#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 4.33 0.06 1.61 0.01 -1.26 -5.06 113.70 113.39 2yrq s SER 2 Ca 0.00 -1.19 -0.23 0.00 1.31 0.00 0.00 55.95 55.84 2yrq s SER 2 Cb 0.00 -0.30 -0.14 0.00 0.21 0.00 0.00 66.02 65.79 2yrq s SER 2 CO 0.00 -0.61 1.54 0.77 0.41 0.00 0.00 173.24 175.36 2yrq h SER 3 N 1.42 0.12 -0.70 2.44 4.64 -1.88 -3.44 113.55 116.15 2yrq h SER 3 Ca -0.43 -0.22 0.06 0.00 -0.47 0.00 0.00 61.79 60.73 2yrq h SER 3 Cb 1.26 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 63.30 2yrq h SER 3 CO 0.71 0.31 -0.08 0.61 -0.87 0.00 0.00 176.83 177.51 2yrq n GLY 4 N -0.51 -0.47 3.27 -0.77 0.00 -1.26 -4.06 105.19 101.39 2yrq n GLY 4 Ca -0.06 -0.36 -0.14 0.00 0.00 0.00 0.00 46.02 45.46 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 -3.59 -0.28 0.89 1.61 0.01 -1.08 -4.83 113.70 106.43 2yrq s SER 5 Ca 0.00 0.30 -0.17 0.00 1.31 0.00 0.00 55.95 57.39 2yrq s SER 5 Cb 0.00 0.44 -0.14 0.00 0.21 0.00 0.00 66.02 66.53 2yrq s SER 5 CO 0.00 -0.38 -0.61 -1.54 0.41 0.00 0.00 173.24 171.11 2yrq n SER 6 N 1.63 -5.37 0.00 2.44 3.41 -1.26 -4.23 113.62 110.23 2yrq n SER 6 Ca -0.19 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 2yrq n SER 6 Cb 0.56 -0.80 0.00 0.00 -0.26 0.00 0.00 64.21 63.72 2yrq n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yrq n GLY 7 N 3.21 1.80 3.94 5.00 0.00 -1.26 -4.73 105.19 113.14 2yrq n GLY 7 Ca 0.00 0.40 -0.19 0.00 0.00 0.00 0.00 46.02 46.23 2yrq n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2yrq s MET 8 N 0.00 2.86 -0.29 1.61 0.00 -1.26 -4.64 119.30 117.57 2yrq s MET 8 Ca 0.00 -1.22 0.02 0.00 0.00 0.00 0.00 55.69 54.49 2yrq s MET 8 Cb 0.00 -2.65 0.16 0.00 0.00 0.00 0.00 34.83 32.34 2yrq s MET 8 CO 0.00 -0.05 0.39 0.20 0.00 0.00 0.00 175.02 175.56 2yrq s GLY 9 N -4.16 -0.48 -0.25 3.16 0.00 -1.26 -4.90 107.32 99.42 2yrq s GLY 9 Ca 0.47 0.07 0.00 0.00 0.00 0.00 0.00 44.72 45.26 2yrq s GLY 9 CO 0.30 2.97 0.00 0.28 0.00 0.00 0.00 173.10 176.65 2yrq n LYS 10 N 5.30 -2.06 -1.43 2.90 4.01 -1.26 -2.89 118.16 122.73 2yrq n LYS 10 Ca 0.01 0.14 0.00 0.00 -0.51 0.00 0.00 58.31 57.95 2yrq n LYS 10 Cb 0.49 -4.46 0.00 0.00 -0.51 0.00 0.00 35.03 30.55 2yrq n LYS 10 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2yrq n GLY 11 N -0.34 -1.92 3.72 0.72 0.00 -1.26 -5.09 105.19 101.02 2yrq n GLY 11 Ca -0.03 -0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.36 5.17 0.00 1.61 1.01 -1.14 -4.99 116.67 117.97 2yrq s ASP 12 Ca 0.00 -0.14 0.12 0.00 0.71 0.00 0.00 52.55 53.24 2yrq s ASP 12 Cb 0.00 -1.28 0.74 0.00 1.01 0.00 0.00 42.92 43.39 2yrq s ASP 12 CO 0.00 0.16 1.17 -0.81 0.21 0.00 0.00 175.17 175.90 2yrq n PRO 13 N 0.45 0.49 -0.05 8.23 -0.04 -1.26 -3.33 135.00 139.49 2yrq n PRO 13 Ca -0.10 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.25 2yrq n PRO 13 Cb 0.52 -1.40 -0.05 0.00 -0.04 0.00 0.00 33.50 32.54 2yrq n PRO 13 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2yrq h LYS 14 N 0.00 0.26 -4.24 0.54 1.79 -1.99 -3.45 116.57 109.49 2yrq h LYS 14 Ca 0.00 -0.05 -0.54 0.00 -2.18 0.00 0.00 60.65 57.87 2yrq h LYS 14 Cb 0.00 -0.04 0.04 0.00 -1.58 0.00 0.00 32.23 30.66 2yrq h LYS 14 CO 0.00 0.37 -0.04 1.17 -1.08 0.00 0.00 179.45 179.87 2yrq n LYS 15 N -4.83 0.00 -2.26 3.15 3.00 -1.21 -4.85 118.16 111.16 2yrq n LYS 15 Ca -0.04 0.00 -0.36 0.00 -0.00 0.00 0.00 58.31 57.90 2yrq n LYS 15 Cb 0.14 -0.99 -0.01 0.00 0.00 0.00 0.00 35.03 34.18 2yrq n LYS 15 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2yrq s PRO 16 N -0.14 3.63 -0.54 1.64 0.04 -1.26 -4.96 135.00 133.40 2yrq s PRO 16 Ca 0.61 1.72 0.01 0.00 0.04 0.00 0.00 61.00 63.38 2yrq s PRO 16 Cb -0.85 -2.28 0.45 0.00 0.04 0.00 0.00 34.50 31.87 2yrq s PRO 16 CO 0.40 -0.65 1.76 2.89 0.04 0.00 0.00 177.00 181.45 2yrq n ARG 17 N -0.75 2.99 0.00 4.56 1.85 -1.26 -4.83 116.66 119.22 2yrq n ARG 17 Ca 0.09 -3.57 0.00 0.00 -1.00 0.00 0.00 57.85 53.36 2yrq n ARG 17 Cb 0.49 -2.28 0.00 0.00 -1.05 0.00 0.00 32.46 29.61 2yrq n ARG 17 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2yrq n GLY 18 N -0.85 -2.95 2.94 2.89 0.00 -1.26 -4.74 105.19 101.22 2yrq n GLY 18 Ca 0.57 0.15 -0.35 0.00 0.00 0.00 0.00 46.02 46.38 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 -1.09 0.00 -3.94 1.61 2.85 -1.26 -4.99 118.16 111.34 2yrq n LYS 19 Ca 0.00 0.00 -0.10 0.00 -1.05 0.00 0.00 58.31 57.16 2yrq n LYS 19 Cb 0.00 -0.90 -0.12 0.00 -0.65 0.00 0.00 35.03 33.35 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 -0.90 0.19 0.91 -1.58 -1.94 -1.26 -5.06 119.30 109.65 2yrq s MET 20 Ca 0.52 -0.36 -0.12 0.00 -1.71 0.00 0.00 55.69 54.01 2yrq s MET 20 Cb -0.45 0.05 0.13 0.00 2.01 0.00 0.00 34.83 36.57 2yrq s MET 20 CO 0.60 -0.03 1.10 -1.12 -0.01 0.00 0.00 175.02 175.56 2yrq s SER 21 N -0.86 3.43 0.23 3.03 0.01 -1.26 -4.55 113.70 113.73 2yrq s SER 21 Ca -0.09 1.32 -0.15 0.00 1.31 0.00 0.00 55.95 58.34 2yrq s SER 21 Cb -0.06 -2.00 0.26 0.00 0.21 0.00 0.00 66.02 64.43 2yrq s SER 21 CO -0.01 -2.64 1.58 0.77 0.41 0.00 0.00 173.24 173.35 2yrq h SER 22 N -1.55 -1.04 0.52 2.44 4.64 -1.92 0.79 113.55 117.42 2yrq h SER 22 Ca -0.50 0.26 -0.03 0.00 -0.47 0.00 0.00 61.79 61.05 2yrq h SER 22 Cb 1.30 0.59 0.01 0.00 -0.31 0.00 0.00 62.40 63.98 2yrq h SER 22 CO 0.57 -0.29 -0.25 0.22 -0.87 0.00 0.00 176.83 176.21 2yrq h TYR 23 N -0.05 -0.64 -0.98 4.77 3.20 -1.95 0.92 116.97 122.24 2yrq h TYR 23 Ca 0.34 -0.02 0.33 0.00 3.14 0.00 0.00 58.73 62.52 2yrq h TYR 23 Cb 0.59 0.21 -0.17 0.00 1.54 0.00 0.00 36.73 38.90 2yrq h TYR 23 CO -0.70 -0.32 0.32 0.00 -1.64 0.00 0.00 178.16 175.83 2yrq h ALA 24 N -0.75 1.68 0.10 1.82 0.00 -1.68 0.24 119.26 120.67 2yrq h ALA 24 Ca -0.07 0.28 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2yrq h ALA 24 Cb 0.61 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2yrq