#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 -0.30 0.28 1.61 0.01 -1.26 -5.04 113.70 109.01 2yrq s SER 2 Ca 0.00 -0.12 -0.04 0.00 1.31 0.00 0.00 55.95 57.10 2yrq s SER 2 Cb 0.00 0.40 0.56 0.00 0.21 0.00 0.00 66.02 67.20 2yrq s SER 2 CO 0.00 -0.69 1.57 0.28 0.41 0.00 0.00 173.24 174.82 2yrq h SER 3 N 2.00 -0.68 0.00 2.44 0.02 -2.04 -3.43 113.55 111.85 2yrq h SER 3 Ca -0.23 0.28 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 2yrq h SER 3 Cb 1.24 0.53 0.00 0.00 0.14 0.00 0.00 62.40 64.31 2yrq h SER 3 CO 0.29 -0.32 0.00 0.61 -1.14 0.00 0.00 176.83 176.27 2yrq n GLY 4 N -1.55 1.46 3.77 -3.77 0.00 -1.26 -4.67 105.19 99.17 2yrq n GLY 4 Ca 0.18 0.42 -0.40 0.00 0.00 0.00 0.00 46.02 46.23 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 -4.00 6.18 0.26 1.61 0.01 -1.26 -4.90 113.70 111.61 2yrq s SER 5 Ca 0.00 2.75 -0.04 0.00 1.31 0.00 0.00 55.95 59.97 2yrq s SER 5 Cb 0.00 -2.64 0.52 0.00 0.21 0.00 0.00 66.02 64.11 2yrq s SER 5 CO 0.00 -0.95 1.63 0.77 0.41 0.00 0.00 173.24 175.10 2yrq h SER 6 N 2.59 -0.29 0.00 2.44 4.64 -2.02 -3.44 113.55 117.47 2yrq h SER 6 Ca -0.50 0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2yrq h SER 6 Cb 1.25 0.34 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 2yrq h SER 6 CO 0.62 -0.19 0.00 0.61 -0.87 0.00 0.00 176.83 177.00 2yrq n GLY 7 N -1.42 0.12 3.61 -0.77 0.00 -1.26 -5.09 105.19 100.38 2yrq n GLY 7 Ca 0.16 -0.03 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 2yrq n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2yrq s MET 8 N 0.00 3.51 -0.21 1.61 1.75 -1.26 -4.97 119.30 119.73 2yrq s MET 8 Ca 0.00 1.45 0.00 0.00 -1.25 0.00 0.00 55.69 55.89 2yrq s MET 8 Cb 0.00 -4.13 0.05 0.00 2.84 0.00 0.00 34.83 33.60 2yrq s MET 8 CO 0.00 -1.64 -0.06 0.20 -0.65 0.00 0.00 175.02 172.86 2yrq s GLY 9 N 5.24 1.22 -0.06 2.11 0.00 -1.26 -4.95 107.32 109.61 2yrq s GLY 9 Ca 0.75 -1.22 0.01 0.00 0.00 0.00 0.00 44.72 44.26 2yrq s GLY 9 CO 0.32 0.88 -0.05 0.28 0.00 0.00 0.00 173.10 174.53 2yrq n LYS 10 N 4.72 0.43 0.00 2.90 4.76 -1.26 -5.10 118.16 124.60 2yrq n LYS 10 Ca -0.13 0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.35 2yrq n LYS 10 Cb 0.45 -1.13 0.00 0.00 -1.84 0.00 0.00 35.03 32.51 2yrq n LYS 10 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2yrq n GLY 11 N 3.14 4.86 3.81 0.72 0.00 -1.26 -4.97 105.19 111.48 2yrq n GLY 11 Ca -0.11 -0.65 -0.25 0.00 0.00 0.00 0.00 46.02 45.01 2yrq n GLY 11 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2yrq n ASP 12 N 0.00 -0.99 0.00 1.61 9.92 -1.26 -4.72 116.55 121.11 2yrq n ASP 12 Ca 0.00 -0.82 0.07 0.00 -0.53 0.00 0.00 54.79 53.51 2yrq n ASP 12 Cb 0.00 -1.00 0.40 0.00 -0.64 0.00 0.00 41.12 39.88 2yrq n ASP 12 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 2yrq n PRO 13 N -3.42 0.28 -0.01 -0.24 -0.04 -1.26 -2.94 135.00 127.37 2yrq n PRO 13 Ca -0.14 0.11 -0.18 0.00 -0.04 0.00 0.00 63.50 63.25 2yrq n PRO 13 Cb 0.40 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.22 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 0.15 -6.07 0.54 1.57 -2.05 -3.46 116.57 107.25 2yrq h LYS 14 Ca 0.00 -0.26 -0.80 0.00 -1.87 0.00 0.00 60.65 57.73 2yrq h LYS 14 Cb 0.10 0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.52 2yrq h LYS 14 CO 0.00 1.12 0.86 1.17 -0.57 0.00 0.00 179.45 182.04 2yrq n LYS 15 N -4.32 0.62 -2.26 3.15 4.81 -1.15 -4.89 118.16 114.13 2yrq n LYS 15 Ca -0.15 0.22 -0.35 0.00 -0.87 0.00 0.00 58.31 57.16 2yrq n LYS 15 Cb 0.69 -1.84 0.00 0.00 0.02 0.00 0.00 35.03 33.90 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 3.59 3.41 0.08 1.64 0.04 -1.26 -5.06 135.00 137.43 2yrq s PRO 16 Ca 1.03 1.64 -0.07 0.00 0.04 0.00 0.00 61.00 63.64 2yrq s PRO 16 Cb -1.26 -2.06 -0.01 0.00 0.04 0.00 0.00 34.50 31.20 2yrq s PRO 16 CO 0.72 -0.81 0.13 -0.98 0.04 0.00 0.00 177.00 176.10 2yrq s ARG 17 N -3.20 0.79 0.00 4.56 1.70 -1.26 -4.98 118.95 116.55 2yrq s ARG 17 Ca 0.72 -1.04 0.00 0.00 -0.47 0.00 0.00 55.73 54.94 2yrq s ARG 17 Cb -0.25 0.31 0.00 0.00 -0.57 0.00 0.00 34.95 34.44 2yrq s ARG 17 CO 0.28 -0.23 0.00 0.41 -1.08 0.00 0.00 175.30 174.68 2yrq n GLY 18 N -0.02 3.73 3.29 3.88 0.00 -1.26 -5.09 105.19 109.72 2yrq n GLY 18 Ca -0.15 -0.57 -0.57 0.00 0.00 0.00 0.00 46.02 44.73 2yrq n GLY 18 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2yrq n LYS 19 N 0.00 0.03 -4.60 1.61 5.02 -1.26 -4.90 118.16 114.06 2yrq n LYS 19 Ca 0.00 0.01 -0.32 0.00 -2.02 0.00 0.00 58.31 55.98 2yrq n LYS 19 Cb 0.00 -1.53 -0.12 0.00 -0.02 0.00 0.00 35.03 33.37 2yrq n LYS 19 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2yrq s MET 20 N 6.43 2.39 0.57 1.97 -1.94 -1.26 -5.09 119.30 122.38 2yrq s MET 20 Ca 1.22 -0.80 -0.06 0.00 -1.71 0.00 0.00 55.69 54.34 