#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 -7.54 -3.94 1.61 2.88 -1.26 -5.05 113.62 100.33 2yqr n SER 2 Ca 0.00 0.21 -0.09 0.00 -1.33 0.00 0.00 58.87 57.66 2yqr n SER 2 Cb 0.00 -4.85 -0.09 0.00 -0.75 0.00 0.00 64.21 58.52 2yqr n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yqr s SER 3 N -2.65 0.21 0.00 -3.46 0.01 -1.26 -5.16 113.70 101.40 2yqr s SER 3 Ca 0.17 -0.62 0.00 0.00 1.31 0.00 0.00 55.95 56.81 2yqr s SER 3 Cb -0.04 0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.43 2yqr s SER 3 CO 0.78 -0.55 0.00 0.61 0.41 0.00 0.00 173.24 174.49 2yqr n GLY 4 N 0.55 3.46 3.71 3.44 0.00 -1.26 -5.18 105.19 109.92 2yqr n GLY 4 Ca -0.18 -0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.20 2yqr n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yqr s SER 5 N 1.00 4.12 -0.47 1.61 0.01 -1.26 -5.11 113.70 113.60 2yqr s SER 5 Ca 0.00 -1.42 0.05 0.00 1.31 0.00 0.00 55.95 55.89 2yqr s SER 5 Cb 0.00 -0.01 0.23 0.00 0.21 0.00 0.00 66.02 66.44 2yqr s SER 5 CO 0.00 -0.66 0.89 -1.54 0.41 0.00 0.00 173.24 172.33 2yqr n SER 6 N -1.19 -2.82 0.00 2.44 3.41 -1.26 -5.15 113.62 109.05 2yqr n SER 6 Ca -0.09 -2.87 0.00 0.00 -0.26 0.00 0.00 58.87 55.65 2yqr n SER 6 Cb 0.66 1.62 0.00 0.00 -0.26 0.00 0.00 64.21 66.23 2yqr n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yqr n GLY 7 N 2.11 5.45 3.12 5.00 0.00 -1.26 -5.12 105.19 114.50 2yqr n GLY 7 Ca 0.11 -1.43 -0.37 0.00 0.00 0.00 0.00 46.02 44.33 2yqr n GLY 7 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2yqr s GLY 8 N 0.00 2.16 -0.53 -0.02 0.00 -1.26 -5.01 107.32 102.67 2yqr s GLY 8 Ca 0.00 -2.77 0.04 0.00 0.00 0.00 0.00 44.72 41.98 2yqr s GLY 8 CO 0.00 1.06 0.31 1.06 0.00 0.00 0.00 173.10 175.54 2yqr s MET 9 N 0.78 1.79 -0.24 2.90 1.00 -1.26 -5.04 119.30 119.23 2yqr s MET 9 Ca 0.11 -2.55 -0.03 0.00 0.00 0.00 0.00 55.69 53.21 2yqr s MET 9 Cb -0.22 -2.88 0.10 0.00 0.00 0.00 0.00 34.83 31.83 2yqr s MET 9 CO -0.04 -1.19 0.21 -1.01 0.00 0.00 0.00 175.02 173.00 2yqr s HIS 10 N -0.33 -0.19 0.41 -0.03 0.09 -1.26 -5.15 115.29 108.84 2yqr s HIS 10 Ca 0.20 -0.11 -0.10 0.00 -0.00 0.00 0.00 55.06 55.06 2yqr s HIS 10 Cb -0.18 -0.50 -0.06 0.00 -0.00 0.00 0.00 32.58 31.83 2yqr s HIS 10 CO -0.05 -0.71 0.77 0.71 -0.00 0.00 0.00 174.74 175.45 2yqr s TYR 11 N 2.28 3.48 -0.04 1.40 1.51 -1.26 -4.66 117.35 120.06 2yqr s TYR 11 Ca 0.07 1.02 0.05 0.00 -1.01 0.00 0.00 57.07 57.20 2yqr s TYR 11 Cb -0.15 -2.42 -0.01 0.00 -0.11 0.00 0.00 41.96 39.27 2yqr s TYR 11 CO -0.21 -0.13 -0.19 0.14 -1.11 0.00 0.00 175.55 174.05 2yqr s VAL 12 N -2.41 1.59 0.19 0.71 -7.23 0.29 -5.00 120.40 108.53 2yqr s VAL 12 Ca 0.51 -0.82 0.08 0.00 -1.81 0.00 0.00 61.98 59.94 2yqr s VAL 12 Cb -0.10 -1.35 -0.04 0.00 0.56 0.00 0.00 36.38 35.44 2yqr s VAL 12 CO 0.33 0.45 -0.16 0.00 -0.31 0.00 0.00 175.10 175.41 2yqr s GLN 13 N -0.11 1.31 0.28 4.82 -2.07 -1.26 -1.49 119.66 121.13 2yqr s GLN 13 Ca -0.01 -1.50 0.04 0.00 -1.82 0.00 0.00 55.36 52.06 2yqr s GLN 13 Cb -0.11 -1.25 -0.06 0.00 -1.09 0.00 0.00 33.01 30.51 2yqr s GLN 13 CO 0.02 0.23 0.03 0.34 -1.32 0.00 0.00 175.29 174.60 2yqr s ASP 14 N -2.99 2.03 -0.20 12.60 -1.08 -0.79 -4.97 116.67 121.27 2yqr s ASP 14 Ca 0.19 -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 41.51 2yqr s ASP 14 CO 0.07 -0.57 0.29 -0.54 0.52 0.00 0.00 175.17 174.93 2yqr s LYS 15 N -3.89 0.24 -0.32 4.34 1.02 -1.26 -3.00 119.74 116.87 2yqr s LYS 15 Ca 0.33 0.44 -0.01 0.00 0.02 0.00 0.00 55.97 56.76 2yqr s LYS 15 Cb 0.07 -0.70 0.07 0.00 -0.52 0.00 0.00 37.83 