#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 2.18 0.05 1.61 0.15 -1.26 -5.12 113.70 111.31 2yqr s SER 2 Ca 0.00 -0.39 -0.27 0.00 0.70 0.00 0.00 55.95 55.99 2yqr s SER 2 Cb 0.00 -0.58 0.09 0.00 -1.71 0.00 0.00 66.02 63.82 2yqr s SER 2 CO 0.00 -0.22 0.87 -0.44 1.20 0.00 0.00 173.24 174.65 2yqr s SER 3 N 1.87 -0.34 0.37 5.45 0.01 -1.26 -5.19 113.70 114.61 2yqr s SER 3 Ca 0.03 -0.09 -0.05 0.00 1.31 0.00 0.00 55.95 57.15 2yqr s SER 3 Cb -0.14 0.43 0.02 0.00 0.21 0.00 0.00 66.02 66.54 2yqr s SER 3 CO -0.07 -0.72 0.57 0.61 0.41 0.00 0.00 173.24 174.05 2yqr n GLY 4 N -0.31 1.79 0.05 3.44 0.00 -1.26 -5.10 105.19 103.81 2yqr n GLY 4 Ca -0.09 -1.52 -0.01 0.00 0.00 0.00 0.00 46.02 44.40 2yqr n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2yqr h SER 5 N 2.00 -0.05 -3.42 1.61 0.87 -2.08 -3.50 113.55 108.98 2yqr h SER 5 Ca -0.29 0.00 0.34 0.00 -1.23 0.00 0.00 61.79 60.61 2yqr h SER 5 Cb 1.21 0.01 -0.10 0.00 -0.44 0.00 0.00 62.40 63.09 2yqr h SER 5 CO 0.39 0.20 -0.54 -1.20 -0.53 0.00 0.00 176.83 175.14 2yqr n SER 6 N -3.47 -7.51 0.00 6.23 7.64 -1.26 -5.05 113.62 110.19 2yqr n SER 6 Ca -0.01 0.61 0.00 0.00 1.01 0.00 0.00 58.87 60.48 2yqr n SER 6 Cb 0.03 -3.88 0.00 0.00 -1.01 0.00 0.00 64.21 59.34 2yqr n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yqr n GLY 7 N -3.90 3.23 1.01 0.23 0.00 -1.26 -5.17 105.19 99.33 2yqr n GLY 7 Ca -0.00 0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.12 2yqr n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yqr n GLY 8 N -0.07 -3.31 2.95 -0.02 0.00 -1.26 -5.00 105.19 98.48 2yqr n GLY 8 Ca 0.00 -1.12 -0.11 0.00 0.00 0.00 0.00 46.02 44.79 2yqr n GLY 8 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2yqr s MET 9 N -4.22 0.31 0.36 1.61 -2.45 -1.26 -5.13 119.30 108.52 2yqr s MET 9 Ca 0.00 0.58 0.00 0.00 -1.25 0.00 0.00 55.69 55.02 2yqr s MET 9 Cb 0.00 -0.43 0.00 0.00 1.25 0.00 0.00 34.83 35.65 2yqr s MET 9 CO 0.00 -0.56 0.00 0.72 1.05 0.00 0.00 175.02 176.23 2yqr n HIS 10 N 5.36 -3.18 -4.07 4.11 -0.00 -1.26 -4.91 115.22 111.27 2yqr n HIS 10 Ca -0.05 1.63 -0.26 0.00 -0.00 0.00 0.00 57.72 59.04 2yqr n HIS 10 Cb 0.50 -2.89 -0.05 0.00 -0.00 0.00 0.00 29.99 27.55 2yqr n HIS 10 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.34 177.05 2yqr s TYR 11 N -2.61 3.18 -0.04 4.41 1.51 -1.26 -4.63 117.35 117.89 2yqr s TYR 11 Ca 0.00 -0.01 0.05 0.00 -1.01 0.00 0.00 57.07 56.10 2yqr s TYR 11 Cb 0.00 -1.52 -0.01 0.00 -0.11 0.00 0.00 41.96 40.32 2yqr s TYR 11 CO 0.00 0.52 -0.20 0.14 -1.11 0.00 0.00 175.55 174.89 2yqr s VAL 12 N -1.77 1.67 0.18 0.71 -7.23 0.21 -5.00 120.40 109.17 2yqr s VAL 12 Ca 0.31 -0.86 0.08 0.00 -1.81 0.00 0.00 61.98 59.70 2yqr s VAL 12 Cb -0.10 -1.42 -0.04 0.00 0.56 0.00 0.00 36.38 35.38 2yqr s VAL 12 CO 0.24 0.47 -0.16 -1.10 -0.31 0.00 0.00 175.10 174.25 2yqr s GLN 13 N -0.12 1.28 0.27 4.82 1.11 -1.26 -1.43 119.66 124.32 2yqr s GLN 13 Ca -0.02 -1.48 0.03 0.00 0.01 0.00 0.00 55.36 53.90 2yqr s GLN 13 Cb -0.12 -1.17 -0.06 0.00 -1.01 0.00 0.00 33.01 30.66 2yqr s GLN 13 CO 0.02 0.21 0.04 0.34 0.01 0.00 0.00 175.29 175.92 2yqr s ASP 14 N -2.99 1.83 -0.21 5.90 -1.08 -0.77 -4.97 116.67 114.40 2yqr s ASP 14 Ca 0.18 -1.31 -0.04 0.00 -0.52 0.00 0.00 52.55 50.87 2yqr s ASP 14 Cb -0.03 0.02 0.10 0.00 -1.46 0.00 0.00 42.92 41.55 2yqr s ASP 14 CO 0.06 -0.60 0.30 -0.54 0.52 0.00 0.00 175.17 174.91 2yqr s LYS 15 N -3.92 0.25 -0.32 4.34 1.02 -1.26 -2.79 119.74 117.07 2yqr s LYS 15 Ca 0.33 0.46 -0.02 0.00 0.02 0.00 0.00 55.97 56.76 2yqr s LYS 15 Cb 0.07 -0.66 0.06 0.00 -0.52 0.00 0.00 37.83 36.78 2yqr s LYS 15 CO 0.12 -0.57 0.04 -0.51 -0.92 0.00 0.00 175.35 173.51 2yqr s LEU 16 N 2.44 4.13 -0.22 3.17 1.02 0.13 -4.94 118.68 124.41 2yqr s LEU 