#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yrq s SER 2 N 0.00 4.63 -0.52 1.61 0.15 -1.26 -5.03 113.70 113.29 2yrq s SER 2 Ca 0.00 0.22 -0.23 0.00 0.70 0.00 0.00 55.95 56.64 2yrq s SER 2 Cb 0.00 -0.80 0.04 0.00 -1.71 0.00 0.00 66.02 63.55 2yrq s SER 2 CO 0.00 -1.69 0.85 -0.94 1.20 0.00 0.00 173.24 172.66 2yrq s SER 3 N -4.58 6.34 0.00 5.45 1.04 -1.26 -4.83 113.70 115.86 2yrq s SER 3 Ca 0.62 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.66 2yrq s SER 3 Cb -0.09 -2.40 0.00 0.00 0.10 0.00 0.00 66.02 63.63 2yrq s SER 3 CO 0.44 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 174.18 2yrq n GLY 4 N 5.09 3.26 3.05 7.32 0.00 -1.26 -5.08 105.19 117.57 2yrq n GLY 4 Ca 0.00 -0.52 -0.37 0.00 0.00 0.00 0.00 46.02 45.13 2yrq n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2yrq n SER 5 N 0.00 -3.29 0.21 1.61 3.41 -1.26 -4.84 113.62 109.46 2yrq n SER 5 Ca 0.00 0.64 0.12 0.00 -0.26 0.00 0.00 58.87 59.38 2yrq n SER 5 Cb 0.00 -0.80 0.23 0.00 -0.26 0.00 0.00 64.21 63.38 2yrq n SER 5 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2yrq h SER 6 N 0.05 0.00 0.00 4.04 4.64 -1.99 -3.50 113.55 116.80 2yrq h SER 6 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 2yrq h SER 6 Cb 1.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 2yrq h SER 6 CO 0.40 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.97 2yrq n GLY 7 N 1.07 0.49 2.59 -0.77 0.00 -1.26 -5.08 105.19 102.23 2yrq n GLY 7 Ca 0.04 -2.01 -0.34 0.00 0.00 0.00 0.00 46.02 43.70 2yrq n GLY 7 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2yrq n MET 8 N 0.00 0.00 0.00 1.61 -0.00 -1.26 -4.92 117.12 112.55 2yrq n MET 8 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 2yrq n MET 8 Cb 0.00 -0.77 0.00 0.00 -0.00 0.00 0.00 33.22 32.45 2yrq n MET 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2yrq n GLY 9 N 1.70 3.28 3.77 3.17 0.00 -1.26 -5.14 105.19 110.71 2yrq n GLY 9 Ca 0.11 -0.07 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 2yrq n GLY 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yrq s LYS 10 N 3.84 4.11 -0.25 1.61 1.02 -1.26 -4.99 119.74 123.82 2yrq s LYS 10 Ca 0.00 0.31 -0.01 0.00 0.02 0.00 0.00 55.97 56.28 2yrq s LYS 10 Cb 0.00 -3.34 -0.17 0.00 -0.52 0.00 0.00 37.83 33.80 2yrq s LYS 10 CO 0.00 0.41 -0.20 0.41 -0.92 0.00 0.00 175.35 175.05 2yrq n GLY 11 N 2.69 -0.39 3.47 -3.33 0.00 -1.26 -4.98 105.19 101.38 2yrq n GLY 11 Ca -0.12 -0.17 -0.51 0.00 0.00 0.00 0.00 46.02 45.22 2yrq n GLY 11 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2yrq n ASP 12 N -3.44 -0.29 0.27 1.61 5.68 -1.26 -4.83 116.55 114.30 2yrq n ASP 12 Ca -0.46 1.14 0.17 0.00 -0.50 0.00 0.00 54.79 55.14 2yrq n ASP 12 Cb 0.98 -1.01 0.68 0.00 -1.14 0.00 0.00 41.12 40.63 2yrq n ASP 12 CO 0.00 0.00 0.00 1.55 -1.33 0.00 0.00 177.20 177.42 2yrq h PRO 13 N 2.02 0.00 -0.64 0.11 0.13 -2.06 -3.19 132.00 128.37 2yrq h PRO 13 Ca -0.38 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 64.89 2yrq h PRO 13 Cb 1.41 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.44 2yrq h PRO 13 CO 0.62 0.03 0.04 0.87 -0.23 0.00 0.00 178.00 179.33 2yrq h LYS 14 N 0.00 0.15 -4.35 0.86 1.57 -2.01 -3.42 116.57 109.37 2yrq h LYS 14 Ca -0.00 -0.01 -0.63 0.00 -1.87 0.00 0.00 60.65 58.14 2yrq h LYS 14 Cb 0.51 -0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.80 2yrq h LYS 14 CO 0.00 0.10 0.43 1.17 -0.57 0.00 0.00 179.45 180.58 2yrq n LYS 15 N -5.25 0.00 -2.17 3.15 4.81 -1.21 -4.79 118.16 112.70 2yrq n LYS 15 Ca 0.10 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.12 2yrq n LYS 15 Cb 0.37 -1.09 -0.03 0.00 0.02 0.00 0.00 35.03 34.31 2yrq n LYS 15 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2yrq s PRO 16 N 1.82 4.26 -0.02 1.64 0.04 -1.26 -5.01 135.00 136.48 2yrq s PRO 16 Ca 0.75 2.02 -0.18 0.00 0.04 0.00 0.00 61.00 63.63 2yrq s PRO 16 Cb -1.06 -3.62 -0.05 0.00 0.04 0.00 0.00 34.50 29.81 2yrq s PRO 16 CO 0.57 -0.62 0.52 -0.98 0.04 0.00 0.00 177.00 176.52 2yrq s ARG 17 N 2.60 4.21 0.00 4.56 1.70 -1.26 -4.83 118.95 125.93 2yrq s ARG 17 Ca 0.66 0.59 0.00 0.00 -0.47 0.00 0.00 55.73 56.50 2yrq s ARG 17 Cb -0.32 -3.32 0.00 0.00 -0.57 0.00 0.00 34.95 30.73 2yrq s ARG 17 CO 0.27 0.43 0.00 0.41 -1.08 0.00 0.00 175.30 175.33 2yrq n GLY 18 N 2.41 -2.12 3.41 3.88 0.00 -1.26 -5.15 105.19 106.36 2yrq n GLY 18 Ca -0.09 0.66 -0.32 0.00 0.00 0.00 0.00 46.02 46.28 2yrq n GLY 18 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2yrq n LYS 19 N -1.49 -1.16 -3.61 1.61 2.85 -1.26 -5.04 118.16 110.05 2yrq n LYS 19 Ca 0.00 -0.30 -0.10 0.00 -1.05 0.00 0.00 58.31 56.86 2yrq n LYS 19 Cb 0.00 -1.93 -0.02 0.00 -0.65 0.00 0.00 35.03 32.43 2yrq n LYS 19 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 177.40 175.71 2yrq s MET 20 N -3.85 1.50 0.83 -1.58 -1.94 -1.26 -5.08 119.30 107.91 2yrq s MET 20 Ca 0.60 -0.69 -0.11 0.00 -1.71 0.00 0.00 55.69 53.77 2yrq s MET 20 Cb -0.19 0.59 0.11 0.00 2.01 0.00 0.00 34.83 37.36 2yrq s MET 20 CO 0.65 -0.67 1.18 -1.12 -0.01 0.00 0.00 175.02 175.05 2yrq s SER 21 N -2.82 4.17 0.13 3.03 0.01 -1.26 -4.76 113.70 112.20 2yrq s SER 21 Ca 0.05 0.51 -0.31 0.00 1.31 0.00 0.00 55.95 57.52 2yrq s SER 21 Cb -0.03 -0.91 -0.08 0.00 0.21 0.00 0.00 66.02 65.21 2yrq s SER 21 CO -0.04 -2.07 1.57 0.28 0.41 0.00 0.00 173.24 173.38 2yrq h SER 22 N -1.10 -1.56 0.69 2.44 0.02 -1.90 0.69 113.55 112.83 2yrq h SER 22 Ca -0.45 0.20 -0.03 0.00 -0.84 0.00 0.00 61.79 60.67 2yrq h SER 22 Cb 1.30 0.63 0.01 0.00 0.14 0.00 0.00 62.40 64.47 2yrq h SER 22 CO 0.56 -0.45 -0.33 0.22 -1.14 0.00 0.00 176.83 175.69 2yrq h TYR 23 N -0.51 -0.86 -0.99 3.45 3.20 -1.94 0.20 116.97 119.54 2yrq h TYR 23 Ca 0.06 -0.02 0.34 0.00 3.14 0.00 0.00 58.73 62.25 2yrq h TYR 23 Cb 0.65 0.28 -0.16 0.00 1.54 0.00 0.00 36.73 39.04 2yrq h TYR 23 CO -0.57 -0.52 0.49 0.00 -1.64 0.00 0.00 178.16 175.92 2yrq h ALA 24 N -0.66 1.89 0.10 1.82 0.00 -1.87 0.19 119.26 120.74 2yrq h ALA 24 Ca -0.09 0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2yrq h ALA 24 Cb 0.72 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2yrq h ALA 24 CO 0.16 -0.67 -0.05 0.74 0.00 0.00 0.00 179.25 179.42 2yrq h PHE 25 N 0.20 -0.13 -1.31 0.00 0.04 -0.57 -3.28 116.94 111.89 2yrq h PHE 25 Ca 0.74 -0.00 0.38 0.00 2.80 0.00 0.00 57.97 61.88 2yrq h PHE 25 Cb 1.75 0.04 -0.06 0.00 2.20 0.00 0.00 35.95 39.88 2yrq h PHE 25 CO -0.07 0.17 0.93 0.35 -0.60 0.00 0.00 178.31 179.09 2yrq h PHE 26 N -0.99 0.11 -0.36 -0.55 3.57 0.54 0.98 116.94 120.25 2yrq h PHE 26 Ca -0.01 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.41 2yrq h PHE 26 Cb 0.36 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 2yrq h PHE 26 CO 0.07 -0.01 -0.12 0.28 -2.23 0.00 0.00 178.31 176.30 2yrq h VAL 27 N 0.05 1.25 0.00 1.41 2.07 -0.74 -2.33 116.25 117.95 2yrq h VAL 27 Ca 0.65 -1.10 -0.15 0.00 0.82 0.00 0.00 66.70 66.92 2yrq h VAL 27 Cb 2.45 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 33.30 2yrq h VAL 27 CO -0.07 0.37 -1.53 1.67 0.02 0.00 0.00 177.57 178.03 2yrq n GLN 28 N -4.18 0.63 -0.04 1.57 7.27 0.29 -3.57 117.38 119.36 2yrq n GLN 28 Ca 0.01 0.14 -0.12 0.00 0.07 0.00 0.00 57.00 57.10 2yrq n GLN 28 Cb 0.35 -1.75 -0.06 0.00 2.41 0.00 0.00 30.24 31.19 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 1.24 0.15 1.69 2.02 -0.07 -1.56 112.91 116.39 2yrq h THR 29 Ca -0.16 -0.78 -0.01 0.00 0.77 0.00 0.00 66.41 66.23 2yrq h THR 29 Cb 1.51 1.52 0.00 0.00 -1.74 0.00 0.00 68.15 69.44 2yrq h THR 29 CO 0.03 0.23 -0.07 0.00 0.37 0.00 0.00 175.52 176.08 2yrq h ARG 31 N -0.59 0.71 0.34 0.00 0.11 -1.62 -0.36 114.38 112.98 2yrq h ARG 31 Ca -0.02 -0.04 -0.02 0.00 0.10 0.00 0.00 59.98 60.00 2yrq h ARG 31 Cb 0.45 -0.16 0.00 0.00 1.11 0.00 0.00 29.97 31.37 2yrq h ARG 31 CO 0.03 0.47 -0.16 0.93 0.10 0.00 0.00 179.97 181.34 2yrq h GLU 32 N 0.74 -0.44 -0.84 0.08 4.39 -1.24 -3.03 114.58 114.24 2yrq h GLU 32 Ca 0.52 0.03 0.24 0.00 0.34 0.00 0.00 59.36 60.50 2yrq h GLU 32 Cb 0.75 0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.47 2yrq h GLU 32 CO -0.36 -0.12 0.61 0.93 -1.16 0.00 0.00 179.01 178.91 2yrq h GLU 33 N -0.88 0.00 0.24 2.33 5.08 -0.74 -2.52 114.58 118.09 2yrq h GLU 33 Ca -0.05 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2yrq h GLU 33 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 2yrq h GLU 33 CO 0.08 0.00 -0.12 1.25 -1.00 0.00 0.00 179.01 179.22 2yrq h HIS 34 N 0.00 -0.30 -1.16 4.33 2.76 -0.97 -2.06 115.15 117.74 2yrq h HIS 34 Ca 0.40 -0.01 0.38 0.00 -2.20 0.00 0.00 60.37 58.94 2yrq h HIS 34 Cb 1.63 0.10 -0.09 0.00 1.55 0.00 0.00 27.41 30.60 2yrq h HIS 34 CO 0.00 -0.19 0.78 1.63 -1.30 0.00 0.00 177.93 178.85 2yrq n LYS 35 N -3.06 -0.02 -0.03 5.26 4.01 -0.95 0.22 118.16 123.59 2yrq n LYS 35 Ca -0.04 0.89 -0.15 0.00 -0.51 0.00 0.00 58.31 58.50 2yrq n LYS 35 Cb 0.13 -1.84 -0.11 0.00 -0.51 0.00 0.00 35.03 32.69 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 0.16 -0.55 1.97 1.79 -1.49 -2.84 116.57 115.61 2yrq h LYS 36 Ca 0.67 -0.17 -0.04 0.00 -2.18 0.00 0.00 60.65 58.93 2yrq h LYS 36 Cb 2.33 0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 33.00 2yrq h LYS 36 CO -0.24 0.92 0.19 0.87 -1.08 0.00 0.00 179.45 180.10 2yrq h LYS 37 N -0.53 0.83 -3.03 3.15 1.57 0.34 -3.38 116.57 115.53 2yrq h LYS 37 Ca -0.03 -0.17 -0.58 0.00 -1.87 0.00 0.00 60.65 58.00 2yrq h LYS 37 Cb 1.00 -0.13 -0.40 0.00 0.08 0.00 0.00 32.23 32.78 2yrq h LYS 37 CO 0.05 0.75 -0.78 -1.01 -0.57 0.00 0.00 179.45 177.89 2yrq s HIS 38 N -5.47 1.32 0.01 -1.35 3.76 0.73 -5.00 115.29 109.29 2yrq s HIS 38 Ca -0.13 -1.78 -0.23 0.00 -0.15 0.00 0.00 55.06 52.77 2yrq s HIS 38 Cb 0.12 -1.43 -0.18 0.00 1.11 0.00 0.00 32.58 32.20 2yrq s HIS 38 CO 0.79 -0.83 1.30 -1.00 -0.85 0.00 0.00 174.74 174.15 2yrq h PRO 39 N 7.47 0.17 -0.97 8.40 0.13 -1.70 -3.22 132.00 142.27 2yrq h PRO 39 Ca -0.06 -0.09 0.05 0.00 -0.87 0.00 0.00 66.00 65.04 2yrq h PRO 39 Cb 0.98 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.05 2yrq h PRO 39 CO 0.41 0.61 0.63 0.22 -0.23 0.00 0.00 178.00 179.64 2yrq h ASP 40 N -0.26 1.02 -2.44 1.44 1.82 -1.94 -3.41 116.42 112.64 2yrq h ASP 40 Ca 0.01 0.00 -0.55 0.00 -0.39 0.00 0.00 57.03 56.10 2yrq h ASP 40 Cb 0.57 -0.22 0.00 0.00 0.68 0.00 0.00 39.33 40.37 2yrq h ASP 40 CO 0.02 0.67 1.22 0.00 -1.61 0.00 0.00 179.24 179.54 2yrq s ALA 41 N -6.06 3.39 -0.96 -0.78 0.00 -1.22 -4.93 121.76 111.20 2yrq s ALA 41 Ca -0.13 0.98 -0.08 0.00 0.00 0.00 0.00 51.96 52.73 2yrq s ALA 41 Cb 0.19 -3.86 0.24 0.00 0.00 0.00 0.00 23.12 19.70 2yrq s ALA 41 CO 0.81 -1.80 0.91 -1.12 0.00 0.00 0.00 175.76 174.56 2yrq s SER 42 N 4.77 6.78 0.20 0.00 0.01 -1.26 -4.91 113.70 119.29 2yrq s SER 42 Ca 0.84 -3.34 -0.30 0.00 1.31 0.00 0.00 55.95 54.46 2yrq s SER 42 Cb -0.36 -2.13 -0.08 0.00 0.21 0.00 0.00 66.02 63.67 2yrq s SER 42 CO 0.35 -0.34 1.16 0.54 0.41 0.00 0.00 173.24 175.35 2yrq s VAL 43 N -0.83 3.63 0.65 3.43 0.11 -1.26 -5.02 120.40 121.11 2yrq s VAL 43 Ca 0.26 1.42 -0.13 0.00 -2.93 0.00 0.00 61.98 60.60 2yrq s VAL 43 Cb -0.10 -3.91 -0.01 0.00 -1.53 0.00 0.00 36.38 30.83 2yrq s VAL 43 CO -0.09 0.25 1.06 0.20 -3.33 0.00 0.00 175.10 173.19 2yrq s ASN 44 N -0.10 5.54 -0.00 3.54 0.01 -1.26 -4.98 114.94 117.69 2yrq s ASN 44 Ca 0.50 1.70 -0.21 0.00 -0.71 0.00 0.00 52.86 54.14 2yrq s ASN 44 Cb -0.32 -2.51 -0.21 0.00 0.41 0.00 0.00 41.25 38.62 2yrq s ASN 44 CO 0.37 -1.33 1.13 0.15 -1.51 0.00 0.00 177.10 175.91 2yrq h PHE 45 N -0.24 0.49 -0.31 2.20 3.57 -1.99 -2.67 116.94 118.00 2yrq h PHE 45 Ca -0.45 -0.24 -0.01 0.00 3.53 0.00 0.00 57.97 60.81 2yrq h PHE 45 Cb 1.21 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.87 2yrq h PHE 45 CO 0.61 