36.75 2yqr s LYS 15 CO 0.13 -0.57 0.04 -0.51 -0.92 0.00 0.00 175.35 173.51 2yqr s LEU 16 N 2.43 4.23 0.04 3.17 1.02 -0.37 -4.95 118.68 124.25 2yqr s LEU 16 Ca 0.07 -1.53 -0.30 0.00 0.02 0.00 0.00 54.13 52.39 2yqr s LEU 16 Cb -0.15 -1.72 -0.04 0.00 0.02 0.00 0.00 46.19 44.30 2yqr s LEU 16 CO -0.13 -0.33 1.10 -0.36 0.02 0.00 0.00 176.35 176.65 2yqr s PHE 17 N 1.18 3.54 0.07 0.29 0.40 -1.26 -0.31 117.98 121.90 2yqr s PHE 17 Ca -0.01 1.49 0.09 0.00 -0.60 0.00 0.00 56.93 57.89 2yqr s PHE 17 Cb -0.20 -3.28 -0.18 0.00 0.51 0.00 0.00 43.02 39.86 2yqr s PHE 17 CO -0.03 -0.69 1.22 -0.39 0.70 0.00 0.00 175.22 176.04 2yqr h VAL 18 N 4.62 1.52 -6.03 -0.44 -1.51 -1.95 -3.48 116.25 108.97 2yqr h VAL 18 Ca -0.41 -3.21 -0.38 0.00 -1.23 0.00 0.00 66.70 61.47 2yqr h VAL 18 Cb 1.22 2.75 0.11 0.00 -2.13 0.00 0.00 31.29 33.23 2yqr h VAL 18 CO 0.78 0.87 -0.89 0.61 -1.23 0.00 0.00 177.57 177.71 2yqr n GLY 19 N 1.36 -1.05 1.04 5.19 0.00 -1.26 -4.92 105.19 105.54 2yqr n GLY 19 Ca -0.02 0.49 0.04 0.00 0.00 0.00 0.00 46.02 46.53 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 -3.83 1.01 -0.06 0.99 7.94 -1.26 -4.85 117.00 116.94 2yqr n LEU 20 Ca -0.09 -2.02 0.02 0.00 -1.11 0.00 0.00 56.01 52.81 2yqr n LEU 20 Cb 0.60 -0.09 0.33 0.00 0.53 0.00 0.00 43.42 44.79 2yqr n LEU 20 CO 0.65 0.55 1.11 -0.33 -1.11 0.00 0.00 177.39 178.26 2yqr h GLU 21 N 0.67 0.67 0.00 1.96 3.07 -1.97 -1.31 114.58 117.67 2yqr h GLU 21 Ca -0.13 -0.07 -0.02 0.00 -0.50 0.00 0.00 59.36 58.64 2yqr h GLU 21 Cb 1.61 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 29.38 2yqr h GLU 21 CO 0.06 0.51 -0.11 1.12 -1.40 0.00 0.00 179.01 179.18 2yqr h HIS 22 N 0.68 0.00 -2.56 4.33 2.07 -2.02 -3.44 115.15 114.21 2yqr h HIS 22 Ca 0.17 0.00 -0.60 0.00 -2.85 0.00 0.00 60.37 57.09 2yqr h HIS 22 Cb 0.05 0.00 0.09 0.00 2.57 0.00 0.00 27.41 30.12 2yqr h HIS 22 CO 0.00 0.11 0.40 0.00 -3.07 0.00 0.00 177.93 175.38 2yqr n ALA 23 N -2.36 0.39 -1.17 6.11 0.00 -0.50 -4.90 120.51 118.09 2yqr n ALA 23 Ca -0.02 0.41 -0.35 0.00 0.00 0.00 0.00 53.44 53.48 2yqr n ALA 23 Cb 0.21 -2.15 0.09 0.00 0.00 0.00 0.00 19.45 17.60 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 1.18 1.70 0.35 0.00 0.24 -1.26 -4.87 118.33 115.66 2yqr n VAL 24 Ca 0.11 -0.32 0.14 0.00 -2.04 0.00 0.00 64.34 62.23 2yqr n VAL 24 Cb 0.31 -0.87 0.58 0.00 -1.47 0.00 0.00 33.84 32.39 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 -0.66 0.00 0.00 7.34 0.13 -1.93 -2.71 132.00 134.16 2yqr h PRO 25 Ca -0.46 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.55 2yqr h PRO 25 Cb 1.32 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.44 2yqr h PRO 25 CO 0.42 0.00 -0.58 1.79 -0.23 0.00 0.00 178.00 179.41 2yqr h THR 26 N 0.00 1.05 -0.25 1.56 1.35 -2.02 -3.26 112.91 111.35 2yqr h THR 26 Ca 0.00 -2.30 -0.15 0.00 -0.55 0.00 0.00 66.41 63.41 2yqr h THR 26 Cb 0.41 2.39 0.00 0.00 -1.73 0.00 0.00 68.15 69.22 2yqr h THR 26 CO 0.00 0.56 -0.44 0.15 -0.25 0.00 0.00 175.52 175.55 2yqr h PHE 27 N 0.00 0.91 -5.52 4.73 3.57 -1.83 -3.48 116.94 115.32 2yqr h PHE 27 Ca -0.01 -0.32 -0.15 0.00 3.53 0.00 0.00 57.97 61.02 2yqr h PHE 27 Cb 1.34 -0.17 0.08 0.00 2.79 0.00 0.00 35.95 39.99 2yqr h PHE 27 CO 0.00 1.11 -0.45 0.09 -2.23 0.00 0.00 178.31 176.83 2yqr n ASN 28 N -4.16 -7.06 -0.06 0.41 4.13 -1.23 -4.82 115.26 102.47 2yqr n ASN 28 Ca -0.05 -0.42 0.17 0.00 1.68 0.00 0.00 54.58 55.95 2yqr n ASN 28 Cb 0.56 -4.98 0.59 0.00 -1.54 0.00 0.00 39.78 34.41 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 -0.33 0.79 -0.36 