#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 6.42 -0.27 1.61 0.15 -1.26 -5.09 113.70 115.26 2yrq s SER 2 Ca 0.00 0.42 -0.02 0.00 0.70 0.00 0.00 55.95 57.05 2yrq s SER 2 Cb 0.00 -2.02 0.16 0.00 -1.71 0.00 0.00 66.02 62.45 2yrq s SER 2 CO 0.00 0.17 0.47 -0.44 1.20 0.00 0.00 173.24 174.65 2yrq s SER 3 N -2.23 -0.46 0.00 5.45 0.01 -1.26 -5.16 113.70 110.05 2yrq s SER 3 Ca 0.34 0.47 0.00 0.00 1.31 0.00 0.00 55.95 58.06 2yrq s SER 3 Cb -0.13 1.57 0.00 0.00 0.21 0.00 0.00 66.02 67.67 2yrq s SER 3 CO 0.23 -0.29 0.00 0.61 0.41 0.00 0.00 173.24 174.21 2yrq n GLY 4 N 5.39 3.29 3.20 3.44 0.00 -1.26 -5.17 105.19 114.09 2yrq n GLY 4 Ca -0.02 -1.82 -0.09 0.00 0.00 0.00 0.00 46.02 44.09 2yrq n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yrq s SER 5 N -0.13 0.24 0.01 1.61 1.04 -1.26 -5.08 113.70 110.13 2yrq s SER 5 Ca 0.00 -1.06 -0.02 0.00 0.48 0.00 0.00 55.95 55.35 2yrq s SER 5 Cb 0.00 0.33 -0.01 0.00 0.10 0.00 0.00 66.02 66.44 2yrq s SER 5 CO 0.00 -0.76 1.04 0.28 0.98 0.00 0.00 173.24 174.78 2yrq h SER 6 N 2.80 -0.14 -2.64 7.02 0.02 -2.02 -3.48 113.55 115.11 2yrq h SER 6 Ca -0.34 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 2yrq h SER 6 Cb 1.20 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.80 2yrq h SER 6 CO 0.56 -0.03 0.00 0.61 -1.14 0.00 0.00 176.83 176.84 2yrq n GLY 7 N -1.03 3.90 3.44 -3.77 0.00 -1.26 -4.73 105.19 101.75 2yrq n GLY 7 Ca -0.00 -1.47 -0.32 0.00 0.00 0.00 0.00 46.02 44.22 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 -4.44 2.44 -0.47 1.61 0.00 -1.26 -4.82 119.30 112.37 2yrq s MET 8 Ca 0.00 -0.74 0.03 0.00 0.00 0.00 0.00 55.69 54.98 2yrq s MET 8 Cb 0.00 -2.32 0.14 0.00 0.00 0.00 0.00 34.83 32.65 2yrq s MET 8 CO 0.00 0.60 0.25 0.20 0.00 0.00 0.00 175.02 176.08 2yrq s GLY 9 N -0.69 1.92 0.10 3.16 0.00 -1.26 -4.99 107.32 105.55 2yrq s GLY 9 Ca 0.11 -2.82 -0.35 0.00 0.00 0.00 0.00 44.72 41.66 2yrq s GLY 9 CO 0.00 1.39 1.55 1.70 0.00 0.00 0.00 173.10 177.74 2yrq h LYS 10 N 6.61 -0.78 -2.15 2.90 1.63 -2.08 -3.39 116.57 119.30 2yrq h LYS 10 Ca -0.02 0.05 -0.48 0.00 -0.85 0.00 0.00 60.65 59.35 2yrq h LYS 10 Cb 0.91 0.18 -0.34 0.00 -0.60 0.00 0.00 32.23 32.38 2yrq h LYS 10 CO 0.54 -0.52 -0.82 0.20 -3.45 0.00 0.00 179.45 175.40 2yrq s GLY 11 N -2.17 0.52 0.16 5.01 0.00 -1.26 -5.13 107.32 104.44 2yrq s GLY 11 Ca -0.17 -1.69 0.11 0.00 0.00 0.00 0.00 44.72 42.97 2yrq s GLY 11 CO 0.60 2.45 -0.23 0.99 0.00 0.00 0.00 173.10 176.90 2yrq s ASP 12 N 0.76 3.51 0.00 1.64 1.01 -1.26 -5.01 116.67 117.31 2yrq s ASP 12 Ca 0.25 -0.75 0.15 0.00 0.71 0.00 0.00 52.55 52.90 2yrq s ASP 12 Cb -0.08 -0.31 0.72 0.00 1.01 0.00 0.00 42.92 44.26 2yrq s ASP 12 CO -0.08 0.15 1.41 -0.81 0.21 0.00 0.00 175.17 176.05 2yrq n PRO 13 N 0.59 0.18 -0.00 8.23 -0.04 -1.26 -2.89 135.00 139.81 2yrq n PRO 13 Ca -0.15 0.16 -0.17 0.00 -0.04 0.00 0.00 63.50 63.30 2yrq n PRO 13 Cb 0.54 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.40 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 0.46 -4.23 0.54 1.57 -1.95 -3.46 116.57 109.51 2yrq h LYS 14 Ca 0.00 -0.46 -0.59 0.00 -1.87 0.00 0.00 60.65 57.73 2yrq h LYS 14 Cb 0.15 0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 2yrq h LYS 14 CO 0.00 1.11 0.68 1.17 -0.57 0.00 0.00 179.45 181.84 2yrq n LYS 15 N -4.19 0.00 -2.05 3.15 4.81 -1.14 -4.71 118.16 114.02 2yrq n LYS 15 Ca -0.10 0.00 -0.27 0.00 -0.87 0.00 0.00 58.31 57.07 2yrq n LYS 15 Cb 0.67 -1.06 -0.05 0.00 0.02 0.00 0.00 35.03 34.61 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 3.04 2.55 -0.35 1.64 0.04 -1.26 -4.80 135.00 135.86 2yrq s PRO 16 Ca 0.79 -0.36 0.00 0.00 0.04 0.00 0.00 61.00 61.47 2yrq s PRO 16 Cb -1.06 -5.08 0.31 0.00 0.04 0.00 0.00 34.50 28.71 2yrq s PRO 16 CO 0.53 -3.42 1.85 2.89 0.04 0.00 0.00 177.00 178.89 2yrq n ARG 17 N 8.81 1.90 -3.58 4.56 1.85 -1.26 -4.87 116.66 124.07 2yrq n ARG 17 Ca 0.41 -1.87 -0.09 0.00 -1.00 0.00 0.00 57.85 55.30 2yrq n ARG 17 Cb 0.47 -1.73 -0.04 0.00 -1.05 0.00 0.00 32.46 30.10 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 -0.28 -0.24 0.60 2.89 0.00 -1.26 -5.18 107.32 103.85 2yrq s GLY 18 Ca 0.36 2.01 0.02 0.00 0.00 0.00 0.00 44.72 47.12 2yrq s GLY 18 CO 0.02 0.94 0.84 0.54 0.00 0.00 0.00 173.10 175.44 2yrq s LYS 19 N -1.37 2.22 0.39 2.90 3.01 -1.26 -5.04 119.74 120.59 2yrq s LYS 19 Ca 0.01 -1.08 0.02 0.00 -1.01 0.00 0.00 55.97 53.91 2yrq s LYS 19 Cb -0.01 -2.48 -0.02 0.00 -1.01 0.00 0.00 37.83 34.32 2yrq s LYS 19 CO -0.01 -0.96 0.58 -1.64 0.51 0.00 0.00 175.35 173.83 2yrq s MET 20 N -4.85 3.24 0.35 1.68 -1.94 -1.26 -5.11 119.30 111.41 2yrq s MET 20 Ca 0.61 -0.52 0.02 0.00 -1.71 0.00 0.00 55.69 54.09 2yrq s MET 20 Cb -0.08 -2.65 0.06 0.00 2.01 0.00 0.00 34.83 34.18 2yrq s MET 20 CO 0.40 -0.04 0.48 0.45 -0.01 0.00 0.00 175.02 176.30 2yrq n SER 21 N -1.88 0.92 0.05 3.03 2.88 -1.26 -4.88 113.62 112.48 2yrq n SER 21 Ca -0.02 -1.71 -0.11 0.00 -1.33 0.00 0.00 58.87 55.70 2yrq n SER 21 Cb 0.57 -0.29 -0.04 0.00 -0.75 0.00 0.00 64.21 63.70 2yrq n SER 21 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2yrq h SER 22 N -0.14 -0.64 0.69 -3.46 0.02 -1.93 -1.61 113.55 106.48 2yrq h SER 22 Ca -0.16 0.09 -0.03 0.00 -0.84 0.00 0.00 61.79 60.85 2yrq h SER 22 Cb 0.66 0.27 0.01 0.00 0.14 0.00 0.00 62.40 63.47 2yrq h SER 22 CO 0.20 -0.28 -0.33 0.22 -1.14 0.00 0.00 176.83 175.49 2yrq h TYR 23 N -0.34 -0.86 -1.28 3.45 3.20 -1.95 0.42 116.97 119.61 2yrq h TYR 23 Ca 0.06 -0.02 0.46 0.00 3.14 0.00 0.00 58.73 62.37 2yrq h TYR 23 Cb 0.42 0.29 -0.15 0.00 1.54 0.00 0.00 36.73 38.83 2yrq h TYR 23 CO -0.27 -0.54 0.80 0.00 -1.64 0.00 0.00 178.16 176.51 2yrq n ALA 24 N -2.49 1.28 0.09 1.82 0.00 -1.19 0.10 120.51 120.12 2yrq n ALA 24 Ca -0.12 0.89 -0.23 0.00 0.00 0.00 0.00 53.44 53.98 2yrq n ALA 24 Cb 0.37 -1.04 -0.15 0.00 0.00 0.00 0.00 19.45 18.63 2yrq n ALA 24 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2yrq h PHE 25 N 0.00 0.78 -0.34 0.00 0.04 -1.00 -3.31 116.94 113.11 2yrq h PHE 25 Ca 0.86 -0.57 0.01 0.00 2.80 0.00 0.00 57.97 61.08 2yrq h PHE 25 Cb 2.67 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 40.78 2yrq h PHE 25 CO -0.01 1.60 0.23 0.35 -0.60 0.00 0.00 178.31 179.88 2yrq h PHE 26 N 0.04 0.39 0.00 -0.55 3.57 0.53 -0.10 116.94 120.82 2yrq h PHE 26 Ca -0.30 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.15 2yrq h PHE 26 Cb 2.06 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 40.66 2yrq h PHE 26 CO 0.12 0.24 -0.32 0.28 -2.23 0.00 0.00 178.31 176.40 2yrq h VAL 27 N 0.41 1.01 0.00 1.41 2.07 -0.74 -2.08 116.25 118.33 2yrq h VAL 27 Ca 0.13 -1.21 0.00 0.00 0.82 0.00 0.00 66.70 66.44 2yrq h VAL 27 Cb 0.02 1.