16 Ca 0.08 -1.37 -0.29 0.00 0.02 0.00 0.00 54.13 52.57 2yqr s LEU 16 Cb -0.15 -1.74 0.01 0.00 0.02 0.00 0.00 46.19 44.32 2yqr s LEU 16 CO -0.13 -0.31 1.09 -0.36 0.02 0.00 0.00 176.35 176.67 2yqr s PHE 17 N 1.25 3.22 0.30 0.29 0.40 -1.26 -0.16 117.98 122.01 2yqr s PHE 17 Ca -0.03 1.35 0.24 0.00 -0.60 0.00 0.00 56.93 57.89 2yqr s PHE 17 Cb -0.20 -3.36 1.14 0.00 0.51 0.00 0.00 43.02 41.11 2yqr s PHE 17 CO -0.01 -0.77 1.94 -0.39 0.70 0.00 0.00 175.22 176.69 2yqr h VAL 18 N 5.49 0.66 -6.12 -0.44 -1.51 -1.94 -3.47 116.25 108.91 2yqr h VAL 18 Ca -0.21 -0.88 -0.42 0.00 -1.23 0.00 0.00 66.70 63.96 2yqr h VAL 18 Cb 1.07 1.56 0.05 0.00 -2.13 0.00 0.00 31.29 31.84 2yqr h VAL 18 CO 0.98 0.20 -0.85 0.61 -1.23 0.00 0.00 177.57 177.28 2yqr n GLY 19 N -0.32 -0.37 0.85 5.19 0.00 -1.26 -4.90 105.19 104.38 2yqr n GLY 19 Ca -0.01 0.17 0.04 0.00 0.00 0.00 0.00 46.02 46.22 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 -4.24 1.27 0.24 0.99 7.94 -1.26 -4.81 117.00 117.13 2yqr n LEU 20 Ca -0.28 -2.27 0.09 0.00 -1.11 0.00 0.00 56.01 52.44 2yqr n LEU 20 Cb 0.67 -0.17 0.61 0.00 0.53 0.00 0.00 43.42 45.07 2yqr n LEU 20 CO 0.69 0.65 0.92 1.05 -1.11 0.00 0.00 177.39 179.59 2yqr h GLU 21 N 0.60 0.00 0.00 1.96 4.11 -1.95 -1.91 114.58 117.39 2yqr h GLU 21 Ca -0.09 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.25 2yqr h GLU 21 Cb 1.46 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.70 2yqr h GLU 21 CO 0.04 0.17 -0.45 1.12 0.07 0.00 0.00 179.01 179.96 2yqr h HIS 22 N 0.00 0.00 -2.63 2.06 2.07 -2.01 -3.46 115.15 111.18 2yqr h HIS 22 Ca -0.00 0.00 -0.60 0.00 -2.85 0.00 0.00 60.37 56.92 2yqr h HIS 22 Cb 0.37 0.00 0.10 0.00 2.57 0.00 0.00 27.41 30.46 2yqr h HIS 22 CO 0.00 0.45 0.29 0.00 -3.07 0.00 0.00 177.93 175.60 2yqr n ALA 23 N -2.29 0.23 -1.11 6.11 0.00 -0.72 -4.89 120.51 117.84 2yqr n ALA 23 Ca 0.00 0.39 -0.35 0.00 0.00 0.00 0.00 53.44 53.49 2yqr n ALA 23 Cb 0.59 -2.11 0.09 0.00 0.00 0.00 0.00 19.45 18.02 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 0.61 1.26 0.27 0.00 0.24 -1.26 -4.87 118.33 114.57 2yqr n VAL 24 Ca 0.09 -0.33 0.15 0.00 -2.04 0.00 0.00 64.34 62.22 2yqr n VAL 24 Cb 0.32 -0.72 0.66 0.00 -1.47 0.00 0.00 33.84 32.62 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 -0.76 0.00 -0.08 7.34 0.13 -1.95 -2.92 132.00 133.75 2yqr h PRO 25 Ca -0.45 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.52 2yqr h PRO 25 Cb 1.32 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.45 2yqr h PRO 25 CO 0.40 0.06 -0.65 1.79 -0.23 0.00 0.00 178.00 179.38 2yqr h THR 26 N 0.00 1.38 -0.94 1.56 1.35 -2.02 -3.15 112.91 111.08 2yqr h THR 26 Ca -0.00 -2.04 0.00 0.00 -0.55 0.00 0.00 66.41 63.82 2yqr h THR 26 Cb 0.54 2.03 -0.05 0.00 -1.73 0.00 0.00 68.15 68.94 2yqr h THR 26 CO 0.01 0.61 0.60 0.15 -0.25 0.00 0.00 175.52 176.64 2yqr h PHE 27 N 0.23 1.21 -5.52 4.73 3.57 -1.87 -3.47 116.94 115.82 2yqr h PHE 27 Ca -0.01 0.01 -0.21 0.00 3.53 0.00 0.00 57.97 61.29 2yqr h PHE 27 Cb 1.18 -0.41 0.14 0.00 2.79 0.00 0.00 35.95 39.66 2yqr h PHE 27 CO 0.03 0.78 -0.68 0.09 -2.23 0.00 0.00 178.31 176.31 2yqr n ASN 28 N -4.40 -6.77 -0.27 0.41 4.13 -1.19 -4.84 115.26 102.32 2yqr n ASN 28 Ca 0.11 -0.60 0.03 0.00 1.68 0.00 0.00 54.58 55.80 2yqr n ASN 28 Cb 0.03 -5.02 0.25 0.00 -1.54 0.00 0.00 39.78 33.50 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 -0.80 1.10 -0.66 2.41 3.04 -1.90 -2.01 116.25 117.44 2yqr h VAL 29 Ca -0.48 -0.35 0.05 0.00 -1.01 0.00 0.00 66.70 64.91 2yqr h VAL 29 Cb 1.25 -0.00 -0.05 0.00 -2.01 0.00 0.00 31.29 30.48 2yqr h VAL 29 CO 0.41 0.19 0.38 0.50 -1.01 0.00 0.00 177.57 178.04 2yqr h LYS 30 N 1.02 0.70 0.00 4.17 3.64 -1.95 0.11 116.57 124.26 2yqr h LYS 30 Ca 0.35 