2.41 3.04 -1.91 -1.27 116.25 118.62 2yqr h VAL 29 Ca -0.31 -0.07 -0.00 0.00 -1.01 0.00 0.00 66.70 65.31 2yqr h VAL 29 Cb 1.16 0.56 -0.02 0.00 -2.01 0.00 0.00 31.29 30.99 2yqr h VAL 29 CO 0.37 0.04 0.22 0.50 -1.01 0.00 0.00 177.57 177.69 2yqr h LYS 30 N 0.21 0.48 0.00 4.17 3.64 -1.93 -0.02 116.57 123.12 2yqr h LYS 30 Ca 0.29 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.61 2yqr h LYS 30 Cb 0.83 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.55 2yqr h LYS 30 CO -0.05 0.35 -0.10 0.93 -2.27 0.00 0.00 179.45 178.31 2yqr h GLU 31 N 0.47 0.00 0.02 1.90 4.39 -1.58 -1.66 114.58 118.12 2yqr h GLU 31 Ca 0.13 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.83 2yqr h GLU 31 Cb -0.01 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 2yqr h GLU 31 CO -0.03 0.10 -0.01 0.87 -1.16 0.00 0.00 179.01 178.78 2yqr h LYS 32 N 0.00 -0.02 -0.95 2.33 1.79 -1.04 0.24 116.57 118.92 2yqr h LYS 32 Ca -0.00 0.00 0.06 0.00 -2.18 0.00 0.00 60.65 58.53 2yqr h LYS 32 Cb 0.35 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.94 2yqr h LYS 32 CO 0.01 0.49 0.62 -0.24 -1.08 0.00 0.00 179.45 179.25 2yqr h VAL 33 N -0.99 1.10 0.00 0.50 3.04 -0.96 -1.36 116.25 117.58 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 0.52 -0.12 0.00 0.00 -2.01 0.00 0.00 31.29 29.68 2yqr h VAL 33 CO 0.00 0.21 -0.72 -1.84 -1.01 0.00 0.00 177.57 174.21 2yqr n GLU 34 N -4.48 0.27 -1.44 4.17 0.28 -0.63 -4.04 120.64 114.78 2yqr n GLU 34 Ca 0.14 0.06 0.19 0.00 -0.16 0.00 0.00 57.16 57.39 2yqr n GLU 34 Cb 0.17 -1.65 -0.05 0.00 1.43 0.00 0.00 31.44 31.33 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 -2.06 3.72 -1.84 0.00 0.84 -3.11 105.19 104.10 2yqr n GLY 35 Ca 0.03 -1.10 -0.42 0.00 0.00 0.00 0.00 46.02 44.53 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 -2.51 4.35 -1.30 1.61 0.04 -1.26 -3.00 135.00 132.95 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 31.31 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 3.18 -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 -0.39 0.18 0.00 0.87 -0.47 0.14 113.55 113.88 2yqr h SER 39 Ca -0.39 -0.07 0.01 0.00 -1.23 0.00 0.00 61.79 60.12 2yqr h SER 39 Cb 1.22 0.10 -0.04 0.00 -0.44 0.00 0.00 62.40 63.24 2yqr h SER 39 CO 0.51 -0.17 -0.52 1.88 -0.53 0.00 0.00 176.83 177.99 2yqr h TYR 40 N -0.60 -1.49 -0.93 2.24 -1.99 -1.77 -0.91 116.97 111.53 2yqr h TYR 40 Ca -0.05 0.03 0.06 0.00 2.00 0.00 0.00 58.73 60.78 2yqr h TYR 40 Cb 0.44 0.62 -0.06 0.00 2.00 0.00 0.00 36.73 39.73 2yqr h TYR 40 CO -0.02 -0.61 0.60 -0.07 -0.00 0.00 0.00 178.16 178.07 2yqr h LEU 41 N -0.79 0.94 -0.59 3.88 4.07 -1.59 -2.07 115.31 119.17 2yqr h LEU 41 Ca -0.01 0.00 0.07 0.00 0.08 0.00 0.00 57.88 58.02 2yqr h LEU 41 Cb 0.78 -0.20 -0.06 0.00 1.08 0.00 0.00 40.66 42.26 2yqr h LEU 41 CO -0.25 0.61 0.27 1.56 -1.08 0.00 0.00 178.44 179.56 2yqr h GLN 42 N 1.08 0.49 0.19 1.13 1.08 0.15 -0.48 115.11 118.73 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 0.17 -0.11 -0.04 0.00 -0.05 0.00 0.00 27.48 27.45 2yqr h GLN 42 CO -0.15 0.32 -0.47 1.25 -0.95 0.00 0.00 178.83 178.83 2yqr h HIS 43 N 0.50 -1.36 -0.01 2.96 2.76 -0.45 0.28 115.15 119.83 2yqr h HIS 43 Ca 0.28 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.48 2yqr h HIS 43 Cb 0.26 0.57 -0.00 0.00 1.55 0.00 0.00 27.41 29.79 2yqr h HIS 43 CO -0.12 -0.56 0.01 0.82 -1.30 0.00 0.00 177.93 176.78 2yqr h ILE 44 N -0.73 0.49 0.00 6.26 2.04 -1.48 0.29 117.51 124.38 2yqr h ILE 44 Ca -0.02 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.71 2yqr h