2yrq s MET 20 Cb -1.45 -2.38 -0.00 0.00 2.01 0.00 0.00 34.83 33.01 2yrq s MET 20 CO 0.63 0.59 0.88 0.45 -0.01 0.00 0.00 175.02 177.56 2yrq s SER 21 N -1.30 5.73 0.10 3.03 0.15 -1.26 -4.72 113.70 115.43 2yrq s SER 21 Ca 0.15 0.77 -0.19 0.00 0.70 0.00 0.00 55.95 57.38 2yrq s SER 21 Cb -0.11 -1.82 -0.04 0.00 -1.71 0.00 0.00 66.02 62.34 2yrq s SER 21 CO 0.06 -0.97 1.15 -1.20 1.20 0.00 0.00 173.24 173.47 2yrq n SER 22 N -2.53 -0.65 0.24 5.45 7.64 -1.26 -0.95 113.62 121.57 2yrq n SER 22 Ca 0.04 1.29 -0.17 0.00 1.01 0.00 0.00 58.87 61.04 2yrq n SER 22 Cb 0.57 -0.24 -0.09 0.00 -1.01 0.00 0.00 64.21 63.44 2yrq n SER 22 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2yrq h TYR 23 N 0.00 -1.27 -1.01 1.43 3.20 -1.93 0.25 116.97 117.64 2yrq h TYR 23 Ca 0.10 0.01 0.41 0.00 3.14 0.00 0.00 58.73 62.39 2yrq h TYR 23 Cb 0.25 0.50 -0.17 0.00 1.54 0.00 0.00 36.73 38.85 2yrq h TYR 23 CO -0.82 -0.61 0.56 0.00 -1.64 0.00 0.00 178.16 175.65 2yrq n ALA 24 N -2.79 1.03 -0.05 1.82 0.00 -0.13 -0.15 120.51 120.25 2yrq n ALA 24 Ca -0.11 0.97 -0.01 0.00 0.00 0.00 0.00 53.44 54.30 2yrq n ALA 24 Cb 0.43 -0.99 -0.00 0.00 0.00 0.00 0.00 19.45 18.88 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 0.00 -0.95 0.00 0.04 -0.25 -3.30 116.94 112.47 2yrq h PHE 25 Ca 0.83 0.00 0.29 0.00 2.80 0.00 0.00 57.97 61.88 2yrq h PHE 25 Cb 2.24 0.00 -0.16 0.00 2.20 0.00 0.00 35.95 40.23 2yrq h PHE 25 CO -0.01 0.02 0.23 0.35 -0.60 0.00 0.00 178.31 178.30 2yrq h PHE 26 N -1.00 0.31 -0.70 -0.55 3.57 0.85 1.27 116.94 120.69 2yrq h PHE 26 Ca -0.00 0.06 0.08 0.00 3.53 0.00 0.00 57.97 61.64 2yrq h PHE 26 Cb 0.07 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.79 2yrq h PHE 26 CO -0.02 -0.34 0.46 0.28 -2.23 0.00 0.00 178.31 176.46 2yrq h VAL 27 N 0.10 0.96 0.00 1.41 2.07 -0.69 0.04 116.25 120.14 2yrq h VAL 27 Ca 0.63 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.94 2yrq h VAL 27 Cb 1.39 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 2yrq h VAL 27 CO -0.78 0.11 -0.72 -0.61 0.02 0.00 0.00 177.57 175.59 2yrq h GLN 28 N 0.63 0.00 0.00 1.57 4.15 0.13 -3.25 115.11 118.34 2yrq h GLN 28 Ca 0.31 0.00 -0.17 0.00 0.77 0.00 0.00 58.65 59.56 2yrq h GLN 28 Cb 0.40 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.07 2yrq h GLN 28 CO -0.11 0.00 -0.82 1.15 -1.93 0.00 0.00 178.83 177.13 2yrq h THR 29 N 0.00 1.50 0.05 2.39 2.02 0.14 -3.23 112.91 115.78 2yrq h THR 29 Ca 0.00 -2.88 -0.12 0.00 0.77 0.00 0.00 66.41 64.18 2yrq h THR 29 Cb 0.77 2.59 -0.00 0.00 -1.74 0.00 0.00 68.15 69.77 2yrq h THR 29 CO 0.00 0.80 -0.58 0.00 0.37 0.00 0.00 175.52 176.11 2yrq h ARG 31 N -0.76 0.28 -0.63 0.00 0.11 -1.67 0.17 114.38 111.88 2yrq h ARG 31 Ca -0.13 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 59.92 2yrq h ARG 31 Cb 1.30 -0.06 -0.03 0.00 1.11 0.00 0.00 29.97 32.29 2yrq h ARG 31 CO 0.01 0.18 0.34 0.93 0.10 0.00 0.00 179.97 181.54 2yrq h GLU 32 N 0.29 0.88 -0.50 0.08 5.08 -1.69 -2.15 114.58 116.58 2yrq h GLU 32 Ca 0.51 -0.11 0.06 0.00 -1.00 0.00 0.00 59.36 58.83 2yrq h GLU 32 Cb 0.97 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.02 2yrq h GLU 32 CO -0.57 0.67 0.33 0.93 -1.00 0.00 0.00 179.01 179.37 2yrq h GLU 33 N 0.86 0.41 0.53 2.33 4.39 -0.73 -2.83 114.58 119.53 2yrq h GLU 33 Ca 0.22 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.87 2yrq h GLU 33 Cb 0.05 -0.09 0.01 0.00 -0.10 0.00 0.00 28.75 28.61 2yrq h GLU 33 CO -0.04 0.27 -0.25 1.25 -1.16 0.00 0.00 179.01 179.08 2yrq h HIS 34 N 0.42 -0.65 -0.99 4.33 2.76 -0.74 -2.90 115.15 117.38 2yrq h HIS 34 Ca 0.22 -0.02 0.29 0.00 -2.20 0.00 0.00 60.37 58.66 2yrq h HIS 34 Cb 0.32 0.22 -0.04 0.00 1.55 0.00 0.00 27.41 29.46 2yrq h HIS 34 CO -0.00 -0.35 1.11 0.87 -1.30 0.00 0.00 177.93 178.26 2yrq h LYS 35 N -1.11 0.00 0.20 5.26 6.56 -1.23 1.33 116.57 127.57 2yrq h LYS 35 Ca -0.07 0.00 -0.26 0.00 -1.06 0.00 0.00 60.65 59.26 2yrq h LYS 35 Cb 0.60 0.00 0.03 0.00 -0.57 0.00 0.00 32.23 32.29 2yrq h LYS 35 CO 0.12 0.00 -1.15 0.87 -2.06 0.00 0.00 179.45 177.22 2yrq h LYS 36 N 0.00 0.42 -0.14 3.15 1.79 -1.42 -3.05 116.57 117.33 2yrq h LYS 36 Ca 0.47 -0.72 -0.09 0.00 -2.18 0.00 0.00 60.65 58.13 2yrq h LYS 36 Cb 2.69 0.27 0.00 0.00 -1.58 0.00 0.00 32.23 33.61 2yrq h LYS 36 CO -0.00 1.35 -0.25 0.87 -1.08 0.00 0.00 179.45 180.33 2yrq h LYS 37 N -0.11 0.41 -2.99 3.15 1.79 0.18 -3.41 116.57 115.59 2yrq h LYS 37 Ca -0.20 -0.26 -0.59 0.00 -2.18 0.00 0.00 60.65 57.42 2yrq h LYS 37 Cb 1.91 0.03 -0.40 0.00 -1.58 0.00 0.00 32.23 32.19 2yrq h LYS 37 CO 0.21 0.85 -0.78 -1.01 -1.08 0.00 0.00 179.45 177.65 2yrq s HIS 38 N -4.05 1.38 -0.02 -1.35 3.76 0.29 -5.00 115.29 110.30 2yrq s HIS 38 Ca -0.14 -1.86 -0.26 0.00 -0.15 0.00 0.00 55.06 52.65 2yrq s HIS 38 Cb 