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.65 2yqr h LYS 30 Cb 0.11 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 2yqr h LYS 30 CO -0.12 0.46 -0.18 1.49 -2.27 0.00 0.00 179.45 178.84 2yqr h GLU 31 N 0.72 0.00 0.01 1.90 4.22 -1.73 -1.98 114.58 117.72 2yqr h GLU 31 Ca 0.28 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.72 2yqr h GLU 31 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2yqr h GLU 31 CO -0.15 0.18 -0.00 0.87 -2.18 0.00 0.00 179.01 177.72 2yqr h LYS 32 N 0.00 -0.01 -0.94 1.92 1.79 -0.72 0.24 116.57 118.85 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 0.53 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.12 2yqr h LYS 32 CO 0.02 0.69 0.62 -0.24 -1.08 0.00 0.00 179.45 179.46 2yqr h VAL 33 N -0.98 1.12 0.00 0.50 3.04 -0.83 -1.55 116.25 117.55 2yqr h VAL 33 Ca -0.00 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 65.30 2yqr h VAL 33 Cb 0.71 -0.12 0.00 0.00 -2.01 0.00 0.00 31.29 29.87 2yqr h VAL 33 CO 0.00 0.21 -0.77 -1.84 -1.01 0.00 0.00 177.57 174.16 2yqr n GLU 34 N -4.46 0.27 -1.42 4.17 0.28 -0.75 -4.03 120.64 114.69 2yqr n GLU 34 Ca 0.13 0.04 0.19 0.00 -0.16 0.00 0.00 57.16 57.37 2yqr n GLU 34 Cb 0.14 -1.63 -0.05 0.00 1.43 0.00 0.00 31.44 31.32 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 1.36 -2.02 3.72 -1.84 0.00 0.84 -3.11 105.19 104.15 2yqr n GLY 35 Ca 0.03 -1.09 -0.42 0.00 0.00 0.00 0.00 46.02 44.54 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 -2.48 4.35 -1.30 1.61 0.04 -1.26 -3.00 135.00 132.96 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 -3.24 0.01 0.00 0.04 0.00 0.00 34.50 31.31 2yqr s PRO 36 CO 0.00 -0.37 0.15 0.41 0.04 0.00 0.00 177.00 177.24 2yqr n GLY 37 N 3.15 -0.50 2.42 0.56 0.00 -1.26 -0.12 105.19 109.44 2yqr n GLY 37 Ca 0.10 0.03 -0.18 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.43 0.19 0.00 0.87 -0.47 0.14 113.55 113.86 2yqr h SER 39 Ca -0.39 -0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.13 2yqr h SER 39 Cb 1.23 0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 63.25 2yqr h SER 39 CO 0.51 -0.22 -0.52 1.88 -0.53 0.00 0.00 176.83 177.95 2yqr h TYR 40 N -0.61 -1.49 -0.88 2.24 -1.99 -1.77 -0.82 116.97 111.64 2yqr h TYR 40 Ca -0.05 0.03 0.07 0.00 2.00 0.00 0.00 58.73 60.79 2yqr h TYR 40 Cb 0.45 0.62 -0.06 0.00 2.00 0.00 0.00 36.73 39.75 2yqr h TYR 40 CO -0.02 -0.60 0.57 -0.07 -0.00 0.00 0.00 178.16 178.03 2yqr h LEU 41 N -0.79 0.85 -0.55 3.88 4.07 -1.59 -1.94 115.31 119.23 2yqr h LEU 41 Ca -0.02 0.01 0.05 0.00 0.08 0.00 0.00 57.88 58.01 2yqr h LEU 41 Cb 0.77 -0.17 -0.05 0.00 1.08 0.00 0.00 40.66 42.29 2yqr h LEU 41 CO -0.24 0.53 0.27 1.56 -1.08 0.00 0.00 178.44 179.48 2yqr h GLN 42 N 0.96 0.50 0.19 1.13 1.08 0.17 -0.51 115.11 118.63 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 0.27 -0.11 -0.04 0.00 -0.05 0.00 0.00 27.48 27.54 2yqr h GLN 42 CO -0.15 0.33 -0.52 1.25 -0.95 0.00 0.00 178.83 178.79 2yqr h HIS 43 N 0.52 -1.50 0.00 2.96 2.76 -0.36 0.29 115.15 119.81 2yqr h HIS 43 Ca 0.25 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.45 2yqr h HIS 43 Cb 0.18 0.63 -0.00 0.00 1.55 0.00 0.00 27.41 29.77 2yqr h HIS 43 CO -0.11 -0.61 -0.02 0.82 -1.30 0.00 0.00 177.93 176.71 2yqr h ILE 44 N -0.80 0.53 0.00 6.26 2.04 -1.46 0.26 117.51 124.33 2yqr h ILE 44 Ca -0.01 -0.09 -0.13 0.00 1.00 0.00 0.00 64.86 65.63 2yqr h ILE 44 Cb 0.78 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 2yqr h ILE 44 CO -0.25 0.02 -0.60 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 0.59 -2.48 115.11 119.79 2yqr h GLN 45 Ca -0.00 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.55 2yqr h GLN 45 Cb 0.05 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 2yqr h GLN 45 CO 0.00 0.60 -1.68 -0.89 -0.67 0.00 0.00 178.83 176.20 2yqr n ILE 46 N -3.36 0.93 0.12 2.54 5.41 0.84 -0.67 119.36 125.17 2yqr n ILE 46 Ca 0.01 -0.67 0.01 0.00 1.00 0.00 0.00 62.75 63.09 2yqr n ILE 46 Cb 0.73 -0.50 -0.01 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 -0.60 -3.35 114.58 115.40 2yqr h GLU 47 Ca -0.19 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.47 2yqr h GLU 47 Cb 1.54 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.18 2yqr h GLU 47 CO 0.03 0.56 -1.30 0.25 -1.16 0.00 0.00 179.01 177.39 2yqr n THR 48 N -3.22 0.17 -1.11 1.13 -2.24 -0.93 -5.02 114.28 103.06 2yqr n THR 48 Ca 0.01 -0.17 -0.04 0.00 -2.27 0.00 0.00 64.05 61.58 2yqr n THR 48 Cb 0.78 -0.21 -0.02 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 2.42 0.67 3.89 3.38 0.00 0.16 -4.86 105.19 110.84 2yqr n GLY 49 Ca -0.05 -0.75 -0.23 0.00 0.00 0.00 0.00 46.02 44.99 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 -2.11 3.76 -0.55 4.61 0.00 -1.20 -5.00 121.76 121.27 2yqr s ALA 50 Ca 0.00 -1.25 -0.27 0.00 0.00 0.00 0.00 51.96 50.45 2yqr s ALA 50 Cb 0.00 -1.54 0.03 0.00 0.00 0.00 0.00 23.12 21.62 2yqr s ALA 50 CO 0.00 0.35 1.08 0.15 0.00 0.00 0.00 175.76 177.34 2yqr s LYS 51 N -3.62 3.48 -0.22 0.00 1.02 -0.50 -4.54 119.74 115.36 2yqr s LYS 51 Ca 0.33 0.11 -0.05 0.00 0.02 0.00 0.00 55.97 56.38 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 -1.54 -0.01 0.08 -0.92 0.00 0.00 175.35 173.22 2yqr s VAL 52 N 4.46 3.70 -0.08 3.17 1.01 -1.26 -0.09 120.40 131.31 2yqr s VAL 52 Ca 0.39 -0.39 -0.05 0.00 0.00 0.00 0.00 61.98 61.93 2yqr s VAL 52 Cb -0.09 -2.69 0.03 0.00 0.00 0.00 0.00 36.38 33.63 2yqr s VAL 52 CO 0.24 0.41 0.19 0.72 0.00 0.00 0.00 175.10 176.67 2yqr s PHE 53 N 1.33 -0.23 0.18 5.22 -0.12 -0.44 -4.96 117.98 118.97 2yqr s PHE 53 Ca 0.04 0.57 -0.30 0.00 -0.05 0.00 0.00 56.93 57.19 2yqr s PHE 53 Cb -0.15 0.03 -0.08 0.00 -0.63 0.00 0.00 43.02 42.19 2yqr s PHE 53 CO -0.00 -0.15 1.26 -1.17 -0.05 0.00 0.00 175.22 175.11 2yqr s LEU 54 N 0.66 4.42 0.15 -1.99 2.96 -1.26 -2.20 118.68 121.42 2yqr s LEU 54 Ca -0.05 2.31 -0.01 0.00 -0.22 0.00 0.00 54.13 56.16 2yqr s LEU 54 Cb -0.06 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 2yqr s LEU 54 CO -0.04 -0.47 0.06 -0.60 -1.32 0.00 0.00 176.35 173.99 2yqr s ARG 55 N -0.04 0.99 0.00 1.98 3.52 -0.47 -4.80 118.95 120.13 2yqr s ARG 55 Ca 0.56 -1.48 0.00 0.00 -0.13 0.00 0.00 55.73 54.67 2yqr s ARG 55 Cb -0.34 0.17 0.00 0.00 -1.56 0.00 0.00 34.95 33.22 2yqr s ARG 55 CO 0.37 -0.26 0.00 0.41 -0.81 0.00 0.00 175.30 175.01 2yqr n GLY 56 N -0.14 0.60 3.65 8.12 0.00 -1.26 -0.28 105.19 115.88 2yqr n GLY 56 Ca -0.05 -2.03 -0.50 0.00 0.00 0.00 0.00 46.02 43.44 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 0.60 1.69 0.00 1.61 4.81 0.83 -0.51 118.16 127.20 2yqr n LYS 57 Ca 0.00 0.61 0.00 0.00 -0.87 0.00 0.00 58.31 58.05 2yqr n LYS 57 Cb 0.00 -2.34 0.00 0.00 0.02 0.00 0.00 35.03 32.71 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 3.38 3.00 0.33 3.14 0.00 -1.26 -0.14 105.19 113.64 2yqr n GLY 58 Ca 0.20 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.18 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 1.00 0.00 1.61 4.64 -1.05 -3.47 113.55 116.27 2yqr h SER 59 Ca 0.00 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2yqr h SER 59 Cb 0.00 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 61.84 2yqr h SER 59 CO 0.00 0.73 0.00 0.61 -0.87 0.00 0.00 176.83 177.30 2yqr n GLY 60 N -1.31 1.61 3.56 -0.77 0.00 -1.25 -4.89 105.19 102.13 2yqr n GLY 60 Ca 0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 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 7.42 0.15 -4.60 0.00 1.08 -1.90 -3.35 117.51 116.30 2yqr h ILE 62 Ca -0.02 