#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 -0.17 -0.15 1.61 0.15 -1.26 -5.18 113.70 108.70 2yqr s SER 2 Ca 0.00 0.17 -0.28 0.00 0.70 0.00 0.00 55.95 56.54 2yqr s SER 2 Cb 0.00 0.14 0.07 0.00 -1.71 0.00 0.00 66.02 64.52 2yqr s SER 2 CO 0.00 -0.16 0.71 -0.94 1.20 0.00 0.00 173.24 174.05 2yqr s SER 3 N -1.12 -0.69 -0.28 5.45 1.04 -1.26 -5.17 113.70 111.67 2yqr s SER 3 Ca 0.05 1.02 -0.22 0.00 0.48 0.00 0.00 55.95 57.28 2yqr s SER 3 Cb -0.01 0.93 0.11 0.00 0.10 0.00 0.00 66.02 67.15 2yqr s SER 3 CO -0.04 -0.44 0.89 -0.83 0.98 0.00 0.00 173.24 173.79 2yqr s GLY 4 N -0.51 -0.30 -0.09 7.32 0.00 -1.26 -5.16 107.32 107.32 2yqr s GLY 4 Ca -0.06 2.56 0.04 0.00 0.00 0.00 0.00 44.72 47.26 2yqr s GLY 4 CO 0.06 2.04 -0.23 -0.45 0.00 0.00 0.00 173.10 174.52 2yqr s SER 5 N 0.69 2.92 -0.06 1.64 0.15 -1.26 -5.11 113.70 112.66 2yqr s SER 5 Ca -0.02 -0.52 -0.02 0.00 0.70 0.00 0.00 55.95 56.09 2yqr s SER 5 Cb -0.05 -1.28 0.03 0.00 -1.71 0.00 0.00 66.02 63.01 2yqr s SER 5 CO -0.08 0.15 0.02 -0.94 1.20 0.00 0.00 173.24 173.59 2yqr s SER 6 N 0.33 1.47 0.00 5.45 1.04 -1.26 -5.12 113.70 115.61 2yqr s SER 6 Ca -0.17 -0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.22 2yqr s SER 6 Cb -0.17 -0.36 0.00 0.00 0.10 0.00 0.00 66.02 65.59 2yqr s SER 6 CO 0.08 -0.21 0.00 0.61 0.98 0.00 0.00 173.24 174.70 2yqr n GLY 7 N 5.19 0.27 3.75 7.32 0.00 -1.26 -5.12 105.19 115.35 2yqr n GLY 7 Ca -0.06 -1.48 -0.41 0.00 0.00 0.00 0.00 46.02 44.07 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 2.93 -0.24 -0.02 0.00 -1.26 -5.04 107.32 103.69 2yqr s GLY 8 Ca 0.00 0.96 -0.16 0.00 0.00 0.00 0.00 44.72 45.52 2yqr s GLY 8 CO 0.00 1.67 0.60 -0.29 0.00 0.00 0.00 173.10 175.08 2yqr s MET 9 N -1.06 0.64 0.40 2.90 -2.45 -1.26 -5.14 119.30 113.33 2yqr s MET 9 Ca 0.48 1.01 0.00 0.00 -1.25 0.00 0.00 55.69 55.93 2yqr s MET 9 Cb -0.33 0.17 0.00 0.00 1.25 0.00 0.00 34.83 35.92 2yqr s MET 9 CO 0.41 -0.13 0.00 1.58 1.05 0.00 0.00 175.02 177.93 2yqr n HIS 10 N 3.82 -3.72 -4.15 4.11 -0.00 -1.26 -4.90 115.22 109.11 2yqr n HIS 10 Ca -0.19 1.89 -0.26 0.00 -0.00 0.00 0.00 57.72 59.16 2yqr n HIS 10 Cb 0.57 -3.38 -0.07 0.00 -0.00 0.00 0.00 29.99 27.11 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 -2.64 2.99 -0.04 1.57 1.51 -1.26 -4.61 117.35 114.86 2yqr s TYR 11 Ca 0.00 -0.08 0.05 0.00 -1.01 0.00 0.00 57.07 56.03 2yqr s TYR 11 Cb 0.00 -1.43 -0.01 0.00 -0.11 0.00 0.00 41.96 40.41 2yqr s TYR 11 CO 0.00 0.52 -0.19 0.14 -1.11 0.00 0.00 175.55 174.91 2yqr s VAL 12 N -1.77 1.61 0.17 0.71 -7.23 0.20 -5.00 120.40 109.08 2yqr s VAL 12 Ca 0.29 -0.82 0.07 0.00 -1.81 0.00 0.00 61.98 59.71 2yqr s VAL 12 Cb -0.10 -1.37 -0.04 0.00 0.56 0.00 0.00 36.38 35.43 2yqr s VAL 12 CO 0.21 0.46 -0.16 -1.10 -0.31 0.00 0.00 175.10 174.20 2yqr s GLN 13 N -0.07 1.22 0.25 4.82 -0.21 -1.26 -1.55 119.66 122.87 2yqr s GLN 13 Ca -0.02 -1.43 0.02 0.00 0.02 0.00 0.00 55.36 53.95 2yqr s GLN 13 Cb -0.12 -1.13 -0.05 0.00 1.00 0.00 0.00 33.01 32.71 2yqr s GLN 13 CO 0.02 0.21 0.06 0.34 -2.12 0.00 0.00 175.29 173.80 2yqr s ASP 14 N -2.85 1.54 -0.20 5.90 -1.08 -0.85 -4.98 116.67 114.16 2yqr s ASP 14 Ca 0.16 -1.32 -0.04 0.00 -0.52 0.00 0.00 52.55 50.83 2yqr s ASP 14 Cb -0.04 0.08 0.10 0.00 -1.46 0.00 0.00 42.92 41.60 2yqr s ASP 14 CO 0.06 -0.64 0.26 -0.54 0.52 0.00 0.00 175.17 174.83 2yqr s LYS 15 N -3.96 0.22 -0.32 4.34 1.02 -1.26 -2.82 119.74 116.97 2yqr s LYS 15 Ca 0.34 0.40 -0.04 0.00 0.02 0.00 0.00 55.97 56.69 2yqr s LYS 15 Cb 0.07 -0.79 0.04 0.00 -0.52 0.00 0.00 37.83 36.64 2yqr s LYS 15 CO 0.12 -0.57 0.05 -0.51 -0.92 0.00 