0.05 -1.47 -0.20 0.00 1.11 0.00 0.00 32.58 32.07 2yrq s HIS 38 CO 0.78 -0.83 1.27 -1.00 -0.85 0.00 0.00 174.74 174.11 2yrq h PRO 39 N 7.32 0.01 -0.41 8.40 0.13 -1.76 -3.19 132.00 142.51 2yrq h PRO 39 Ca -0.04 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 65.09 2yrq h PRO 39 Cb 0.97 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.08 2yrq h PRO 39 CO 0.41 0.50 0.27 0.38 -0.23 0.00 0.00 178.00 179.33 2yrq h ASP 40 N -0.47 0.45 -2.89 1.44 2.03 -1.94 -3.41 116.42 111.62 2yrq h ASP 40 Ca 0.00 -0.01 -0.55 0.00 -0.73 0.00 0.00 57.03 55.74 2yrq h ASP 40 Cb 0.50 -0.11 -0.02 0.00 -0.83 0.00 0.00 39.33 38.87 2yrq h ASP 40 CO 0.00 0.32 0.88 0.00 -1.03 0.00 0.00 179.24 179.41 2yrq s ALA 41 N -5.47 3.60 -1.10 4.15 0.00 -1.20 -4.95 121.76 116.79 2yrq s ALA 41 Ca -0.08 0.70 -0.05 0.00 0.00 0.00 0.00 51.96 52.53 2yrq s ALA 41 Cb 0.18 -3.62 0.30 0.00 0.00 0.00 0.00 23.12 19.98 2yrq s ALA 41 CO 0.73 -1.06 1.47 -1.13 0.00 0.00 0.00 175.76 175.78 2yrq n SER 42 N 6.06 6.28 -4.63 0.00 3.41 -1.26 -4.92 113.62 118.56 2yrq n SER 42 Ca 0.14 -3.36 -0.60 0.00 -0.26 0.00 0.00 58.87 54.78 2yrq n SER 42 Cb 0.44 -1.29 -0.08 0.00 -0.26 0.00 0.00 64.21 63.02 2yrq n SER 42 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 2yrq n VAL 43 N 1.56 0.05 -2.00 -3.33 3.14 -1.26 -4.84 118.33 111.66 2yrq n VAL 43 Ca 0.27 -0.01 -0.41 0.00 -2.96 0.00 0.00 64.34 61.22 2yrq n VAL 43 Cb 0.34 -0.51 -0.02 0.00 -1.06 0.00 0.00 33.84 32.59 2yrq n VAL 43 CO 0.00 0.00 0.00 0.20 -6.46 0.00 0.00 176.83 170.57 2yrq s ASN 44 N 1.65 6.63 -0.01 6.55 0.01 -1.26 -4.94 114.94 123.57 2yrq s ASN 44 Ca 0.96 2.72 -0.22 0.00 -0.71 0.00 0.00 52.86 55.60 2yrq s ASN 44 Cb -1.26 -2.63 -0.13 0.00 0.41 0.00 0.00 41.25 37.64 2yrq s ASN 44 CO 0.65 -0.70 0.95 -0.26 -1.51 0.00 0.00 177.10 176.23 2yrq h PHE 45 N 4.59 -0.65 -0.80 2.20 0.04 -1.99 -0.42 116.94 119.91 2yrq h PHE 45 Ca -0.47 -0.02 0.18 0.00 2.80 0.00 0.00 57.97 60.46 2yrq h PHE 45 Cb 1.22 0.21 -0.15 0.00 2.20 0.00 0.00 35.95 39.44 2yrq h PHE 45 CO 0.59 -0.36 -0.09 0.77 -0.60 0.00 0.00 178.31 178.62 2yrq h SER 46 N -1.13 -0.55 0.09 2.17 0.02 -2.02 -0.54 113.55 111.60 2yrq h SER 46 Ca -0.07 0.23 -0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2yrq h SER 46 Cb 0.58 0.43 0.00 0.00 0.14 0.00 0.00 62.40 63.56 2yrq h SER 46 CO 0.12 -0.24 -0.04 -0.33 -1.14 0.00 0.00 176.83 175.20 2yrq h GLU 47 N 0.04 -0.11 -1.00 3.45 4.39 -1.97 -3.06 114.58 116.33 2yrq h GLU 47 Ca 0.42 0.01 0.38 0.00 0.34 0.00 0.00 59.36 60.50 2yrq h GLU 47 Cb 0.71 0.03 -0.17 0.00 -0.10 0.00 0.00 28.75 29.22 2yrq h GLU 47 CO -0.77 0.21 0.49 0.35 -1.16 0.00 0.00 179.01 178.13 2yrq h PHE 48 N -0.44 0.76 -0.62 4.33 3.57 0.51 0.21 116.94 125.26 2yrq h PHE 48 Ca -0.01 0.04 0.11 0.00 3.53 0.00 0.00 57.97 61.64 2yrq h PHE 48 Cb 0.37 -0.16 -0.12 0.00 2.79 0.00 0.00 35.95 38.83 2yrq h PHE 48 CO 0.03 -0.39 -0.30 1.03 -2.23 0.00 0.00 178.31 176.45 2yrq h SER 49 N 0.09 -1.05 -0.65 0.41 0.87 -1.25 0.77 113.55 112.74 2yrq h SER 49 Ca 0.79 0.22 0.19 0.00 -1.23 0.00 0.00 61.79 61.76 2yrq h SER 49 Cb 1.98 0.55 -0.03 0.00 -0.44 0.00 0.00 62.40 64.46 2yrq h SER 49 CO -0.74 -0.29 0.52 0.07 -0.53 0.00 0.00 176.83 175.87 2yrq h LYS 50 N -0.13 0.00 0.17 2.24 2.10 -0.73 -0.95 116.57 119.27 2yrq h LYS 50 Ca 0.26 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.90 2yrq h LYS 50 Cb 0.54 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.88 2yrq h LYS 50 CO -0.69 0.00 -0.08 -0.22 -2.00 0.00 0.00 179.45 176.46 2yrq h LYS 51 N 0.00 -0.22 -0.84 0.07 1.63 0.51 -2.36 116.57 115.36 2yrq h LYS 51 Ca 0.31 0.01 0.12 0.00 -0.85 0.00 0.00 60.65 60.25 2yrq h LYS 51 Cb 1.35 0.05 -0.06 0.00 -0.60 0.00 0.00 32.23 32.97 2yrq h LYS 51 CO -0.00 0.19 0.55 0.00 -3.45 0.00 0.00 179.45 176.73 2yrq h SER 53 N 0.69 -0.59 -0.03 0.00 4.64 -1.26 0.38 113.55 117.39 2yrq h SER 53 Ca 0.41 -0.06 0.01 0.00 -0.47 0.00 0.00 61.79 61.68 2yrq h SER 53 Cb 0.61 0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.85 2yrq h SER 53 CO -0.17 -0.21 0.06 1.05 -0.87 0.00 0.00 176.83 176.69 2yrq h GLU 54 N -1.04 0.00 0.15 4.77 4.11 -1.06 0.44 114.58 121.95 2yrq h GLU 54 Ca -0.07 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 59.03 2yrq h GLU 54 Cb 0.61 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 2yrq h GLU 54 CO 0.12 0.00 -1.67 0.00 0.07 0.00 0.00 179.01 177.52 2yrq h ARG 55 N 0.00 0.31 -0.31 1.06 -0.00 -0.80 -3.00 114.38 111.64 2yrq h ARG 55 Ca 0.01 -0.53 -0.11 0.00 -0.50 0.00 0.00 59.98 58.85 2yrq h ARG 55 Cb 0.14 0.20 -0.01 0.00 0.00 0.00 0.00 29.97 30.30 2yrq h ARG 55 CO -0.00 1.25 -0.26 2.35 0.00 0.00 0.00 179.97 183.31 2yrq h TRP 56 N -0.07 0.72 -0.18 3.04 2.91 0.60 0.41 115.95 123.39 2yrq h TRP 56 Ca -0.35 -0.17 -0.15 