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.46 2yqr h ILE 62 Cb 1.05 0.97 -0.11 0.00 -3.07 0.00 0.00 36.82 35.66 2yqr h ILE 62 CO 1.13 0.00 -1.28 -0.62 -0.69 0.00 0.00 178.15 176.69 2yqr n GLU 63 N -3.28 -3.68 0.00 2.37 1.02 -1.26 -1.73 120.64 114.08 2yqr n GLU 63 Ca -0.03 2.87 0.07 0.00 -0.02 0.00 0.00 57.16 60.05 2yqr n GLU 63 Cb 0.11 -4.29 0.33 0.00 -0.02 0.00 0.00 31.44 27.57 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 1.33 0.09 -0.15 3.49 -0.04 -1.26 -0.01 135.00 138.46 2yqr n PRO 64 Ca -0.33 0.21 -0.10 0.00 -0.04 0.00 0.00 63.50 63.23 2yqr n PRO 64 Cb 0.51 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.46 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 2.58 0.58 0.00 0.55 0.00 -1.94 -3.39 119.26 117.64 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 0.00 179.25 179.33 2yqr n SER 66 N -4.37 3.42 0.00 0.00 2.88 -1.16 -5.04 113.62 109.35 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 0.33 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 2.78 1.32 3.37 0.46 0.00 0.99 -5.10 105.19 109.00 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 0.50 0.00 0.00 0.00 173.32 173.82 2yqr s ARG 68 N -0.13 1.57 1.14 1.61 0.52 -0.71 -4.77 118.95 118.19 2yqr s ARG 68 Ca 0.00 -1.24 -0.18 0.00 -0.52 0.00 0.00 55.73 53.79 2yqr s ARG 68 Cb 0.00 -1.93 0.15 0.00 0.52 0.00 0.00 34.95 33.69 2yqr s ARG 68 CO 0.00 0.48 0.16 0.39 0.02 0.00 0.00 175.30 176.35 2yqr n GLU 69 N 1.30 -1.94 -0.50 3.54 1.02 -1.17 -4.37 120.64 118.52 2yqr n GLU 69 Ca -0.18 -0.55 -0.29 0.00 -0.02 0.00 0.00 57.16 56.13 2yqr n GLU 69 Cb 0.53 -1.74 0.25 0.00 -0.02 0.00 0.00 31.44 30.45 2yqr n GLU 69 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2yqr n ALA 70 N -4.58 -2.67 0.09 0.62 0.00 -1.26 -4.87 120.51 107.85 2yqr n ALA 70 Ca 0.02 -1.11 -0.14 0.00 0.00 0.00 0.00 53.44 52.21 2yqr n ALA 70 Cb 0.59 -2.02 -0.14 0.00 0.00 0.00 0.00 19.45 17.89 2yqr n ALA 70 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2yqr h PHE 71 N -2.58 0.40 -3.96 0.00 0.04 -1.97 -3.34 116.94 105.52 2yqr h PHE 71 Ca -0.59 -0.29 -0.49 0.00 2.80 0.00 0.00 57.97 59.39 2yqr h PHE 71 Cb 1.33 -0.02 0.05 0.00 2.20 0.00 0.00 35.95 39.51 2yqr h PHE 71 CO 0.29 1.24 0.26 -1.21 -0.60 0.00 0.00 178.31 178.30 2yqr s GLU 72 N -2.66 3.31 0.85 1.51 2.02 -1.26 -4.87 118.70 117.60 2yqr s GLU 72 Ca -0.03 0.35 -0.11 0.00 0.02 0.00 0.00 54.97 55.20 2yqr s GLU 72 Cb 0.08 -2.21 0.10 0.00 0.10 0.00 0.00 34.13 32.20 2yqr s GLU 72 CO 0.87 -0.56 1.09 -1.25 0.02 0.00 0.00 175.26 175.43 2yqr s PRO 73 N -5.03 1.62 0.71 0.39 0.04 -1.26 -0.12 135.00 131.35 2yqr s PRO 73 Ca 0.53 0.95 -0.16 0.00 0.04 0.00 0.00 61.00 62.36 2yqr s PRO 73 Cb -0.11 -1.84 -0.02 0.00 0.04 0.00 0.00 34.50 32.57 2yqr s PRO 73 CO 0.49 -2.03 0.76 0.00 0.04 0.00 0.00 177.00 176.26 2yqr n MET 74 N -3.76 0.43 -3.51 4.56 0.00 0.80 -4.12 117.12 111.53 2yqr n MET 74 Ca 0.08 0.19 -0.09 0.00 0.00 0.00 0.00 57.70 57.88 2yqr n MET 74 Cb 0.54 -2.02 -0.02 0.00 0.00 0.00 0.00 33.22 31.72 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 -1.84 -0.40 -0.06 3.17 -0.85 0.61 -3.91 117.35 114.07 2yqr s TYR 75 Ca 0.70 0.21 -0.25 0.00 -0.52 0.00 0.00 57.07 57.21 2yqr s TYR 75 Cb -0.36 0.56 -0.03 0.00 0.38 0.00 0.00 41.96 42.51 2yqr s TYR 75 CO 0.54 -0.72 0.75 0.42 -1.52 0.00 0.00 175.55 175.01 2yqr s ILE 76 N -3.43 5.01 -0.19 -3.49 1.01 0.77 -1.37 121.20 119.52 2yqr s ILE 76 Ca 0.04 1.55 0.00 0.00 0.00 0.00 0.00 60.65 62.25 2yqr s ILE 76 Cb -0.01 -4.09 0.02 0.00 0.01 0.00 0.00 42.46 38.39 2yqr s ILE 76 CO -0.09 0.23 -0.18 -0.47 0.00 0.00 0.00 174.94 174.43 2yqr s TYR 77 N 0.89 2.83 -0.02 3.97 6.14 -0.94 -0.70 117.35 129.52 2yqr s TYR 77 Ca 0.40 -1.60 0.00 0.00 0.64 0.00 0.00 57.07 56.51 