h ALA 24 CO 0.12 -0.71 -0.05 0.74 0.00 0.00 0.00 179.25 179.34 2yrq h PHE 25 N 0.07 -0.13 -0.97 0.00 0.04 -0.82 -3.33 116.94 111.80 2yrq h PHE 25 Ca 0.71 -0.00 0.22 0.00 2.80 0.00 0.00 57.97 61.70 2yrq h PHE 25 Cb 1.68 0.04 -0.18 0.00 2.20 0.00 0.00 35.95 39.69 2yrq h PHE 25 CO -0.21 -0.08 -0.12 0.35 -0.60 0.00 0.00 178.31 177.64 2yrq h PHE 26 N -0.88 -0.31 -1.04 -0.55 3.57 -0.01 1.04 116.94 118.77 2yrq h PHE 26 Ca -0.01 0.08 0.29 0.00 3.53 0.00 0.00 57.97 61.85 2yrq h PHE 26 Cb 0.11 0.29 -0.12 0.00 2.79 0.00 0.00 35.95 39.01 2yrq h PHE 26 CO 0.00 -0.42 0.63 0.28 -2.23 0.00 0.00 178.31 176.58 2yrq h VAL 27 N 0.01 0.43 0.13 1.41 2.07 -0.68 -0.90 116.25 118.71 2yrq h VAL 27 Ca 0.52 -0.14 -0.33 0.00 0.82 0.00 0.00 66.70 67.56 2yrq h VAL 27 Cb 0.92 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 2yrq h VAL 27 CO -0.95 0.08 -1.75 -0.61 0.02 0.00 0.00 177.57 174.35 2yrq h GLN 28 N 0.42 0.27 -1.06 1.57 4.15 0.81 -3.25 115.11 118.02 2yrq h GLN 28 Ca 0.67 -0.46 0.29 0.00 0.77 0.00 0.00 58.65 59.92 2yrq h GLN 28 Cb 1.54 0.17 -0.11 0.00 0.21 0.00 0.00 27.48 29.29 2yrq h GLN 28 CO -0.47 1.22 0.66 1.15 -1.93 0.00 0.00 178.83 179.47 2yrq h THR 29 N -0.09 0.44 0.01 2.39 2.02 0.80 0.16 112.91 118.63 2yrq h THR 29 Ca -0.37 -0.13 -0.04 0.00 0.77 0.00 0.00 66.41 66.63 2yrq h THR 29 Cb 1.93 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 2yrq h THR 29 CO 0.08 0.07 -0.16 0.00 0.37 0.00 0.00 175.52 175.88 2yrq h ARG 31 N -0.69 0.35 0.06 0.00 0.11 -1.14 -1.36 114.38 111.71 2yrq h ARG 31 Ca -0.02 -0.02 -0.00 0.00 0.10 0.00 0.00 59.98 60.03 2yrq h ARG 31 Cb 0.99 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 31.99 2yrq h ARG 31 CO 0.03 0.23 -0.03 0.93 0.10 0.00 0.00 179.97 181.23 2yrq h GLU 32 N 0.36 -0.08 -0.99 0.08 5.08 -0.81 -3.08 114.58 115.14 2yrq h GLU 32 Ca 0.32 0.01 0.19 0.00 -1.00 0.00 0.00 59.36 58.88 2yrq h GLU 32 Cb 0.76 0.02 -0.11 0.00 0.50 0.00 0.00 28.75 29.92 2yrq h GLU 32 CO -0.09 0.52 0.60 0.93 -1.00 0.00 0.00 179.01 179.97 2yrq h GLU 33 N -0.83 0.71 0.02 2.33 5.08 -0.99 -2.64 114.58 118.27 2yrq h GLU 33 Ca -0.01 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2yrq h GLU 33 Cb 0.64 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.73 2yrq h GLU 33 CO 0.01 0.47 -0.01 1.25 -1.00 0.00 0.00 179.01 179.74 2yrq h HIS 34 N 0.74 -0.03 -1.45 4.33 2.76 -1.33 -1.83 115.15 118.34 2yrq h HIS 34 Ca 0.58 -0.00 0.44 0.00 -2.20 0.00 0.00 60.37 59.19 2yrq h HIS 34 Cb 0.92 0.01 -0.08 0.00 1.55 0.00 0.00 27.41 29.80 2yrq h HIS 34 CO -0.01 -0.02 1.01 1.63 -1.30 0.00 0.00 177.93 179.24 2yrq n LYS 35 N -2.08 -0.01 -0.03 5.26 4.01 -1.09 0.18 118.16 124.40 2yrq n LYS 35 Ca -0.00 0.95 -0.14 0.00 -0.51 0.00 0.00 58.31 58.61 2yrq n LYS 35 Cb 0.01 -2.05 -0.11 0.00 -0.51 0.00 0.00 35.03 32.37 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 0.04 -0.36 1.97 1.79 -1.19 -2.62 116.57 116.20 2yrq h LYS 36 Ca 0.76 -0.03 -0.06 0.00 -2.18 0.00 0.00 60.65 59.13 2yrq h LYS 36 Cb 2.83 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 33.47 2yrq h LYS 36 CO -0.15 0.70 -0.02 0.87 -1.08 0.00 0.00 179.45 179.77 2yrq h LYS 37 N -0.61 0.65 -3.03 3.15 1.79 0.28 -3.39 116.57 115.40 2yrq h LYS 37 Ca -0.00 -0.22 -0.59 0.00 -2.18 0.00 0.00 60.65 57.66 2yrq h LYS 37 Cb 0.71 -0.05 -0.40 0.00 -1.58 0.00 0.00 32.23 30.91 2yrq h LYS 37 CO 0.01 0.77 -0.78 -1.01 -1.08 0.00 0.00 179.45 177.36 2yrq s HIS 38 N -4.93 1.38 0.02 -1.35 3.76 0.75 -5.00 115.29 109.92 2yrq s HIS 38 Ca -0.13 -1.84 -0.22 0.00 -0.15 0.00 0.00 55.06 52.72 2yrq s HIS 38 Cb 0.09 -1.47 -0.16 0.00 1.11 0.00 0.00 32.58 32.15 2yrq s HIS 38 CO 0.79 -0.83 1.33 -1.00 -0.85 0.00 0.00 174.74 174.17 2yrq h PRO 39 N 7.39 0.25 -0.86 8.40 0.13 -1.68 -3.21 132.00 142.44 2yrq h PRO 39 Ca -0.05 -0.13 0.01 0.00 -0.87 0.00 0.00 66.00 64.96 2yrq h PRO 39 Cb 0.97 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.06 2yrq h PRO 39 CO 0.42 0.66 0.57 0.38 -0.23 0.00 0.00 178.00 179.80 2yrq h ASP 40 N -0.15 0.98 -1.95 1.44 2.03 -1.94 -3.43 116.42 113.39 2yrq h ASP 40 Ca 0.02 -0.02 -0.65 0.00 -0.73 0.00 0.00 57.03 55.65 2yrq h ASP 40 Cb 0.61 -0.24 0.07 0.00 -0.83 0.00 0.00 39.33 38.94 2yrq h ASP 40 CO 0.03 0.70 0.42 0.00 -1.03 0.00 0.00 179.24 179.35 2yrq n ALA 41 N -2.40 -0.48 -3.34 4.15 0.00 -1.21 -4.92 120.51 112.31 2yrq n ALA 41 Ca 0.10 0.48 -0.45 0.00 0.00 0.00 0.00 53.44 53.56 2yrq n ALA 41 Cb 0.03 -2.10 -0.05 0.00 0.00 0.00 0.00 19.45 17.33 2yrq n ALA 41 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2yrq s SER 42 N 0.28 6.14 -0.30 0.00 0.15 -1.26 -4.99 113.70 113.72 2yrq s SER 42 Ca 0.77 -1.82 -0.16 0.00 0.70 0.00 0.00 55.95 55.44 2yrq s SER 42 Cb -0.85 -2.18 -0.02 0.00 -1.71 0.00 0.00 66.02 61.25 2yrq s SER 42 CO 0.49 -0.83 0.43 0.54 1.20 0.00 0.00 173.24 175.06 2yrq s VAL 43 N 1.54 5.12 0.66 4.45 0.11 -1.26 -5.06 120.40 125.95 2yrq s VAL 43 Ca 0.04 0.46 -0.17 0.00 -2.93 0.00 0.00 61.98 59.37 2yrq s VAL 43 Cb -0.29 -3.81 -0.00 0.00 -1.53 0.00 0.00 36.38 30.75 2yrq s VAL 43 CO 0.02 0.00 1.21 0.20 -3.33 0.00 0.00 175.10 173.21 2yrq s ASN 44 N 1.68 4.74 0.07 3.54 0.01 -1.26 -4.95 114.94 118.76 2yrq s ASN 44 Ca 0.16 2.38 -0.13 0.00 -0.71 0.00 0.00 52.86 54.57 2yrq s ASN 44 Cb -0.16 -2.59 -0.25 0.00 0.41 0.00 0.00 41.25 38.66 2yrq s ASN 44 CO 0.11 -1.90 1.16 0.15 -1.51 0.00 0.00 177.10 175.11 2yrq h PHE 45 N 0.34 0.97 -0.20 2.20 3.57 -1.99 -2.80 116.94 119.04 2yrq h PHE 45 Ca -0.49 -0.57 -0.21 0.00 3.53 0.00 0.00 57.97 60.23 2yrq h PHE 45 Cb 1.30 -0.09 0.01 0.00 2.79 0.00 0.00 35.95 39.95 2yrq h PHE 45 CO 0.47 1.41 -0.69 1.03 -2.23 0.00 0.00 178.31 178.30 2yrq h SER 46 N 0.31 0.95 -0.33 0.41 0.87 -1.99 -2.34 113.55 111.43 2yrq h SER 46 Ca -0.15 -0.60 -0.01 0.00 -1.23 0.00 0.00 61.79 59.80 