0.00 1.13 0.00 0.00 58.89 59.36 2yrq h TRP 56 Cb 1.95 -0.17 0.00 0.00 -0.51 0.00 0.00 29.16 30.44 2yrq h TRP 56 CO 0.11 0.83 -0.47 1.57 -1.03 0.00 0.00 178.44 179.44 2yrq h LYS 57 N 0.55 0.63 -0.07 2.65 2.10 -1.09 -3.28 116.57 118.05 2yrq h LYS 57 Ca 0.07 -0.44 -0.22 0.00 -2.00 0.00 0.00 60.65 58.05 2yrq h LYS 57 Cb 0.74 0.07 0.01 0.00 -0.90 0.00 0.00 32.23 32.15 2yrq h LYS 57 CO 0.06 1.06 -0.83 0.00 -2.00 0.00 0.00 179.45 177.74 2yrq h THR 58 N 0.31 1.30 -1.72 0.07 1.03 -1.45 -3.45 112.91 109.00 2yrq h THR 58 Ca -0.01 -2.07 -0.69 0.00 -0.01 0.00 0.00 66.41 63.63 2yrq h THR 58 Cb 1.09 2.23 0.02 0.00 -1.07 0.00 0.00 68.15 70.42 2yrq h THR 58 CO 0.10 0.64 0.86 0.23 -0.01 0.00 0.00 175.52 177.34 2yrq n MET 59 N -3.97 1.44 -1.63 0.00 2.81 0.14 -4.94 117.12 110.96 2yrq n MET 59 Ca -0.09 0.53 -0.30 0.00 -1.81 0.00 0.00 57.70 56.03 2yrq n MET 59 Cb 0.77 -2.24 0.18 0.00 -0.71 0.00 0.00 33.22 31.22 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 2.96 2.80 0.32 7.83 1.04 -1.26 -4.73 113.70 122.66 2yrq s SER 60 Ca 0.93 0.56 0.05 0.00 0.48 0.00 0.00 55.95 57.98 2yrq s SER 60 Cb -0.94 -0.81 0.70 0.00 0.10 0.00 0.00 66.02 65.06 2yrq s SER 60 CO 0.58 -2.95 1.85 0.00 0.98 0.00 0.00 173.24 173.70 2yrq h ALA 61 N -1.78 1.69 -0.73 5.32 0.00 -1.98 -1.12 119.26 120.67 2yrq h ALA 61 Ca -0.46 0.02 0.13 0.00 0.00 0.00 0.00 54.91 54.60 2yrq h ALA 61 Cb 1.28 -0.16 -0.09 0.00 0.00 0.00 0.00 17.79 18.82 2yrq h ALA 61 CO 0.45 0.06 0.30 1.57 0.00 0.00 0.00 179.25 181.63 2yrq h LYS 62 N 0.83 0.45 0.33 0.00 2.10 -1.99 0.64 116.57 118.92 2yrq h LYS 62 Ca 0.47 -0.03 -0.02 0.00 -2.00 0.00 0.00 60.65 59.08 2yrq h LYS 62 Cb 0.62 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 31.85 2yrq h LYS 62 CO -0.23 0.30 -0.16 0.93 -2.00 0.00 0.00 179.45 178.28 2yrq h GLU 63 N 0.46 -0.42 -0.70 0.07 4.39 -1.57 -3.23 114.58 113.57 2yrq h GLU 63 Ca 0.39 0.03 0.20 0.00 0.34 0.00 0.00 59.36 60.32 2yrq h GLU 63 Cb 0.55 0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.27 2yrq h GLU 63 CO -0.37 -0.18 0.50 0.87 -1.16 0.00 0.00 179.01 178.67 2yrq h LYS 64 N -1.06 0.01 0.00 2.33 1.57 -1.17 -3.16 116.57 115.09 2yrq h LYS 64 Ca -0.04 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2yrq h LYS 64 Cb 0.44 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2yrq h LYS 64 CO 0.07 0.01 0.00 0.41 -0.57 0.00 0.00 179.45 179.37 2yrq n GLY 65 N -1.67 -3.57 0.34 3.86 0.00 0.22 0.41 105.19 104.78 2yrq n GLY 65 Ca 0.14 0.74 0.05 0.00 0.00 0.00 0.00 46.02 46.95 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 0.00 -0.99 1.61 2.10 -1.72 0.92 116.57 118.50 2yrq h LYS 66 Ca 0.00 -0.00 0.13 0.00 -2.00 0.00 0.00 60.65 58.78 2yrq h LYS 66 Cb 0.00 -0.00 -0.08 0.00 -0.90 0.00 0.00 32.23 31.25 2yrq h LYS 66 CO 0.00 0.00 0.62 0.74 -2.00 0.00 0.00 179.45 178.81 2yrq h PHE 67 N 0.00 1.08 -0.39 0.07 0.04 -1.34 0.54 116.94 116.95 2yrq h PHE 67 Ca 0.45 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 61.22 2yrq h PHE 67 Cb 0.70 -0.34 -0.02 0.00 2.20 0.00 0.00 35.95 38.49 2yrq h PHE 67 CO -0.70 0.41 0.10 0.93 -0.60 0.00 0.00 178.31 178.45 2yrq h GLU 68 N 0.92 0.57 -0.10 1.51 4.39 0.58 -0.02 114.58 122.44 2yrq h GLU 68 Ca 0.50 -0.09 -0.21 0.00 0.34 0.00 0.00 59.36 59.89 2yrq h GLU 68 Cb 0.57 -0.10 0.01 0.00 -0.10 0.00 0.00 28.75 29.12 2yrq h GLU 68 CO -0.27 0.52 -0.80 0.22 -1.16 0.00 0.00 179.01 177.52 2yrq h ASP 69 N 0.56 0.75 -0.06 1.42 3.58 -0.37 -2.58 116.42 119.71 2yrq h ASP 69 Ca 0.13 -0.51 -0.02 0.00 0.42 0.00 0.00 57.03 57.05 2yrq h ASP 69 Cb 0.20 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 41.03 2yrq h ASP 69 CO -0.01 1.29 -0.05 0.24 -2.88 0.00 0.00 179.24 177.84 2yrq h MET 70 N 0.41 0.14 -0.67 0.28 2.86 -0.80 -0.29 114.93 116.86 2yrq h MET 70 Ca -0.05 -0.07 0.04 0.00 -2.06 0.00 0.00 59.70 57.55 2yrq h MET 70 Cb 1.41 -0.00 -0.05 0.00 0.06 0.00 0.00 31.60 33.03 2yrq h MET 70 CO 0.15 0.55 0.41 0.00 1.06 0.00 0.00 176.91 179.08 2yrq h ALA 71 N 0.58 0.88 -0.20 6.32 0.00 -1.09 -2.14 119.26 123.61 2yrq h ALA 71 Ca 0.01 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 2yrq h ALA 71 Cb 0.52 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2yrq h ALA 71 CO 0.01 0.15 -0.47 1.57 0.00 0.00 0.00 179.25 180.51 2yrq h LYS 72 N 0.79 0.52 -0.79 0.00 2.10 -1.46 -3.01 116.57 114.71 2yrq h LYS 72 Ca 0.28 -0.29 0.07 0.00 -2.00 0.00 0.00 60.65 58.71 2yrq h LYS 72 Cb 0.06 0.02 -0.05 0.00 -0.90 0.00 0.00 32.23 31.36 2yrq h LYS 72 CO -0.12 0.88 0.52 0.00 -2.00 0.00 0.00 179.45 178.73 2yrq h ALA 73 N 1.07 1.67 -0.09 0.07 0.00 -0.40 -1.19 119.26 120.37 2yrq h ALA 73 Ca 0.02 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 2yrq h ALA 73 Cb 0.98 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2yrq h ALA 73 CO 0.09 0.20 -0.61 0.22 0.00 0.00 0.00 179.25 179.15 2yrq h ASP 74 N 0.82 0.37 -0.54 0.00 1.82 -1.33 -2.99 116.42 114.57 2yrq h ASP 74 Ca 0.35 -0.21 0.16 0.00 -0.39 0.00 0.00 57.03 56.93 2yrq h ASP 74 Cb 0.29 -0.11 -0.02 0.00 0.68 0.00 0.00 39.33 40.17 2yrq h ASP 74 CO -0.13 0.89 0.49 0.50 -1.61 0.00 0.00 179.24 179.39 2yrq h LYS 75 N 0.24 0.00 0.00 0.28 3.64 -1.12 0.11 116.57 119.72 2yrq h LYS 75 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2yrq h LYS 75 Cb 1.