2yqr s TYR 77 Cb -0.18 -1.94 -0.04 0.00 0.42 0.00 0.00 41.96 40.22 2yqr s TYR 77 CO 0.20 -0.78 0.03 0.42 0.64 0.00 0.00 175.55 176.05 2yqr s ILE 78 N 1.30 4.39 -0.22 3.14 1.01 -1.12 -1.32 121.20 128.38 2yqr s ILE 78 Ca 0.04 -0.46 -0.02 0.00 0.00 0.00 0.00 60.65 60.22 2yqr s ILE 78 Cb -0.13 -2.95 0.07 0.00 0.01 0.00 0.00 42.46 39.45 2yqr s ILE 78 CO -0.11 0.42 0.03 -0.94 0.00 0.00 0.00 174.94 174.33 2yqr s SER 79 N -1.47 3.33 -0.02 3.58 1.04 0.87 -1.85 113.70 119.18 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 -0.78 -0.00 0.00 0.10 0.00 0.00 66.02 65.22 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 1.71 1.04 -1.04 5.02 5.04 -0.52 -1.42 115.29 125.13 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 -0.18 -0.72 0.62 0.00 0.04 0.00 0.00 32.58 32.34 2yqr s HIS 80 CO -0.11 -0.09 1.45 -0.35 -2.34 0.00 0.00 174.74 173.31 2yqr n PRO 81 N 3.16 0.02 -4.10 2.88 -0.04 -1.26 -0.62 135.00 135.04 2yqr n PRO 81 Ca -0.17 0.25 -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 -2.96 0.65 0.31 0.54 1.02 -1.26 -4.53 119.74 113.50 2yqr s LYS 82 Ca 0.07 -0.97 0.10 0.00 0.02 0.00 0.00 55.97 55.20 2yqr s LYS 82 Cb 0.09 -0.28 0.51 0.00 -0.52 0.00 0.00 37.83 37.63 2yqr s LYS 82 CO 0.26 0.03 1.71 -1.00 -0.92 0.00 0.00 175.35 175.43 2yqr h PRO 83 N 3.96 0.05 0.12 -1.68 0.13 -1.94 -2.80 132.00 129.84 2yqr h PRO 83 Ca -0.36 -0.03 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 0.49 0.52 -0.32 1.49 -0.23 0.00 0.00 178.00 179.96 2yqr h GLU 84 N 0.04 -0.47 -0.56 0.86 4.81 -1.97 0.44 114.58 117.73 2yqr h GLU 84 Ca -0.00 0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.20 2yqr h GLU 84 Cb 0.87 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.34 2yqr h GLU 84 CO 0.07 -0.32 0.10 0.78 -0.73 0.00 0.00 179.01 178.91 2yqr h GLY 85 N -0.49 0.98 0.26 1.92 0.00 -1.89 -2.65 103.07 101.20 2yqr h GLY 85 Ca -0.01 -0.64 0.16 0.00 0.00 0.00 0.00 47.33 46.83 2yqr h GLY 85 CO -0.15 0.60 0.57 -2.00 0.00 0.00 0.00 176.54 175.56 2yqr h LEU 86 N 0.81 0.76 -0.78 3.11 7.12 -1.31 0.34 115.31 125.35 2yqr h LEU 86 Ca 0.17 0.08 -0.06 0.00 0.13 0.00 0.00 57.88 58.20 2yqr h LEU 86 Cb 0.39 -0.06 -0.01 0.00 -0.53 0.00 0.00 40.66 40.45 2yqr h LEU 86 CO 0.01 0.33 -0.29 0.00 -0.13 0.00 0.00 178.44 178.36 2yqr h ALA 87 N 1.59 0.94 0.00 1.25 0.00 -0.70 -2.99 119.26 119.35 2yqr h ALA 87 Ca 0.52 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 2yqr h ALA 87 Cb 0.70 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2yqr h ALA 87 CO -0.34 0.36 -0.00 0.00 0.00 0.00 0.00 179.25 179.27 2yqr h ALA 88 N 1.71 -0.01 -0.98 0.00 0.00 -0.16 -3.14 119.26 116.68 2yqr h ALA 88 Ca -0.00 -0.24 0.19 0.00 0.00 0.00 0.00 54.91 54.86 2yqr h ALA 88 Cb 0.92 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.62 2yqr h ALA 88 CO 0.04 -0.01 0.61 0.00 0.00 0.00 0.00 179.25 179.89 2yqr h ALA 89 N -0.53 1.81 -0.37 0.00 0.00 -0.66 0.18 119.26 119.70 2yqr h ALA 89 Ca -0.00 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 2yqr h ALA 89 Cb 0.47 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2yqr h ALA 89 CO 0.00 -0.16 -0.08 -0.22 0.00 0.00 0.00 179.25 178.79 2yqr h LYS 90 N 0.69 0.62 -0.43 0.00 3.64 -1.64 -1.72 116.57 117.72 2yqr h LYS 90 Ca 0.55 -0.18 -0.11 0.00 -1.27 0.00 0.00 60.65 59.64 2yqr h LYS 90 Cb 0.96 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.70 2yqr h LYS 90 CO -0.32 0.70 -0.17 0.87 -2.27 0.00 0.00 179.45 178.26 2yqr h LYS 91 N 0.57 0.87 -0.56 1.90 1.57 -0.63 -2.80 116.57 117.50 2yqr h LYS 91 Ca 0.11 -0.36 -0.11 0.00 -1.87 0.00 0.00 60.65 58.42 2yqr h LYS 91 Cb 0.49 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 2yqr h LYS 91 CO 0.03 1.01 -0.07 -0.07 -0.57 0.00 0.00 179.45 179.78 2yqr h LEU 