2yrq h SER 46 Cb 1.80 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 63.47 2yrq h SER 46 CO 0.22 1.38 0.17 1.05 -0.53 0.00 0.00 176.83 179.12 2yrq h GLU 47 N 0.57 0.48 -0.17 2.24 4.11 -1.96 0.70 114.58 120.54 2yrq h GLU 47 Ca -0.03 -0.07 -0.07 0.00 0.07 0.00 0.00 59.36 59.26 2yrq h GLU 47 Cb 1.31 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 2yrq h GLU 47 CO 0.15 0.43 -0.22 0.35 0.07 0.00 0.00 179.01 179.78 2yrq h PHE 48 N 0.41 0.33 0.27 2.06 3.57 -1.53 -1.77 116.94 120.27 2yrq h PHE 48 Ca 0.12 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 2yrq h PHE 48 Cb 0.10 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.76 2yrq h PHE 48 CO -0.02 0.51 -0.13 1.03 -2.23 0.00 0.00 178.31 177.47 2yrq h SER 49 N 0.28 -0.31 -0.99 0.41 0.87 -1.02 -0.30 113.55 112.48 2yrq h SER 49 Ca 0.05 0.01 0.23 0.00 -1.23 0.00 0.00 61.79 60.85 2yrq h SER 49 Cb 0.55 0.08 -0.09 0.00 -0.44 0.00 0.00 62.40 62.50 2yrq h SER 49 CO 0.04 -0.01 0.63 0.07 -0.53 0.00 0.00 176.83 177.04 2yrq h LYS 50 N -0.80 0.49 0.28 2.24 2.10 -0.93 -2.06 116.57 117.88 2yrq h LYS 50 Ca -0.04 -0.03 -0.01 0.00 -2.00 0.00 0.00 60.65 58.57 2yrq h LYS 50 Cb 0.28 -0.11 0.00 0.00 -0.90 0.00 0.00 32.23 31.50 2yrq h LYS 50 CO 0.06 0.32 -0.13 0.87 -2.00 0.00 0.00 179.45 178.57 2yrq h LYS 51 N 0.50 -0.36 -1.63 0.07 1.57 -1.38 -3.18 116.57 112.17 2yrq h LYS 51 Ca 0.56 0.02 0.47 0.00 -1.87 0.00 0.00 60.65 59.84 2yrq h LYS 51 Cb 1.25 0.08 -0.07 0.00 0.08 0.00 0.00 32.23 33.57 2yrq h LYS 51 CO -0.30 -0.04 1.17 0.00 -0.57 0.00 0.00 179.45 179.72 2yrq n SER 53 N -3.60 0.00 0.31 0.00 2.88 -1.13 -0.01 113.62 112.08 2yrq n SER 53 Ca 0.37 0.77 0.18 0.00 -1.33 0.00 0.00 58.87 58.86 2yrq n SER 53 Cb 1.66 -0.41 1.01 0.00 -0.75 0.00 0.00 64.21 65.72 2yrq n SER 53 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2yrq h GLU 54 N 0.00 0.00 0.00 -1.46 5.08 -1.10 -0.89 114.58 116.21 2yrq h GLU 54 Ca 0.00 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.16 2yrq h GLU 54 Cb 0.00 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 2yrq h GLU 54 CO 0.00 0.02 -0.97 -0.09 -1.00 0.00 0.00 179.01 176.97 2yrq h ARG 55 N 0.00 0.00 0.02 2.33 2.43 -0.47 -2.90 114.38 115.79 2yrq h ARG 55 Ca -0.00 0.00 -0.27 0.00 -0.81 0.00 0.00 59.98 58.90 2yrq h ARG 55 Cb 0.09 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 29.66 2yrq h ARG 55 CO 0.00 0.91 -1.07 2.35 -1.51 0.00 0.00 179.97 180.65 2yrq h TRP 56 N 0.00 1.04 -0.27 2.20 2.91 0.96 -3.04 115.95 119.75 2yrq h TRP 56 Ca -0.02 -0.58 -0.05 0.00 1.13 0.00 0.00 58.89 59.37 2yrq h TRP 56 Cb 1.73 -0.11 -0.01 0.00 -0.51 0.00 0.00 29.16 30.26 2yrq h TRP 56 CO 0.00 1.42 -0.04 1.57 -1.03 0.00 0.00 178.44 180.36 2yrq h LYS 57 N 0.37 0.51 -0.62 2.65 2.10 -1.50 -2.97 116.57 117.10 2yrq h LYS 57 Ca -0.14 -0.18 0.05 0.00 -2.00 0.00 0.00 60.65 58.38 2yrq h LYS 57 Cb 1.72 -0.04 -0.04 0.00 -0.90 0.00 0.00 32.23 32.98 2yrq h LYS 57 CO 0.21 0.70 0.41 0.00 -2.00 0.00 0.00 179.45 178.77 2yrq h THR 58 N 0.28 1.04 -1.83 0.07 1.03 -1.60 -3.43 112.91 108.46 2yrq h THR 58 Ca 0.07 -0.23 -0.66 0.00 -0.01 0.00 0.00 66.41 65.59 2yrq h THR 58 Cb 0.49 0.31 0.05 0.00 -1.07 0.00 0.00 68.15 67.93 2yrq h THR 58 CO 0.02 0.12 0.65 0.23 -0.01 0.00 0.00 175.52 176.53 2yrq n MET 59 N -4.47 1.47 -0.94 0.00 2.81 -1.12 -4.93 117.12 109.94 2yrq n MET 59 Ca 0.08 0.53 -0.30 0.00 -1.81 0.00 0.00 57.70 56.21 2yrq n MET 59 Cb 0.19 -2.23 0.17 0.00 -0.71 0.00 0.00 33.22 30.64 2yrq n MET 59 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 2yrq s SER 60 N 1.29 2.75 0.31 7.83 1.04 -1.26 -4.74 113.70 120.92 2yrq s SER 60 Ca 0.86 1.64 0.03 0.00 0.48 0.00 0.00 55.95 58.96 2yrq s SER 60 Cb -0.88 -2.29 0.62 0.00 0.10 0.00 0.00 66.02 63.57 2yrq s SER 60 CO 0.48 -3.11 1.87 0.00 0.98 0.00 0.00 173.24 173.45 2yrq h ALA 61 N -1.88 1.61 -0.79 5.32 0.00 -1.95 -0.66 119.26 120.92 2yrq h ALA 61 Ca -0.51 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 2yrq h ALA 61 Cb 1.29 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 2yrq h ALA 61 CO 0.51 0.18 0.47 1.57 0.00 0.00 0.00 179.25 181.98 2yrq h LYS 62 N 0.92 1.07 -0.33 0.00 2.10 -1.99 0.42 116.57 118.75 2yrq h LYS 62 Ca 0.45 -0.10 -0.11 0.00 -2.00 0.00 0.00 60.65 58.89 2yrq h LYS 62 Cb 0.46 -0.22 -0.01 0.00 -0.90 0.00 0.00 32.23 31.56 2yrq h LYS 62 CO -0.21 0.76 -0.23 0.93 -2.00 0.00 0.00 179.45 178.69 2yrq h GLU 63 N 1.09 0.73 -0.10 0.07 4.39 -1.48 -3.14 114.58 116.13 2yrq h GLU 63 Ca 0.28 -0.35 -0.16 0.00 0.34 0.00 0.00 59.36 59.47 2yrq h GLU 63 Cb -0.03 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 2yrq h GLU 63 CO -0.05 0.97 -0.63 0.87 -1.16 0.00 0.00 179.01 179.01 2yrq h LYS 64 N 0.50 0.38 0.00 2.33 1.57 -0.98 -3.35 116.57 117.03 2yrq h LYS 64 Ca 0.06 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 2yrq h LYS 64 Cb 0.79 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.14 2yrq h LYS 64 CO 0.06 0.89 0.00 0.41 -0.57 0.00 0.00 179.45 180.24 2yrq n GLY 65 N 0.36 -3.16 0.34 3.86 0.00 0.14 0.00 105.19 106.73 2yrq n GLY 65 Ca -0.03 0.61 -0.02 0.00 0.00 0.00 0.00 46.02 46.58 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 -0.86 1.61 2.10 -1.70 0.39 116.57 118.05 2yrq h LYS 66 Ca 0.00 0.00 0.15 0.00 -2.00 0.00 0.00 60.65 58.80 2yrq h LYS 66 Cb 0.00 0.02 -0.09 0.00 -0.90 0.00 0.00 32.23 31.25 2yrq h LYS 66 CO 0.00 -0.05 0.45 0.74 -2.00 0.00 0.00 179.45 178.60 2yrq h PHE 67 N -0.07 0.79 -0.23 0.07 0.04 -1.29 -1.19 116.94 115.06 2yrq h PHE 67 Ca 0.31 0.03 0.02 0.00 2.80 0.00 0.00 57.97 61.13 2yrq h PHE 67 Cb 0.58 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.48 2yrq h PHE 67 CO -0.69 0.20 0.11 0.93 -0.60 0.00 0.00 178.31 178.25 2yrq h GLU 68 N 0.64 0.23 -0.97 1.51 4.39 0.36 -0.34 114.58 120.41 2yrq h GLU 68 Ca 0.47 -0.01 0.05 0.00 