#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yqr n SER 2 N 0.00 -7.15 -3.53 1.61 7.64 -1.26 -5.01 113.62 105.93 2yqr n SER 2 Ca 0.00 0.03 -0.29 0.00 1.01 0.00 0.00 58.87 59.62 2yqr n SER 2 Cb 0.00 -4.34 -0.14 0.00 -1.01 0.00 0.00 64.21 58.72 2yqr n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2yqr s SER 3 N -2.63 3.34 -0.04 6.43 0.15 -1.26 -5.02 113.70 114.68 2yqr s SER 3 Ca 0.15 -1.72 -0.04 0.00 0.70 0.00 0.00 55.95 55.04 2yqr s SER 3 Cb -0.03 -0.43 -0.01 0.00 -1.71 0.00 0.00 66.02 63.84 2yqr s SER 3 CO 0.80 -0.38 -0.08 0.61 1.20 0.00 0.00 173.24 175.38 2yqr n GLY 4 N 4.67 -0.43 3.26 9.45 0.00 -1.26 -5.06 105.19 115.83 2yqr n GLY 4 Ca 0.02 -0.08 -0.12 0.00 0.00 0.00 0.00 46.02 45.84 2yqr n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yqr n SER 5 N -3.01 -6.81 -3.20 1.61 2.88 -1.26 -5.00 113.62 98.84 2yqr n SER 5 Ca -0.03 -0.19 -0.17 0.00 -1.33 0.00 0.00 58.87 57.14 2yqr n SER 5 Cb 0.13 -3.97 -0.06 0.00 -0.75 0.00 0.00 64.21 59.56 2yqr n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yqr s SER 6 N -2.74 0.48 0.00 -3.46 0.15 -1.26 -5.12 113.70 101.75 2yqr s SER 6 Ca 0.09 -2.26 0.00 0.00 0.70 0.00 0.00 55.95 54.48 2yqr s SER 6 Cb -0.02 0.54 0.00 0.00 -1.71 0.00 0.00 66.02 64.83 2yqr s SER 6 CO 0.81 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.70 2yqr n GLY 7 N 3.26 -1.47 0.00 9.45 0.00 -1.26 -5.10 105.19 110.07 2yqr n GLY 7 Ca 0.21 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.38 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 0.00 0.26 3.03 -0.02 0.00 -1.26 -5.07 105.19 102.14 2yqr n GLY 8 Ca 0.00 -0.27 -0.31 0.00 0.00 0.00 0.00 46.02 45.44 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 0.00 2.35 -0.32 1.61 -2.45 -1.26 -5.07 119.30 114.17 2yqr s MET 9 Ca 0.00 -0.67 0.05 0.00 -1.25 0.00 0.00 55.69 53.82 2yqr s MET 9 Cb 0.00 -2.26 0.18 0.00 1.25 0.00 0.00 34.83 34.00 2yqr s MET 9 CO 0.00 -0.28 0.52 -1.58 1.05 0.00 0.00 175.02 174.74 2yqr s HIS 10 N 1.43 -1.45 0.16 4.11 5.65 -1.26 -5.16 115.29 118.77 2yqr s HIS 10 Ca 0.03 0.55 0.03 0.00 0.25 0.00 0.00 55.06 55.93 2yqr s HIS 10 Cb -0.14 0.11 -0.04 0.00 -1.18 0.00 0.00 32.58 31.34 2yqr s HIS 10 CO -0.10 -1.06 0.28 0.71 -0.65 0.00 0.00 174.74 173.91 2yqr s TYR 11 N 2.46 3.46 -0.04 3.88 1.51 -1.26 -4.61 117.35 122.74 2yqr s TYR 11 Ca 0.11 0.10 0.05 0.00 -1.01 0.00 0.00 57.07 56.32 2yqr s TYR 11 Cb -0.10 -1.65 -0.01 0.00 -0.11 0.00 0.00 41.96 40.09 2yqr s TYR 11 CO -0.22 0.51 -0.20 0.14 -1.11 0.00 0.00 175.55 174.67 2yqr s VAL 12 N -1.76 1.62 0.12 0.71 -7.23 0.28 -5.00 120.40 109.13 2yqr s VAL 12 Ca 0.34 -0.83 0.07 0.00 -1.81 0.00 0.00 61.98 59.75 2yqr s VAL 12 Cb -0.11 -1.38 -0.04 0.00 0.56 0.00 0.00 36.38 35.42 2yqr s VAL 12 CO 0.28 0.46 -0.17 -1.10 -0.31 0.00 0.00 175.10 174.26 2yqr s GLN 13 N -0.09 1.07 0.32 4.82 -0.21 -1.26 -1.50 119.66 122.81 2yqr s GLN 13 Ca -0.02 -1.21 0.05 0.00 0.02 0.00 0.00 55.36 54.20 2yqr s GLN 13 Cb -0.11 -1.11 -0.06 0.00 1.00 0.00 0.00 33.01 32.73 2yqr s GLN 13 CO 0.02 0.23 0.01 0.34 -2.12 0.00 0.00 175.29 173.77 2yqr s ASP 14 N -2.26 2.74 -0.19 5.90 -1.08 -0.82 -4.97 116.67 115.98 2yqr s ASP 14 Ca 0.08 -1.31 -0.04 0.00 -0.52 0.00 0.00 52.55 50.77 2yqr s ASP 14 Cb -0.07 -0.16 0.09 0.00 -1.46 0.00 0.00 42.92 41.32 2yqr s ASP 14 CO 0.04 -0.48 0.26 -0.54 0.52 0.00 0.00 175.17 174.97 2yqr s LYS 15 N -3.80 0.21 -0.32 4.34 1.02 -1.26 -2.91 119.74 117.03 2yqr s LYS 15 Ca 0.34 0.39 -0.02 0.00 0.02 0.00 0.00 55.97 56.69 2yqr s LYS 15 Cb 0.07 -0.81 0.05 0.00 -0.52 0.00 0.00 37.83 36.62 2yqr s LYS 15 CO 0.14 -0.57 0.03 -0.51 -0.92 0.00 0.00 175.35 173.52 2yqr s LEU 16 N 2.39 4.09 -0.30 3.17 1.02 -0.23 -4.94 