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 2yrq h LYS 75 CO 0.10 0.00 -0.24 0.00 -2.27 0.00 0.00 179.45 177.04 2yrq h ALA 76 N 1.52 0.00 -0.73 5.00 0.00 -1.53 -3.32 119.26 120.20 2yrq h ALA 76 Ca 0.25 -0.26 0.21 0.00 0.00 0.00 0.00 54.91 55.12 2yrq h ALA 76 Cb 1.24 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 19.24 2yrq h ALA 76 CO -0.00 0.24 0.64 0.07 0.00 0.00 0.00 179.25 180.19 2yrq h ARG 77 N -0.84 0.00 -0.51 0.00 -0.00 -1.44 0.32 114.38 111.90 2yrq h ARG 77 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 59.98 59.87 2yrq h ARG 77 Cb 0.24 0.00 -0.02 0.00 -0.00 0.00 0.00 29.97 30.19 2yrq h ARG 77 CO 0.00 0.00 -0.12 -0.92 -0.00 0.00 0.00 179.97 178.93 2yrq h TYR 78 N 0.00 1.06 -1.05 4.08 5.03 -0.94 -2.98 116.97 122.17 2yrq h TYR 78 Ca 0.35 -0.21 0.36 0.00 2.58 0.00 0.00 58.73 61.80 2yrq h TYR 78 Cb 1.62 -0.26 -0.15 0.00 1.55 0.00 0.00 36.73 39.49 2yrq h TYR 78 CO 0.00 1.00 0.61 0.93 -1.32 0.00 0.00 178.16 179.37 2yrq h GLU 79 N 0.85 0.21 -0.73 1.82 5.08 -0.45 -0.19 114.58 121.17 2yrq h GLU 79 Ca 0.13 -0.01 0.18 0.00 -1.00 0.00 0.00 59.36 58.66 2yrq h GLU 79 Cb 0.66 -0.05 -0.14 0.00 0.50 0.00 0.00 28.75 29.72 2yrq h GLU 79 CO 0.05 0.14 -0.05 -2.13 -1.00 0.00 0.00 179.01 176.02 2yrq n ARG 80 N -5.04 -0.06 0.08 2.33 0.00 -1.13 -0.11 116.66 112.73 2yrq n ARG 80 Ca 0.34 1.10 -0.10 0.00 -0.00 0.00 0.00 57.85 59.19 2yrq n ARG 80 Cb 1.12 -1.71 -0.07 0.00 0.00 0.00 0.00 32.46 31.79 2yrq n ARG 80 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2yrq h GLU 81 N 0.00 -0.26 -0.86 -0.14 5.08 -1.26 -3.17 114.58 113.96 2yrq h GLU 81 Ca 0.41 0.02 0.25 0.00 -1.00 0.00 0.00 59.36 59.04 2yrq h GLU 81 Cb 0.78 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.06 2yrq h GLU 81 CO -0.70 0.10 0.94 1.98 -1.00 0.00 0.00 179.01 180.33 2yrq h MET 82 N -0.93 0.00 -0.12 2.33 4.05 -0.56 0.61 114.93 120.31 2yrq h MET 82 Ca -0.03 0.00 -0.07 0.00 -0.28 0.00 0.00 59.70 59.32 2yrq h MET 82 Cb 0.49 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.29 2yrq h MET 82 CO 0.05 0.00 -0.20 -0.22 0.23 0.00 0.00 176.91 176.76 2yrq h LYS 83 N 0.00 0.36 0.00 0.39 3.64 -0.76 -3.16 116.57 117.04 2yrq h LYS 83 Ca 0.41 -0.22 -0.09 0.00 -1.27 0.00 0.00 60.65 59.48 2yrq h LYS 83 Cb 2.28 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 34.11 2yrq h LYS 83 CO -0.00 0.80 -0.42 1.79 -2.27 0.00 0.00 179.45 179.35 2yrq h THR 84 N -0.05 1.20 -3.86 1.00 1.35 0.14 -3.44 112.91 109.26 2yrq h THR 84 Ca 0.01 -1.47 -0.48 0.00 -0.55 0.00 0.00 66.41 63.92 2yrq h THR 84 Cb 0.78 1.82 -0.01 0.00 -1.73 0.00 0.00 68.15 69.00 2yrq h THR 84 CO 0.05 0.41 0.19 -0.47 -0.25 0.00 0.00 175.52 175.45 2yrq s TYR 85 N -3.95 3.38 -0.31 4.73 5.04 -0.64 -5.06 117.35 120.54 2yrq s TYR 85 Ca -0.02 1.31 -0.02 0.00 -2.44 0.00 0.00 57.07 55.91 2yrq s TYR 85 Cb 0.13 -2.63 0.10 0.00 0.35 0.00 0.00 41.96 39.92 2yrq s TYR 85 CO 0.72 -0.04 0.12 0.42 -1.34 0.00 0.00 175.55 175.42 2yrq s ILE 86 N -2.17 0.56 0.97 3.14 1.01 -1.26 -4.89 121.20 118.56 2yrq s ILE 86 Ca 0.56 -1.25 -0.12 0.00 0.00 0.00 0.00 60.65 59.84 2yrq s ILE 86 Cb -0.10 -1.43 0.17 0.00 0.01 0.00 0.00 42.46 41.11 2yrq s ILE 86 CO 0.20 -0.72 1.09 -2.16 0.00 0.00 0.00 174.94 173.36 2yrq s PRO 87 N 1.70 0.63 1.00 2.79 0.04 -1.26 -5.04 135.00 134.87 2yrq s PRO 87 Ca 0.10 0.60 -0.12 0.00 0.04 0.00 0.00 61.00 61.62 2yrq s PRO 87 Cb -0.17 -1.75 0.19 0.00 0.04 0.00 0.00 34.50 32.80 2yrq s PRO 87 CO -0.27 -2.61 1.09 -1.25 0.04 0.00 0.00 177.00 174.00 2yrq s PRO 88 N -4.95 0.41 -0.35 0.56 0.04 -1.26 -4.86 135.00 124.59 2yrq s PRO 88 Ca 0.65 0.52 -0.34 0.00 0.04 0.00 0.00 61.00 61.87 2yrq s PRO 88 Cb -0.18 -1.73 -0.11 0.00 0.04 0.00 0.00 34.50 32.51 2yrq s PRO 88 CO 0.57 -2.75 2.21 1.17 0.04 0.00 0.00 177.00 178.25 2yrq n LYS 89 N -4.19 1.15 -4.36 4.56 3.00 -1.26 -4.90 118.16 112.16 2yrq n LYS 89 Ca 0.05 0.30 -0.22 0.00 -0.00 0.00 0.00 58.31 58.44 2yrq n LYS 89 Cb 0.57 -2.56 -0.08 0.00 0.00 0.00 0.00 35.03 32.96 2yrq n LYS 89 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2yrq s GLY 90 N 7.65 2.50 0.61 3.14 0.00 -1.26 -5.16 107.32 114.80 2yrq s GLY 90 Ca 1.09 -1.79 -0.07 0.00 0.00 0.00 0.00 44.72 43.95 2yrq s GLY 90 CO 0.47 -1.59 0.94 -1.83 0.00 0.00 