#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yrq n SER 2 N 0.00 -1.35 -4.49 1.61 7.64 -1.26 -4.63 113.62 111.13 2yrq n SER 2 Ca 0.00 -1.24 -0.42 0.00 1.01 0.00 0.00 58.87 58.22 2yrq n SER 2 Cb 0.00 -1.66 -0.11 0.00 -1.01 0.00 0.00 64.21 61.43 2yrq n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2yrq n SER 3 N -2.56 1.10 0.00 6.43 3.41 -1.26 -4.85 113.62 115.90 2yrq n SER 3 Ca 0.03 0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 2yrq n SER 3 Cb 0.50 -1.15 0.00 0.00 -0.26 0.00 0.00 64.21 63.30 2yrq n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yrq n GLY 4 N 6.42 -2.76 3.76 5.00 0.00 -1.26 -4.70 105.19 111.65 2yrq n GLY 4 Ca 0.54 0.42 -0.29 0.00 0.00 0.00 0.00 46.02 46.69 2yrq n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yrq s SER 5 N -2.71 2.92 -0.29 1.61 0.01 -1.26 -5.09 113.70 108.88 2yrq s SER 5 Ca 0.00 0.82 -0.23 0.00 1.31 0.00 0.00 55.95 57.85 2yrq s SER 5 Cb 0.00 -1.27 0.15 0.00 0.21 0.00 0.00 66.02 65.12 2yrq s SER 5 CO 0.00 -2.91 1.17 -0.94 0.41 0.00 0.00 173.24 170.97 2yrq s SER 6 N -4.08 -0.31 0.00 2.44 1.04 -1.26 -5.14 113.70 106.38 2yrq s SER 6 Ca 0.67 0.56 0.00 0.00 0.48 0.00 0.00 55.95 57.66 2yrq s SER 6 Cb -0.13 0.71 0.00 0.00 0.10 0.00 0.00 66.02 66.70 2yrq s SER 6 CO 0.54 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 175.28 2yrq n GLY 7 N 2.34 0.38 3.64 7.32 0.00 -1.25 -4.85 105.19 112.76 2yrq n GLY 7 Ca -0.13 -2.24 -0.44 0.00 0.00 0.00 0.00 46.02 43.21 2yrq n GLY 7 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2yrq n MET 8 N -0.05 2.44 0.00 1.61 2.81 -1.26 -4.66 117.12 118.01 2yrq n MET 8 Ca 0.00 0.84 0.00 0.00 -1.81 0.00 0.00 57.70 56.73 2yrq n MET 8 Cb 0.00 -2.97 0.00 0.00 -0.71 0.00 0.00 33.22 29.54 2yrq n MET 8 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2yrq n GLY 9 N 4.91 -0.81 3.64 3.03 0.00 -1.26 -5.17 105.19 109.52 2yrq n GLY 9 Ca 0.24 0.54 -0.09 0.00 0.00 0.00 0.00 46.02 46.71 2yrq n GLY 9 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2yrq s LYS 10 N 0.49 0.60 0.00 1.61 -2.85 -1.26 -5.16 119.74 113.17 2yrq s LYS 10 Ca 0.00 0.81 0.00 0.00 -1.00 0.00 0.00 55.97 55.78 2yrq s LYS 10 Cb 0.00 0.24 0.00 0.00 -2.06 0.00 0.00 37.83 36.01 2yrq s LYS 10 CO 0.00 -0.09 0.00 0.41 0.10 0.00 0.00 175.35 175.77 2yrq n GLY 11 N 2.90 -0.97 3.31 0.59 0.00 -1.26 -5.14 105.19 104.62 2yrq n GLY 11 Ca -0.15 -0.02 -0.17 0.00 0.00 0.00 0.00 46.02 45.67 2yrq n GLY 11 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2yrq s ASP 12 N -4.00 2.34 0.29 1.61 1.01 -1.26 -5.05 116.67 111.61 2yrq s ASP 12 Ca 0.00 -1.00 0.07 0.00 0.71 0.00 0.00 52.55 52.33 2yrq s ASP 12 Cb 0.00 -0.10 0.42 0.00 1.01 0.00 0.00 42.92 44.25 2yrq s ASP 12 CO 0.00 -0.21 1.67 1.55 0.21 0.00 0.00 175.17 178.39 2yrq h PRO 13 N 2.69 0.20 -0.52 8.23 0.13 -2.04 -3.29 132.00 137.41 2yrq h PRO 13 Ca -0.38 -0.11 0.05 0.00 -0.87 0.00 0.00 66.00 64.70 2yrq h PRO 13 Cb 1.21 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.26 2yrq h PRO 13 CO 0.61 0.63 -0.49 0.87 -0.23 0.00 0.00 178.00 179.39 2yrq h LYS 14 N 0.16 -0.23 -6.17 0.86 6.56 -2.05 -3.37 116.57 112.34 2yrq h LYS 14 Ca 0.01 0.02 -0.57 0.00 -1.06 0.00 0.00 60.65 59.05 2yrq h LYS 14 Cb 0.89 0.05 -0.04 0.00 -0.57 0.00 0.00 32.23 32.57 2yrq h LYS 14 CO 0.07 -0.15 0.93 0.15 -2.06 0.00 0.00 179.45 178.39 2yrq s LYS 15 N -5.24 4.21 -0.83 3.15 1.02 -1.24 -4.93 119.74 115.87 2yrq s LYS 15 Ca -0.12 1.72 -0.25 0.00 0.02 0.00 0.00 55.97 57.34 2yrq s LYS 15 Cb 0.08 -3.80 -0.04 0.00 -0.52 0.00 0.00 37.83 33.55 2yrq s LYS 15 CO 0.53 -0.74 1.93 -1.25 -0.92 0.00 0.00 175.35 174.89 2yrq s PRO 16 N 3.60 2.57 0.18 -1.68 0.04 -1.26 -4.86 135.00 133.60 2yrq s PRO 16 Ca 0.57 -0.08 -0.07 0.00 0.04 0.00 0.00 61.00 61.46 2yrq s PRO 16 Cb -0.23 -4.90 -0.06 0.00 0.04 0.00 0.00 34.50 29.34 2yrq s PRO 16 CO 0.17 -3.22 0.45 -0.98 0.04 0.00 0.00 177.00 173.46 2yrq s ARG 17 N 7.01 3.70 0.00 4.56 1.70 -1.26 -4.81 118.95 129.85 2yrq s ARG 17 Ca 0.69 0.07 0.00 0.00 -0.47 0.00 0.00 55.73 56.03 2yrq s ARG 17 Cb -0.08 -2.76 0.00 0.00 -0.57 0.00 0.00 34.95 31.54 2yrq s ARG 17 CO 0.04 0.40 0.00 0.41 -1.08 0.00 0.00 175.30 175.07 2yrq n GLY 18 N -0.01 0.00 3.43 3.88 0.00 -1.26 -5.03 105.19 106.19 2yrq n GLY 18 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 2yrq n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yrq s LYS 19 N 0.00 3.29 0.08 1.61 1.02 -1.26 -4.95 119.74 119.52 2yrq s LYS 19 Ca 0.00 -0.75 0.06 0.00 0.02 0.00 0.00 55.97 55.30 2yrq s LYS 19 Cb 0.00 -3.54 -0.04 0.00 -0.52 0.00 0.00 37.83 33.73 2yrq s LYS 19 CO 0.00 -0.43 -0.08 -1.64 -0.92 0.00 0.00 175.35 172.29 2yrq s MET 20 N 1.60 2.30 0.33 1.68 -1.94 -1.26 -3.88 119.30 118.13 2yrq s MET 20 Ca 0.04 -0.92 0.02 0.00 -1.71 0.00 0.00 55.69 53.12 2yrq s MET 20 Cb -0.17 -2.39 0.06 0.00 2.01 0.00 0.00 34.83 34.34 2yrq s MET 20 CO 0.06 0.54 0.46 -1.13 -0.01 0.00 0.00 175.02 174.93 2yrq n SER 21 N 0.89 0.81 0.00 3.03 3.41 -1.26 -4.82 113.62 115.69 2yrq n SER 21 Ca -0.13 -1.64 -0.11 0.00 -0.26 0.00 0.00 58.87 56.73 2yrq n SER 21 Cb 0.52 -0.28 -0.05 0.00 -0.26 0.00 0.00 64.21 64.15 2yrq n SER 21 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2yrq h SER 22 N -0.16 -1.09 0.62 4.04 4.64 -1.92 -1.67 113.55 118.00 2yrq h SER 22 Ca -0.15 0.15 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 2yrq h SER 22 Cb 0.61 0.46 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2yrq h SER 22 CO 0.18 -0.38 -0.33 0.22 -0.87 0.00 0.00 176.83 175.65 2yrq h TYR 23 N -0.43 -0.85 -1.47 4.77 3.20 -1.95 0.37 116.97 120.61 2yrq h TYR 23 Ca 0.09 -0.02 0.47 0.00 3.14 0.00 0.00 58.73 62.41 2yrq h TYR 23 Cb 0.57 0.29 -0.11 0.00 1.54 0.00 0.00 36.73 39.03 2yrq h TYR 23 CO -0.43 -0.51 1.00 0.00 -1.64 0.00 0.00 178.16 176.58 2yrq n ALA 24 N -2.48 1.43 0.04 1.82 0.00 -1.15 0.17 120.51 120.34 2yrq n ALA 24 Ca -0.11 0.71 -0.21 0.00 0.00 0.00 0.00 53.44 53.83 2yrq n ALA 24 Cb 0.35 -0.99 -0.14 0.00 0.00 0.00 0.00 19.45 18.66 2yrq n ALA 24 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2yrq h PHE 25 N 0.00 0.59 -0.29 0.00 0.04 -0.85 -3.34 116.94 113.09 2yrq h PHE 25 Ca 0.82 -0.43 -0.01 0.00 2.80 0.00 0.00 57.97 61.16 2yrq h PHE 25 Cb 2.91 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 41.03 2yrq h PHE 25 CO -0.00 1.68 0.15 0.35 -0.60 0.00 0.00 178.31 179.89 2yrq h PHE 26 N 0.09 0.40 -0.72 -0.55 3.57 0.60 0.12 116.94 120.45 2yrq h PHE 26 Ca -0.37 -0.01 0.17 0.00 3.53 0.00 0.00 57.97 61.29 2yrq h PHE 26 Cb 2.07 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 40.64 2yrq h PHE 26 CO 0.09 0.34 0.49 0.28 -2.23 0.00 0.00 178.31 177.27 2yrq h VAL 27 N 0.35 0.74 0.00 1.41 2.07 -0.70 0.27 116.25 120.38 2yrq h VAL 27 Ca 0.10 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.54 2yrq h VAL 27 Cb 0.07 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 2yrq h VAL 27 CO -0.02 0.05 -0.87 1.67 0.02 0.00 0.00 177.57 178.42 2yrq n GLN 28 N -4.43 0.26 0.14 1.57 7.27 -0.89 -3.53 117.38 117.77 2yrq n GLN 28 Ca 0.14 0.02 0.03 0.00 0.07 0.00 0.00 57.00 57.26 2yrq n GLN 28 Cb 0.61 -1.61 0.04 0.00 2.41 0.00 0.00 30.24 31.70 2yrq n GLN 28 CO 0.00 0.00 0.00 1.15 0.07 0.00 0.00 177.06 178.28 2yrq h THR 29 N 0.00 0.84 0.13 1.69 2.02 0.22 -2.85 112.91 114.97 2yrq h THR 29 Ca 0.00 -2.16 -0.35 0.00 0.77 0.00 0.00 66.41 64.67 2yrq h THR 29 Cb 0.71 2.39 -0.01 0.00 -1.74 0.00 0.00 68.15 69.50 2yrq h THR 29 CO 0.00 0.48 -1.89 0.00 0.37 0.00 0.00 175.52 174.48 2yrq h ARG 31 N 0.08 0.96 -0.48 0.00 0.11 -1.65 -1.54 114.38 111.85 2yrq h ARG 31 Ca -0.38 -0.26 -0.07 0.00 0.10 0.00 0.00 59.98 59.36 2yrq h ARG 31 Cb 2.05 -0.11 -0.02 0.00 1.11 0.00 0.00 29.97 33.01 2yrq h ARG 31 CO 0.12 0.92 0.03 0.93 0.10 0.00 0.00 179.97 182.07 2yrq h GLU 32 N 0.85 0.82 -0.10 0.08 5.08 -1.67 -2.74 114.58 116.91 2yrq h GLU 32 Ca 0.17 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 58.22 2yrq h GLU 32 Cb 0.43 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 2yrq h GLU 32 CO 0.01 0.86 -0.23 0.93 -1.00 0.00 0.00 179.01 179.58 2yrq h GLU 33 N 0.68 0.17 0.46 2.33 4.39 -1.53 -3.12 114.58 117.96 2yrq h GLU 33 Ca 0.14 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.77 2yrq h GLU 33 Cb 0.46 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 2yrq h GLU 33 CO 0.02 0.39 -0.22 1.25 -1.16 0.00 0.00 179.01 179.29 2yrq h HIS 34 N 0.16 -0.58 -1.08 4.33 -0.00 -0.99 -2.61 115.15 114.37 2yrq h HIS 34 Ca 0.03 -0.01 0.31 0.00 -0.00 0.00 0.00 60.37 60.70 2yrq h HIS 34 Cb 0.50 0.19 -0.04 0.00 -0.00 0.00 0.00 27.41 28.05 2yrq h HIS 34 CO 0.01 -0.28 1.21 1.63 -0.00 0.00 0.00 177.93 180.49 2yrq n LYS 35 N -5.29 0.01 0.10 5.26 4.01 -1.07 0.24 118.16 121.41 2yrq n LYS 35 Ca -0.11 1.00 -0.23 0.00 -0.51 0.00 0.00 58.31 58.46 2yrq n LYS 35 Cb 0.29 -2.47 -0.15 0.00 -0.51 0.00 0.00 35.03 32.20 2yrq n LYS 35 CO 0.00 0.00 0.00 0.87 -1.11 0.00 0.00 177.40 177.16 2yrq h LYS 36 N 0.00 0.43 -0.14 1.97 1.79 -1.57 -3.14 116.57 115.91 2yrq h LYS 36 Ca 0.52 -0.73 -0.10 0.00 -2.18 0.00 0.00 60.65 58.15 2yrq h LYS 36 Cb 2.93 0.27 0.00 0.00 -1.58 0.00 0.00 32.23 33.85 2yrq h LYS 36 CO -0.01 1.35 -0.31 0.87 -1.08 0.00 0.00 179.45 180.28 2yrq h LYS 37 N -0.02 0.46 -3.04 3.15 1.57 0.31 -3.41 116.57 115.60 2yrq h LYS 37 Ca -0.26 -0.31 -0.58 0.00 -1.87 0.00 0.00 60.65 57.63 2yrq h LYS 37 Cb 2.00 0.04 -0.40 0.00 0.08 0.00 0.00 32.23 33.96 2yrq h LYS 37 CO 0.20 0.91 -0.78 -1.01 -0.57 0.00 0.00 179.45 178.21 2yrq s HIS 38 N -3.98 1.31 -0.02 -1.35 3.76 0.30 -5.00 115.29 110.30 2yrq s HIS 38 Ca -0.13 -1.75 -0.25 0.00 -0.15 0.00 0.00 55.06 52.77 2yrq s HIS 38 Cb 0.06 -1.43 -0.20 0.00 1.11 0.00 0.00 32.58 32.12 2yrq s HIS 38 CO 0.79 -0.83 1.23 -1.00 -0.85 0.00 0.00 174.74 174.08 2yrq h PRO 39 N 7.51 -0.05 -1.08 8.40 0.13 -1.78 -3.18 132.00 141.95 2yrq h PRO 39 Ca -0.06 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.78 2yrq h PRO 39 Cb 0.98 0.01 -0.16 0.00 0.13 0.00 0.00 31.00 31.96 2yrq h PRO 39 CO 0.42 0.42 0.37 -0.25 -0.23 0.00 0.00 178.00 178.73 2yrq n ASP 40 N -4.88 3.95 -4.76 1.44 8.00 -1.26 -4.93 116.55 114.11 2yrq n ASP 40 Ca -0.08 -2.90 -0.40 0.00 0.71 0.00 0.00 54.79 52.11 2yrq n ASP 40 Cb 0.25 -0.74 -0.06 0.00 -0.02 0.00 0.00 41.12 40.55 2yrq n ASP 40 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2yrq s ALA 41 N -1.80 3.40 -0.61 2.24 0.00 -1.20 -4.96 121.76 118.83 2yrq s ALA 41 Ca 0.31 0.39 -0.05 0.00 0.00 0.00 0.00 51.96 52.62 2yrq s ALA 41 Cb 0.26 -3.03 0.03 0.00 0.00 0.00 0.00 23.12 20.38 2yrq s ALA 41 CO 0.05 0.20 2.80 0.43 0.00 0.00 0.00 175.76 179.24 2yrq n SER 42 N 1.97 6.71 -4.75 0.00 7.64 -1.26 -4.96 113.62 118.96 2yrq n SER 42 Ca -0.04 -3.09 -0.41 0.00 1.01 0.00 0.00 58.87 56.34 2yrq n SER 42 Cb 0.49 -1.29 -0.04 0.00 -1.01 0.00 0.00 64.21 62.36 2yrq n SER 42 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2yrq s VAL 43 N -1.53 3.52 0.11 0.44 0.11 -1.26 -5.04 120.40 116.75 2yrq s VAL 43 Ca 0.59 1.43 -0.03 0.00 -2.93 0.00 0.00 61.98 61.04 2yrq s VAL 43 Cb 0.33 -3.91 -0.05 0.00 -1.53 0.00 0.00 36.38 31.22 2yrq s VAL 43 CO -0.17 0.30 0.32 0.20 -3.33 0.00 0.00 175.10 172.42 2yrq s ASN 44 N -0.51 6.45 0.09 3.54 0.01 -1.26 -5.02 114.94 118.24 2yrq s ASN 44 Ca 0.47 0.48 -0.16 0.00 -0.71 0.00 0.00 52.86 52.95 2yrq s ASN 44 Cb -0.32 -2.05 -0.09 0.00 0.41 0.00 0.00 41.25 39.20 2yrq s ASN 44 CO 0.40 0.10 1.42 2.19 -1.51 0.00 0.00 177.10 179.70 2yrq h PHE 45 N 2.95 0.78 0.19 2.20 -0.00 -1.98 -2.14 116.94 118.94 2yrq h PHE 45 Ca -0.46 -0.23 -0.01 0.00 -0.00 0.00 0.00 57.97 57.28 2yrq h PHE 45 Cb 1.16 -0.17 0.00 0.00 -0.00 0.00 0.00 35.95 36.95 2yrq h PHE 45 CO 0.61 0.94 -0.09 0.77 -0.00 0.00 0.00 178.31 180.55 2yrq h SER 46 N 0.39 -0.21 -0.64 -0.68 0.02 -1.99 -1.38 113.55 