0.00 175.35 173.51 2yqr s LEU 16 N 2.40 4.08 -0.09 3.17 1.02 -0.20 -4.94 118.68 124.12 2yqr s LEU 16 Ca 0.07 -1.21 -0.29 0.00 0.02 0.00 0.00 54.13 52.72 2yqr s LEU 16 Cb -0.15 -1.78 -0.02 0.00 0.02 0.00 0.00 46.19 44.26 2yqr s LEU 16 CO -0.12 -0.29 0.98 -0.36 0.02 0.00 0.00 176.35 176.58 2yqr s PHE 17 N 1.32 3.53 0.12 0.29 0.40 -1.26 -0.24 117.98 122.14 2yqr s PHE 17 Ca -0.04 1.57 0.14 0.00 -0.60 0.00 0.00 56.93 58.00 2yqr s PHE 17 Cb -0.20 -3.15 0.35 0.00 0.51 0.00 0.00 43.02 40.53 2yqr s PHE 17 CO 0.01 -0.18 1.58 -0.39 0.70 0.00 0.00 175.22 176.93 2yqr h VAL 18 N 5.05 1.14 -6.07 -0.44 -1.51 -1.95 -3.48 116.25 108.98 2yqr h VAL 18 Ca -0.33 -2.09 -0.40 0.00 -1.23 0.00 0.00 66.70 62.66 2yqr h VAL 18 Cb 1.16 2.22 0.10 0.00 -2.13 0.00 0.00 31.29 32.64 2yqr h VAL 18 CO 0.83 0.54 -0.91 0.61 -1.23 0.00 0.00 177.57 177.41 2yqr n GLY 19 N 0.60 -0.94 1.01 5.19 0.00 -1.26 -4.92 105.19 104.87 2yqr n GLY 19 Ca 0.00 0.44 0.03 0.00 0.00 0.00 0.00 46.02 46.50 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 -4.01 0.88 0.25 0.99 7.94 -1.26 -4.84 117.00 116.95 2yqr n LEU 20 Ca -0.11 -1.88 0.10 0.00 -1.11 0.00 0.00 56.01 53.00 2yqr n LEU 20 Cb 0.61 -0.07 0.66 0.00 0.53 0.00 0.00 43.42 45.15 2yqr n LEU 20 CO 0.66 0.50 0.97 -0.33 -1.11 0.00 0.00 177.39 178.09 2yqr h GLU 21 N 0.61 0.00 0.00 1.96 5.08 -1.96 -1.53 114.58 118.74 2yqr h GLU 21 Ca -0.12 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.17 2yqr h GLU 21 Cb 1.61 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.85 2yqr h GLU 21 CO 0.05 0.12 -0.35 1.12 -1.00 0.00 0.00 179.01 178.96 2yqr h HIS 22 N 0.00 0.00 -2.76 4.33 2.07 -2.02 -3.45 115.15 113.33 2yqr h HIS 22 Ca -0.00 0.00 -0.59 0.00 -2.85 0.00 0.00 60.37 56.93 2yqr h HIS 22 Cb 0.26 0.00 0.11 0.00 2.57 0.00 0.00 27.41 30.36 2yqr h HIS 22 CO 0.00 0.35 0.22 0.00 -3.07 0.00 0.00 177.93 175.42 2yqr n ALA 23 N -2.31 0.18 -1.15 6.11 0.00 -0.58 -4.90 120.51 117.88 2yqr n ALA 23 Ca -0.01 0.36 -0.35 0.00 0.00 0.00 0.00 53.44 53.44 2yqr n ALA 23 Cb 0.47 -2.08 0.09 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 0.13 1.61 0.35 0.00 0.24 -1.26 -4.87 118.33 114.53 2yqr n VAL 24 Ca 0.08 -0.31 0.14 0.00 -2.04 0.00 0.00 64.34 62.21 2yqr n VAL 24 Cb 0.34 -0.86 0.58 0.00 -1.47 0.00 0.00 33.84 32.42 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 -0.71 0.00 0.02 7.34 0.13 -1.95 -2.81 132.00 134.02 2yqr h PRO 25 Ca -0.45 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.47 2yqr h PRO 25 Cb 1.32 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.43 2yqr h PRO 25 CO 0.42 0.00 -0.98 1.79 -0.23 0.00 0.00 178.00 179.00 2yqr h THR 26 N 0.00 1.65 -0.57 1.56 1.35 -2.02 -3.28 112.91 111.60 2yqr h THR 26 Ca 0.00 -3.20 -0.05 0.00 -0.55 0.00 0.00 66.41 62.61 2yqr h THR 26 Cb 0.41 2.77 -0.02 0.00 -1.73 0.00 0.00 68.15 69.57 2yqr h THR 26 CO 0.00 0.92 0.18 0.15 -0.25 0.00 0.00 175.52 176.51 2yqr h PHE 27 N 0.02 0.92 -5.73 4.73 3.57 -1.85 -3.48 116.94 115.13 2yqr h PHE 27 Ca -0.03 -0.09 -0.22 0.00 3.53 0.00 0.00 57.97 61.16 2yqr h PHE 27 Cb 1.71 -0.27 0.08 0.00 2.79 0.00 0.00 35.95 40.26 2yqr h PHE 27 CO 0.01 0.78 -0.58 0.09 -2.23 0.00 0.00 178.31 176.38 2yqr n ASN 28 N -4.42 -6.61 0.03 0.41 4.13 -1.24 -4.85 115.26 102.71 2yqr n ASN 28 Ca 0.03 -0.56 0.11 0.00 1.68 0.00 0.00 54.58 55.83 2yqr n ASN 28 Cb 0.21 -4.47 0.55 0.00 -1.54 0.00 0.00 39.78 34.52 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 -0.60 0.94 -0.78 2.41 3.04 -1.92 -1.69 116.25 117.65 2yqr h VAL 29 Ca -0.40 -0.09 0.05 0.00 -1.01 0.00 0.00 66.70 65.26 2yqr h VAL 29 Cb 1.21 0.65 -0.06 