#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 6.68 0.11 1.61 0.15 -1.26 -5.01 113.70 115.99 2yrq s SER 2 Ca 0.00 0.95 -0.29 0.00 0.70 0.00 0.00 55.95 57.31 2yrq s SER 2 Cb 0.00 -2.24 -0.09 0.00 -1.71 0.00 0.00 66.02 61.98 2yrq s SER 2 CO 0.00 -0.00 1.61 0.77 1.20 0.00 0.00 173.24 176.81 2yrq h SER 3 N 2.91 -1.05 0.00 5.45 4.64 -2.10 -3.48 113.55 119.91 2yrq h SER 3 Ca -0.47 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2yrq h SER 3 Cb 1.18 0.40 0.00 0.00 -0.31 0.00 0.00 62.40 63.66 2yrq h SER 3 CO 0.68 -0.44 0.00 0.61 -0.87 0.00 0.00 176.83 176.81 2yrq n GLY 4 N -1.44 0.45 3.60 -0.77 0.00 -1.26 -5.12 105.19 100.65 2yrq n GLY 4 Ca -0.07 -0.41 -0.04 0.00 0.00 0.00 0.00 46.02 45.51 2yrq n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yrq s SER 5 N -4.00 -0.14 -0.11 1.61 0.15 -1.26 -5.07 113.70 104.88 2yrq s SER 5 Ca 0.00 -0.03 -0.13 0.00 0.70 0.00 0.00 55.95 56.49 2yrq s SER 5 Cb 0.00 0.16 0.03 0.00 -1.71 0.00 0.00 66.02 64.51 2yrq s SER 5 CO 0.00 -0.27 0.36 -0.55 1.20 0.00 0.00 173.24 173.97 2yrq s SER 6 N -2.33 -0.34 0.14 5.45 0.15 -1.26 -5.05 113.70 110.45 2yrq s SER 6 Ca 0.10 0.59 -0.24 0.00 0.70 0.00 0.00 55.95 57.10 2yrq s SER 6 Cb -0.00 0.65 0.07 0.00 -1.71 0.00 0.00 66.02 65.03 2yrq s SER 6 CO -0.05 -0.20 0.61 -0.83 1.20 0.00 0.00 173.24 173.97 2yrq s GLY 7 N -0.16 -0.61 0.00 9.45 0.00 -1.26 -4.99 107.32 109.75 2yrq s GLY 7 Ca -0.03 0.59 -0.04 0.00 0.00 0.00 0.00 44.72 45.24 2yrq s GLY 7 CO 0.01 0.25 -0.07 -0.13 0.00 0.00 0.00 173.10 173.16 2yrq n MET 8 N -0.25 0.11 0.00 2.90 0.00 -1.26 -4.94 117.12 113.68 2yrq n MET 8 Ca -0.17 0.04 0.00 0.00 -0.00 0.00 0.00 57.70 57.57 2yrq n MET 8 Cb 0.64 -0.55 0.00 0.00 0.00 0.00 0.00 33.22 33.31 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 2.81 3.95 3.66 -5.12 0.00 -1.26 -4.76 105.19 104.47 2yrq n GLY 9 Ca -0.03 -1.24 -0.11 0.00 0.00 0.00 0.00 46.02 44.64 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 -2.65 1.94 -0.83 1.61 1.02 -1.26 -5.01 119.74 114.57 2yrq s LYS 10 Ca 0.00 -1.46 -0.19 0.00 0.02 0.00 0.00 55.97 54.34 2yrq s LYS 10 Cb 0.00 0.53 -0.22 0.00 -0.52 0.00 0.00 37.83 37.62 2yrq s LYS 10 CO 0.00 -0.86 2.06 0.41 -0.92 0.00 0.00 175.35 176.05 2yrq n GLY 11 N -0.50 -0.41 3.49 -3.33 0.00 -1.23 -4.80 105.19 98.40 2yrq n GLY 11 Ca -0.03 0.60 -0.15 0.00 0.00 0.00 0.00 46.02 46.44 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 4.70 -0.59 0.05 1.61 1.01 -1.26 -4.67 116.67 117.52 2yrq s ASP 12 Ca 1.11 0.39 0.16 0.00 0.71 0.00 0.00 52.55 54.92 2yrq s ASP 12 Cb -0.92 0.53 0.67 0.00 1.01 0.00 0.00 42.92 44.22 2yrq s ASP 12 CO 0.43 -0.72 1.50 -0.81 0.21 0.00 0.00 175.17 175.78 2yrq n PRO 13 N 0.35 0.04 0.04 8.23 -0.04 -1.26 -2.78 135.00 139.58 2yrq n PRO 13 Ca -0.17 0.29 -0.01 0.00 -0.04 0.00 0.00 63.50 63.57 2yrq n PRO 13 Cb 0.60 -1.57 0.28 0.00 -0.04 0.00 0.00 33.50 32.77 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 0.41 -5.85 0.54 1.79 -1.92 -3.40 116.57 108.15 2yrq h LYS 14 Ca 0.00 -0.12 -0.62 0.00 -2.18 0.00 0.00 60.65 57.73 2yrq h LYS 14 Cb 0.26 -0.04 -0.12 0.00 -1.58 0.00 0.00 32.23 30.75 2yrq h LYS 14 CO 0.00 0.57 0.44 0.15 -1.08 0.00 0.00 179.45 179.53 2yrq s LYS 15 N -4.66 3.40 0.00 3.15 1.02 -1.12 -4.05 119.74 117.49 2yrq s LYS 15 Ca -0.06 -0.11 0.00 0.00 0.02 0.00 0.00 55.97 55.81 2yrq s LYS 15 Cb 0.15 -3.97 0.00 0.00 -0.52 0.00 0.00 37.83 33.49 2yrq s LYS 15 CO 0.77 -1.22 0.33 -0.35 -0.92 0.00 0.00 175.35 173.96 2yrq n PRO 16 N 6.96 0.49 -0.48 -1.68 -0.04 -1.26 -4.02 135.00 134.97 2yrq n PRO 16 Ca 0.03 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.45 2yrq n PRO 16 Cb 0.48 -1.16 0.01 0.00 -0.04 0.00 0.00 33.50 32.80 2yrq n PRO 16 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2yrq n ARG 17 N -0.02 1.18 -3.27 0.54 1.85 -1.26 -4.60 116.66 111.08 2yrq n ARG 17 Ca 0.00 -0.37 -0.06 0.00 -1.00 0.00 0.00 57.85 56.42 2yrq n ARG 17 Cb 0.08 -1.14 -0.05 0.00 -1.05 0.00 0.00 32.46 30.30 2yrq n ARG 17 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2yrq s GLY 18 N 1.35 -0.71 0.48 2.89 0.00 -1.26 -5.16 107.32 104.92 2yrq s GLY 18 Ca 0.07 0.57 -0.06 0.00 0.00 0.00 0.00 44.72 45.30 2yrq s GLY 18 CO 0.00 3.13 0.23 0.28 0.00 0.00 0.00 173.10 176.74 2yrq n LYS 19 N 5.37 -1.14 -4.27 2.90 4.01 -1.26 -5.03 118.16 118.73 2yrq n LYS 19 Ca 0.01 -0.38 -0.18 0.00 -0.51 0.00 0.00 58.31 57.25 2yrq n LYS 19 Cb 0.50 -0.68 -0.14 0.00 -0.51 0.00 0.00 35.03 34.21 2yrq n LYS 19 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 2yrq s MET 20 N -2.68 0.71 0.25 1.97 -1.94 -1.26 -5.10 119.30 111.24 2yrq s MET 20 Ca 0.18 -0.52 0.01 0.00 -1.71 0.00 0.00 55.69 53.64 2yrq s MET 20 Cb -0.03 -0.66 -0.04 0.00 2.01 0.00 0.00 34.83 36.12 2yrq s MET 20 CO 0.15 0.17 0.42 -1.12 -0.01 0.00 0.00 175.02 174.63 2yrq s SER 21 N -0.75 6.35 0.30 3.03 0.01 -1.26 -4.65 113.70 116.73 2yrq s SER 21 Ca 0.00 0.34 0.05 0.00 1.31 0.00 0.00 55.95 57.66 2yrq s SER 21 Cb -0.06 -1.98 0.82 0.00 0.21 0.00 0.00 66.02 65.00 2yrq s SER 21 CO 0.00 -0.11 1.45 -1.54 0.41 0.00 0.00 173.24 173.45 2yrq n SER 22 N -1.10 -0.02 0.38 2.44 3.41 -1.25 -0.12 113.62 117.36 2yrq n SER 22 Ca -0.06 1.56 -0.18 0.00 -0.26 0.00 0.00 58.87 59.94 2yrq n SER 22 Cb 0.55 -0.61 -0.09 0.00 -0.26 0.00 0.00 64.21 63.80 2yrq n SER 22 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2yrq h TYR 23 N 0.00 -0.89 -1.01 7.33 3.20 -1.94 0.22 116.97 123.89 2yrq h TYR 23 Ca 0.61 -0.02 0.35 0.00 3.14 0.00 0.00 58.73 62.80 2yrq h TYR 23 Cb 1.34 0.29 -0.16 0.00 1.54 0.00 0.00 36.73 39.75 2yrq h TYR 23 CO -0.38 -0.54 0.57 0.00 -1.64 0.00 0.00 178.16 176.17 2yrq h ALA 24 N -0.75 2.03 0.09 1.82 0.00 -0.89 0.22 119.26 121.77 2yrq h ALA 24 Ca -0.10 0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2yrq h ALA 24 Cb 0.75 