#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yqr h SER 2 N 0.00 0.34 -2.94 1.61 4.64 -2.14 -3.41 113.55 111.65 2yqr h SER 2 Ca 0.00 -0.40 -0.57 0.00 -0.47 0.00 0.00 61.79 60.35 2yqr h SER 2 Cb 0.00 -0.09 -0.04 0.00 -0.31 0.00 0.00 62.40 61.96 2yqr h SER 2 CO 0.00 0.67 1.11 -0.44 -0.87 0.00 0.00 176.83 177.30 2yqr s SER 3 N -5.98 6.33 0.77 4.97 0.01 -1.26 -5.00 113.70 113.54 2yqr s SER 3 Ca -0.14 1.28 -0.02 0.00 1.31 0.00 0.00 55.95 58.38 2yqr s SER 3 Cb 0.06 -2.53 0.15 0.00 0.21 0.00 0.00 66.02 63.90 2yqr s SER 3 CO 0.74 -1.36 1.01 0.61 0.41 0.00 0.00 173.24 174.65 2yqr n GLY 4 N 4.85 0.34 3.01 3.44 0.00 -1.26 -5.07 105.19 110.50 2yqr n GLY 4 Ca 0.18 -1.98 -0.32 0.00 0.00 0.00 0.00 46.02 43.90 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 -5.03 4.68 -0.03 1.61 0.01 -1.26 -5.08 113.70 108.60 2yqr s SER 5 Ca 0.65 -2.58 -0.30 0.00 1.31 0.00 0.00 55.95 55.03 2yqr s SER 5 Cb -0.03 -1.68 -0.04 0.00 0.21 0.00 0.00 66.02 64.47 2yqr s SER 5 CO 0.44 -0.33 1.29 -0.94 0.41 0.00 0.00 173.24 174.11 2yqr s SER 6 N 0.48 6.96 0.64 2.44 1.04 -1.26 -5.03 113.70 118.97 2yqr s SER 6 Ca 0.14 1.95 -0.01 0.00 0.48 0.00 0.00 55.95 58.51 2yqr s SER 6 Cb -0.22 -2.56 0.04 0.00 0.10 0.00 0.00 66.02 63.37 2yqr s SER 6 CO -0.04 -0.65 0.23 0.61 0.98 0.00 0.00 173.24 174.38 2yqr n GLY 7 N 3.49 0.09 3.07 7.32 0.00 -1.26 -5.11 105.19 112.79 2yqr n GLY 7 Ca 0.12 -1.87 -0.21 0.00 0.00 0.00 0.00 46.02 44.05 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 -3.18 0.61 -0.10 -0.02 0.00 -1.26 -5.04 107.32 98.33 2yqr s GLY 8 Ca 0.15 -0.52 -0.04 0.00 0.00 0.00 0.00 44.72 44.30 2yqr s GLY 8 CO 0.10 -0.41 -0.13 1.03 0.00 0.00 0.00 173.10 173.70 2yqr n MET 9 N 2.84 0.22 -1.45 2.90 0.00 -1.26 -5.00 117.12 115.37 2yqr n MET 9 Ca -0.15 0.09 -0.33 0.00 0.00 0.00 0.00 57.70 57.32 2yqr n MET 9 Cb 0.55 -0.91 0.08 0.00 0.00 0.00 0.00 33.22 32.94 2yqr n MET 9 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 175.97 172.59 2yqr s HIS 10 N -2.19 2.30 0.17 2.03 0.00 -1.26 -5.03 115.29 111.30 2yqr s HIS 10 Ca -0.14 1.60 0.02 0.00 -3.00 0.00 0.00 55.06 53.53 2yqr s HIS 10 Cb 0.05 -3.28 -0.04 0.00 -4.00 0.00 0.00 32.58 25.32 2yqr s HIS 10 CO 0.19 -2.16 0.31 0.71 -1.00 0.00 0.00 174.74 172.79 2yqr s TYR 11 N -2.32 3.48 -0.04 0.38 1.51 -1.26 -4.62 117.35 114.48 2yqr s TYR 11 Ca 0.69 0.16 0.05 0.00 -1.01 0.00 0.00 57.07 56.96 2yqr s TYR 11 Cb -0.23 -1.71 -0.01 0.00 -0.11 0.00 0.00 41.96 39.90 2yqr s TYR 11 CO 0.47 0.48 -0.20 0.14 -1.11 0.00 0.00 175.55 175.33 2yqr s VAL 12 N -1.79 1.62 0.21 0.71 -7.23 0.33 -5.00 120.40 109.25 2yqr s VAL 12 Ca 0.35 -0.83 0.09 0.00 -1.81 0.00 0.00 61.98 59.77 2yqr s VAL 12 Cb -0.11 -1.38 -0.05 0.00 0.56 0.00 0.00 36.38 35.41 2yqr s VAL 12 CO 0.29 0.46 -0.16 0.00 -0.31 0.00 0.00 175.10 175.38 2yqr s GLN 13 N -0.12 1.38 0.24 4.82 -2.07 -1.26 -1.46 119.66 121.20 2yqr s GLN 13 Ca -0.01 -1.59 0.02 0.00 -1.82 0.00 0.00 55.36 51.95 2yqr s GLN 13 Cb -0.11 -1.25 -0.05 0.00 -1.09 0.00 0.00 33.01 30.50 2yqr s GLN 13 CO 0.02 0.22 0.06 0.34 -1.32 0.00 0.00 175.29 174.61 2yqr s ASP 14 N -3.25 1.41 -0.20 12.60 -1.08 -0.80 -4.97 116.67 120.37 2yqr s ASP 14 Ca 0.23 -1.31 -0.04 0.00 -0.52 0.00 0.00 52.55 50.91 2yqr s ASP 14 Cb -0.02 0.11 0.10 0.00 -1.46 0.00 0.00 42.92 41.65 2yqr s ASP 14 CO 0.08 -0.65 0.29 -0.54 0.52 0.00 0.00 175.17 174.87 2yqr s LYS 15 N -3.97 0.24 -0.33 4.34 1.02 -1.26 -2.92 119.74 116.86 2yqr s LYS 15 Ca 0.33 0.44 -0.02 0.00 0.02 0.00 0.00 55.97 56.74 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 0.11 -0.57 0.06 -0.51 -0.92 