0.00 -2.01 0.00 0.00 31.29 31.08 2yqr h VAL 29 CO 0.39 0.05 0.47 0.50 -1.01 0.00 0.00 177.57 177.97 2yqr h LYS 30 N 0.27 0.85 0.00 4.17 3.64 -1.92 0.13 116.57 123.71 2yqr h LYS 30 Ca 0.18 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.46 2yqr h LYS 30 Cb 0.36 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2yqr h LYS 30 CO -0.04 0.56 -0.22 0.93 -2.27 0.00 0.00 179.45 178.41 2yqr h GLU 31 N 0.88 0.00 0.01 1.90 4.39 -1.65 -2.23 114.58 117.87 2yqr h GLU 31 Ca 0.34 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.04 2yqr h GLU 31 Cb 0.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 2yqr h GLU 31 CO -0.16 0.22 -0.00 0.87 -1.16 0.00 0.00 179.01 178.78 2yqr h LYS 32 N 0.00 -0.01 -0.95 2.33 1.79 -0.96 0.24 116.57 119.01 2yqr h LYS 32 Ca -0.00 0.00 0.04 0.00 -2.18 0.00 0.00 60.65 58.51 2yqr h LYS 32 Cb 0.65 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.24 2yqr h LYS 32 CO 0.03 0.80 0.62 -0.24 -1.08 0.00 0.00 179.45 179.57 2yqr h VAL 33 N -0.97 1.14 0.00 0.50 3.04 -0.82 -1.65 116.25 117.49 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 0.81 -0.13 0.00 0.00 -2.01 0.00 0.00 31.29 29.96 2yqr h VAL 33 CO 0.00 0.21 -0.78 -1.84 -1.01 0.00 0.00 177.57 174.16 2yqr n GLU 34 N -4.45 0.23 -1.41 4.17 0.28 -0.84 -4.04 120.64 114.57 2yqr n GLU 34 Ca 0.13 0.03 0.19 0.00 -0.16 0.00 0.00 57.16 57.35 2yqr n GLU 34 Cb 0.12 -1.61 -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 1.38 -2.02 3.72 -1.84 0.00 0.83 -3.11 105.19 104.16 2yqr n GLY 35 Ca 0.03 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.55 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 2.04 -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 3.16 -0.50 2.42 0.56 0.00 -1.26 -0.12 105.19 109.45 2yqr n GLY 37 Ca 0.10 0.03 -0.17 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 -0.42 0.19 0.00 0.02 -0.47 0.11 113.55 112.98 2yqr h SER 39 Ca -0.39 -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 63.83 2yqr h SER 39 CO 0.51 -0.21 -0.49 1.88 -1.14 0.00 0.00 176.83 177.38 2yqr h TYR 40 N -0.61 -1.40 -0.90 3.45 -1.99 -1.77 -0.62 116.97 113.13 2yqr h TYR 40 Ca -0.05 0.03 0.09 0.00 2.00 0.00 0.00 58.73 60.80 2yqr h TYR 40 Cb 0.45 0.59 -0.06 0.00 2.00 0.00 0.00 36.73 39.70 2yqr h TYR 40 CO -0.02 -0.57 0.58 -0.07 -0.00 0.00 0.00 178.16 178.07 2yqr h LEU 41 N -0.75 0.82 -0.59 3.88 4.07 -1.59 -1.67 115.31 119.48 2yqr h LEU 41 Ca -0.02 0.02 0.04 0.00 0.08 0.00 0.00 57.88 58.01 2yqr h LEU 41 Cb 0.73 -0.15 -0.05 0.00 1.08 0.00 0.00 40.66 42.27 2yqr h LEU 41 CO -0.22 0.49 0.33 1.56 -1.08 0.00 0.00 178.44 179.51 2yqr h GLN 42 N 0.91 0.61 0.18 1.13 1.08 0.11 -0.83 115.11 118.30 2yqr h GLN 42 Ca 0.41 -0.04 0.01 0.00 -1.45 0.00 0.00 58.65 57.58 2yqr h GLN 42 Cb 0.38 -0.14 -0.04 0.00 -0.05 0.00 0.00 27.48 27.63 2yqr h GLN 42 CO -0.17 0.40 -0.52 1.25 -0.95 0.00 0.00 178.83 178.84 2yqr h HIS 43 N 0.62 -1.48 0.00 2.96 2.76 -0.16 0.28 115.15 120.15 2yqr h HIS 43 Ca 0.25 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.45 2yqr h HIS 43 Cb 0.12 0.62 -0.00 0.00 1.55 0.00 0.00 27.41 29.70 2yqr h HIS 43 CO -0.08 -0.60 -0.03 0.82 -1.30 0.00 0.00 177.93 176.74 2yqr h ILE 44 N -0.79 0.52 0.00 6.26 2.04 -1.46 0.24 117.51 124.32 2yqr h ILE 44 Ca -0.01 -0.13 -0.12 0.00 1.00 0.00 0.00 64.86 65.60 2yqr h ILE 44 Cb 0.77 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 2yqr h ILE 44 CO -0.25 0.03 -0.59 1.56 0.00 0.00 0.00 178.15 178.90 2yqr h GLN 45 N 0.00 0.00 0.00 2.37 4.20 0.41 -2.49 115.11 119.59 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 0.08 