0.00 173.10 171.09 2yrq s GLU 91 N -3.48 2.97 0.10 2.90 -1.05 -1.26 -5.10 118.70 113.78 2yrq s GLU 91 Ca 0.35 0.15 -0.25 0.00 -0.15 0.00 0.00 54.97 55.07 2yrq s GLU 91 Cb 0.02 -2.21 0.08 0.00 -0.44 0.00 0.00 34.13 31.58 2yrq s GLU 91 CO 0.24 -0.74 0.71 0.99 0.95 0.00 0.00 175.26 177.41 2yrq s THR 92 N -3.07 0.00 0.21 1.83 2.01 -1.26 -5.18 115.64 110.19 2yrq s THR 92 Ca 0.54 -0.04 0.06 0.00 0.31 0.00 0.00 61.69 62.57 2yrq s THR 92 Cb -0.11 -1.04 -0.04 0.00 0.01 0.00 0.00 72.50 71.32 2yrq s THR 92 CO 0.47 0.00 0.18 -1.59 -0.69 0.00 0.00 174.62 172.99 2yrq s LYS 93 N -3.52 2.95 -0.13 4.92 0.00 -1.26 -5.13 119.74 117.57 2yrq s LYS 93 Ca 0.03 -0.95 -0.08 0.00 0.00 0.00 0.00 55.97 54.96 2yrq s LYS 93 Cb -0.01 -2.62 0.04 0.00 0.00 0.00 0.00 37.83 35.24 2yrq s LYS 93 CO -0.11 0.44 0.32 0.15 0.00 0.00 0.00 175.35 176.15 2yrq s LYS 94 N -3.52 0.32 -0.02 1.78 1.02 -1.26 -5.16 119.74 112.90 2yrq s LYS 94 Ca 0.32 0.56 0.01 0.00 0.02 0.00 0.00 55.97 56.88 2yrq s LYS 94 Cb -0.09 0.02 0.02 0.00 -0.52 0.00 0.00 37.83 37.26 2yrq s LYS 94 CO 0.25 -0.12 -0.01 -1.59 -0.92 0.00 0.00 175.35 172.96 2yrq s LYS 95 N 0.87 0.31 -0.30 1.68 -2.85 -1.26 -5.13 119.74 113.07 2yrq s LYS 95 Ca -0.06 0.00 -0.06 0.00 -1.00 0.00 0.00 55.97 54.85 2yrq s LYS 95 Cb -0.07 -0.41 0.02 0.00 -2.06 0.00 0.00 37.83 35.31 2yrq s LYS 95 CO -0.06 -0.06 0.06 -0.59 0.10 0.00 0.00 175.35 174.80 2yrq s PHE 96 N 0.63 3.16 0.02 1.78 -0.71 -1.26 -5.08 117.98 116.53 2yrq s PHE 96 Ca -0.06 -1.18 -0.02 0.00 -1.04 0.00 0.00 56.93 54.63 2yrq s PHE 96 Cb -0.09 -2.23 -0.02 0.00 -1.21 0.00 0.00 43.02 39.47 2yrq s PHE 96 CO -0.01 -0.64 0.01 0.15 -1.34 0.00 0.00 175.22 173.39 2yrq s LYS 97 N 1.45 0.41 -0.89 1.99 -0.14 -1.26 -5.09 119.74 116.21 2yrq s LYS 97 Ca 0.01 -0.69 -0.00 0.00 -1.36 0.00 0.00 55.97 53.92 2yrq s LYS 97 Cb -0.18 0.15 0.27 0.00 -1.68 0.00 0.00 37.83 36.40 2yrq s LYS 97 CO 0.01 -0.08 1.08 -0.25 -0.76 0.00 0.00 175.35 175.35 2yrq n ASP 98 N 1.24 5.04 0.22 2.83 8.00 -1.26 -4.84 116.55 127.79 2yrq n ASP 98 Ca -0.22 -3.36 0.15 0.00 0.71 0.00 0.00 54.79 52.08 2yrq n ASP 98 Cb 0.56 -1.02 0.62 0.00 -0.02 0.00 0.00 41.12 41.26 2yrq n ASP 98 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2yrq h PRO 99 N 5.15 0.00 -0.33 -0.24 0.13 -2.04 -3.00 132.00 131.67 2yrq h PRO 99 Ca 0.19 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.16 2yrq h PRO 99 Cb 0.68 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.80 2yrq h PRO 99 CO 1.06 0.00 -0.41 -0.91 -0.23 0.00 0.00 178.00 177.51 2yrq h ASN 100 N 0.00 0.93 -1.02 1.44 2.35 -2.07 -3.45 115.58 113.76 2yrq h ASN 100 Ca 0.00 -0.49 -0.82 0.00 -0.55 0.00 0.00 56.30 54.44 2yrq h ASN 100 Cb 0.43 -0.26 0.04 0.00 0.05 0.00 0.00 38.32 38.58 2yrq h ASN 100 CO 0.00 1.23 0.28 0.00 -1.65 0.00 0.00 177.43 177.29 2yrq n ALA 101 N -2.54 -2.85 -1.30 -0.83 0.00 -1.14 -4.89 120.51 106.97 2yrq n ALA 101 Ca -0.03 0.56 -0.31 0.00 0.00 0.00 0.00 53.44 53.66 2yrq n ALA 101 Cb 0.55 -1.82 0.08 0.00 0.00 0.00 0.00 19.45 18.27 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 1.00 2.34 -0.03 0.00 0.04 -1.26 -5.05 135.00 132.04 2yrq s PRO 102 Ca 0.95 1.20 -0.03 0.00 0.04 0.00 0.00 61.00 63.16 2yrq s PRO 102 Cb -1.34 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 31.26 2yrq s PRO 102 CO 0.65 -1.58 0.16 -1.59 0.04 0.00 0.00 177.00 174.68 2yrq s LYS 103 N -4.78 3.40 0.23 4.56 -2.85 -1.26 -5.04 119.74 114.00 2yrq s LYS 103 Ca 0.62 -0.30 -0.30 0.00 -1.00 0.00 0.00 55.97 54.99 2yrq s LYS 103 Cb -0.18 -3.09 -0.09 0.00 -2.06 0.00 0.00 37.83 32.42 2yrq s LYS 103 CO 0.54 0.69 1.11 -0.98 0.10 0.00 0.00 175.35 176.81 2yrq s ARG 104 N -1.73 4.61 0.89 1.78 3.03 -1.26 -4.98 118.95 121.29 2yrq s ARG 104 Ca 0.24 1.78 -0.11 0.00 2.03 0.00 0.00 55.73 59.67 2yrq s ARG 104 Cb -0.12 -3.23 0.13 0.00 -1.03 0.00 0.00 34.95 30.70 2yrq s ARG 104 CO 0.15 0.14 1.09 -1.25 -1.13 0.00 0.00 175.30 174.30 2yrq s PRO 105 N -0.94 1.28 0.85 3.89 0.04 -1.26 -5.03 135.00 133.83 2yrq s PRO 105 Ca 0.47 0.82 -0.11 0.00 0.04 0.00 0.00 61.00 62.22 2yrq s PRO 105 Cb -0.31 -1.81 0.10 0.00 0.04 0.00 0.00 34.50 32.52 2yrq s PRO 105 CO 0.38 -2.23 1.09 -1.25 0.04 0.00 0.00 177.00 175.04 2yrq s PRO 106 N -4.94 1.60 0.24 0.56 0.04 -1.26 -5.06 135.00 126.19 2yrq s PRO 106 Ca 0.63 0.94 0.11 0.00 0.04 0.00 0.00 61.00 62.72 2yrq s PRO 106 Cb -0.18 -1.84 -0.05 0.00 0.04 0.00 0.00 34.50 32.48 2yrq s PRO 106 CO 0.57 -2.03 -0.17 -1.12 0.04 0.00 0.00 177.00 174.28 2yrq s SER 107 N -3.42 3.76 0.18 6.66 0.01 -1.26 -4.87 113.70 114.76 2yrq s SER 107 Ca 0.63 -0.88 -0.16 0.00 1.31 0.00 0.00 55.95 56.85 2yrq s SER 107 Cb -0.18 -0.41 0.15 0.00 0.21 0.00 0.00 66.02 65.79 2yrq s SER 107 CO 0.57 0.07 1.25 0.00 0.41 0.00 0.00 173.24 