0.34 0.00 0.00 59.36 60.20 2yrq h GLU 68 Cb 0.65 -0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 29.19 2yrq h GLU 68 CO -0.36 0.15 0.63 0.22 -1.16 0.00 0.00 179.01 178.50 2yrq h ASP 69 N 0.24 1.02 0.37 1.42 1.82 -0.43 0.10 116.42 120.96 2yrq h ASP 69 Ca 0.10 -0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 56.72 2yrq h ASP 69 Cb 0.03 -0.22 0.00 0.00 0.68 0.00 0.00 39.33 39.82 2yrq h ASP 69 CO -0.07 0.68 -0.18 0.24 -1.61 0.00 0.00 179.24 178.30 2yrq h MET 70 N 1.17 -0.48 -0.08 0.28 0.00 -0.79 0.14 114.93 115.17 2yrq h MET 70 Ca 0.40 0.03 0.03 0.00 0.00 0.00 0.00 59.70 60.16 2yrq h MET 70 Cb 0.09 0.11 -0.03 0.00 0.00 0.00 0.00 31.60 31.77 2yrq h MET 70 CO -0.14 -0.16 -0.11 0.00 0.00 0.00 0.00 176.91 176.49 2yrq h ALA 71 N -0.38 -0.06 -0.63 6.32 0.00 -0.87 0.72 119.26 124.37 2yrq h ALA 71 Ca -0.05 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2yrq h ALA 71 Cb 0.53 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 2yrq h ALA 71 CO 0.08 -0.58 0.41 1.57 0.00 0.00 0.00 179.25 180.73 2yrq h LYS 72 N -0.15 0.80 -0.83 0.00 2.10 -0.86 -2.33 116.57 115.31 2yrq h LYS 72 Ca 0.07 -0.05 -0.02 0.00 -2.00 0.00 0.00 60.65 58.65 2yrq h LYS 72 Cb 0.25 -0.18 -0.04 0.00 -0.90 0.00 0.00 32.23 31.36 2yrq h LYS 72 CO -0.17 0.53 0.43 0.00 -2.00 0.00 0.00 179.45 178.24 2yrq h ALA 73 N 1.24 1.20 -0.68 0.07 0.00 -0.50 -2.25 119.26 118.35 2yrq h ALA 73 Ca 0.24 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 55.10 2yrq h ALA 73 Cb -0.06 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.35 2yrq h ALA 73 CO -0.07 0.63 0.45 -0.44 0.00 0.00 0.00 179.25 179.82 2yrq h ASP 74 N 1.17 0.51 -1.18 0.00 3.32 -0.31 -1.29 116.42 118.64 2yrq h ASP 74 Ca 0.29 0.01 0.34 0.00 0.02 0.00 0.00 57.03 57.69 2yrq h ASP 74 Cb 0.06 -0.10 -0.05 0.00 0.22 0.00 0.00 39.33 39.46 2yrq h ASP 74 CO -0.04 0.32 1.00 0.11 -1.72 0.00 0.00 179.24 178.90 2yrq h LYS 75 N 0.58 0.00 0.00 3.56 1.79 -1.22 0.17 116.57 121.45 2yrq h LYS 75 Ca 0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.78 2yrq h LYS 75 Cb 0.44 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.09 2yrq h LYS 75 CO -0.10 0.00 -0.04 0.00 -1.08 0.00 0.00 179.45 178.23 2yrq h ALA 76 N 1.12 0.00 -1.17 3.86 0.00 -1.40 -3.37 119.26 118.30 2yrq h ALA 76 Ca 0.56 -0.16 0.38 0.00 0.00 0.00 0.00 54.91 55.70 2yrq h ALA 76 Cb 2.55 0.04 -0.13 0.00 0.00 0.00 0.00 17.79 20.25 2yrq h ALA 76 CO -0.01 0.04 0.73 0.07 0.00 0.00 0.00 179.25 180.08 2yrq h ARG 77 N -0.16 0.17 -0.76 0.00 -0.00 -1.48 0.38 114.38 112.53 2yrq h ARG 77 Ca 0.00 -0.01 0.17 0.00 -0.00 0.00 0.00 59.98 60.14 2yrq h ARG 77 Cb 0.04 -0.04 -0.11 0.00 -0.00 0.00 0.00 29.97 29.86 2yrq h ARG 77 CO 0.00 0.11 0.20 -0.92 -0.00 0.00 0.00 179.97 179.36 2yrq h TYR 78 N 0.18 0.31 -1.73 4.08 3.20 -0.84 0.16 116.97 122.33 2yrq h TYR 78 Ca 0.77 0.04 0.52 0.00 3.14 0.00 0.00 58.73 63.20 2yrq h TYR 78 Cb 2.18 -0.02 -0.09 0.00 1.54 0.00 0.00 36.73 40.33 2yrq h TYR 78 CO -0.01 -0.09 1.21 0.93 -1.64 0.00 0.00 178.16 178.56 2yrq h GLU 79 N 0.28 0.01 -0.57 1.82 4.39 -0.39 0.63 114.58 120.75 2yrq h GLU 79 Ca 0.44 -0.00 0.09 0.00 0.34 0.00 0.00 59.36 60.23 2yrq h GLU 79 Cb 0.76 -0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.34 2yrq h GLU 79 CO -0.52 0.01 0.18 0.07 -1.16 0.00 0.00 179.01 177.58 2yrq h ARG 80 N 0.01 0.33 -1.01 2.33 0.11 -0.84 -0.62 114.38 114.70 2yrq h ARG 80 Ca 0.88 -0.02 0.24 0.00 0.10 0.00 0.00 59.98 61.18 2yrq h ARG 80 Cb 3.33 -0.07 -0.10 0.00 1.11 0.00 0.00 29.97 34.24 2yrq h ARG 80 CO -0.14 0.22 0.63 0.93 0.10 0.00 0.00 179.97 181.71 2yrq h GLU 81 N 0.34 0.52 -0.84 0.08 4.39 0.11 -1.18 114.58 117.99 2yrq h GLU 81 Ca 0.29 -0.03 0.28 0.00 0.34 0.00 0.00 59.36 60.24 2yrq h GLU 81 Cb 0.37 -0.12 -0.16 0.00 -0.10 0.00 0.00 28.75 28.75 2yrq h GLU 81 CO -0.32 0.34 0.19 -0.12 -1.16 0.00 0.00 179.01 177.94 2yrq n MET 82 N -4.71 -0.06 -0.33 2.33 1.56 -0.24 0.49 117.12 116.15 2yrq n MET 82 Ca 0.25 1.23 0.03 0.00 -0.27 0.00 0.00 57.70 58.93 2yrq n MET 82 Cb 0.75 -2.04 0.10 0.00 2.15 0.00 0.00 33.22 34.18 2yrq n MET 82 CO 0.00 0.00 0.00 -0.22 -0.73 0.00 0.00 175.97 175.02 2yrq h LYS 83 N 0.00 -0.01 0.00 2.12 3.64 -1.37 1.47 116.57 122.42 2yrq h LYS 83 Ca 0.59 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.95 2yrq h LYS 83 Cb 1.39 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.20 2yrq h LYS 83 CO -0.74 -0.01 -0.10 1.79 -2.27 0.00 0.00 179.45 178.13 2yrq h THR 84 N -0.01 0.97 -1.13 1.00 1.35 -0.10 -3.36 112.91 111.63 2yrq h THR 84 Ca 0.41 -0.35 -0.69 0.00 -0.55 0.00 0.00 66.41 65.23 2yrq h THR 84 Cb 0.65 1.19 0.10 0.00 -1.73 0.00 0.00 68.15 68.36 2yrq h THR 84 CO -0.94 0.10 -0.33 0.00 -0.25 0.00 0.00 175.52 174.09 2yrq n TYR 85 N -4.28 -0.08 -3.74 4.73 4.19 0.50 -4.66 117.16 113.82 2yrq n TYR 85 Ca -0.03 0.96 -0.30 0.00 3.31 0.00 0.00 57.90 61.85 2yrq n TYR 85 Cb 0.18 -2.02 -0.15 0.00 0.49 0.00 0.00 39.34 37.84 2yrq n TYR 85 CO 0.00 0.00 0.00 0.42 0.91 0.00 0.00 176.86 178.19 2yrq s ILE 86 N -0.76 0.85 1.00 2.97 1.01 -1.26 -2.65 121.20 122.36 2yrq s ILE 86 Ca 0.70 -1.27 -0.12 0.00 0.00 0.00 0.00 60.65 59.95 2yrq s ILE 86 Cb -0.98 -1.58 0.19 0.00 0.01 0.00 0.00 42.46 40.10 2yrq s ILE 86 CO 0.56 -0.59 1.09 -2.16 0.00 0.00 0.00 174.94 173.85 2yrq s PRO 87 N 1.64 0.41 1.03 2.79 0.04 -1.26 -5.04 135.00 134.61 2yrq s PRO 87 Ca 0.08 0.52 -0.13 0.00 0.04 0.00 0.00 61.00 61.51 2yrq s PRO 87 Cb -0.17 -1.73 0.20 0.00 0.04 0.00 0.00 34.50 32.84 2yrq s PRO 87 CO -0.22 -2.75 1.09 -1.25 0.04 0.00 0.00 177.00 173.92 2yrq s PRO 88 N -4.96 0.19 -0.51 0.56 0.04 -1.26 -4.85 135.00 124.21 2yrq s PRO 88 Ca 0.65 0.44 -0.28 0.00 0.04 0.00 0.00 61.00 61.85 2yrq s PRO 88 Cb -0.19 -1.72 -0.10 0.00 0.04 0.00 0.00 34.50 32.54 2yrq s PRO 88 CO 0.58 -2.87 2.40 1.17 0.04 0.00 0.00 