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 2yrq h VAL 27 CO -0.03 0.32 -1.00 1.67 0.02 0.00 0.00 177.57 178.55 2yrq n GLN 28 N -3.83 0.45 0.06 1.57 7.27 -0.31 -3.10 117.38 119.50 2yrq n GLN 28 Ca -0.01 0.06 -0.12 0.00 0.07 0.00 0.00 57.00 56.99 2yrq n GLN 28 Cb 0.40 -1.71 -0.13 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 1.40 0.06 1.69 2.02 -0.71 -2.94 112.91 114.44 2yrq h THR 29 Ca 0.00 -3.08 -0.28 0.00 0.77 0.00 0.00 66.41 63.83 2yrq h THR 29 Cb 0.87 2.79 -0.02 0.00 -1.74 0.00 0.00 68.15 70.05 2yrq h THR 29 CO 0.00 0.85 -1.41 0.00 0.37 0.00 0.00 175.52 175.33 2yrq h ARG 31 N 0.04 0.74 -0.07 0.00 0.11 -1.66 -2.59 114.38 110.94 2yrq h ARG 31 Ca -0.18 -0.42 -0.13 0.00 0.10 0.00 0.00 59.98 59.34 2yrq h ARG 31 Cb 1.95 0.03 0.01 0.00 1.11 0.00 0.00 29.97 33.06 2yrq h ARG 31 CO 0.14 1.04 -0.47 0.93 0.10 0.00 0.00 179.97 181.71 2yrq h GLU 32 N 0.58 0.45 -0.50 0.08 4.39 -1.63 -3.20 114.58 114.74 2yrq h GLU 32 Ca 0.03 -0.38 0.05 0.00 0.34 0.00 0.00 59.36 59.39 2yrq h GLU 32 Cb 1.03 0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.74 2yrq h GLU 32 CO 0.10 1.02 0.34 0.93 -1.16 0.00 0.00 179.01 180.24 2yrq h GLU 33 N -0.00 0.49 0.29 2.33 4.39 -1.53 -3.01 114.58 117.54 2yrq h GLU 33 Ca -0.04 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 2yrq h GLU 33 Cb 1.13 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.67 2yrq h GLU 33 CO 0.10 0.32 -0.17 1.25 -1.16 0.00 0.00 179.01 179.35 2yrq h HIS 34 N 0.50 -0.45 -1.67 4.33 2.76 -1.46 -0.78 115.15 118.39 2yrq h HIS 34 Ca 0.21 -0.01 0.49 0.00 -2.20 0.00 0.00 60.37 58.86 2yrq h HIS 34 Cb 0.21 0.16 -0.07 0.00 1.55 0.00 0.00 27.41 29.25 2yrq h HIS 34 CO -0.00 -0.26 1.19 0.87 -1.30 0.00 0.00 177.93 178.44 2yrq h LYS 35 N -0.43 0.01 -0.02 5.26 6.56 -1.57 0.59 116.57 126.97 2yrq h LYS 35 Ca -0.04 -0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.52 2yrq h LYS 35 Cb 0.34 -0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.00 2yrq h LYS 35 CO 0.05 0.01 -0.11 0.87 -2.06 0.00 0.00 179.45 178.20 2yrq h LYS 36 N 0.01 0.10 -0.69 3.15 1.57 -1.31 -2.77 116.57 116.63 2yrq h LYS 36 Ca 0.80 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 59.46 2yrq h LYS 36 Cb 3.18 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 35.48 2yrq h LYS 36 CO -0.03 0.78 0.31 0.87 -0.57 0.00 0.00 179.45 180.80 2yrq h LYS 37 N -0.54 1.01 -3.07 3.15 1.79 0.15 -3.38 116.57 115.69 2yrq h LYS 37 Ca -0.01 -0.17 -0.58 0.00 -2.18 0.00 0.00 60.65 57.71 2yrq h LYS 37 Cb 0.80 -0.17 -0.40 0.00 -1.58 0.00 0.00 32.23 30.88 2yrq h LYS 37 CO 0.02 0.82 -0.77 -1.01 -1.08 0.00 0.00 179.45 177.43 2yrq s HIS 38 N -5.63 1.41 0.22 -1.35 3.76 0.13 -4.99 115.29 108.84 2yrq s HIS 38 Ca -0.13 -1.82 -0.02 0.00 -0.15 0.00 0.00 55.06 52.94 2yrq s HIS 38 Cb 0.14 -1.49 0.19 0.00 1.11 0.00 0.00 32.58 32.53 2yrq s HIS 38 CO 0.81 -0.83 1.58 -1.00 -0.85 0.00 0.00 174.74 174.44 2yrq h PRO 39 N 7.47 0.57 -0.12 8.40 0.13 -1.68 -3.10 132.00 143.67 2yrq h PRO 39 Ca -0.06 -0.30 -0.15 0.00 -0.87 0.00 0.00 66.00 64.62 2yrq h PRO 39 Cb 0.98 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 2yrq h PRO 39 CO 0.42 0.89 -0.58 -0.44 -0.23 0.00 0.00 178.00 178.06 2yrq h ASP 40 N 0.47 0.42 -2.85 1.44 3.32 -1.94 -3.43 116.42 113.85 2yrq h ASP 40 Ca 0.04 -0.23 -0.56 0.00 0.02 0.00 0.00 57.03 56.29 2yrq h ASP 40 Cb 0.93 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.33 2yrq h ASP 40 CO 0.08 0.91 0.98 0.00 -1.72 0.00 0.00 179.24 179.49 2yrq s ALA 41 N -3.86 3.57 -0.62 3.45 0.00 -1.17 -4.98 121.76 118.16 2yrq s ALA 41 Ca -0.05 0.53 -0.12 0.00 0.00 0.00 0.00 51.96 52.31 2yrq s ALA 41 Cb 0.12 -3.69 0.16 0.00 0.00 0.00 0.00 23.12 19.70 2yrq s ALA 41 CO 0.82 -1.39 0.53 0.45 0.00 0.00 0.00 175.76 176.17 2yrq s SER 42 N 2.65 6.15 0.18 0.00 0.15 -1.26 -4.86 113.70 116.70 2yrq s SER 42 Ca 0.61 -2.19 -0.22 0.00 0.70 0.00 0.00 55.95 54.85 2yrq s SER 42 Cb -0.24 -2.13 -0.08 0.00 -1.71 0.00 0.00 66.02 61.86 2yrq s SER 42 CO 0.21 -0.69 0.72 0.54 1.20 0.00 0.00 173.24 175.22 2yrq s VAL 43 N 0.95 4.52 0.48 4.45 0.11 -1.26 -5.06 120.40 124.60 2yrq s VAL 43 Ca 0.09 1.43 -0.18 0.00 -2.93 0.00 0.00 61.98 60.39 2yrq s VAL 43 Cb -0.22 -3.97 -0.09 0.00 -1.53 0.00 0.00 36.38 30.57 2yrq s VAL 43 CO -0.02 0.38 0.97 0.20 -3.33 0.00 0.00 175.10 173.30 2yrq s ASN 44 N -1.37 6.75 -0.03 3.54 0.01 -1.26 -4.99 114.94 117.59 2yrq s ASN 44 Ca 0.38 1.62 -0.19 0.00 -0.71 0.00 0.00 52.86 53.95 2yrq s ASN 44 Cb -0.20 -2.52 -0.12 0.00 0.41 0.00 0.00 41.25 38.82 2yrq s ASN 44 CO 0.23 -0.49 0.83 0.15 -1.51 0.00 0.00 177.10 176.30 2yrq h PHE 45 N 1.33 -0.44 -0.26 2.20 3.57 -1.98 -2.06 116.94 119.30 2yrq h PHE 45 Ca -0.48 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.08 2yrq h PHE 45 Cb 1.18 0.15 -0.07 0.00 2.79 0.00 0.00 35.95 39.99 2yrq h PHE 45 CO 0.63 -0.14 -0.27 1.03 -2.23 0.00 0.00 178.31 177.33 2yrq h SER 46 N -1.02 -0.86 -1.01 0.41 0.87 -2.00 0.27 