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.83 2yqr h GLN 45 CO 0.00 0.59 -1.69 -0.89 -0.67 0.00 0.00 178.83 176.17 2yqr n ILE 46 N -3.35 0.95 0.12 2.54 5.41 0.84 -0.66 119.36 125.20 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 0.72 -0.51 -0.00 0.00 -0.71 0.00 0.00 39.64 39.14 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 -0.64 -3.35 114.58 115.35 2yqr h GLU 47 Ca -0.20 0.00 -0.05 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 30.20 2yqr h GLU 47 CO 0.03 0.57 -1.31 0.25 -1.16 0.00 0.00 179.01 177.39 2yqr n THR 48 N -3.23 0.17 -1.12 1.13 -2.24 -0.94 -5.02 114.28 103.04 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 0.77 -0.21 -0.02 0.00 -2.10 0.00 0.00 70.33 68.77 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 0.69 3.89 3.38 0.00 0.16 -4.86 105.19 110.86 2yqr n GLY 49 Ca -0.05 -0.76 -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 -2.12 3.77 -0.55 4.61 0.00 -1.20 -5.00 121.76 121.26 2yqr s ALA 50 Ca 0.00 -1.25 -0.27 0.00 0.00 0.00 0.00 51.96 50.44 2yqr s ALA 50 Cb 0.00 -1.54 0.03 0.00 0.00 0.00 0.00 23.12 21.61 2yqr s ALA 50 CO 0.00 0.34 1.10 0.15 0.00 0.00 0.00 175.76 177.35 2yqr s LYS 51 N -3.65 3.49 -0.22 0.00 1.02 -0.47 -4.54 119.74 115.37 2yqr s LYS 51 Ca 0.33 0.15 -0.05 0.00 0.02 0.00 0.00 55.97 56.42 2yqr s LYS 51 Cb -0.09 -4.00 -0.02 0.00 -0.52 0.00 0.00 37.83 33.20 2yqr s LYS 51 CO 0.27 -1.56 -0.02 0.08 -0.92 0.00 0.00 175.35 173.20 2yqr s VAL 52 N 4.54 3.67 -0.09 3.17 1.01 -1.26 -0.07 120.40 131.38 2yqr s VAL 52 Ca 0.40 -0.40 -0.04 0.00 0.00 0.00 0.00 61.98 61.94 2yqr s VAL 52 Cb -0.09 -2.67 0.04 0.00 0.00 0.00 0.00 36.38 33.66 2yqr s VAL 52 CO 0.25 0.41 0.20 0.72 0.00 0.00 0.00 175.10 176.68 2yqr s PHE 53 N 1.32 -0.25 0.26 5.22 -0.71 -0.40 -4.96 117.98 118.47 2yqr s PHE 53 Ca 0.04 0.63 -0.29 0.00 -1.04 0.00 0.00 56.93 56.27 2yqr s PHE 53 Cb -0.14 -0.01 -0.09 0.00 -1.21 0.00 0.00 43.02 41.57 2yqr s PHE 53 CO -0.00 -0.19 1.21 -1.17 -1.34 0.00 0.00 175.22 173.72 2yqr s LEU 54 N 1.13 4.47 0.18 -1.99 2.96 -1.26 -2.14 118.68 122.03 2yqr s LEU 54 Ca -0.08 2.40 -0.06 0.00 -0.22 0.00 0.00 54.13 56.17 2yqr s LEU 54 Cb -0.10 -3.63 -0.02 0.00 0.50 0.00 0.00 46.19 42.94 2yqr s LEU 54 CO -0.07 -0.36 0.24 -0.13 -1.32 0.00 0.00 176.35 174.71 2yqr s ARG 55 N -1.08 1.20 0.00 1.98 0.52 -0.44 -4.92 118.95 116.20 2yqr s ARG 55 Ca 0.49 -1.35 0.00 0.00 -0.52 0.00 0.00 55.73 54.35 2yqr s ARG 55 Cb -0.35 0.34 0.00 0.00 0.52 0.00 0.00 34.95 35.46 2yqr s ARG 55 CO 0.43 -0.42 0.00 0.41 0.02 0.00 0.00 175.30 175.74 2yqr n GLY 56 N -0.24 1.26 3.64 -3.53 0.00 -1.26 -0.41 105.19 104.65 2yqr n GLY 56 Ca -0.04 -2.01 -0.49 0.00 0.00 0.00 0.00 46.02 43.48 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 1.76 1.68 0.00 1.61 4.81 0.85 -0.66 118.16 128.21 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 -2.32 0.00 0.00 0.02 0.00 0.00 35.03 32.73 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 3.11 3.20 0.20 3.14 0.00 -1.26 -0.11 105.19 113.47 2yqr n GLY 58 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 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 0.16 0.00 1.61 4.64 -1.16 -3.47 113.55 115.33 2yqr h SER 59 Ca 0.00 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2yqr h SER 59 Cb 0.00 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 2yqr h SER 59 CO 0.00 0.49 0.00 0.61 -0.87 0.00 0.00 176.83 177.06 2yqr n GLY 60 N -0.43 1.56 3.26 -0.77 0.00 -1.26 -4.92 105.19 102.64 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 5.51 0.15 -4.60 0.00 1.08 -1.90 -3.35 117.51 114.39 2yqr h ILE 62 Ca -0.11 