0.00 0.00 175.35 173.52 2yqr s LEU 16 N 2.43 4.34 -0.16 3.17 1.02 -0.32 -4.94 118.68 124.22 2yqr s LEU 16 Ca 0.08 -1.53 -0.29 0.00 0.02 0.00 0.00 54.13 52.41 2yqr s LEU 16 Cb -0.15 -1.75 -0.01 0.00 0.02 0.00 0.00 46.19 44.31 2yqr s LEU 16 CO -0.13 -0.35 1.12 -0.36 0.02 0.00 0.00 176.35 176.65 2yqr s PHE 17 N 1.21 3.22 0.29 0.29 0.40 -1.26 -0.31 117.98 121.83 2yqr s PHE 17 Ca -0.00 1.34 0.24 0.00 -0.60 0.00 0.00 56.93 57.90 2yqr s PHE 17 Cb -0.21 -3.34 1.11 0.00 0.51 0.00 0.00 43.02 41.10 2yqr s PHE 17 CO -0.02 -0.87 1.93 -0.39 0.70 0.00 0.00 175.22 176.56 2yqr h VAL 18 N 5.32 0.67 -6.12 -0.44 -1.51 -1.94 -3.47 116.25 108.76 2yqr h VAL 18 Ca -0.26 -0.92 -0.42 0.00 -1.23 0.00 0.00 66.70 63.87 2yqr h VAL 18 Cb 1.10 1.58 0.05 0.00 -2.13 0.00 0.00 31.29 31.89 2yqr h VAL 18 CO 0.94 0.21 -0.84 0.61 -1.23 0.00 0.00 177.57 177.25 2yqr n GLY 19 N -0.29 -0.31 0.84 5.19 0.00 -1.26 -4.90 105.19 104.46 2yqr n GLY 19 Ca -0.01 0.14 0.04 0.00 0.00 0.00 0.00 46.02 46.19 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 -4.27 1.33 0.26 0.99 7.94 -1.26 -4.81 117.00 117.18 2yqr n LEU 20 Ca -0.29 -2.33 0.11 0.00 -1.11 0.00 0.00 56.01 52.38 2yqr n LEU 20 Cb 0.68 -0.18 0.70 0.00 0.53 0.00 0.00 43.42 45.15 2yqr n LEU 20 CO 0.69 0.67 0.98 1.05 -1.11 0.00 0.00 177.39 179.67 2yqr h GLU 21 N 0.61 0.00 0.00 1.96 4.11 -1.95 -1.56 114.58 117.75 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 1.45 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.68 2yqr h GLU 21 CO 0.04 0.12 -0.42 1.12 0.07 0.00 0.00 179.01 179.94 2yqr h HIS 22 N 0.00 0.00 -2.42 2.06 2.07 -2.01 -3.45 115.15 111.40 2yqr h HIS 22 Ca -0.00 0.00 -0.61 0.00 -2.85 0.00 0.00 60.37 56.91 2yqr h HIS 22 Cb 0.28 0.00 0.09 0.00 2.57 0.00 0.00 27.41 30.35 2yqr h HIS 22 CO 0.00 0.42 0.40 0.00 -3.07 0.00 0.00 177.93 175.68 2yqr n ALA 23 N -2.29 0.22 -1.13 6.11 0.00 -0.59 -4.89 120.51 117.94 2yqr n ALA 23 Ca 0.00 0.42 -0.35 0.00 0.00 0.00 0.00 53.44 53.51 2yqr n ALA 23 Cb 0.56 -2.14 0.09 0.00 0.00 0.00 0.00 19.45 17.95 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 1.38 1.40 0.35 0.00 0.24 -1.26 -4.87 118.33 115.57 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 -0.76 0.58 0.00 -1.47 0.00 0.00 33.84 32.48 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 -0.03 7.34 0.13 -1.95 -2.88 132.00 133.90 2yqr h PRO 25 Ca -0.45 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.49 2yqr h PRO 25 Cb 1.33 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.45 2yqr h PRO 25 CO 0.41 0.00 -0.79 1.79 -0.23 0.00 0.00 178.00 179.18 2yqr h THR 26 N 0.00 1.43 -0.58 1.56 1.35 -2.02 -3.21 112.91 111.44 2yqr h THR 26 Ca 0.00 -2.34 -0.11 0.00 -0.55 0.00 0.00 66.41 63.41 2yqr h THR 26 Cb 0.41 2.27 -0.02 0.00 -1.73 0.00 0.00 68.15 69.08 2yqr h THR 26 CO 0.00 0.69 -0.05 0.15 -0.25 0.00 0.00 175.52 176.06 2yqr h PHE 27 N 0.17 1.17 -5.84 4.73 3.57 -1.86 -3.48 116.94 115.41 2yqr h PHE 27 Ca -0.04 -0.22 -0.20 0.00 3.53 0.00 0.00 57.97 61.04 2yqr h PHE 27 Cb 1.37 -0.30 0.03 0.00 2.79 0.00 0.00 35.95 39.85 2yqr h PHE 27 CO 0.03 1.05 -0.48 0.09 -2.23 0.00 0.00 178.31 176.78 2yqr n ASN 28 N -4.16 -6.63 0.05 0.41 4.13 -1.22 -4.86 115.26 102.99 2yqr n ASN 28 Ca 0.02 -0.48 0.05 0.00 1.68 0.00 0.00 54.58 55.85 2yqr n ASN 28 Cb 0.38 -4.14 0.48 0.00 -1.54 0.00 0.00 39.78 34.95 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 -0.19 1.07 -0.64 2.41 3.04 -1.91 -2.31 116.25 117.71 2yqr h VAL 29 Ca -0.30 -0.15 0.09 0.00 -1.01 0.00 0.00 66.70 65.33 2yqr h VAL 29 Cb 1.18 0.60 -0.07 0.00 -2.01 0.00 0.00 31.29 30.99 