113.55 110.22 2yrq h SER 46 Ca -0.05 0.15 0.07 0.00 -1.23 0.00 0.00 61.79 60.73 2yrq h SER 46 Cb 0.49 0.40 -0.07 0.00 -0.44 0.00 0.00 62.40 62.78 2yrq h SER 46 CO 0.08 -0.30 0.65 -0.33 -0.53 0.00 0.00 176.83 176.40 2yrq h GLU 47 N -0.27 1.14 -0.27 2.24 4.39 -1.98 -1.32 114.58 118.50 2yrq h GLU 47 Ca 0.14 -0.07 -0.10 0.00 0.34 0.00 0.00 59.36 59.67 2yrq h GLU 47 Cb 0.49 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 2yrq h GLU 47 CO -0.42 0.75 -0.25 0.35 -1.16 0.00 0.00 179.01 178.28 2yrq h PHE 48 N 1.17 0.59 0.27 4.33 3.57 -0.39 -3.10 116.94 123.38 2yrq h PHE 48 Ca 0.44 -0.13 0.01 0.00 3.53 0.00 0.00 57.97 61.82 2yrq h PHE 48 Cb 0.19 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.75 2yrq h PHE 48 CO -0.00 0.73 -0.46 0.66 -2.23 0.00 0.00 178.31 177.01 2yrq h SER 49 N 0.46 -1.32 0.00 0.41 4.64 0.67 0.48 113.55 118.90 2yrq h SER 49 Ca 0.07 0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2yrq h SER 49 Cb 0.68 0.47 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2yrq h SER 49 CO 0.05 -0.56 0.07 0.07 -0.87 0.00 0.00 176.83 175.59 2yrq h LYS 50 N -0.80 0.00 0.00 4.77 2.10 -1.54 0.13 116.57 121.23 2yrq h LYS 50 Ca -0.01 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.48 2yrq h LYS 50 Cb 0.76 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.06 2yrq h LYS 50 CO -0.17 0.00 -0.83 -0.22 -2.00 0.00 0.00 179.45 176.23 2yrq h LYS 51 N 0.00 0.00 0.00 0.07 3.64 -0.90 -3.21 116.57 116.17 2yrq h LYS 51 Ca 0.00 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.24 2yrq h LYS 51 Cb 0.15 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 2yrq h LYS 51 CO 0.00 0.63 -0.68 0.00 -2.27 0.00 0.00 179.45 177.13 2yrq h SER 53 N 0.00 0.08 1.20 0.00 0.87 -1.52 0.02 113.55 114.20 2yrq h SER 53 Ca -0.01 -0.53 0.00 0.00 -1.23 0.00 0.00 61.79 60.02 2yrq h SER 53 Cb 1.51 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.45 2yrq h SER 53 CO 0.09 0.60 0.00 -1.84 -0.53 0.00 0.00 176.83 175.15 2yrq n GLU 54 N -4.77 0.23 -0.01 2.24 0.28 -1.21 -2.63 120.64 114.78 2yrq n GLU 54 Ca -0.08 0.29 -0.06 0.00 -0.16 0.00 0.00 57.16 57.14 2yrq n GLU 54 Cb 0.30 -1.82 -0.13 0.00 1.43 0.00 0.00 31.44 31.22 2yrq n GLU 54 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2yrq n ARG 55 N -2.24 0.63 0.09 3.44 1.74 -0.95 -3.26 116.66 116.11 2yrq n ARG 55 Ca 0.04 0.27 -0.20 0.00 -0.77 0.00 0.00 57.85 57.20 2yrq n ARG 55 Cb 0.36 -1.79 -0.11 0.00 -1.02 0.00 0.00 32.46 29.89 2yrq n ARG 55 CO 0.00 0.00 0.00 2.35 -1.52 0.00 0.00 177.63 178.46 2yrq h TRP 56 N 0.00 0.89 -0.35 -1.55 2.91 -0.91 -2.67 115.95 114.27 2yrq h TRP 56 Ca -0.26 -0.55 -0.17 0.00 1.13 0.00 0.00 58.89 59.05 2yrq h TRP 56 Cb 1.91 -0.07 -0.00 0.00 -0.51 0.00 0.00 29.16 30.48 2yrq h TRP 56 CO 0.00 1.39 -0.44 1.57 -1.03 0.00 0.00 178.44 179.93 2yrq h LYS 57 N 0.25 0.90 -0.56 2.65 2.10 -1.67 -3.17 116.57 117.08 2yrq h LYS 57 Ca -0.16 -0.50 -0.10 0.00 -2.00 0.00 0.00 60.65 57.88 2yrq h LYS 57 Cb 1.85 0.03 -0.02 0.00 -0.90 0.00 0.00 32.23 33.19 2yrq h LYS 57 CO 0.22 1.15 -0.05 0.00 -2.00 0.00 0.00 179.45 178.77 2yrq h THR 58 N 0.72 1.27 -1.14 0.07 1.03 -1.63 -3.43 112.91 109.81 2yrq h THR 58 Ca 0.05 -1.20 -0.67 0.00 -0.01 0.00 0.00 66.41 64.58 2yrq h THR 58 Cb 1.03 0.90 -0.02 0.00 -1.07 0.00 0.00 68.15 69.00 2yrq h THR 58 CO 0.10 0.43 1.41 0.23 -0.01 0.00 0.00 175.52 177.68 2yrq n MET 59 N -4.19 1.12 -0.65 0.00 2.81 -1.01 -4.90 117.12 110.30 2yrq n MET 59 Ca 0.02 0.31 -0.22 0.00 -1.81 0.00 0.00 57.70 56.00 2yrq n MET 59 Cb 0.37 -2.48 0.12 0.00 -0.71 0.00 0.00 33.22 30.51 2yrq n MET 59 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 2yrq n SER 60 N 9.79 -2.75 0.24 7.83 7.64 -1.26 -4.62 113.62 130.49 2yrq n SER 60 Ca 0.40 -0.23 0.08 0.00 1.01 0.00 0.00 58.87 60.13 2yrq n SER 60 Cb 0.24 -0.73 0.58 0.00 -1.01 0.00 0.00 64.21 63.29 2yrq n SER 60 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2yrq h ALA 61 N -2.23 1.51 0.32 -0.43 0.00 -1.95 -2.94 119.26 113.54 2yrq h ALA 61 Ca -0.30 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 2yrq h ALA 61 Cb 0.89 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2yrq h ALA 61 CO 0.19 0.21 -0.15 -0.22 0.00 0.00 0.00 179.25 179.28 2yrq h LYS 62 N 0.00 -0.41 -0.94 0.00 1.63 -2.00 -2.21 116.57 112.63 2yrq h LYS 62 Ca -0.00 0.03 0.27 0.00 -0.85 0.00 0.00 60.65 60.10 2yrq h LYS 62 Cb 0.35 0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 32.03 2yrq h LYS 62 CO 0.02 -0.10 0.69 0.93 -3.45 0.00 0.00 179.45 177.55 2yrq h GLU 63 N -0.95 0.00 0.00 1.90 4.39 -1.84 0.66 114.58 118.73 2yrq h GLU 63 Ca -0.04 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.47 2yrq h GLU 63 Cb 0.51 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.13 2yrq h GLU 63 CO 0.07 0.00 -0.90 0.87 -1.16 0.00 0.00 179.01 177.89 2yrq h LYS 64 N 0.00 0.00 -0.94 2.33 1.57 -1.47 -3.35 116.57 114.71 2yrq h LYS 64 Ca 0.45 0.00 0.14 0.00 -1.87 0.00 0.00 60.65 59.37 2yrq h LYS 64 Cb 1.83 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.99 2yrq h LYS 64 CO -0.00 0.88 -0.42 0.78 -0.57 0.00 0.00 179.45 180.11 2yrq h GLY 65 N 3.12 -0.11 0.57 3.86 0.00 0.99 0.97 103.07 112.49 2yrq h GLY 65 Ca -0.01 0.56 0.14 0.00 0.00 0.00 0.00 47.33 48.02 2yrq h GLY 65 CO 0.11 -0.16 0.56 0.07 0.00 0.00 0.00 176.54 177.12 2yrq h LYS 66 N -0.03 0.63 0.00 4.80 2.10 -1.70 1.00 116.57 123.37 2yrq h LYS 66 Ca 0.30 -0.04 -0.15 0.00 -2.00 0.00 0.00 60.65 58.76 2yrq h LYS 66 Cb 0.56 -0.14 -0.02 0.00 -0.90 0.00 0.00 32.23 31.73 2yrq h LYS 66 CO -0.94 0.42 -0.73 0.74 -2.00 0.00 0.00 179.45 176.93 2yrq h PHE 67 N 0.65 0.00 -0.01 0.07 0.04 0.45 -2.15 116.94 115.99 2yrq h PHE 67 Ca 0.43 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 61.07 2yrq h PHE 67 Cb 0.72 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.85 