118.68 123.88 2yqr s LEU 16 Ca 0.07 -1.34 -0.29 0.00 0.02 0.00 0.00 54.13 52.59 2yqr s LEU 16 Cb -0.15 -1.74 0.01 0.00 0.02 0.00 0.00 46.19 44.33 2yqr s LEU 16 CO -0.12 -0.30 1.08 -0.36 0.02 0.00 0.00 176.35 176.67 2yqr s PHE 17 N 1.26 3.16 0.40 0.29 0.40 -1.26 -0.13 117.98 122.09 2yqr s PHE 17 Ca -0.03 1.23 0.18 0.00 -0.60 0.00 0.00 56.93 57.71 2yqr s PHE 17 Cb -0.20 -3.63 1.04 0.00 0.51 0.00 0.00 43.02 40.74 2yqr s PHE 17 CO -0.01 -0.76 1.95 -0.39 0.70 0.00 0.00 175.22 176.71 2yqr h VAL 18 N 5.69 0.98 -6.16 -0.44 -1.51 -1.95 -3.47 116.25 109.38 2yqr h VAL 18 Ca -0.20 -0.85 -0.43 0.00 -1.23 0.00 0.00 66.70 63.99 2yqr h VAL 18 Cb 1.06 1.48 0.04 0.00 -2.13 0.00 0.00 31.29 31.74 2yqr h VAL 18 CO 1.02 0.23 -0.85 0.61 -1.23 0.00 0.00 177.57 177.35 2yqr n GLY 19 N -0.66 -0.35 0.69 5.19 0.00 -1.26 -4.90 105.19 103.90 2yqr n GLY 19 Ca -0.02 0.16 0.06 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 -4.26 1.84 0.14 0.99 7.94 -1.26 -4.79 117.00 117.60 2yqr n LEU 20 Ca -0.28 -2.87 0.04 0.00 -1.11 0.00 0.00 56.01 51.79 2yqr n LEU 20 Cb 0.67 -0.31 0.46 0.00 0.53 0.00 0.00 43.42 44.78 2yqr n LEU 20 CO 0.69 0.88 0.98 -0.33 -1.11 0.00 0.00 177.39 178.50 2yqr h GLU 21 N 0.65 0.22 0.00 1.96 3.07 -1.97 -1.48 114.58 117.04 2yqr h GLU 21 Ca -0.06 -0.03 -0.05 0.00 -0.50 0.00 0.00 59.36 58.72 2yqr h GLU 21 Cb 1.28 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 29.14 2yqr h GLU 21 CO 0.02 0.27 -0.22 1.12 -1.40 0.00 0.00 179.01 178.81 2yqr h HIS 22 N 0.22 0.00 -2.39 4.33 2.07 -2.01 -3.44 115.15 113.93 2yqr h HIS 22 Ca 0.05 0.00 -0.61 0.00 -2.85 0.00 0.00 60.37 56.96 2yqr h HIS 22 Cb 0.20 0.00 0.08 0.00 2.57 0.00 0.00 27.41 30.27 2yqr h HIS 22 CO 0.00 0.22 0.43 0.00 -3.07 0.00 0.00 177.93 175.51 2yqr n ALA 23 N -2.33 0.24 -1.12 6.11 0.00 -0.56 -4.89 120.51 117.96 2yqr n ALA 23 Ca -0.01 0.43 -0.35 0.00 0.00 0.00 0.00 53.44 53.50 2yqr n ALA 23 Cb 0.33 -2.15 0.09 0.00 0.00 0.00 0.00 19.45 17.71 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 1.53 1.26 0.35 0.00 0.24 -1.26 -4.86 118.33 115.58 2yqr n VAL 24 Ca 0.12 -0.33 0.14 0.00 -2.04 0.00 0.00 64.34 62.23 2yqr n VAL 24 Cb 0.29 -0.71 0.58 0.00 -1.47 0.00 0.00 33.84 32.53 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 -0.75 0.00 0.00 7.34 0.13 -1.94 -2.75 132.00 134.04 2yqr h PRO 25 Ca -0.45 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.53 2yqr h PRO 25 Cb 1.33 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.43 2yqr h PRO 25 CO 0.40 0.00 -0.73 1.79 -0.23 0.00 0.00 178.00 179.23 2yqr h THR 26 N 0.00 1.31 -0.34 1.56 1.35 -2.02 -3.27 112.91 111.50 2yqr h THR 26 Ca 0.00 -2.70 -0.11 0.00 -0.55 0.00 0.00 66.41 63.05 2yqr h THR 26 Cb 0.41 2.55 -0.01 0.00 -1.73 0.00 0.00 68.15 69.36 2yqr h THR 26 CO 0.00 0.72 -0.22 0.15 -0.25 0.00 0.00 175.52 175.91 2yqr h PHE 27 N 0.00 0.89 -5.43 4.73 3.57 -1.83 -3.48 116.94 115.38 2yqr h PHE 27 Ca -0.01 -0.24 -0.12 0.00 3.53 0.00 0.00 57.97 61.13 2yqr h PHE 27 Cb 1.49 -0.20 0.09 0.00 2.79 0.00 0.00 35.95 40.12 2yqr h PHE 27 CO 0.00 0.98 -0.41 0.09 -2.23 0.00 0.00 178.31 176.74 2yqr n ASN 28 N -4.27 -7.24 -0.29 0.41 4.13 -1.24 -4.81 115.26 101.95 2yqr n ASN 28 Ca -0.03 -0.38 0.09 0.00 1.68 0.00 0.00 54.58 55.94 2yqr n ASN 28 Cb 0.44 -5.22 0.31 0.00 -1.54 0.00 0.00 39.78 33.77 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 -0.27 0.91 -0.58 2.41 3.04 -1.91 -1.45 116.25 118.41 2yqr h VAL 29 Ca -0.29 -0.29 0.07 0.00 -1.01 0.00 0.00 66.70 65.19 2yqr h VAL 29 Cb 1.15 -0.00 -0.06 0.00 -2.01 0.00 0.00 31.29 30.37 2yqr h VAL 29 CO 0.37 0.15 0.26 0.50 -1.01 0.00 0.00 177.57 177.84 2yqr h LYS 30 N 0.84 0.47 0.00 4.17 3.64 -1.94 0.18 116.57 123.93 2yqr h LYS 30 Ca 0.44 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.76 2yqr h LYS 30 Cb 0.53 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.24 2yqr h LYS 30 CO -0.20 0.31 -0.15 0.93 -2.27 0.00 0.00 179.45 178.06 2yqr h GLU 31 N 0.48 0.00 0.01 1.90 4.39 -1.62 -1.92 114.58 117.82 2yqr h GLU 31 Ca 0.28 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.98 2yqr h GLU 31 Cb 0.