2yqr h VAL 29 CO 0.35 0.08 0.27 0.50 -1.01 0.00 0.00 177.57 177.76 2yqr h LYS 30 N 0.43 0.46 0.00 4.17 3.64 -1.91 0.25 116.57 123.60 2yqr h LYS 30 Ca 0.13 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 2yqr h LYS 30 Cb -0.01 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 2yqr h LYS 30 CO -0.03 0.30 -0.18 0.93 -2.27 0.00 0.00 179.45 178.21 2yqr h GLU 31 N 0.47 0.00 0.01 1.90 4.39 -1.76 -2.01 114.58 117.57 2yqr h GLU 31 Ca 0.32 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.02 2yqr h GLU 31 Cb 0.38 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.03 2yqr h GLU 31 CO -0.29 0.18 -0.00 0.87 -1.16 0.00 0.00 179.01 178.60 2yqr h LYS 32 N 0.00 -0.01 -0.95 2.33 1.79 -0.72 0.24 116.57 119.24 2yqr h LYS 32 Ca -0.00 0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.52 2yqr h LYS 32 Cb 0.54 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.13 2yqr h LYS 32 CO 0.02 0.69 0.62 -0.24 -1.08 0.00 0.00 179.45 179.47 2yqr h VAL 33 N -0.98 1.12 0.00 0.50 3.04 -0.62 -1.57 116.25 117.75 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 0.71 -0.13 0.00 0.00 -2.01 0.00 0.00 31.29 29.86 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 0.25 -1.43 4.17 0.28 -0.76 -4.04 120.64 114.64 2yqr n GLU 34 Ca 0.14 0.04 0.19 0.00 -0.16 0.00 0.00 57.16 57.37 2yqr n GLU 34 Cb 0.14 -1.63 -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 1.37 -2.05 3.72 -1.84 0.00 0.84 -3.11 105.19 104.12 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 -2.49 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 3.17 -0.50 2.42 0.56 0.00 -1.26 -0.11 105.19 109.47 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 -0.41 0.17 0.00 0.87 -0.47 0.10 113.55 113.82 2yqr h SER 39 Ca -0.39 -0.06 0.01 0.00 -1.23 0.00 0.00 61.79 60.12 2yqr h SER 39 Cb 1.22 0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 63.25 2yqr h SER 39 CO 0.51 -0.20 -0.48 1.88 -0.53 0.00 0.00 176.83 178.01 2yqr h TYR 40 N -0.60 -1.38 -0.91 2.24 -1.99 -1.77 -0.66 116.97 111.90 2yqr h TYR 40 Ca -0.05 0.03 0.09 0.00 2.00 0.00 0.00 58.73 60.81 2yqr h TYR 40 Cb 0.44 0.58 -0.07 0.00 2.00 0.00 0.00 36.73 39.68 2yqr h TYR 40 CO -0.02 -0.56 0.59 -0.07 -0.00 0.00 0.00 178.16 178.10 2yqr h LEU 41 N -0.73 0.84 -0.60 3.88 4.07 -1.59 -1.66 115.31 119.52 2yqr h LEU 41 Ca -0.02 0.02 0.05 0.00 0.08 0.00 0.00 57.88 58.02 2yqr h LEU 41 Cb 0.71 -0.15 -0.05 0.00 1.08 0.00 0.00 40.66 42.25 2yqr h LEU 41 CO -0.23 0.50 0.32 1.56 -1.08 0.00 0.00 178.44 179.52 2yqr h GLN 42 N 0.93 0.59 0.19 1.13 1.08 0.07 -0.89 115.11 118.22 2yqr h GLN 42 Ca 0.42 -0.04 0.01 0.00 -1.45 0.00 0.00 58.65 57.59 2yqr h GLN 42 Cb 0.38 -0.13 -0.04 0.00 -0.05 0.00 0.00 27.48 27.63 2yqr h GLN 42 CO -0.18 0.39 -0.51 1.25 -0.95 0.00 0.00 178.83 178.83 2yqr h HIS 43 N 0.61 -1.47 0.00 2.96 2.76 -0.16 0.28 115.15 120.14 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 0.15 0.62 -0.00 0.00 1.55 0.00 0.00 27.41 29.72 2yqr h HIS 43 CO -0.09 -0.60 -0.01 0.82 -1.30 0.00 0.00 177.93 176.76 2yqr h ILE 44 N -0.78 0.51 0.00 6.26 2.04 -1.47 0.29 117.51 124.36 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 0.76 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 2yqr h ILE 44 CO -0.24 0.01 -0.62 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 0.36 -2.52 115.11 119.51 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 0.62 -1.69 -0.89 -0.67 0.00 0.00 178.83 176.20 2yqr n ILE 46 N -3.36 0.95 0.12 2.54 5.41 0.83 -0.65 119.36 125.19 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 -0.00 