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2yrq h ALA 24 CO 0.16 -0.69 -0.04 0.74 0.00 0.00 0.00 179.25 179.42 2yrq h PHE 25 N 0.24 -0.11 -0.94 0.00 0.04 -1.10 -3.14 116.94 111.93 2yrq h PHE 25 Ca 0.77 -0.00 0.27 0.00 2.80 0.00 0.00 57.97 61.81 2yrq h PHE 25 Cb 1.84 0.04 -0.15 0.00 2.20 0.00 0.00 35.95 39.88 2yrq h PHE 25 CO -0.01 0.11 0.38 0.35 -0.60 0.00 0.00 178.31 178.54 2yrq h PHE 26 N -1.01 0.61 -0.00 -0.55 3.57 0.46 1.32 116.94 121.34 2yrq h PHE 26 Ca -0.01 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.48 2yrq h PHE 26 Cb 0.27 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 2yrq h PHE 26 CO 0.05 -0.19 -0.26 0.28 -2.23 0.00 0.00 178.31 175.95 2yrq h VAL 27 N 0.26 1.19 0.00 1.41 2.07 -0.73 -1.69 116.25 118.76 2yrq h VAL 27 Ca 0.63 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 67.26 2yrq h VAL 27 Cb 1.36 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.61 2yrq h VAL 27 CO -0.64 0.25 -0.89 1.67 0.02 0.00 0.00 177.57 177.99 2yrq n GLN 28 N -4.23 0.27 0.08 1.57 7.27 0.38 -3.46 117.38 119.26 2yrq n GLN 28 Ca -0.02 0.02 -0.17 0.00 0.07 0.00 0.00 57.00 56.90 2yrq n GLN 28 Cb 0.31 -1.61 -0.14 0.00 2.41 0.00 0.00 30.24 31.21 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 1.23 0.05 1.69 2.02 0.12 -3.05 112.91 114.98 2yrq h THR 29 Ca 0.00 -2.84 -0.24 0.00 0.77 0.00 0.00 66.41 64.10 2yrq h THR 29 Cb 0.72 2.82 -0.00 0.00 -1.74 0.00 0.00 68.15 69.95 2yrq h THR 29 CO 0.00 0.84 -1.05 0.00 0.37 0.00 0.00 175.52 175.68 2yrq h ARG 31 N 0.12 0.73 0.01 0.00 0.11 -1.68 -2.43 114.38 111.24 2yrq h ARG 31 Ca -0.09 -0.34 -0.00 0.00 0.10 0.00 0.00 59.98 59.65 2yrq h ARG 31 Cb 1.73 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.80 2yrq h ARG 31 CO 0.17 0.95 -0.01 1.05 0.10 0.00 0.00 179.97 182.24 2yrq h GLU 32 N 0.62 -0.02 -1.00 0.08 4.11 -1.58 -2.70 114.58 114.09 2yrq h GLU 32 Ca 0.07 0.00 0.13 0.00 0.07 0.00 0.00 59.36 59.63 2yrq h GLU 32 Cb 0.85 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.01 2yrq h GLU 32 CO 0.07 0.56 0.63 0.93 0.07 0.00 0.00 179.01 181.27 2yrq h GLU 33 N -0.60 0.92 0.18 1.06 5.08 -1.49 -2.35 114.58 117.38 2yrq h GLU 33 Ca -0.00 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2yrq h GLU 33 Cb 0.58 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2yrq h GLU 33 CO 0.00 0.61 -0.09 1.25 -1.00 0.00 0.00 179.01 179.78 2yrq h HIS 34 N 0.95 -0.23 -0.78 4.33 2.76 -1.45 -1.66 115.15 119.07 2yrq h HIS 34 Ca 0.51 -0.01 0.23 0.00 -2.20 0.00 0.00 60.37 58.90 2yrq h HIS 34 Cb 0.57 0.08 -0.03 0.00 1.55 0.00 0.00 27.41 29.57 2yrq h HIS 34 CO -0.00 -0.14 1.10 0.87 -1.30 0.00 0.00 177.93 178.45 2yrq h LYS 35 N -0.29 0.00 0.10 5.26 6.56 -1.35 1.08 116.57 127.93 2yrq h LYS 35 Ca -0.03 0.00 -0.16 0.00 -1.06 0.00 0.00 60.65 59.41 2yrq h LYS 35 Cb 0.19 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 31.86 2yrq h LYS 35 CO 0.04 0.00 -0.72 0.87 -2.06 0.00 0.00 179.45 177.58 2yrq h LYS 36 N 0.00 0.21 -0.40 3.15 1.79 -1.19 -3.12 116.57 117.00 2yrq h LYS 36 Ca 0.37 -0.35 -0.09 0.00 -2.18 0.00 0.00 60.65 58.40 2yrq h LYS 36 Cb 2.56 0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 33.33 2yrq h LYS 36 CO -0.00 1.17 -0.10 0.87 -1.08 0.00 0.00 179.45 180.30 2yrq h LYS 37 N -0.54 0.78 -3.13 3.15 1.57 0.21 -3.39 116.57 115.20 2yrq h LYS 37 Ca -0.14 -0.30 -0.59 0.00 -1.87 0.00 0.00 60.65 57.75 2yrq h LYS 37 Cb 1.49 -0.04 -0.40 0.00 0.08 0.00 0.00 32.23 33.36 2yrq h LYS 37 CO 0.09 0.91 -0.77 -1.01 -0.57 0.00 0.00 179.45 178.10 2yrq s HIS 38 N -4.78 1.56 0.06 -1.35 3.76 0.20 -4.99 115.29 109.74 2yrq s HIS 38 Ca -0.12 -1.92 -0.19 0.00 -0.15 0.00 0.00 55.06 52.67 2yrq s HIS 38 Cb 0.10 -1.60 -0.13 0.00 1.11 0.00 0.00 32.58 32.07 2yrq s HIS 38 CO 0.82 -0.83 1.37 -1.00 -0.85 0.00 0.00 174.74 174.24 2yrq h PRO 39 N 7.42 0.44 -1.00 8.40 0.13 -1.75 -3.20 132.00 142.43 2yrq h PRO 39 Ca -0.06 -0.23 0.02 0.00 -0.87 0.00 0.00 66.00 64.86 2yrq h PRO 39 Cb 0.97 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.06 2yrq h PRO 39 CO 0.44 0.80 0.66 0.38 -0.23 0.00 0.00 178.00 180.04 2yrq h ASP 40 N 0.10 1.12 -1.16 1.44 2.03 -1.94 -3.41 116.42 114.61 2yrq h ASP 40 Ca 0.03 -0.02 -0.60 0.00 -0.73 0.00 0.00 57.03 55.71 2yrq h ASP 40 Cb 0.71 -0.27 -0.02 0.00 -0.83 0.00 0.00 39.33 38.92 2yrq h ASP 40 CO 0.04 0.79 1.51 0.00 -1.03 0.00 0.00 179.24 180.56 2yrq n ALA 41 N -2.37 1.01 -3.04 4.15 0.00 -1.21 -4.87 120.51 114.17 2yrq n ALA 41 Ca 0.13 -0.28 -0.45 0.00 0.00 0.00 0.00 53.44 52.84 2yrq n ALA 41 Cb 0.05 -2.69 -0.02 0.00 0.00 0.00 0.00 19.45 16.79 2yrq n ALA 41 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2yrq s SER 42 N 8.63 6.69 0.09 0.00 0.01 -1.26 -4.96 113.70 122.89 2yrq s SER 42 Ca 1.10 -2.28 -0.17 0.00 1.31 0.00 0.00 55.95 55.91 2yrq s SER 42 Cb -0.71 -2.34 -0.07 0.00 0.21 0.00 0.00 66.02 63.11 2yrq s SER 42 CO 0.43 -0.91 0.54 0.54 0.41 0.00 0.00 173.24 174.25 2yrq s VAL 43 N 1.89 4.82 1.00 3.43 0.11 -1.26 -5.08 120.40 125.31 2yrq s VAL 43 Ca 0.29 1.04 -0.16 0.00 -2.93 0.00 0.00 61.98 60.21 2yrq s VAL 43 Cb -0.06 -3.82 0.20 0.00 -1.53 0.00 0.00 36.38 31.17 2yrq s VAL 43 CO -0.09 0.45 1.23 0.20 -3.33 0.00 0.00 175.10 173.56 2yrq s ASN 44 N -1.32 2.71 -0.18 3.54 0.01 -1.26 -5.01 114.94 113.44 2yrq s ASN 44 Ca 0.31 0.50 -0.19 0.00 -0.71 0.00 0.00 52.86 52.77 2yrq s ASN 44 Cb -0.18 -0.70 -0.22 0.00 0.41 0.00 0.00 41.25 40.57 2yrq s ASN 44 CO 0.18 -3.00 0.31 2.19 -1.51 0.00 0.00 177.10 175.27 2yrq h PHE 45 N -1.82 0.13 -0.82 2.20 -5.15 -1.99 -3.27 116.94 106.23 2yrq h PHE 45 Ca -0.45 -0.09 -0.02 0.00 -0.20 0.00 0.00 57.97 57.20 2yrq h PHE 45 Cb 1.27 -0.01 -0.04 0.00 0.22 0.00 0.00 35.95 37.40 2yrq h PHE 45 CO -1.09 1.52 0.42 1.03 -2.00 0.00 0.00 178.31 178.19 2yrq h SER 46 N -0.75 1.04 -0.71 -0.68 0.87 -1.98 0.18 113.55 111.51 2yrq