2yrq h PHE 67 CO -0.00 0.73 -0.61 0.93 -0.60 0.00 0.00 178.31 178.76 2yrq h GLU 68 N 0.00 0.04 0.15 1.51 4.39 0.25 -2.34 114.58 118.57 2yrq h GLU 68 Ca -0.01 -0.03 -0.28 0.00 0.34 0.00 0.00 59.36 59.38 2yrq h GLU 68 Cb 1.48 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.14 2yrq h GLU 68 CO 0.10 0.64 -1.40 0.22 -1.16 0.00 0.00 179.01 177.40 2yrq h ASP 69 N 0.03 0.48 0.21 1.42 3.58 -1.16 -3.30 116.42 117.67 2yrq h ASP 69 Ca -0.01 -0.89 -0.02 0.00 0.42 0.00 0.00 57.03 56.53 2yrq h ASP 69 Cb 1.09 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 41.98 2yrq h ASP 69 CO 0.08 1.63 -0.12 0.00 -2.88 0.00 0.00 179.24 177.95 2yrq h MET 70 N -0.19 0.00 -0.21 0.28 -0.00 -1.43 -2.65 114.93 110.73 2yrq h MET 70 Ca -0.29 0.00 -0.05 0.00 -0.00 0.00 0.00 59.70 59.36 2yrq h MET 70 Cb 1.85 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 33.44 2yrq h MET 70 CO 0.11 0.12 -0.08 0.00 -0.00 0.00 0.00 176.91 177.06 2yrq h ALA 71 N 1.88 0.30 -0.03 -3.00 0.00 -1.52 -1.13 119.26 115.76 2yrq h ALA 71 Ca -0.00 -0.28 0.03 0.00 0.00 0.00 0.00 54.91 54.66 2yrq h ALA 71 Cb 0.25 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 2yrq h ALA 71 CO 0.02 0.11 -0.22 0.87 0.00 0.00 0.00 179.25 180.02 2yrq h LYS 72 N 0.14 -0.32 -0.44 0.00 1.57 -1.55 -2.00 116.57 113.97 2yrq h LYS 72 Ca 0.05 0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 2yrq h LYS 72 Cb 0.56 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.92 2yrq h LYS 72 CO 0.03 -0.22 0.05 0.00 -0.57 0.00 0.00 179.45 178.74 2yrq h ALA 73 N 0.56 1.26 0.00 3.86 0.00 -1.57 -2.06 119.26 121.30 2yrq h ALA 73 Ca 0.07 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2yrq h ALA 73 Cb 0.43 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2yrq h ALA 73 CO -0.22 0.51 0.21 -0.25 0.00 0.00 0.00 179.25 179.49 2yrq n ASP 74 N -4.26 0.41 0.31 0.00 8.00 -0.43 -0.74 116.55 119.83 2yrq n ASP 74 Ca 0.03 0.62 0.21 0.00 0.71 0.00 0.00 54.79 56.35 2yrq n ASP 74 Cb 0.25 -0.60 1.06 0.00 -0.02 0.00 0.00 41.12 41.81 2yrq n ASP 74 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2yrq h LYS 75 N 0.00 0.00 0.00 -1.24 1.57 -1.26 -0.99 116.57 114.66 2yrq h LYS 75 Ca 0.00 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 2yrq h LYS 75 Cb 0.43 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.71 2yrq h LYS 75 CO 0.00 0.00 -1.59 0.00 -0.57 0.00 0.00 179.45 177.29 2yrq n ALA 76 N -2.04 1.78 0.23 3.86 0.00 0.08 -4.58 120.51 119.84 2yrq n ALA 76 Ca -0.02 -0.47 0.07 0.00 0.00 0.00 0.00 53.44 53.02 2yrq n ALA 76 Cb 0.10 0.22 0.56 0.00 0.00 0.00 0.00 19.45 20.32 2yrq n ALA 76 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2yrq h ARG 77 N 0.00 0.00 -0.95 0.00 -0.00 -1.44 -2.47 114.38 109.52 2yrq h ARG 77 Ca -0.23 0.00 0.25 0.00 -0.00 0.00 0.00 59.98 60.00 2yrq h ARG 77 Cb 1.40 0.00 -0.06 0.00 -0.00 0.00 0.00 29.97 31.31 2yrq h ARG 77 CO -0.02 0.16 0.65 0.10 -0.00 0.00 0.00 179.97 180.86 2yrq h TYR 78 N 0.00 0.31 -1.14 4.08 -0.00 -1.43 -0.21 116.97 118.59 2yrq h TYR 78 Ca -0.00 0.01 0.36 0.00 -0.00 0.00 0.00 58.73 59.10 2yrq h TYR 78 Cb 0.30 -0.09 -0.13 0.00 -0.00 0.00 0.00 36.73 36.81 2yrq h TYR 78 CO 0.00 0.06 0.70 0.93 -0.00 0.00 0.00 178.16 179.85 2yrq h GLU 79 N 0.22 0.22 -1.02 0.10 5.08 -1.72 0.49 114.58 117.95 2yrq h GLU 79 Ca 0.48 -0.01 0.26 0.00 -1.00 0.00 0.00 59.36 59.09 2yrq h GLU 79 Cb 1.53 -0.05 -0.12 0.00 0.50 0.00 0.00 28.75 30.61 2yrq h GLU 79 CO -0.12 0.15 0.62 -0.09 -1.00 0.00 0.00 179.01 178.56 2yrq h ARG 80 N 0.23 0.49 -0.54 2.33 2.43 -1.26 0.25 114.38 118.31 2yrq h ARG 80 Ca 0.74 -0.03 0.11 0.00 -0.81 0.00 0.00 59.98 59.99 2yrq h ARG 80 Cb 2.03 -0.11 -0.10 0.00 -0.42 0.00 0.00 29.97 31.37 2yrq h ARG 80 CO -0.47 0.33 -0.05 0.93 -1.51 0.00 0.00 179.97 179.19 2yrq h GLU 81 N 0.51 0.06 -0.85 0.20 5.08 -0.21 0.17 114.58 119.54 2yrq h GLU 81 Ca 0.65 -0.00 0.19 0.00 -1.00 0.00 0.00 59.36 59.19 2yrq h GLU 81 Cb 1.36 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.53 2yrq h GLU 81 CO -0.45 0.04 0.57 1.98 -1.00 0.00 0.00 179.01 180.15 2yrq h MET 82 N 0.07 0.39 0.31 2.33 4.05 -1.08 -1.19 114.93 119.80 2yrq h MET 82 Ca 0.27 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.67 2yrq h MET 82 Cb 0.42 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.12 2yrq h MET 82 CO -0.50 0.26 -0.31 0.87 0.23 0.00 0.00 176.91 177.45 2yrq h LYS 83 N 0.40 -0.63 -0.19 0.39 1.79 -0.66 -1.35 116.57 116.32 2yrq h LYS 83 Ca 0.44 0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.95 2yrq h LYS 83 Cb 1.08 0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 2yrq h LYS 83 CO -0.15 -0.42 0.00 -2.37 -1.08 0.00 0.00 179.45 175.43 2yrq n THR 84 N -5.43 0.16 -0.88 -0.16 5.66 -0.71 -4.95 114.28 107.97 2yrq n THR 84 Ca -0.09 -0.14 -0.32 0.00 -3.05 0.00 0.00 64.05 60.45 2yrq n THR 84 Cb 0.33 0.01 -0.03 0.00 -1.55 0.00 0.00 70.33 69.09 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 -0.18 -0.01 -4.02 1.09 4.19 -0.51 -4.93 117.16 112.79 2yrq n TYR 85 Ca 0.03 0.62 -0.31 0.00 3.31 0.00 0.00 57.90 61.55 2yrq n TYR 85 Cb 0.12 -1.23 -0.16 0.00 0.49 0.00 0.00 39.34 38.56 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 -0.36 1.78 1.01 2.97 1.01 -1.26 -5.02 121.20 121.33 2yrq s ILE 86 Ca 0.46 -1.11 -0.12 0.00 0.00 0.00 0.00 60.65 59.87 2yrq s ILE 86 Cb -0.66 -1.83 0.20 0.00 0.01 0.00 0.00 42.46 40.18 2yrq s ILE 86 CO 0.35 0.17 1.09 -2.16 0.00 0.00 0.00 174.94 174.39 2yrq s PRO 87 N 1.33 0.33 1.21 2.79 0.04 -1.26 -4.97 135.00 134.47 2yrq s PRO 87 Ca -0.02 0.49 -0.20 0.00 0.04 0.00 0.00 61.00 61.31 2yrq s PRO 87 Cb -0.17 -1.73 0.29 0.00 0.04 0.00 0.00 34.50 32.94 2yrq s PRO 87 CO -0.08 -2.79 1.11 -1.25 0.04 0.00 0.00 177.00 174.03 2yrq s PRO 88 N -4.97 -1.30 -1.11 0.56 0.04 -1.26 -4.42 135.00 122.53 2yrq s PRO 88 Ca 