#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yqr s SER 2 N 0.00 -0.01 0.53 1.61 0.01 -1.26 -5.11 113.70 109.48 2yqr s SER 2 Ca 0.00 0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.36 2yqr s SER 2 Cb 0.00 0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.27 2yqr s SER 2 CO 0.00 -0.09 0.00 -0.24 0.41 0.00 0.00 173.24 173.32 2yqr n SER 3 N 3.76 -7.17 0.00 2.44 2.88 -1.26 -5.03 113.62 109.24 2yqr n SER 3 Ca -0.22 1.20 0.00 0.00 -1.33 0.00 0.00 58.87 58.53 2yqr n SER 3 Cb 0.54 -4.35 0.00 0.00 -0.75 0.00 0.00 64.21 59.65 2yqr n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yqr n GLY 4 N -4.09 0.56 6.71 0.46 0.00 -1.26 -5.14 105.19 102.42 2yqr n GLY 4 Ca -0.07 -0.08 0.01 0.00 0.00 0.00 0.00 46.02 45.87 2yqr n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yqr n SER 5 N 0.00 -4.21 -3.46 1.61 7.64 -1.26 -4.97 113.62 108.96 2yqr n SER 5 Ca 0.00 0.05 -0.14 0.00 1.01 0.00 0.00 58.87 59.79 2yqr n SER 5 Cb 0.00 -0.16 -0.04 0.00 -1.01 0.00 0.00 64.21 63.01 2yqr n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yqr s SER 6 N -4.06 -0.60 0.06 6.43 0.01 -1.26 -5.07 113.70 109.20 2yqr s SER 6 Ca 0.00 0.26 -0.25 0.00 1.31 0.00 0.00 55.95 57.27 2yqr s SER 6 Cb 0.00 0.58 -0.12 0.00 0.21 0.00 0.00 66.02 66.68 2yqr s SER 6 CO 0.00 -0.83 1.39 1.23 0.41 0.00 0.00 173.24 175.44 2yqr h GLY 7 N 2.38 -1.10 -6.39 3.44 0.00 -2.03 -3.21 103.07 96.16 2yqr h GLY 7 Ca -0.31 0.50 -0.81 0.00 0.00 0.00 0.00 47.33 46.71 2yqr h GLY 7 CO 0.38 -0.34 1.03 0.61 0.00 0.00 0.00 176.54 178.22 2yqr n GLY 8 N -1.40 5.88 0.09 4.60 0.00 -1.26 -4.60 105.19 108.50 2yqr n GLY 8 Ca -0.09 -2.58 -0.06 0.00 0.00 0.00 0.00 46.02 43.29 2yqr n GLY 8 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2yqr n MET 9 N 0.34 0.64 -3.12 1.61 0.00 -1.21 -4.92 117.12 110.46 2yqr n MET 9 Ca 0.42 0.21 -0.33 0.00 -0.00 0.00 0.00 57.70 58.00 2yqr n MET 9 Cb 0.28 -1.74 -0.06 0.00 0.00 0.00 0.00 33.22 31.70 2yqr n MET 9 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 175.97 174.96 2yqr s HIS 10 N -2.69 3.39 0.19 1.12 0.09 -1.26 -5.08 115.29 111.05 2yqr s HIS 10 Ca -0.05 1.25 0.01 0.00 -0.00 0.00 0.00 55.06 56.27 2yqr s HIS 10 Cb 0.08 -2.56 -0.04 0.00 -0.00 0.00 0.00 32.58 30.07 2yqr s HIS 10 CO 0.82 0.11 0.35 0.71 -0.00 0.00 0.00 174.74 176.74 2yqr s TYR 11 N -1.95 3.48 -0.04 1.40 1.51 -1.26 -4.64 117.35 115.85 2yqr s TYR 11 Ca 0.53 0.23 0.05 0.00 -1.01 0.00 0.00 57.07 56.87 2yqr s TYR 11 Cb -0.11 -1.76 -0.01 0.00 -0.11 0.00 0.00 41.96 39.97 2yqr s TYR 11 CO 0.18 0.43 -0.19 0.14 -1.11 0.00 0.00 175.55 174.99 2yqr s VAL 12 N -1.85 1.57 0.23 0.71 -7.23 0.33 -5.00 120.40 109.16 2yqr s VAL 12 Ca 0.37 -0.80 0.09 0.00 -1.81 0.00 0.00 61.98 59.83 2yqr s VAL 12 Cb -0.11 -1.34 -0.05 0.00 0.56 0.00 0.00 36.38 35.44 2yqr s VAL 12 CO 0.29 0.45 -0.16 -1.10 -0.31 0.00 0.00 175.10 174.26 2yqr s GLN 13 N -0.07 1.45 0.28 4.82 1.11 -1.26 -1.33 119.66 124.65 2yqr s GLN 13 Ca -0.02 -1.64 0.03 0.00 0.01 0.00 0.00 55.36 53.74 2yqr s GLN 13 Cb -0.11 -1.35 -0.06 0.00 -1.01 0.00 0.00 33.01 30.48 2yqr s GLN 13 CO 0.02 0.24 0.04 0.34 0.01 0.00 0.00 175.29 175.93 2yqr s ASP 14 N -3.36 1.99 -0.22 5.90 -1.08 -0.67 -4.96 116.67 114.28 2yqr s ASP 14 Ca 0.25 -1.31 -0.04 0.00 -0.52 0.00 0.00 52.55 50.93 2yqr s ASP 14 Cb -0.02 -0.01 0.11 0.00 -1.46 0.00 0.00 42.92 41.54 2yqr s ASP 14 CO 0.10 -0.58 0.33 -0.54 0.52 0.00 0.00 175.17 175.00 2yqr s LYS 15 N -3.90 0.28 -0.29 4.34 1.02 -1.26 -2.91 119.74 117.03 2yqr s LYS 15 Ca 0.34 0.53 -0.03 0.00 0.02 0.00 0.00 55.97 56.82 2yqr s LYS 15 Cb 0.07 -0.53 0.04 0.00 -0.52 0.00 0.00 37.83 36.89 2yqr s LYS 15 CO 0.13 -0.56 0.02 -0.51 -0.92 0.00 0.00 175.35 173.50 2yqr s LEU 16 N 2.48 3.80 -0.62 3.17 1.02 -0.13 -4.94 118.68 123.47 2yqr s LEU 16 Ca 0.08 -1.06 -0.27 0.00 0.02 0.00 0.00 54.13 52.90 2yqr s LEU 16 Cb -0.15 -1.76 0.04 0.00 0.02 0.00 0.00 46.19 44.34 2yqr s LEU 16 CO -0.14 -0.23 1.15 -0.36 0.02 0.00 0.00 176.35 176.79 2yqr s PHE 17 N 1.34 2.57 0.53 0.29 0.40 -1.26 -0.30 117.98 121.55 2yqr s PHE 17 Ca -0.02 0.15 0.25 0.00 -0.60 0.00 0.00 56.93 56.71 2yqr s PHE 17 Cb -0.19 -4.44 1.40 0.00 0.51 0.00 0.00 43.02 40.31 2yqr s PHE 17 CO -0.01 -1.66 2.00 -0.39 0.70 0.00 0.00 175.22 175.86 2yqr h VAL 18 N 6.09 0.73 -5.94 -0.44 -1.51 -1.95 -3.46 116.25 109.76 2yqr h VAL 18 Ca -0.26 0.00 -0.39 0.00 -1.23 0.00 0.00 66.70 64.82 2yqr h VAL 18 Cb 1.06 0.73 0.09 0.00 -2.13 0.00 0.00 31.29 31.05 2yqr h VAL 18 CO 1.19 0.00 -0.83 0.61 -1.23 0.00 0.00 177.57 177.31 2yqr n GLY 19 N -1.64 -0.41 0.77 5.19 0.00 -1.26 -4.91 105.19 102.93 2yqr n GLY 19 Ca 0.10 0.17 0.05 0.00 0.00 0.00 0.00 46.02 46.34 2yqr n GLY 19 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2yqr n LEU 20 N -4.15 1.53 0.26 0.99 7.94 -1.26 -4.80 117.00 117.51 2yqr n LEU 20 Ca -0.27 -2.54 0.11 0.00 -1.11 0.00 0.00 56.01 52.20 2yqr n LEU 20 Cb 0.67 -0.23 0.68 0.00 0.53 0.00 0.00 43.42 45.07 2yqr n LEU 20 CO 0.66 0.75 0.97 1.05 -1.11 0.00 0.00 177.39 179.70 2yqr h GLU 21 N 0.61 0.00 0.00 1.96 4.11 -1.94 -1.67 114.58 117.65 2yqr h GLU 21 Ca -0.07 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.27 2yqr h GLU 21 Cb 1.37 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.61 2yqr h GLU 21 CO 0.03 0.13 -0.41 1.12 0.07 0.00 0.00 179.01 179.95 2yqr h HIS 22 N 0.00 0.00 -2.43 2.06 2.07 -2.02 -3.45 115.15 111.38 2yqr h HIS 22 Ca -0.00 0.00 -0.61 0.00 -2.85 0.00 0.00 60.37 56.91 2yqr h HIS 22 Cb 0.30 0.00 0.09 0.00 2.57 0.00 0.00 27.41 30.37 2yqr h HIS 22 CO 0.00 0.41 0.40 0.00 -3.07 0.00 0.00 177.93 175.67 2yqr n ALA 23 N -2.29 0.23 -1.14 6.11 0.00 -0.63 -4.89 120.51 117.90 2yqr n ALA 23 Ca 0.00 0.42 -0.35 0.00 0.00 0.00 0.00 53.44 53.51 2yqr n ALA 23 Cb 0.55 -2.14 0.08 0.00 0.00 0.00 0.00 19.45 17.94 2yqr n ALA 23 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2yqr n VAL 24 N 1.35 1.34 0.35 0.00 0.24 -1.26 -4.86 118.33 115.48 2yqr n VAL 24 Ca 0.12 -0.34 0.14 0.00 -2.04 0.00 0.00 64.34 62.22 2yqr n VAL 24 Cb 0.29 -0.72 0.58 0.00 -1.47 0.00 0.00 33.84 32.52 2yqr n VAL 24 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2yqr h PRO 25 N -0.70 0.00 0.01 7.34 0.13 -1.95 -2.82 132.00 134.01 2yqr h PRO 25 Ca -0.45 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.49 2yqr h PRO 25 Cb 1.33 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.44 2yqr h PRO 25 CO 0.40 0.00 -0.89 1.79 -0.23 0.00 0.00 178.00 179.07 2yqr h THR 26 N 0.00 1.58 -0.72 1.56 1.35 -2.02 -3.24 112.91 111.42 2yqr h THR 26 Ca 0.00 -2.88 -0.06 0.00 -0.55 0.00 0.00 66.41 62.91 2yqr h THR 26 Cb 0.41 2.59 -0.03 0.00 -1.73 0.00 0.00 68.15 69.39 2yqr h THR 26 CO 0.00 0.83 0.21 0.15 -0.25 0.00 0.00 175.52 176.46 2yqr h PHE 27 N 0.03 1.17 -5.63 4.73 3.57 -1.85 -3.47 116.94 115.49 2yqr h PHE 27 Ca -0.02 -0.12 -0.30 0.00 3.53 0.00 0.00 57.97 61.06 2yqr h PHE 27 Cb 1.55 -0.34 0.17 0.00 2.79 0.00 0.00 35.95 40.12 2yqr h PHE 27 CO 0.01 0.93 -0.86 0.09 -2.23 0.00 0.00 178.31 176.25 2yqr n ASN 28 N -4.25 -5.54 -0.32 0.41 4.13 -1.23 -4.83 115.26 103.65 2yqr n ASN 28 Ca 0.06 -0.75 0.14 0.00 1.68 0.00 0.00 54.58 55.71 2yqr n ASN 28 Cb 0.24 -4.85 0.37 0.00 -1.54 0.00 0.00 39.78 34.00 2yqr n ASN 28 CO 0.00 0.00 0.00 1.62 0.28 0.00 0.00 177.26 179.16 2yqr h VAL 29 N -1.36 0.73 -0.61 2.41 3.04 -1.91 -0.56 116.25 117.99 2yqr h VAL 29 Ca -0.62 -0.23 0.09 0.00 -1.01 0.00 0.00 66.70 64.93 2yqr h VAL 29 Cb 1.32 -0.01 -0.07 0.00 -2.01 0.00 0.00 31.29 30.53 2yqr h VAL 29 CO 0.46 0.12 0.23 0.50 -1.01 0.00 0.00 177.57 177.88 2yqr h LYS 30 N 0.68 0.40 0.00 4.17 3.64 -1.94 0.26 116.57 123.79 2yqr h LYS 30 Ca 0.53 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.85 2yqr h LYS 30 Cb 0.92 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.65 2yqr h LYS 30 CO -0.29 0.27 -0.16 0.93 -2.27 0.00 0.00 179.45 177.93 2yqr h GLU 