h SER 46 Ca -0.34 -0.10 -0.04 0.00 -1.23 0.00 0.00 61.79 60.08 2yrq h SER 46 Cb 1.46 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 63.12 2yrq h SER 46 CO -0.12 0.85 0.30 -0.33 -0.53 0.00 0.00 176.83 177.00 2yrq h GLU 47 N 1.15 1.05 -0.02 2.24 4.39 -1.98 -1.92 114.58 119.50 2yrq h GLU 47 Ca 0.29 -0.18 -0.21 0.00 0.34 0.00 0.00 59.36 59.59 2yrq h GLU 47 Cb 0.06 -0.17 -0.00 0.00 -0.10 0.00 0.00 28.75 28.54 2yrq h GLU 47 CO -0.04 0.86 -0.88 0.35 -1.16 0.00 0.00 179.01 178.14 2yrq h PHE 48 N 1.01 0.50 0.82 4.33 3.57 -1.50 -3.04 116.94 122.64 2yrq h PHE 48 Ca 0.24 -0.26 -0.04 0.00 3.53 0.00 0.00 57.97 61.43 2yrq h PHE 48 Cb 0.19 -0.06 0.01 0.00 2.79 0.00 0.00 35.95 38.88 2yrq h PHE 48 CO 0.01 1.07 -0.40 0.77 -2.23 0.00 0.00 178.31 177.54 2yrq h SER 49 N 0.20 -0.94 -0.12 0.41 0.02 -0.39 0.19 113.55 112.93 2yrq h SER 49 Ca -0.06 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 60.95 2yrq h SER 49 Cb 1.50 0.24 -0.00 0.00 0.14 0.00 0.00 62.40 64.27 2yrq h SER 49 CO 0.15 -0.65 0.14 0.07 -1.14 0.00 0.00 176.83 175.39 2yrq h LYS 50 N -1.13 0.00 0.12 3.45 2.10 -1.46 -0.61 116.57 119.04 2yrq h LYS 50 Ca -0.11 0.00 -0.22 0.00 -2.00 0.00 0.00 60.65 58.32 2yrq h LYS 50 Cb 0.85 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.20 2yrq h LYS 50 CO 0.19 0.00 -0.93 -0.22 -2.00 0.00 0.00 179.45 176.48 2yrq h LYS 51 N 0.00 0.41 0.00 0.07 1.63 -1.31 -3.13 116.57 114.25 2yrq h LYS 51 Ca 0.06 -0.61 -0.08 0.00 -0.85 0.00 0.00 60.65 59.17 2yrq h LYS 51 Cb 0.34 0.21 -0.01 0.00 -0.60 0.00 0.00 32.23 32.17 2yrq h LYS 51 CO -0.00 1.27 -0.38 0.00 -3.45 0.00 0.00 179.45 176.89 2yrq h SER 53 N 0.00 0.05 1.65 0.00 0.87 -1.22 0.78 113.55 115.68 2yrq h SER 53 Ca -0.00 -0.32 -0.02 0.00 -1.23 0.00 0.00 61.79 60.22 2yrq h SER 53 Cb 0.68 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.62 2yrq h SER 53 CO 0.05 0.36 -0.11 -0.33 -0.53 0.00 0.00 176.83 176.27 2yrq h GLU 54 N -0.26 0.00 0.00 2.24 4.39 -1.48 -3.02 114.58 116.46 2yrq h GLU 54 Ca 0.01 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.61 2yrq h GLU 54 Cb 0.33 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 2yrq h GLU 54 CO 0.00 0.11 -0.66 0.00 -1.16 0.00 0.00 179.01 177.30 2yrq h ARG 55 N 0.00 0.00 0.14 2.33 3.08 -0.79 -2.58 114.38 116.56 2yrq h ARG 55 Ca -0.00 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.77 2yrq h ARG 55 Cb 0.96 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.02 2yrq h ARG 55 CO 0.01 0.34 -1.30 2.35 -1.07 0.00 0.00 179.97 180.30 2yrq h TRP 56 N 0.00 0.53 0.01 3.04 2.91 -0.77 -2.86 115.95 118.81 2yrq h TRP 56 Ca -0.04 -0.39 -0.21 0.00 1.13 0.00 0.00 58.89 59.38 2yrq h TRP 56 Cb 1.33 -0.02 -0.03 0.00 -0.51 0.00 0.00 29.16 29.93 2yrq h TRP 56 CO 0.00 1.32 -1.02 1.57 -1.03 0.00 0.00 178.44 179.27 2yrq h LYS 57 N 0.08 0.01 0.00 2.65 2.10 -1.62 -3.25 116.57 116.54 2yrq h LYS 57 Ca -0.16 -0.02 -0.12 0.00 -2.00 0.00 0.00 60.65 58.35 2yrq h LYS 57 Cb 2.00 0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 33.32 2yrq h LYS 57 CO 0.21 1.00 -0.58 0.00 -2.00 0.00 0.00 179.45 178.08 2yrq h THR 58 N 0.00 1.19 -2.79 0.07 1.03 -1.55 -3.44 112.91 107.42 2yrq h THR 58 Ca -0.02 -2.16 -0.53 0.00 -0.01 0.00 0.00 66.41 63.69 2yrq h THR 58 Cb 1.78 2.24 0.03 0.00 -1.07 0.00 0.00 68.15 71.14 2yrq h THR 58 CO 0.13 0.57 0.91 -0.04 -0.01 0.00 0.00 175.52 177.08 2yrq s MET 59 N -3.33 4.22 1.00 0.00 -1.94 -1.08 -4.99 119.30 113.19 2yrq s MET 59 Ca 0.01 2.32 -0.12 0.00 -1.71 0.00 0.00 55.69 56.18 2yrq s MET 59 Cb 0.11 -3.33 0.19 0.00 2.01 0.00 0.00 34.83 33.81 2yrq s MET 59 CO 0.74 -0.64 1.08 -1.12 -0.01 0.00 0.00 175.02 175.08 2yrq s SER 60 N 1.62 2.52 0.17 3.03 0.01 -1.26 -4.74 113.70 115.04 2yrq s SER 60 Ca 0.71 1.32 -0.16 0.00 1.31 0.00 0.00 55.95 59.13 2yrq s SER 60 Cb -0.42 -2.00 0.10 0.00 0.21 0.00 0.00 66.02 63.92 2yrq s SER 60 CO 0.31 -3.21 1.69 0.00 0.41 0.00 0.00 173.24 172.44 2yrq h ALA 61 N -1.95 0.32 -1.03 1.44 0.00 -1.97 -0.58 119.26 115.50 2yrq h ALA 61 Ca -0.54 0.13 0.26 0.00 0.00 0.00 0.00 54.91 54.75 2yrq h ALA 61 Cb 1.32 0.23 -0.11 0.00 0.00 0.00 0.00 17.79 19.23 2yrq h ALA 61 CO 0.55 -0.42 0.64 0.87 0.00 0.00 0.00 179.25 180.89 2yrq h LYS 62 N 0.06 0.47 -0.18 0.00 1.79 -2.00 0.53 116.57 117.25 2yrq h LYS 62 Ca 0.19 -0.03 -0.10 0.00 -2.18 0.00 0.00 60.65 58.53 2yrq h LYS 62 Cb 0.28 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 30.83 2yrq h LYS 62 CO -0.35 0.31 -0.29 0.93 -1.08 0.00 0.00 179.45 178.97 2yrq h GLU 63 N 0.49 0.51 0.00 3.15 4.39 -1.47 -3.08 114.58 118.57 2yrq h GLU 63 Ca 0.62 -0.31 -0.05 0.00 0.34 0.00 0.00 59.36 59.96 2yrq h GLU 63 Cb 1.38 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 30.06 2yrq h GLU 63 CO -0.39 0.91 -0.24 0.87 -1.16 0.00 0.00 179.01 179.00 2yrq h LYS 64 N 0.16 0.00 -0.22 2.33 1.57 -0.14 -3.32 116.57 116.95 2yrq h LYS 64 Ca 0.02 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.81 2yrq h LYS 64 Cb 0.87 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.15 2yrq h LYS 64 CO 0.07 0.24 -0.13 0.41 -0.57 0.00 0.00 179.45 179.47 2yrq n GLY 65 N -0.17 -2.86 0.36 3.86 0.00 0.16 0.11 105.19 106.66 2yrq n GLY 65 Ca -0.01 0.69 0.07 0.00 0.00 0.00 0.00 46.02 46.76 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 0.84 0.00 1.61 2.10 -1.74 0.10 116.57 119.48 2yrq h LYS 66 Ca 0.03 -0.05 -0.02 0.00 -2.00 0.00 0.00 60.65 58.61 2yrq h LYS 66 Cb 0.09 -0.19 -0.00 0.00 -0.90 0.00 0.00 32.23 31.23 2yrq h LYS 66 CO -0.20 0.55 -0.11 0.74 -2.00 0.00 0.00 179.45 178.43 2yrq h PHE 67 N 0.86 0.00 0.04 0.07 0.04 -0.59 -0.16 116.94 117.20 2yrq h PHE 67 Ca 0.38 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 61.06 2yrq h PHE 67 Cb 0.33 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.49 2yrq h PHE 67 CO -0.00 0.11 -0.34 0.93 -0.60 0.00 