109.05 2yrq h SER 46 Ca 0.05 -0.19 0.09 0.00 -0.84 0.00 0.00 61.79 60.90 2yrq h SER 46 Cb 0.80 0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.35 2yrq h SER 46 CO 0.06 0.08 0.43 -0.33 -1.14 0.00 0.00 176.83 175.93 2yrq h GLU 47 N -0.52 0.49 0.00 3.45 5.08 -1.98 0.17 114.58 121.27 2yrq h GLU 47 Ca -0.03 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2yrq h GLU 47 Cb 0.39 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2yrq h GLU 47 CO 0.04 0.32 0.00 0.35 -1.00 0.00 0.00 179.01 178.73 2yrq h PHE 48 N 0.51 0.00 0.04 4.33 3.57 -1.21 -3.16 116.94 121.02 2yrq h PHE 48 Ca 0.29 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.79 2yrq h PHE 48 Cb 0.48 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.22 2yrq h PHE 48 CO -0.00 0.00 -0.02 1.03 -2.23 0.00 0.00 178.31 177.09 2yrq h SER 49 N 0.00 -0.04 -1.24 0.41 0.87 0.48 -2.85 113.55 111.17 2yrq h SER 49 Ca 0.00 0.00 0.36 0.00 -1.23 0.00 0.00 61.79 60.92 2yrq h SER 49 Cb 0.84 0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 62.76 2yrq h SER 49 CO 0.00 0.06 0.89 0.07 -0.53 0.00 0.00 176.83 177.32 2yrq h LYS 50 N -0.24 0.02 0.18 2.24 2.10 -1.58 0.55 116.57 119.84 2yrq h LYS 50 Ca -0.01 -0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.63 2yrq h LYS 50 Cb 0.04 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.37 2yrq h LYS 50 CO 0.01 0.01 -0.09 0.87 -2.00 0.00 0.00 179.45 178.25 2yrq h LYS 51 N 0.02 -0.23 -1.02 0.07 1.57 -1.64 -3.06 116.57 112.27 2yrq h LYS 51 Ca 0.60 0.02 0.27 0.00 -1.87 0.00 0.00 60.65 59.66 2yrq h LYS 51 Cb 2.36 0.05 -0.07 0.00 0.08 0.00 0.00 32.23 34.65 2yrq h LYS 51 CO -0.02 0.14 0.69 0.00 -0.57 0.00 0.00 179.45 179.69 2yrq n SER 53 N -4.44 0.00 0.30 0.00 7.64 -1.05 0.18 113.62 116.25 2yrq n SER 53 Ca 0.23 0.90 0.19 0.00 1.01 0.00 0.00 58.87 61.20 2yrq n SER 53 Cb 0.94 -0.42 0.94 0.00 -1.01 0.00 0.00 64.21 64.66 2yrq n SER 53 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 2yrq h GLU 54 N 0.00 0.00 0.00 1.43 4.11 -1.46 -1.45 114.58 117.22 2yrq h GLU 54 Ca 0.00 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.29 2yrq h GLU 54 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2yrq h GLU 54 CO 0.00 0.03 -0.69 -0.09 0.07 0.00 0.00 179.01 178.33 2yrq h ARG 55 N 0.00 0.00 0.19 1.06 2.43 0.39 -2.68 114.38 115.77 2yrq h ARG 55 Ca -0.00 0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 58.85 2yrq h ARG 55 Cb 0.22 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 29.80 2yrq h ARG 55 CO 0.00 0.69 -1.36 2.35 -1.51 0.00 0.00 179.97 180.14 2yrq h TRP 56 N 0.00 0.96 -0.08 2.20 2.91 0.82 -3.09 115.95 119.66 2yrq h TRP 56 Ca -0.01 -0.65 -0.02 0.00 1.13 0.00 0.00 58.89 59.34 2yrq h TRP 56 Cb 1.47 -0.06 -0.00 0.00 -0.51 0.00 0.00 29.16 30.06 2yrq h TRP 56 CO 0.00 1.50 -0.04 1.57 -1.03 0.00 0.00 178.44 180.44 2yrq h LYS 57 N 0.20 0.17 -0.93 2.65 2.10 -1.54 -3.15 116.57 116.07 2yrq h LYS 57 Ca -0.22 -0.08 0.10 0.00 -2.00 0.00 0.00 60.65 58.46 2yrq h LYS 57 Cb 2.05 -0.00 -0.08 0.00 -0.90 0.00 0.00 32.23 33.29 2yrq h LYS 57 CO 0.25 0.54 0.57 0.00 -2.00 0.00 0.00 179.45 178.81 2yrq h THR 58 N -0.20 0.94 -1.38 0.07 1.03 -1.60 -3.42 112.91 108.35 2yrq h THR 58 Ca 0.02 -0.32 -0.76 0.00 -0.01 0.00 0.00 66.41 65.34 2yrq h THR 58 Cb 0.49 -0.08 0.03 0.00 -1.07 0.00 0.00 68.15 67.52 2yrq h THR 58 CO 0.01 0.17 0.55 0.23 -0.01 0.00 0.00 175.52 176.47 2yrq n MET 59 N -4.65 0.70 -1.22 0.00 2.81 -1.17 -4.88 117.12 108.72 2yrq n MET 59 Ca 0.16 0.26 -0.33 0.00 -1.81 0.00 0.00 57.70 55.97 2yrq n MET 59 Cb 0.30 -1.86 0.11 0.00 -0.71 0.00 0.00 33.22 31.07 2yrq n MET 59 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2yrq s SER 60 N 1.76 3.83 0.27 7.83 0.01 -1.26 -4.69 113.70 121.44 2yrq s SER 60 Ca 0.94 2.32 -0.03 0.00 1.31 0.00 0.00 55.95 60.48 2yrq s SER 60 Cb -1.15 -2.58 0.56 0.00 0.21 0.00 0.00 66.02 63.05 2yrq s SER 60 CO 0.61 -2.51 1.62 0.00 0.41 0.00 0.00 173.24 173.37 2yrq h ALA 61 N -0.74 0.95 -0.69 1.44 0.00 -1.93 0.32 119.26 118.60 2yrq h ALA 61 Ca -0.46 0.27 0.12 0.00 0.00 0.00 0.00 54.91 54.83 2yrq h ALA 61 Cb 1.29 0.45 -0.08 0.00 0.00 0.00 0.00 17.79 19.45 2yrq h ALA 61 CO 0.47 -0.46 0.28 0.87 0.00 0.00 0.00 179.25 180.41 2yrq h LYS 62 N 0.10 0.44 -0.75 0.00 1.57 -2.00 0.20 116.57 116.13 2yrq h LYS 62 Ca 0.48 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.23 2yrq h LYS 62 Cb 0.91 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 33.08 2yrq h LYS 62 CO -0.74 0.29 0.43 0.93 -0.57 0.00 0.00 179.45 179.79 2yrq h GLU 63 N 0.45 1.03 -0.28 3.15 4.39 -0.72 -2.51 114.58 120.09 2yrq h GLU 63 Ca 0.36 -0.11 -0.12 0.00 0.34 0.00 0.00 59.36 59.84 2yrq h GLU 63 Cb 0.49 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 2yrq h GLU 63 CO -0.35 0.75 -0.31 0.87 -1.16 0.00 0.00 179.01 178.81 2yrq h LYS 64 N 1.02 0.60 0.00 2.33 1.57 -0.52 -3.32 116.57 118.25 2yrq h LYS 64 Ca 0.26 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2yrq h LYS 64 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.30 2yrq h LYS 64 CO -0.05 0.84 0.00 0.41 -0.57 0.00 0.00 179.45 180.09 2yrq n GLY 65 N -0.17 -2.98 0.27 3.86 0.00 0.57 0.14 105.19 106.89 2yrq n GLY 65 Ca -0.01 0.56 0.04 0.00 0.00 0.00 0.00 46.02 46.62 2yrq n GLY 65 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2yrq h LYS 66 N 0.00 0.07 -0.09 1.61 2.10 -1.67 0.94 116.57 119.54 2yrq h LYS 66 Ca 0.00 -0.00 0.03 0.00 -2.00 0.00 0.00 60.65 58.67 2yrq h LYS 66 Cb 0.00 -0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 31.31 2yrq h LYS 66 CO 0.00 0.05 0.07 0.74 -2.00 0.00 0.00 179.45 178.31 2yrq h PHE 67 N 0.08 0.00 0.12 0.07 0.04 -1.01 0.80 116.94 117.03 2yrq h PHE 67 Ca 0.40 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 61.00 2yrq h PHE 67 Cb 0.68 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.85 2yrq h PHE 67 CO -0.46 0.00 -0.77 0.93 -0.60 0.00 