0.66 -0.10 -0.01 0.00 0.04 0.00 0.00 61.00 61.59 2yrq s PRO 88 Cb -0.19 -1.59 -0.01 0.00 0.04 0.00 0.00 34.50 32.75 2yrq s PRO 88 CO 0.58 -3.76 0.94 1.17 0.04 0.00 0.00 177.00 175.97 2yrq n LYS 89 N -4.79 -5.45 0.00 4.56 0.00 -1.26 -4.94 118.16 106.28 2yrq n LYS 89 Ca 0.14 0.81 0.00 0.00 0.00 0.00 0.00 58.31 59.26 2yrq n LYS 89 Cb 0.60 -5.70 0.00 0.00 0.00 0.00 0.00 35.03 29.93 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 -1.15 2.19 0.00 3.14 0.00 -1.26 -5.03 105.19 103.08 2yrq n GLY 90 Ca -0.23 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 0.00 1.14 -4.09 1.61 1.02 -1.26 -4.99 120.64 114.06 2yrq n GLU 91 Ca 0.00 -0.90 -0.32 0.00 -0.02 0.00 0.00 57.16 55.92 2yrq n GLU 91 Cb 0.00 -0.84 -0.15 0.00 -0.02 0.00 0.00 31.44 30.43 2yrq n GLU 91 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2yrq s THR 92 N -0.45 2.12 1.13 2.62 2.01 -1.26 -5.12 115.64 116.69 2yrq s THR 92 Ca 0.00 -1.35 -0.13 0.00 0.31 0.00 0.00 61.69 60.52 2yrq s THR 92 Cb 0.00 -2.10 0.26 0.00 0.01 0.00 0.00 72.50 70.67 2yrq s THR 92 CO 0.00 0.21 1.04 -1.59 -0.69 0.00 0.00 174.62 173.59 2yrq s LYS 93 N 1.18 -0.65 0.34 4.92 0.00 -1.26 -4.69 119.74 119.58 2yrq s LYS 93 Ca -0.03 0.67 0.06 0.00 0.00 0.00 0.00 55.97 56.67 2yrq s LYS 93 Cb -0.17 -1.60 -0.07 0.00 0.00 0.00 0.00 37.83 35.99 2yrq s LYS 93 CO -0.08 -3.50 0.00 -1.59 0.00 0.00 0.00 175.35 170.18 2yrq s LYS 94 N -4.64 1.75 0.14 1.78 0.00 -1.26 -5.06 119.74 112.45 2yrq s LYS 94 Ca 0.68 -1.95 0.11 0.00 0.00 0.00 0.00 55.97 54.80 2yrq s LYS 94 Cb -0.23 -1.26 -0.04 0.00 0.00 0.00 0.00 37.83 36.30 2yrq s LYS 94 CO 0.62 -0.06 -0.25 0.21 0.00 0.00 0.00 175.35 175.87 2yrq s LYS 95 N -3.77 1.37 -0.32 1.78 2.47 -1.26 -5.11 119.74 114.89 2yrq s LYS 95 Ca 0.34 -1.35 -0.16 0.00 -1.56 0.00 0.00 55.97 53.24 2yrq s LYS 95 Cb 0.07 -1.79 -0.02 0.00 -1.46 0.00 0.00 37.83 34.64 2yrq s LYS 95 CO 0.16 0.42 0.42 -0.06 0.16 0.00 0.00 175.35 176.45 2yrq s PHE 96 N -1.19 3.21 0.22 4.03 0.40 -1.26 -4.98 117.98 118.41 2yrq s PHE 96 Ca 0.14 0.18 0.11 0.00 -0.60 0.00 0.00 56.93 56.75 2yrq s PHE 96 Cb -0.10 -2.74 -0.05 0.00 0.51 0.00 0.00 43.02 40.65 2yrq s PHE 96 CO 0.06 -0.41 -0.18 0.21 0.70 0.00 0.00 175.22 175.60 2yrq s LYS 97 N 2.17 1.75 -0.83 0.44 2.36 -1.26 -5.09 119.74 119.28 2yrq s LYS 97 Ca 0.15 -1.52 -0.05 0.00 -2.55 0.00 0.00 55.97 52.00 2yrq s LYS 97 Cb -0.16 -1.93 0.21 0.00 -1.05 0.00 0.00 37.83 34.90 2yrq s LYS 97 CO 0.12 0.39 0.72 -0.51 1.55 0.00 0.00 175.35 177.61 2yrq s ASP 98 N -3.01 6.06 0.28 1.43 1.01 -1.26 -4.89 116.67 116.29 2yrq s ASP 98 Ca 0.25 -3.28 0.06 0.00 0.71 0.00 0.00 52.55 50.29 2yrq s ASP 98 Cb -0.07 -1.98 0.40 0.00 1.01 0.00 0.00 42.92 42.27 2yrq s ASP 98 CO 0.13 -0.32 1.66 1.55 0.21 0.00 0.00 175.17 178.41 2yrq h PRO 99 N 6.69 0.25 -1.57 8.23 0.13 -2.01 -3.11 132.00 140.60 2yrq h PRO 99 Ca 0.10 -0.13 0.46 0.00 -0.87 0.00 0.00 66.00 65.57 2yrq h PRO 99 Cb 0.90 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.96 2yrq h PRO 99 CO 0.81 0.66 1.11 -0.91 -0.23 0.00 0.00 178.00 179.44 2yrq h ASN 100 N 0.20 0.06 -3.02 1.44 4.21 -2.04 -3.39 115.58 113.04 2yrq h ASN 100 Ca 0.01 0.03 -0.53 0.00 1.21 0.00 0.00 56.30 57.02 2yrq h ASN 100 Cb 0.89 0.02 0.06 0.00 -1.12 0.00 0.00 38.32 38.17 2yrq h ASN 100 CO 0.07 -0.03 0.87 0.00 -1.29 0.00 0.00 177.43 177.06 2yrq s ALA 101 N -4.99 3.76 1.14 -0.83 0.00 -1.18 -4.99 121.76 114.67 2yrq s ALA 101 Ca -0.06 1.43 -0.11 0.00 0.00 0.00 0.00 51.96 53.22 2yrq s ALA 101 Cb 0.26 -3.62 0.16 0.00 0.00 0.00 0.00 23.12 19.92 2yrq s ALA 101 CO 0.85 -0.83 0.59 -0.35 0.00 0.00 0.00 175.76 176.02 2yrq n PRO 102 N 3.27 -2.17 -4.22 0.00 -0.04 -1.26 -5.09 135.00 125.48 2yrq n PRO 102 Ca 0.11 -0.94 -0.14 0.00 -0.04 0.00 0.00 63.50 62.49 2yrq n PRO 102 Cb 0.38 -0.88 -0.10 0.00 -0.04 0.00 0.00 33.50 32.86 2yrq n PRO 102 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 2yrq s LYS 103 N -4.34 0.98 0.07 0.54 0.00 -1.26 -5.07 119.74 110.67 2yrq s LYS 103 Ca 0.38 -1.34 -0.30 0.00 0.00 0.00 0.00 55.97 54.71 2yrq s LYS 103 Cb -0.04 -0.60 -0.06 0.00 0.00 0.00 0.00 37.83 37.13 2yrq s LYS 103 CO 0.29 0.08 1.16 -0.98 0.00 0.00 0.00 175.35 175.90 2yrq s ARG 104 N -3.37 4.47 0.88 1.78 1.70 -1.26 -4.95 118.95 118.20 2yrq s ARG 104 Ca 0.12 1.72 -0.11 0.00 -0.47 0.00 0.00 55.73 56.99 2yrq s ARG 104 Cb 0.00 -3.35 0.12 0.00 -0.57 0.00 0.00 34.95 31.15 2yrq s ARG 104 CO 0.00 -0.18 1.09 -1.25 -1.08 0.00 0.00 175.30 173.88 2yrq s PRO 105 N 0.84 1.42 1.01 3.89 0.04 -1.26 -5.04 135.00 135.90 2yrq s PRO 105 Ca 0.56 0.87 -0.13 0.00 0.04 0.00 0.00 61.00 62.35 2yrq s PRO 105 Cb -0.28 -1.82 0.20 0.00 0.04 0.00 0.00 34.50 32.63 2yrq s PRO 105 CO 0.30 -2.14 1.09 -1.25 0.04 0.00 0.00 177.00 175.04 2yrq s PRO 106 N -4.93 0.30 0.19 0.56 0.04 -1.26 -5.03 135.00 124.87 2yrq s PRO 106 Ca 0.63 0.48 0.11 0.00 0.04 0.00 0.00 61.00 62.26 2yrq s PRO 106 Cb -0.18 -1.73 -0.04 0.00 0.04 0.00 0.00 34.50 32.59 2yrq s PRO 106 CO 0.57 -2.81 -0.20 -1.54 0.04 0.00 0.00 177.00 173.06 2yrq s SER 107 N -3.45 3.65 0.24 6.66 1.04 -1.26 -4.91 113.70 115.67 2yrq s SER 107 Ca 0.66 -0.79 0.07 0.00 0.48 0.00 0.00 55.95 56.37 2yrq s SER 107 Cb -0.19 -0.38 0.74 0.00 0.10 0.00 0.00 66.02 66.29 2yrq s SER 107 CO 0.58 0.12 1.15 0.00 0.98 0.00 0.00 173.24 176.06 2yrq n ALA 108 N 0.23 0.53 0.39 5.32 0.00 -1.25 0.23 120.51 125.96 2yrq n ALA 108 Ca -0.12 0.77 -0.18 0.00 0.00 0.00 0.00 53.44 53.91 2yrq n ALA 108 Cb 0.56 -0.64 -0.09 0.00 0.00 0.00 0.00 19.45 19.28 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 -1.17 -0.88 0.00 3.57 -1.95 -0.94 116.94 115.57 2yrq h PHE 109 Ca 0.52 -0.01 0.22 0.00 3.53 0.00 0.00 57.97 62.23 2yrq h PHE 109 Cb 1.22 0.42 -0.13 0.00 2.79 0.00 0.00 35.95 40.24 2yrq h PHE 109 CO -0.22 -0.66 0.35 0.35 -2.23 0.00 0.00 178.31 175.90 