0.00 178.31 178.41 2yrq h GLU 68 N 0.00 0.16 0.28 1.51 4.39 0.34 -3.09 114.58 118.17 2yrq h GLU 68 Ca -0.00 -0.23 -0.01 0.00 0.34 0.00 0.00 59.36 59.46 2yrq h GLU 68 Cb 0.44 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 2yrq h GLU 68 CO 0.01 1.04 -0.13 0.22 -1.16 0.00 0.00 179.01 179.00 2yrq h ASP 69 N -0.61 -0.32 -1.11 1.42 3.58 -1.29 -3.01 116.42 115.08 2yrq h ASP 69 Ca -0.05 -0.21 0.32 0.00 0.42 0.00 0.00 57.03 57.50 2yrq h ASP 69 Cb 1.20 0.08 -0.06 0.00 1.72 0.00 0.00 39.33 42.27 2yrq h ASP 69 CO 0.07 0.15 0.78 0.00 -2.88 0.00 0.00 179.24 177.36 2yrq h MET 70 N -0.90 0.09 -0.29 0.28 -0.00 -1.20 0.25 114.93 113.15 2yrq h MET 70 Ca -0.04 -0.01 -0.09 0.00 -0.00 0.00 0.00 59.70 59.57 2yrq h MET 70 Cb 0.51 -0.02 -0.01 0.00 -0.00 0.00 0.00 31.60 32.08 2yrq h MET 70 CO 0.06 0.06 -0.17 0.00 -0.00 0.00 0.00 176.91 176.87 2yrq h ALA 71 N 1.48 0.41 -0.86 -3.00 0.00 -1.50 -3.06 119.26 112.73 2yrq h ALA 71 Ca 0.56 -0.34 0.10 0.00 0.00 0.00 0.00 54.91 55.23 2yrq h ALA 71 Cb 2.02 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 19.65 2yrq h ALA 71 CO -0.08 0.32 0.56 0.87 0.00 0.00 0.00 179.25 180.92 2yrq h LYS 72 N 0.37 0.79 -1.01 0.00 1.57 -0.38 -1.17 116.57 116.74 2yrq h LYS 72 Ca 0.06 -0.05 0.24 0.00 -1.87 0.00 0.00 60.65 59.03 2yrq h LYS 72 Cb 0.70 -0.18 -0.10 0.00 0.08 0.00 0.00 32.23 32.73 2yrq h LYS 72 CO 0.05 0.53 0.63 0.00 -0.57 0.00 0.00 179.45 180.08 2yrq h ALA 73 N 1.57 1.99 -0.92 3.86 0.00 -1.39 -0.86 119.26 123.51 2yrq h ALA 73 Ca 0.40 0.08 0.24 0.00 0.00 0.00 0.00 54.91 55.63 2yrq h ALA 73 Cb 0.45 -0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.07 2yrq h ALA 73 CO -0.17 -0.40 0.02 0.22 0.00 0.00 0.00 179.25 178.93 2yrq h ASP 74 N 0.53 -0.43 -0.89 0.00 1.82 -1.32 0.31 116.42 116.43 2yrq h ASP 74 Ca 0.59 0.25 0.32 0.00 -0.39 0.00 0.00 57.03 57.81 2yrq h ASP 74 Cb 1.27 0.44 -0.16 0.00 0.68 0.00 0.00 39.33 41.56 2yrq h ASP 74 CO -0.35 -0.29 0.28 1.17 -1.61 0.00 0.00 179.24 178.44 2yrq n LYS 75 N -5.44 -0.06 0.15 0.28 4.81 -0.33 0.16 118.16 117.73 2yrq n LYS 75 Ca 0.20 1.28 -0.06 0.00 -0.87 0.00 0.00 58.31 58.85 2yrq n LYS 75 Cb 0.67 -2.17 -0.03 0.00 0.02 0.00 0.00 35.03 33.51 2yrq n LYS 75 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2yrq h ALA 76 N 1.78 -0.66 0.00 3.14 0.00 -0.57 -3.10 119.26 119.84 2yrq h ALA 76 Ca 0.66 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.48 2yrq h ALA 76 Cb 1.62 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.57 2yrq h ALA 76 CO -0.75 -0.63 0.03 2.89 0.00 0.00 0.00 179.25 180.78 2yrq n ARG 77 N -3.79 0.07 0.16 0.00 -4.01 -0.18 -1.07 116.66 107.83 2yrq n ARG 77 Ca -0.05 0.56 0.00 0.00 -1.04 0.00 0.00 57.85 57.32 2yrq n ARG 77 Cb 0.16 -1.76 0.26 0.00 -3.04 0.00 0.00 32.46 28.09 2yrq n ARG 77 CO 0.00 0.00 0.00 -0.92 -3.04 0.00 0.00 177.63 173.67 2yrq h TYR 78 N 0.00 0.02 0.16 2.89 5.03 0.16 -1.93 116.97 123.31 2yrq h TYR 78 Ca 0.00 -0.01 -0.32 0.00 2.58 0.00 0.00 58.73 60.99 2yrq h TYR 78 Cb 0.06 -0.00 0.01 0.00 1.55 0.00 0.00 36.73 38.34 2yrq h TYR 78 CO 0.00 0.51 -1.54 0.93 -1.32 0.00 0.00 178.16 176.74 2yrq h GLU 79 N 0.01 0.33 -0.16 1.82 5.08 -1.16 -3.33 114.58 117.19 2yrq h GLU 79 Ca -0.00 -0.57 -0.09 0.00 -1.00 0.00 0.00 59.36 57.70 2yrq h GLU 79 Cb 0.88 0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 2yrq h GLU 79 CO 0.06 1.23 -0.31 -0.09 -1.00 0.00 0.00 179.01 178.90 2yrq h ARG 80 N 0.09 0.30 -0.46 2.33 2.43 -1.54 -3.06 114.38 114.47 2yrq h ARG 80 Ca -0.25 -0.12 0.08 0.00 -0.81 0.00 0.00 59.98 58.87 2yrq h ARG 80 Cb 2.05 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 31.53 2yrq h ARG 80 CO 0.19 0.58 0.10 0.93 -1.51 0.00 0.00 179.97 180.26 2yrq h GLU 81 N 0.27 0.23 -1.11 0.20 4.39 -1.45 -1.46 114.58 115.64 2yrq h GLU 81 Ca 0.04 -0.01 0.41 0.00 0.34 0.00 0.00 59.36 60.14 2yrq h GLU 81 Cb 0.68 -0.05 -0.14 0.00 -0.10 0.00 0.00 28.75 29.14 2yrq h GLU 81 CO 0.05 0.15 0.68 -1.33 -1.16 0.00 0.00 179.01 177.40 2yrq n MET 82 N -5.10 -0.04 -0.13 2.33 2.81 -1.16 0.10 117.12 115.93 2yrq n MET 82 Ca 0.05 1.18 -0.04 0.00 -1.81 0.00 0.00 57.70 57.08 2yrq n MET 82 Cb 0.22 -2.25 0.03 0.00 -0.71 0.00 0.00 33.22 30.51 2yrq n MET 82 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 2yrq h LYS 83 N 0.00 0.03 -0.51 0.03 2.10 -1.44 0.23 116.57 117.00 2yrq h LYS 83 Ca 0.79 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.44 2yrq h LYS 83 Cb 2.36 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 33.69 2yrq h LYS 83 CO -0.53 0.02 0.00 -2.37 -2.00 0.00 0.00 179.45 174.56 2yrq n THR 84 N -5.29 0.61 -1.09 0.07 5.66 0.28 -4.96 114.28 109.56 2yrq n THR 84 Ca 0.03 -0.41 -0.37 0.00 -3.05 0.00 0.00 64.05 60.25 2yrq n THR 84 Cb 0.23 -0.08 0.03 0.00 -1.55 0.00 0.00 70.33 68.96 2yrq n THR 84 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2yrq n TYR 85 N 0.24 -4.32 -3.61 1.09 4.19 0.80 -4.99 117.16 110.57 2yrq n TYR 85 Ca 0.09 0.14 -0.24 0.00 3.31 0.00 0.00 57.90 61.20 2yrq n TYR 85 Cb 0.37 -1.53 -0.17 0.00 0.49 0.00 0.00 39.34 38.50 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 -2.00 -0.12 0.78 2.97 1.01 -1.26 -5.08 121.20 117.50 2yrq s ILE 86 Ca 0.46 -0.08 -0.11 0.00 0.00 0.00 0.00 60.65 60.93 2yrq s ILE 86 Cb -0.29 -0.53 0.06 0.00 0.01 0.00 0.00 42.46 41.71 2yrq s ILE 86 CO 0.77 -0.21 1.09 -2.16 0.00 0.00 0.00 174.94 174.42 2yrq s PRO 87 N 2.16 2.19 0.07 2.79 0.04 -1.26 -4.73 135.00 136.27 2yrq s PRO 87 Ca 0.03 1.15 -0.01 0.00 0.04 0.00 0.00 61.00 62.20 2yrq s PRO 87 Cb -0.15 -1.89 0.02 0.00 0.04 0.00 0.00 34.50 32.51 2yrq s PRO 87 CO -0.09 -1.68 0.06 -0.35 0.04 0.00 0.00 177.00 174.99 2yrq n PRO 88 N -3.55 -1.15 -1.52 0.56 -0.04 -1.26 -4.75 135.00 123.30 2yrq n PRO 88 Ca 0.09 -0.10 -0.34 0.00 -0.04 0.00 0.00 63.50 63.10 2yrq n PRO 88 Cb 0.53 -0.10 -0.13 0.00 -0.04 0.00 