31 N 0.42 0.00 0.01 1.90 4.39 -1.45 -2.10 114.58 117.74 2yqr h GLU 31 Ca 0.31 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.01 2yqr h GLU 31 Cb 0.38 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.03 2yqr h GLU 31 CO -0.30 0.16 -0.00 0.87 -1.16 0.00 0.00 179.01 178.57 2yqr h LYS 32 N 0.00 -0.01 -0.97 2.33 1.79 -0.45 0.24 116.57 119.50 2yqr h LYS 32 Ca -0.00 0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.52 2yqr h LYS 32 Cb 0.54 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.13 2yqr h LYS 32 CO 0.02 0.67 0.63 -0.24 -1.08 0.00 0.00 179.45 179.45 2yqr h VAL 33 N -0.98 1.12 0.00 0.50 3.04 -0.61 -1.51 116.25 117.82 2yqr h VAL 33 Ca -0.00 -0.40 0.00 0.00 -1.01 0.00 0.00 66.70 65.29 2yqr h VAL 33 Cb 0.68 -0.15 0.00 0.00 -2.01 0.00 0.00 31.29 29.82 2yqr h VAL 33 CO 0.00 0.21 -0.74 -1.84 -1.01 0.00 0.00 177.57 174.20 2yqr n GLU 34 N -4.47 0.22 -1.45 4.17 0.28 -0.79 -4.08 120.64 114.52 2yqr n GLU 34 Ca 0.14 0.04 0.19 0.00 -0.16 0.00 0.00 57.16 57.37 2yqr n GLU 34 Cb 0.15 -1.61 -0.05 0.00 1.43 0.00 0.00 31.44 31.35 2yqr n GLU 34 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2yqr n GLY 35 N 1.39 -2.08 3.72 -1.84 0.00 0.84 -3.11 105.19 104.10 2yqr n GLY 35 Ca 0.03 -1.11 -0.42 0.00 0.00 0.00 0.00 46.02 44.52 2yqr n GLY 35 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yqr s PRO 36 N -2.52 4.35 -1.30 1.61 0.04 -1.26 -3.00 135.00 132.93 2yqr s PRO 36 Ca 0.00 2.03 -0.02 0.00 0.04 0.00 0.00 61.00 63.05 2yqr s PRO 36 Cb 0.00 -3.25 0.01 0.00 0.04 0.00 0.00 34.50 31.30 2yqr s PRO 36 CO 0.00 -0.38 0.15 0.41 0.04 0.00 0.00 177.00 177.23 2yqr n GLY 37 N 3.23 -0.50 2.42 0.56 0.00 -1.26 -0.12 105.19 109.52 2yqr n GLY 37 Ca 0.10 0.03 -0.17 0.00 0.00 0.00 0.00 46.02 45.98 2yqr n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yqr h SER 39 N 0.00 -0.38 0.19 0.00 0.02 -0.48 0.12 113.55 113.02 2yqr h SER 39 Ca -0.39 -0.08 0.01 0.00 -0.84 0.00 0.00 61.79 60.49 2yqr h SER 39 Cb 1.22 0.10 -0.04 0.00 0.14 0.00 0.00 62.40 63.82 2yqr h SER 39 CO 0.51 -0.15 -0.53 1.88 -1.14 0.00 0.00 176.83 177.40 2yqr h TYR 40 N -0.59 -1.52 -0.90 3.45 -1.99 -1.77 -0.92 116.97 112.73 2yqr h TYR 40 Ca -0.05 0.04 0.06 0.00 2.00 0.00 0.00 58.73 60.78 2yqr h TYR 40 Cb 0.43 0.64 -0.06 0.00 2.00 0.00 0.00 36.73 39.74 2yqr h TYR 40 CO -0.02 -0.62 0.58 -0.07 -0.00 0.00 0.00 178.16 178.04 2yqr h LEU 41 N -0.81 0.89 -0.55 3.88 4.07 -1.59 -2.06 115.31 119.15 2yqr h LEU 41 Ca -0.02 0.01 0.06 0.00 0.08 0.00 0.00 57.88 58.01 2yqr h LEU 41 Cb 0.79 -0.19 -0.06 0.00 1.08 0.00 0.00 40.66 42.29 2yqr h LEU 41 CO -0.25 0.57 0.24 1.56 -1.08 0.00 0.00 178.44 179.49 2yqr h GLN 42 N 1.01 0.45 0.20 1.13 1.08 0.12 -0.27 115.11 118.83 2yqr h GLN 42 Ca 0.39 -0.03 0.01 0.00 -1.45 0.00 0.00 58.65 57.57 2yqr h GLN 42 Cb 0.20 -0.10 -0.04 0.00 -0.05 0.00 0.00 27.48 27.49 2yqr h GLN 42 CO -0.14 0.30 -0.53 1.25 -0.95 0.00 0.00 178.83 178.75 2yqr h HIS 43 N 0.46 -1.52 0.00 2.96 2.76 -0.45 0.29 115.15 119.64 2yqr h HIS 43 Ca 0.26 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.46 2yqr h HIS 43 Cb 0.24 0.64 -0.00 0.00 1.55 0.00 0.00 27.41 29.83 2yqr h HIS 43 CO -0.13 -0.62 -0.02 0.82 -1.30 0.00 0.00 177.93 176.68 2yqr h ILE 44 N -0.81 0.50 0.00 6.26 2.04 -1.47 0.25 117.51 124.27 2yqr h ILE 44 Ca -0.02 -0.10 -0.13 0.00 1.00 0.00 0.00 64.86 65.62 2yqr h ILE 44 Cb 0.79 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 2yqr h ILE 44 CO -0.24 0.02 -0.61 1.56 0.00 0.00 0.00 178.15 178.88 2yqr h GLN 45 N 0.00 0.00 0.00 2.37 4.20 0.64 -2.59 115.11 119.73 2yqr h GLN 45 Ca -0.00 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.54 2yqr h GLN 45 Cb 0.06 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 2yqr h GLN 45 CO 0.00 0.61 -1.70 -0.89 -0.67 0.00 0.00 178.83 176.17 2yqr n ILE 46 N -3.35 0.98 0.13 2.54 5.41 0.84 -0.62 119.36 125.28 2yqr n ILE 46 Ca 0.01 -0.68 0.01 0.00 1.00 0.00 0.00 