0.00 178.31 177.41 2yrq h GLU 68 N 0.00 0.25 -0.35 1.51 4.39 0.50 -2.58 114.58 118.29 2yrq h GLU 68 Ca 0.04 -0.43 -0.07 0.00 0.34 0.00 0.00 59.36 59.24 2yrq h GLU 68 Cb 0.19 0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 2yrq h GLU 68 CO -0.00 1.21 -0.05 0.22 -1.16 0.00 0.00 179.01 179.22 2yrq h ASP 69 N -0.45 0.56 0.65 1.42 1.82 -0.31 -1.45 116.42 118.66 2yrq h ASP 69 Ca -0.14 -0.13 -0.17 0.00 -0.39 0.00 0.00 57.03 56.19 2yrq h ASP 69 Cb 1.57 -0.15 -0.02 0.00 0.68 0.00 0.00 39.33 41.42 2yrq h ASP 69 CO 0.12 0.66 -0.80 0.00 -1.61 0.00 0.00 179.24 177.62 2yrq h MET 70 N 0.55 0.11 -0.11 0.28 -0.00 -0.97 -2.97 114.93 111.81 2yrq h MET 70 Ca 0.11 -0.11 -0.07 0.00 -0.00 0.00 0.00 59.70 59.63 2yrq h MET 70 Cb 0.43 0.03 0.00 0.00 -0.00 0.00 0.00 31.60 32.06 2yrq h MET 70 CO 0.02 0.85 -0.20 0.00 -0.00 0.00 0.00 176.91 177.57 2yrq h ALA 71 N 1.12 0.18 -0.59 -3.00 0.00 -1.07 -3.18 119.26 112.72 2yrq h ALA 71 Ca -0.02 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2yrq h ALA 71 Cb 1.40 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.13 2yrq h ALA 71 CO 0.11 0.12 0.38 1.57 0.00 0.00 0.00 179.25 181.43 2yrq h LYS 72 N -0.09 0.79 -0.35 0.00 2.10 -1.34 -1.51 116.57 116.18 2yrq h LYS 72 Ca 0.01 -0.06 0.08 0.00 -2.00 0.00 0.00 60.65 58.68 2yrq h LYS 72 Cb 0.78 -0.17 -0.02 0.00 -0.90 0.00 0.00 32.23 31.92 2yrq h LYS 72 CO 0.05 0.54 0.25 0.00 -2.00 0.00 0.00 179.45 178.28 2yrq h ALA 73 N 1.61 2.20 -0.04 0.07 0.00 -1.50 -1.72 119.26 119.88 2yrq h ALA 73 Ca 0.22 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.92 2yrq h ALA 73 Cb -0.07 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.73 2yrq h ALA 73 CO -0.04 -0.29 -0.72 0.22 0.00 0.00 0.00 179.25 178.41 2yrq h ASP 74 N 0.10 0.71 0.00 0.00 3.58 -1.32 -2.82 116.42 116.67 2yrq h ASP 74 Ca 0.16 -0.71 0.00 0.00 0.42 0.00 0.00 57.03 56.90 2yrq h ASP 74 Cb 0.52 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.36 2yrq h ASP 74 CO -0.02 1.32 0.31 0.50 -2.88 0.00 0.00 179.24 178.47 2yrq h LYS 75 N 0.17 0.00 0.00 0.28 3.64 -1.18 0.23 116.57 119.70 2yrq h LYS 75 Ca -0.08 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 58.97 2yrq h LYS 75 Cb 1.39 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 33.16 2yrq h LYS 75 CO 0.14 0.00 -1.96 0.00 -2.27 0.00 0.00 179.45 175.37 2yrq n ALA 76 N -1.68 1.02 0.31 5.00 0.00 -1.17 -4.05 120.51 119.94 2yrq n ALA 76 Ca -0.01 -0.89 0.20 0.00 0.00 0.00 0.00 53.44 52.74 2yrq n ALA 76 Cb 0.34 -0.05 1.02 0.00 0.00 0.00 0.00 19.45 20.75 2yrq n ALA 76 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2yrq h ARG 77 N -1.00 0.00 -0.01 0.00 -0.00 -1.06 -1.84 114.38 110.47 2yrq h ARG 77 Ca -0.50 0.00 -0.21 0.00 -0.00 0.00 0.00 59.98 59.26 2yrq h ARG 77 Cb 1.42 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 31.38 2yrq h ARG 77 CO -0.31 0.01 -0.90 -0.92 -0.00 0.00 0.00 179.97 177.86 2yrq h TYR 78 N 0.00 0.50 0.00 4.08 5.03 -0.79 -3.16 116.97 122.63 2yrq h TYR 78 Ca -0.00 -0.27 -0.02 0.00 2.58 0.00 0.00 58.73 61.03 2yrq h TYR 78 Cb 0.16 -0.06 -0.00 0.00 1.55 0.00 0.00 36.73 38.38 2yrq h TYR 78 CO 0.00 1.08 -0.08 0.93 -1.32 0.00 0.00 178.16 178.77 2yrq h GLU 79 N 0.19 0.00 -1.18 1.82 5.08 -1.47 -2.42 114.58 116.60 2yrq h GLU 79 Ca -0.06 0.00 0.34 0.00 -1.00 0.00 0.00 59.36 58.64 2yrq h GLU 79 Cb 1.53 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.68 2yrq h GLU 79 CO 0.15 0.08 0.78 -0.09 -1.00 0.00 0.00 179.01 178.93 2yrq h ARG 80 N 0.00 0.21 0.20 2.33 2.43 -1.58 0.36 114.38 118.34 2yrq h ARG 80 Ca -0.00 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 2yrq h ARG 80 Cb 0.14 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 2yrq h ARG 80 CO 0.01 0.14 -0.10 0.93 -1.51 0.00 0.00 179.97 179.44 2yrq h GLU 81 N 0.22 -0.26 -1.16 0.20 4.39 -1.64 -3.09 114.58 113.24 2yrq h GLU 81 Ca 0.67 0.02 0.37 0.00 0.34 0.00 0.00 59.36 60.76 2yrq h GLU 81 Cb 2.04 0.06 -0.13 0.00 -0.10 0.00 0.00 28.75 30.62 2yrq h GLU 81 CO -0.28 0.09 0.73 0.52 -1.16 0.00 0.00 179.01 178.91 2yrq h MET 82 N -0.67 0.21 -0.36 2.33 2.86 -1.07 0.32 114.93 118.55 2yrq h MET 82 Ca -0.03 -0.01 0.06 0.00 -2.06 0.00 0.00 59.70 57.66 2yrq h MET 82 Cb 0.47 -0.05 -0.06 0.00 0.06 0.00 0.00 31.60 32.03 2yrq h MET 82 CO 0.05 0.14 0.01 -0.22 1.06 0.00 0.00 176.91 177.94 2yrq h LYS 83 N 0.21 0.10 0.00 1.72 3.11 -1.40 0.06 116.57 120.38 2yrq h LYS 83 Ca 0.75 -0.01 -0.01 0.00 -2.81 0.00 0.00 60.65 58.57 2yrq h LYS 83 Cb 2.09 -0.02 -0.00 0.00 -1.00 0.00 0.00 32.23 33.29 2yrq h LYS 83 CO -0.45 0.07 -0.04 1.79 -2.81 0.00 0.00 179.45 178.02 2yrq h THR 84 N 0.11 0.10 -2.93 1.00 1.35 -0.47 -3.43 112.91 108.64 2yrq h THR 84 Ca 0.18 -0.57 -0.62 0.00 -0.55 0.00 0.00 66.41 64.84 2yrq h THR 84 Cb 0.24 1.52 -0.06 0.00 -1.73 0.00 0.00 68.15 68.12 2yrq h THR 84 CO -0.29 0.03 -0.28 -0.47 -0.25 0.00 0.00 175.52 174.27 2yrq s TYR 85 N -3.71 3.68 -0.35 4.73 5.04 0.01 -5.07 117.35 121.68 2yrq s TYR 85 Ca 0.01 0.85 0.02 0.00 -2.44 0.00 0.00 57.07 55.51 2yrq s TYR 85 Cb 0.09 -2.18 0.11 0.00 0.35 0.00 0.00 41.96 40.33 2yrq s TYR 85 CO 0.55 0.66 0.10 0.42 -1.34 0.00 0.00 175.55 175.93 2yrq s ILE 86 N -1.10 1.83 1.02 3.14 1.01 -1.26 -4.85 121.20 120.98 2yrq s ILE 86 Ca 0.22 -2.17 -0.13 0.00 0.00 0.00 0.00 60.65 58.58 2yrq s ILE 86 Cb -0.15 -2.35 0.20 0.00 0.01 0.00 0.00 42.46 40.17 2yrq s ILE 86 CO 0.12 -0.66 1.09 -2.16 0.00 0.00 0.00 174.94 173.33 2yrq s PRO 87 N 0.97 0.28 0.62 2.79 0.04 -1.26 -5.05 135.00 133.39 2yrq s PRO 87 Ca 0.12 0.48 -0.10 0.00 0.04 0.00 0.00 61.00 61.53 2yrq s PRO 87 Cb -0.19 -1.72 0.15 0.00 0.04 0.00 0.00 34.50 32.78 2yrq s PRO 87 CO -0.12 -2.82 0.55 -0.35 0.04 0.00 0.00 177.00 174.30 2yrq n PRO 88 N -4.23 -2.10 -3.40 0.56 -0.04 -1.26 -5.01 135.00 119.51 2yrq n PRO 88 Ca 0.05 -0.89 -0.38 0.00 -0.04 0.00 0.00 63.50 62.25 2yrq n PRO 88 Cb 0.57 -0.83 -0.07 0.00 -0.04 0.00 0.00 33.50 33.14 2yrq n PRO 88 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 2yrq s LYS 89 N -4.26 4.26 -0.39 0.54 0.00 -1.26 -4.95 119.74 113.68 2yrq s LYS 89 Ca 0.36 0.26 0.09 0.00 0.00 0.00 0.00 55.97 56.68 2yrq s LYS 89 Cb -0.04 -3.47 0.37 0.00 0.00 0.00 0.00 37.83 34.69 2yrq s LYS 89 CO 0.28 0.10 1.35 0.41 0.00 0.00 0.00 175.35 177.48 2yrq n GLY 90 N 3.55 1.24 3.75 0.59 0.00 -1.26 -5.13 105.19 107.94 2yrq n GLY 90 Ca -0.09 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.43 2yrq n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yrq s GLU 91 N 0.19 4.36 -0.36 1.61 0.41 -1.26 -5.05 118.70 118.59 2yrq s GLU 91 Ca 0.20 0.80 -0.11 0.00 -0.41 0.00 0.00 54.97 55.45 2yrq s GLU 91 Cb 0.38 -3.36 0.02 0.00 -1.78 0.00 0.00 34.13 29.40 2yrq s GLU 91 CO -0.09 0.32 0.20 0.95 -0.49 0.00 0.00 175.26 176.15 2yrq s THR 92 N -0.06 4.55 -1.66 3.63 -4.23 -1.26 -4.62 115.64 111.99 2yrq s THR 92 Ca 0.33 -0.81 -0.12 0.00 -1.18 0.00 0.00 61.69 59.90 2yrq s THR 92 Cb -0.18 -3.51 0.12 0.00 1.34 0.00 0.00 72.50 70.27 2yrq s THR 92 CO 0.18 -0.19 0.31 0.29 -0.54 0.00 0.00 174.62 174.67 2yrq n LYS 93 N 4.99 -0.82 -3.18 3.99 4.01 -1.26 -4.91 118.16 120.97 2yrq n LYS 93 Ca -0.12 0.11 -0.21 0.00 -0.51 0.00 0.00 58.31 57.58 2yrq n LYS 93 Cb 0.46 -4.01 0.05 0.00 -0.51 0.00 0.00 35.03 31.02 2yrq n LYS 93 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 2yrq n LYS 94 N -4.14 0.63 -2.33 1.97 4.76 -1.26 -4.50 118.16 113.29 2yrq n LYS 94 Ca -0.08 -3.17 -0.05 0.00 -2.87 0.00 0.00 58.31 52.14 2yrq n LYS 94 Cb 0.54 -0.07 -0.01 0.00 -1.84 0.00 0.00 35.03 33.65 2yrq n LYS 94 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2yrq n LYS 95 N -2.11 -2.25 -3.02 1.97 4.01 -1.26 -4.84 118.16 110.66 2yrq n LYS 95 Ca 0.11 0.02 -0.20 0.00 -0.51 0.00 0.00 58.31 57.72 2yrq n LYS 95 Cb 0.60 -3.48 0.01 0.00 -0.51 0.00 0.00 35.03 31.65 2yrq n LYS 95 CO 0.00 0.00 0.00 0.12 -1.11 0.00 0.00 177.40 176.41 2yrq s PHE 96 N -1.73 3.03 0.31 2.13 5.36 -1.26 -5.09 117.98 120.73 2yrq s PHE 96 Ca 0.10 -0.04 -0.25 0.00 -0.96 0.00 0.00 56.93 55.78 2yrq s PHE 96 Cb -0.06 -2.36 -0.10 0.00 -0.34 0.00 0.00 43.02 40.16 2yrq s PHE 96 CO 0.13 -0.42 0.91 0.15 -1.46 0.00 0.00 175.22 174.53 2yrq s LYS 97 N -4.48 4.54 -0.11 10.12 3.01 -1.26 -5.07 119.74 126.48 2yrq s LYS 97 Ca 0.51 1.26 -0.07 0.00 -1.01 0.00 0.00 55.97 56.66 2yrq s LYS 97 Cb -0.10 -2.82 0.04 0.00 -1.01 0.00 0.00 37.83 33.94 2yrq s LYS 97 CO 0.36 0.30 0.28 -0.51 0.51 0.00 0.00 175.35 176.29 2yrq s ASP 98 N -1.62 -0.31 0.33 2.83 1.01 -1.26 -5.04 116.67 112.61 2yrq s ASP 98 Ca 0.49 0.59 0.12 0.00 0.71 0.00 0.00 52.55 54.46 2yrq s ASP 98 Cb -0.18 0.50 0.56 0.00 1.01 0.00 0.00 42.92 44.81 2yrq s ASP 98 CO 0.23 -0.15 1.73 1.55 0.21 0.00 0.00 175.17 178.74 2yrq h PRO 99 N 6.78 0.00 -0.01 8.23 0.13 -1.99 -3.22 132.00 141.92 2yrq h PRO 99 Ca -0.36 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2yrq h PRO 99 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 2yrq h PRO 99 CO 0.35 0.48 -0.01 -0.91 -0.23 0.00 0.00 178.00 177.68 2yrq h ASN 100 N 0.00 0.03 -3.86 1.44 2.35 -2.04 -3.45 115.58 110.06 2yrq h ASN 100 Ca -0.00 -0.54 -0.49 0.00 -0.55 0.00 0.00 56.30 54.72 2yrq h ASN 100 Cb 0.86 -0.01 0.01 0.00 0.05 0.00 0.00 38.32 39.23 2yrq h ASN 100 CO 0.06 0.56 0.20 0.00 -1.65 0.00 0.00 177.43 176.60 2yrq s ALA 101 N -4.05 3.26 0.22 -0.83 0.00 -1.22 -5.03 121.76 114.11 2yrq s ALA 101 Ca -0.16 -0.09 -0.30 0.00 0.00 0.00 0.00 51.96 51.41 2yrq s ALA 101 Cb 0.01 -2.83 -0.09 0.00 0.00 0.00 0.00 23.12 20.21 2yrq s ALA 101 CO 0.68 -0.10 1.29 -1.25 0.00 0.00 0.00 175.76 176.38 2yrq s PRO 102 N -3.96 4.41 0.33 0.00 0.04 -1.26 -4.68 135.00 129.88 2yrq s PRO 102 Ca 0.53 2.05 -0.29 0.00 0.04 0.00 0.00 61.00 63.33 2yrq s PRO 102 Cb -0.10 -3.18 -0.11 0.00 0.04 0.00 0.00 34.50 31.15 2yrq s PRO 102 CO 0.32 -0.20 1.45 0.15 0.04 0.00 0.00 177.00 178.77 2yrq s LYS 103 N -0.47 4.20 0.08 4.56 -0.14 -1.26 -4.99 119.74 121.71 2yrq s LYS 103 Ca 0.54 2.44 -0.22 0.00 -1.36 0.00 0.00 55.97 57.38 2yrq s LYS 103 Cb -0.36 -3.02 -0.07 0.00 -1.68 0.00 0.00 37.83 32.70 2yrq s LYS 103 CO 0.40 -0.45 0.65 1.03 -0.76 0.00 0.00 175.35 176.23 2yrq s ARG 104 N -1.48 4.36 0.90 1.68 0.52 -1.26 -4.92 118.95 118.74 2yrq s ARG 104 Ca 0.55 0.89 -0.12 0.00 -0.52 0.00 0.00 55.73 56.53 2yrq s ARG 104 Cb -0.44 -3.28 0.13 0.00 0.52 0.00 0.00 34.95 31.88 2yrq s ARG 104 CO 0.55 0.53 1.09 -1.25 0.02 0.00 0.00 175.30 176.24 2yrq s PRO 105 N -0.81 1.24 0.87 3.54 0.04 -1.26 -5.03 135.00 133.59 2yrq s PRO 105 Ca 0.32 0.82 -0.11 0.00 0.04 0.00 0.00 61.00 62.07 2yrq s PRO 105 Cb -0.20 -1.81 0.11 0.00 0.04 0.00 0.00 34.50 32.64 2yrq s PRO 105 CO 0.21 -2.25 1.09 -1.25 0.04 0.00 0.00 177.00 174.84 2yrq s PRO 106 N -4.93 1.46 0.45 0.56 0.04 -1.26 -5.04 135.00 126.28 2yrq s PRO 106 Ca 0.63 0.90 0.05 0.00 0.04 0.00 0.00 61.00 62.62 2yrq s PRO 106 Cb -0.18 -1.83 -0.05 0.00 0.04 0.00 0.00 34.50 32.48 2yrq s PRO 106 CO 0.57 -2.12 0.01 -1.12 0.04 0.00 0.00 177.00 174.38 2yrq s SER 107 N -3.41 3.98 0.24 6.66 0.01 -1.26 -4.87 113.70 115.05 2yrq s SER 107 Ca 0.63 -1.48 -0.11 0.00 1.31 0.00 0.00 55.95 56.30 2yrq s SER 107 Cb -0.18 -0.04 0.34 0.00 0.21 0.00 0.00 66.02 66.35 2yrq s SER 107 CO 0.57 -0.61 1.60 0.00 0.41 0.00 0.00 173.24 175.20 2yrq h ALA 108 N 1.60 0.53 -0.69 1.44 0.00 -1.88 0.40 119.26 120.66 2yrq h ALA 108 Ca -0.44 0.31 0.05 0.00 0.00 0.00 0.00 54.91 54.83 2yrq h ALA 108 Cb 1.27 0.61 -0.05 0.00 0.00 0.00 0.00 17.79 19.62 2yrq h ALA 108 CO 0.78 -0.40 0.40 0.35 0.00 0.00 0.00 179.25 180.38 2yrq h PHE 109 N -0.00 0.74 -0.47 0.00 3.57 -1.96 0.59 116.94 119.41 2yrq h PHE 109 Ca 0.38 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.80 2yrq h PHE 109 Cb 0.58 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 2yrq h PHE 109 CO -0.63 0.38 -0.12 0.35 -2.23 