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 2yqr h GLU 31 CO -0.23 0.15 -0.01 0.87 -1.16 0.00 0.00 179.01 178.63 2yqr h LYS 32 N 0.00 -0.02 -0.95 2.33 1.79 -0.60 0.24 116.57 119.36 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 0.48 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.08 2yqr h LYS 32 CO 0.02 0.63 0.62 -0.24 -1.08 0.00 0.00 179.45 179.40 2yqr h VAL 33 N -0.98 1.11 0.00 0.50 3.04 -0.71 -1.49 116.25 117.72 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 0.65 -0.13 0.00 0.00 -2.01 0.00 0.00 31.29 29.80 2yqr h VAL 33 CO 0.00 0.21 -0.76 -1.84 -1.01 0.00 0.00 177.57 174.17 2yqr n GLU 34 N -4.47 0.26 -1.43 4.17 0.28 -0.73 -4.03 120.64 114.69 2yqr n GLU 34 Ca 0.14 0.05 0.19 0.00 -0.16 0.00 0.00 57.16 57.38 2yqr n GLU 34 Cb 0.15 -1.64 -0.05 0.00 1.43 0.00 0.00 31.44 31.34 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 -2.03 3.72 -1.84 0.00 0.84 -3.10 105.19 104.14 2yqr n GLY 35 Ca 0.03 -1.10 -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 -1.29 1.61 0.04 -1.26 -3.00 135.00 132.96 2yqr s PRO 36 Ca 0.00 2.04 -0.02 0.00 0.04 0.00 0.00 61.00 63.06 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 0.00 177.00 177.23 2yqr n GLY 37 N 3.19 -0.50 2.42 0.56 0.00 -1.26 -0.11 105.19 109.48 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 -0.42 0.19 0.00 0.02 -0.47 0.15 113.55 113.01 2yqr h SER 39 Ca -0.38 -0.05 0.01 0.00 -0.84 0.00 0.00 61.79 60.52 2yqr h SER 39 Cb 1.22 0.11 -0.04 0.00 0.14 0.00 0.00 62.40 63.82 2yqr h SER 39 CO 0.51 -0.21 -0.51 1.88 -1.14 0.00 0.00 176.83 177.36 2yqr h TYR 40 N -0.60 -1.46 -0.94 3.45 -1.99 -1.77 -0.94 116.97 112.72 2yqr h TYR 40 Ca -0.05 0.03 0.08 0.00 2.00 0.00 0.00 58.73 60.79 2yqr h TYR 40 Cb 0.44 0.61 -0.07 0.00 2.00 0.00 0.00 36.73 39.72 2yqr h TYR 40 CO -0.02 -0.59 0.61 -0.07 -0.00 0.00 0.00 178.16 178.08 2yqr h LEU 41 N -0.77 0.92 -0.54 3.88 4.07 -1.59 -1.95 115.31 119.34 2yqr h LEU 41 Ca -0.02 0.02 0.07 0.00 0.08 0.00 0.00 57.88 58.03 2yqr h LEU 41 Cb 0.75 -0.18 -0.06 0.00 1.08 0.00 0.00 40.66 42.25 2yqr h LEU 41 CO -0.24 0.57 0.22 1.56 -1.08 0.00 0.00 178.44 179.48 2yqr h GLN 42 N 1.03 0.41 0.20 1.13 1.08 0.12 -0.23 115.11 118.86 2yqr h GLN 42 Ca 0.42 -0.02 0.01 0.00 -1.45 0.00 0.00 58.65 57.60 2yqr h GLN 42 Cb 0.27 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.56 2yqr h GLN 42 CO -0.17 0.27 -0.51 1.25 -0.95 0.00 0.00 178.83 178.72 2yqr h HIS 43 N 0.43 -1.48 0.00 2.96 2.76 -0.39 0.29 115.15 119.72 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 0.25 0.62 -0.00 0.00 1.55 0.00 0.00 27.41 29.83 2yqr h HIS 43 CO -0.14 -0.60 -0.01 0.82 -1.30 0.00 0.00 177.93 176.70 2yqr h ILE 44 N -0.79 0.50 0.00 6.26 2.04 -1.45 0.28 117.51 124.35 2yqr h ILE 44 Ca -0.02 -0.03 -0.13 0.00 1.00 0.00 0.00 64.86 65.68 2yqr h ILE 44 Cb 0.77 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 2yqr h ILE 44 CO -0.23 0.01 -0.63 1.56 0.00 0.00 0.00 178.15 178.86 2yqr h GLN 45 N 0.00 0.00 0.00 2.37 4.20 0.64 -2.64 115.11 119.68 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 0.02 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.77 2yqr h GLN 45 CO 0.00 0.63 -1.69 -0.89 -0.67 0.00 0.00 178.83 176.21 2yqr n ILE 46 N -3.36 0.95 0.13 2.54 5.41 0.84 -0.59 119.36 