177.00 178.32 2yrq n LYS 89 N -4.26 1.02 0.00 4.56 3.00 -1.26 -4.82 118.16 116.40 2yrq n LYS 89 Ca 0.05 0.11 0.00 0.00 -0.00 0.00 0.00 58.31 58.48 2yrq n LYS 89 Cb 0.58 -2.98 0.00 0.00 0.00 0.00 0.00 35.03 32.62 2yrq n LYS 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2yrq n GLY 90 N 6.13 0.97 3.70 3.14 0.00 -1.26 -5.02 105.19 112.85 2yrq n GLY 90 Ca 0.41 -0.67 -0.43 0.00 0.00 0.00 0.00 46.02 45.33 2yrq n GLY 90 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2yrq n GLU 91 N -0.13 2.15 -3.86 1.61 -0.58 -1.26 -5.01 120.64 113.56 2yrq n GLU 91 Ca 0.00 0.76 -0.10 0.00 -0.42 0.00 0.00 57.16 57.39 2yrq n GLU 91 Cb 0.00 -2.36 -0.08 0.00 -0.57 0.00 0.00 31.44 28.43 2yrq n GLU 91 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2yrq s THR 92 N -0.93 0.12 0.33 2.62 -4.23 -1.26 -5.12 115.64 107.17 2yrq s THR 92 Ca 0.57 -0.95 -0.06 0.00 -1.18 0.00 0.00 61.69 60.06 2yrq s THR 92 Cb -0.57 -0.95 -0.05 0.00 1.34 0.00 0.00 72.50 72.26 2yrq s THR 92 CO 0.60 -0.53 0.63 -0.54 -0.54 0.00 0.00 174.62 174.24 2yrq s LYS 93 N -2.71 3.67 -0.03 3.99 1.02 -1.26 -5.09 119.74 119.33 2yrq s LYS 93 Ca -0.04 0.14 -0.00 0.00 0.02 0.00 0.00 55.97 56.09 2yrq s LYS 93 Cb -0.00 -2.56 -0.04 0.00 -0.52 0.00 0.00 37.83 34.71 2yrq s LYS 93 CO -0.05 0.12 0.03 -1.59 -0.92 0.00 0.00 175.35 172.95 2yrq s LYS 94 N -3.71 2.95 0.53 1.68 0.00 -1.26 -4.67 119.74 115.26 2yrq s LYS 94 Ca 0.46 -0.50 0.05 0.00 0.00 0.00 0.00 55.97 55.98 2yrq s LYS 94 Cb -0.11 -2.78 0.03 0.00 0.00 0.00 0.00 37.83 34.97 2yrq s LYS 94 CO 0.31 0.66 0.36 0.15 0.00 0.00 0.00 175.35 176.83 2yrq s LYS 95 N -1.43 2.26 -0.28 1.78 -0.14 -1.26 -5.12 119.74 115.56 2yrq s LYS 95 Ca 0.19 -2.01 0.02 0.00 -1.36 0.00 0.00 55.97 52.81 2yrq s LYS 95 Cb -0.12 -2.06 0.06 0.00 -1.68 0.00 0.00 37.83 34.03 2yrq s LYS 95 CO 0.09 -0.54 -0.07 -0.59 -0.76 0.00 0.00 175.35 173.48 2yrq s PHE 96 N -2.75 3.31 0.11 3.18 -0.71 -1.26 -5.09 117.98 114.76 2yrq s PHE 96 Ca 0.33 -2.27 -0.05 0.00 -1.04 0.00 0.00 56.93 53.89 2yrq s PHE 96 Cb -0.02 -2.05 -0.02 0.00 -1.21 0.00 0.00 43.02 39.72 2yrq s PHE 96 CO 0.20 -0.87 0.14 0.15 -1.34 0.00 0.00 175.22 173.50 2yrq s LYS 97 N 1.12 0.89 -0.24 1.99 -0.14 -1.26 -5.10 119.74 117.00 2yrq s LYS 97 Ca -0.07 -1.17 -0.28 0.00 -1.36 0.00 0.00 55.97 53.09 2yrq s LYS 97 Cb -0.20 0.30 -0.04 0.00 -1.68 0.00 0.00 37.83 36.21 2yrq s LYS 97 CO -0.04 -0.27 2.03 0.34 -0.76 0.00 0.00 175.35 176.65 2yrq s ASP 98 N -2.94 5.70 -0.02 2.83 2.15 -1.26 -4.88 116.67 118.25 2yrq s ASP 98 Ca 0.12 1.73 -0.26 0.00 0.43 0.00 0.00 52.55 54.57 2yrq s ASP 98 Cb 0.06 -2.52 -0.20 0.00 -0.30 0.00 0.00 42.92 39.96 2yrq s ASP 98 CO -0.05 -1.79 1.26 1.55 -0.17 0.00 0.00 175.17 175.97 2yrq h PRO 99 N 13.87 -0.01 -0.91 4.34 0.13 -2.02 -3.27 132.00 144.12 2yrq h PRO 99 Ca -0.39 0.00 0.17 0.00 -0.87 0.00 0.00 66.00 64.91 2yrq h PRO 99 Cb 1.21 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.18 2yrq h PRO 99 CO 0.98 0.48 -0.27 0.09 -0.23 0.00 0.00 178.00 179.05 2yrq n ASN 100 N -4.86 -0.42 -3.09 1.44 3.02 -1.26 -4.55 115.26 105.54 2yrq n ASN 100 Ca -0.08 1.58 -0.41 0.00 -0.03 0.00 0.00 54.58 55.63 2yrq n ASN 100 Cb 0.25 -0.44 -0.06 0.00 -0.61 0.00 0.00 39.78 38.93 2yrq n ASN 100 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2yrq n ALA 101 N -3.61 -2.37 -2.18 5.41 0.00 -1.24 -4.80 120.51 111.73 2yrq n ALA 101 Ca 0.13 0.40 -0.42 0.00 0.00 0.00 0.00 53.44 53.54 2yrq n ALA 101 Cb 0.42 -1.21 -0.03 0.00 0.00 0.00 0.00 19.45 18.63 2yrq n ALA 101 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2yrq s PRO 102 N 0.33 4.34 0.60 0.00 0.04 -1.26 -5.03 135.00 134.02 2yrq s PRO 102 Ca 0.63 2.04 -0.10 0.00 0.04 0.00 0.00 61.00 63.61 2yrq s PRO 102 Cb -0.89 -3.25 0.14 0.00 0.04 0.00 0.00 34.50 30.54 2yrq s PRO 102 CO 0.42 -0.39 0.68 0.36 0.04 0.00 0.00 177.00 178.11 2yrq n LYS 103 N 3.76 -1.32 -4.15 4.56 0.00 -1.26 -4.94 118.16 114.81 2yrq n LYS 103 Ca 0.10 -1.06 -0.31 0.00 -0.00 0.00 0.00 58.31 57.04 2yrq n LYS 103 Cb 0.43 -0.81 -0.08 0.00 -0.00 0.00 0.00 35.03 34.56 2yrq n LYS 103 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 2yrq s ARG 104 N -4.51 2.64 0.96 -1.58 1.04 -1.26 -4.97 118.95 111.27 2yrq s ARG 104 Ca 0.41 -0.77 -0.12 0.00 -1.04 0.00 0.00 55.73 54.21 2yrq s ARG 104 Cb -0.02 -2.59 0.16 0.00 -2.04 0.00 0.00 34.95 30.46 2yrq s ARG 104 CO 0.29 0.56 1.09 -1.25 -0.04 0.00 0.00 175.30 175.96 2yrq s PRO 105 N -2.15 0.77 0.38 3.89 0.04 -1.26 -4.51 135.00 132.16 2yrq s PRO 105 Ca 0.25 0.65 -0.26 0.00 0.04 0.00 0.00 61.00 61.67 2yrq s PRO 105 Cb -0.12 -1.77 -0.09 0.00 0.04 0.00 0.00 34.50 32.57 2yrq s PRO 105 CO 0.17 -2.53 1.20 -1.25 0.04 0.00 0.00 177.00 174.63 2yrq s PRO 106 N -4.95 4.15 0.44 0.56 0.04 -1.26 -4.89 135.00 129.09 2yrq s PRO 106 Ca 0.65 1.93 0.02 0.00 0.04 0.00 0.00 61.00 63.63 2yrq s PRO 106 Cb -0.18 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 31.56 2yrq s PRO 106 CO 0.57 -0.26 0.65 0.45 0.04 0.00 0.00 177.00 178.45 2yrq s SER 107 N -0.97 5.75 0.31 6.66 0.15 -1.26 -4.80 113.70 119.54 2yrq s SER 107 Ca 0.54 0.11 0.03 0.00 0.70 0.00 0.00 55.95 57.34 2yrq s SER 107 Cb -0.33 -1.32 0.80 0.00 -1.71 0.00 0.00 66.02 63.46 2yrq s SER 107 CO 0.42 -0.73 1.59 0.00 1.20 0.00 0.00 173.24 175.72 2yrq h ALA 108 N 0.44 1.28 -0.76 5.45 0.00 -1.90 0.84 119.26 124.61 2yrq h ALA 108 Ca -0.45 0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.80 2yrq h ALA 108 Cb 1.26 0.51 -0.05 0.00 0.00 0.00 0.00 17.79 19.52 2yrq h ALA 108 CO 0.55 -0.59 0.48 0.35 0.00 0.00 0.00 179.25 180.04 2yrq h PHE 109 N 0.05 0.90 -0.19 0.00 3.57 -1.93 0.20 116.94 119.54 2yrq h PHE 109 Ca 0.61 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 62.07 2yrq h PHE 109 Cb 1.30 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 39.74 