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.37 2yqr h ILE 62 Cb 1.05 0.96 -0.11 0.00 -3.07 0.00 0.00 36.82 35.66 2yqr h ILE 62 CO 0.86 0.00 -1.28 -0.62 -0.69 0.00 0.00 178.15 176.42 2yqr n GLU 63 N -3.28 -3.69 0.00 2.37 1.02 -1.26 -1.73 120.64 114.07 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 -4.29 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 0.10 -0.15 3.49 -0.04 -1.26 -0.01 135.00 138.46 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 32.46 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 2.59 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 -0.77 0.45 0.00 0.00 0.00 179.25 179.32 2yqr n SER 66 N -4.37 3.44 0.00 0.00 2.88 -1.16 -5.04 113.62 109.36 2yqr n SER 66 Ca -0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 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 2.78 1.32 3.37 0.46 0.00 0.98 -5.10 105.19 108.99 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 1.58 1.12 1.61 0.52 -0.71 -4.77 118.95 118.18 2yqr s ARG 68 Ca 0.00 -1.23 -0.18 0.00 -0.52 0.00 0.00 55.73 53.80 2yqr s ARG 68 Cb 0.00 -1.92 0.11 0.00 0.52 0.00 0.00 34.95 33.66 2yqr s ARG 68 CO 0.00 0.48 0.06 0.39 0.02 0.00 0.00 175.30 176.25 2yqr n GLU 69 N 1.33 -1.64 -0.87 3.54 4.71 -1.17 -4.37 120.64 122.17 2yqr n GLU 69 Ca -0.17 -0.46 -0.31 0.00 -0.01 0.00 0.00 57.16 56.21 2yqr n GLU 69 Cb 0.52 -1.73 0.14 0.00 -1.01 0.00 0.00 31.44 29.37 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 -2.25 1.72 0.19 0.62 0.00 -1.26 -4.89 121.76 115.89 2yqr s ALA 70 Ca 0.57 0.50 0.01 0.00 0.00 0.00 0.00 51.96 53.03 2yqr s ALA 70 Cb -0.13 -3.40 0.09 0.00 0.00 0.00 0.00 23.12 19.69 2yqr s ALA 70 CO 0.66 -2.46 1.45 0.35 0.00 0.00 0.00 175.76 175.77 2yqr h PHE 71 N -1.64 0.45 -3.59 0.00 3.04 -1.97 -3.33 116.94 109.89 2yqr h PHE 71 Ca -0.43 -0.20 -0.48 0.00 3.98 0.00 0.00 57.97 60.83 2yqr h PHE 71 Cb 1.26 -0.07 0.04 0.00 2.56 0.00 0.00 35.95 39.74 2yqr h PHE 71 CO 0.53 0.94 0.14 -1.21 -2.02 0.00 0.00 178.31 176.69 2yqr s GLU 72 N -3.58 3.30 1.09 1.11 2.02 -1.26 -4.89 118.70 116.48 2yqr s GLU 72 Ca -0.05 0.11 -0.15 0.00 0.02 0.00 0.00 54.97 54.91 2yqr s GLU 72 Cb 0.11 -2.33 0.23 0.00 0.10 0.00 0.00 34.13 32.23 2yqr s GLU 72 CO 0.83 -0.40 1.10 -1.25 0.02 0.00 0.00 175.26 175.56 2yqr s PRO 73 N -4.84 -0.29 0.72 0.39 0.04 -1.26 -0.10 135.00 129.65 2yqr s PRO 73 Ca 0.50 0.27 -0.16 0.00 0.04 0.00 0.00 61.00 61.65 2yqr s PRO 73 Cb -0.10 -1.68 0.03 0.00 0.04 0.00 0.00 34.50 32.79 2yqr s PRO 73 CO 0.45 -3.16 1.26 0.00 0.04 0.00 0.00 177.00 175.59 2yqr s MET 74 N -5.13 2.15 0.03 4.56 0.23 0.84 -3.91 119.30 118.07 2yqr s MET 74 Ca 0.68 1.94 -0.28 0.00 -1.03 0.00 0.00 55.69 57.00 2yqr s MET 74 Cb -0.15 -1.81 0.10 0.00 -1.53 0.00 0.00 34.83 31.43 2yqr s MET 74 CO 0.57 -1.87 0.82 1.52 -2.03 0.00 0.00 175.02 174.03 2yqr s TYR 75 N -1.71 -0.40 -0.01 3.16 -0.85 0.45 -3.84 117.35 114.16 2yqr s TYR 75 Ca 0.79 0.27 -0.24 0.00 -0.52 0.00 0.00 57.07 57.37 2yqr s TYR 75 Cb -0.34 0.54 -0.05 0.00 0.38 0.00 0.00 41.96 42.49 2yqr s TYR 75 CO 0.44 -0.61 0.73 0.42 -1.52 0.00 0.00 175.55 175.02 2yqr s ILE 76 N -3.17 4.88 -0.21 -3.49 1.01 0.67 -1.33 121.20 119.57 2yqr s ILE 76 Ca 0.04 1.53 0.01 0.00 0.00 0.00 0.00 60.65 62.23 2yqr s ILE 76 Cb -0.01 -4.07 0.03 0.00 0.01 0.00 0.00 42.46 38.42 2yqr s ILE 76 CO -0.09 0.32 -0.16 -0.47 0.00 0.00 0.00 174.94 174.54 2yqr s TYR 77 N 0.31 2.95 -0.06 3.97 6.14 -0.91 -1.03 117.35 128.72 2yqr s TYR 77 Ca 0.38 -1.82 -0.02 0.00 0.64 0.00 0.00 57.07 56.25 2yqr s TYR 77 Cb -0.19 -1.94 -0.04 0.00 0.42 0.00 0.00 41.96 40.21 2yqr s TYR 