125.28 2yqr n ILE 46 Ca 0.01 -0.68 0.01 0.00 1.00 0.00 0.00 62.75 63.10 2yqr n ILE 46 Cb 0.74 -0.51 0.03 0.00 -0.71 0.00 0.00 39.64 39.19 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 -0.57 -3.35 114.58 115.43 2yqr h GLU 47 Ca -0.19 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.47 2yqr h GLU 47 Cb 1.55 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.20 2yqr h GLU 47 CO 0.03 0.57 -1.23 0.25 -1.16 0.00 0.00 179.01 177.46 2yqr n THR 48 N -3.27 0.12 -1.08 1.13 -2.24 -1.00 -5.02 114.28 102.93 2yqr n THR 48 Ca 0.02 -0.13 -0.03 0.00 -2.27 0.00 0.00 64.05 61.64 2yqr n THR 48 Cb 0.75 -0.16 -0.01 0.00 -2.10 0.00 0.00 70.33 68.80 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 2.47 0.59 3.92 3.38 0.00 0.24 -4.86 105.19 110.92 2yqr n GLY 49 Ca -0.03 -0.73 -0.23 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.06 3.83 -0.54 4.61 0.00 -1.19 -5.00 121.76 121.40 2yqr s ALA 50 Ca 0.00 -1.24 -0.26 0.00 0.00 0.00 0.00 51.96 50.46 2yqr s ALA 50 Cb 0.00 -1.61 0.03 0.00 0.00 0.00 0.00 23.12 21.55 2yqr s ALA 50 CO 0.00 0.32 1.03 0.15 0.00 0.00 0.00 175.76 177.26 2yqr s LYS 51 N -3.75 3.45 -0.22 0.00 1.02 -0.51 -4.52 119.74 115.20 2yqr s LYS 51 Ca 0.34 0.02 -0.05 0.00 0.02 0.00 0.00 55.97 56.29 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 -1.50 0.00 0.08 -0.92 0.00 0.00 175.35 173.29 2yqr s VAL 52 N 4.28 3.82 -0.07 3.17 1.01 -1.26 -0.08 120.40 131.28 2yqr s VAL 52 Ca 0.37 -0.34 -0.06 0.00 0.00 0.00 0.00 61.98 61.94 2yqr s VAL 52 Cb -0.10 -2.75 0.02 0.00 0.00 0.00 0.00 36.38 33.55 2yqr s VAL 52 CO 0.23 0.40 0.19 0.72 0.00 0.00 0.00 175.10 176.64 2yqr s PHE 53 N 1.35 -0.21 0.18 5.22 -0.12 -0.42 -4.95 117.98 119.02 2yqr s PHE 53 Ca 0.04 0.52 -0.30 0.00 -0.05 0.00 0.00 56.93 57.14 2yqr s PHE 53 Cb -0.15 0.06 -0.08 0.00 -0.63 0.00 0.00 43.02 42.22 2yqr s PHE 53 CO 0.00 -0.11 1.26 -1.17 -0.05 0.00 0.00 175.22 175.15 2yqr s LEU 54 N 0.27 4.43 0.09 -1.99 2.96 -1.26 -2.07 118.68 121.11 2yqr s LEU 54 Ca -0.01 2.30 -0.00 0.00 -0.22 0.00 0.00 54.13 56.20 2yqr s LEU 54 Cb -0.03 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 43.02 2yqr s LEU 54 CO -0.01 -0.46 -0.01 -0.60 -1.32 0.00 0.00 176.35 173.95 2yqr s ARG 55 N -0.05 0.79 0.00 1.98 3.52 -0.46 -4.90 118.95 119.82 2yqr s ARG 55 Ca 0.55 -1.33 0.00 0.00 -0.13 0.00 0.00 55.73 54.82 2yqr s ARG 55 Cb -0.34 0.09 0.00 0.00 -1.56 0.00 0.00 34.95 33.14 2yqr s ARG 55 CO 0.37 -0.13 0.00 0.41 -0.81 0.00 0.00 175.30 175.13 2yqr n GLY 56 N -0.01 1.54 3.63 8.12 0.00 -1.26 -0.19 105.19 117.02 2yqr n GLY 56 Ca -0.11 -1.98 -0.47 0.00 0.00 0.00 0.00 46.02 43.46 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 1.92 1.66 0.00 1.61 0.00 0.83 -1.00 118.16 123.18 2yqr n LYS 57 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 58.31 58.90 2yqr n LYS 57 Cb 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 35.03 32.82 2yqr n LYS 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2yqr n GLY 58 N 2.30 3.04 0.22 3.14 0.00 -1.26 -0.14 105.19 112.49 2yqr n GLY 58 Ca 0.14 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.24 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 -1.35 -3.46 113.55 114.99 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 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 176.80 2yqr n GLY 60 N -0.60 1.41 3.30 -0.77 0.00 -1.26 -4.92 105.19 102.35 2yqr n GLY 60 Ca -0.02 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.55 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 5.36 0.14 -4.60 0.00 1.08 -1.90 -3.36 117.51 114.23 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 1.06 0.96 -0.11 0.00 -3.07 0.00 0.00 36.82 35.67 2yqr h