1.01 0.17 1.03 -2.23 0.00 0.00 178.31 178.90 2yrq h SER 46 N -0.18 0.38 -0.96 0.41 0.87 -1.99 -0.98 113.55 111.10 2yrq h SER 46 Ca -0.04 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2yrq h SER 46 Cb 1.09 -0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 62.91 2yrq h SER 46 CO 0.08 0.36 0.61 -0.33 -0.53 0.00 0.00 176.83 177.02 2yrq h GLU 47 N 0.38 1.28 -0.33 2.24 4.39 -1.97 -1.87 114.58 118.69 2yrq h GLU 47 Ca 0.11 -0.09 -0.10 0.00 0.34 0.00 0.00 59.36 59.61 2yrq h GLU 47 Cb 0.06 -0.28 -0.01 0.00 -0.10 0.00 0.00 28.75 28.41 2yrq h GLU 47 CO -0.02 0.86 -0.22 0.35 -1.16 0.00 0.00 179.01 178.82 2yrq h PHE 48 N 1.31 0.71 0.43 4.33 3.57 -1.13 -2.79 116.94 123.36 2yrq h PHE 48 Ca 0.35 -0.15 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 2yrq h PHE 48 Cb -0.11 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 38.46 2yrq h PHE 48 CO 0.00 0.80 -0.20 1.03 -2.23 0.00 0.00 178.31 177.71 2yrq h SER 49 N 0.56 -0.49 -1.29 0.41 0.87 -0.53 0.65 113.55 113.73 2yrq h SER 49 Ca 0.08 0.02 0.37 0.00 -1.23 0.00 0.00 61.79 61.03 2yrq h SER 49 Cb 0.69 0.13 -0.06 0.00 -0.44 0.00 0.00 62.40 62.71 2yrq h SER 49 CO 0.05 -0.28 0.92 0.07 -0.53 0.00 0.00 176.83 177.06 2yrq h LYS 50 N -0.71 0.04 0.06 2.24 2.10 -1.44 -0.03 116.57 118.83 2yrq h LYS 50 Ca -0.06 -0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.59 2yrq h LYS 50 Cb 0.44 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.76 2yrq h LYS 50 CO 0.10 0.03 -0.03 -0.22 -2.00 0.00 0.00 179.45 177.32 2yrq h LYS 51 N 0.04 -0.08 -1.53 0.07 3.64 -1.35 -3.26 116.57 114.10 2yrq h LYS 51 Ca 0.63 0.01 0.45 0.00 -1.27 0.00 0.00 60.65 60.47 2yrq h LYS 51 Cb 2.43 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 34.20 2yrq h LYS 51 CO -0.05 0.48 1.09 0.00 -2.27 0.00 0.00 179.45 178.70 2yrq n SER 53 N -4.14 0.00 0.11 0.00 2.88 -0.97 0.38 113.62 111.88 2yrq n SER 53 Ca 0.35 0.93 0.11 0.00 -1.33 0.00 0.00 58.87 58.93 2yrq n SER 53 Cb 1.58 -0.43 0.46 0.00 -0.75 0.00 0.00 64.21 65.07 2yrq n SER 53 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2yrq n GLU 54 N -1.80 0.17 0.11 -1.46 1.02 -0.73 -2.15 120.64 115.80 2yrq n GLU 54 Ca 0.00 0.39 0.07 0.00 -0.02 0.00 0.00 57.16 57.59 2yrq n GLU 54 Cb 0.00 -1.81 0.01 0.00 -0.02 0.00 0.00 31.44 29.62 2yrq n GLU 54 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2yrq h ARG 55 N 0.00 0.00 0.07 3.49 2.43 0.27 -3.07 114.38 117.57 2yrq h ARG 55 Ca 0.00 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.02 2yrq h ARG 55 Cb 0.36 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 2yrq h ARG 55 CO 0.00 0.18 -0.73 2.35 -1.51 0.00 0.00 179.97 180.26 2yrq h TRP 56 N 0.00 0.28 -0.52 2.20 2.91 0.45 -3.18 115.95 118.10 2yrq h TRP 56 Ca -0.05 -0.21 -0.05 0.00 1.13 0.00 0.00 58.89 59.72 2yrq h TRP 56 Cb 1.24 -0.01 -0.02 0.00 -0.51 0.00 0.00 29.16 29.86 2yrq h TRP 56 CO 0.00 1.28 0.14 1.57 -1.03 0.00 0.00 178.44 180.40 2yrq h LYS 57 N -0.64 0.82 -0.45 2.65 2.10 -1.67 -3.02 116.57 116.37 2yrq h LYS 57 Ca -0.16 -0.19 0.04 0.00 -2.00 0.00 0.00 60.65 58.35 2yrq h LYS 57 Cb 1.42 -0.11 -0.04 0.00 -0.90 0.00 0.00 32.23 32.60 2yrq h LYS 57 CO 0.04 0.78 0.21 0.00 -2.00 0.00 0.00 179.45 178.48 2yrq h THR 58 N 0.72 0.94 -0.95 0.07 1.03 -1.68 -3.43 112.91 109.59 2yrq h THR 58 Ca 0.16 -0.14 -0.69 0.00 -0.01 0.00 0.00 66.41 65.73 2yrq h THR 58 Cb 0.32 0.48 0.08 0.00 -1.07 0.00 0.00 68.15 67.96 2yrq h THR 58 CO -0.00 0.08 -0.23 0.23 -0.01 0.00 0.00 175.52 175.59 2yrq n MET 59 N -4.93 0.00 -1.05 0.00 2.81 -1.14 -4.88 117.12 107.93 2yrq n MET 59 Ca 0.03 0.00 -0.30 0.00 -1.81 0.00 0.00 57.70 55.62 2yrq n MET 59 Cb 0.13 -1.19 0.14 0.00 -0.71 0.00 0.00 33.22 31.59 2yrq n MET 59 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2yrq s SER 60 N -0.48 3.41 0.25 7.83 0.15 -1.26 -4.76 113.70 118.84 2yrq s SER 60 Ca 0.74 1.74 -0.04 0.00 0.70 0.00 0.00 55.95 59.09 2yrq s SER 60 Cb -1.05 -2.37 0.47 0.00 -1.71 0.00 0.00 66.02 61.36 2yrq s SER 60 CO 0.54 -2.71 1.72 0.00 1.20 0.00 0.00 173.24 173.98 2yrq h ALA 61 N -1.60 1.04 -0.11 5.45 0.00 -1.95 -1.43 119.26 120.67 2yrq h ALA 61 Ca -0.47 0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.61 2yrq h ALA 61 Cb 1.27 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 19.14 2yrq h ALA 61 CO 0.50 -0.25 -0.16 1.57 0.00 0.00 0.00 179.25 180.91 2yrq h LYS 62 N 0.39 -0.20 -0.44 0.00 2.10 -1.99 0.34 116.57 116.78 2yrq h LYS 62 Ca 0.42 0.01 0.07 0.00 -2.00 0.00 0.00 60.65 59.16 2yrq h LYS 62 Cb 0.67 0.05 -0.06 0.00 -0.90 0.00 0.00 32.23 31.98 2yrq h LYS 62 CO -0.44 -0.13 0.07 0.93 -2.00 0.00 0.00 179.45 177.88 2yrq h GLU 63 N -0.21 0.18 -0.58 0.07 5.08 -1.63 -1.59 114.58 115.91 2yrq h GLU 63 Ca 0.09 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.37 2yrq h GLU 63 Cb 0.33 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 2yrq h GLU 63 CO -0.23 0.12 0.07 0.87 -1.00 0.00 0.00 179.01 178.84 2yrq h LYS 64 N 0.19 0.95 0.00 2.33 1.57 -0.85 -3.32 116.57 117.44 2yrq h LYS 64 Ca 0.22 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2yrq h LYS 64 Cb 0.28 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.48 2yrq h LYS 64 CO -0.30 0.89 0.00 0.41 -0.57 0.00 0.00 179.45 179.88 2yrq n GLY 65 N -0.65 -2.87 0.32 3.86 0.00 0.12 0.44 105.19 106.41 2yrq n GLY 65 Ca 0.04 0.58 0.16 0.00 0.00 0.00 0.00 46.02 46.79 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 0.09 -0.65 1.61 2.10 -1.65 1.08 116.57 119.15 2yrq h LYS 66 Ca 0.00 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.63 2yrq h LYS 66 Cb 0.00 -0.02 -0.03 0.00 -0.90 0.00 0.00 32.23 31.28 2yrq h LYS 66 CO 0.00 0.06 0.36 0.74 -2.00 0.00 0.00 179.45 178.61 2yrq h PHE 67 N 0.09 0.86 -0.03 0.07 0.04 -0.66 0.43 116.94 117.75 2yrq h PHE 67 Ca 0.60 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 61.36 2yrq h PHE 67 