0.00 33.50 33.77 2yrq n PRO 88 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2yrq n LYS 89 N -1.71 0.31 0.00 0.54 3.00 -1.26 -4.50 118.16 114.55 2yrq n LYS 89 Ca 0.01 -0.07 0.00 0.00 -0.00 0.00 0.00 58.31 58.24 2yrq n LYS 89 Cb 0.03 -2.10 0.00 0.00 0.00 0.00 0.00 35.03 32.97 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 6.24 0.00 3.29 3.14 0.00 -1.26 -4.84 105.19 111.76 2yrq n GLY 90 Ca 0.57 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.40 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 -1.19 1.77 0.05 1.61 2.02 -1.26 -4.52 118.70 117.18 2yrq s GLU 91 Ca 0.00 -2.02 -0.30 0.00 0.02 0.00 0.00 54.97 52.67 2yrq s GLU 91 Cb 0.00 0.33 -0.09 0.00 0.10 0.00 0.00 34.13 34.47 2yrq s GLU 91 CO 0.00 -0.66 1.90 0.99 0.02 0.00 0.00 175.26 177.51 2yrq s THR 92 N -3.43 2.96 0.23 3.63 2.01 -1.26 -4.96 115.64 114.83 2yrq s THR 92 Ca 0.41 0.11 0.03 0.00 0.31 0.00 0.00 61.69 62.55 2yrq s THR 92 Cb 0.02 -3.07 -0.01 0.00 0.01 0.00 0.00 72.50 69.45 2yrq s THR 92 CO 0.28 -0.01 0.24 0.29 -0.69 0.00 0.00 174.62 174.73 2yrq n LYS 93 N 7.02 0.35 -0.00 4.92 4.76 -1.26 -5.08 118.16 128.87 2yrq n LYS 93 Ca 0.19 -2.15 -0.00 0.00 -2.87 0.00 0.00 58.31 53.48 2yrq n LYS 93 Cb 0.41 1.86 -0.01 0.00 -1.84 0.00 0.00 35.03 35.45 2yrq n LYS 93 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 2yrq n LYS 94 N -0.42 2.53 -3.89 1.97 2.85 -1.26 -5.04 118.16 114.90 2yrq n LYS 94 Ca 0.04 -0.00 -0.30 0.00 -1.05 0.00 0.00 58.31 57.00 2yrq n LYS 94 Cb 0.41 -1.02 -0.04 0.00 -0.65 0.00 0.00 35.03 33.73 2yrq n LYS 94 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 177.40 175.76 2yrq s LYS 95 N -2.03 3.46 0.12 -1.58 0.00 -1.26 -5.11 119.74 113.34 2yrq s LYS 95 Ca -0.00 -0.43 0.05 0.00 0.00 0.00 0.00 55.97 55.59 2yrq s LYS 95 Cb 0.00 -2.99 -0.04 0.00 0.00 0.00 0.00 37.83 34.80 2yrq s LYS 95 CO 0.03 0.56 0.03 -0.59 0.00 0.00 0.00 175.35 175.38 2yrq s PHE 96 N -1.59 2.99 0.54 1.78 -0.71 -1.26 -5.02 117.98 114.71 2yrq s PHE 96 Ca 0.36 -0.05 0.06 0.00 -1.04 0.00 0.00 56.93 56.26 2yrq s PHE 96 Cb -0.12 -1.50 0.06 0.00 -1.21 0.00 0.00 43.02 40.25 2yrq s PHE 96 CO 0.28 0.50 0.51 1.63 -1.34 0.00 0.00 175.22 176.79 2yrq n LYS 97 N 0.24 0.68 -3.86 1.99 4.01 -1.26 -5.09 118.16 114.87 2yrq n LYS 97 Ca -0.10 -3.26 -0.30 0.00 -0.51 0.00 0.00 58.31 54.14 2yrq n LYS 97 Cb 0.53 0.19 -0.11 0.00 -0.51 0.00 0.00 35.03 35.13 2yrq n LYS 97 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2yrq s ASP 98 N -4.25 5.00 0.01 4.39 1.01 -1.26 -4.90 116.67 116.67 2yrq s ASP 98 Ca 0.38 -3.77 0.15 0.00 0.71 0.00 0.00 52.55 50.02 2yrq s ASP 98 Cb -0.03 -1.69 0.62 0.00 1.01 0.00 0.00 42.92 42.84 2yrq s ASP 98 CO 0.24 -0.11 1.47 -0.81 0.21 0.00 0.00 175.17 176.17 2yrq n PRO 99 N 2.12 0.01 -0.09 8.23 -0.04 -1.26 -2.83 135.00 141.14 2yrq n PRO 99 Ca 0.19 0.26 -0.14 0.00 -0.04 0.00 0.00 63.50 63.77 2yrq n PRO 99 Cb 0.35 -1.52 -0.03 0.00 -0.04 0.00 0.00 33.50 32.27 2yrq n PRO 99 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 2yrq h ASN 100 N 0.00 0.97 -1.79 3.54 4.21 -1.94 -3.45 115.58 117.12 2yrq h ASN 100 Ca 0.00 -0.50 -0.63 0.00 1.21 0.00 0.00 56.30 56.38 2yrq h ASN 100 Cb 0.25 -0.28 0.11 0.00 -1.12 0.00 0.00 38.32 37.29 2yrq h ASN 100 CO 0.00 1.30 -0.24 0.00 -1.29 0.00 0.00 177.43 177.20 2yrq n ALA 101 N -2.56 -1.58 -1.83 -0.83 0.00 -1.13 -4.88 120.51 107.70 2yrq n ALA 101 Ca -0.04 0.38 -0.41 0.00 0.00 0.00 0.00 53.44 53.38 2yrq n ALA 101 Cb 0.60 -1.80 -0.03 0.00 0.00 0.00 0.00 19.45 18.22 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 -1.30 4.45 0.66 0.00 0.04 -1.26 -4.23 135.00 133.35 2yrq s PRO 102 Ca 0.61 2.06 -0.11 0.00 0.04 0.00 0.00 61.00 63.60 2yrq s PRO 102 Cb -0.79 -3.14 -0.02 0.00 0.04 0.00 0.00 34.50 30.60 2yrq s PRO 102 CO 0.58 -0.09 1.05 -1.59 0.04 0.00 0.00 177.00 177.00 2yrq s LYS 103 N -1.27 3.26 0.12 4.56 -2.85 -1.26 -3.56 119.74 118.73 2yrq s LYS 103 Ca 0.49 0.60 -0.20 0.00 -1.00 0.00 0.00 55.97 55.87 2yrq s LYS 103 Cb -0.37 -2.06 -0.07 0.00 -2.06 0.00 0.00 37.83 33.27 2yrq s LYS 103 CO 0.46 -0.77 0.62 1.03 0.10 0.00 0.00 175.35 176.78 2yrq s ARG 104 N -5.25 4.23 1.01 1.78 0.52 -1.26 -4.92 118.95 115.06 2yrq s ARG 104 Ca 0.56 0.79 -0.12 0.00 -0.52 0.00 0.00 55.73 56.43 2yrq s ARG 104 Cb -0.11 -3.15 0.19 0.00 0.52 0.00 0.00 34.95 32.40 2yrq s ARG 104 CO 0.53 0.57 1.09 -1.25 0.02 0.00 0.00 175.30 176.27 2yrq s PRO 105 N -1.35 0.36 1.04 3.54 0.04 -1.26 -5.04 135.00 132.33 2yrq s PRO 105 Ca 0.33 0.50 -0.13 0.00 0.04 0.00 0.00 61.00 61.73 2yrq s PRO 105 Cb -0.19 -1.73 0.21 0.00 0.04 0.00 0.00 34.50 32.83 2yrq s PRO 105 CO 0.20 -2.78 1.10 -1.25 0.04 0.00 0.00 177.00 174.31 2yrq s PRO 106 N -4.97 0.07 0.53 0.56 0.04 -1.26 -5.06 135.00 124.92 2yrq s PRO 106 Ca 0.65 0.40 0.03 0.00 0.04 0.00 0.00 61.00 62.13 2yrq s PRO 106 Cb -0.19 -1.71 0.01 0.00 0.04 0.00 0.00 34.50 32.66 2yrq s PRO 106 CO 0.58 -2.95 0.20 -1.54 0.04 0.00 0.00 177.00 173.33 2yrq s SER 107 N -3.51 4.37 0.35 6.66 1.04 -1.26 -4.91 113.70 116.44 2yrq s SER 107 Ca 0.66 -1.47 0.09 0.00 0.48 0.00 0.00 55.95 55.71 2yrq s SER 107 Cb -0.17 0.50 0.82 0.00 0.10 0.00 0.00 66.02 67.26 2yrq s SER 107 CO 0.57 -0.99 1.86 0.00 0.98 0.00 0.00 173.24 175.66 2yrq h ALA 108 N 1.05 1.83 -0.14 5.32 0.00 -1.90 -1.39 119.26 124.03 2yrq h ALA 108 Ca -0.40 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 2yrq h ALA 108 Cb 1.31 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2yrq h ALA 108 CO 0.66 -0.09 0.06 0.35 0.00 0.00 0.00 179.25 180.23 2yrq h PHE 109 N 0.69 0.20 -0.46 0.00 3.57 -1.95 -1.27 116.94 117.73 2yrq h PHE 109 Ca 0.47 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.98 2yrq h PHE 109 Cb 0.76 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.41 2yrq h PHE 109 CO -0.00 0.27 0.26 0.35 -2.23 0.00 0.00 