ILE 62 CO 0.87 0.00 -1.28 -0.62 -0.69 0.00 0.00 178.15 176.43 2yqr n GLU 63 N -3.27 -3.69 0.00 2.37 1.02 -1.26 -1.73 120.64 114.08 2yqr n GLU 63 Ca -0.03 2.88 0.07 0.00 -0.02 0.00 0.00 57.16 60.06 2yqr n GLU 63 Cb 0.11 -4.30 0.34 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 1.34 0.09 -0.15 3.49 -0.04 -1.26 -0.01 135.00 138.47 2yqr n PRO 64 Ca -0.33 0.21 -0.11 0.00 -0.04 0.00 0.00 63.50 63.23 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 2.58 0.57 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 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2yqr h ALA 65 CO 0.00 0.40 -0.78 0.43 0.00 0.00 0.00 179.25 179.30 2yqr n SER 66 N -4.37 3.44 0.00 0.00 7.64 -1.16 -5.04 113.62 114.12 2yqr n SER 66 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.87 2yqr n SER 66 Cb 0.32 0.17 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 2yqr n SER 66 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yqr n GLY 67 N 2.79 1.32 3.37 0.23 0.00 0.99 -5.10 105.19 108.78 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 1.13 1.61 0.52 -0.70 -4.76 118.95 118.18 2yqr s ARG 68 Ca 0.00 -1.24 -0.18 0.00 -0.52 0.00 0.00 55.73 53.78 2yqr s ARG 68 Cb 0.00 -1.92 0.12 0.00 0.52 0.00 0.00 34.95 33.67 2yqr s ARG 68 CO 0.00 0.47 0.07 0.39 0.02 0.00 0.00 175.30 176.25 2yqr n GLU 69 N 1.30 -1.74 -0.93 3.54 4.71 -1.17 -4.37 120.64 121.97 2yqr n GLU 69 Ca -0.18 -0.49 -0.30 0.00 -0.01 0.00 0.00 57.16 56.19 2yqr n GLU 69 Cb 0.53 -1.73 0.17 0.00 -1.01 0.00 0.00 31.44 29.40 2yqr n GLU 69 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2yqr s ALA 70 N -2.24 1.01 0.10 0.62 0.00 -1.26 -4.91 121.76 115.08 2yqr s ALA 70 Ca 0.57 0.05 -0.05 0.00 0.00 0.00 0.00 51.96 52.53 2yqr s ALA 70 Cb -0.12 -3.26 -0.21 0.00 0.00 0.00 0.00 23.12 19.53 2yqr s ALA 70 CO 0.66 -2.82 1.20 0.74 0.00 0.00 0.00 175.76 175.54 2yqr h PHE 71 N -1.89 0.56 -3.80 0.00 0.04 -1.97 -3.35 116.94 106.51 2yqr h PHE 71 Ca -0.51 -0.36 -0.49 0.00 2.80 0.00 0.00 57.97 59.41 2yqr h PHE 71 Cb 1.29 -0.04 0.05 0.00 2.20 0.00 0.00 35.95 39.45 2yqr h PHE 71 CO 0.40 1.24 0.21 -1.21 -0.60 0.00 0.00 178.31 178.35 2yqr s GLU 72 N -2.91 3.24 1.08 1.51 0.41 -1.26 -4.88 118.70 115.89 2yqr s GLU 72 Ca -0.05 0.22 -0.15 0.00 -0.41 0.00 0.00 54.97 54.59 2yqr s GLU 72 Cb 0.08 -2.26 0.23 0.00 -1.78 0.00 0.00 34.13 30.40 2yqr s GLU 72 CO 0.88 -0.53 1.10 -1.25 -0.49 0.00 0.00 175.26 174.97 2yqr s PRO 73 N -4.96 -0.25 0.79 0.39 0.04 -1.26 -0.12 135.00 129.63 2yqr s PRO 73 Ca 0.52 0.29 -0.13 0.00 0.04 0.00 0.00 61.00 61.72 2yqr s PRO 73 Cb -0.11 -1.68 0.07 0.00 0.04 0.00 0.00 34.50 32.83 2yqr s PRO 73 CO 0.47 -3.14 1.17 0.00 0.04 0.00 0.00 177.00 175.55 2yqr s MET 74 N -5.12 1.85 -0.10 4.56 0.23 0.80 -3.86 119.30 117.67 2yqr s MET 74 Ca 0.67 1.62 -0.31 0.00 -1.03 0.00 0.00 55.69 56.65 2yqr s MET 74 Cb -0.16 -1.81 0.12 0.00 -1.53 0.00 0.00 34.83 31.45 2yqr s MET 74 CO 0.57 -2.02 1.00 1.52 -2.03 0.00 0.00 175.02 174.06 2yqr s TYR 75 N -2.29 -0.30 0.19 3.16 -0.85 0.73 -4.07 117.35 113.92 2yqr s TYR 75 Ca 0.70 0.29 -0.30 0.00 -0.52 0.00 0.00 57.07 57.25 2yqr s TYR 75 Cb -0.26 0.51 -0.08 0.00 0.38 0.00 0.00 41.96 42.51 2yqr s TYR 75 CO 0.50 -0.40 1.03 0.42 -1.52 0.00 0.00 175.55 175.58 2yqr s ILE 76 N -2.34 4.01 -0.18 -3.49 1.01 0.82 -1.35 121.20 119.67 2yqr s ILE 76 Ca 0.04 1.82 0.00 0.00 0.00 0.00 0.00 60.65 62.52 2yqr s ILE 76 Cb -0.01 -4.16 0.04 0.00 0.01 0.00 0.00 42.46 38.34 2yqr s ILE 76 CO -0.05 0.36 -0.08 -0.47 0.00 0.00 0.00 174.94 174.70 2yqr s TYR 77 N -0.56 1.99 -0.05 3.97 6.14 -0.88 -1.06 117.35 126.89 2yqr s TYR 77 Ca 0.46 -1.27 -0.02 0.00 0.64 0.00 0.00 57.07 56.87 2yqr s TYR 77 Cb -0.27 -1.45 -0.04 0.00 0.42 0.00 0.00 41.96 40.62 2yqr s TYR 77 CO 0.34 -0.66 0.08 0.42 0.64 0.00 0.00 175.55 176.37 2yqr s ILE 78 N 1.54 4.87 -0.23 3.14 1.01 -1.15 -1.31 121.20 129.07 2yqr s ILE 78 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 60.65 60.44 2yqr s ILE 78 Cb -0.15 -3.16 0.07 0.00 0.01 0.00 0.00 42.46 39.22 2yqr s ILE 78 CO -0.08 0.48 0.02 -0.94 0.00 0.00 0.00 174.94 174.41 2yqr s SER 79 N -1.37 3.42 -0.02 3.58 1.04 0.89 -1.95 113.70 119.28 2yqr s SER 79 Ca 0.19 -1.09 0.03 0.00 0.48 0.00 0.00 55.95 55.56 2yqr s SER 79 Cb -0.12 -0.83 -0.00 0.00 0.10 0.00 0.00 66.02 65.17 2yqr s SER 79 CO 0.09 -0.31 -0.10 -2.28 0.98 0.00 0.00 173.24 171.62 2yqr s HIS 80 N 1.66 1.04 -1.04 5.02 5.04 -0.56 -1.43 115.29 125.03 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 32.35 2yqr s HIS 80 CO -0.10 -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 -0.56 135.00 135.10 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 -2.96 0.64 0.32 0.54 1.02 -1.26 -4.50 119.74 113.54 2yqr s LYS 82 Ca 0.08 -0.96 0.11 0.00 0.02 0.00 0.00 55.97 55.21 2yqr s LYS 82 Cb 0.09 -0.29 0.52 0.00 -0.52 0.00 0.00 37.83 37.64 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 3.98 0.04 0.14 -1.68 0.13 -1.93 -2.78 132.00 129.90 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 0.49 0.52 -0.36 1.49 -0.23 0.00 0.00 178.00 179.91 2yqr h GLU 84 N 0.04 -0.53 -0.52 0.86 4.81 -1.97 0.45 114.58 117.72 2yqr h GLU 84 Ca -0.00 0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.19 2yqr h GLU 84 Cb 0.87 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.35 2yqr h GLU 84 CO 0.07 -0.35 0.04 0.78 -0.73 0.00 0.00 179.01 178.81 2yqr h GLY 85 N -0.55 0.96 0.26 1.92 0.00 -1.89 -2.70 103.07 101.08 2yqr h GLY 85 Ca -0.01 -0.68 0.15 0.00 0.00 0.00 0.00 47.33 46.79 2yqr h GLY 85 CO -0.16 0.63 0.55 -2.00 0.00 0.00 0.00 176.54 175.55 2yqr h LEU 86 N 0.76 0.73 -0.82 3.11 7.12 -1.30 0.34 115.31 125.24 2yqr h LEU 86 Ca 0.15 0.08 -0.06 0.00 0.13 0.00 0.00 57.88 58.19 2yqr h LEU 86 Cb 0.47 -0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 40.54 2yqr h LEU 86 CO 0.02 0.32 -0.27 0.00 -0.13 0.00 0.00 178.44 178.37 2yqr h ALA 87 N 1.58 0.95 0.00 1.25 0.00 -0.74 -2.97 119.26 119.33 2yqr h ALA 87 Ca 0.51 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 2yqr h ALA 87 Cb 0.69 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2yqr h ALA 87 CO -0.34 0.34 -0.00 0.00 0.00 0.00 0.00 179.25 179.25 2yqr h ALA 88 N 1.73 -0.00 -0.98 0.00 0.00 -0.19 -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 0.89 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.59 2yqr h ALA 88 CO 0.04 -0.00 0.61 0.00 0.00 0.00 0.00 179.25 179.90 2yqr h ALA 89 N -0.52 1.81 -0.33 0.00 0.00 -0.64 0.19 119.26 119.78 2yqr h ALA 89 Ca -0.00 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2yqr h ALA 89 Cb 0.48 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2yqr h ALA 89 CO 0.00 -0.16 -0.12 -0.22 0.00 0.00 0.00 179.25 178.75 2yqr h LYS 90 N 0.68 0.57 -0.48 0.00 3.64 -1.64 -1.91 116.57 117.43 2yqr h LYS 90 Ca 0.55 -0.17 -0.12 0.00 -1.27 0.00 0.00 60.65 59.64 2yqr h LYS 90 Cb 0.96 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 2yqr h LYS 90 CO -0.32 0.68 -0.18 0.87 -2.27 0.00 0.00 179.45 178.23 2yqr h LYS 91 N 0.52 0.96 -0.08 1.90 1.57 -0.60 -2.70 116.57 118.14 2yqr h LYS 91 Ca 0.09 -0.40 -0.10 0.00 -1.87 0.00 0.00 60.65 58.37 2yqr h LYS 91 Cb 0.52 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 2yqr h LYS 91 CO 0.03 1.07 -0.41 -0.07 -0.57 0.00 0.00 179.45 179.50 2yqr h LEU 92 N 0.81 0.19 -0.33 2.94 3.38 -1.11 -2.95 115.31 118.25 2yqr h LEU 92 Ca 0.11 