Cb 1.28 -0.28 -0.00 0.00 2.20 0.00 0.00 35.95 39.15 2yrq h PHE 67 CO -0.34 0.60 -0.01 0.93 -0.60 0.00 0.00 178.31 178.89 2yrq h GLU 68 N 0.90 0.05 0.62 1.51 4.39 0.62 -1.36 114.58 121.31 2yrq h GLU 68 Ca 0.23 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.88 2yrq h GLU 68 Cb 0.01 -0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2yrq h GLU 68 CO -0.04 0.41 -0.30 0.22 -1.16 0.00 0.00 179.01 178.14 2yrq h ASP 69 N -0.31 -0.70 -0.90 1.42 1.82 -0.96 -2.36 116.42 114.43 2yrq h ASP 69 Ca 0.01 0.02 0.22 0.00 -0.39 0.00 0.00 57.03 56.89 2yrq h ASP 69 Cb 0.39 0.18 -0.12 0.00 0.68 0.00 0.00 39.33 40.46 2yrq h ASP 69 CO 0.00 -0.43 0.41 0.00 -1.61 0.00 0.00 179.24 177.61 2yrq h MET 70 N -0.97 0.41 -0.56 0.28 -0.00 -1.03 0.14 114.93 113.20 2yrq h MET 70 Ca -0.08 -0.02 0.05 0.00 -0.00 0.00 0.00 59.70 59.64 2yrq h MET 70 Cb 0.64 -0.09 -0.05 0.00 -0.00 0.00 0.00 31.60 32.10 2yrq h MET 70 CO 0.14 0.27 0.30 0.00 -0.00 0.00 0.00 176.91 177.63 2yrq h ALA 71 N 1.70 0.73 0.56 -3.00 0.00 -1.19 -2.16 119.26 115.90 2yrq h ALA 71 Ca 0.56 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.45 2yrq h ALA 71 Cb 1.04 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.73 2yrq h ALA 71 CO -0.51 -0.02 -0.27 0.87 0.00 0.00 0.00 179.25 179.32 2yrq h LYS 72 N 0.59 -0.72 -1.26 0.00 1.57 -0.25 -3.14 116.57 113.35 2yrq h LYS 72 Ca 0.25 0.05 0.46 0.00 -1.87 0.00 0.00 60.65 59.53 2yrq h LYS 72 Cb 0.13 0.16 -0.15 0.00 0.08 0.00 0.00 32.23 32.45 2yrq h LYS 72 CO -0.15 -0.48 0.77 0.00 -0.57 0.00 0.00 179.45 179.02 2yrq h ALA 73 N -1.29 2.61 -0.76 3.86 0.00 -1.04 1.45 119.26 124.09 2yrq h ALA 73 Ca -0.08 0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2yrq h ALA 73 Cb 0.58 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 2yrq h ALA 73 CO 0.13 -1.34 0.33 0.22 0.00 0.00 0.00 179.25 178.58 2yrq h ASP 74 N 0.01 1.03 -0.93 0.00 1.82 -1.34 -2.30 116.42 114.71 2yrq h ASP 74 Ca 0.87 -0.16 0.20 0.00 -0.39 0.00 0.00 57.03 57.56 2yrq h ASP 74 Cb 2.64 -0.27 -0.08 0.00 0.68 0.00 0.00 39.33 42.31 2yrq h ASP 74 CO -0.57 0.91 0.61 0.11 -1.61 0.00 0.00 179.24 178.69 2yrq h LYS 75 N 1.09 0.47 0.12 0.28 1.57 0.21 0.42 116.57 120.73 2yrq h LYS 75 Ca 0.26 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.00 2yrq h LYS 75 Cb 0.18 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.38 2yrq h LYS 75 CO -0.03 0.31 -0.06 0.00 -0.57 0.00 0.00 179.45 179.11 2yrq h ALA 76 N 1.61 -0.16 -0.23 3.86 0.00 -1.40 -3.21 119.26 119.74 2yrq h ALA 76 Ca 0.50 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.42 2yrq h ALA 76 Cb 1.13 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2yrq h ALA 76 CO -0.22 -0.15 0.32 0.07 0.00 0.00 0.00 179.25 179.27 2yrq h ARG 77 N -1.04 0.00 -0.19 0.00 -0.00 -1.11 0.13 114.38 112.17 2yrq h ARG 77 Ca -0.02 0.00 -0.15 0.00 -0.00 0.00 0.00 59.98 59.82 2yrq h ARG 77 Cb 0.16 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.12 2yrq h ARG 77 CO 0.03 0.00 -0.50 -0.92 -0.00 0.00 0.00 179.97 178.57 2yrq h TYR 78 N 0.00 0.65 -0.87 4.08 5.03 -0.23 -3.15 116.97 122.47 2yrq h TYR 78 Ca 0.11 -0.21 0.22 0.00 2.58 0.00 0.00 58.73 61.43 2yrq h TYR 78 Cb 0.74 -0.13 -0.13 0.00 1.55 0.00 0.00 36.73 38.76 2yrq h TYR 78 CO 0.00 0.92 0.30 0.93 -1.32 0.00 0.00 178.16 178.99 2yrq h GLU 79 N 0.41 0.29 -0.95 1.82 5.08 -0.74 -0.16 114.58 120.33 2yrq h GLU 79 Ca 0.02 -0.02 0.25 0.00 -1.00 0.00 0.00 59.36 58.61 2yrq h GLU 79 Cb 1.02 -0.06 -0.18 0.00 0.50 0.00 0.00 28.75 30.03 2yrq h GLU 79 CO 0.09 0.19 -0.03 0.54 -1.00 0.00 0.00 179.01 178.80 2yrq n ARG 80 N -5.14 -0.08 -0.25 2.33 1.74 -1.19 0.14 116.66 114.21 2yrq n ARG 80 Ca 0.21 1.43 0.04 0.00 -0.77 0.00 0.00 57.85 58.76 2yrq n ARG 80 Cb 0.65 -2.24 0.17 0.00 -1.02 0.00 0.00 32.46 30.01 2yrq n ARG 80 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 2yrq h GLU 81 N 0.00 0.50 -0.02 5.56 5.08 -1.23 0.18 114.58 124.64 2yrq h GLU 81 Ca 0.55 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.89 2yrq h GLU 81 Cb 1.08 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.22 2yrq h GLU 81 CO -0.91 0.33 0.55 0.52 -1.00 0.00 0.00 179.01 178.50 2yrq h MET 82 N 0.52 0.00 -0.99 2.33 2.86 0.11 0.02 114.93 119.77 2yrq h MET 82 Ca 0.39 0.00 0.26 0.00 -2.06 0.00 0.00 59.70 58.28 2yrq h MET 82 Cb 0.51 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.11 2yrq h MET 82 CO -0.34 0.00 0.67 1.57 1.06 0.00 0.00 176.91 179.87 2yrq h LYS 83 N 0.00 0.25 0.00 1.72 5.09 -0.66 0.17 116.57 123.13 2yrq h LYS 83 Ca 0.01 -0.01 -0.18 0.00 0.09 0.00 0.00 60.65 60.55 2yrq h LYS 83 Cb 1.11 -0.06 -0.03 0.00 0.10 0.00 0.00 32.23 33.35 2yrq h LYS 83 CO -0.00 0.16 -1.58 -2.37 -2.09 0.00 0.00 179.45 173.57 2yrq n THR 84 N -4.45 1.14 -2.94 0.07 5.66 -0.01 -4.90 114.28 108.85 2yrq n THR 84 Ca 0.22 -0.70 -0.39 0.00 -3.05 0.00 0.00 64.05 60.13 2yrq n THR 84 Cb 0.90 -0.67 -0.06 0.00 -1.55 0.00 0.00 70.33 68.95 2yrq n THR 84 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 2yrq s TYR 85 N -2.91 3.90 -0.34 1.09 5.04 0.58 -5.05 117.35 119.67 2yrq s TYR 85 Ca -0.04 1.67 0.01 0.00 -2.44 0.00 0.00 57.07 56.28 2yrq s TYR 85 Cb 0.09 -2.80 0.11 0.00 0.35 0.00 0.00 41.96 39.70 2yrq s TYR 85 CO 0.82 0.49 0.10 0.42 -1.34 0.00 0.00 175.55 176.04 2yrq s ILE 86 N -1.19 1.50 0.96 3.14 1.01 -1.26 -4.86 121.20 120.49 2yrq s ILE 86 Ca 0.37 -1.94 -0.12 0.00 0.00 0.00 0.00 60.65 58.97 2yrq s ILE 86 Cb -0.23 -2.11 0.16 0.00 0.01 0.00 0.00 42.46 40.30 2yrq s ILE 86 CO 0.27 -0.68 1.09 -2.16 0.00 0.00 0.00 174.94 173.46 2yrq s PRO 87 N 1.15 0.77 1.16 2.79 0.04 -1.26 -5.05 135.00 134.61 2yrq s PRO 87 Ca 0.11 0.65 -0.18 0.00 0.04 0.00 0.00 61.00 61.63 2yrq s PRO 87 Cb -0.19 -1.77 0.27 0.00 0.04 0.00 0.00 34.50 32.85 2yrq s PRO 87 CO -0.15 -2.53 1.11 -1.25 0.04 0.00 0.00 177.00 174.21 2yrq s PRO 88 N -4.95 -0.91 -0.88 