62.75 63.08 2yqr n ILE 46 Cb 0.73 -0.53 0.02 0.00 -0.71 0.00 0.00 39.64 39.15 2yqr n ILE 46 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2yqr h GLU 47 N 0.00 0.00 0.00 0.38 4.39 -0.63 -3.35 114.58 115.37 2yqr h GLU 47 Ca -0.21 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.46 2yqr h GLU 47 Cb 1.59 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.23 2yqr h GLU 47 CO 0.03 0.58 -1.27 0.25 -1.16 0.00 0.00 179.01 177.45 2yqr n THR 48 N -3.27 0.15 -1.09 1.13 -2.24 -0.98 -5.02 114.28 102.97 2yqr n THR 48 Ca 0.01 -0.15 -0.03 0.00 -2.27 0.00 0.00 64.05 61.61 2yqr n THR 48 Cb 0.76 -0.20 -0.01 0.00 -2.10 0.00 0.00 70.33 68.78 2yqr n THR 48 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yqr n GLY 49 N 2.45 0.62 3.91 3.38 0.00 0.20 -4.87 105.19 110.88 2yqr n GLY 49 Ca -0.04 -0.74 -0.23 0.00 0.00 0.00 0.00 46.02 45.01 2yqr n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yqr s ALA 50 N -2.08 3.82 -0.54 4.61 0.00 -1.20 -5.00 121.76 121.37 2yqr s ALA 50 Ca 0.00 -1.23 -0.26 0.00 0.00 0.00 0.00 51.96 50.47 2yqr s ALA 50 Cb 0.00 -1.60 0.03 0.00 0.00 0.00 0.00 23.12 21.55 2yqr s ALA 50 CO 0.00 0.34 1.05 0.15 0.00 0.00 0.00 175.76 177.30 2yqr s LYS 51 N -3.68 3.45 -0.22 0.00 1.02 -0.50 -4.53 119.74 115.29 2yqr s LYS 51 Ca 0.33 0.05 -0.05 0.00 0.02 0.00 0.00 55.97 56.32 2yqr s LYS 51 Cb -0.09 -4.01 -0.02 0.00 -0.52 0.00 0.00 37.83 33.19 2yqr s LYS 51 CO 0.27 -1.52 -0.02 0.08 -0.92 0.00 0.00 175.35 173.25 2yqr s VAL 52 N 4.34 3.67 -0.07 3.17 1.01 -1.26 -0.06 120.40 131.19 2yqr s VAL 52 Ca 0.37 -0.40 -0.06 0.00 0.00 0.00 0.00 61.98 61.90 2yqr s VAL 52 Cb -0.10 -2.67 0.02 0.00 0.00 0.00 0.00 36.38 33.63 2yqr s VAL 52 CO 0.23 0.41 0.19 0.72 0.00 0.00 0.00 175.10 176.66 2yqr s PHE 53 N 1.33 -0.21 0.24 5.22 -0.12 -0.42 -4.95 117.98 119.06 2yqr s PHE 53 Ca 0.04 0.53 -0.30 0.00 -0.05 0.00 0.00 56.93 57.16 2yqr s PHE 53 Cb -0.14 0.05 -0.09 0.00 -0.63 0.00 0.00 43.02 42.20 2yqr s PHE 53 CO -0.00 -0.12 1.23 -1.17 -0.05 0.00 0.00 175.22 175.10 2yqr s LEU 54 N 0.36 4.46 0.21 -1.99 2.96 -1.26 -2.12 118.68 121.30 2yqr s LEU 54 Ca -0.02 2.38 -0.02 0.00 -0.22 0.00 0.00 54.13 56.25 2yqr s LEU 54 Cb -0.04 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 43.00 2yqr s LEU 54 CO -0.02 -0.39 0.17 -0.60 -1.32 0.00 0.00 176.35 174.19 2yqr s ARG 55 N -0.82 1.24 0.00 1.98 3.52 -0.46 -4.88 118.95 119.53 2yqr s ARG 55 Ca 0.51 -1.60 0.00 0.00 -0.13 0.00 0.00 55.73 54.51 2yqr s ARG 55 Cb -0.35 0.29 0.00 0.00 -1.56 0.00 0.00 34.95 33.33 2yqr s ARG 55 CO 0.41 -0.42 0.00 0.41 -0.81 0.00 0.00 175.30 174.90 2yqr n GLY 56 N -0.29 -0.05 3.63 8.12 0.00 -1.26 -0.41 105.19 114.94 2yqr n GLY 56 Ca 0.02 -1.84 -0.48 0.00 0.00 0.00 0.00 46.02 43.72 2yqr n GLY 56 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2yqr n LYS 57 N 0.01 1.66 0.00 1.61 4.81 0.82 -0.69 118.16 126.39 2yqr n LYS 57 Ca 0.00 0.60 0.00 0.00 -0.87 0.00 0.00 58.31 58.04 2yqr n LYS 57 Cb 0.00 -2.27 0.00 0.00 0.02 0.00 0.00 35.03 32.78 2yqr n LYS 57 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2yqr n GLY 58 N 2.71 3.26 0.22 3.14 0.00 -1.26 -0.10 105.19 113.16 2yqr n GLY 58 Ca 0.16 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.26 2yqr n GLY 58 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2yqr h SER 59 N 0.00 0.00 0.00 1.61 4.64 -1.15 -3.47 113.55 115.18 2yqr h SER 59 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2yqr h SER 59 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2yqr h SER 59 CO 0.00 0.26 0.00 0.61 -0.87 0.00 0.00 176.83 176.83 2yqr n GLY 60 N -0.31 2.64 3.56 -0.77 0.00 -1.26 -4.88 105.19 104.17 2yqr n GLY 60 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 2yqr n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yqr h ILE 62 N 7.48 0.15 -4.62 0.00 1.08 -1.90 -3.35 117.51 116.34 2yqr h ILE 62 Ca -0.09 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.39 