77 CO 0.21 -0.82 0.06 0.42 0.64 0.00 0.00 175.55 176.06 2yqr s ILE 78 N 1.24 4.70 -0.22 3.14 1.01 -1.13 -1.27 121.20 128.68 2yqr s ILE 78 Ca 0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 60.65 60.40 2yqr s ILE 78 Cb -0.15 -3.07 0.07 0.00 0.01 0.00 0.00 42.46 39.31 2yqr s ILE 78 CO -0.10 0.49 0.02 -0.94 0.00 0.00 0.00 174.94 174.42 2yqr s SER 79 N -1.29 3.30 -0.02 3.58 1.04 0.91 -2.01 113.70 119.20 2yqr s SER 79 Ca 0.18 -1.02 0.03 0.00 0.48 0.00 0.00 55.95 55.61 2yqr s SER 79 Cb -0.12 -0.77 -0.00 0.00 0.10 0.00 0.00 66.02 65.23 2yqr s SER 79 CO 0.08 -0.31 -0.10 -2.28 0.98 0.00 0.00 173.24 171.61 2yqr s HIS 80 N 1.71 1.04 -1.04 5.02 5.04 -0.59 -1.37 115.29 125.10 2yqr s HIS 80 Ca -0.01 -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 -0.10 -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 -0.63 135.00 135.03 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 0.64 0.32 0.54 1.02 -1.26 -4.50 119.74 113.54 2yqr s LYS 82 Ca 0.07 -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 37.65 2yqr s LYS 82 CO 0.25 0.03 1.72 -1.00 -0.92 0.00 0.00 175.35 175.43 2yqr h PRO 83 N 3.97 0.05 0.13 -1.68 0.13 -1.93 -2.80 132.00 129.87 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 -0.52 -0.51 0.86 4.81 -1.97 0.54 114.58 117.82 2yqr h GLU 84 Ca -0.00 0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.20 2yqr h GLU 84 Cb 0.86 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.34 2yqr h GLU 84 CO 0.06 -0.35 0.05 0.78 -0.73 0.00 0.00 179.01 178.83 2yqr h GLY 85 N -0.54 0.94 0.27 1.92 0.00 -1.89 -2.66 103.07 101.10 2yqr h GLY 85 Ca -0.01 -0.65 0.15 0.00 0.00 0.00 0.00 47.33 46.82 2yqr h GLY 85 CO -0.16 0.60 0.54 -2.00 0.00 0.00 0.00 176.54 175.52 2yqr h LEU 86 N 0.74 0.72 -0.84 3.11 7.12 -1.31 0.34 115.31 125.19 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 0.45 -0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 40.52 2yqr h LEU 86 CO 0.02 0.31 -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 -0.72 -2.94 119.26 119.38 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 0.68 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 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 -0.96 0.00 0.00 -0.16 -3.14 119.26 116.73 2yqr h ALA 88 Ca -0.00 -0.18 0.20 0.00 0.00 0.00 0.00 54.91 54.93 2yqr h ALA 88 Cb 0.89 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.60 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 -0.64 1.98 -0.19 0.00 0.00 -0.63 0.26 119.26 120.04 2yqr h ALA 89 Ca -0.00 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 2yqr h ALA 89 Cb 0.36 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2yqr h ALA 89 CO -0.00 -0.31 -0.26 -0.22 0.00 0.00 0.00 179.25 178.46 2yqr h LYS 90 N 0.57 0.36 -0.25 0.00 3.64 -1.64 -1.76 116.57 117.50 2yqr h LYS 90 Ca 0.52 -0.13 -0.18 0.00 -1.27 0.00 0.00 60.65 59.59 2yqr h LYS 90 Cb 1.07 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.86 2yqr h LYS 90 CO -0.27 0.61 -0.56 0.87 -2.27 0.00 0.00 179.45 177.83 2yqr h LYS 91 N 0.32 0.76 -0.27 1.90 1.79 -0.46 -2.95 116.57 117.67 2yqr h LYS 91 Ca 0.05 -0.49 -0.14 0.00 -2.18 0.00 0.00 60.65 57.89 2yqr h LYS 91 Cb 0.64 0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.34 2yqr h LYS 91 CO 0.05 1.12 -0.39 -0.07 -1.08 0.00 0.00 179.45 179.07 2yqr h LEU 92 N 0.58 0.67 -0.82 2.94 3.38 -1.09 -2.96 115.31 118.01 2yqr h LEU 92 Ca 0.01 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 2yqr h LEU 92 Cb 1.15 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.67 2yqr h LEU 92 CO 0.12 0.98 0.46 0.00 0.09 0.00 0.00 