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 2yqr h LEU 92 Cb 0.75 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2yqr h LEU 92 CO 0.06 0.58 0.04 0.00 0.09 0.00 0.00 178.44 179.21 2yqr h GLU 94 N 0.37 0.04 0.04 0.00 4.39 -1.38 -0.68 114.58 117.36 2yqr h GLU 94 Ca 0.10 -0.01 -0.23 0.00 0.34 0.00 0.00 59.36 59.56 2yqr h GLU 94 Cb 0.37 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.00 2yqr h GLU 94 CO 0.01 0.14 -1.08 -0.97 -1.16 0.00 0.00 179.01 175.95 2yqr h ASN 95 N 0.04 0.15 0.22 1.42 -1.24 -1.32 -3.19 115.58 111.66 2yqr h ASN 95 Ca 0.01 -0.16 -0.20 0.00 0.71 0.00 0.00 56.30 56.66 2yqr h ASN 95 Cb 0.19 -0.05 -0.00 0.00 0.73 0.00 0.00 38.32 39.19 2yqr h ASN 95 CO 0.01 1.12 -0.77 0.25 -1.29 0.00 0.00 177.43 176.75 2yqr h LEU 96 N 0.03 0.54 -0.57 0.34 6.46 -0.41 -3.23 115.31 118.46 2yqr h LEU 96 Ca -0.05 -0.37 -0.03 0.00 -0.12 0.00 0.00 57.88 57.31 2yqr h LEU 96 Cb 1.83 -0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 41.57 2yqr h LEU 96 CO 0.16 1.12 0.24 -0.07 -0.62 0.00 0.00 178.44 179.27 2yqr h LEU 97 N 0.30 0.78 -1.96 2.25 3.38 -1.22 -2.25 115.31 116.58 2yqr h LEU 97 Ca -0.04 -0.16 0.18 0.00 0.09 0.00 0.00 57.88 57.95 2yqr h LEU 97 Cb 1.36 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 2yqr h LEU 97 CO 0.14 0.72 0.45 1.56 0.09 0.00 0.00 178.44 181.40 2yqr h GLN 98 N 0.79 0.03 0.38 1.13 1.08 -1.57 0.19 115.11 117.14 2yqr h GLN 98 Ca 0.19 -0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.37 2yqr h GLN 98 Cb 0.18 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.60 2yqr h GLN 98 CO -0.02 0.02 -0.18 1.15 -0.95 0.00 0.00 178.83 178.85 2yqr h THR 99 N 0.03 0.06 -0.13 -0.54 2.02 -1.49 -2.96 112.91 109.91 2yqr h THR 99 Ca 0.30 -0.65 0.02 0.00 0.77 0.00 0.00 66.41 66.86 2yqr h THR 99 Cb 1.17 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.67 2yqr h THR 99 CO -0.01 0.01 0.09 1.62 0.37 0.00 0.00 175.52 177.60 2yqr h VAL 100 N -1.12 0.97 0.00 3.16 3.04 -1.29 -0.41 116.25 120.60 2yqr h VAL 100 Ca -0.05 -0.02 -0.06 0.00 -1.01 0.00 0.00 66.70 65.56 2yqr h VAL 100 Cb 0.41 0.90 -0.01 0.00 -2.01 0.00 0.00 31.29 30.58 2yqr h VAL 100 CO 0.09 0.01 -0.28 0.45 -1.01 0.00 0.00 177.57 176.83 2yqr h HIS 101 N 0.07 0.00 0.00 3.17 -0.00 -0.69 -2.39 115.15 115.30 2yqr h HIS 101 Ca 0.06 0.00 -0.11 0.00 -0.00 0.00 0.00 60.37 60.32 2yqr h HIS 101 Cb 0.15 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.54 2yqr h HIS 101 CO -0.00 0.28 -0.52 0.00 -0.00 0.00 0.00 177.93 177.69 2yqr h ALA 102 N 1.72 0.74 -0.24 2.45 0.00 -0.89 -3.20 119.26 119.84 2yqr h ALA 102 Ca -0.00 -0.48 -0.13 0.00 0.00 0.00 0.00 54.91 54.30 2yqr h ALA 102 Cb 0.57 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2yqr h ALA 102 CO 0.04 0.65 -0.35 0.93 0.00 0.00 0.00 179.25 180.52 2yqr h GLU 103 N 0.00 0.67 -0.01 0.00 4.39 -1.28 -3.11 114.58 115.24 2yqr h GLU 103 Ca -0.01 -0.39 0.00 0.00 0.34 0.00 0.00 59.36 59.30 2yqr h GLU 103 Cb 1.27 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.95 2yqr h GLU 103 CO 0.07 1.01 0.00 -0.92 -1.16 0.00 0.00 179.01 178.01 2yqr h TYR 104 N 0.38 0.01 -0.55 4.33 3.20 -1.57 0.17 116.97 122.93 2yqr h TYR 104 Ca 0.03 0.00 0.16 0.00 3.14 0.00 0.00 58.73 62.06 2yqr h TYR 104 Cb 0.93 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.18 2yqr h TYR 104 CO 0.08 0.01 0.44 1.03 -1.64 0.00 0.00 178.16 178.08 2yqr h SER 105 N 0.01 0.00 0.45 -2.11 0.87 -1.59 0.22 113.55 111.40 2yqr h SER 105 Ca 0.00 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.26 2yqr h SER 105 Cb 0.00 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 61.93 2yqr h SER 105 CO -0.00 0.00 -1.65 0.03 -0.53 0.00 0.00 176.83 174.68 2yqr h ARG 106 