2yqr h ILE 62 Cb 1.10 0.97 -0.11 0.00 -3.07 0.00 0.00 36.82 35.71 2yqr h ILE 62 CO 1.12 0.00 -1.30 -0.62 -0.69 0.00 0.00 178.15 176.66 2yqr n GLU 63 N -3.28 -3.75 0.00 2.37 1.02 -1.26 -1.76 120.64 113.98 2yqr n GLU 63 Ca -0.03 2.92 0.07 0.00 -0.02 0.00 0.00 57.16 60.10 2yqr n GLU 63 Cb 0.11 -4.35 0.34 0.00 -0.02 0.00 0.00 31.44 27.51 2yqr n GLU 63 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 2yqr n PRO 64 N 1.36 0.10 -0.15 3.49 -0.04 -1.26 -0.02 135.00 138.48 2yqr n PRO 64 Ca -0.34 0.21 -0.10 0.00 -0.04 0.00 0.00 63.50 63.22 2yqr n PRO 64 Cb 0.52 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.47 2yqr n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2yqr h ALA 65 N 2.59 0.58 0.00 0.55 0.00 -1.94 -3.39 119.26 117.65 2yqr h ALA 65 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2yqr h ALA 65 Cb 0.20 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2yqr h ALA 65 CO 0.00 0.41 -0.77 0.45 0.00 0.00 0.00 179.25 179.34 2yqr n SER 66 N -4.37 3.41 0.00 0.00 2.88 -1.16 -5.04 113.62 109.34 2yqr n SER 66 Ca -0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2yqr n SER 66 Cb 0.32 0.17 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 2yqr n SER 66 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yqr n GLY 67 N 2.77 1.38 3.36 0.46 0.00 0.97 -5.10 105.19 109.03 2yqr n GLY 67 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2yqr n GLY 67 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2yqr s ARG 68 N -0.12 1.61 1.11 1.61 1.04 -0.72 -4.76 118.95 118.71 2yqr s ARG 68 Ca 0.00 -1.20 -0.19 0.00 -1.04 0.00 0.00 55.73 53.30 2yqr s ARG 68 Cb 0.00 -1.92 0.10 0.00 -2.04 0.00 0.00 34.95 31.09 2yqr s ARG 68 CO 0.00 0.48 0.00 0.39 -0.04 0.00 0.00 175.30 176.13 2yqr n GLU 69 N 1.41 -1.52 -0.56 3.89 1.02 -1.17 -4.40 120.64 119.31 2yqr n GLU 69 Ca -0.17 -0.43 -0.29 0.00 -0.02 0.00 0.00 57.16 56.25 2yqr n GLU 69 Cb 0.52 -1.70 0.22 0.00 -0.02 0.00 0.00 31.44 30.47 2yqr n GLU 69 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2yqr s ALA 70 N -2.24 0.24 0.04 0.62 0.00 -1.26 -4.87 121.76 114.29 2yqr s ALA 70 Ca 0.56 0.20 -0.14 0.00 0.00 0.00 0.00 51.96 52.58 2yqr s ALA 70 Cb -0.12 -3.35 -0.33 0.00 0.00 0.00 0.00 23.12 19.33 2yqr s ALA 70 CO 0.66 -3.48 1.05 0.35 0.00 0.00 0.00 175.76 174.34 2yqr h PHE 71 N -2.38 0.93 -4.37 0.00 3.57 -1.96 -3.33 116.94 109.42 2yqr h PHE 71 Ca -0.54 -0.66 -0.50 0.00 3.53 0.00 0.00 57.97 59.80 2yqr h PHE 71 Cb 1.31 -0.05 0.08 0.00 2.79 0.00 0.00 35.95 40.08 2yqr h PHE 71 CO 0.36 1.51 0.39 -1.21 -2.23 0.00 0.00 178.31 177.13 2yqr s GLU 72 N -2.71 2.95 0.86 1.11 2.02 -1.26 -4.83 118.70 116.85 2yqr s GLU 72 Ca -0.08 0.73 -0.11 0.00 0.02 0.00 0.00 54.97 55.52 2yqr s GLU 72 Cb 0.05 -2.01 0.11 0.00 0.10 0.00 0.00 34.13 32.38 2yqr s GLU 72 CO 0.94 -1.03 1.09 -1.25 0.02 0.00 0.00 175.26 175.03 2yqr s PRO 73 N -5.17 1.52 0.60 0.39 0.04 -1.26 -0.13 135.00 130.99 2yqr s PRO 73 Ca 0.58 0.91 -0.19 0.00 0.04 0.00 0.00 61.00 62.34 2yqr s PRO 73 Cb -0.13 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.54 2yqr s PRO 73 CO 0.54 -2.08 1.02 0.00 0.04 0.00 0.00 177.00 176.52 2yqr n MET 74 N -3.79 0.97 -3.54 4.56 0.00 0.86 -4.11 117.12 112.08 2yqr n MET 74 Ca 0.08 0.38 -0.10 0.00 0.00 0.00 0.00 57.70 58.05 2yqr n MET 74 Cb 0.55 -2.23 -0.02 0.00 0.00 0.00 0.00 33.22 31.52 2yqr n MET 74 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 175.97 177.49 2yqr s TYR 75 N -1.48 -0.42 0.06 3.17 -0.85 0.46 -4.02 117.35 114.27 2yqr s TYR 75 Ca 0.76 0.17 -0.25 0.00 -0.52 0.00 0.00 57.07 57.23 2yqr s TYR 75 Cb -0.42 0.59 -0.06 0.00 0.38 0.00 0.00 41.96 42.46 2yqr s TYR 75 CO 0.47 -0.87 0.76 0.42 -1.52 0.00 0.00 175.55 174.80 2yqr s ILE 76 N -3.65 4.69 -0.16 -3.49 1.01 0.59 -1.36 121.20 118.83 2yqr s ILE 76 Ca 0.04 1.62 0.01 0.00 0.00 0.00 0.00 60.65 62.32 2yqr s ILE 76 Cb -0.02 -4.11 0.03 0.00 0.01 0.00 0.00 42.46 38.37 2yqr s