178.31 176.96 2yrq h PHE 110 N 0.09 0.49 -0.40 0.41 3.04 -1.67 0.15 116.94 119.04 2yrq h PHE 110 Ca 0.05 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.02 2yrq h PHE 110 Cb 0.14 -0.16 -0.02 0.00 2.56 0.00 0.00 35.95 38.48 2yrq h PHE 110 CO -0.02 0.28 0.26 -0.07 -2.02 0.00 0.00 178.31 176.74 2yrq h LEU 111 N 0.53 0.46 -0.03 0.59 3.38 -1.21 0.13 115.31 119.17 2yrq h LEU 111 Ca 0.18 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 2yrq h LEU 111 Cb 0.03 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 2yrq h LEU 111 CO -0.09 0.34 0.01 0.15 0.09 0.00 0.00 178.44 178.94 2yrq h PHE 112 N 0.54 0.04 0.00 1.13 3.04 -0.86 -2.36 116.94 118.47 2yrq h PHE 112 Ca 0.15 -0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.07 2yrq h PHE 112 Cb -0.06 -0.01 -0.00 0.00 2.56 0.00 0.00 35.95 38.44 2yrq h PHE 112 CO -0.05 0.24 -0.09 0.00 -2.02 0.00 0.00 178.31 176.40 2yrq h SER 114 N 0.00 0.00 0.00 0.00 0.87 -0.45 0.29 113.55 114.27 2yrq h SER 114 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2yrq h SER 114 Cb 0.16 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.12 2yrq h SER 114 CO 0.01 0.00 -1.51 1.21 -0.53 0.00 0.00 176.83 176.01 2yrq n GLU 115 N -2.50 0.57 -0.11 2.24 2.13 -0.18 -4.54 120.64 118.25 2yrq n GLU 115 Ca 0.04 -0.11 -0.19 0.00 0.66 0.00 0.00 57.16 57.57 2yrq n GLU 115 Cb 0.39 -1.46 -0.09 0.00 0.27 0.00 0.00 31.44 30.55 2yrq n GLU 115 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 2yrq n TYR 116 N -1.90 0.00 -0.36 4.31 4.02 -0.31 -4.14 117.16 118.78 2yrq n TYR 116 Ca -0.01 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.86 2yrq n TYR 116 Cb 0.44 -0.81 0.01 0.00 -0.02 0.00 0.00 39.34 38.96 2yrq n TYR 116 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 2yrq n ARG 117 N -3.49 -0.25 0.19 -0.72 0.63 0.10 0.12 116.66 113.24 2yrq n ARG 117 Ca -0.40 1.40 0.04 0.00 -0.92 0.00 0.00 57.85 57.97 2yrq n ARG 117 Cb 0.86 -2.08 0.36 0.00 0.45 0.00 0.00 32.46 32.05 2yrq n ARG 117 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 2yrq h PRO 118 N 0.00 0.00 0.26 -0.14 0.13 -1.80 -0.98 132.00 129.48 2yrq h PRO 118 Ca 0.29 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.40 2yrq h PRO 118 Cb 0.51 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.65 2yrq h PRO 118 CO -0.90 0.39 -0.12 -0.22 -0.23 0.00 0.00 178.00 176.92 2yrq h LYS 119 N 0.00 -0.34 -0.13 0.86 3.64 0.78 -2.96 116.57 118.43 2yrq h LYS 119 Ca -0.00 0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.31 2yrq h LYS 119 Cb 0.79 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.67 2yrq h LYS 119 CO 0.05 0.02 -0.32 -0.84 -2.27 0.00 0.00 179.45 176.09 2yrq h ILE 120 N -0.88 1.27 -0.41 2.00 3.07 -0.37 -2.98 117.51 119.21 2yrq h ILE 120 Ca -0.04 -1.30 0.04 0.00 1.55 0.00 0.00 64.86 65.12 2yrq h ILE 120 Cb 0.51 1.53 -0.04 0.00 -0.27 0.00 0.00 36.82 38.55 2yrq h ILE 120 CO 0.06 0.39 0.17 0.50 -1.05 0.00 0.00 178.15 178.22 2yrq h LYS 121 N 0.22 0.34 -0.31 0.16 3.64 -1.23 0.76 116.57 120.16 2yrq h LYS 121 Ca 0.03 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.30 2yrq h LYS 121 Cb 0.68 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.41 2yrq h LYS 121 CO 0.05 0.22 -0.19 0.78 -2.27 0.00 0.00 179.45 178.05 2yrq h GLY 122 N 0.35 0.60 0.83 5.01 0.00 -1.40 -3.10 103.07 105.36 2yrq h GLY 122 Ca 0.19 -0.47 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 2yrq h GLY 122 CO -0.17 0.43 -0.15 0.83 0.00 0.00 0.00 176.54 177.48 2yrq h GLU 123 N 0.50 0.48 -3.87 4.80 3.07 -1.26 -3.38 114.58 114.93 2yrq h GLU 123 Ca 0.08 -0.23 -0.72 0.00 -0.50 0.00 0.00 59.36 57.99 2yrq h GLU 123 Cb 0.61 -0.00 -0.32 0.00 -0.84 0.00 0.00 28.75 28.19 2yrq h GLU 123 CO 0.04 0.79 -0.29 -1.01 -1.40 0.00 0.00 179.01 177.14 2yrq s HIS 124 N -4.48 3.50 -2.00 4.33 3.76 0.20 -4.91 115.29 115.70 2yrq s HIS 124 Ca -0.13 -2.35 0.15 0.00 -0.15 0.00 0.00 55.06 52.58 2yrq s HIS 124 Cb 0.07 -3.40 0.92 0.00 1.11 0.00 0.00 32.58 31.27 2yrq s HIS 124 CO 0.77 -0.92 1.33 -0.35 -0.85 0.00 0.00 174.74 174.73 2yrq n PRO 125 N 4.00 0.49 -0.11 8.40 -0.04 -1.24 -2.73 135.00 143.76 2yrq n PRO 125 Ca 0.05 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.37 2yrq n PRO 125 Cb 0.41 -1.49 -0.13 0.00 -0.04 0.00 0.00 33.50 32.24 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 -0.60 3.64 0.55 0.00 -1.26 -4.96 105.19 102.52 2yrq n GLY 126 Ca 0.12 -0.23 -0.51 0.00 0.00 0.00 0.00 46.02 45.39 2yrq n GLY 126 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2yrq n LEU 127 N -3.01 2.28 -4.93 0.99 4.77 -1.11 -4.96 117.00 111.03 2yrq n LEU 127 Ca -0.39 1.09 -0.26 0.00 -0.03 0.00 0.00 56.01 56.42 2yrq n LEU 127 Cb 1.04 -1.26 -0.03 0.00 -2.33 0.00 0.00 43.42 40.84 2yrq n LEU 127 CO 0.32 -0.68 0.06 -0.44 -1.33 0.00 0.00 177.39 175.33 2yrq s SER 128 N 1.35 6.37 0.46 -1.43 0.01 -1.26 -4.77 113.70 114.43 2yrq s SER 128 Ca 0.86 0.42 0.35 0.00 1.31 0.00 0.00 55.95 58.88 2yrq s SER 128 Cb -0.88 -2.02 1.52 0.00 0.21 0.00 0.00 66.02 64.86 2yrq s SER 128 CO 0.48 -0.10 1.58 0.40 0.41 0.00 0.00 173.24 176.01 2yrq h ILE 129 N 1.36 0.02 -0.55 1.44 2.04 -1.99 1.29 117.51 121.12 2yrq h ILE 129 Ca -0.49 -0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.27 2yrq h ILE 129 Cb 1.20 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 2yrq h ILE 129 CO 0.66 0.00 -0.06 1.23 0.00 0.00 0.00 178.15 179.98 2yrq h GLY 130 N 0.01 1.07 0.00 5.37 0.00 -2.01 -3.16 103.07 104.37 2yrq h GLY 130 Ca 0.88 -0.82 -0.00 0.00 0.00 0.00 0.00 47.33 47.39 2yrq h GLY 130 CO -0.41 0.75 -0.00 -0.55 0.00 0.00 0.00 176.54 176.34 2yrq h ASP 131 N 0.90 -0.00 -0.96 0.19 5.19 0.12 -3.14 116.42 118.71 2yrq h ASP 131 Ca 0.15 0.00 0.32 0.00 -0.62 0.00 0.00 57.03 56.88 2yrq h ASP 131 Cb 0.61 0.00 -0.08 0.00 0.18 0.00 0.00 39.33 40.04 2yrq h ASP 131 CO 0.04 