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 -0.19 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.46 2yqr h GLU 47 Cb 1.55 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.19 2yqr h GLU 47 CO 0.03 0.59 -1.29 0.25 -1.16 0.00 0.00 179.01 177.43 2yqr n THR 48 N -3.24 0.16 -1.10 1.13 -2.24 -0.95 -5.02 114.28 103.02 2yqr n THR 48 Ca 0.01 -0.16 -0.03 0.00 -2.27 0.00 0.00 64.05 61.60 2yqr n THR 48 Cb 0.78 -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 2.42 0.64 3.89 3.38 0.00 0.17 -4.86 105.19 110.83 2yqr n GLY 49 Ca -0.04 -0.74 -0.24 0.00 0.00 0.00 0.00 46.02 45.00 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 -2.09 3.78 -0.55 4.61 0.00 -1.20 -5.00 121.76 121.30 2yqr s ALA 50 Ca 0.00 -1.23 -0.27 0.00 0.00 0.00 0.00 51.96 50.46 2yqr s ALA 50 Cb 0.00 -1.56 0.03 0.00 0.00 0.00 0.00 23.12 21.59 2yqr s ALA 50 CO 0.00 0.37 1.12 0.15 0.00 0.00 0.00 175.76 177.40 2yqr s LYS 51 N -3.58 3.50 -0.22 0.00 1.02 -0.49 -4.53 119.74 115.45 2yqr s LYS 51 Ca 0.33 0.18 -0.04 0.00 0.02 0.00 0.00 55.97 56.46 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 -1.58 -0.02 0.08 -0.92 0.00 0.00 175.35 173.18 2yqr s VAL 52 N 4.62 3.63 -0.08 3.17 1.01 -1.26 -0.08 120.40 131.41 2yqr s VAL 52 Ca 0.41 -0.41 -0.05 0.00 0.00 0.00 0.00 61.98 61.93 2yqr s VAL 52 Cb -0.09 -2.65 0.04 0.00 0.00 0.00 0.00 36.38 33.68 2yqr s VAL 52 CO 0.25 0.42 0.20 0.72 0.00 0.00 0.00 175.10 176.68 2yqr s PHE 53 N 1.33 -0.24 0.23 5.22 -0.71 -0.42 -4.95 117.98 118.43 2yqr s PHE 53 Ca 0.04 0.61 -0.30 0.00 -1.04 0.00 0.00 56.93 56.24 2yqr s PHE 53 Cb -0.14 0.01 -0.09 0.00 -1.21 0.00 0.00 43.02 41.58 2yqr s PHE 53 CO -0.01 -0.18 1.23 -1.17 -1.34 0.00 0.00 175.22 173.76 2yqr s LEU 54 N 0.95 4.45 0.14 -1.99 2.96 -1.26 -2.16 118.68 121.78 2yqr s LEU 54 Ca -0.07 2.36 -0.03 0.00 -0.22 0.00 0.00 54.13 56.17 2yqr s LEU 54 Cb -0.09 -3.62 -0.03 0.00 0.50 0.00 0.00 46.19 42.96 2yqr s LEU 54 CO -0.06 -0.41 0.13 -0.13 -1.32 0.00 0.00 176.35 174.56 2yqr s ARG 55 N -0.64 1.01 0.00 1.98 0.52 -0.47 -4.91 118.95 116.44 2yqr s ARG 55 Ca 0.52 -1.37 0.00 0.00 -0.52 0.00 0.00 55.73 54.36 2yqr s ARG 55 Cb -0.35 0.28 0.00 0.00 0.52 0.00 0.00 34.95 35.40 2yqr s ARG 55 CO 0.40 -0.31 0.00 0.41 0.02 0.00 0.00 175.30 175.82 2yqr n GLY 56 N -0.14 1.13 3.63 -3.53 0.00 -1.26 -0.58 105.19 104.44 2yqr n GLY 56 Ca -0.06 -2.01 -0.47 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 1.60 1.67 0.00 1.61 4.81 0.82 -0.84 118.16 127.83 2yqr n LYS 57 Ca 0.00 0.60 0.00 0.00 -0.87 0.00 0.00 58.31 58.04 2yqr n LYS 57 Cb 0.00 -2.22 0.00 0.00 0.02 0.00 0.00 35.03 32.83 2yqr n LYS 57 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2yqr n GLY 58 N 2.35 3.25 0.25 3.14 0.00 -1.26 -0.11 105.19 112.80 2yqr n GLY 58 Ca 0.14 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.03 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 0.92 0.00 1.61 4.64 -1.27 -3.48 113.55 115.98 2yqr h SER 59 Ca 0.00 -0.48 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2yqr h SER 59 Cb 0.00 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 61.83 2yqr h SER 59 CO 0.00 1.22 0.00 0.61 -0.87 0.00 0.00 176.83 177.79 2yqr n GLY 60 N 0.20 1.59 3.56 -0.77 0.00 -1.26 -4.96 105.19 103.55 2yqr n GLY 60 Ca -0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 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 7.46 0.14 -4.60 0.00 1.08 -1.90 -3.35 117.51 116.34 2yqr h ILE 62 Ca -0.05 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.42 2yqr h ILE 62 Cb 1.08 0.97 -0.11 0.00 -3.07 0.00 0.00 36.82 35.69 2yqr h ILE 62 CO 1.12 0.00 -1.28 -0.62 -0.69 0.00 0.00 178.15 176.68 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 60.06 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 -0.02 135.00 138.46 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 0.51 -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 -3.39 119.26 117.63 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 0.45 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 -5.04 113.62 109.37 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 0.33 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 2.79 1.30 3.36 0.46 0.00 0.98 -5.10 105.19 108.98 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 -4.77 118.95 118.17 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 0.12 0.00 0.52 0.00 0.00 34.95 33.67 2yqr s ARG 68 CO 0.00 0.47 0.08 0.39 0.02 0.00 0.00 175.30 176.27 2yqr n GLU 69 N 1.32 -1.68 -0.47 3.54 4.71 -1.17 -4.37 120.64 122.51 2yqr n GLU 69 Ca -0.18 -0.47 -0.29 0.00 -0.01 0.00 0.00 57.16 56.21 2yqr n GLU 69 Cb 0.53 -1.74 0.25 0.00 -1.01 0.00 0.00 31.44 29.47 2yqr n GLU 69 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2yqr n ALA 70 N -4.48 -3.42 0.09 0.62 0.00 -1.26 -4.88 120.51 107.19 2yqr n ALA 70 Ca 0.01 -1.31 -0.21 0.00 0.00 0.00 0.00 53.44 51.93 2yqr n ALA 70 Cb 0.62 -1.87 -0.15 0.00 0.00 0.00 0.00 19.45 18.05 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 -2.73 0.70 -4.40 0.00 -1.00 -1.96 -3.35 116.94 104.19 2yqr h PHE 71 Ca -0.61 -0.51 -0.50 0.00 2.81 0.00 0.00 57.97 59.16 2yqr h PHE 71 Cb 1.34 -0.03 0.07 0.00 3.61 0.00 0.00 35.95 40.94 2yqr h PHE 71 CO -0.03 1.54 0.42 -1.21 -1.61 0.00 0.00 178.31 177.41 2yqr s GLU 72 N -2.60 3.30 0.94 1.51 2.02 -1.26 -4.84 118.70 117.77 2yqr s GLU 72 Ca -0.11 0.63 -0.12 0.00 0.02 0.00 0.00 54.97 55.39 2yqr s GLU 72 Cb 0.06 -2.06 0.16 0.00 0.10 0.00 0.00 34.13 32.38 2yqr s GLU 72 CO 0.88 -0.75 1.09 -1.25 0.02 0.00 0.00 175.26 175.25 2yqr s PRO 73 N -5.25 0.87 0.67 0.39 0.04 -1.26 -0.13 135.00 130.33 2yqr s PRO 73 Ca 0.56 0.68 -0.17 0.00 0.04 0.00 0.00 61.00 62.11 2yqr s PRO 73 Cb -0.11 -1.77 -0.01 0.00 0.04 0.00 0.00 34.50 32.65 2yqr s PRO 73 CO 0.53 -2.47 1.14 0.00 0.04 0.00 0.00 177.00 176.24 2yqr n MET 74 N -4.02 0.87 -3.48 4.56 0.00 0.84 -4.07 117.12 111.82 2yqr n MET 74 Ca 0.06 0.35 -0.10 0.00 0.00 0.00 0.00 57.70 58.01 2yqr n MET 74 Cb 0.56 -2.38 -0.02 0.00 0.00 0.00 0.00 33.22 31.38 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 -1.56 -0.42 0.06 3.17 -0.85 0.25 -3.78 117.35 114.22 2yqr s TYR 75 Ca 0.79 0.24 -0.24 0.00 -0.52 0.00 0.00 57.07 57.34 2yqr s TYR 75 Cb -0.37 0.56 -0.06 0.00 0.38 0.00 0.00 41.96 42.46 2yqr s TYR 75 CO 0.44 -0.71 0.74 0.42 -1.52 0.00 0.00 175.55 174.92 2yqr s ILE 76 N -3.44 4.70 -0.20 -3.49 1.01 0.58 -1.37 121.20 118.99 2yqr s ILE 76 Ca 0.04 1.58 0.01 0.00 0.00 0.00 0.00 60.65 62.28 2yqr s ILE 76 Cb -0.01 -4.09 0.04 0.00 0.01 0.00 0.00 42.46 38.41 2yqr s ILE 76 CO -0.10 0.40 -0.13 -0.47 0.00 0.00 0.00 174.94 174.64 2yqr s TYR 77 N -0.27 2.63 -0.05 3.97 6.14 -0.92 -1.17 117.35 127.69 2yqr s TYR 77 Ca 0.37 -1.70 -0.02 0.00 0.64 0.00 0.00 57.07 56.35 2yqr s TYR 77 Cb -0.21 -1.75 -0.04 0.00 0.42 0.00 0.00 41.96 40.38 2yqr s TYR 77 CO 0.23 -0.78 0.07 0.42 0.64 0.00 0.00 175.55 176.13 2yqr s ILE 78 N 1.33 4.77 -0.22 3.14 1.01 -1.15 -1.31 121.20 128.77 2yqr s ILE 78 Ca -0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 60.65 60.40 2yqr s ILE 78 Cb -0.16 -3.11 0.07 0.00 0.01 0.00 0.00 42.46 39.27 2yqr s ILE 78 CO -0.09 0.48 0.03 -0.94 0.00 0.00 0.00 174.94 174.42 2yqr s