ILE 76 CO -0.08 0.39 -0.14 -0.47 0.00 0.00 0.00 174.94 174.64 2yqr s TYR 77 N -0.22 2.30 -0.02 3.97 6.14 -0.90 -0.95 117.35 127.67 2yqr s TYR 77 Ca 0.38 -1.36 0.00 0.00 0.64 0.00 0.00 57.07 56.73 2yqr s TYR 77 Cb -0.21 -1.65 -0.04 0.00 0.42 0.00 0.00 41.96 40.49 2yqr s TYR 77 CO 0.23 -0.70 0.03 0.42 0.64 0.00 0.00 175.55 176.17 2yqr s ILE 78 N 1.44 4.39 -0.22 3.14 1.01 -1.14 -1.31 121.20 128.51 2yqr s ILE 78 Ca 0.04 -0.46 -0.02 0.00 0.00 0.00 0.00 60.65 60.21 2yqr s ILE 78 Cb -0.14 -2.95 0.07 0.00 0.01 0.00 0.00 42.46 39.45 2yqr s ILE 78 CO -0.10 0.41 0.03 -0.94 0.00 0.00 0.00 174.94 174.34 2yqr s SER 79 N -1.48 3.31 -0.02 3.58 1.04 0.91 -1.67 113.70 119.37 2yqr s SER 79 Ca 0.19 -1.05 0.03 0.00 0.48 0.00 0.00 55.95 55.60 2yqr s SER 79 Cb -0.12 -0.76 -0.00 0.00 0.10 0.00 0.00 66.02 65.24 2yqr s SER 79 CO 0.10 -0.31 -0.10 -2.28 0.98 0.00 0.00 173.24 171.62 2yqr s HIS 80 N 1.72 1.04 -1.05 5.02 5.04 -0.45 -1.40 115.29 125.22 2yqr s HIS 80 Ca 0.00 -0.25 0.14 0.00 -1.54 0.00 0.00 55.06 53.41 2yqr s HIS 80 Cb -0.17 -0.72 0.62 0.00 0.04 0.00 0.00 32.58 32.35 2yqr s HIS 80 CO -0.11 -0.09 1.45 -0.35 -2.34 0.00 0.00 174.74 173.30 2yqr n PRO 81 N 3.17 0.02 -4.11 2.88 -0.04 -1.26 -0.51 135.00 135.15 2yqr n PRO 81 Ca -0.17 0.24 -0.12 0.00 -0.04 0.00 0.00 63.50 63.41 2yqr n PRO 81 Cb 0.55 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.40 2yqr n PRO 81 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2yqr s LYS 82 N -2.95 0.65 0.32 0.54 1.02 -1.26 -4.52 119.74 113.54 2yqr s LYS 82 Ca 0.08 -0.98 0.11 0.00 0.02 0.00 0.00 55.97 55.19 2yqr s LYS 82 Cb 0.09 -0.28 0.52 0.00 -0.52 0.00 0.00 37.83 37.64 2yqr s LYS 82 CO 0.25 0.03 1.71 -1.00 -0.92 0.00 0.00 175.35 175.43 2yqr h PRO 83 N 3.92 0.04 0.12 -1.68 0.13 -1.93 -2.81 132.00 129.80 2yqr h PRO 83 Ca -0.36 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 2yqr h PRO 83 Cb 1.19 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 2yqr h PRO 83 CO 0.50 0.52 -0.31 0.93 -0.23 0.00 0.00 178.00 179.41 2yqr h GLU 84 N 0.03 -0.46 -0.58 0.86 4.39 -1.97 0.14 114.58 116.99 2yqr h GLU 84 Ca -0.00 0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.67 2yqr h GLU 84 Cb 0.87 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.61 2yqr h GLU 84 CO 0.07 -0.31 0.12 0.78 -1.16 0.00 0.00 179.01 178.51 2yqr h GLY 85 N -0.48 1.02 0.24 -3.84 0.00 -1.89 -2.54 103.07 95.58 2yqr h GLY 85 Ca -0.01 -0.66 0.17 0.00 0.00 0.00 0.00 47.33 46.82 2yqr h GLY 85 CO -0.14 0.62 0.62 -2.00 0.00 0.00 0.00 176.54 175.63 2yqr h LEU 86 N 0.85 0.84 -0.52 3.11 7.12 -1.30 0.34 115.31 125.75 2yqr h LEU 86 Ca 0.18 0.08 -0.07 0.00 0.13 0.00 0.00 57.88 58.20 2yqr h LEU 86 Cb 0.38 -0.08 -0.01 0.00 -0.53 0.00 0.00 40.66 40.43 2yqr h LEU 86 CO 0.01 0.35 -0.33 0.00 -0.13 0.00 0.00 178.44 178.34 2yqr h ALA 87 N 1.61 0.87 0.03 1.25 0.00 -0.74 -3.02 119.26 119.26 2yqr h ALA 87 Ca 0.55 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 2yqr h ALA 87 Cb 0.76 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2yqr h ALA 87 CO -0.34 0.42 -0.02 0.00 0.00 0.00 0.00 179.25 179.31 2yqr h ALA 88 N 1.67 -0.04 -0.64 0.00 0.00 -0.10 -3.07 119.26 117.08 2yqr h ALA 88 Ca -0.00 -0.20 0.12 0.00 0.00 0.00 0.00 54.91 54.83 2yqr h ALA 88 Cb 1.05 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.77 2yqr h ALA 88 CO 0.04 -0.05 0.16 0.00 0.00 0.00 0.00 179.25 179.41 2yqr h ALA 89 N -0.58 0.79 -0.01 0.00 0.00 -0.65 0.20 119.26 119.01 2yqr h ALA 89 Ca -0.00 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2yqr h ALA 89 Cb 0.42 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2yqr h ALA 89 CO 0.01 -0.29 -0.08 -0.22 0.00 0.00 0.00 179.25 178.66 2yqr h LYS 90 N 0.29 0.02 -0.03 0.00 3.64 -1.67 -0.95 116.57 117.87 2yqr h LYS 90 Ca 0.34 -0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.55 2yqr h LYS 90 Cb 0.52 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.32 