0.00 0.00 178.31 176.06 2yrq h PHE 110 N 0.76 0.98 -0.29 0.41 3.57 -0.80 0.11 116.94 121.67 2yrq h PHE 110 Ca 0.30 -0.19 -0.11 0.00 3.53 0.00 0.00 57.97 61.50 2yrq h PHE 110 Cb 0.13 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 2yrq h PHE 110 CO -0.06 0.94 -0.26 -0.07 -2.23 0.00 0.00 178.31 176.63 2yrq h LEU 111 N 0.79 0.59 0.14 0.59 3.38 0.29 0.39 115.31 121.48 2yrq h LEU 111 Ca 0.13 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2yrq h LEU 111 Cb 0.64 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2yrq h LEU 111 CO 0.04 0.83 -0.07 0.15 0.09 0.00 0.00 178.44 179.49 2yrq h PHE 112 N 0.51 -0.17 -0.03 1.13 3.57 -0.70 -2.00 116.94 119.25 2yrq h PHE 112 Ca 0.07 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 2yrq h PHE 112 Cb 0.72 0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.51 2yrq h PHE 112 CO 0.03 0.22 -0.00 0.00 -2.23 0.00 0.00 178.31 176.32 2yrq h SER 114 N 0.05 0.82 1.59 0.00 0.87 -0.98 0.12 113.55 116.01 2yrq h SER 114 Ca 0.01 -0.61 0.00 0.00 -1.23 0.00 0.00 61.79 59.96 2yrq h SER 114 Cb 0.04 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 61.75 2yrq h SER 114 CO 0.00 1.41 0.00 -0.08 -0.53 0.00 0.00 176.83 177.63 2yrq h GLU 115 N 0.40 0.00 0.00 2.24 4.57 -0.64 -3.22 114.58 117.93 2yrq h GLU 115 Ca -0.09 0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 57.91 2yrq h GLU 115 Cb 1.56 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 30.11 2yrq h GLU 115 CO 0.18 0.00 -2.04 0.66 -1.18 0.00 0.00 179.01 176.63 2yrq n TYR 116 N -2.57 0.19 -0.06 0.92 4.02 0.23 -4.34 117.16 115.55 2yrq n TYR 116 Ca 0.05 0.06 -0.08 0.00 -0.01 0.00 0.00 57.90 57.92 2yrq n TYR 116 Cb 0.45 -0.82 -0.01 0.00 -0.02 0.00 0.00 39.34 38.93 2yrq n TYR 116 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 2yrq h ARG 117 N 0.00 -0.16 0.00 -0.72 2.43 -0.76 0.19 114.38 115.35 2yrq h ARG 117 Ca -0.26 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 2yrq h ARG 117 Cb 1.62 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 31.21 2yrq h ARG 117 CO 0.02 -0.11 0.00 -0.35 -1.51 0.00 0.00 179.97 178.02 2yrq n PRO 118 N -5.34 0.14 -0.12 0.20 -0.04 -1.26 -0.55 135.00 128.03 2yrq n PRO 118 Ca -0.00 0.18 -0.23 0.00 -0.04 0.00 0.00 63.50 63.41 2yrq n PRO 118 Cb 0.26 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.12 2yrq n PRO 118 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2yrq n LYS 119 N -1.36 0.56 0.08 0.54 5.02 0.39 -4.12 118.16 119.28 2yrq n LYS 119 Ca 0.06 0.41 -0.14 0.00 -2.02 0.00 0.00 58.31 56.62 2yrq n LYS 119 Cb 0.13 -1.61 -0.06 0.00 -0.02 0.00 0.00 35.03 33.47 2yrq n LYS 119 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 2yrq h ILE 120 N -1.00 1.43 -0.72 -0.18 3.07 -0.79 -3.11 117.51 116.20 2yrq h ILE 120 Ca -0.45 -2.60 0.09 0.00 1.55 0.00 0.00 64.86 63.45 2yrq h ILE 120 Cb 1.35 2.55 -0.07 0.00 -0.27 0.00 0.00 36.82 40.38 2yrq h ILE 120 CO -0.27 0.77 0.36 0.50 -1.05 0.00 0.00 178.15 178.46 2yrq h LYS 121 N 0.19 0.60 -0.34 0.16 3.64 -1.02 0.36 116.57 120.16 2yrq h LYS 121 Ca -0.09 -0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 59.09 2yrq h LYS 121 Cb 1.67 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 33.35 2yrq h LYS 121 CO 0.17 0.40 -0.42 0.78 -2.27 0.00 0.00 179.45 178.11 2yrq h GLY 122 N 0.62 0.93 1.56 5.01 0.00 -1.71 -3.14 103.07 106.34 2yrq h GLY 122 Ca 0.35 -0.97 -0.13 0.00 0.00 0.00 0.00 47.33 46.58 2yrq h GLY 122 CO -0.26 0.87 -0.44 0.83 0.00 0.00 0.00 176.54 177.54 2yrq h GLU 123 N 0.69 0.49 -3.74 4.80 4.39 -1.30 -3.38 114.58 116.52 2yrq h GLU 123 Ca 0.05 -0.26 -0.65 0.00 0.34 0.00 0.00 59.36 58.84 2yrq h GLU 123 Cb 1.00 0.01 -0.40 0.00 -0.10 0.00 0.00 28.75 29.26 2yrq h GLU 123 CO 0.10 0.83 -0.64 -1.01 -1.16 0.00 0.00 179.01 177.14 2yrq s HIS 124 N -4.15 3.35 0.16 4.33 3.76 0.12 -4.95 115.29 117.90 2yrq s HIS 124 Ca -0.07 -3.10 -0.09 0.00 -0.15 0.00 0.00 55.06 51.66 2yrq s HIS 124 Cb 0.12 -2.88 0.00 0.00 1.11 0.00 0.00 32.58 30.94 2yrq s HIS 124 CO 0.82 -0.80 1.50 -1.00 -0.85 0.00 0.00 174.74 174.40 2yrq h PRO 125 N 6.83 0.88 -0.80 8.40 0.13 -1.74 -3.22 132.00 142.48 2yrq h PRO 125 Ca -0.07 -0.46 0.19 0.00 -0.87 0.00 0.00 66.00 64.79 2yrq h PRO 125 Cb 0.93 0.02 -0.13 0.00 0.13 0.00 0.00 31.00 31.95 2yrq h PRO 125 CO 0.65 1.11 0.17 0.78 -0.23 0.00 0.00 178.00 180.48 2yrq h GLY 126 N 0.83 1.12 -1.01 1.56 0.00 -1.92 -3.41 103.07 100.23 2yrq h GLY 126 Ca 0.06 -0.01 -0.33 0.00 0.00 0.00 0.00 47.33 47.05 2yrq h GLY 126 CO 0.09 -0.28 -0.20 1.04 0.00 0.00 0.00 176.54 177.19 2yrq n LEU 127 N -5.22 -0.79 -3.90 3.11 4.77 -1.22 -5.06 117.00 108.69 2yrq n LEU 127 Ca 0.17 -0.66 -0.09 0.00 -0.03 0.00 0.00 56.01 55.39 2yrq n LEU 127 Cb 0.55 -0.97 -0.09 0.00 -2.33 0.00 0.00 43.42 40.58 2yrq n LEU 127 CO 0.09 -4.10 -0.17 -0.44 -1.33 0.00 0.00 177.39 171.43 2yrq s SER 128 N -2.68 0.14 0.23 -1.43 0.01 -1.26 -4.94 113.70 103.78 2yrq s SER 128 Ca 0.59 -0.53 0.06 0.00 1.31 0.00 0.00 55.95 57.38 2yrq s SER 128 Cb -0.12 0.26 0.68 0.00 0.21 0.00 0.00 66.02 67.05 2yrq s SER 128 CO 0.51 -0.56 1.11 -0.38 0.41 0.00 0.00 173.24 174.34 2yrq n ILE 129 N 0.59 -0.30 0.22 1.44 5.41 -1.26 -0.00 119.36 125.46 2yrq n ILE 129 Ca -0.18 1.52 -0.09 0.00 1.00 0.00 0.00 62.75 65.00 2yrq n ILE 129 Cb 0.59 -2.30 -0.04 0.00 -0.71 0.00 0.00 39.64 37.18 2yrq n ILE 129 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2yrq h GLY 130 N 0.00 -0.61 0.50 7.39 0.00 -2.00 -2.98 103.07 105.37 2yrq h GLY 130 Ca 0.49 0.23 -0.01 0.00 0.00 0.00 0.00 47.33 48.04 2yrq h GLY 130 CO -0.62 -0.22 -0.46 -0.55 0.00 0.00 0.00 176.54 174.68 2yrq h ASP 131 N -0.70 -1.29 -0.73 0.19 5.19 -1.24 -1.77 116.42 116.08 2yrq h ASP 131 Ca -0.06 0.11 0.13 0.00 -0.62 0.00 0.00 57.03 56.59 2yrq h ASP 131 Cb 0.45 0.44 -0.13 0.00 0.18 0.00 0.00 39.33 40.27 2yrq h ASP 131 CO 0.10 -0.61 -0.24 0.52 -3.12 0.00 0.00 179.24 