ILE 44 Cb 0.71 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 2yqr h ILE 44 CO -0.22 0.00 -0.63 1.56 0.00 0.00 0.00 178.15 178.87 2yqr h GLN 45 N 0.00 0.00 0.00 2.37 4.20 0.54 -2.55 115.11 119.67 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 0.03 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.78 2yqr h GLN 45 CO -0.00 0.63 -1.70 -0.89 -0.67 0.00 0.00 178.83 176.20 2yqr n ILE 46 N -3.37 0.96 0.13 2.54 5.41 0.83 -0.63 119.36 125.23 2yqr n ILE 46 Ca 0.01 -0.68 0.01 0.00 1.00 0.00 0.00 62.75 63.09 2yqr n ILE 46 Cb 0.74 -0.51 0.01 0.00 -0.71 0.00 0.00 39.64 39.16 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 -0.56 -3.35 114.58 115.44 2yqr h GLU 47 Ca -0.20 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.46 2yqr h GLU 47 Cb 1.56 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.21 2yqr h GLU 47 CO 0.03 0.60 -1.27 0.25 -1.16 0.00 0.00 179.01 177.45 2yqr n THR 48 N -3.26 0.15 -1.08 1.13 -2.24 -0.96 -5.02 114.28 103.00 2yqr n THR 48 Ca 0.02 -0.15 -0.03 0.00 -2.27 0.00 0.00 64.05 61.61 2yqr n THR 48 Cb 0.77 -0.19 -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 2.44 0.61 3.91 3.38 0.00 0.20 -4.86 105.19 110.86 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 -2.07 3.81 -0.54 4.61 0.00 -1.20 -5.00 121.76 121.37 2yqr s ALA 50 Ca 0.00 -1.25 -0.26 0.00 0.00 0.00 0.00 51.96 50.45 2yqr s ALA 50 Cb 0.00 -1.59 0.03 0.00 0.00 0.00 0.00 23.12 21.57 2yqr s ALA 50 CO 0.00 0.32 1.04 0.15 0.00 0.00 0.00 175.76 177.27 2yqr s LYS 51 N -3.73 3.45 -0.22 0.00 1.02 -0.49 -4.52 119.74 115.25 2yqr s LYS 51 Ca 0.33 0.03 -0.05 0.00 0.02 0.00 0.00 55.97 56.30 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 -1.51 -0.00 0.08 -0.92 0.00 0.00 175.35 173.26 2yqr s VAL 52 N 4.32 3.76 -0.07 3.17 1.01 -1.26 -0.04 120.40 131.29 2yqr s VAL 52 Ca 0.37 -0.37 -0.06 0.00 0.00 0.00 0.00 61.98 61.92 2yqr s VAL 52 Cb -0.10 -2.72 0.02 0.00 0.00 0.00 0.00 36.38 33.58 2yqr s VAL 52 CO 0.23 0.41 0.19 0.72 0.00 0.00 0.00 175.10 176.65 2yqr s PHE 53 N 1.35 -0.21 0.16 5.22 -0.12 -0.42 -4.95 117.98 119.01 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 0.05 -0.08 0.00 -0.63 0.00 0.00 43.02 42.22 2yqr s PHE 53 CO 0.00 -0.12 1.28 -1.17 -0.05 0.00 0.00 175.22 175.16 2yqr s LEU 54 N 0.30 4.41 0.05 -1.99 2.96 -1.26 -2.11 118.68 121.04 2yqr s LEU 54 Ca -0.02 2.29 0.00 0.00 -0.22 0.00 0.00 54.13 56.18 2yqr s LEU 54 Cb -0.03 -3.60 -0.03 0.00 0.50 0.00 0.00 46.19 43.03 2yqr s LEU 54 CO -0.01 -0.50 -0.04 -0.13 -1.32 0.00 0.00 176.35 174.35 2yqr s ARG 55 N 0.23 0.56 0.00 1.98 0.52 -0.47 -4.89 118.95 116.87 2yqr s ARG 55 Ca 0.57 -1.02 0.00 0.00 -0.52 0.00 0.00 55.73 54.77 2yqr s ARG 55 Cb -0.34 0.04 0.00 0.00 0.52 0.00 0.00 34.95 35.17 2yqr s ARG 55 CO 0.35 -0.06 0.00 0.41 0.02 0.00 0.00 175.30 176.02 2yqr n GLY 56 N 0.66 1.86 3.63 -3.53 0.00 -1.26 -0.28 105.19 106.28 2yqr n GLY 56 Ca -0.17 -2.04 -0.48 0.00 0.00 0.00 0.00 46.02 43.32 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 0.92 1.67 0.00 1.61 0.00 0.84 -0.68 118.16 122.52 2yqr n LYS 57 Ca 0.00 0.60 0.00 0.00 0.00 0.00 0.00 58.31 58.91 2yqr n LYS 57 Cb 0.00 -2.28 0.00 0.00 0.00 0.00 0.00 35.03 32.75 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 2.74 3.27 0.20 3.14 0.00 -1.26 -0.12 105.19 113.17 2yqr n GLY 58 Ca 0.16 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.20 -3.47 113.55 115.13 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 0.33 0.00 0.61 -0.87 0.00 0.00 176.83 176.90 2yqr n GLY 60 N -0.03 1.34 3.27 -0.77 0.00 -1.26 -4.91 105.19 102.83 2yqr n GLY 60 Ca -0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.57 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 5.49 0.15 -4.62 0.00 1.08 -1.90 -3.35 117.51 114.36 2yqr h ILE 62 Ca -0.10 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.38 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 0.86 0.00 -1.30 -0.62 -0.69 0.00 0.00 178.15 176.39 2yqr n GLU 63 N -3.29 -3.75 0.00 2.37 1.02 -1.26 -1.76 120.64 113.97 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 0.33 0.00 -0.02 0.00 0.00 31.44 27.52 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 0.09 -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 0.53 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.48 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 0.40 -0.77 0.43 0.00 0.00 0.00 179.25 179.30 2yqr n SER 66 N -4.37 3.42 0.00 0.00 7.64 -1.16 -5.04 113.62 114.10 2yqr n SER 66 Ca -0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 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 2.78 1.40 3.36 0.23 0.00 0.98 -5.10 105.19 108.83 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 1.70 -0.72 -4.76 118.95 119.38 2yqr s ARG 68 Ca 0.00 -1.20 -0.19 0.00 -0.47 0.00 0.00 55.73 53.87 2yqr s ARG 68 Cb 0.00 -1.92 0.10 0.00 -0.57 0.00 0.00 34.95 32.57 2yqr s ARG 68 CO 0.00 0.48 0.00 0.39 -1.08 0.00 0.00 175.30 175.09 2yqr n GLU 69 N 1.41 -1.54 -0.85 3.89 4.71 -1.17 -4.40 120.64 122.69 2yqr n GLU 69 Ca -0.17 -0.43 -0.30 0.00 -0.01 0.00 0.00 57.16 56.24 2yqr n GLU 69 Cb 0.52 -1.70 0.17 0.00 -1.01 0.00 0.00 31.44 29.43 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 1.12 0.12 0.62 0.00 -1.26 -4.89 121.76 115.23 2yqr s ALA 70 Ca 0.56 0.22 -0.06 0.00 0.00 0.00 0.00 51.96 52.69 2yqr s ALA 70 Cb -0.12 -3.32 -0.12 0.00 0.00 0.00 0.00 23.12 19.56 2yqr s ALA 70 CO 0.66 -2.80 1.28 0.74 0.00 0.00 0.00 175.76 175.65 2yqr h PHE 71 N -1.88 0.67 -3.88 0.00 -1.00 -1.97 -3.34 116.94 105.54 2yqr h PHE 71 Ca -0.49 -0.37 -0.49 0.00 2.81 0.00 0.00 57.97 59.43 2yqr h PHE 71 Cb 1.28 -0.08 0.05 0.00 3.61 0.00 0.00 35.95 40.82 2yqr h PHE 71 CO 0.44 1.19 0.24 -1.21 -1.61 0.00 0.00 178.31 177.35 2yqr s GLU 72 N -3.26 3.29 1.04 1.51 2.02 -1.26 -4.87 118.70 117.17 2yqr s GLU 72 Ca -0.06 0.30 -0.14 0.00 0.02 0.00 0.00 54.97 55.09 2yqr s GLU 72 Cb 0.08 -2.24 0.21 0.00 0.10 0.00 0.00 34.13 32.29 2yqr s GLU 72 CO 0.88 -0.53 1.10 -1.25 0.02 0.00 0.00 175.26 175.47 2yqr s PRO 73 N -4.99 0.06 0.69 0.39 0.04 -1.26 -0.11 135.00 129.82 2yqr s PRO 73 Ca 0.52 0.39 -0.17 0.00 0.04 0.00 0.00 61.00 61.79 2yqr s PRO 73 Cb -0.11 -1.70 0.01 0.00 0.04 0.00 0.00 34.50 32.74 2yqr s PRO 73 CO 0.48 -2.95 1.27 0.00 0.04 0.00 0.00 177.00 175.84 2yqr n MET 74 N -4.31 0.90 -3.48 4.56 0.00 0.84 -3.97 117.12 111.66 2yqr n MET 74 Ca 0.06 0.37 -0.10 0.00 0.00 0.00 0.00 57.70 58.03 2yqr n MET 74 Cb 0.58 -2.51 -0.02 0.00 0.00 0.00 0.00 33.22 31.26 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 -1.55 -0.43 0.17 3.17 -0.85 0.62 -3.94 117.35 114.54 2yqr s TYR 75 Ca 0.81 0.31 -0.30 0.00 -0.52 0.00 0.00 57.07 57.37 2yqr s TYR 75 Cb -0.36 0.54 -0.07 0.00 0.38 0.00 0.00 41.96 42.44 2yqr s TYR 75 CO 0.43 -0.64 1.00 0.42 -1.52 0.00 0.00 175.55 175.24 2yqr s ILE 76 N -3.15 4.16 -0.19 -3.49 1.01 0.58 -1.37 121.20 118.75 2yqr s ILE 76 Ca 0.03 1.92 0.00 0.00 0.00 0.00 0.00 60.65 62.60 2yqr s ILE 76 Cb -0.01 -4.23 0.04 0.00 0.01 0.00 0.00 42.46 38.28 2yqr s ILE 76 CO -0.09 0.36 -0.07 -0.47 0.00 0.00 0.00 174.94 174.66 2yqr s TYR 77 