2yqr h LYS 90 CO -0.41 0.10 -0.73 0.87 -2.27 0.00 0.00 179.45 177.01 2yqr h LYS 91 N 0.02 0.19 0.03 1.90 1.57 -0.55 -3.14 116.57 116.59 2yqr h LYS 91 Ca 0.00 -0.17 -0.25 0.00 -1.87 0.00 0.00 60.65 58.36 2yqr h LYS 91 Cb 0.16 0.04 0.01 0.00 0.08 0.00 0.00 32.23 32.52 2yqr h LYS 91 CO 0.01 0.84 -1.03 -0.07 -0.57 0.00 0.00 179.45 178.63 2yqr h LEU 92 N 0.13 0.67 -0.62 2.94 3.38 -0.32 -3.25 115.31 118.24 2yqr h LEU 92 Ca -0.02 -0.56 0.05 0.00 0.09 0.00 0.00 57.88 57.44 2yqr h LEU 92 Cb 1.29 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.78 2yqr h LEU 92 CO 0.11 1.37 0.34 0.00 0.09 0.00 0.00 178.44 180.35 2yqr h GLU 94 N 0.64 1.02 -0.06 0.00 5.08 -1.60 0.08 114.58 119.74 2yqr h GLU 94 Ca 0.27 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.50 2yqr h GLU 94 Cb 0.16 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 2yqr h GLU 94 CO -0.17 0.68 -0.32 -0.97 -1.00 0.00 0.00 179.01 177.22 2yqr h ASN 95 N 1.05 0.11 -0.06 1.42 -1.24 -1.40 -2.86 115.58 112.60 2yqr h ASN 95 Ca 0.35 -0.04 -0.16 0.00 0.71 0.00 0.00 56.30 57.17 2yqr h ASN 95 Cb 0.05 -0.03 0.01 0.00 0.73 0.00 0.00 38.32 39.08 2yqr h ASN 95 CO -0.13 0.43 -0.57 0.25 -1.29 0.00 0.00 177.43 176.12 2yqr h LEU 96 N 0.10 0.62 -1.14 0.34 6.46 -0.25 -3.24 115.31 118.20 2yqr h LEU 96 Ca 0.01 -0.69 0.10 0.00 -0.12 0.00 0.00 57.88 57.18 2yqr h LEU 96 Cb 0.62 -0.18 -0.07 0.00 -0.73 0.00 0.00 40.66 40.30 2yqr h LEU 96 CO 0.05 1.21 0.60 -0.07 -0.62 0.00 0.00 178.44 179.60 2yqr h LEU 97 N 0.07 0.86 -1.72 2.25 3.38 -0.90 -0.18 115.31 119.07 2yqr h LEU 97 Ca -0.05 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.00 2yqr h LEU 97 Cb 1.24 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.81 2yqr h LEU 97 CO 0.12 0.51 0.29 1.56 0.09 0.00 0.00 178.44 181.00 2yqr h GLN 98 N 0.95 0.34 0.35 1.13 4.20 -1.53 0.19 115.11 120.74 2yqr h GLN 98 Ca 0.43 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 59.10 2yqr h GLN 98 Cb 0.38 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.09 2yqr h GLN 98 CO -0.19 0.22 -0.17 1.15 -0.67 0.00 0.00 178.83 179.17 2yqr h THR 99 N 0.35 0.38 -0.58 -0.54 2.02 -1.10 -2.86 112.91 110.58 2yqr h THR 99 Ca 0.19 -0.72 -0.00 0.00 0.77 0.00 0.00 66.41 66.65 2yqr h THR 99 Cb 0.30 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 2yqr h THR 99 CO -0.04 0.09 0.35 1.62 0.37 0.00 0.00 175.52 177.90 2yqr h VAL 100 N -1.00 1.16 -0.07 3.16 3.04 -1.27 -1.49 116.25 119.78 2yqr h VAL 100 Ca -0.05 -0.35 -0.02 0.00 -1.01 0.00 0.00 66.70 65.27 2yqr h VAL 100 Cb 0.51 0.35 -0.01 0.00 -2.01 0.00 0.00 31.29 30.13 2yqr h VAL 100 CO 0.08 0.17 -0.04 0.45 -1.01 0.00 0.00 177.57 177.22 2yqr h HIS 101 N 0.79 0.10 0.00 3.17 -0.00 -0.68 -1.27 115.15 117.27 2yqr h HIS 101 Ca 0.21 -0.00 -0.09 0.00 -0.00 0.00 0.00 60.37 60.48 2yqr h HIS 101 Cb -0.04 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 27.33 2yqr h HIS 101 CO 0.00 0.15 -0.43 0.00 -0.00 0.00 0.00 177.93 177.65 2yqr h ALA 102 N 1.86 0.91 -0.18 2.45 0.00 -1.03 -3.13 119.26 120.15 2yqr h ALA 102 Ca 0.03 -0.39 -0.12 0.00 0.00 0.00 0.00 54.91 54.42 2yqr h ALA 102 Cb 0.14 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2yqr h ALA 102 CO 0.01 0.54 -0.37 0.93 0.00 0.00 0.00 179.25 180.35 2yqr h GLU 103 N 0.00 0.57 -0.15 0.00 4.39 -1.10 -3.16 114.58 115.12 2yqr h GLU 103 Ca -0.00 -0.37 0.01 0.00 0.34 0.00 0.00 59.36 59.33 2yqr h GLU 103 Cb 1.02 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.71 2yqr h GLU 103 CO 0.06 0.99 0.06 -0.92 -1.16 0.00 0.00 179.01 178.03 2yqr h TYR 104 N 0.23 0.11 -0.67 4.33 3.20 -1.50 0.26 116.97 122.93 2yqr h TYR 104 Ca 0.00 0.01 0.19 0.00 3.14 0.00 0.00 58.73 62.07 2yqr h TYR 104 Cb 0.97 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 39.19 2yqr h TYR 104 CO 0.09 0.06 0.48 0.77 -1.64 0.00 0.00 178.16 177.92 2yqr h SER 105 N 0.14 0.01 0.50 -2.11 0.02 -1.59 0.28 113.55 110.80 2yqr h SER 105 Ca 0.06 