2yrq h PHE 109 CO -0.40 0.51 -0.12 0.35 -2.23 0.00 0.00 178.31 176.43 2yrq h PHE 110 N 0.93 0.48 -0.72 0.41 3.57 0.20 -0.25 116.94 121.57 2yrq h PHE 110 Ca 0.30 -0.13 0.01 0.00 3.53 0.00 0.00 57.97 61.68 2yrq h PHE 110 Cb 0.02 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.61 2yrq h PHE 110 CO -0.03 0.73 0.48 -0.07 -2.23 0.00 0.00 178.31 177.18 2yrq h LEU 111 N 0.09 0.82 0.20 0.59 3.38 -0.51 0.68 115.31 120.57 2yrq h LEU 111 Ca 0.04 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2yrq h LEU 111 Cb 0.62 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2yrq h LEU 111 CO 0.03 0.60 -0.10 0.15 0.09 0.00 0.00 178.44 179.21 2yrq h PHE 112 N 0.97 -0.25 -0.11 1.13 3.04 -0.88 -2.96 116.94 117.88 2yrq h PHE 112 Ca 0.26 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 62.19 2yrq h PHE 112 Cb -0.11 0.08 -0.01 0.00 2.56 0.00 0.00 35.95 38.47 2yrq h PHE 112 CO -0.00 0.07 -0.00 0.00 -2.02 0.00 0.00 178.31 176.36 2yrq h SER 114 N 0.15 0.00 0.40 0.00 4.64 0.32 0.29 113.55 119.35 2yrq h SER 114 Ca 0.04 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.29 2yrq h SER 114 Cb 0.11 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 2yrq h SER 114 CO 0.00 0.19 -1.65 1.21 -0.87 0.00 0.00 176.83 175.71 2yrq n GLU 115 N -3.47 0.64 0.01 4.77 2.13 -0.40 -4.32 120.64 120.01 2yrq n GLU 115 Ca -0.01 -0.02 -0.17 0.00 0.66 0.00 0.00 57.16 57.62 2yrq n GLU 115 Cb 0.36 -1.66 -0.14 0.00 0.27 0.00 0.00 31.44 30.27 2yrq n GLU 115 CO 0.00 0.00 0.00 1.88 -0.41 0.00 0.00 177.13 178.60 2yrq h TYR 116 N 0.00 0.36 -0.92 4.31 -1.99 -0.82 -3.35 116.97 114.56 2yrq h TYR 116 Ca -0.08 -0.26 0.16 0.00 2.00 0.00 0.00 58.73 60.55 2yrq h TYR 116 Cb 1.22 -0.01 -0.16 0.00 2.00 0.00 0.00 36.73 39.78 2yrq h TYR 116 CO 0.00 1.51 -0.31 -0.09 -0.00 0.00 0.00 178.16 179.27 2yrq h ARG 117 N 0.05 -0.02 0.00 4.88 2.43 -0.62 1.32 114.38 122.42 2yrq h ARG 117 Ca -0.36 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.81 2yrq h ARG 117 Cb 2.03 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.59 2yrq h ARG 117 CO 0.10 -0.01 0.00 -1.00 -1.51 0.00 0.00 179.97 177.55 2yrq h PRO 118 N -0.02 0.00 0.08 0.20 0.13 -1.79 0.37 132.00 130.97 2yrq h PRO 118 Ca 0.38 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.38 2yrq h PRO 118 Cb 0.63 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.77 2yrq h PRO 118 CO -0.94 0.00 -0.60 0.87 -0.23 0.00 0.00 178.00 177.11 2yrq h LYS 119 N 0.00 0.17 -0.00 0.86 1.57 0.14 -3.35 116.57 115.95 2yrq h LYS 119 Ca 0.00 -0.28 -0.16 0.00 -1.87 0.00 0.00 60.65 58.34 2yrq h LYS 119 Cb 0.49 0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.92 2yrq h LYS 119 CO 0.00 1.14 -0.61 -0.84 -0.57 0.00 0.00 179.45 178.57 2yrq h ILE 120 N -0.63 1.42 -1.28 1.86 3.07 -0.47 -3.20 117.51 118.28 2yrq h ILE 120 Ca -0.12 -2.07 0.46 0.00 1.55 0.00 0.00 64.86 64.68 2yrq h ILE 120 Cb 1.40 2.58 -0.15 0.00 -0.27 0.00 0.00 36.82 40.37 2yrq h ILE 120 CO 0.07 0.61 0.80 0.07 -1.05 0.00 0.00 178.15 178.64 2yrq h LYS 121 N -0.08 0.00 0.01 0.16 2.10 -1.09 0.30 116.57 117.97 2yrq h LYS 121 Ca -0.07 -0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.56 2yrq h LYS 121 Cb 1.32 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.65 2yrq h LYS 121 CO 0.12 0.00 -0.05 0.78 -2.00 0.00 0.00 179.45 178.31 2yrq h GLY 122 N 0.00 0.02 0.57 0.07 0.00 -1.69 -3.34 103.07 98.71 2yrq h GLY 122 Ca 0.88 -0.05 0.08 0.00 0.00 0.00 0.00 47.33 48.24 2yrq h GLY 122 CO -0.55 0.05 0.45 0.83 0.00 0.00 0.00 176.54 177.31 2yrq h GLU 123 N -0.91 0.75 -4.20 4.80 4.39 -0.57 -3.33 114.58 115.51 2yrq h GLU 123 Ca -0.01 -0.05 -0.69 0.00 0.34 0.00 0.00 59.36 58.96 2yrq h GLU 123 Cb 0.99 -0.17 -0.35 0.00 -0.10 0.00 0.00 28.75 29.12 2yrq h GLU 123 CO 0.01 0.50 -0.51 -1.01 -1.16 0.00 0.00 179.01 176.84 2yrq s HIS 124 N -6.05 3.53 -0.06 4.33 3.76 0.63 -4.93 115.29 116.50 2yrq s HIS 124 Ca -0.12 -2.55 0.31 0.00 -0.15 0.00 0.00 55.06 52.55 2yrq s HIS 124 Cb 0.18 -3.20 1.29 0.00 1.11 0.00 0.00 32.58 31.96 2yrq s HIS 124 CO 0.78 -0.93 1.91 -1.00 -0.85 0.00 0.00 174.74 174.65 2yrq h PRO 125 N 7.69 0.00 0.03 8.40 0.13 -1.69 -3.18 132.00 143.38 2yrq h PRO 125 Ca -0.09 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.97 2yrq h PRO 125 Cb 1.01 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.15 2yrq h PRO 125 CO 0.70 0.00 -0.27 0.78 -0.23 0.00 0.00 178.00 178.97 2yrq h GLY 126 N 2.03 0.15 -6.56 1.56 0.00 -1.92 -3.45 103.07 94.90 2yrq h GLY 126 Ca 0.00 -0.32 -0.71 0.00 0.00 0.00 0.00 47.33 46.29 2yrq h GLY 126 CO 0.00 0.28 1.11 1.04 0.00 0.00 0.00 176.54 178.97 2yrq n LEU 127 N -4.47 2.25 -4.94 3.11 4.77 -1.20 -4.93 117.00 111.58 2yrq n LEU 127 Ca -0.11 0.84 -0.25 0.00 -0.03 0.00 0.00 56.01 56.46 2yrq n LEU 127 Cb 0.56 -1.17 0.03 0.00 -2.33 0.00 0.00 43.42 40.51 2yrq n LEU 127 CO 0.39 -0.52 0.46 -0.55 -1.33 0.00 0.00 177.39 175.84 2yrq s SER 128 N 4.93 5.46 0.25 -1.43 0.15 -1.26 -4.58 113.70 117.22 2yrq s SER 128 Ca 1.03 0.44 -0.02 0.00 0.70 0.00 0.00 55.95 58.10 2yrq s SER 128 Cb -1.02 -1.41 0.53 0.00 -1.71 0.00 0.00 66.02 62.41 2yrq s SER 128 CO 0.60 -1.08 1.33 -0.38 1.20 0.00 0.00 173.24 174.91 2yrq n ILE 129 N -2.47 -0.36 0.17 6.45 5.41 -1.26 0.15 119.36 127.45 2yrq n ILE 129 Ca 0.05 1.90 -0.07 0.00 1.00 0.00 0.00 62.75 65.63 2yrq n ILE 129 Cb 0.58 -2.71 -0.03 0.00 -0.71 0.00 0.00 39.64 36.77 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 -0.45 -0.14 7.39 0.00 -1.95 -3.03 103.07 104.89 2yrq h GLY 130 Ca 0.47 0.17 0.04 0.00 0.00 0.00 0.00 47.33 48.00 2yrq h GLY 130 CO -0.83 -0.16 -0.52 -0.55 0.00 0.00 0.00 176.54 174.48 2yrq h ASP 131 N -0.52 -1.65 -0.75 0.19 5.19 -1.59 -2.07 116.42 115.22 2yrq h ASP 131 Ca -0.04 0.20 0.09 0.00 -0.62 0.00 0.00 57.03 56.66 2yrq h ASP 131 Cb 0.33 0.65 -0.11 0.00 0.18 