2yrq h PHE 110 N -1.09 0.56 0.39 0.41 3.04 -0.61 -1.35 116.94 118.29 2yrq h PHE 110 Ca -0.10 0.04 -0.02 0.00 3.98 0.00 0.00 57.97 61.88 2yrq h PHE 110 Cb 0.87 -0.11 0.00 0.00 2.56 0.00 0.00 35.95 39.27 2yrq h PHE 110 CO -0.08 -0.09 -0.19 -0.07 -2.02 0.00 0.00 178.31 175.86 2yrq h LEU 111 N 0.34 -0.44 -0.97 0.59 3.38 -1.04 0.34 115.31 117.51 2yrq h LEU 111 Ca 0.55 0.02 0.29 0.00 0.09 0.00 0.00 57.88 58.83 2yrq h LEU 111 Cb 1.07 0.11 -0.17 0.00 0.09 0.00 0.00 40.66 41.76 2yrq h LEU 111 CO -0.56 -0.31 0.16 0.15 0.09 0.00 0.00 178.44 177.97 2yrq h PHE 112 N -0.53 0.18 -0.23 1.13 3.04 -0.66 1.38 116.94 121.25 2yrq h PHE 112 Ca -0.05 0.06 -0.10 0.00 3.98 0.00 0.00 57.97 61.86 2yrq h PHE 112 Cb 0.40 0.08 -0.01 0.00 2.56 0.00 0.00 35.95 38.97 2yrq h PHE 112 CO 0.14 -0.40 -0.29 0.00 -2.02 0.00 0.00 178.31 175.74 2yrq n SER 114 N -4.10 0.63 -0.10 0.00 2.88 0.47 -0.11 113.62 113.29 2yrq n SER 114 Ca -0.01 0.72 -0.10 0.00 -1.33 0.00 0.00 58.87 58.15 2yrq n SER 114 Cb 0.42 -0.83 -0.14 0.00 -0.75 0.00 0.00 64.21 62.91 2yrq n SER 114 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2yrq n GLU 115 N -2.26 0.88 0.09 -1.46 4.07 -0.87 -4.48 120.64 116.61 2yrq n GLU 115 Ca 0.00 0.01 -0.17 0.00 -0.06 0.00 0.00 57.16 56.94 2yrq n GLU 115 Cb 0.14 -1.48 -0.14 0.00 -0.06 0.00 0.00 31.44 29.89 2yrq n GLU 115 CO 0.00 0.00 0.00 1.88 -0.06 0.00 0.00 177.13 178.95 2yrq h TYR 116 N 0.00 0.53 -0.55 4.31 -1.99 -0.85 -3.28 116.97 115.14 2yrq h TYR 116 Ca -0.52 -0.39 0.09 0.00 2.00 0.00 0.00 58.73 59.91 2yrq h TYR 116 Cb 2.12 -0.02 -0.11 0.00 2.00 0.00 0.00 36.73 40.73 2yrq h TYR 116 CO 0.00 1.35 -0.39 -0.09 -0.00 0.00 0.00 178.16 179.03 2yrq h ARG 117 N 0.08 -0.21 0.00 4.88 2.43 -0.74 1.41 114.38 122.23 2yrq h ARG 117 Ca -0.19 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 2yrq h ARG 117 Cb 2.01 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 31.61 2yrq h ARG 117 CO 0.20 -0.14 0.00 -0.35 -1.51 0.00 0.00 179.97 178.17 2yrq n PRO 118 N -5.42 0.20 0.02 0.20 -0.04 -1.26 0.16 135.00 128.86 2yrq n PRO 118 Ca 0.02 0.43 0.11 0.00 -0.04 0.00 0.00 63.50 64.03 2yrq n PRO 118 Cb 0.35 -1.88 -0.11 0.00 -0.04 0.00 0.00 33.50 31.82 2yrq n PRO 118 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2yrq n LYS 119 N -2.25 0.60 -0.13 0.54 4.81 0.16 -4.16 118.16 117.73 2yrq n LYS 119 Ca 0.02 -0.10 -0.26 0.00 -0.87 0.00 0.00 58.31 57.10 2yrq n LYS 119 Cb 0.23 -1.60 -0.09 0.00 0.02 0.00 0.00 35.03 33.58 2yrq n LYS 119 CO 0.00 0.00 0.00 0.44 1.17 0.00 0.00 177.40 179.01 2yrq n ILE 120 N -2.33 1.39 -0.29 3.15 -5.35 0.43 -4.09 119.36 112.28 2yrq n ILE 120 Ca -0.02 -0.38 0.11 0.00 -0.27 0.00 0.00 62.75 62.18 2yrq n ILE 120 Cb 0.55 -1.78 0.26 0.00 -1.74 0.00 0.00 39.64 36.94 2yrq n ILE 120 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 2yrq h LYS 121 N -0.79 0.36 -0.32 6.28 3.64 -0.47 0.22 116.57 125.50 2yrq h LYS 121 Ca -0.63 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 58.62 2yrq h LYS 121 Cb 1.60 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 33.33 2yrq h LYS 121 CO -0.35 0.24 -0.26 0.78 -2.27 0.00 0.00 179.45 177.59 2yrq h GLY 122 N 0.37 0.69 1.01 5.01 0.00 -1.76 -3.12 103.07 105.28 2yrq h GLY 122 Ca 0.51 -0.60 -0.13 0.00 0.00 0.00 0.00 47.33 47.11 2yrq h GLY 122 CO -0.52 0.54 -0.33 0.83 0.00 0.00 0.00 176.54 177.06 2yrq h GLU 123 N 0.56 0.76 -3.82 4.80 4.39 -0.89 -3.38 114.58 117.00 2yrq h GLU 123 Ca 0.08 -0.41 -0.70 0.00 0.34 0.00 0.00 59.36 58.66 2yrq h GLU 123 Cb 0.73 0.02 -0.34 0.00 -0.10 0.00 0.00 28.75 29.06 2yrq h GLU 123 CO 0.06 1.04 -0.39 -1.01 -1.16 0.00 0.00 179.01 177.55 2yrq s HIS 124 N -4.33 3.46 -1.25 4.33 3.76 0.48 -4.92 115.29 116.82 2yrq s HIS 124 Ca -0.12 -2.59 0.14 0.00 -0.15 0.00 0.00 55.06 52.35 2yrq s HIS 124 Cb 0.09 -3.24 0.68 0.00 1.11 0.00 0.00 32.58 31.22 2yrq s HIS 124 CO 0.84 -0.88 1.42 -0.35 -0.85 0.00 0.00 174.74 174.93 2yrq n PRO 125 N 3.80 0.12 -0.05 8.40 -0.04 -1.24 -2.65 135.00 143.34 2yrq n PRO 125 Ca 0.05 0.19 -0.11 0.00 -0.04 0.00 0.00 63.50 63.60 2yrq n PRO 125 Cb 0.39 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.21 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 -0.04 -0.92 3.75 0.55 0.00 -1.26 -4.93 105.19 102.34 2yrq n GLY 126 Ca 0.05 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 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 -6.04 4.34 0.37 0.99 1.43 -1.09 -5.01 118.68 113.68 2yrq s LEU 127 Ca -0.10 2.96 0.08 0.00 -1.03 0.00 0.00 54.13 56.04 2yrq s LEU 127 Cb 0.07 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.63 2yrq s LEU 127 CO 0.81 -0.93 0.28 -0.55 0.23 0.00 0.00 176.35 176.19 2yrq s SER 128 N 0.55 5.03 0.42 2.29 0.15 -1.26 -4.80 113.70 116.08 2yrq s SER 128 Ca 0.64 -0.67 0.26 0.00 0.70 0.00 0.00 55.95 56.88 2yrq s SER 128 Cb -0.48 -0.76 1.32 0.00 -1.71 0.00 0.00 66.02 64.38 2yrq s SER 128 CO 0.47 -0.45 1.67 0.40 1.20 0.00 0.00 173.24 176.53 2yrq h ILE 129 N 1.25 0.24 0.03 6.45 2.04 -1.98 0.39 117.51 125.92 2yrq h ILE 129 Ca -0.43 -0.06 -0.00 0.00 1.00 0.00 0.00 64.86 65.36 2yrq h ILE 129 Cb 1.26 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 2yrq h ILE 129 CO 0.60 0.03 -0.01 1.23 0.00 0.00 0.00 178.15 180.00 2yrq h GLY 130 N 0.18 -0.04 0.56 5.37 0.00 -2.01 -3.08 103.07 104.05 2yrq h GLY 130 Ca 0.75 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 48.07 2yrq h GLY 130 CO -0.40 -0.02 -0.23 -0.55 0.00 0.00 0.00 176.54 175.34 2yrq h ASP 131 N -0.47 -0.55 -0.81 0.19 3.32 -1.15 -3.23 116.42 113.72 2yrq h ASP 131 Ca -0.00 -0.04 0.23 0.00 0.02 0.00 0.00 57.03 57.24 2yrq h ASP 131 Cb 0.44 0.14 -0.15 0.00 0.22 0.00 0.00 39.33 39.98 2yrq h ASP 131 CO 0.01 -0.14 0.06 0.52 -1.72 0.00 0.00 179.24 177.97 2yrq n VAL 132 N -5.22 -0.34 0.28 -1.35 0.31 0.11 0.08 118.33 112.21 2yrq