N -0.44 2.10 -0.05 3.97 6.14 -0.89 -1.24 117.35 126.93 2yqr s TYR 77 Ca 0.46 -1.39 -0.03 0.00 0.64 0.00 0.00 57.07 56.75 2yqr s TYR 77 Cb -0.26 -1.49 -0.04 0.00 0.42 0.00 0.00 41.96 40.59 2yqr s TYR 77 CO 0.32 -0.69 0.09 0.42 0.64 0.00 0.00 175.55 176.33 2yqr s ILE 78 N 1.50 4.92 -0.22 3.14 1.01 -1.16 -1.30 121.20 129.09 2yqr s ILE 78 Ca -0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 60.65 60.45 2yqr s ILE 78 Cb -0.16 -3.19 0.07 0.00 0.01 0.00 0.00 42.46 39.19 2yqr s ILE 78 CO -0.08 0.48 0.02 -0.94 0.00 0.00 0.00 174.94 174.43 2yqr s SER 79 N -1.37 3.34 -0.02 3.58 1.04 0.94 -1.89 113.70 119.32 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 -0.79 -0.00 0.00 0.10 0.00 0.00 66.02 65.21 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 1.70 1.03 -1.04 5.02 5.04 -0.56 -1.39 115.29 125.09 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 -0.71 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 -0.55 135.00 135.11 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 -4.50 119.74 113.55 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 -0.28 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 3.96 0.05 0.14 -1.68 0.13 -1.91 -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 -0.35 1.49 -0.23 0.00 0.00 178.00 179.92 2yqr h GLU 84 N 0.04 -0.53 -0.52 0.86 4.81 -1.97 0.40 114.58 117.67 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 0.97 0.26 1.92 0.00 -1.89 -2.68 103.07 101.10 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 0.56 -2.00 0.00 0.00 0.00 176.54 175.57 2yqr h LEU 86 N 0.77 0.74 -0.79 3.11 7.12 -1.30 0.34 115.31 125.30 2yqr h LEU 86 Ca 0.15 0.08 -0.06 0.00 0.13 0.00 0.00 57.88 58.18 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 -0.29 0.00 -0.13 0.00 0.00 178.44 178.36 2yqr h ALA 87 N 1.58 0.94 0.01 1.25 0.00 -0.74 -2.98 119.26 119.31 2yqr h ALA 87 Ca 0.52 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 2yqr h ALA 87 Cb 0.70 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.44 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 -0.99 0.00 0.00 -0.17 -3.16 119.26 116.63 2yqr h ALA 88 Ca -0.00 -0.23 0.19 0.00 0.00 0.00 0.00 54.91 54.86 2yqr h ALA 88 Cb 0.92 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.62 2yqr h ALA 88 CO 0.04 -0.02 0.61 0.00 0.00 0.00 0.00 179.25 179.89 2yqr h ALA 89 N -0.53 1.77 -0.48 0.00 0.00 -0.64 0.16 119.26 119.54 2yqr h ALA 89 Ca -0.00 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2yqr h ALA 89 Cb 0.47 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2yqr h ALA 89 CO 0.00 -0.12 0.07 -0.22 0.00 0.00 0.00 179.25 178.98 2yqr h LYS 90 N 0.71 0.75 -0.37 0.00 3.64 -1.64 -1.60 116.57 118.07 2yqr h LYS 90 Ca 0.55 -0.16 -0.09 0.00 -1.27 0.00 0.00 60.65 59.68 2yqr h LYS 90 Cb 0.93 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.63 2yqr h LYS 90 CO -0.33 0.71 -0.14 0.87 -2.27 0.00 0.00 179.45 178.29 2yqr h LYS 91 N 0.71 0.74 -0.40 1.90 1.57 -0.69 -2.68 116.57 117.73 2yqr h LYS 91 Ca 0.15 -0.31 -0.07 0.00 -1.87 0.00 0.00 60.65 58.55 2yqr h LYS 91 Cb 0.34 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 2yqr h LYS 91 CO 0.01 0.91 -0.05 -0.07 -0.57 0.00 0.00 179.45 179.68 2yqr h LEU 92 N 0.53 0.64 -0.30 2.94 3.38 -1.08 -2.83 115.31 118.58 2yqr h LEU 92 Ca 0.09 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2yqr h LEU 92 Cb 0.67 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2yqr h LEU 92 CO 0.05 0.74 0.14 0.00 0.09 0.00 0.00 178.44 179.46 2yqr h GLU 94 N 0.35 0.23 0.00 0.00 