0.56 0.04 -1.26 -4.96 135.00 122.65 2yrq s PRO 88 Ca 0.65 0.04 -0.18 0.00 0.04 0.00 0.00 61.00 61.54 2yrq s PRO 88 Cb -0.18 -1.62 0.13 0.00 0.04 0.00 0.00 34.50 32.87 2yrq s PRO 88 CO 0.57 -3.53 1.05 0.15 0.04 0.00 0.00 177.00 175.28 2yrq s LYS 89 N -5.32 3.53 0.00 4.56 -0.14 -1.26 -4.94 119.74 116.17 2yrq s LYS 89 Ca 0.70 -1.75 0.00 0.00 -1.36 0.00 0.00 55.97 53.56 2yrq s LYS 89 Cb -0.12 -4.77 0.00 0.00 -1.68 0.00 0.00 37.83 31.27 2yrq s LYS 89 CO 0.56 -1.71 0.00 0.41 -0.76 0.00 0.00 175.35 173.86 2yrq n GLY 90 N 5.29 5.45 1.79 -3.33 0.00 -1.26 -4.99 105.19 108.13 2yrq n GLY 90 Ca 0.19 -1.58 -0.07 0.00 0.00 0.00 0.00 46.02 44.56 2yrq n GLY 90 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2yrq n GLU 91 N 0.00 1.56 -4.13 1.61 0.00 -1.26 -4.87 120.64 113.56 2yrq n GLU 91 Ca 0.00 -0.62 -0.22 0.00 0.00 0.00 0.00 57.16 56.32 2yrq n GLU 91 Cb 0.00 -1.55 -0.05 0.00 0.00 0.00 0.00 31.44 29.84 2yrq n GLU 91 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.13 177.05 2yrq s THR 92 N 0.34 4.37 -0.25 6.31 -1.32 -1.26 -5.10 115.64 118.72 2yrq s THR 92 Ca 0.36 -1.44 -0.16 0.00 -1.21 0.00 0.00 61.69 59.24 2yrq s THR 92 Cb 0.18 -3.36 -0.03 0.00 -1.51 0.00 0.00 72.50 67.78 2yrq s THR 92 CO -0.01 -0.35 0.42 -0.54 -2.21 0.00 0.00 174.62 171.94 2yrq s LYS 93 N -3.81 4.07 0.09 7.08 1.02 -1.26 -5.07 119.74 121.86 2yrq s LYS 93 Ca 0.33 0.17 -0.09 0.00 0.02 0.00 0.00 55.97 56.39 2yrq s LYS 93 Cb -0.08 -3.62 -0.06 0.00 -0.52 0.00 0.00 37.83 33.55 2yrq s LYS 93 CO 0.24 -0.24 0.40 0.21 -0.92 0.00 0.00 175.35 175.05 2yrq s LYS 94 N 1.95 3.74 -0.17 1.68 2.20 -1.26 -5.09 119.74 122.79 2yrq s LYS 94 Ca 0.18 0.13 -0.06 0.00 -0.36 0.00 0.00 55.97 55.87 2yrq s LYS 94 Cb -0.15 -2.96 0.08 0.00 -1.51 0.00 0.00 37.83 33.28 2yrq s LYS 94 CO 0.09 0.54 0.34 0.15 -0.36 0.00 0.00 175.35 176.11 2yrq s LYS 95 N -2.05 0.24 0.03 4.03 -0.14 -1.26 -5.14 119.74 115.45 2yrq s LYS 95 Ca 0.35 0.88 -0.29 0.00 -1.36 0.00 0.00 55.97 55.55 2yrq s LYS 95 Cb -0.14 0.13 -0.04 0.00 -1.68 0.00 0.00 37.83 36.10 2yrq s LYS 95 CO 0.19 -0.28 0.93 0.12 -0.76 0.00 0.00 175.35 175.55 2yrq s PHE 96 N 2.52 3.71 0.45 3.18 5.36 -1.26 -5.06 117.98 126.88 2yrq s PHE 96 Ca 0.00 1.67 0.06 0.00 -0.96 0.00 0.00 56.93 57.70 2yrq s PHE 96 Cb -0.12 -3.04 -0.03 0.00 -0.34 0.00 0.00 43.02 39.49 2yrq s PHE 96 CO -0.11 0.10 0.23 0.15 -1.46 0.00 0.00 175.22 174.12 2yrq s LYS 97 N 0.57 2.25 -0.67 10.12 -0.14 -1.26 -5.10 119.74 125.52 2yrq s LYS 97 Ca 0.48 -1.91 0.05 0.00 -1.36 0.00 0.00 55.97 53.22 2yrq s LYS 97 Cb -0.21 -1.99 0.17 0.00 -1.68 0.00 0.00 37.83 34.11 2yrq s LYS 97 CO 0.27 -0.26 0.47 0.34 -0.76 0.00 0.00 175.35 175.41 2yrq s ASP 98 N -4.00 4.51 0.27 2.83 -1.08 -1.26 -4.92 116.67 113.02 2yrq s ASP 98 Ca 0.37 -3.73 0.05 0.00 -0.52 0.00 0.00 52.55 48.72 2yrq s ASP 98 Cb 0.02 -1.53 0.39 0.00 -1.46 0.00 0.00 42.92 40.33 2yrq s ASP 98 CO 0.21 -0.10 1.66 1.55 0.52 0.00 0.00 175.17 179.00 2yrq h PRO 99 N 5.49 0.26 -0.26 4.34 0.13 -1.99 -3.18 132.00 136.79 2yrq h PRO 99 Ca 0.14 -0.14 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 2yrq h PRO 99 Cb 0.78 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.90 2yrq h PRO 99 CO 0.69 0.67 0.12 -0.91 -0.23 0.00 0.00 178.00 178.34 2yrq h ASN 100 N 0.21 0.35 -4.00 1.44 4.21 -2.04 -3.43 115.58 112.33 2yrq h ASN 100 Ca 0.01 -0.14 -0.54 0.00 1.21 0.00 0.00 56.30 56.84 2yrq h ASN 100 Cb 0.89 -0.09 0.12 0.00 -1.12 0.00 0.00 38.32 38.12 2yrq h ASN 100 CO 0.07 0.40 0.69 0.00 -1.29 0.00 0.00 177.43 177.30 2yrq s ALA 101 N -5.64 3.19 1.13 -0.83 0.00 -1.20 -5.00 121.76 113.41 2yrq s ALA 101 Ca -0.13 1.45 -0.17 0.00 0.00 0.00 0.00 51.96 53.11 2yrq s ALA 101 Cb 0.08 -3.59 0.25 0.00 0.00 0.00 0.00 23.12 19.87 2yrq s ALA 101 CO 0.72 -1.22 1.10 -1.25 0.00 0.00 0.00 175.76 175.11 2yrq s PRO 102 N -2.50 -0.66 0.18 0.00 0.04 -1.26 -5.02 135.00 125.78 2yrq s PRO 102 Ca 0.62 0.14 0.09 0.00 0.04 0.00 0.00 61.00 61.89 2yrq s PRO 102 Cb -0.43 -1.64 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 2yrq s PRO 102 CO 0.55 -3.38 -0.09 -1.59 0.04 0.00 0.00 177.00 172.54 2yrq s LYS 103 N -5.24 2.08 0.12 4.56 0.00 -1.26 -5.06 119.74 114.94 2yrq s LYS 103 Ca 0.69 -1.27 -0.28 0.00 0.00 0.00 0.00 55.97 55.10 2yrq s LYS 103 Cb -0.13 -2.16 -0.06 0.00 0.00 0.00 0.00 37.83 35.47 2yrq s LYS 103 CO 0.57 0.43 0.89 -0.98 0.00 0.00 0.00 175.35 176.26 2yrq s ARG 104 N -2.88 4.66 0.99 1.78 1.70 -1.26 -4.93 118.95 119.02 2yrq s ARG 104 Ca 0.25 1.34 -0.12 0.00 -0.47 0.00 0.00 55.73 56.72 2yrq s ARG 104 Cb -0.09 -3.35 0.18 0.00 -0.57 0.00 0.00 34.95 31.13 2yrq s ARG 104 CO 0.15 0.31 1.09 -1.25 -1.08 0.00 0.00 175.30 174.53 2yrq s PRO 105 N -0.31 0.50 0.89 3.89 0.04 -1.26 -5.03 135.00 133.71 2yrq s PRO 105 Ca 0.43 0.55 -0.11 0.00 0.04 0.00 0.00 61.00 61.90 2yrq s PRO 105 Cb -0.23 -1.74 0.12 0.00 0.04 0.00 0.00 34.50 32.69 2yrq s PRO 105 CO 0.28 -2.69 1.09 -1.25 0.04 0.00 0.00 177.00 174.47 2yrq s PRO 106 N -4.96 1.34 0.42 0.56 0.04 -1.26 -5.03 135.00 126.11 2yrq s PRO 106 Ca 0.65 0.85 0.07 0.00 0.04 0.00 0.00 61.00 62.61 2yrq s PRO 106 Cb -0.18 -1.82 -0.06 0.00 0.04 0.00 0.00 34.50 32.48 2yrq s PRO 106 CO 0.58 -2.19 0.12 -1.12 0.04 0.00 0.00 177.00 174.42 2yrq s SER 107 N -3.42 4.22 0.17 6.66 0.01 -1.26 -4.91 113.70 115.18 2yrq s SER 107 Ca 0.63 -1.20 -0.19 0.00 1.31 0.00 0.00 55.95 56.50 2yrq s SER 107 Cb -0.18 -0.42 0.11 0.00 0.21 0.00 0.00 66.02 65.74 2yrq s SER 107 CO 0.57 -0.52 1.31 0.00 0.41 0.00 0.00 173.24 175.01 2yrq n ALA 108 N -1.15 -0.27 0.02 1.44 0.00 -1.20 -0.45 120.51 118.91 2yrq n ALA 108 Ca -0.03 0.80 -0.05 0.00 0.00 0.00 0.00 53.44 54.16 2yrq n ALA 108 Cb 0.65 -0.28 -0.03 0.00 0.00 0.00 0.00 19.45 19.79 2yrq n ALA 108 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2yrq h PHE 109 N 0.00 -0.48 -0.88 0.00 3.57 -1.96 -0.45 116.94 116.73 2yrq h PHE 109 Ca 0.24 0.01 0.24 0.00 3.53 0.00 0.00 57.97 61.99 2yrq h PHE 109 Cb 0.45 0.21 -0.14 0.00 2.79 0.00 0.00 35.95 39.26 2yrq h PHE 109 CO -0.79 -0.18 0.24 0.35 -2.23 0.00 0.00 178.31 175.69 2yrq h PHE 110 N -0.21 0.35 0.05 0.41 3.04 -1.56 0.10 116.94 119.12 2yrq h PHE 110 Ca 0.00 0.05 0.02 0.00 3.98 0.00 0.00 57.97 62.02 2yrq h PHE 110 Cb 0.23 -0.01 -0.03 0.00 2.56 0.00 0.00 35.95 38.69 2yrq h PHE 110 CO -0.39 -0.22 -0.21 -0.07 -2.02 0.00 0.00 178.31 175.40 2yrq h LEU 111 N 0.20 -0.60 0.91 0.59 3.38 0.01 0.45 115.31 120.26 2yrq h LEU 111 Ca 0.56 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.56 2yrq h LEU 111 Cb 1.13 0.24 0.01 0.00 0.09 0.00 0.00 40.66 42.13 2yrq h LEU 111 CO -0.66 -0.28 -0.44 0.15 0.09 0.00 0.00 178.44 177.30 2yrq h PHE 112 N -0.36 -1.14 -0.95 1.13 3.57 0.69 -1.13 116.94 118.75 2yrq h PHE 112 Ca 0.04 -0.03 0.21 0.00 3.53 0.00 0.00 57.97 61.73 2yrq h PHE 112 Cb 0.41 0.38 -0.08 0.00 2.79 0.00 0.00 35.95 39.45 2yrq h PHE 112 CO -0.23 -0.71 0.62 0.00 -2.23 0.00 0.00 178.31 175.76 2yrq h SER 114 N 0.50 0.00 1.36 0.00 0.87 0.11 0.36 113.55 116.76 2yrq h SER 114 Ca 0.52 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 61.07 2yrq h SER 114 Cb 1.15 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.11 2yrq h SER 114 CO -0.24 0.34 -0.64 -0.08 -0.53 0.00 0.00 176.83 175.68 2yrq h GLU 115 N 0.00 0.00 0.00 2.24 4.22 0.13 -3.33 114.58 117.83 2yrq h GLU 115 Ca -0.00 0.00 -0.12 0.00 0.08 0.00 0.00 59.36 59.32 2yrq h GLU 115 Cb 0.84 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.07 2yrq h GLU 115 CO 0.04 0.01 -2.12 0.66 -2.18 0.00 0.00 179.01 175.43 2yrq n TYR 116 N -2.84 0.00 -0.12 0.92 4.02 -0.00 -4.39 117.16 114.74 2yrq n TYR 116 Ca 0.01 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.85 2yrq n TYR 116 Cb 0.55 -0.66 0.01 0.00 -0.02 0.00 0.00 39.34 39.22 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 -0.12 0.00 -0.72 2.43 -0.40 0.34 114.38 115.91 2yrq h ARG 117 Ca -0.17 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 2yrq h ARG 117 Cb 1.39 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.97 2yrq h ARG 117 CO 0.01 -0.08 0.00 -0.35 -1.51 0.00 0.00 179.97 178.04 2yrq n PRO 118 N -5.38 0.12 0.00 0.20 -0.04 -1.26 0.04 135.00 128.68 2yrq n PRO 118 Ca 0.02 0.36 -0.21 0.00 -0.04 0.00 0.00 63.50 63.64 2yrq n PRO 118 Cb 0.29 -1.74 -0.14 0.00 -0.04 0.00 0.00 33.50 31.88 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 -1.97 0.75 -0.06 0.54 5.02 0.82 -3.92 118.16 119.35 2yrq n LYS 119 Ca 0.03 0.26 -0.21 0.00 -2.02 0.00 0.00 58.31 56.37 2yrq n LYS 119 Cb 0.20 -1.70 -0.13 0.00 -0.02 0.00 0.00 35.03 33.38 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 0.07 1.04 -0.74 -0.18 3.07 -0.36 -3.29 117.51 117.11 2yrq h ILE 120 Ca -0.43 -2.28 0.17 0.00 1.55 0.00 0.00 64.86 63.87 2yrq h ILE 120 Cb 2.03 2.55 -0.12 0.00 -0.27 0.00 0.00 36.82 41.02 2yrq h ILE 120 CO 0.08 0.53 0.11 0.50 -1.05 0.00 0.00 178.15 178.32 2yrq h LYS 121 N -0.69 0.19 -0.66 0.16 3.11 -0.59 0.19 116.57 118.28 2yrq h LYS 121 Ca -0.30 -0.01 -0.05 0.00 -2.81 0.00 0.00 60.65 57.48 2yrq h LYS 121 Cb 1.47 -0.04 -0.03 0.00 -1.00 0.00 0.00 32.23 32.63 2yrq h LYS 121 CO -0.07 0.12 0.21 0.78 -2.81 0.00 0.00 179.45 177.68 2yrq h GLY 122 N 0.19 1.08 1.13 5.01 0.00 -1.73 -2.88 103.07 105.87 2yrq h GLY 122 Ca 0.42 -0.61 -0.14 0.00 0.00 0.00 0.00 47.33 46.99 2yrq h GLY 122 CO -0.57 0.58 -0.26 0.83 0.00 0.00 0.00 176.54 177.11 2yrq h GLU 123 N 0.97 0.98 -3.83 4.80 5.08 -0.90 -3.37 114.58 118.31 2yrq h GLU 123 Ca 0.22 -0.45 -0.71 0.00 -1.00 0.00 0.00 59.36 57.42 2yrq h GLU 123 Cb 0.27 -0.02 -0.33 0.00 0.50 0.00 0.00 28.75 29.17 2yrq h GLU 123 CO -0.01 1.12 -0.34 -1.01 -1.00 0.00 0.00 179.01 177.77 2yrq s HIS 124 N -4.59 3.48 -1.77 4.33 3.76 0.40 -4.91 115.29 115.98 2yrq s HIS 124 Ca -0.11 -2.49 0.15 0.00 -0.15 0.00 0.00 55.06 52.46 2yrq s HIS 124 Cb 0.12 -3.31 0.86 0.00 1.11 0.00 0.00 32.58 31.35 2yrq s HIS 124 CO 0.87 -0.90 1.37 -0.35 -0.85 0.00 0.00 174.74 174.89 2yrq n PRO 125 N 3.87 0.38 -0.08 8.40 -0.04 -1.24 -2.79 135.00 143.50 2yrq n PRO 125 Ca 0.05 0.06 -0.17 0.00 -0.04 0.00 0.00 63.50 63.40 2yrq n PRO 125 Cb 0.40 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.22 2yrq n PRO 125 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2yrq n GLY 126 N -0.03 -0.58 3.70 0.55 0.00 -1.26 -4.93 105.19 102.65 2yrq n GLY 126 Ca 0.10 -0.22 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 2yrq n GLY 126 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2yrq s LEU 127 N -6.47 4.39 0.37 0.99 1.43 -1.12 -4.90 118.68 113.38 2yrq s LEU 127 Ca -0.25 2.80 0.07 0.00 -1.03 0.00 0.00 54.13 55.73 2yrq s LEU 127 Cb 0.08 -3.58 -0.01 0.00 0.03 0.00 0.00 46.19 42.71 2yrq s LEU 127 CO 0.71 -1.00 0.41 -0.55 0.23 0.00 0.00 176.35 176.14 2yrq s SER 128 N 2.24 5.45 0.23 2.29 0.15 -1.26 -4.67 113.70 118.13 2yrq s SER 128 Ca 0.79 -0.48 0.03 0.00 0.70 0.00 0.00 55.95 57.00 2yrq s SER 128 Cb -0.47 -0.87 0.61 0.00 -1.71 0.00 0.00 66.02 63.57 2yrq s SER 128 CO 0.35 -0.52 1.12 -0.38 1.20 0.00 0.00 173.24 175.01 2yrq n ILE 129 N -1.57 -0.30 0.18 6.45 5.41 -1.26 0.36 119.36 128.63 2yrq n ILE 129 Ca 0.02 1.56 -0.07 0.00 1.00 0.00 0.00 62.75 65.26 2yrq n ILE 129 Cb 0.60 -2.31 -0.03 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 -0.48 0.42 7.39 0.00 -1.93 -2.81 103.07 105.67 2yrq h GLY 130 Ca 0.46 0.18 0.01 0.00 0.00 0.00 0.00 47.33 47.97 2yrq h GLY 130 CO -0.66 -0.17 -0.40 -0.55 0.00 0.00 0.00 176.54 174.76 2yrq h ASP 131 N -0.54 -1.15 -0.96 0.19 5.19 -1.34 -1.92 116.42 115.89 2yrq h ASP 131 Ca -0.05 0.12 0.37 0.00 -0.62 0.00 0.00 57.03 56.85 2yrq h ASP 131 Cb 0.35 0.41 -0.18 0.00 0.18 0.00 0.00 39.33 40.10 2yrq h ASP 131 CO 0.08 -0.51 0.40 0.52 -3.12 0.00 0.00 179.24 