SER 79 N -1.34 3.27 -0.02 3.58 1.04 0.89 -1.90 113.70 119.22 2yqr s SER 79 Ca 0.18 -1.01 0.03 0.00 0.48 0.00 0.00 55.95 55.63 2yqr s SER 79 Cb -0.12 -0.75 -0.00 0.00 0.10 0.00 0.00 66.02 65.25 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 1.73 1.03 -1.02 5.02 5.04 -0.53 -1.39 115.29 125.16 2yqr s HIS 80 Ca -0.00 -0.25 0.14 0.00 -1.54 0.00 0.00 55.06 53.41 2yqr s HIS 80 Cb -0.17 -0.71 0.62 0.00 0.04 0.00 0.00 32.58 32.35 2yqr s HIS 80 CO -0.10 -0.08 1.45 -0.35 -2.34 0.00 0.00 174.74 173.32 2yqr n PRO 81 N 3.15 0.01 -4.10 2.88 -0.04 -1.26 -0.52 135.00 135.12 2yqr n PRO 81 Ca -0.17 0.25 -0.12 0.00 -0.04 0.00 0.00 63.50 63.42 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 -2.98 0.65 0.32 0.54 -0.14 -1.26 -4.49 119.74 112.38 2yqr s LYS 82 Ca 0.07 -0.97 0.11 0.00 -1.36 0.00 0.00 55.97 53.83 2yqr s LYS 82 Cb 0.09 -0.28 0.53 0.00 -1.68 0.00 0.00 37.83 36.50 2yqr s LYS 82 CO 0.26 0.03 1.72 -1.00 -0.76 0.00 0.00 175.35 175.60 2yqr h PRO 83 N 3.95 0.02 0.13 -1.68 0.13 -1.93 -2.80 132.00 129.82 2yqr h PRO 83 Ca -0.36 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 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 0.50 -0.33 1.49 -0.23 0.00 0.00 178.00 179.92 2yqr h GLU 84 N 0.02 -0.49 -0.53 0.86 4.81 -1.97 0.46 114.58 117.73 2yqr h GLU 84 Ca -0.00 0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.19 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 0.06 -0.33 0.06 0.78 -0.73 0.00 0.00 179.01 178.86 2yqr h GLY 85 N -0.51 0.97 0.26 1.92 0.00 -1.89 -2.68 103.07 101.14 2yqr h GLY 85 Ca -0.01 -0.67 0.15 0.00 0.00 0.00 0.00 47.33 46.80 2yqr h GLY 85 CO -0.15 0.62 0.56 -2.00 0.00 0.00 0.00 176.54 175.56 2yqr h LEU 86 N 0.78 0.74 -0.81 3.11 7.12 -1.31 0.34 115.31 125.28 2yqr h LEU 86 Ca 0.16 0.08 -0.06 0.00 0.13 0.00 0.00 57.88 58.19 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 0.32 -0.28 0.00 -0.13 0.00 0.00 178.44 178.36 2yqr h ALA 87 N 1.58 0.95 0.00 1.25 0.00 -0.73 -2.96 119.26 119.35 2yqr h ALA 87 Ca 0.51 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 2yqr h ALA 87 Cb 0.69 -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 0.00 179.25 179.26 2yqr h ALA 88 N 1.72 -0.00 -0.98 0.00 0.00 -0.18 -3.15 119.26 116.66 2yqr h ALA 88 Ca -0.00 -0.21 0.19 0.00 0.00 0.00 0.00 54.91 54.89 2yqr h ALA 88 Cb 0.91 0.00 -0.09 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 -0.59 1.83 -0.40 0.00 0.00 -0.64 0.18 119.26 119.64 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 0.41 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2yqr h ALA 89 CO 0.00 -0.18 -0.04 -0.22 0.00 0.00 0.00 179.25 178.81 2yqr h LYS 90 N 0.67 0.67 -0.44 0.00 3.64 -1.64 -1.99 116.57 117.48 2yqr h LYS 90 Ca 0.55 -0.18 -0.10 0.00 -1.27 0.00 0.00 60.65 59.65 2yqr h LYS 90 Cb 0.98 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 2yqr h LYS 90 CO -0.32 0.72 -0.12 0.87 -2.27 0.00 0.00 179.45 178.32 2yqr h LYS 91 N 0.63 0.85 -0.39 1.90 1.57 -0.63 -2.80 116.57 117.71 2yqr h LYS 91 Ca 0.12 -0.34 -0.08 0.00 -1.87 0.00 0.00 60.65 58.49 2yqr h LYS 91 Cb 0.45 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.70 2yqr h LYS 91 CO 0.02 0.97 -0.08 -0.07 -0.57 0.00 0.00 179.45 179.72 2yqr h LEU 92 N 0.68 0.64 -0.32 2.94 3.38 -1.12 -2.81 115.31 118.70 2yqr h LEU 92 Ca 0.11 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2yqr h LEU 92 Cb 0.67 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 2yqr h LEU 92 CO 0.05 0.76 0.18 0.00 0.09 0.00 0.00 178.44 179.52 2yqr h GLU 94 N 0.40 0.33 0.04 0.00 4.39 -1.34 -0.37 114.58 118.03 2yqr