5.08 -1.31 -0.23 114.58 118.70 2yqr h GLU 94 Ca 0.10 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.32 2yqr h GLU 94 Cb 0.14 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2yqr h GLU 94 CO -0.01 0.15 -0.59 -0.97 -1.00 0.00 0.00 179.01 176.59 2yqr h ASN 95 N 0.24 0.00 0.50 1.42 -1.24 -1.21 -3.17 115.58 112.12 2yqr h ASN 95 Ca 0.07 0.00 -0.28 0.00 0.71 0.00 0.00 56.30 56.80 2yqr h ASN 95 Cb -0.02 0.00 0.01 0.00 0.73 0.00 0.00 38.32 39.04 2yqr h ASN 95 CO -0.01 0.59 -1.25 0.25 -1.29 0.00 0.00 177.43 175.73 2yqr h LEU 96 N 0.00 0.54 -0.82 0.34 6.46 0.01 -3.30 115.31 118.53 2yqr h LEU 96 Ca -0.01 -0.55 -0.03 0.00 -0.12 0.00 0.00 57.88 57.17 2yqr h LEU 96 Cb 1.36 -0.17 -0.04 0.00 -0.73 0.00 0.00 40.66 41.08 2yqr h LEU 96 CO 0.08 1.41 0.39 -0.07 -0.62 0.00 0.00 178.44 179.63 2yqr h LEU 97 N 0.12 1.08 -1.98 2.25 3.38 -1.14 -2.04 115.31 116.98 2yqr h LEU 97 Ca -0.15 -0.14 0.09 0.00 0.09 0.00 0.00 57.88 57.77 2yqr h LEU 97 Cb 1.95 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 42.41 2yqr h LEU 97 CO 0.21 0.91 0.23 1.56 0.09 0.00 0.00 178.44 181.45 2yqr h GLN 98 N 1.17 0.03 0.31 1.13 1.08 -1.63 0.12 115.11 117.32 2yqr h GLN 98 Ca 0.28 -0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.47 2yqr h GLN 98 Cb 0.12 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.55 2yqr h GLN 98 CO -0.03 0.02 -0.15 1.15 -0.95 0.00 0.00 178.83 178.87 2yqr h THR 99 N 0.03 0.14 -0.53 -0.54 2.02 -1.48 -3.03 112.91 109.52 2yqr h THR 99 Ca 0.16 -0.75 0.05 0.00 0.77 0.00 0.00 66.41 66.64 2yqr h THR 99 Cb 0.59 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.20 2yqr h THR 99 CO -0.01 0.04 0.35 1.62 0.37 0.00 0.00 175.52 177.89 2yqr h VAL 100 N -1.08 1.01 0.00 3.16 3.04 -1.26 -0.33 116.25 120.79 2yqr h VAL 100 Ca -0.04 -0.18 -0.03 0.00 -1.01 0.00 0.00 66.70 65.43 2yqr h VAL 100 Cb 0.38 0.44 -0.00 0.00 -2.01 0.00 0.00 31.29 30.09 2yqr h VAL 100 CO 0.07 0.10 -0.16 0.45 -1.01 0.00 0.00 177.57 177.01 2yqr h HIS 101 N 0.52 0.00 0.00 3.17 -0.00 -0.83 -1.90 115.15 116.11 2yqr h HIS 101 Ca 0.22 0.00 -0.14 0.00 -0.00 0.00 0.00 60.37 60.46 2yqr h HIS 101 Cb 0.22 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.61 2yqr h HIS 101 CO -0.00 0.16 -0.65 0.00 -0.00 0.00 0.00 177.93 177.44 2yqr h ALA 102 N 1.84 0.75 -0.19 2.45 0.00 -0.93 -3.19 119.26 120.00 2yqr h ALA 102 Ca -0.00 -0.59 -0.06 0.00 0.00 0.00 0.00 54.91 54.25 2yqr h ALA 102 Cb 0.32 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2yqr h ALA 102 CO 0.02 0.82 -0.13 0.93 0.00 0.00 0.00 179.25 180.89 2yqr h GLU 103 N 0.00 0.42 -0.24 0.00 4.39 -1.18 -3.13 114.58 114.84 2yqr h GLU 103 Ca -0.01 -0.20 0.04 0.00 0.34 0.00 0.00 59.36 59.53 2yqr h GLU 103 Cb 1.30 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.91 2yqr h GLU 103 CO 0.08 0.74 0.02 -0.92 -1.16 0.00 0.00 179.01 177.78 2yqr h TYR 104 N 0.09 0.03 -0.60 4.33 3.20 -1.56 0.24 116.97 122.71 2yqr h TYR 104 Ca 0.04 0.02 0.17 0.00 3.14 0.00 0.00 58.73 62.10 2yqr h TYR 104 Cb 0.64 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.91 2yqr h TYR 104 CO 0.07 -0.01 0.46 1.03 -1.64 0.00 0.00 178.16 178.07 2yqr h SER 105 N 0.10 0.00 0.59 -2.11 0.87 -1.57 0.30 113.55 111.73 2yqr h SER 105 Ca 0.11 0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 60.44 2yqr h SER 105 Cb 0.13 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.05 2yqr h SER 105 CO -0.17 0.00 -1.56 0.03 -0.53 0.00 0.00 176.83 174.59 2yqr h ARG 106 N 0.00 0.00 -0.01 2.24 2.47 -1.11 -2.56 114.38 115.40 2yqr h ARG 106 Ca 0.28 