0.41 0.64 0.52 -3.12 0.00 0.00 179.24 177.73 2yrq n VAL 132 N -4.33 -0.13 -0.00 -1.35 0.31 -0.17 0.27 118.33 112.93 2yrq n VAL 132 Ca -0.00 1.12 -0.17 0.00 -0.01 0.00 0.00 64.34 65.28 2yrq n VAL 132 Cb 0.00 -1.84 -0.13 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 0.95 -0.01 -0.69 3.52 0.00 -1.65 -3.21 119.26 118.17 2yrq h ALA 133 Ca 0.57 -0.57 0.10 0.00 0.00 0.00 0.00 54.91 55.01 2yrq h ALA 133 Cb 1.95 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 19.74 2yrq h ALA 133 CO -0.24 0.23 0.46 1.57 0.00 0.00 0.00 179.25 181.26 2yrq h LYS 134 N -0.45 0.55 0.00 0.00 2.10 0.38 0.12 116.57 119.27 2yrq h LYS 134 Ca -0.07 -0.03 -0.07 0.00 -2.00 0.00 0.00 60.65 58.47 2yrq h LYS 134 Cb 1.28 -0.12 -0.01 0.00 -0.90 0.00 0.00 32.23 32.48 2yrq h LYS 134 CO 0.09 0.36 -0.33 0.87 -2.00 0.00 0.00 179.45 178.44 2yrq h LYS 135 N 0.57 0.00 0.13 0.07 1.57 -1.27 -2.98 116.57 114.66 2yrq h LYS 135 Ca 0.32 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.80 2yrq h LYS 135 Cb 0.49 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.80 2yrq h LYS 135 CO -0.11 0.33 -1.45 -0.07 -0.57 0.00 0.00 179.45 177.59 2yrq h LEU 136 N 0.00 0.42 -1.03 2.94 3.38 -0.84 -2.09 115.31 118.09 2yrq h LEU 136 Ca -0.00 -0.53 0.10 0.00 0.09 0.00 0.00 57.88 57.53 2yrq h LEU 136 Cb 0.70 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 41.24 2yrq h LEU 136 CO 0.04 1.44 0.63 1.23 0.09 0.00 0.00 178.44 181.87 2yrq h GLY 137 N 1.58 1.55 0.55 0.83 0.00 -0.94 -2.49 103.07 104.16 2yrq h GLY 137 Ca -0.21 -0.44 -0.33 0.00 0.00 0.00 0.00 47.33 46.34 2yrq h GLY 137 CO 0.18 0.24 -1.79 1.05 0.00 0.00 0.00 176.54 176.21 2yrq h GLU 138 N 1.06 0.24 -0.82 4.80 4.11 -1.66 -3.34 114.58 118.96 2yrq h GLU 138 Ca 0.46 -0.41 0.17 0.00 0.07 0.00 0.00 59.36 59.65 2yrq h GLU 138 Cb 0.35 0.15 -0.16 0.00 0.50 0.00 0.00 28.75 29.60 2yrq h GLU 138 CO -0.22 1.20 -0.20 0.52 0.07 0.00 0.00 179.01 180.38 2yrq h MET 139 N -0.13 0.00 0.24 1.06 2.86 -1.21 0.36 114.93 118.12 2yrq h MET 139 Ca -0.39 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.24 2yrq h MET 139 Cb 1.90 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.56 2yrq h MET 139 CO 0.05 0.00 -0.13 2.35 1.06 0.00 0.00 176.91 180.24 2yrq h TRP 140 N 0.00 -0.33 -0.85 -0.22 -0.00 -1.63 0.75 115.95 113.68 2yrq h TRP 140 Ca 0.40 -0.01 0.20 0.00 -0.00 0.00 0.00 58.89 59.48 2yrq h TRP 140 Cb 0.61 0.11 -0.12 0.00 -0.00 0.00 0.00 29.16 29.76 2yrq h TRP 140 CO -0.65 -0.20 0.32 -0.91 -0.00 0.00 0.00 178.44 177.00 2yrq h ASN 141 N -0.34 0.23 0.14 2.65 2.35 -1.11 0.15 115.58 119.64 2yrq h ASN 141 Ca -0.03 0.15 -0.18 0.00 -0.55 0.00 0.00 56.30 55.69 2yrq h ASN 141 Cb 0.27 0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.79 2yrq h ASN 141 CO 0.04 -0.01 -0.68 0.78 -1.65 0.00 0.00 177.43 175.91 2yrq h ASN 142 N 0.36 0.58 -1.94 5.81 2.35 -0.84 -3.45 115.58 118.46 2yrq h ASN 142 Ca 0.51 -0.36 -0.64 0.00 -0.55 0.00 0.00 56.30 55.26 2yrq h ASN 142 Cb 0.94 -0.17 0.04 0.00 0.05 0.00 0.00 38.32 39.18 2yrq h ASN 142 CO -0.52 1.10 0.80 0.41 -1.65 0.00 0.00 177.43 177.56 2yrq n THR 143 N -3.89 0.19 -0.85 2.81 -1.04 0.53 -4.93 114.28 107.10 2yrq n THR 143 Ca -0.04 -0.03 -0.29 0.00 -2.04 0.00 0.00 64.05 61.64 2yrq n THR 143 Cb 0.68 -1.38 0.19 0.00 -1.82 0.00 0.00 70.33 68.00 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 2.02 0.78 0.31 2.41 0.00 -1.26 -4.93 121.76 121.08 2yrq s ALA 144 Ca 0.87 0.05 0.07 0.00 0.00 0.00 0.00 51.96 52.95 2yrq s ALA 144 Cb -0.82 -3.27 0.50 0.00 0.00 0.00 0.00 23.12 19.53 2yrq s ALA 144 CO 0.48 -3.01 1.73 0.00 0.00 0.00 0.00 175.76 174.96 2yrq h ALA 145 N -2.03 1.16 -0.07 0.00 0.00 -1.96 -3.13 119.26 113.23 2yrq h ALA 145 Ca -0.53 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 53.99 2yrq h ALA 145 Cb 1.30 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 2yrq h ALA 145 CO 0.50 0.56 0.04 0.22 0.00 0.00 0.00 179.25 180.57 2yrq h ASP 146 N 0.19 0.09 0.00 0.00 3.58 -2.02 -1.64 116.42 116.63 2yrq h ASP 146 Ca 0.02 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.37 2yrq h ASP 146 Cb 0.77 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.79 2yrq h ASP 146 CO 0.06 0.17 0.04 -0.67 -2.88 0.00 0.00 179.24 175.95 2yrq n ASP 147 N -4.98 0.27 -1.93 2.28 -0.08 -1.18 -0.31 116.55 110.61 2yrq n ASP 147 Ca -0.06 0.61 0.04 0.00 -1.51 0.00 0.00 54.79 53.87 2yrq n ASP 147 Cb 0.08 -0.63 0.39 0.00 2.34 0.00 0.00 41.12 43.29 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 -1.86 4.69 0.26 -0.67 5.02 -0.62 -4.53 118.16 120.45 2yrq n LYS 148 Ca -0.01 -3.14 -0.13 0.00 -2.02 0.00 0.00 58.31 53.01 2yrq n LYS 148 Cb 0.05 -2.27 -0.07 0.00 -0.02 0.00 0.00 35.03 32.73 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 3.74 -0.67 0.00 1.97 4.15 -0.72 0.35 115.11 123.93 2yrq h GLN 149 Ca 0.05 0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.52 2yrq h GLN 149 Cb 2.06 0.15 0.00 0.00 0.21 0.00 0.00 27.48 29.91 2yrq h GLN 149 CO 0.55 -0.38 0.00 -0.35 -1.93 0.00 0.00 178.83 176.72 2yrq n PRO 150 N -5.26 0.20 -0.10 -2.39 -0.04 -1.26 -1.79 135.00 124.36 2yrq n PRO 150 Ca -0.10 0.44 -0.19 0.00 -0.04 0.00 0.00 63.50 63.61 2yrq n PRO 150 Cb 0.31 -1.89 -0.08 0.00 -0.04 0.00 0.00 33.50 31.79 2yrq n PRO 150 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2yrq n TYR 151 N -2.28 0.72 0.23 0.54 4.01 -1.20 -3.36 117.16 115.83 2yrq n TYR 151 Ca 0.02 0.31 -0.15 0.00 -0.16 0.00 0.00 57.90 57.92 2yrq n TYR 151 Cb 0.23 -0.96 -0.08 0.00 -0.31 0.00 0.00 39.34 38.21 2yrq n TYR 151 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 2yrq h GLU 152 N -1.00 -0.54 -0.88 -0.72 4.39 -0.33 -1.57 114.58 113.94 2yrq h GLU 152 Ca -0.32 0.04 0.03 0.00 0.34 0.00 0.00 59.36 59.45 2yrq h GLU 152 Cb 1.17 0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 29.89 