N 0.00 0.13 0.28 2.24 3.08 -1.28 -3.20 114.38 115.63 2yqr h ARG 106 Ca 0.26 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 2yqr h ARG 106 Cb 1.14 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.27 2yqr h ARG 106 CO -0.00 0.87 -0.13 0.35 -1.07 0.00 0.00 179.97 179.98 2yqr h PHE 107 N 0.03 -0.34 -0.04 3.04 3.04 0.15 -3.16 116.94 119.66 2yqr h PHE 107 Ca -0.27 -0.01 0.01 0.00 3.98 0.00 0.00 57.97 61.68 2yqr h PHE 107 Cb 2.00 0.11 -0.00 0.00 2.56 0.00 0.00 35.95 40.62 2yqr h PHE 107 CO 0.03 0.01 0.04 -0.24 -2.02 0.00 0.00 178.31 176.13 2yqr h VAL 108 N -0.89 0.64 -0.19 1.41 3.04 -0.87 -1.00 116.25 118.39 2yqr h VAL 108 Ca -0.04 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.63 2yqr h VAL 108 Cb 0.51 0.97 -0.01 0.00 -2.01 0.00 0.00 31.29 30.75 2yqr h VAL 108 CO 0.06 0.00 0.00 0.78 -1.01 0.00 0.00 177.57 177.40 2yqr h ASN 109 N 0.00 0.25 0.43 3.17 4.21 -1.54 -2.50 115.58 119.60 2yqr h ASN 109 Ca 0.02 -0.03 -0.29 0.00 1.21 0.00 0.00 56.30 57.21 2yqr h ASN 109 Cb 0.09 -0.06 0.02 0.00 -1.12 0.00 0.00 38.32 37.25 2yqr h ASN 109 CO -0.00 0.29 -1.26 1.56 -1.29 0.00 0.00 177.43 176.73 2yqr h GLN 110 N 0.27 0.41 -0.22 0.81 4.20 -1.20 -3.23 115.11 116.15 2yqr h GLN 110 Ca 0.06 -0.63 0.06 0.00 0.06 0.00 0.00 58.65 58.20 2yqr h GLN 110 Cb 0.18 0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 2yqr h GLN 110 CO 0.00 1.28 0.20 0.82 -0.67 0.00 0.00 178.83 180.47 2yqr h ILE 111 N 0.14 0.60 -3.41 2.54 2.04 -1.30 -3.41 117.51 114.71 2yqr h ILE 111 Ca -0.17 0.00 -0.55 0.00 1.00 0.00 0.00 64.86 65.15 2yqr h ILE 111 Cb 1.96 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 38.85 2yqr h ILE 111 CO 0.22 0.00 0.12 0.20 0.00 0.00 0.00 178.15 178.69 2yqr s ASN 112 N -6.07 7.21 0.76 1.72 0.01 -1.13 -5.04 114.94 112.40 2yqr s ASN 112 Ca -0.05 1.44 -0.14 0.00 -0.71 0.00 0.00 52.86 53.40 2yqr s ASN 112 Cb 0.16 -2.45 0.05 0.00 0.41 0.00 0.00 41.25 39.43 2yqr s ASN 112 CO 0.60 0.11 1.17 0.42 -1.51 0.00 0.00 177.10 177.89 2yqr s THR 113 N -0.50 2.50 -0.36 1.60 -4.23 -1.26 -4.30 115.64 109.08 2yqr s THR 113 Ca 0.35 0.22 -0.16 0.00 -1.18 0.00 0.00 61.69 60.93 2yqr s THR 113 Cb -0.21 -2.67 0.02 0.00 1.34 0.00 0.00 72.50 70.98 2yqr s THR 113 CO 0.23 -0.16 0.41 0.00 -0.54 0.00 0.00 174.62 174.56 2yqr n ALA 114 N -3.02 -2.87 -2.97 3.99 0.00 -1.26 -4.91 120.51 109.46 2yqr n ALA 114 Ca 0.12 0.73 -0.44 0.00 0.00 0.00 0.00 53.44 53.85 2yqr n ALA 114 Cb 0.51 -2.50 -0.05 0.00 0.00 0.00 0.00 19.45 17.41 2yqr n ALA 114 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2yqr s VAL 115 N -1.98 4.76 0.31 0.00 1.01 -1.26 -5.04 120.40 118.20 2yqr s VAL 115 Ca 0.20 -0.74 -0.29 0.00 0.00 0.00 0.00 61.98 61.14 2yqr s VAL 115 Cb -0.04 -4.47 -0.10 0.00 0.00 0.00 0.00 36.38 31.77 2yqr s VAL 115 CO 0.72 -1.08 1.23 -2.16 0.00 0.00 0.00 175.10 173.80 2yqr s PRO 116 N 2.88 4.46 0.21 2.72 0.04 -1.26 -5.05 135.00 139.01 2yqr s PRO 116 Ca 0.14 2.06 0.11 0.00 0.04 0.00 0.00 61.00 63.35 2yqr s PRO 116 Cb -0.22 -3.12 -0.04 0.00 0.04 0.00 0.00 34.50 31.16 2yqr s PRO 116 CO 0.09 -0.03 -0.19 -0.48 0.04 0.00 0.00 177.00 176.43 2yqr s LEU 117 N -1.66 2.63 0.78 -3.56 2.34 -1.26 -5.13 118.68 112.81 2yqr s LEU 117 Ca 0.47 -0.82 -0.11 0.00 0.06 0.00 0.00 54.13 53.74 2yqr s LEU 117 Cb -0.37 -1.30 0.06 0.00 -0.56 0.00 0.00 46.19 44.02 2yqr s LEU 117 CO 0.48 0.09 1.09 -2.16 -1.06 0.00 0.00 176.35 174.80 2yqr s PRO 118 N -2.92 2.22 0.00 1.48 0.04 -1.26 -5.35 135.00 129.21 2yqr s PRO 118 Ca 0.24 1.16 0.00 0.00 0.04 0.00 0.00 61.00 62.44 2yqr s PRO 118 Cb -0.07 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2yqr s PRO 118 CO 0.13 -1.67 0.00 0.41 0.04 0.00 0.00 177.00 175.91