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.72 2yqr h SER 105 Cb 0.03 -0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.53 2yqr h SER 105 CO -0.06 0.01 -1.64 0.03 -1.14 0.00 0.00 176.83 174.02 2yqr h ARG 106 N 0.01 0.06 -0.07 3.45 2.47 -1.27 -2.26 114.38 116.77 2yqr h ARG 106 Ca 0.32 -0.10 -0.14 0.00 -1.26 0.00 0.00 59.98 58.79 2yqr h ARG 106 Cb 1.25 0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 29.60 2yqr h ARG 106 CO -0.01 0.70 -0.59 0.35 0.56 0.00 0.00 179.97 180.98 2yqr h PHE 107 N 0.02 0.29 0.00 3.04 3.04 0.17 -3.18 116.94 120.32 2yqr h PHE 107 Ca -0.27 -0.11 -0.17 0.00 3.98 0.00 0.00 57.97 61.41 2yqr h PHE 107 Cb 1.99 -0.05 -0.03 0.00 2.56 0.00 0.00 35.95 40.42 2yqr h PHE 107 CO 0.02 0.76 -1.52 1.55 -2.02 0.00 0.00 178.31 177.10 2yqr n VAL 108 N -3.88 1.10 -0.32 1.41 3.14 0.76 -4.10 118.33 116.45 2yqr n VAL 108 Ca -0.02 -0.69 0.11 0.00 -2.96 0.00 0.00 64.34 60.78 2yqr n VAL 108 Cb 0.61 -0.65 0.33 0.00 -1.06 0.00 0.00 33.84 33.06 2yqr n VAL 108 CO 0.00 0.00 0.00 0.78 -6.46 0.00 0.00 176.83 171.15 2yqr h ASN 109 N 0.00 0.76 -0.09 6.55 4.21 -1.38 -0.55 115.58 125.08 2yqr h ASN 109 Ca -0.18 0.06 -0.21 0.00 1.21 0.00 0.00 56.30 57.18 2yqr h ASN 109 Cb 1.58 -0.09 0.01 0.00 -1.12 0.00 0.00 38.32 38.70 2yqr h ASN 109 CO 0.04 0.35 -0.74 0.06 -1.29 0.00 0.00 177.43 175.86 2yqr h GLN 110 N 0.79 0.73 -0.87 0.81 3.07 -1.72 0.15 115.11 118.07 2yqr h GLN 110 Ca 0.50 -0.58 0.02 0.00 0.09 0.00 0.00 58.65 58.68 2yqr h GLN 110 Cb 0.73 0.11 -0.05 0.00 0.08 0.00 0.00 27.48 28.36 2yqr h GLN 110 CO -0.27 1.19 0.58 0.82 0.09 0.00 0.00 178.83 181.24 2yqr h ILE 111 N 0.51 1.20 0.00 1.86 2.04 -1.29 -3.28 117.51 118.55 2yqr h ILE 111 Ca -0.04 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.41 2yqr h ILE 111 Cb 1.35 -0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 37.37 2yqr h ILE 111 CO 0.15 0.21 -0.34 -1.13 0.00 0.00 0.00 178.15 177.04 2yqr h ASN 112 N 1.15 0.00 -3.36 1.72 -1.24 -1.26 -3.46 115.58 109.14 2yqr h ASN 112 Ca 0.33 -0.07 -0.57 0.00 0.71 0.00 0.00 56.30 56.70 2yqr h ASN 112 Cb -0.09 0.00 -0.07 0.00 0.73 0.00 0.00 38.32 38.90 2yqr h ASN 112 CO -0.08 0.71 0.14 -0.89 -1.29 0.00 0.00 177.43 176.02 2yqr s THR 113 N -1.98 5.02 -0.29 -3.57 2.01 0.51 -5.03 115.64 112.30 2yqr s THR 113 Ca -0.10 1.40 -0.20 0.00 0.31 0.00 0.00 61.69 63.10 2yqr s THR 113 Cb 0.01 -4.03 0.13 0.00 0.01 0.00 0.00 72.50 68.63 2yqr s THR 113 CO 0.17 0.18 1.00 0.00 -0.69 0.00 0.00 174.62 175.29 2yqr s ALA 114 N 1.29 -2.13 -0.40 7.40 0.00 -1.26 -4.21 121.76 122.44 2yqr s ALA 114 Ca 0.35 2.06 -0.04 0.00 0.00 0.00 0.00 51.96 54.33 2yqr s ALA 114 Cb -0.17 -1.59 0.10 0.00 0.00 0.00 0.00 23.12 21.46 2yqr s ALA 114 CO 0.15 -0.29 0.20 0.08 0.00 0.00 0.00 175.76 175.89 2yqr s VAL 115 N 0.84 3.42 -0.10 0.00 1.01 -1.26 -5.07 120.40 119.24 2yqr s VAL 115 Ca -0.03 -1.89 -0.29 0.00 0.00 0.00 0.00 61.98 59.76 2yqr s VAL 115 Cb -0.04 -3.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 2yqr s VAL 115 CO -0.11 -0.61 1.52 -2.16 0.00 0.00 0.00 175.10 173.73 2yqr s PRO 116 N 1.20 4.18 0.39 2.72 0.04 -1.26 -5.01 135.00 137.27 2yqr s PRO 116 Ca 0.06 1.99 -0.07 0.00 0.04 0.00 0.00 61.00 63.02 2yqr s PRO 116 Cb -0.23 -3.91 -0.05 0.00 0.04 0.00 0.00 34.50 30.35 2yqr s PRO 116 CO -0.03 -0.82 0.72 -0.51 0.04 0.00 0.00 177.00 176.40 2yqr s LEU 117 N 3.90 3.84 -0.09 -3.56 1.43 -1.26 -5.02 118.68 117.92 2yqr s LEU 117 Ca 0.67 0.96 -0.30 0.00 -1.03 0.00 0.00 54.13 54.44 2yqr s LEU 117 Cb -0.29 -3.84 -0.04 0.00 0.03 0.00 0.00 46.19 42.04 2yqr s LEU 117 CO 0.24 -0.39 1.51 -2.16 0.23 0.00 0.00 176.35 175.79 2yqr s PRO 118 N -4.01 4.20 0.00 1.29 0.04 -1.26 -5.35 135.00 129.91 2yqr s PRO 118 Ca 0.48 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.53 2yqr s PRO 118 Cb -0.10 -3.89 0.00 0.00 0.04 0.00 0.00 34.50 30.55 2yqr s PRO 118 CO 0.34 -0.79 0.00 0.41 0.04 0.00 0.00 177.00 177.01