n VAL 132 Ca -0.09 1.76 -0.18 0.00 -0.01 0.00 0.00 64.34 65.82 2yrq n VAL 132 Cb 0.29 -2.60 -0.10 0.00 -0.91 0.00 0.00 33.84 30.52 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 1.61 -1.12 -1.10 3.52 0.00 -1.56 -1.81 119.26 118.80 2yrq h ALA 133 Ca 0.51 -0.18 0.31 0.00 0.00 0.00 0.00 54.91 55.54 2yrq h ALA 133 Cb 1.09 0.73 -0.10 0.00 0.00 0.00 0.00 17.79 19.51 2yrq h ALA 133 CO -0.74 -1.17 0.70 0.87 0.00 0.00 0.00 179.25 178.90 2yrq h LYS 134 N -0.99 0.32 -0.25 0.00 6.56 -0.38 0.85 116.57 122.67 2yrq h LYS 134 Ca -0.06 -0.02 -0.04 0.00 -1.06 0.00 0.00 60.65 59.47 2yrq h LYS 134 Cb 0.87 -0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 32.44 2yrq h LYS 134 CO -0.08 0.21 -0.03 -0.22 -2.06 0.00 0.00 179.45 177.27 2yrq h LYS 135 N 0.33 0.38 0.00 3.15 1.63 -0.74 -2.15 116.57 119.16 2yrq h LYS 135 Ca 0.65 -0.07 -0.12 0.00 -0.85 0.00 0.00 60.65 60.26 2yrq h LYS 135 Cb 1.74 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 33.30 2yrq h LYS 135 CO -0.34 0.43 -0.71 -0.07 -3.45 0.00 0.00 179.45 175.31 2yrq h LEU 136 N 0.37 0.00 -0.26 5.20 3.38 0.10 -3.11 115.31 120.99 2yrq h LEU 136 Ca 0.08 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 2yrq h LEU 136 Cb 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2yrq h LEU 136 CO 0.01 0.51 -0.16 1.23 0.09 0.00 0.00 178.44 180.12 2yrq h GLY 137 N 3.55 0.61 1.52 0.83 0.00 -0.52 -2.97 103.07 106.10 2yrq h GLY 137 Ca -0.04 -0.57 -0.16 0.00 0.00 0.00 0.00 47.33 46.56 2yrq h GLY 137 CO 0.06 0.52 -0.58 1.05 0.00 0.00 0.00 176.54 177.59 2yrq h GLU 138 N 0.29 0.50 0.28 4.80 -0.00 -1.58 -3.16 114.58 115.71 2yrq h GLU 138 Ca 0.05 -0.32 -0.01 0.00 -0.00 0.00 0.00 59.36 59.08 2yrq h GLU 138 Cb 0.68 0.04 -0.01 0.00 -0.00 0.00 0.00 28.75 29.46 2yrq h GLU 138 CO 0.04 0.93 -0.29 0.52 -0.00 0.00 0.00 179.01 180.21 2yrq h MET 139 N 0.38 -0.55 -1.03 1.06 2.86 -1.52 0.20 114.93 116.32 2yrq h MET 139 Ca 0.00 0.04 0.28 0.00 -2.06 0.00 0.00 59.70 57.96 2yrq h MET 139 Cb 1.11 0.13 -0.12 0.00 0.06 0.00 0.00 31.60 32.78 2yrq h MET 139 CO 0.10 -0.37 0.63 2.35 1.06 0.00 0.00 176.91 180.68 2yrq h TRP 140 N -0.57 0.87 0.00 -0.22 -0.00 -1.61 1.18 115.95 115.60 2yrq h TRP 140 Ca -0.04 0.03 -0.06 0.00 -0.00 0.00 0.00 58.89 58.83 2yrq h TRP 140 Cb 0.50 -0.25 -0.01 0.00 -0.00 0.00 0.00 29.16 29.41 2yrq h TRP 140 CO -0.18 0.00 -0.27 -0.91 -0.00 0.00 0.00 178.44 177.08 2yrq h ASN 141 N 0.45 0.00 -0.38 2.65 2.35 -1.38 -2.98 115.58 116.29 2yrq h ASN 141 Ca 0.66 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 56.25 2yrq h ASN 141 Cb 1.47 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 39.74 2yrq h ASN 141 CO -0.45 0.27 0.00 -0.46 -1.65 0.00 0.00 177.43 175.14 2yrq n ASN 142 N -3.38 2.99 -4.55 5.81 0.23 0.38 -4.99 115.26 111.74 2yrq n ASN 142 Ca 0.00 -3.55 -0.34 0.00 -0.53 0.00 0.00 54.58 50.17 2yrq n ASN 142 Cb 0.47 -0.63 -0.12 0.00 -2.08 0.00 0.00 39.78 37.43 2yrq n ASN 142 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2yrq s THR 143 N -3.13 3.61 0.38 5.53 2.01 0.61 -4.96 115.64 119.70 2yrq s THR 143 Ca 0.45 -0.51 -0.25 0.00 0.31 0.00 0.00 61.69 61.69 2yrq s THR 143 Cb 0.39 -2.48 -0.09 0.00 0.01 0.00 0.00 72.50 70.34 2yrq s THR 143 CO 0.03 0.59 1.09 0.00 -0.69 0.00 0.00 174.62 175.64 2yrq s ALA 144 N -0.67 3.15 0.32 7.40 0.00 -1.26 -4.93 121.76 125.76 2yrq s ALA 144 Ca 0.10 0.81 0.07 0.00 0.00 0.00 0.00 51.96 52.94 2yrq s ALA 144 Cb -0.11 -3.31 0.75 0.00 0.00 0.00 0.00 23.12 20.44 2yrq s ALA 144 CO 0.02 -0.31 1.82 0.00 0.00 0.00 0.00 175.76 177.29 2yrq h ALA 145 N 2.72 1.73 -0.76 0.00 0.00 -1.98 0.75 119.26 121.71 2yrq h ALA 145 Ca -0.48 0.04 0.12 0.00 0.00 0.00 0.00 54.91 54.59 2yrq h ALA 145 Cb 1.22 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.84 2yrq h ALA 145 CO 0.63 -0.04 0.50 0.38 0.00 0.00 0.00 179.25 180.73 2yrq h ASP 146 N 0.77 0.51 1.00 0.00 3.04 -2.01 0.39 116.42 120.11 2yrq h ASP 146 Ca 0.52 0.02 0.00 0.00 -3.24 0.00 0.00 57.03 54.33 2yrq h ASP 146 Cb 0.79 -0.08 0.00 0.00 -1.04 0.00 0.00 39.33 38.99 2yrq h ASP 146 CO -0.29 0.28 0.00 -0.67 -2.04 0.00 0.00 179.24 176.53 2yrq n ASP 147 N -4.50 0.74 -0.97 4.15 -0.08 0.25 -2.26 116.55 113.88 2yrq n ASP 147 Ca 0.14 0.64 0.12 0.00 -1.51 0.00 0.00 54.79 54.17 2yrq n ASP 147 Cb 0.43 -0.81 0.22 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 -2.27 2.30 0.08 -0.67 5.02 0.13 -4.51 118.16 118.25 2yrq n LYS 148 Ca 0.03 -1.93 -0.15 0.00 -2.02 0.00 0.00 58.31 54.24 2yrq n LYS 148 Cb 0.30 -1.48 -0.09 0.00 -0.02 0.00 0.00 35.03 33.75 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 4.16 -0.64 0.00 1.97 4.15 -1.07 0.90 115.11 124.57 2yrq h GLN 149 Ca 0.00 0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.45 2yrq h GLN 149 Cb 0.90 0.15 -0.00 0.00 0.21 0.00 0.00 27.48 28.74 2yrq h GLN 149 CO 0.00 -0.43 -0.08 -1.00 -1.93 0.00 0.00 178.83 175.39 2yrq h PRO 150 N -0.67 0.00 0.00 -2.39 0.13 -1.82 -0.30 132.00 126.95 2yrq h PRO 150 Ca 0.02 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.08 2yrq h PRO 150 Cb 0.71 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.83 2yrq h PRO 150 CO -0.31 0.08 -0.76 1.88 -0.23 0.00 0.00 178.00 178.65 2yrq h TYR 151 N 0.00 0.00 0.00 1.56 0.05 -1.52 -3.21 116.97 113.85 2yrq h TYR 151 Ca -0.00 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 58.59 2yrq h TYR 151 Cb 0.55 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.26 2yrq h TYR 151 CO 0.00 0.29 -1.27 0.39 -1.05 0.00 0.00 178.16 176.52 2yrq n GLU 152 N -2.97 0.54 -0.19 4.88 1.02 0.30 -3.31 120.64 120.90 2yrq n GLU 152 Ca -0.01 0.48 0.00 0.00 -0.02 0.00 0.00 57.16 57.61 2yrq n GLU 152 Cb 0.67 -1.66 0.10 0.00 -0.02 0.00 0.00 31.44 30.53 2yrq n GLU 152 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2yrq h LYS 153 N -1.00 0.19 -0.05 3.49 1.79 -1.24 -1.68 116.57 118.07 2yrq h LYS 153 Ca -0.29 -0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.16 2yrq h LYS 153 Cb 1.13 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 31.73 2yrq h LYS 153 CO -0.18 0.13 0.01 -0.22 -1.08 0.00 0.00 179.45 178.10 2yrq h LYS 154 N 0.20 0.08 -1.08 3.15 1.63 -1.76 -2.77 116.57 116.01 2yrq h LYS 154 Ca 0.31 -0.02 0.31 0.00 -0.85 0.00 0.00 60.65 60.40 2yrq h LYS 154 Cb 0.48 -0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 32.05 2yrq h LYS 154 CO -0.44 0.32 0.77 0.00 -3.45 0.00 0.00 179.45 176.65 2yrq h ALA 155 N 0.75 2.96 0.91 5.00 0.00 -1.36 -1.49 119.26 126.03 2yrq h ALA 155 Ca 0.01 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2yrq h ALA 155 Cb 0.28 0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.16 2yrq h ALA 155 CO 0.00 -1.28 -0.44 0.00 0.00 0.00 0.00 179.25 177.54 2yrq h ALA 156 N 1.47 -1.22 -0.61 0.00 0.00 -1.03 -0.59 119.26 117.28 2yrq h ALA 156 Ca 0.52 -0.27 0.18 0.00 0.00 0.00 0.00 54.91 55.34 2yrq h ALA 156 Cb 2.02 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 20.26 2yrq h ALA 156 CO -0.03 -1.14 0.60 0.87 0.00 0.00 0.00 179.25 179.55 2yrq h LYS 157 N -1.32 0.00 0.22 0.00 1.57 -1.32 0.27 116.57 116.00 2yrq h LYS 157 Ca -0.12 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.33 2yrq h LYS 157 Cb 0.94 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.28 2yrq h LYS 157 CO 0.21 0.00 -1.42 -0.07 -0.57 0.00 0.00 179.45 177.59 2yrq h LEU 158 N 0.00 0.77 -0.12 2.94 3.38 -1.23 -2.94 115.31 118.10 2yrq h LEU 158 Ca 0.29 -0.82 -0.00 0.00 0.09 0.00 0.00 57.88 57.44 2yrq h LEU 158 Cb 1.48 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 2yrq h LEU 158 CO -0.00 1.64 0.07 0.50 0.09 0.00 0.00 178.44 180.73 2yrq h LYS 159 N 0.14 0.17 0.08 1.13 3.11 0.11 -2.69 116.57 118.63 2yrq h LYS 159 Ca -0.23 -0.02 -0.00 0.00 -2.81 0.00 0.00 60.65 57.59 2yrq h LYS 159 Cb 2.12 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 33.32 2yrq h LYS 159 CO 0.26 0.19 -0.04 1.05 -2.81 0.00 0.00 179.45 178.11 2yrq h GLU 160 N 0.11 -0.10 -0.09 1.90 4.11 -1.48 -1.64 114.58 117.38 2yrq h GLU 160 Ca 0.04 0.01 0.03 0.00 0.07 0.00 0.00 59.36 59.51 2yrq h GLU 160 Cb 0.07 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 2yrq h GLU 160 CO -0.01 -0.02 0.40 0.87 0.07 0.00 0.00 179.01 180.32 2yrq h LYS 161 N -0.16 0.00 0.00 1.06 1.79 -1.44 -1.16 116.57 116.66 2yrq h LYS 161 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2yrq h LYS 161 Cb 0.13 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.78 2yrq h LYS 161 CO 0.02 0.00 -0.11 -0.92 -1.08 0.00 0.00 179.45 177.35 2yrq h TYR 162 N 0.00 0.00 -1.16 -1.35 3.20 -0.98 -3.08 116.97 113.59 2yrq h TYR 162 Ca 0.04 0.00 0.36 0.00 3.14 0.00 0.00 58.73 62.28 2yrq h TYR 162 Cb 0.84 0.00 -0.12 0.00 1.54 0.00 0.00 36.73 38.99 2yrq h TYR 162 CO 0.00 0.00 0.73 0.93 -1.64 0.00 0.00 178.16 178.18 2yrq h GLU 163 N -0.39 0.21 -0.26 1.82 5.08 -1.03 0.58 114.58 120.59 2yrq h GLU 163 Ca 0.00 -0.01 -0.11 0.00 -1.00 0.00 0.00 59.36 58.23 2yrq h GLU 163 Cb 0.11 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 2yrq h GLU 163 CO 0.00 0.14 -0.28 1.57 -1.00 0.00 0.00 179.01 179.44 2yrq h LYS 164 N 0.22 0.65 -0.51 2.33 5.09 -1.39 -1.59 116.57 121.37 2yrq h LYS 164 Ca 0.74 -0.35 -0.01 0.00 0.09 0.00 0.00 60.65 61.12 2yrq h LYS 164 Cb 2.07 0.02 -0.02 0.00 0.10 0.00 0.00 32.23 34.39 2yrq h LYS 164 CO -0.44 0.96 0.29 -0.44 -2.09 0.00 0.00 179.45 177.73 2yrq h ASP 165 N 0.38 0.64 0.62 7.07 3.32 0.18 -2.29 116.42 126.34 2yrq h ASP 165 Ca 0.04 -0.09 -0.07 0.00 0.02 0.00 0.00 57.03 56.93 2yrq h ASP 165 Cb 0.85 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.23 2yrq h ASP 165 CO 0.07 0.54 -0.35 -0.29 -1.72 0.00 0.00 179.24 177.49 2yrq h ILE 166 N 0.69 0.98 -0.05 0.35 2.10 -1.10 -2.81 117.51 117.67 2yrq h ILE 166 Ca 0.18 -1.34 0.01 0.00 1.08 0.00 0.00 64.86 64.79 2yrq h ILE 166 Cb 0.04 1.78 -0.00 0.00 -1.09 0.00 0.00 36.82 37.55 2yrq h ILE 166 CO -0.03 0.34 0.03 0.00 -1.08 0.00 0.00 178.15 177.42 2yrq h ALA 167 N 1.65 2.02 0.02 0.18 0.00 -0.68 -1.70 119.26 120.75 2yrq h ALA 167 Ca -0.00 -0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.64 2yrq h ALA 167 Cb 0.76 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 2yrq h ALA 167 CO 0.05 -0.06 -1.41 0.00 0.00 0.00 0.00 179.25 177.83 2yrq h ALA 168 N 1.98 0.51 -0.18 0.00 0.00 -1.46 -2.26 119.26 117.86 2yrq h ALA 168 Ca 0.02 -1.19 0.00 0.00 0.00 0.00 0.00 54.91 53.74 2yrq h ALA 168 Cb 0.09 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2yrq h ALA 168 CO -0.00 1.37 0.12 -0.92 0.00 0.00 0.00 179.25 179.82 2yrq h TYR 169 N 0.01 0.23 0.00 0.00 3.20 -1.25 -3.27 116.97 115.89 2yrq h TYR 169 Ca -0.18 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.68 2yrq h TYR 169 Cb 1.92 -0.08 -0.00 0.00 1.54 0.00 0.00 36.73 40.11 2yrq h TYR 169 CO 0.01 0.15 -0.09 0.07 -1.64 0.00 0.00 178.16 176.67 2yrq h ARG 170 N 0.24 0.00 -0.40 1.82 0.11 -1.61 -3.48 114.38 111.06 2yrq h ARG 170 Ca 0.07 0.00 0.24 0.00 0.10 0.00 0.00 59.98 60.38 2yrq h ARG 170 Cb -0.02 0.00 -0.24 0.00 1.11 0.00 0.00 29.97 30.82 2yrq h ARG 170 CO -0.01 0.95 0.34 0.00 0.10 0.00 0.00 179.97 181.34 2yrq s ALA 171 N -2.25 -3.23 0.23 0.08 0.00 -0.87 -5.04 121.76 110.67 2yrq s ALA 171 Ca -0.19 1.73 -0.13 0.00 0.00 0.00 0.00 51.96 53.37 2yrq s ALA 171 Cb -0.02 -2.31 0.28 0.00 0.00 0.00 0.00 23.12 21.07 2yrq s ALA 171 CO 0.65 -1.13 1.60 0.87 0.00 0.00 0.00 175.76 177.75 2yrq h LYS 172 N 7.48 -0.02 0.00 0.00 1.79 -1.64 -3.39 116.57 120.79 2yrq h LYS 172 Ca -0.14 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.34 2yrq h LYS 172 Cb 1.14 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.79 2yrq h LYS 172 CO 0.00 -0.02 0.00 0.41 -1.08 0.00 0.00 179.45 178.77