h GLU 94 Ca 0.11 -0.03 -0.23 0.00 0.34 0.00 0.00 59.36 59.55 2yqr h GLU 94 Cb 0.05 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.63 2yqr h GLU 94 CO -0.02 0.27 -1.01 -0.97 -1.16 0.00 0.00 179.01 176.12 2yqr h ASN 95 N 0.34 0.35 0.09 1.42 -1.24 -1.17 -3.12 115.58 112.24 2yqr h ASN 95 Ca 0.09 -0.32 -0.17 0.00 0.71 0.00 0.00 56.30 56.61 2yqr h ASN 95 Cb 0.06 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 38.99 2yqr h ASN 95 CO -0.01 1.17 -0.60 0.25 -1.29 0.00 0.00 177.43 176.94 2yqr h LEU 96 N 0.12 0.58 -0.74 0.34 6.46 -0.19 -3.16 115.31 118.72 2yqr h LEU 96 Ca -0.08 -0.33 -0.06 0.00 -0.12 0.00 0.00 57.88 57.30 2yqr h LEU 96 Cb 1.69 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 41.42 2yqr h LEU 96 CO 0.16 1.05 0.23 -0.07 -0.62 0.00 0.00 178.44 179.19 2yqr h LEU 97 N 0.38 1.08 -2.14 2.25 3.38 -1.14 -2.20 115.31 116.92 2yqr h LEU 97 Ca -0.00 -0.21 0.07 0.00 0.09 0.00 0.00 57.88 57.83 2yqr h LEU 97 Cb 1.15 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 2yqr h LEU 97 CO 0.11 1.00 0.23 1.56 0.09 0.00 0.00 178.44 181.43 2yqr h GLN 98 N 1.10 0.00 0.17 1.13 1.08 -1.50 0.96 115.11 118.05 2yqr h GLN 98 Ca 0.24 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.43 2yqr h GLN 98 Cb 0.31 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.74 2yqr h GLN 98 CO -0.01 0.00 -0.08 1.15 -0.95 0.00 0.00 178.83 178.94 2yqr h THR 99 N 0.00 0.00 -0.46 -0.54 2.02 -1.46 -3.13 112.91 109.34 2yqr h THR 99 Ca 0.12 -0.75 0.08 0.00 0.77 0.00 0.00 66.41 66.62 2yqr h THR 99 Cb 0.58 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 2yqr h THR 99 CO -0.00 0.00 0.31 1.62 0.37 0.00 0.00 175.52 177.82 2yqr h VAL 100 N -0.98 0.92 -0.16 3.16 3.04 -1.33 -0.23 116.25 120.67 2yqr h VAL 100 Ca -0.02 -0.10 -0.04 0.00 -1.01 0.00 0.00 66.70 65.52 2yqr h VAL 100 Cb 0.17 0.60 -0.01 0.00 -2.01 0.00 0.00 31.29 30.04 2yqr h VAL 100 CO 0.04 0.05 -0.10 0.45 -1.01 0.00 0.00 177.57 177.00 2yqr h HIS 101 N 0.29 0.26 0.00 3.17 -0.00 -0.91 -2.09 115.15 115.86 2yqr h HIS 101 Ca 0.21 -0.03 -0.10 0.00 -0.00 0.00 0.00 60.37 60.45 2yqr h HIS 101 Cb 0.44 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.76 2yqr h HIS 101 CO -0.00 0.36 -0.48 0.00 -0.00 0.00 0.00 177.93 177.80 2yqr h ALA 102 N 1.66 1.17 -0.12 2.45 0.00 -0.97 -3.01 119.26 120.44 2yqr h ALA 102 Ca 0.05 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 2yqr h ALA 102 Cb 0.34 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2yqr h ALA 102 CO 0.02 0.61 -0.10 0.93 0.00 0.00 0.00 179.25 180.70 2yqr h GLU 103 N 0.00 0.29 -0.17 0.00 4.39 -1.29 -3.05 114.58 114.74 2yqr h GLU 103 Ca -0.00 -0.14 0.04 0.00 0.34 0.00 0.00 59.36 59.59 2yqr h GLU 103 Cb 0.87 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.49 2yqr h GLU 103 CO 0.06 0.67 -0.07 -0.92 -1.16 0.00 0.00 179.01 177.59 2yqr h TYR 104 N -0.10 -0.17 -0.37 4.33 3.20 -1.48 0.20 116.97 122.60 2yqr h TYR 104 Ca 0.02 0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.02 2yqr h TYR 104 Cb 0.61 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.97 2yqr h TYR 104 CO 0.08 -0.12 0.33 1.03 -1.64 0.00 0.00 178.16 177.84 2yqr h SER 105 N -0.05 0.00 0.60 -2.11 0.87 -1.57 0.26 113.55 111.55 2yqr h SER 105 Ca 0.09 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.38 2yqr h SER 105 Cb 0.19 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.11 2yqr h SER 105 CO -0.21 0.00 -1.53 0.03 -0.53 0.00 0.00 176.83 174.59 2yqr h ARG 106 N 0.00 0.03 0.16 2.24 3.08 -0.98 -3.16 114.38 115.75 2yqr h ARG 106 Ca 0.17 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 