2yrq h GLU 152 CO -0.19 -0.31 0.57 0.87 -1.16 0.00 0.00 179.01 178.79 2yrq h LYS 153 N -0.64 1.09 0.61 2.33 1.79 -1.52 -2.57 116.57 117.67 2yrq h LYS 153 Ca -0.06 -0.07 -0.02 0.00 -2.18 0.00 0.00 60.65 58.33 2yrq h LYS 153 Cb 0.47 -0.24 -0.01 0.00 -1.58 0.00 0.00 32.23 30.87 2yrq h LYS 153 CO 0.09 0.72 -0.44 0.87 -1.08 0.00 0.00 179.45 179.61 2yrq h LYS 154 N 1.12 -0.98 -1.00 3.15 1.79 -1.53 -2.47 116.57 116.65 2yrq h LYS 154 Ca 0.34 0.07 0.25 0.00 -2.18 0.00 0.00 60.65 59.13 2yrq h LYS 154 Cb -0.02 0.22 -0.13 0.00 -1.58 0.00 0.00 32.23 30.73 2yrq h LYS 154 CO -0.11 -0.66 0.59 0.00 -1.08 0.00 0.00 179.45 178.19 2yrq h ALA 155 N -0.81 1.78 -0.68 3.86 0.00 -1.12 0.05 119.26 122.34 2yrq h ALA 155 Ca -0.08 0.13 0.15 0.00 0.00 0.00 0.00 54.91 55.11 2yrq h ALA 155 Cb 0.85 0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.55 2yrq h ALA 155 CO 0.03 -0.28 0.02 0.00 0.00 0.00 0.00 179.25 179.03 2yrq h ALA 156 N 1.73 0.71 -0.54 0.00 0.00 -1.03 0.45 119.26 120.58 2yrq h ALA 156 Ca 0.64 0.20 0.03 0.00 0.00 0.00 0.00 54.91 55.79 2yrq h ALA 156 Cb 1.23 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 19.33 2yrq h ALA 156 CO -0.48 -0.40 0.32 0.87 0.00 0.00 0.00 179.25 179.56 2yrq h LYS 157 N 0.13 0.61 -0.50 0.00 1.79 -0.94 -2.55 116.57 115.12 2yrq h LYS 157 Ca 0.36 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.80 2yrq h LYS 157 Cb 0.61 -0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 31.10 2yrq h LYS 157 CO -0.57 0.41 0.32 -0.07 -1.08 0.00 0.00 179.45 178.45 2yrq h LEU 158 N 0.63 0.58 -1.59 2.94 3.38 -0.93 -2.12 115.31 118.20 2yrq h LEU 158 Ca 0.22 -0.03 0.33 0.00 0.09 0.00 0.00 57.88 58.49 2yrq h LEU 158 Cb 0.04 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 40.56 2yrq h LEU 158 CO -0.11 0.43 0.78 0.50 0.09 0.00 0.00 178.44 180.14 2yrq h LYS 159 N 0.67 0.20 -0.79 1.13 1.63 -0.63 0.36 116.57 119.14 2yrq h LYS 159 Ca 0.18 -0.01 0.04 0.00 -0.85 0.00 0.00 60.65 60.01 2yrq h LYS 159 Cb -0.06 -0.05 -0.05 0.00 -0.60 0.00 0.00 32.23 31.48 2yrq h LYS 159 CO -0.04 0.13 0.49 0.93 -3.45 0.00 0.00 179.45 177.52 2yrq h GLU 160 N 0.21 0.91 0.00 1.90 5.08 -1.32 0.15 114.58 121.51 2yrq h GLU 160 Ca 0.63 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.94 2yrq h GLU 160 Cb 1.99 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 31.03 2yrq h GLU 160 CO -0.22 0.60 -0.00 0.87 -1.00 0.00 0.00 179.01 179.26 2yrq h LYS 161 N 0.93 0.00 0.00 2.33 1.79 -0.38 -1.37 116.57 119.88 2yrq h LYS 161 Ca 0.33 0.00 -0.20 0.00 -2.18 0.00 0.00 60.65 58.60 2yrq h LYS 161 Cb 0.08 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.70 2yrq h LYS 161 CO -0.14 0.00 -1.23 0.98 -1.08 0.00 0.00 179.45 177.99 2yrq n TYR 162 N -3.10 0.87 0.00 -1.35 9.36 -0.02 -3.27 117.16 119.65 2yrq n TYR 162 Ca -0.02 0.38 0.13 0.00 3.32 0.00 0.00 57.90 61.71 2yrq n TYR 162 Cb 0.15 -1.01 0.58 0.00 -0.63 0.00 0.00 39.34 38.43 2yrq n TYR 162 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 2yrq h GLU 163 N -1.00 0.22 -0.03 2.98 4.39 -0.70 0.64 114.58 121.08 2yrq h GLU 163 Ca -0.30 -0.01 -0.22 0.00 0.34 0.00 0.00 59.36 59.17 2yrq h GLU 163 Cb 1.16 -0.05 0.02 0.00 -0.10 0.00 0.00 28.75 29.78 2yrq h GLU 163 CO -0.18 0.14 -0.82 1.57 -1.16 0.00 0.00 179.01 178.56 2yrq h LYS 164 N 0.22 0.61 0.12 2.33 5.09 -1.42 -2.59 116.57 120.93 2yrq h LYS 164 Ca 0.22 -0.62 -0.01 0.00 0.09 0.00 0.00 60.65 60.33 2yrq h LYS 164 Cb 0.57 0.17 0.00 0.00 0.10 0.00 0.00 32.23 33.06 2yrq h LYS 164 CO -0.04 1.23 -0.06 -0.44 -2.09 0.00 0.00 179.45 178.05 2yrq h ASP 165 N 0.24 -0.13 0.20 7.07 3.32 -1.27 -2.82 116.42 123.02 2yrq h ASP 165 Ca -0.09 -0.25 -0.01 0.00 0.02 0.00 0.00 57.03 56.70 2yrq h ASP 165 Cb 1.49 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 41.08 2yrq h ASP 165 CO 0.16 0.18 -0.03 -0.29 -1.72 0.00 0.00 179.24 177.55 2yrq h ILE 166 N -0.46 0.24 -0.56 0.35 2.10 -1.03 -2.00 117.51 116.15 2yrq h ILE 166 Ca -0.02 -0.17 -0.01 0.00 1.08 0.00 0.00 64.86 65.74 2yrq h ILE 166 Cb 0.37 1.13 -0.03 0.00 -1.09 0.00 0.00 36.82 37.21 2yrq h ILE 166 CO 0.03 0.02 0.32 0.00 -1.08 0.00 0.00 178.15 177.44 2yrq h ALA 167 N 1.97 1.52 0.09 0.18 0.00 -1.19 -2.66 119.26 119.18 2yrq h ALA 167 Ca -0.00 -0.07 -0.29 0.00 0.00 0.00 0.00 54.91 54.54 2yrq h ALA 167 Cb 0.13 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2yrq h ALA 167 CO 0.00 0.41 -1.48 0.00 0.00 0.00 0.00 179.25 178.18 2yrq h ALA 168 N 1.59 0.35 -0.30 0.00 0.00 -1.42 -3.22 119.26 116.26 2yrq h ALA 168 Ca 0.20 -1.13 0.04 0.00 0.00 0.00 0.00 54.91 54.02 2yrq h ALA 168 Cb -0.01 0.25 -0.08 0.00 0.00 0.00 0.00 17.79 17.95 2yrq h ALA 168 CO -0.04 1.21 -0.55 -0.92 0.00 0.00 0.00 179.25 178.96 2yrq h TYR 169 N 0.05 -1.65 -0.72 0.00 3.20 -1.27 -1.22 116.97 115.35 2yrq h TYR 169 Ca -0.22 0.07 -0.07 0.00 3.14 0.00 0.00 58.73 61.66 2yrq h TYR 169 Cb 1.98 0.76 -0.03 0.00 1.54 0.00 0.00 36.73 40.98 2yrq h TYR 169 CO 0.05 -0.51 0.19 0.07 -1.64 0.00 0.00 178.16 176.31 2yrq h ARG 170 N -0.47 1.15 -0.90 1.82 0.11 -1.71 -3.43 114.38 110.95 2yrq h ARG 170 Ca 0.06 -0.27 0.15 0.00 0.10 0.00 0.00 59.98 60.02 2yrq h ARG 170 Cb 0.63 -0.15 -0.22 0.00 1.11 0.00 0.00 29.97 31.34 2yrq h ARG 170 CO -0.53 1.00 -0.02 0.00 0.10 0.00 0.00 179.97 180.53 2yrq s ALA 171 N -5.33 -2.71 0.05 0.08 0.00 -0.55 -5.13 121.76 108.16 2yrq s ALA 171 Ca -0.12 1.82 -0.33 0.00 0.00 0.00 0.00 51.96 53.33 2yrq s ALA 171 Cb 0.15 -2.20 -0.11 0.00 0.00 0.00 0.00 23.12 20.95 2yrq s ALA 171 CO 0.85 -1.24 1.82 0.36 0.00 0.00 0.00 175.76 177.55 2yrq n LYS 172 N 5.35 2.48 0.00 0.00 2.85 -0.69 -4.08 118.16 124.06 2yrq n LYS 172 Ca -0.06 0.90 0.00 0.00 -1.05 0.00 0.00 58.31 58.10 2yrq n LYS 172 Cb 0.52 -2.77 0.00 0.00 -0.65 0.00 0.00 35.03 32.13 2yrq n LYS 172 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76