0.00 -0.19 0.00 -1.26 0.00 0.00 59.98 58.81 2yqr h ARG 106 Cb 1.20 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.51 2yqr h ARG 106 CO -0.00 0.41 -0.84 0.35 0.56 0.00 0.00 179.97 180.45 2yqr h PHE 107 N 0.00 0.35 0.00 3.04 3.04 0.22 -3.26 116.94 120.34 2yqr h PHE 107 Ca -0.23 -0.18 -0.16 0.00 3.98 0.00 0.00 57.97 61.38 2yqr h PHE 107 Cb 1.83 -0.04 -0.03 0.00 2.56 0.00 0.00 35.95 40.27 2yqr h PHE 107 CO 0.00 0.97 -1.40 1.55 -2.02 0.00 0.00 178.31 177.41 2yqr n VAL 108 N -3.71 1.15 -0.26 1.41 3.14 0.75 -4.01 118.33 116.81 2yqr n VAL 108 Ca -0.04 -0.68 0.01 0.00 -2.96 0.00 0.00 64.34 60.67 2yqr n VAL 108 Cb 0.78 -0.71 0.14 0.00 -1.06 0.00 0.00 33.84 32.99 2yqr n VAL 108 CO 0.00 0.00 0.00 -1.13 -6.46 0.00 0.00 176.83 169.24 2yqr h ASN 109 N 0.00 0.57 -0.30 6.55 -0.73 -1.49 -1.71 115.58 118.47 2yqr h ASN 109 Ca -0.16 0.05 -0.13 0.00 1.87 0.00 0.00 56.30 57.93 2yqr h ASN 109 Cb 1.55 -0.06 -0.01 0.00 0.27 0.00 0.00 38.32 40.07 2yqr h ASN 109 CO 0.04 0.33 -0.30 0.06 -0.37 0.00 0.00 177.43 177.20 2yqr h GLN 110 N 0.70 0.81 -5.66 6.67 3.07 -1.72 -3.41 115.11 115.57 2yqr h GLN 110 Ca 0.35 -0.37 -0.48 0.00 0.09 0.00 0.00 58.65 58.25 2yqr h GLN 110 Cb 0.32 -0.01 0.01 0.00 0.08 0.00 0.00 27.48 27.87 2yqr h GLN 110 CO -0.24 1.00 1.62 0.42 0.09 0.00 0.00 178.83 181.72 2yqr s ILE 111 N -4.49 3.00 -0.17 1.86 1.01 -0.64 -4.78 121.20 116.99 2yqr s ILE 111 Ca -0.10 0.00 -0.16 0.00 0.00 0.00 0.00 60.65 60.39 2yqr s ILE 111 Cb 0.12 -3.01 -0.22 0.00 0.01 0.00 0.00 42.46 39.36 2yqr s ILE 111 CO 0.85 -0.01 0.31 -1.13 0.00 0.00 0.00 174.94 174.97 2yqr h ASN 112 N 19.10 0.18 -3.44 3.58 -1.24 -1.82 -3.47 115.58 128.48 2yqr h ASN 112 Ca -0.26 -0.70 -0.54 0.00 0.71 0.00 0.00 56.30 55.51 2yqr h ASN 112 Cb 1.27 -0.06 -0.04 0.00 0.73 0.00 0.00 38.32 40.22 2yqr h ASN 112 CO 1.14 1.61 0.15 -0.89 -1.29 0.00 0.00 177.43 178.15 2yqr s THR 113 N -2.44 4.66 0.00 -3.57 2.01 -1.26 -5.03 115.64 110.02 2yqr s THR 113 Ca -0.26 1.62 -0.30 0.00 0.31 0.00 0.00 61.69 63.07 2yqr s THR 113 Cb 0.06 -4.11 0.11 0.00 0.01 0.00 0.00 72.50 68.57 2yqr s THR 113 CO 0.67 0.40 1.25 0.00 -0.69 0.00 0.00 174.62 176.25 2yqr s ALA 114 N -0.32 -2.17 -0.38 7.40 0.00 -1.26 -5.13 121.76 119.90 2yqr s ALA 114 Ca 0.37 0.63 -0.02 0.00 0.00 0.00 0.00 51.96 52.94 2yqr s ALA 114 Cb -0.21 0.39 0.10 0.00 0.00 0.00 0.00 23.12 23.40 2yqr s ALA 114 CO 0.23 -1.05 0.15 0.08 0.00 0.00 0.00 175.76 175.17 2yqr s VAL 115 N -2.52 3.10 0.31 0.00 1.01 -1.26 -5.09 120.40 115.95 2yqr s VAL 115 Ca 0.14 -1.99 -0.29 0.00 0.00 0.00 0.00 61.98 59.84 2yqr s VAL 115 Cb 0.04 -3.09 -0.10 0.00 0.00 0.00 0.00 36.38 33.23 2yqr s VAL 115 CO -0.03 -0.59 1.23 -2.16 0.00 0.00 0.00 175.10 173.55 2yqr s PRO 116 N 1.13 4.47 0.67 2.72 0.04 -1.26 -5.01 135.00 137.75 2yqr s PRO 116 Ca 0.07 2.06 -0.14 0.00 0.04 0.00 0.00 61.00 63.02 2yqr s PRO 116 Cb -0.22 -3.12 0.01 0.00 0.04 0.00 0.00 34.50 31.21 2yqr s PRO 116 CO -0.04 -0.03 1.10 -0.51 0.04 0.00 0.00 177.00 177.55 2yqr s LEU 117 N -1.63 3.33 0.32 -3.56 1.43 -1.26 -4.99 118.68 112.32 2yqr s LEU 117 Ca 0.47 1.94 -0.29 0.00 -1.03 0.00 0.00 54.13 55.23 2yqr s LEU 117 Cb -0.37 -4.54 -0.10 0.00 0.03 0.00 0.00 46.19 41.21 2yqr s LEU 117 CO 0.48 -1.65 1.22 -2.16 0.23 0.00 0.00 176.35 174.48 2yqr s PRO 118 N -4.25 4.42 0.00 1.29 0.04 -1.26 -5.34 135.00 129.90 2yqr s PRO 118 Ca 0.65 2.04 0.13 0.00 0.04 0.00 0.00 61.00 63.86 2yqr s PRO 118 Cb -0.19 -3.07 0.76 0.00 0.04 0.00 0.00 34.50 32.03 2yqr s PRO 118 CO 0.44 -0.07 1.18 0.41 0.04 0.00 0.00 177.00 179.01