2yqr h ARG 106 Cb 0.83 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.90 2yqr h ARG 106 CO -0.00 0.69 -0.07 0.35 -1.07 0.00 0.00 179.97 179.87 2yqr h PHE 107 N 0.01 -0.19 -0.06 3.04 3.04 0.17 -3.15 116.94 119.80 2yqr h PHE 107 Ca -0.22 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 61.74 2yqr h PHE 107 Cb 1.96 0.06 -0.00 0.00 2.56 0.00 0.00 35.95 40.53 2yqr h PHE 107 CO 0.01 0.09 0.06 -0.24 -2.02 0.00 0.00 178.31 176.21 2yqr h VAL 108 N -1.00 0.56 0.00 1.41 3.04 -0.81 0.20 116.25 119.65 2yqr h VAL 108 Ca -0.02 0.00 -0.08 0.00 -1.01 0.00 0.00 66.70 65.59 2yqr h VAL 108 Cb 0.37 0.95 -0.01 0.00 -2.01 0.00 0.00 31.29 30.59 2yqr h VAL 108 CO 0.04 0.00 -0.36 -1.13 -1.01 0.00 0.00 177.57 175.11 2yqr h ASN 109 N 0.00 0.00 0.86 3.17 -0.73 -1.61 -3.00 115.58 114.28 2yqr h ASN 109 Ca 0.03 0.00 -0.23 0.00 1.87 0.00 0.00 56.30 57.96 2yqr h ASN 109 Cb 0.15 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.71 2yqr h ASN 109 CO -0.00 0.36 -1.17 1.56 -0.37 0.00 0.00 177.43 177.81 2yqr h GLN 110 N 0.00 0.03 -0.47 6.67 4.20 -0.91 -3.33 115.11 121.30 2yqr h GLN 110 Ca -0.00 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.68 2yqr h GLN 110 Cb 0.86 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.62 2yqr h GLN 110 CO 0.05 0.93 0.26 0.82 -0.67 0.00 0.00 178.83 180.22 2yqr h ILE 111 N 0.01 1.02 -3.60 2.54 2.04 -1.34 -3.41 117.51 114.76 2yqr h ILE 111 Ca -0.08 -0.18 -0.57 0.00 1.00 0.00 0.00 64.86 65.03 2yqr h ILE 111 Cb 1.84 0.45 -0.32 0.00 -0.74 0.00 0.00 36.82 38.04 2yqr h ILE 111 CO 0.13 0.10 -0.84 0.21 0.00 0.00 0.00 178.15 177.75 2yqr s ASN 112 N -5.53 2.19 0.35 1.72 2.47 -1.22 -5.11 114.94 109.81 2yqr s ASN 112 Ca -0.13 -0.37 -0.28 0.00 0.42 0.00 0.00 52.86 52.50 2yqr s ASN 112 Cb 0.12 -0.85 -0.12 0.00 -1.45 0.00 0.00 41.25 38.96 2yqr s ASN 112 CO 0.73 0.11 1.34 0.41 -3.72 0.00 0.00 177.10 175.97 2yqr n THR 113 N 3.48 1.97 -3.60 -5.21 -1.04 -1.26 -4.74 114.28 103.87 2yqr n THR 113 Ca -0.20 -0.49 -0.05 0.00 -2.04 0.00 0.00 64.05 61.27 2yqr n THR 113 Cb 0.52 -1.66 -0.03 0.00 -1.82 0.00 0.00 70.33 67.35 2yqr n THR 113 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2yqr s ALA 114 N -1.07 -2.06 -0.55 2.41 0.00 -1.26 -5.11 121.76 114.11 2yqr s ALA 114 Ca 0.55 1.64 -0.18 0.00 0.00 0.00 0.00 51.96 53.97 2yqr s ALA 114 Cb -0.55 -0.38 0.10 0.00 0.00 0.00 0.00 23.12 22.28 2yqr s ALA 114 CO 0.62 -0.51 0.62 0.08 0.00 0.00 0.00 175.76 176.57 2yqr s VAL 115 N -2.08 4.95 0.72 0.00 1.01 -1.26 -5.06 120.40 118.67 2yqr s VAL 115 Ca 0.08 -1.00 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 2yqr s VAL 115 Cb -0.01 -4.39 0.18 0.00 0.00 0.00 0.00 36.38 32.16 2yqr s VAL 115 CO -0.05 -0.96 0.63 -0.81 0.00 0.00 0.00 175.10 173.92 2yqr n PRO 116 N 5.97 -2.27 -1.89 2.72 -0.04 -1.26 -5.01 135.00 133.23 2yqr n PRO 116 Ca -0.10 -1.01 -0.33 0.00 -0.04 0.00 0.00 63.50 62.02 2yqr n PRO 116 Cb 0.43 -0.95 0.03 0.00 -0.04 0.00 0.00 33.50 32.96 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 3.43 1.20 1.53 1.43 -1.26 -5.04 118.68 119.97 2yqr s LEU 117 Ca 0.41 1.90 -0.19 0.00 -1.03 0.00 0.00 54.13 55.23 2yqr s LEU 117 Cb -0.04 -4.54 0.28 0.00 0.03 0.00 0.00 46.19 41.92 2yqr s LEU 117 CO 0.32 -1.41 1.11 -2.16 0.23 0.00 0.00 176.35 174.44 2yqr s PRO 118 N -4.11 -1.19 0.00 1.29 0.04 -1.26 -5.31 135.00 124.46 2yqr s PRO 118 Ca 0.65 -0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.65 2yqr s PRO 118 Cb -0.18 -1.60 0.00 0.00 0.04 0.00 0.00 34.50 32.76 2yqr s PRO 118 CO 0.40 -3.69 0.48 0.41 0.04 0.00 0.00 177.00 174.63