -0.19 -0.20 1.40 1.01 -0.88 0.88 120.40 120.39 2qbh s VAL 197 Ca 0.71 0.19 -0.02 0.00 0.00 0.00 0.00 61.98 62.87 2qbh s VAL 197 Cb -0.24 -0.43 -0.00 0.00 0.00 0.00 0.00 36.38 35.71 2qbh s VAL 197 CO 0.38 0.08 -0.10 -0.54 0.00 0.00 0.00 175.10 174.92 2qbh s LYS 198 N 1.71 3.26 -0.14 2.72 1.02 -0.71 -1.99 119.74 125.62 2qbh s LYS 198 Ca -0.05 -0.69 -0.06 0.00 0.02 0.00 0.00 55.97 55.18 2qbh s LYS 198 Cb -0.11 -2.83 -0.04 0.00 -0.52 0.00 0.00 37.83 34.34 2qbh s LYS 198 CO -0.09 -0.14 0.06 0.14 -0.92 0.00 0.00 175.35 174.40 2qbh s VAL 199 N 1.26 4.80 -0.10 3.17 -7.23 -0.27 -2.45 120.40 119.58 2qbh s VAL 199 Ca 0.03 -0.04 0.03 0.00 -1.81 0.00 0.00 61.98 60.19 2qbh s VAL 199 Cb -0.14 -3.11 0.01 0.00 0.56 0.00 0.00 36.38 33.69 2qbh s VAL 199 CO -0.05 0.53 -0.21 0.26 -0.31 0.00 0.00 175.10 175.33 2qbh s TRP 200 N -0.23 2.31 -0.17 2.82 0.51 -0.80 -2.84 118.94 120.54 2qbh s TRP 200 Ca 0.08 -0.99 -0.03 0.00 -2.12 0.00 0.00 56.10 53.04 2qbh s TRP 200 Cb -0.12 -1.58 0.06 0.00 -0.81 0.00 0.00 33.47 31.01 2qbh s TRP 200 CO 0.01 -0.43 0.04 0.42 -0.51 0.00 0.00 176.95 176.48 2qbh s ILE 201 N 0.55 0.38 -0.86 2.03 1.01 -1.11 0.07 121.20 123.27 2qbh s ILE 201 Ca -0.15 -0.38 -0.20 0.00 0.00 0.00 0.00 60.65 59.92 2qbh s ILE 201 Cb -0.17 -0.87 0.11 0.00 0.01 0.00 0.00 42.46 41.55 2qbh s ILE 201 CO 0.05 -0.15 1.09 0.12 0.00 0.00 0.00 174.94 176.05 2qbh s PHE 202 N 1.93 2.97 -0.00 3.97 5.36 0.34 -0.82 117.98 131.72 2qbh s PHE 202 Ca 0.01 -1.14 -0.24 0.00 -0.96 0.00 0.00 56.93 54.60 2qbh s PHE 202 Cb -0.16 -4.30 -0.15 0.00 -0.34 0.00 0.00 43.02 38.07 2qbh s PHE 202 CO -0.08 -1.55 1.09 0.87 -1.46 0.00 0.00 175.22 174.10 2qbh h LYS 203 N 9.08 -0.55 -2.23 10.12 1.57 -1.66 -1.09 116.57 131.81 2qbh h LYS 203 Ca 0.04 0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.78 2qbh h LYS 203 Cb 1.04 0.13 -0.20 0.00 0.08 0.00 0.00 32.23 33.28 2qbh h LYS 203 CO 1.14 -0.25 0.07 0.20 -0.57 0.00 0.00 179.45 180.05 2qbh s GLY 204 N -2.71 -0.48 0.00 3.86 0.00 -1.25 -4.14 107.32 102.60 2qbh s GLY 204 Ca -0.13 1.22 0.00 0.00 0.00 0.00 0.00 44.72 45.81 2qbh s GLY 204 CO 0.47 0.91 0.13 1.18 0.00 0.00 0.00 173.10 175.79 2qbh n GLU 205 N 1.33 0.00 0.00 2.90 -0.58 -1.26 -3.51 120.64 119.52 2qbh n GLU 205 Ca -0.18 0.05 0.00 0.00 -0.42 0.00 0.00 57.16 56.61 2qbh n GLU 205 Cb 0.57 -0.63 0.00 0.00 -0.57 0.00 0.00 31.44 30.80 2qbh n GLU 205 CO 0.00 0.00 0.00 1.51 -0.48 0.00 0.00 177.13 178.16