176.61 2yrq n VAL 132 N -5.47 -0.41 0.14 -1.35 0.31 0.16 0.45 118.33 112.16 2yrq n VAL 132 Ca -0.09 2.00 -0.13 0.00 -0.01 0.00 0.00 64.34 66.11 2yrq n VAL 132 Cb 0.38 -3.16 -0.07 0.00 -0.91 0.00 0.00 33.84 30.08 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 1.93 -0.34 -0.94 3.52 0.00 -1.06 -1.94 119.26 120.43 2yrq h ALA 133 Ca 0.76 -0.06 0.26 0.00 0.00 0.00 0.00 54.91 55.88 2yrq h ALA 133 Cb 1.94 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 19.89 2yrq h ALA 133 CO -0.78 -0.71 0.66 -0.22 0.00 0.00 0.00 179.25 178.20 2yrq h LYS 134 N -0.36 0.07 -0.02 0.00 3.11 0.09 0.61 116.57 120.07 2yrq h LYS 134 Ca -0.01 -0.00 -0.08 0.00 -2.81 0.00 0.00 60.65 57.75 2yrq h LYS 134 Cb 0.32 -0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.53 2yrq h LYS 134 CO -0.01 0.04 -0.36 -0.22 -2.81 0.00 0.00 179.45 176.10 2yrq h LYS 135 N 0.07 0.03 0.18 1.90 1.63 -1.00 -3.08 116.57 116.29 2yrq h LYS 135 Ca 0.46 -0.01 -0.31 0.00 -0.85 0.00 0.00 60.65 59.94 2yrq h LYS 135 Cb 1.70 -0.00 0.01 0.00 -0.60 0.00 0.00 32.23 33.34 2yrq h LYS 135 CO -0.04 0.38 -1.48 -0.07 -3.45 0.00 0.00 179.45 174.80 2yrq h LEU 136 N 0.03 0.59 -0.68 5.20 3.38 0.28 -3.11 115.31 121.00 2yrq h LEU 136 Ca 0.00 -0.92 0.15 0.00 0.09 0.00 0.00 57.88 57.20 2yrq h LEU 136 Cb 0.64 -0.19 -0.11 0.00 0.09 0.00 0.00 40.66 41.09 2yrq h LEU 136 CO 0.05 1.68 0.03 1.23 0.09 0.00 0.00 178.44 181.51 2yrq h GLY 137 N 0.25 0.77 0.60 0.83 0.00 -1.14 -0.32 103.07 104.05 2yrq h GLY 137 Ca -0.29 0.07 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 2yrq h GLY 137 CO 0.16 -0.23 -0.14 1.05 0.00 0.00 0.00 176.54 177.39 2yrq h GLU 138 N 0.14 0.22 -0.79 4.80 4.11 -1.68 -2.88 114.58 118.49 2yrq h GLU 138 Ca 0.36 -0.14 0.18 0.00 0.07 0.00 0.00 59.36 59.83 2yrq h GLU 138 Cb 0.61 0.02 -0.12 0.00 0.50 0.00 0.00 28.75 29.76 2yrq h GLU 138 CO -0.57 0.73 0.20 0.52 0.07 0.00 0.00 179.01 179.97 2yrq h MET 139 N -0.27 0.25 -0.65 1.06 2.86 -1.29 0.19 114.93 117.08 2yrq h MET 139 Ca 0.00 -0.02 -0.09 0.00 -2.06 0.00 0.00 59.70 57.54 2yrq h MET 139 Cb 0.73 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.31 2yrq h MET 139 CO 0.03 0.17 0.07 2.35 1.06 0.00 0.00 176.91 180.58 2yrq h TRP 140 N 0.26 1.19 0.00 -0.22 -0.00 -1.11 -2.42 115.95 113.65 2yrq h TRP 140 Ca 0.46 -0.18 -0.04 0.00 -0.00 0.00 0.00 58.89 59.13 2yrq h TRP 140 Cb 0.83 -0.32 -0.01 0.00 -0.00 0.00 0.00 29.16 29.67 2yrq h TRP 140 CO -0.27 1.01 -0.18 -0.91 -0.00 0.00 0.00 178.44 178.10 2yrq h ASN 141 N 1.03 0.00 -0.80 2.65 2.35 -0.52 -2.64 115.58 117.66 2yrq h ASN 141 Ca 0.19 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.43 2yrq h ASN 141 Cb 0.49 0.00 -0.29 0.00 0.05 0.00 0.00 38.32 38.57 2yrq h ASN 141 CO 0.02 0.18 0.20 0.59 -1.65 0.00 0.00 177.43 176.77 2yrq n ASN 142 N -3.65 5.31 -4.23 5.81 3.02 0.18 -4.96 115.26 116.74 2yrq n ASN 142 Ca -0.01 -3.76 -0.32 0.00 -0.03 0.00 0.00 54.58 50.46 2yrq n ASN 142 Cb 0.30 -0.72 -0.17 0.00 -0.61 0.00 0.00 39.78 38.59 2yrq n ASN 142 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2yrq s THR 143 N -4.22 2.19 0.41 3.41 2.01 -1.00 -4.97 115.64 113.48 2yrq s THR 143 Ca 0.56 -0.97 -0.26 0.00 0.31 0.00 0.00 61.69 61.33 2yrq s THR 143 Cb 0.46 -1.85 -0.09 0.00 0.01 0.00 0.00 72.50 71.03 2yrq s THR 143 CO 0.02 0.55 1.37 0.00 -0.69 0.00 0.00 174.62 175.88 2yrq s ALA 144 N 0.39 3.31 0.57 7.40 0.00 -1.26 -4.87 121.76 127.30 2yrq s ALA 144 Ca -0.17 1.36 0.29 0.00 0.00 0.00 0.00 51.96 53.44 2yrq s ALA 144 Cb -0.17 -3.54 1.47 0.00 0.00 0.00 0.00 23.12 20.88 2yrq s ALA 144 CO 0.08 -0.98 1.93 0.00 0.00 0.00 0.00 175.76 176.79 2yrq h ALA 145 N 2.63 2.35 -0.17 0.00 0.00 -1.99 -0.73 119.26 121.36 2yrq h ALA 145 Ca -0.50 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 2yrq h ALA 145 Cb 1.25 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2yrq h ALA 145 CO 0.62 -0.75 0.08 -0.44 0.00 0.00 0.00 179.25 178.77 2yrq h ASP 146 N 0.00 0.22 0.13 0.00 5.19 -2.00 -1.00 116.42 118.96 2yrq h ASP 146 Ca 0.25 -0.12 0.00 0.00 -0.62 0.00 0.00 57.03 56.54 2yrq h ASP 146 Cb 1.19 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.65 2yrq h ASP 146 CO -0.00 0.28 0.00 -0.67 -3.12 0.00 0.00 179.24 175.73 2yrq n ASP 147 N -4.89 0.09 -0.04 6.45 -0.08 -0.28 -1.06 116.55 116.74 2yrq n ASP 147 Ca -0.04 0.54 0.03 0.00 -1.51 0.00 0.00 54.79 53.81 2yrq n ASP 147 Cb 0.09 -0.55 -0.16 0.00 2.34 0.00 0.00 41.12 42.84 2yrq n ASP 147 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2yrq n LYS 148 N -1.62 0.68 -0.25 -0.67 5.02 -0.62 -4.43 118.16 116.27 2yrq n LYS 148 Ca 0.01 -0.13 -0.05 0.00 -2.02 0.00 0.00 58.31 56.12 2yrq n LYS 148 Cb 0.05 -1.51 -0.04 0.00 -0.02 0.00 0.00 35.03 33.50 2yrq n LYS 148 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 2yrq n GLN 149 N -2.44 -0.24 -0.07 1.97 7.27 -0.22 0.22 117.38 123.87 2yrq n GLN 149 Ca -0.15 0.92 -0.13 0.00 0.07 0.00 0.00 57.00 57.71 2yrq n GLN 149 Cb 0.79 -1.36 -0.06 0.00 2.41 0.00 0.00 30.24 32.02 2yrq n GLN 149 CO 0.00 0.00 0.00 -1.00 0.07 0.00 0.00 177.06 176.13 2yrq h PRO 150 N 0.00 0.48 -0.87 3.69 0.13 -1.80 0.20 132.00 133.84 2yrq h PRO 150 Ca 0.12 -0.25 0.17 0.00 -0.87 0.00 0.00 66.00 65.17 2yrq h PRO 150 Cb 0.27 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 31.34 2yrq h PRO 150 CO -0.58 0.83 0.57 1.88 -0.23 0.00 0.00 178.00 180.47 2yrq h TYR 151 N 0.16 0.64 0.00 1.56 0.05 -0.50 0.23 116.97 119.10 2yrq h TYR 151 Ca 0.03 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.83 2yrq h TYR 151 Cb 0.74 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 38.28 2yrq h TYR 151 CO 0.08 0.21 -0.21 0.93 -1.05 0.00 0.00 178.16 178.11 2yrq h GLU 152 N 0.51 0.00 -1.00 4.88 4.39 -0.17 -2.97 114.58 120.22 2yrq h GLU 152 Ca 0.44 0.00 0.33 0.00 0.34 0.00 0.00 59.36 60.48 2yrq h GLU 152 Cb 0.94 