0.00 0.00 39.33 40.39 2yrq h ASP 131 CO 0.07 -0.47 -0.36 0.52 -3.12 0.00 0.00 179.24 175.88 2yrq n VAL 132 N -5.43 -0.45 0.10 -1.35 0.31 0.12 0.25 118.33 111.88 2yrq n VAL 132 Ca -0.05 1.79 -0.12 0.00 -0.01 0.00 0.00 64.34 65.94 2yrq n VAL 132 Cb 0.37 -2.29 -0.05 0.00 -0.91 0.00 0.00 33.84 30.96 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 0.72 -0.36 -0.95 3.52 0.00 -1.26 -1.24 119.26 119.68 2yrq h ALA 133 Ca 0.19 -0.03 0.27 0.00 0.00 0.00 0.00 54.91 55.34 2yrq h ALA 133 Cb 0.38 0.36 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 2yrq h ALA 133 CO -0.73 -0.75 0.68 -0.22 0.00 0.00 0.00 179.25 178.23 2yrq h LYS 134 N -0.41 0.05 -0.17 0.00 3.11 0.38 0.50 116.57 120.03 2yrq h LYS 134 Ca 0.03 -0.00 -0.10 0.00 -2.81 0.00 0.00 60.65 57.77 2yrq h LYS 134 Cb 0.44 -0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 31.64 2yrq h LYS 134 CO -0.13 0.03 -0.35 -0.22 -2.81 0.00 0.00 179.45 175.97 2yrq h LYS 135 N 0.05 0.35 0.00 1.90 1.63 0.25 -2.43 116.57 118.32 2yrq h LYS 135 Ca 0.46 -0.15 0.00 0.00 -0.85 0.00 0.00 60.65 60.11 2yrq h LYS 135 Cb 1.76 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 33.37 2yrq h LYS 135 CO -0.03 0.66 0.00 -0.07 -3.45 0.00 0.00 179.45 176.55 2yrq h LEU 136 N 0.30 0.00 -0.23 5.20 3.38 0.21 -3.18 115.31 121.00 2yrq h LEU 136 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2yrq h LEU 136 Cb 0.76 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2yrq h LEU 136 CO 0.06 0.00 0.15 1.23 0.09 0.00 0.00 178.44 179.97 2yrq h GLY 137 N 3.51 0.32 1.59 0.83 0.00 -1.09 -2.93 103.07 105.31 2yrq h GLY 137 Ca 0.00 -0.12 -0.26 0.00 0.00 0.00 0.00 47.33 46.95 2yrq h GLY 137 CO 0.00 0.11 -1.18 1.05 0.00 0.00 0.00 176.54 176.53 2yrq h GLU 138 N 0.31 0.32 -0.83 4.80 9.09 -1.69 -3.27 114.58 123.30 2yrq h GLU 138 Ca 0.09 -0.48 0.21 0.00 0.05 0.00 0.00 59.36 59.22 2yrq h GLU 138 Cb -0.03 0.17 -0.13 0.00 -1.65 0.00 0.00 28.75 27.10 2yrq h GLU 138 CO -0.02 1.20 0.18 0.52 0.05 0.00 0.00 179.01 180.94 2yrq h MET 139 N 0.12 0.20 -0.22 1.06 2.86 -1.50 0.89 114.93 118.33 2yrq h MET 139 Ca -0.13 -0.01 -0.07 0.00 -2.06 0.00 0.00 59.70 57.43 2yrq h MET 139 Cb 1.88 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 33.49 2yrq h MET 139 CO 0.20 0.13 -0.15 2.35 1.06 0.00 0.00 176.91 180.50 2yrq h TRP 140 N 0.20 0.58 -0.59 -0.22 -0.00 -1.60 -1.28 115.95 113.04 2yrq h TRP 140 Ca 0.50 -0.16 0.09 0.00 -0.00 0.00 0.00 58.89 59.33 2yrq h TRP 140 Cb 0.96 -0.13 -0.07 0.00 -0.00 0.00 0.00 29.16 29.92 2yrq h TRP 140 CO -0.30 0.80 0.21 -0.91 -0.00 0.00 0.00 178.44 178.24 2yrq h ASN 141 N 0.19 0.19 -0.35 2.65 2.35 -0.97 -1.91 115.58 117.73 2yrq h ASN 141 Ca 0.04 0.08 -0.17 0.00 -0.55 0.00 0.00 56.30 55.70 2yrq h ASN 141 Cb 0.67 0.07 -0.00 0.00 0.05 0.00 0.00 38.32 39.10 2yrq h ASN 141 CO 0.04 0.12 -0.44 0.78 -1.65 0.00 0.00 177.43 176.28 2yrq h ASN 142 N 0.38 1.00 -2.56 5.81 2.35 -0.96 -3.45 115.58 118.16 2yrq h ASN 142 Ca 0.30 -0.49 -0.60 0.00 -0.55 0.00 0.00 56.30 54.96 2yrq h ASN 142 Cb 0.37 -0.28 0.11 0.00 0.05 0.00 0.00 38.32 38.56 2yrq h ASN 142 CO -0.31 1.29 0.17 0.41 -1.65 0.00 0.00 177.43 177.34 2yrq n THR 143 N -4.04 2.00 -3.09 2.81 -1.04 -0.49 -4.95 114.28 105.48 2yrq n THR 143 Ca -0.03 -0.50 -0.32 0.00 -2.04 0.00 0.00 64.05 61.16 2yrq n THR 143 Cb 0.58 -1.05 -0.06 0.00 -1.82 0.00 0.00 70.33 67.97 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 -1.06 3.28 0.24 2.41 0.00 -1.26 -4.96 121.76 120.41 2yrq s ALA 144 Ca 0.58 0.09 -0.06 0.00 0.00 0.00 0.00 51.96 52.57 2yrq s ALA 144 Cb -0.69 -2.82 0.44 0.00 0.00 0.00 0.00 23.12 20.05 2yrq s ALA 144 CO 0.60 0.30 1.68 0.00 0.00 0.00 0.00 175.76 178.34 2yrq h ALA 145 N 2.18 0.90 -0.56 0.00 0.00 -1.95 -1.17 119.26 118.68 2yrq h ALA 145 Ca -0.48 0.17 0.11 0.00 0.00 0.00 0.00 54.91 54.71 2yrq h ALA 145 Cb 1.18 0.25 -0.11 0.00 0.00 0.00 0.00 17.79 19.10 2yrq h ALA 145 CO 0.65 -0.35 -0.26 0.22 0.00 0.00 0.00 179.25 179.51 2yrq h ASP 146 N 0.24 -0.89 -0.14 0.00 1.82 -2.01 0.73 116.42 116.17 2yrq h ASP 146 Ca 0.40 0.20 0.04 0.00 -0.39 0.00 0.00 57.03 57.29 2yrq h ASP 146 Cb 0.69 0.48 -0.01 0.00 0.68 0.00 0.00 39.33 41.17 2yrq h ASP 146 CO -0.52 -0.27 0.20 -0.78 -1.61 0.00 0.00 179.24 176.27 2yrq h ASP 147 N -0.12 0.00 -0.34 2.28 1.82 -1.60 0.32 116.42 118.78 2yrq h ASP 147 Ca 0.25 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.89 2yrq h ASP 147 Cb 0.51 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.52 2yrq h ASP 147 CO -0.63 0.00 0.00 0.29 -1.61 0.00 0.00 179.24 177.29 2yrq n LYS 148 N -3.58 2.99 0.24 0.28 5.02 0.25 -4.35 118.16 119.02 2yrq n LYS 148 Ca 0.01 -1.72 -0.13 0.00 -2.02 0.00 0.00 58.31 54.44 2yrq n LYS 148 Cb 0.31 -1.83 -0.07 0.00 -0.02 0.00 0.00 35.03 33.42 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 2.27 -0.63 -0.13 1.97 4.15 -0.16 -1.56 115.11 121.02 2yrq h GLN 149 Ca 0.00 0.04 -0.12 0.00 0.77 0.00 0.00 58.65 59.34 2yrq h GLN 149 Cb 1.20 0.14 -0.01 0.00 0.21 0.00 0.00 27.48 29.03 2yrq h GLN 149 CO 0.23 -0.33 -0.45 -1.00 -1.93 0.00 0.00 178.83 175.35 2yrq h PRO 150 N -1.02 0.32 -0.41 -2.39 0.13 -1.80 -1.02 132.00 125.80 2yrq h PRO 150 Ca -0.07 -0.17 -0.13 0.00 -0.87 0.00 0.00 66.00 64.77 2yrq h PRO 150 Cb 0.59 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.71 2yrq h PRO 150 CO 0.11 0.71 -0.24 1.88 -0.23 0.00 0.00 178.00 180.23 2yrq h TYR 151 N 0.26 0.98 0.05 1.56 0.05 -1.79 -2.80 116.97 115.27 2yrq h TYR 151 Ca 0.02 -0.24 -0.00 0.00 0.05 0.00 0.00 58.73 58.56 2yrq h TYR 151 Cb 0.90 -0.23 0.00 0.00 1.01 0.00 0.00 36.73 38.42 2yrq h TYR 151 CO 0.02 1.00 -0.02 0.93 -1.05 0.00 0.00 178.16 179.04 2yrq h GLU 152 N 0.73 -0.06 -0.89 4.88 5.08 -1.20 -3.12 114.58 120.00 2yrq h GLU 152 Ca 0.09 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.56 