92 N 0.70 1.02 -0.97 2.94 3.38 -1.11 -2.89 115.31 118.38 2yqr h LEU 92 Ca 0.10 -0.32 0.03 0.00 0.09 0.00 0.00 57.88 57.79 2yqr h LEU 92 Cb 0.72 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.14 2yqr h LEU 92 CO 0.06 1.11 0.63 0.00 0.09 0.00 0.00 178.44 180.33 2yqr h GLU 94 N 1.24 0.73 -0.03 0.00 4.39 -1.31 -1.04 114.58 118.55 2yqr h GLU 94 Ca 0.38 -0.17 -0.18 0.00 0.34 0.00 0.00 59.36 59.74 2yqr h GLU 94 Cb -0.02 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 2yqr h GLU 94 CO -0.12 0.71 -0.76 -0.97 -1.16 0.00 0.00 179.01 176.71 2yqr h ASN 95 N 0.70 0.28 -0.08 1.42 -1.24 -1.14 -3.03 115.58 112.49 2yqr h ASN 95 Ca 0.15 -0.20 -0.18 0.00 0.71 0.00 0.00 56.30 56.78 2yqr h ASN 95 Cb 0.35 -0.08 -0.00 0.00 0.73 0.00 0.00 38.32 39.32 2yqr h ASN 95 CO 0.01 0.94 -0.59 0.25 -1.29 0.00 0.00 177.43 176.75 2yqr h LEU 96 N 0.15 0.77 -0.90 0.34 6.46 -0.67 -3.15 115.31 118.30 2yqr h LEU 96 Ca -0.03 -0.43 -0.04 0.00 -0.12 0.00 0.00 57.88 57.26 2yqr h LEU 96 Cb 1.34 -0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 41.02 2yqr h LEU 96 CO 0.12 1.18 0.27 -0.07 -0.62 0.00 0.00 178.44 179.32 2yqr h LEU 97 N 0.51 0.99 -1.97 2.25 3.38 -1.20 -2.14 115.31 117.13 2yqr h LEU 97 Ca -0.00 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 57.87 2yqr h LEU 97 Cb 1.17 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 2yqr h LEU 97 CO 0.12 0.89 0.15 1.56 0.09 0.00 0.00 178.44 181.25 2yqr h GLN 98 N 1.04 0.04 0.28 1.13 1.08 -1.49 0.15 115.11 117.35 2yqr h GLN 98 Ca 0.24 -0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.42 2yqr h GLN 98 Cb 0.22 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.65 2yqr h GLN 98 CO -0.02 0.03 -0.14 1.15 -0.95 0.00 0.00 178.83 178.90 2yqr h THR 99 N 0.04 0.22 -0.79 -0.54 2.02 -1.43 -2.98 112.91 109.46 2yqr h THR 99 Ca 0.10 -0.81 0.04 0.00 0.77 0.00 0.00 66.41 66.51 2yqr h THR 99 Cb 0.35 0.38 -0.04 0.00 -1.74 0.00 0.00 68.15 67.10 2yqr h THR 99 CO -0.01 0.06 0.52 1.62 0.37 0.00 0.00 175.52 178.08 2yqr h VAL 100 N -1.06 1.12 -0.42 3.16 3.04 -1.29 -1.34 116.25 119.46 2yqr h VAL 100 Ca -0.04 -0.33 -0.00 0.00 -1.01 0.00 0.00 66.70 65.32 2yqr h VAL 100 Cb 0.39 0.08 -0.02 0.00 -2.01 0.00 0.00 31.29 29.72 2yqr h VAL 100 CO 0.06 0.17 0.26 0.45 -1.01 0.00 0.00 177.57 177.51 2yqr h HIS 101 N 0.96 0.54 0.00 3.17 -0.00 -0.80 -1.28 115.15 117.73 2yqr h HIS 101 Ca 0.32 0.01 -0.09 0.00 -0.00 0.00 0.00 60.37 60.60 2yqr h HIS 101 Cb 0.06 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 27.28 2yqr h HIS 101 CO -0.00 0.35 -0.43 0.00 -0.00 0.00 0.00 177.93 177.86 2yqr h ALA 102 N 1.71 1.26 -0.20 2.45 0.00 -1.08 -2.98 119.26 120.42 2yqr h ALA 102 Ca 0.15 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 2yqr h ALA 102 Cb -0.03 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 2yqr h ALA 102 CO -0.03 0.53 -0.21 0.93 0.00 0.00 0.00 179.25 180.48 2yqr h GLU 103 N 0.00 0.48 -0.31 0.00 4.39 -1.10 -3.11 114.58 114.94 2yqr h GLU 103 Ca -0.00 -0.26 0.04 0.00 0.34 0.00 0.00 59.36 59.47 2yqr h GLU 103 Cb 0.77 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.40 2yqr h GLU 103 CO 0.06 0.84 0.10 -0.92 -1.16 0.00 0.00 179.01 177.92 2yqr h TYR 104 N 0.15 0.17 -0.30 4.33 3.20 -1.40 0.27 116.97 123.41 2yqr h TYR 104 Ca 0.03 0.02 0.09 0.00 3.14 0.00 0.00 58.73 62.00 2yqr h TYR 104 Cb 0.75 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.98 2yqr h TYR 104 CO 0.08 0.07 0.26 1.03 -1.64 0.00 0.00 178.16 177.97 2yqr h SER 105 N 0.23 0.00 0.47 -2.11 0.87 -1.55 0.26 113.55 111.72 2yqr h SER 105 Ca 0.14 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.40 2yqr h SER 105 Cb 0.12 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.04 2yqr h SER 105 CO -0.15 0.00 -1.70 