175.53 2yrq n ALA 108 N -0.33 -0.17 -0.30 1.44 0.00 -1.24 0.23 120.51 120.14 2yrq n ALA 108 Ca -0.08 0.78 0.12 0.00 0.00 0.00 0.00 53.44 54.26 2yrq n ALA 108 Cb 0.58 -0.32 0.36 0.00 0.00 0.00 0.00 19.45 20.08 2yrq n ALA 108 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2yrq h PHE 109 N 0.00 0.89 0.22 0.00 3.57 -1.96 -0.83 116.94 118.83 2yrq h PHE 109 Ca 0.25 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.77 2yrq h PHE 109 Cb 0.45 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.92 2yrq h PHE 109 CO -0.73 0.30 -0.10 0.35 -2.23 0.00 0.00 178.31 175.90 2yrq h PHE 110 N 0.72 -0.27 -0.53 0.41 3.04 0.26 -1.92 116.94 118.64 2yrq h PHE 110 Ca 0.48 -0.01 0.11 0.00 3.98 0.00 0.00 57.97 62.53 2yrq h PHE 110 Cb 0.77 0.09 -0.09 0.00 2.56 0.00 0.00 35.95 39.27 2yrq h PHE 110 CO -0.00 0.11 -0.06 -0.07 -2.02 0.00 0.00 178.31 176.27 2yrq h LEU 111 N -0.78 -0.35 0.61 0.59 3.38 -0.39 0.48 115.31 118.86 2yrq h LEU 111 Ca -0.03 0.14 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 2yrq h LEU 111 Cb 0.51 0.27 0.01 0.00 0.09 0.00 0.00 40.66 41.54 2yrq h LEU 111 CO 0.05 -0.13 -0.30 0.15 0.09 0.00 0.00 178.44 178.31 2yrq h PHE 112 N 0.06 -0.76 -0.24 1.13 3.04 -1.22 -1.99 116.94 116.95 2yrq h PHE 112 Ca 0.26 -0.02 0.07 0.00 3.98 0.00 0.00 57.97 62.27 2yrq h PHE 112 Cb 0.41 0.25 -0.01 0.00 2.56 0.00 0.00 35.95 39.16 2yrq h PHE 112 CO -0.38 -0.47 0.18 0.00 -2.02 0.00 0.00 178.31 175.62 2yrq h SER 114 N 0.00 0.00 0.48 0.00 0.87 0.42 0.95 113.55 116.27 2yrq h SER 114 Ca 0.11 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.62 2yrq h SER 114 Cb 0.47 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.42 2yrq h SER 114 CO -0.00 0.16 -1.56 1.21 -0.53 0.00 0.00 176.83 176.11 2yrq n GLU 115 N -3.26 0.64 0.03 2.24 0.00 0.46 -4.17 120.64 116.58 2yrq n GLU 115 Ca 0.01 0.00 0.07 0.00 0.00 0.00 0.00 57.16 57.24 2yrq n GLU 115 Cb 0.44 -1.68 -0.09 0.00 0.00 0.00 0.00 31.44 30.11 2yrq n GLU 115 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2yrq n TYR 116 N -2.55 0.57 -0.05 4.31 4.02 -0.23 -4.33 117.16 118.90 2yrq n TYR 116 Ca -0.06 0.17 -0.08 0.00 -0.01 0.00 0.00 57.90 57.93 2yrq n TYR 116 Cb 0.65 -0.84 -0.01 0.00 -0.02 0.00 0.00 39.34 39.11 2yrq n TYR 116 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 2yrq h ARG 117 N 0.00 -0.17 0.00 -0.72 2.43 -0.97 0.18 114.38 115.13 2yrq h ARG 117 Ca -0.08 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2yrq h ARG 117 Cb 1.24 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.83 2yrq h ARG 117 CO 0.01 -0.11 0.00 -0.35 -1.51 0.00 0.00 179.97 178.01 2yrq n PRO 118 N -5.34 0.28 -0.11 0.20 -0.04 -1.26 -0.31 135.00 128.42 2yrq n PRO 118 Ca -0.01 0.11 -0.17 0.00 -0.04 0.00 0.00 63.50 63.40 2yrq n PRO 118 Cb 0.25 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.08 2yrq n PRO 118 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2yrq n LYS 119 N -1.22 0.67 0.01 0.54 5.02 0.41 -4.19 118.16 119.40 2yrq n LYS 119 Ca 0.08 0.13 -0.17 0.00 -2.02 0.00 0.00 58.31 56.33 2yrq n LYS 119 Cb 0.10 -1.54 -0.14 0.00 -0.02 0.00 0.00 35.03 33.43 2yrq n LYS 119 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 2yrq h ILE 120 N 0.01 0.74 -0.80 -0.18 3.07 -0.74 -3.27 117.51 116.33 2yrq h ILE 120 Ca -0.55 -2.48 0.07 0.00 1.55 0.00 0.00 64.86 63.44 2yrq h ILE 120 Cb 1.98 2.51 -0.06 0.00 -0.27 0.00 0.00 36.82 40.98 2yrq h ILE 120 CO -0.05 0.78 0.48 0.50 -1.05 0.00 0.00 178.15 178.81 2yrq h LYS 121 N 0.05 0.84 -0.16 0.16 3.64 -0.88 0.21 116.57 120.43 2yrq h LYS 121 Ca -0.37 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 58.80 2yrq h LYS 121 Cb 2.03 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 33.66 2yrq h LYS 121 CO 0.10 0.55 -0.57 0.78 -2.27 0.00 0.00 179.45 178.04 2yrq h GLY 122 N 0.86 0.54 0.89 5.01 0.00 -1.73 -3.24 103.07 105.41 2yrq h GLY 122 Ca 0.36 -0.64 -0.11 0.00 0.00 0.00 0.00 47.33 46.94 2yrq h GLY 122 CO -0.19 0.58 -0.31 0.83 0.00 0.00 0.00 176.54 177.45 2yrq h GLU 123 N 0.38 0.57 -3.68 4.80 5.08 -1.43 -3.38 114.58 116.93 2yrq h GLU 123 Ca 0.00 -0.34 -0.70 0.00 -1.00 0.00 0.00 59.36 57.33 2yrq h GLU 123 Cb 1.10 0.03 -0.35 0.00 0.50 0.00 0.00 28.75 30.03 2yrq h GLU 123 CO 0.10 0.94 -0.37 -1.01 -1.00 0.00 0.00 179.01 177.68 2yrq s HIS 124 N -4.16 3.43 -0.09 4.33 3.76 0.67 -4.91 115.29 118.32 2yrq s HIS 124 Ca -0.13 -2.67 0.30 0.00 -0.15 0.00 0.00 55.06 52.41 2yrq s HIS 124 Cb 0.07 -3.21 1.26 0.00 1.11 0.00 0.00 32.58 31.81 2yrq s HIS 124 CO 0.81 -0.86 1.90 -1.00 -0.85 0.00 0.00 174.74 174.74 2yrq h PRO 125 N 7.13 0.00 0.22 8.40 0.13 -1.76 -3.10 132.00 143.02 2yrq h PRO 125 Ca -0.02 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.80 2yrq h PRO 125 Cb 0.96 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.12 