175.89 2yrq n VAL 132 N -5.53 -0.35 -0.02 -1.35 0.31 1.00 0.93 118.33 113.32 2yrq n VAL 132 Ca -0.11 1.69 -0.12 0.00 -0.01 0.00 0.00 64.34 65.80 2yrq n VAL 132 Cb 0.43 -2.29 -0.07 0.00 -0.91 0.00 0.00 33.84 31.01 2yrq n VAL 132 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2yrq h ALA 133 N 1.22 0.12 -0.07 3.52 0.00 -1.31 -2.43 119.26 120.31 2yrq h ALA 133 Ca 0.30 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.10 2yrq h ALA 133 Cb 0.48 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 2yrq h ALA 133 CO -0.74 -0.25 0.20 0.87 0.00 0.00 0.00 179.25 179.34 2yrq h LYS 134 N -0.06 0.00 0.01 0.00 1.79 0.14 0.18 116.57 118.63 2yrq h LYS 134 Ca 0.03 0.00 -0.21 0.00 -2.18 0.00 0.00 60.65 58.29 2yrq h LYS 134 Cb 0.25 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.87 2yrq h LYS 134 CO 0.00 0.00 -1.00 -0.22 -1.08 0.00 0.00 179.45 177.15 2yrq h LYS 135 N 0.00 0.02 0.00 3.15 3.64 -0.19 -3.20 116.57 119.99 2yrq h LYS 135 Ca 0.04 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2yrq h LYS 135 Cb 0.44 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 2yrq h LYS 135 CO -0.00 1.00 0.00 -0.07 -2.27 0.00 0.00 179.45 178.11 2yrq h LEU 136 N 0.01 0.00 -1.43 5.20 3.38 -0.48 -3.24 115.31 118.75 2yrq h LEU 136 Ca -0.02 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.08 2yrq h LEU 136 Cb 1.75 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.44 2yrq h LEU 136 CO 0.13 0.00 0.53 1.23 0.09 0.00 0.00 178.44 180.42 2yrq h GLY 137 N 3.44 0.95 0.76 0.83 0.00 -1.46 -2.04 103.07 105.55 2yrq h GLY 137 Ca 0.00 -0.25 -0.34 0.00 0.00 0.00 0.00 47.33 46.74 2yrq h GLY 137 CO 0.00 0.10 -1.88 1.05 0.00 0.00 0.00 176.54 175.80 2yrq h GLU 138 N 0.58 0.20 -0.75 4.80 9.09 -1.76 -3.33 114.58 123.42 2yrq h GLU 138 Ca 0.39 -0.34 0.15 0.00 0.05 0.00 0.00 59.36 59.61 2yrq h GLU 138 Cb 0.71 0.13 -0.10 0.00 -1.65 0.00 0.00 28.75 27.84 2yrq h GLU 138 CO -0.15 1.02 0.28 0.52 0.05 0.00 0.00 179.01 180.73 2yrq h MET 139 N 0.05 0.40 -0.06 1.06 2.86 -1.46 -1.50 114.93 116.29 2yrq h MET 139 Ca -0.37 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.24 2yrq h MET 139 Cb 2.03 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 33.60 2yrq h MET 139 CO 0.10 0.26 0.02 2.35 1.06 0.00 0.00 176.91 180.70 2yrq h TRP 140 N 0.41 0.10 -0.90 -0.22 -0.00 -1.55 -1.00 115.95 112.78 2yrq h TRP 140 Ca 0.41 -0.01 0.19 0.00 -0.00 0.00 0.00 58.89 59.49 2yrq h TRP 140 Cb 0.64 -0.03 -0.11 0.00 -0.00 0.00 0.00 29.16 29.66 2yrq h TRP 140 CO -0.18 0.27 0.46 -0.91 -0.00 0.00 0.00 178.44 178.08 2yrq h ASN 141 N -0.11 0.49 -0.20 2.65 2.35 -1.41 -0.18 115.58 119.17 2yrq h ASN 141 Ca 0.02 0.12 -0.21 0.00 -0.55 0.00 0.00 56.30 55.69 2yrq h ASN 141 Cb 0.22 0.06 0.01 0.00 0.05 0.00 0.00 38.32 38.66 2yrq h ASN 141 CO -0.00 0.12 -0.68 0.78 -1.65 0.00 0.00 177.43 176.01 2yrq h ASN 142 N 0.54 0.95 -1.36 5.81 2.35 -1.15 -3.46 115.58 119.27 2yrq h ASN 142 Ca 0.54 -0.59 -0.67 0.00 -0.55 0.00 0.00 56.30 55.02 2yrq h ASN 142 Cb 0.91 -0.28 0.10 0.00 0.05 0.00 0.00 38.32 39.10 2yrq h ASN 142 CO -0.44 1.38 -0.27 0.41 -1.65 0.00 0.00 177.43 176.85 2yrq n THR 143 N -3.98 1.67 -2.64 2.81 -1.04 -0.08 -4.90 114.28 106.12 2yrq n THR 143 Ca -0.06 -0.42 -0.36 0.00 -2.04 0.00 0.00 64.05 61.17 2yrq n THR 143 Cb 0.70 -0.26 -0.05 0.00 -1.82 0.00 0.00 70.33 68.89 2yrq n THR 143 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2yrq s ALA 144 N -0.82 3.09 0.22 2.41 0.00 -1.26 -4.95 121.76 120.45 2yrq s ALA 144 Ca 0.67 0.61 -0.09 0.00 0.00 0.00 0.00 51.96 53.16 2yrq s ALA 144 Cb -0.92 -3.23 0.36 0.00 0.00 0.00 0.00 23.12 19.32 2yrq s ALA 144 CO 0.56 -0.08 1.67 0.00 0.00 0.00 0.00 175.76 177.92 2yrq h ALA 145 N 2.51 0.74 -0.69 0.00 0.00 -1.96 -0.31 119.26 119.55 2yrq h ALA 145 Ca -0.48 0.18 0.14 0.00 0.00 0.00 0.00 54.91 54.74 2yrq h ALA 145 Cb 1.21 0.28 -0.10 0.00 0.00 0.00 0.00 17.79 19.18 2yrq h ALA 145 CO 0.62 -0.37 0.18 -0.44 0.00 0.00 0.00 179.25 179.25 2yrq h ASP 146 N 0.18 0.06 -0.01 0.00 5.19 -2.01 0.52 116.42 120.36 2yrq h ASP 146 Ca 0.36 0.13 0.00 0.00 -0.62 0.00 0.00 57.03 56.89 2yrq h ASP 146 Cb 0.58 0.16 -0.00 0.00 0.18 0.00 0.00 39.33 40.25 2yrq h ASP 146 CO -0.51 0.01 0.02 0.44 -3.12 0.00 0.00 179.24 176.08 2yrq h ASP 147 N 0.30 0.00 -0.33 6.45 3.32 -1.43 0.25 116.42 124.97 2yrq h ASP 147 Ca 0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.43 2yrq h ASP 147 Cb 0.60 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.15 2yrq h ASP 147 CO -0.45 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 177.36 2yrq n LYS 148 N -3.27 1.94 0.22 3.56 5.02 0.18 -4.39 118.16 121.41 2yrq n LYS 148 Ca -0.03 -1.44 -0.17 0.00 -2.02 0.00 0.00 58.31 54.65 2yrq n LYS 148 Cb 0.10 -1.37 -0.09 0.00 -0.02 0.00 0.00 35.03 33.65 2yrq n LYS 148 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 2yrq h GLN 149 N 2.56 -0.82 -0.21 1.97 4.15 -0.33 0.70 115.11 123.12 2yrq h GLN 149 Ca 0.00 0.06 -0.09 0.00 0.77 0.00 0.00 58.65 59.39 2yrq h GLN 149 Cb 0.58 0.19 -0.00 0.00 0.21 0.00 0.00 27.48 28.45 2yrq h GLN 149 CO 0.00 -0.55 -0.21 -1.00 -1.93 0.00 0.00 178.83 175.14 2yrq h PRO 150 N -0.85 0.52 -0.14 -2.39 0.13 -1.80 0.07 132.00 127.54 2yrq h PRO 150 Ca -0.03 -0.27 0.04 0.00 -0.87 0.00 0.00 66.00 64.87 2yrq h PRO 150 Cb 0.79 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.92 2yrq h PRO 150 CO -0.14 0.86 0.13 1.88 -0.23 0.00 0.00 178.00 180.50 2yrq h TYR 151 N 0.21 0.00 0.00 1.56 0.05 -1.77 -1.70 116.97 115.32 2yrq h TYR 151 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.81 2yrq h TYR 151 Cb 0.76 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.50 2yrq h TYR 151 CO 0.08 0.00 -0.42 0.39 -1.05 0.00 0.00 178.16 177.16 2yrq n GLU 152 N -4.03 0.35 -0.35 4.88 -0.58 0.23 -3.11 120.64 118.03 2yrq n GLU 152 Ca 0.00 0.44 0.00 0.00 -0.42 0.00 0.00 57.16 57.19 2yrq n GLU 152 Cb 