2yrq h GLU 152 Cb 0.78 0.01 -0.12 0.00 0.50 0.00 0.00 28.75 29.93 2yrq h GLU 152 CO 0.06 -0.04 -0.47 1.63 -1.00 0.00 0.00 179.01 179.19 2yrq n LYS 153 N -3.82 -0.34 0.00 2.33 4.76 -0.39 -0.35 118.16 120.35 2yrq n LYS 153 Ca -0.01 1.35 -0.11 0.00 -2.87 0.00 0.00 58.31 56.67 2yrq n LYS 153 Cb 0.03 -1.99 -0.05 0.00 -1.84 0.00 0.00 35.03 31.17 2yrq n LYS 153 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 2yrq h LYS 154 N 0.00 -0.43 -0.71 1.97 3.11 -1.66 -1.55 116.57 117.30 2yrq h LYS 154 Ca 0.19 0.03 0.14 0.00 -2.81 0.00 0.00 60.65 58.20 2yrq h LYS 154 Cb 0.41 0.10 -0.10 0.00 -1.00 0.00 0.00 32.23 31.64 2yrq h LYS 154 CO -0.85 -0.29 0.22 0.00 -2.81 0.00 0.00 179.45 175.72 2yrq h ALA 155 N 0.28 0.94 -0.63 5.00 0.00 -0.62 -1.68 119.26 122.54 2yrq h ALA 155 Ca 0.09 0.14 0.12 0.00 0.00 0.00 0.00 54.91 55.25 2yrq h ALA 155 Cb 0.59 0.16 -0.12 0.00 0.00 0.00 0.00 17.79 18.42 2yrq h ALA 155 CO -0.37 -0.28 -0.29 0.00 0.00 0.00 0.00 179.25 178.31 2yrq h ALA 156 N 1.56 0.10 -0.23 0.00 0.00 0.23 -1.34 119.26 119.59 2yrq h ALA 156 Ca 0.39 0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.55 2yrq h ALA 156 Cb 0.63 0.72 -0.07 0.00 0.00 0.00 0.00 17.79 19.06 2yrq h ALA 156 CO -0.44 -0.60 -0.46 0.87 0.00 0.00 0.00 179.25 178.62 2yrq h LYS 157 N -0.11 -0.44 -0.56 0.00 1.79 -1.12 -1.81 116.57 114.31 2yrq h LYS 157 Ca 0.26 0.03 0.11 0.00 -2.18 0.00 0.00 60.65 58.87 2yrq h LYS 157 Cb 0.54 0.10 -0.11 0.00 -1.58 0.00 0.00 32.23 31.18 2yrq h LYS 157 CO -0.70 -0.30 -0.25 -0.07 -1.08 0.00 0.00 179.45 177.05 2yrq h LEU 158 N -0.46 -0.88 -0.89 2.94 3.38 -1.24 -1.29 115.31 116.88 2yrq h LEU 158 Ca 0.08 0.20 0.14 0.00 0.09 0.00 0.00 57.88 58.39 2yrq h LEU 158 Cb 0.63 0.47 -0.14 0.00 0.09 0.00 0.00 40.66 41.71 2yrq h LEU 158 CO -0.47 -0.27 -0.35 1.17 0.09 0.00 0.00 178.44 178.62 2yrq n LYS 159 N -5.43 -0.21 -0.38 1.13 4.81 -0.69 -0.32 118.16 117.07 2yrq n LYS 159 Ca 0.05 1.36 -0.07 0.00 -0.87 0.00 0.00 58.31 58.78 2yrq n LYS 159 Cb 0.34 -2.02 -0.05 0.00 0.02 0.00 0.00 35.03 33.31 2yrq n LYS 159 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2yrq n GLU 160 N -5.30 -0.35 -0.24 1.64 -0.58 -0.49 0.66 120.64 115.98 2yrq n GLU 160 Ca 0.09 1.40 0.05 0.00 -0.42 0.00 0.00 57.16 58.28 2yrq n GLU 160 Cb 0.35 -2.07 0.17 0.00 -0.57 0.00 0.00 31.44 29.32 2yrq n GLU 160 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2yrq h LYS 161 N 0.00 0.22 0.46 3.49 6.56 -0.76 -0.86 116.57 125.68 2yrq h LYS 161 Ca 0.20 -0.01 -0.02 0.00 -1.06 0.00 0.00 60.65 59.75 2yrq h LYS 161 Cb 0.43 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 32.04 2yrq h LYS 161 CO -0.88 0.15 -0.22 -0.92 -2.06 0.00 0.00 179.45 175.52 2yrq h TYR 162 N 0.23 -0.57 -0.95 -1.35 3.20 0.39 -1.79 116.97 116.12 2yrq h TYR 162 Ca 0.40 -0.01 0.28 0.00 3.14 0.00 0.00 58.73 62.54 2yrq h TYR 162 Cb 0.68 0.19 -0.14 0.00 1.54 0.00 0.00 36.73 39.00 2yrq h TYR 162 CO -0.29 -0.26 0.44 0.93 -1.64 0.00 0.00 178.16 177.34 2yrq h GLU 163 N -0.85 0.30 0.42 1.82 5.08 0.17 0.43 114.58 121.95 2yrq h GLU 163 Ca -0.06 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 2yrq h GLU 163 Cb 0.57 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2yrq h GLU 163 CO 0.10 0.20 -0.20 0.87 -1.00 0.00 0.00 179.01 178.98 2yrq h LYS 164 N 0.31 -0.55 -0.32 2.33 1.79 -1.06 -0.11 116.57 118.96 2yrq h LYS 164 Ca 0.65 0.04 0.07 0.00 -2.18 0.00 0.00 60.65 59.23 2yrq h LYS 164 Cb 1.40 0.12 -0.08 0.00 -1.58 0.00 0.00 32.23 32.09 2yrq h LYS 164 CO -0.61 -0.24 -0.36 -0.44 -1.08 0.00 0.00 179.45 176.73 2yrq h ASP 165 N -0.92 -1.17 -0.95 0.86 3.32 -0.27 -0.88 116.42 116.42 2yrq h ASP 165 Ca -0.06 0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 2yrq h ASP 165 Cb 0.56 0.52 -0.05 0.00 0.22 0.00 0.00 39.33 40.59 2yrq h ASP 165 CO 0.10 -0.35 0.57 -0.29 -1.72 0.00 0.00 179.24 177.54 2yrq h ILE 166 N -0.32 1.26 -0.97 0.35 2.10 -1.04 -2.64 117.51 116.25 2yrq h ILE 166 Ca 0.14 -0.58 0.31 0.00 1.08 0.00 0.00 64.86 65.82 2yrq h ILE 166 Cb 0.56 -0.07 -0.17 0.00 -1.09 0.00 0.00 36.82 36.05 2yrq h ILE 166 CO -0.49 0.28 0.25 0.00 -1.08 0.00 0.00 178.15 177.10 2yrq h ALA 167 N 1.31 1.54 0.15 0.18 0.00 0.47 0.20 119.26 123.10 2yrq h ALA 167 Ca 0.34 0.29 -0.22 0.00 0.00 0.00 0.00 54.91 55.32 2yrq h ALA 167 Cb -0.05 0.44 0.03 0.00 0.00 0.00 0.00 17.79 18.21 2yrq h ALA 167 CO -0.06 -0.67 -0.96 0.00 0.00 0.00 0.00 179.25 177.56 2yrq h ALA 168 N 1.95 -0.09 -0.97 0.00 0.00 -1.35 -2.63 119.26 116.17 2yrq h ALA 168 Ca 0.67 -0.72 0.10 0.00 0.00 0.00 0.00 54.91 54.96 2yrq h ALA 168 Cb 1.54 0.11 -0.13 0.00 0.00 0.00 0.00 17.79 19.32 2yrq h ALA 168 CO -0.81 0.46 -0.53 0.98 0.00 0.00 0.00 179.25 179.35 2yrq n TYR 169 N -4.03 -0.32 -0.03 0.00 9.36 0.64 -1.36 117.16 121.43 2yrq n TYR 169 Ca -0.14 1.21 -0.15 0.00 3.32 0.00 0.00 57.90 62.13 2yrq n TYR 169 Cb 0.88 -0.65 -0.10 0.00 -0.63 0.00 0.00 39.34 38.84 2yrq n TYR 169 CO 0.00 0.00 0.00 0.07 0.22 0.00 0.00 176.86 177.15 2yrq h ARG 170 N 0.00 0.32 -3.54 2.98 0.11 -1.58 -3.37 114.38 109.29 2yrq h ARG 170 Ca 0.20 -0.28 -0.79 0.00 0.10 0.00 0.00 59.98 59.22 2yrq h ARG 170 Cb 0.44 0.06 -0.29 0.00 1.11 0.00 0.00 29.97 31.30 2yrq h ARG 170 CO -0.93 0.94 0.37 0.00 0.10 0.00 0.00 179.97 180.45 2yrq s ALA 171 N -3.50 4.66 -0.59 0.08 0.00 -0.46 -5.01 121.76 116.94 2yrq s ALA 171 Ca -0.14 -3.83 -0.27 0.00 0.00 0.00 0.00 51.96 47.71 2yrq s ALA 171 Cb 0.03 -3.46 -0.00 0.00 0.00 0.00 0.00 23.12 19.69 2yrq s ALA 171 CO 0.77 -2.20 1.61 0.15 0.00 0.00 0.00 175.76 176.10 2yrq s LYS 172 N -1.24 3.01 0.00 0.00 1.02 -0.50 -4.31 119.74 117.72 2yrq s LYS 172 Ca 0.30 0.50 0.15 0.00 0.02 0.00 0.00 55.97 56.94 2yrq s LYS 172 Cb -0.10 -4.25 0.88 0.00 -0.52 0.00 0.00 37.83 33.85 2yrq s LYS 172 CO -0.09 -2.29 1.30 0.41 -0.92 0.00 0.00 175.35 173.76