178.44 180.09 2yqr h GLU 94 N 1.14 0.55 -0.00 0.00 4.39 -1.42 -1.21 114.58 118.02 2yqr h GLU 94 Ca 0.29 -0.14 -0.18 0.00 0.34 0.00 0.00 59.36 59.68 2yqr h GLU 94 Cb 0.02 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 2yqr h GLU 94 CO -0.05 0.61 -0.81 -0.97 -1.16 0.00 0.00 179.01 176.63 2yqr h ASN 95 N 0.52 0.13 0.17 1.42 -1.24 -1.25 -3.10 115.58 112.24 2yqr h ASN 95 Ca 0.11 -0.10 -0.19 0.00 0.71 0.00 0.00 56.30 56.82 2yqr h ASN 95 Cb 0.40 -0.04 -0.00 0.00 0.73 0.00 0.00 38.32 39.41 2yqr h ASN 95 CO 0.02 0.88 -0.75 0.25 -1.29 0.00 0.00 177.43 176.55 2yqr h LEU 96 N 0.06 0.58 -0.62 0.34 6.46 -0.68 -3.22 115.31 118.24 2yqr h LEU 96 Ca -0.02 -0.39 -0.03 0.00 -0.12 0.00 0.00 57.88 57.32 2yqr h LEU 96 Cb 1.41 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 41.14 2yqr h LEU 96 CO 0.12 1.14 0.25 -0.07 -0.62 0.00 0.00 178.44 179.26 2yqr h LEU 97 N 0.33 0.85 -2.00 2.25 3.38 -1.24 -2.25 115.31 116.63 2yqr h LEU 97 Ca -0.04 -0.17 0.16 0.00 0.09 0.00 0.00 57.88 57.93 2yqr h LEU 97 Cb 1.34 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.84 2yqr h LEU 97 CO 0.13 0.78 0.40 1.56 0.09 0.00 0.00 178.44 181.41 2yqr h GLN 98 N 0.86 0.00 0.36 1.13 1.08 -1.55 0.18 115.11 117.18 2yqr h GLN 98 Ca 0.21 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.39 2yqr h GLN 98 Cb 0.20 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.63 2yqr h GLN 98 CO -0.02 0.00 -0.17 1.15 -0.95 0.00 0.00 178.83 178.84 2yqr h THR 99 N 0.00 0.14 -0.05 -0.54 2.02 -1.48 -2.94 112.91 110.06 2yqr h THR 99 Ca 0.26 -0.68 -0.00 0.00 0.77 0.00 0.00 66.41 66.76 2yqr h THR 99 Cb 1.06 0.23 -0.00 0.00 -1.74 0.00 0.00 68.15 67.69 2yqr h THR 99 CO -0.00 0.03 0.03 1.62 0.37 0.00 0.00 175.52 177.57 2yqr h VAL 100 N -1.10 1.02 0.00 3.16 3.04 -1.31 -1.00 116.25 120.07 2yqr h VAL 100 Ca -0.05 -0.05 -0.07 0.00 -1.01 0.00 0.00 66.70 65.52 2yqr h VAL 100 Cb 0.43 0.95 -0.01 0.00 -2.01 0.00 0.00 31.29 30.65 2yqr h VAL 100 CO 0.08 0.02 -0.31 0.45 -1.01 0.00 0.00 177.57 176.80 2yqr h HIS 101 N 0.07 0.00 -0.00 3.17 -0.00 -0.70 -2.48 115.15 115.21 2yqr h HIS 101 Ca 0.02 0.00 -0.16 0.00 -0.00 0.00 0.00 60.37 60.23 2yqr h HIS 101 Cb 0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.39 2yqr h HIS 101 CO 0.00 0.31 -0.76 0.00 -0.00 0.00 0.00 177.93 177.48 2yqr h ALA 102 N 1.69 0.74 -0.41 2.45 0.00 -0.99 -3.16 119.26 119.59 2yqr h ALA 102 Ca -0.00 -0.69 -0.10 0.00 0.00 0.00 0.00 54.91 54.11 2yqr h ALA 102 Cb 0.55 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2yqr h ALA 102 CO 0.04 0.95 -0.15 0.93 0.00 0.00 0.00 179.25 181.02 2yqr h GLU 103 N 0.00 0.82 -0.22 0.00 4.39 -1.28 -3.10 114.58 115.19 2yqr h GLU 103 Ca -0.01 -0.34 0.00 0.00 0.34 0.00 0.00 59.36 59.35 2yqr h GLU 103 Cb 1.35 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.96 2yqr h GLU 103 CO 0.10 0.97 0.14 -0.92 -1.16 0.00 0.00 179.01 178.14 2yqr h TYR 104 N 0.63 0.27 -0.56 4.33 3.20 -1.54 0.19 116.97 123.50 2yqr h TYR 104 Ca 0.10 0.01 0.16 0.00 3.14 0.00 0.00 58.73 62.13 2yqr h TYR 104 Cb 0.70 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.86 2yqr h TYR 104 CO 0.05 0.18 0.42 1.03 -1.64 0.00 0.00 178.16 178.20 2yqr h SER 105 N 0.29 0.00 0.48 -2.11 0.87 -1.52 0.23 113.55 111.79 2yqr h SER 105 Ca 0.08 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.34 2yqr h SER 105 Cb -0.03 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 61.89 2yqr h SER 105 CO -0.02 0.00 -1.69 0.03 -0.53 0.00 0.00 176.83 174.63 2yqr h ARG 106 N 0.00 0.04 0.28 2.24 3.08 -1.27 -3.24 114.38 115.51 2yqr h ARG 106 Ca 0.27 