0.03 -0.53 0.00 0.00 176.83 174.48 2yqr h ARG 106 N 0.00 0.04 0.13 2.24 3.08 -1.09 -3.17 114.38 115.61 2yqr h ARG 106 Ca 0.14 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 2yqr h ARG 106 Cb 0.67 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.74 2yqr h ARG 106 CO -0.00 0.63 -0.06 0.35 -1.07 0.00 0.00 179.97 179.81 2yqr h PHE 107 N 0.01 -0.17 0.00 3.04 3.04 0.12 -3.04 116.94 119.95 2yqr h PHE 107 Ca -0.29 -0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.64 2yqr h PHE 107 Cb 2.00 0.06 -0.00 0.00 2.56 0.00 0.00 35.95 40.57 2yqr h PHE 107 CO 0.01 0.29 -0.09 -0.24 -2.02 0.00 0.00 178.31 176.27 2yqr h VAL 108 N -0.87 0.62 -0.25 1.41 3.04 -0.77 -2.05 116.25 117.39 2yqr h VAL 108 Ca -0.02 -0.37 -0.13 0.00 -1.01 0.00 0.00 66.70 65.17 2yqr h VAL 108 Cb 0.54 1.23 -0.01 0.00 -2.01 0.00 0.00 31.29 31.04 2yqr h VAL 108 CO 0.03 0.09 -0.37 -1.13 -1.01 0.00 0.00 177.57 175.17 2yqr h ASN 109 N 0.00 0.59 0.53 3.17 -0.73 -1.58 -2.90 115.58 114.66 2yqr h ASN 109 Ca -0.00 -0.25 -0.11 0.00 1.87 0.00 0.00 56.30 57.80 2yqr h ASN 109 Cb 0.22 -0.16 -0.02 0.00 0.27 0.00 0.00 38.32 38.63 2yqr h ASN 109 CO 0.01 0.91 -0.54 1.56 -0.37 0.00 0.00 177.43 179.00 2yqr h GLN 110 N 0.47 0.01 -5.61 6.67 4.20 -1.25 -3.40 115.11 116.20 2yqr h GLN 110 Ca 0.05 -0.01 -0.24 0.00 0.06 0.00 0.00 58.65 58.51 2yqr h GLN 110 Cb 0.86 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.62 2yqr h GLN 110 CO 0.07 0.55 0.65 0.42 -0.67 0.00 0.00 178.83 179.85 2yqr s ILE 111 N -3.80 3.24 -0.19 2.54 1.01 -1.10 -4.73 121.20 118.18 2yqr s ILE 111 Ca -0.02 -0.14 -0.22 0.00 0.00 0.00 0.00 60.65 60.27 2yqr s ILE 111 Cb 0.13 -3.56 -0.21 0.00 0.01 0.00 0.00 42.46 38.83 2yqr s ILE 111 CO 0.75 -0.53 0.33 -1.13 0.00 0.00 0.00 174.94 174.36 2yqr h ASN 112 N 13.01 0.03 -3.70 3.58 -1.24 -1.85 -3.45 115.58 121.95 2yqr h ASN 112 Ca -0.01 -0.62 -0.63 0.00 0.71 0.00 0.00 56.30 55.75 2yqr h ASN 112 Cb 1.05 -0.01 -0.14 0.00 0.73 0.00 0.00 38.32 39.94 2yqr h ASN 112 CO 1.14 1.43 -0.22 0.42 -1.29 0.00 0.00 177.43 178.90 2yqr s THR 113 N -2.35 5.17 -0.29 -3.57 -4.23 -1.26 -5.02 115.64 104.09 2yqr s THR 113 Ca -0.27 0.59 0.04 0.00 -1.18 0.00 0.00 61.69 60.87 2yqr s THR 113 Cb 0.04 -3.70 0.20 0.00 1.34 0.00 0.00 72.50 70.38 2yqr s THR 113 CO 0.62 0.16 0.61 0.00 -0.54 0.00 0.00 174.62 175.47 2yqr s ALA 114 N 2.04 -2.43 -0.56 3.99 0.00 -1.26 -5.12 121.76 118.42 2yqr s ALA 114 Ca 0.15 1.24 -0.19 0.00 0.00 0.00 0.00 51.96 53.17 2yqr s ALA 114 Cb -0.16 -2.47 0.09 0.00 0.00 0.00 0.00 23.12 20.58 2yqr s ALA 114 CO 0.10 -1.73 0.65 0.08 0.00 0.00 0.00 175.76 174.86 2yqr s VAL 115 N 2.84 4.89 0.51 0.00 1.01 -1.26 -5.06 120.40 123.33 2yqr s VAL 115 Ca 0.13 -0.91 -0.09 0.00 0.00 0.00 0.00 61.98 61.11 2yqr s VAL 115 Cb -0.11 -4.41 0.13 0.00 0.00 0.00 0.00 36.38 31.99 2yqr s VAL 115 CO -0.25 -0.99 0.45 -0.81 0.00 0.00 0.00 175.10 173.50 2yqr n PRO 116 N 6.14 -1.91 -4.14 2.72 -0.04 -1.26 -5.07 135.00 131.45 2yqr n PRO 116 Ca -0.09 -0.73 -0.26 0.00 -0.04 0.00 0.00 63.50 62.38 2yqr n PRO 116 Cb 0.43 -0.68 -0.06 0.00 -0.04 0.00 0.00 33.50 33.15 2yqr n PRO 116 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2yqr s LEU 117 N 0.00 3.57 0.70 1.53 2.34 -1.26 -5.11 118.68 120.44 2yqr s LEU 117 Ca 0.29 -0.26 -0.13 0.00 0.06 0.00 0.00 54.13 54.09 2yqr s LEU 117 Cb -0.03 -2.20 0.02 0.00 -0.56 0.00 0.00 46.19 43.42 2yqr s LEU 117 CO 0.23 0.08 1.10 -2.16 -1.06 0.00 0.00 176.35 174.54 2yqr s PRO 118 N -3.03 2.62 0.00 1.48 0.04 -1.26 -5.35 135.00 129.50 2yqr s PRO 118 Ca 0.29 1.32 0.00 0.00 0.04 0.00 0.00 61.00 62.65 2yqr s PRO 118 Cb -0.10 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.51 2yqr s PRO 118 CO 0.21 -1.38 0.00 0.41 0.04 0.00 0.00 177.00 176.28