0.25 -1.46 0.06 0.00 -0.57 0.00 0.00 31.44 29.72 2yrq n GLU 152 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2yrq h LYS 153 N -0.77 -0.02 0.25 3.49 1.79 -0.95 0.57 116.57 120.93 2yrq h LYS 153 Ca 0.00 0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.48 2yrq h LYS 153 Cb 0.42 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.04 2yrq h LYS 153 CO 0.00 -0.01 -0.37 -0.22 -1.08 0.00 0.00 179.45 177.77 2yrq h LYS 154 N -0.02 -0.65 -0.77 3.15 3.11 -1.53 -2.54 116.57 117.32 2yrq h LYS 154 Ca 0.36 0.04 0.16 0.00 -2.81 0.00 0.00 60.65 58.41 2yrq h LYS 154 Cb 0.62 0.15 -0.14 0.00 -1.00 0.00 0.00 32.23 31.85 2yrq h LYS 154 CO -0.96 -0.44 -0.14 0.00 -2.81 0.00 0.00 179.45 175.11 2yrq h ALA 155 N -0.17 0.59 -0.91 5.00 0.00 -1.01 -0.26 119.26 122.50 2yrq h ALA 155 Ca -0.00 0.29 0.15 0.00 0.00 0.00 0.00 54.91 55.35 2yrq h ALA 155 Cb 0.65 0.54 -0.16 0.00 0.00 0.00 0.00 17.79 18.83 2yrq h ALA 155 CO -0.14 -0.42 -0.34 0.00 0.00 0.00 0.00 179.25 178.35 2yrq h ALA 156 N 1.76 0.24 -0.41 0.00 0.00 -0.79 0.22 119.26 120.28 2yrq h ALA 156 Ca 0.39 0.28 0.08 0.00 0.00 0.00 0.00 54.91 55.66 2yrq h ALA 156 Cb 0.62 0.90 -0.08 0.00 0.00 0.00 0.00 17.79 19.22 2yrq h ALA 156 CO -0.76 -0.57 -0.16 0.87 0.00 0.00 0.00 179.25 178.63 2yrq h LYS 157 N -0.03 -0.08 -0.32 0.00 1.57 -1.03 -1.75 116.57 114.94 2yrq h LYS 157 Ca 0.35 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 59.20 2yrq h LYS 157 Cb 0.61 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.88 2yrq h LYS 157 CO -0.93 -0.05 -0.08 -0.07 -0.57 0.00 0.00 179.45 177.74 2yrq h LEU 158 N -0.08 -0.31 -0.95 2.94 3.38 -0.55 -2.00 115.31 117.74 2yrq h LEU 158 Ca 0.20 0.10 0.24 0.00 0.09 0.00 0.00 57.88 58.50 2yrq h LEU 158 Cb 0.38 0.20 -0.18 0.00 0.09 0.00 0.00 40.66 41.16 2yrq h LEU 158 CO -0.46 -0.11 -0.07 1.17 0.09 0.00 0.00 178.44 179.05 2yrq n LYS 159 N -5.27 -0.08 -0.35 1.13 4.81 -0.62 -0.16 118.16 117.62 2yrq n LYS 159 Ca 0.00 1.44 -0.05 0.00 -0.87 0.00 0.00 58.31 58.84 2yrq n LYS 159 Cb 0.18 -2.24 -0.00 0.00 0.02 0.00 0.00 35.03 32.99 2yrq n LYS 159 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 2yrq h GLU 160 N 0.00 -0.05 -0.86 1.64 4.39 -1.29 0.58 114.58 119.00 2yrq h GLU 160 Ca 0.53 0.00 0.22 0.00 0.34 0.00 0.00 59.36 60.45 2yrq h GLU 160 Cb 1.01 0.01 -0.13 0.00 -0.10 0.00 0.00 28.75 29.54 2yrq h GLU 160 CO -0.92 -0.03 0.29 0.87 -1.16 0.00 0.00 179.01 178.06 2yrq h LYS 161 N -0.05 0.29 0.17 2.33 1.79 -0.68 0.12 116.57 120.53 2yrq h LYS 161 Ca 0.27 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.72 2yrq h LYS 161 Cb 0.55 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.14 2yrq h LYS 161 CO -0.91 0.19 -0.08 -0.92 -1.08 0.00 0.00 179.45 176.65 2yrq h TYR 162 N 0.30 -0.21 -0.52 -1.35 3.20 0.03 -1.92 116.97 116.51 2yrq h TYR 162 Ca 0.53 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.55 2yrq h TYR 162 Cb 1.02 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 39.34 2yrq h TYR 162 CO -0.21 0.17 0.45 0.93 -1.64 0.00 0.00 178.16 177.86 2yrq h GLU 163 N -0.66 0.00 0.16 1.82 5.08 0.28 0.15 114.58 121.42 2yrq h GLU 163 Ca -0.02 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.08 2yrq h GLU 163 Cb 0.48 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.76 2yrq h GLU 163 CO 0.04 0.00 -1.08 0.87 -1.00 0.00 0.00 179.01 177.84 2yrq h LYS 164 N 0.00 0.46 0.33 2.33 1.79 -0.67 -2.95 116.57 117.84 2yrq h LYS 164 Ca 0.25 -0.70 -0.02 0.00 -2.18 0.00 0.00 60.65 58.00 2yrq h LYS 164 Cb 1.14 0.25 0.00 0.00 -1.58 0.00 0.00 32.23 32.04 2yrq h LYS 164 CO -0.00 1.32 -0.16 -0.44 -1.08 0.00 0.00 179.45 179.09 2yrq h ASP 165 N -0.05 -0.37 -0.96 0.86 3.32 -0.21 -3.18 116.42 115.84 2yrq h ASP 165 Ca -0.18 -0.18 0.16 0.00 0.02 0.00 0.00 57.03 56.86 2yrq h ASP 165 Cb 1.82 0.10 -0.08 0.00 0.22 0.00 0.00 39.33 41.39 2yrq h ASP 165 CO 0.20 0.03 0.60 -0.29 -1.72 0.00 0.00 179.24 178.07 2yrq h ILE 166 N -0.84 0.78 -0.87 0.35 2.10 -0.95 -0.61 117.51 117.46 2yrq h ILE 166 Ca -0.04 -0.25 0.25 0.00 1.08 0.00 0.00 64.86 65.90 2yrq h ILE 166 Cb 0.52 -0.01 -0.03 0.00 -1.09 0.00 0.00 36.82 36.21 2yrq h ILE 166 CO 0.07 0.13 1.11 0.00 -1.08 0.00 0.00 178.15 178.39 2yrq h ALA 167 N 1.60 2.79 0.03 0.18 0.00 -1.49 0.51 119.26 122.88 2yrq h ALA 167 Ca 0.51 -0.03 -0.29 0.00 0.00 0.00 0.00 54.91 55.10 2yrq h ALA 167 Cb 0.81 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 2yrq h ALA 167 CO -0.27 -1.56 -1.59 0.00 0.00 0.00 0.00 179.25 175.83 2yrq n ALA 168 N -2.18 0.86 -0.30 0.00 0.00 -0.24 -2.79 120.51 115.85 2yrq n ALA 168 Ca 0.19 -0.57 0.01 0.00 0.00 0.00 0.00 53.44 53.07 2yrq n ALA 168 Cb 1.38 -0.53 0.08 0.00 0.00 0.00 0.00 19.45 20.37 2yrq n ALA 168 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2yrq h TYR 169 N -0.69 -0.68 0.02 0.00 5.03 -0.03 -1.67 116.97 118.96 2yrq h TYR 169 Ca -0.40 0.08 -0.07 0.00 2.58 0.00 0.00 58.73 60.92 2yrq h TYR 169 Cb 1.54 0.42 0.01 0.00 1.55 0.00 0.00 36.73 40.25 2yrq h TYR 169 CO 0.08 -0.38 -0.30 0.07 -1.32 0.00 0.00 178.16 176.31 2yrq h ARG 170 N -0.03 0.16 -5.88 1.82 0.11 -1.67 -3.48 114.38 105.41 2yrq h ARG 170 Ca 0.36 -0.21 -0.39 0.00 0.10 0.00 0.00 59.98 59.84 2yrq h ARG 170 Cb 0.60 0.07 0.11 0.00 1.11 0.00 0.00 29.97 31.86 2yrq h ARG 170 CO -0.86 0.99 -0.73 0.00 0.10 0.00 0.00 179.97 179.47 2yrq n ALA 171 N -2.58 -1.57 -2.86 0.08 0.00 -0.63 -4.92 120.51 108.04 2yrq n ALA 171 Ca -0.11 0.19 -0.43 0.00 0.00 0.00 0.00 53.44 53.10 2yrq n ALA 171 Cb 0.56 -4.19 -0.03 0.00 0.00 0.00 0.00 19.45 15.79 2yrq n ALA 171 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2yrq s LYS 172 N -6.07 3.40 0.00 0.00 1.02 -1.26 -5.09 119.74 111.74 2yrq s LYS 172 Ca 0.38 -1.32 0.00 0.00 0.02 0.00 0.00 55.97 55.05 2yrq s LYS 172 Cb -0.17 -4.68 0.00 0.00 -0.52 0.00 0.00 37.83 32.46 2yrq s LYS 172 CO 0.75 -1.83 0.00 0.41 -0.92 0.00 0.00 175.35 173.76