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 2yqr h ARG 106 Cb 1.11 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.19 2yqr h ARG 106 CO -0.00 0.64 -0.13 0.35 -1.07 0.00 0.00 179.97 179.75 2yqr h PHE 107 N 0.01 -0.35 -0.06 3.04 3.04 0.14 -3.19 116.94 119.58 2yqr h PHE 107 Ca -0.28 -0.01 0.02 0.00 3.98 0.00 0.00 57.97 61.68 2yqr h PHE 107 Cb 2.00 0.12 -0.00 0.00 2.56 0.00 0.00 35.95 40.62 2yqr h PHE 107 CO 0.01 -0.01 0.06 -0.24 -2.02 0.00 0.00 178.31 176.11 2yqr h VAL 108 N -0.95 0.57 -0.06 1.41 3.04 -0.85 -0.66 116.25 118.76 2yqr h VAL 108 Ca -0.04 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.60 2yqr h VAL 108 Cb 0.49 0.95 -0.01 0.00 -2.01 0.00 0.00 31.29 30.72 2yqr h VAL 108 CO 0.06 0.00 -0.20 0.78 -1.01 0.00 0.00 177.57 177.20 2yqr h ASN 109 N 0.00 0.10 0.98 3.17 2.35 -1.57 -2.20 115.58 118.41 2yqr h ASN 109 Ca 0.03 -0.02 -0.13 0.00 -0.55 0.00 0.00 56.30 55.63 2yqr h ASN 109 Cb 0.15 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.48 2yqr h ASN 109 CO -0.00 0.31 -0.60 1.56 -1.65 0.00 0.00 177.43 177.05 2yqr h GLN 110 N 0.10 0.00 -6.17 0.81 1.08 -1.12 -3.42 115.11 106.39 2yqr h GLN 110 Ca 0.02 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 56.69 2yqr h GLN 110 Cb 0.42 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.80 2yqr h GLN 110 CO 0.03 0.60 1.25 0.42 -0.95 0.00 0.00 178.83 180.18 2yqr s ILE 111 N -3.25 3.52 -0.37 2.54 1.01 -0.83 -4.96 121.20 118.86 2yqr s ILE 111 Ca 0.01 0.39 -0.08 0.00 0.00 0.00 0.00 60.65 60.97 2yqr s ILE 111 Cb 0.10 -4.08 0.05 0.00 0.01 0.00 0.00 42.46 38.54 2yqr s ILE 111 CO 0.75 -0.95 0.17 0.20 0.00 0.00 0.00 174.94 175.10 2yqr s ASN 112 N 6.49 5.47 -0.14 3.58 0.01 -1.26 -5.01 114.94 124.08 2yqr s ASN 112 Ca 0.63 -1.27 -0.04 0.00 -0.71 0.00 0.00 52.86 51.47 2yqr s ASN 112 Cb -0.13 -1.93 -0.03 0.00 0.41 0.00 0.00 41.25 39.57 2yqr s ASN 112 CO 0.24 -0.41 0.01 0.42 -1.51 0.00 0.00 177.10 175.85 2yqr s THR 113 N 1.42 4.36 -0.42 1.60 -4.23 -1.26 -5.08 115.64 112.03 2yqr s THR 113 Ca 0.01 -0.20 -0.05 0.00 -1.18 0.00 0.00 61.69 60.26 2yqr s THR 113 Cb -0.21 -2.90 0.11 0.00 1.34 0.00 0.00 72.50 70.84 2yqr s THR 113 CO 0.03 0.53 0.24 0.00 -0.54 0.00 0.00 174.62 174.88 2yqr s ALA 114 N -0.11 3.23 -0.34 3.99 0.00 -1.26 -5.04 121.76 122.22 2yqr s ALA 114 Ca 0.05 -2.47 0.02 0.00 0.00 0.00 0.00 51.96 49.55 2yqr s ALA 114 Cb -0.13 -2.54 0.10 0.00 0.00 0.00 0.00 23.12 20.55 2yqr s ALA 114 CO 0.02 -1.80 0.06 0.08 0.00 0.00 0.00 175.76 174.12 2yqr s VAL 115 N 1.24 2.52 0.17 0.00 1.01 -1.26 -5.11 120.40 118.96 2yqr s VAL 115 Ca 0.06 -2.16 -0.03 0.00 0.00 0.00 0.00 61.98 59.86 2yqr s VAL 115 Cb -0.24 -2.77 0.04 0.00 0.00 0.00 0.00 36.38 33.42 2yqr s VAL 115 CO -0.03 -0.53 0.15 -0.81 0.00 0.00 0.00 175.10 173.89 2yqr n PRO 116 N 4.36 -1.32 -4.41 2.72 -0.04 -1.26 -5.08 135.00 129.97 2yqr n PRO 116 Ca -0.00 -0.24 -0.26 0.00 -0.04 0.00 0.00 63.50 62.96 2yqr n PRO 116 Cb 0.42 -0.23 -0.11 0.00 -0.04 0.00 0.00 33.50 33.55 2yqr n PRO 116 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2yqr s LEU 117 N 0.00 2.60 -0.33 1.53 1.43 -1.26 -5.09 118.68 117.56 2yqr s LEU 117 Ca 0.10 -0.86 -0.29 0.00 -1.03 0.00 0.00 54.13 52.05 2yqr s LEU 117 Cb -0.01 -1.25 -0.01 0.00 0.03 0.00 0.00 46.19 44.95 2yqr s LEU 117 CO 0.08 0.09 1.68 -2.16 0.23 0.00 0.00 176.35 176.27 2yqr s PRO 118 N -2.98 3.46 0.00 1.29 0.04 -1.26 -5.36 135.00 130.19 2yqr s PRO 118 Ca 0.24 1.35 0.29 0.00 0.04 0.00 0.00 61.00 62.92 2yqr s PRO 118 Cb -0.07 -4.13 1.21 0.00 0.04 0.00 0.00 34.50 31.54 2yqr s PRO 118 CO 0.13 -1.71 1.84 0.41 0.04 0.00 0.00 177.00 177.70