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 29.44 2yrq h GLU 152 CO -0.18 0.00 0.55 0.87 -1.16 0.00 0.00 179.01 179.09 2yrq h LYS 153 N -0.60 0.26 -0.01 2.33 1.57 -0.91 0.19 116.57 119.38 2yrq h LYS 153 Ca 0.00 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2yrq h LYS 153 Cb 0.21 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 2yrq h LYS 153 CO 0.00 0.17 -0.02 -0.22 -0.57 0.00 0.00 179.45 178.81 2yrq h LYS 154 N 0.26 0.04 -1.00 3.15 1.63 -0.72 -3.19 116.57 116.74 2yrq h LYS 154 Ca 0.75 -0.02 0.21 0.00 -0.85 0.00 0.00 60.65 60.73 2yrq h LYS 154 Cb 1.75 0.00 -0.11 0.00 -0.60 0.00 0.00 32.23 33.27 2yrq h LYS 154 CO -0.64 0.56 0.60 0.00 -3.45 0.00 0.00 179.45 176.53 2yrq h ALA 155 N 0.48 1.70 -0.76 5.00 0.00 -0.53 0.04 119.26 125.18 2yrq h ALA 155 Ca 0.00 0.09 0.15 0.00 0.00 0.00 0.00 54.91 55.15 2yrq h ALA 155 Cb 0.56 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.20 2yrq h ALA 155 CO 0.00 -0.12 0.31 0.00 0.00 0.00 0.00 179.25 179.44 2yrq h ALA 156 N 1.67 1.08 0.05 0.00 0.00 -1.17 -1.63 119.26 119.26 2yrq h ALA 156 Ca 0.60 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.63 2yrq h ALA 156 Cb 1.00 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2yrq h ALA 156 CO -0.41 -0.21 -0.08 0.87 0.00 0.00 0.00 179.25 179.42 2yrq h LYS 157 N 0.45 -0.15 -0.83 0.00 1.79 -1.07 -2.58 116.57 114.18 2yrq h LYS 157 Ca 0.42 0.01 0.20 0.00 -2.18 0.00 0.00 60.65 59.10 2yrq h LYS 157 Cb 0.65 0.03 -0.12 0.00 -1.58 0.00 0.00 32.23 31.21 2yrq h LYS 157 CO -0.41 -0.10 0.26 -0.07 -1.08 0.00 0.00 179.45 178.06 2yrq h LEU 158 N -0.16 0.12 -1.11 2.94 3.38 -1.23 0.28 115.31 119.52 2yrq h LEU 158 Ca 0.01 0.16 0.22 0.00 0.09 0.00 0.00 57.88 58.37 2yrq h LEU 158 Cb 0.17 0.19 -0.11 0.00 0.09 0.00 0.00 40.66 41.00 2yrq h LEU 158 CO -0.04 -0.05 0.62 0.50 0.09 0.00 0.00 178.44 179.55 2yrq h LYS 159 N 0.30 0.59 -0.91 1.13 1.63 -1.08 0.86 116.57 119.09 2yrq h LYS 159 Ca 0.50 -0.04 0.19 0.00 -0.85 0.00 0.00 60.65 60.46 2yrq h LYS 159 Cb 0.93 -0.13 -0.11 0.00 -0.60 0.00 0.00 32.23 32.31 2yrq h LYS 159 CO -0.56 0.39 0.47 0.93 -3.45 0.00 0.00 179.45 177.24 2yrq h GLU 160 N 0.61 0.55 0.00 1.90 5.08 -0.44 0.74 114.58 123.02 2yrq h GLU 160 Ca 0.60 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.92 2yrq h GLU 160 Cb 1.14 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.27 2yrq h GLU 160 CO -0.38 0.36 -0.03 0.87 -1.00 0.00 0.00 179.01 178.83 2yrq h LYS 161 N 0.57 0.00 0.00 2.33 6.56 -0.90 -2.37 116.57 122.76 2yrq h LYS 161 Ca 0.54 0.00 -0.11 0.00 -1.06 0.00 0.00 60.65 60.02 2yrq h LYS 161 Cb 0.91 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.55 2yrq h LYS 161 CO -0.44 0.03 -0.66 -0.92 -2.06 0.00 0.00 179.45 175.41 2yrq h TYR 162 N 0.00 0.00 -0.94 -1.35 3.20 0.42 -3.05 116.97 115.25 2yrq h TYR 162 Ca -0.00 0.00 0.16 0.00 3.14 0.00 0.00 58.73 62.03 2yrq h TYR 162 Cb 0.23 0.00 -0.08 0.00 1.54 0.00 0.00 36.73 38.42 2yrq h TYR 162 CO 0.00 1.09 0.60 0.93 -1.64 0.00 0.00 178.16 179.14 2yrq h GLU 163 N -1.00 0.69 -0.22 1.82 5.08 -1.02 0.21 114.58 120.13 2yrq h GLU 163 Ca -0.17 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 57.96 2yrq h GLU 163 Cb 1.04 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.14 2yrq h GLU 163 CO -0.10 0.46 -0.58 1.57 -1.00 0.00 0.00 179.01 179.35 2yrq h LYS 164 N 0.71 0.79 -0.09 2.33 5.09 -1.58 -1.54 116.57 122.29 2yrq h LYS 164 Ca 0.50 -0.55 -0.01 0.00 0.09 0.00 0.00 60.65 60.67 2yrq h LYS 164 Cb 0.81 0.09 -0.00 0.00 0.10 0.00 0.00 32.23 33.22 2yrq h LYS 164 CO -0.26 1.18 0.01 -0.44 -2.09 0.00 0.00 179.45 177.85 2yrq h ASP 165 N 0.54 0.15 0.65 7.07 3.32 -1.02 -2.79 116.42 124.33 2yrq h ASP 165 Ca -0.01 -0.26 -0.03 0.00 0.02 0.00 0.00 57.03 56.75 2yrq h ASP 165 Cb 1.20 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.71 2yrq h ASP 165 CO 0.13 0.37 -0.15 -0.29 -1.72 0.00 0.00 179.24 177.58 2yrq h ILE 166 N -0.09 0.47 -0.78 0.35 2.10 -0.72 -2.79 117.51 116.06 2yrq h ILE 166 Ca 0.03 -0.76 0.04 0.00 1.08 0.00 0.00 64.86 65.25 2yrq h ILE 166 Cb 0.29 1.52 -0.04 0.00 -1.09 0.00 0.00 36.82 37.50 2yrq h ILE 166 CO 0.00 0.14 0.51 0.00 -1.08 0.00 0.00 178.15 177.73 2yrq h ALA 167 N 1.85 1.54 0.08 0.18 0.00 -0.99 -2.49 119.26 119.43 2yrq h ALA 167 Ca -0.00 -0.04 -0.29 0.00 0.00 0.00 0.00 54.91 54.58 2yrq h ALA 167 Cb 0.51 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2yrq h ALA 167 CO 0.02 0.38 -1.46 0.00 0.00 0.00 0.00 179.25 178.19 2yrq h ALA 168 N 1.55 0.36 -0.42 0.00 0.00 -1.51 -3.22 119.26 116.01 2yrq h ALA 168 Ca 0.31 -1.13 0.06 0.00 0.00 0.00 0.00 54.91 54.16 2yrq h ALA 168 Cb 0.05 0.23 -0.09 0.00 0.00 0.00 0.00 17.79 17.99 2yrq h ALA 168 CO -0.09 1.22 -0.47 -0.92 0.00 0.00 0.00 179.25 178.99 2yrq h TYR 169 N 0.05 -1.41 -0.54 0.00 3.20 -1.25 -0.31 116.97 116.71 2yrq h TYR 169 Ca -0.21 0.07 -0.10 0.00 3.14 0.00 0.00 58.73 61.64 2yrq h TYR 169 Cb 1.97 0.67 -0.02 0.00 1.54 0.00 0.00 36.73 40.90 2yrq h TYR 169 CO 0.04 -0.46 -0.06 0.07 -1.64 0.00 0.00 178.16 176.12 2yrq h ARG 170 N -0.35 0.99 -0.92 1.82 0.11 -1.69 -3.43 114.38 110.91 2yrq h ARG 170 Ca 0.12 -0.34 0.09 0.00 0.10 0.00 0.00 59.98 59.94 2yrq h ARG 170 Cb 0.59 -0.07 -0.21 0.00 1.11 0.00 0.00 29.97 31.39 2yrq h ARG 170 CO -0.59 1.02 -0.26 0.00 0.10 0.00 0.00 179.97 180.24 2yrq s ALA 171 N -4.93 -2.47 0.05 0.08 0.00 -0.51 -5.13 121.76 108.86 2yrq s ALA 171 Ca -0.12 1.56 -0.37 0.00 0.00 0.00 0.00 51.96 53.03 2yrq s ALA 171 Cb 0.13 -2.33 -0.19 0.00 0.00 0.00 0.00 23.12 20.72 2yrq s ALA 171 CO 0.85 -1.52 1.05 0.36 0.00 0.00 0.00 175.76 176.50 2yrq n LYS 172 N 5.42 0.26 -0.65 0.00 2.85 -0.24 -4.15 118.16 121.65 2yrq n LYS 172 Ca 0.01 0.09 0.00 0.00 -1.05 0.00 0.00 58.31 57.36 2yrq n LYS 172 Cb 0.52 -1.55 0.00 0.00 -0.65 0.00 0.00 35.03 33.35 2yrq n LYS 172 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76