2yrq h PRO 125 CO 0.71 0.00 -1.38 0.78 -0.23 0.00 0.00 178.00 177.88 2yrq h GLY 126 N 2.04 0.53 -5.68 1.56 0.00 -1.91 -3.46 103.07 96.16 2yrq h GLY 126 Ca 0.00 -1.36 -0.70 0.00 0.00 0.00 0.00 47.33 45.28 2yrq h GLY 126 CO 0.00 1.19 0.56 1.04 0.00 0.00 0.00 176.54 179.33 2yrq n LEU 127 N -3.80 1.82 -4.95 3.11 4.77 -1.17 -4.95 117.00 111.83 2yrq n LEU 127 Ca -0.18 1.11 -0.23 0.00 -0.03 0.00 0.00 56.01 56.68 2yrq n LEU 127 Cb 1.04 -1.17 -0.02 0.00 -2.33 0.00 0.00 43.42 40.94 2yrq n LEU 127 CO 0.56 -0.90 0.10 -0.94 -1.33 0.00 0.00 177.39 174.88 2yrq s SER 128 N 1.26 6.31 0.27 -1.43 1.04 -1.26 -4.69 113.70 115.21 2yrq s SER 128 Ca 0.88 0.34 0.07 0.00 0.48 0.00 0.00 55.95 57.72 2yrq s SER 128 Cb -0.99 -1.98 0.80 0.00 0.10 0.00 0.00 66.02 63.96 2yrq s SER 128 CO 0.52 -0.20 1.28 -0.38 0.98 0.00 0.00 173.24 175.43 2yrq n ILE 129 N -1.54 -0.34 0.21 -1.02 5.41 -1.26 0.30 119.36 121.11 2yrq n ILE 129 Ca -0.06 1.74 -0.15 0.00 1.00 0.00 0.00 62.75 65.28 2yrq n ILE 129 Cb 0.56 -2.64 -0.08 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 -0.54 0.83 7.39 0.00 -2.01 -2.95 103.07 105.79 2yrq h GLY 130 Ca 0.57 0.20 -0.04 0.00 0.00 0.00 0.00 47.33 48.06 2yrq h GLY 130 CO -0.71 -0.20 -0.37 -0.55 0.00 0.00 0.00 176.54 174.72 2yrq h ASP 131 N -0.67 -0.87 -0.82 0.19 3.32 -0.52 -2.99 116.42 114.06 2yrq h ASP 131 Ca -0.05 0.02 0.34 0.00 0.02 0.00 0.00 57.03 57.35 2yrq h ASP 131 Cb 0.48 0.22 -0.14 0.00 0.22 0.00 0.00 39.33 40.11 2yrq h ASP 131 CO 0.09 -0.52 0.46 0.52 -1.72 0.00 0.00 179.24 178.06 2yrq n VAL 132 N -5.47 -0.32 0.10 -1.35 0.31 0.99 0.14 118.33 112.73 2yrq n VAL 132 Ca -0.13 1.59 -0.13 0.00 -0.01 0.00 0.00 64.34 65.65 2yrq n VAL 132 Cb 0.41 -2.58 -0.07 0.00 -0.91 0.00 0.00 33.84 30.69 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 1.55 -0.17 -1.00 3.52 0.00 -1.36 -2.53 119.26 119.26 2yrq h ALA 133 Ca 0.67 -0.05 0.22 0.00 0.00 0.00 0.00 54.91 55.76 2yrq h ALA 133 Cb 1.83 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 19.59 2yrq h ALA 133 CO -0.58 -0.59 0.62 0.87 0.00 0.00 0.00 179.25 179.57 2yrq h LYS 134 N -0.19 0.56 0.00 0.00 6.56 0.12 0.65 116.57 124.27 2yrq h LYS 134 Ca -0.02 -0.03 -0.01 0.00 -1.06 0.00 0.00 60.65 59.53 2yrq h LYS 134 Cb 0.15 -0.13 -0.00 0.00 -0.57 0.00 0.00 32.23 31.68 2yrq h LYS 134 CO 0.03 0.37 -0.05 -0.22 -2.06 0.00 0.00 179.45 177.52 2yrq h LYS 135 N 0.58 0.00 0.03 3.15 1.63 -1.19 -2.31 116.57 118.45 2yrq h LYS 135 Ca 0.58 0.00 -0.32 0.00 -0.85 0.00 0.00 60.65 60.06 2yrq h LYS 135 Cb 1.16 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.75 2yrq h LYS 135 CO -0.34 0.05 -1.85 1.28 -3.45 0.00 0.00 179.45 175.14 2yrq n LEU 136 N -4.03 1.28 -0.31 5.20 4.77 0.21 -3.38 117.00 120.73 2yrq n LEU 136 Ca -0.03 0.32 0.06 0.00 -0.03 0.00 0.00 56.01 56.34 2yrq n LEU 136 Cb 0.14 -0.14 0.26 0.00 -2.33 0.00 0.00 43.42 41.35 2yrq n LEU 136 CO 0.31 0.52 1.24 1.23 -1.33 0.00 0.00 177.39 179.36 2yrq h GLY 137 N 2.93 1.39 0.31 -0.72 0.00 -0.35 -2.74 103.07 103.89 2yrq h GLY 137 Ca -0.35 -0.40 -0.11 0.00 0.00 0.00 0.00 47.33 46.48 2yrq h GLY 137 CO 0.07 0.22 -0.49 1.05 0.00 0.00 0.00 176.54 177.39 2yrq h GLU 138 N 0.96 0.14 -0.97 4.80 4.11 -1.68 -3.29 114.58 118.65 2yrq h GLU 138 Ca 0.43 -0.23 0.11 0.00 0.07 0.00 0.00 59.36 59.74 2yrq h GLU 138 Cb 0.37 0.09 -0.13 0.00 0.50 0.00 0.00 28.75 29.58 2yrq h GLU 138 CO -0.19 1.11 -0.50 -1.33 0.07 0.00 0.00 179.01 178.18 2yrq n MET 139 N -4.36 -0.35 -0.32 1.06 2.81 -1.09 0.78 117.12 115.66 2yrq n MET 139 Ca -0.14 1.48 0.04 0.00 -1.81 0.00 0.00 57.70 57.27 2yrq n MET 139 Cb 0.66 -2.19 0.18 0.00 -0.71 0.00 0.00 33.22 31.17 2yrq n MET 139 CO 0.00 0.00 0.00 2.35 1.51 0.00 0.00 175.97 179.83 2yrq h TRP 140 N 0.00 0.98 0.00 2.03 -0.00 -1.65 0.95 115.95 118.26 2yrq h TRP 140 Ca 0.23 0.03 -0.03 0.00 -0.00 0.00 0.00 58.89 59.12 2yrq h TRP 140 Cb 0.47 -0.31 -0.00 0.00 -0.00 0.00 0.00 29.16 29.32 2yrq h TRP 140 CO -0.94 0.42 -0.13 -0.91 -0.00 0.00 0.00 178.44 176.88 2yrq h ASN 141 N 0.90 0.00 -0.91 2.65 2.35 0.30 -2.12 115.58 118.75 2yrq h ASN 141 Ca 0.42 0.00 -0.43 0.00 -0.55 0.00 0.00 56.30 55.75 2yrq h ASN 141 Cb 0.35 0.00 -0.25 0.00 0.05 0.00 0.00 38.32 38.47 2yrq h ASN 141 CO -0.24 0.13 0.53 0.59 -1.65 0.00 0.00 177.43 176.79 2yrq n ASN 142 N -3.55 4.04 -4.55 5.81 3.02 0.62 -4.94 115.26 115.71 2yrq n ASN 142 Ca -0.01 -3.51 -0.29 0.00 -0.03 0.00 0.00 54.58 50.74 2yrq n ASN 142 Cb 0.26 -0.81 -0.10 0.00 -0.61 0.00 0.00 39.78 38.52 2yrq n ASN 142 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2yrq s THR 143 N -3.21 3.20 0.26 3.41 2.01 -0.80 -5.00 115.64 115.51 2yrq s THR 143 Ca 0.56 -1.37 -0.06 0.00 0.31 0.00 0.00 61.69 61.13 2yrq s THR 143 Cb 0.47 -2.50 -0.06 0.00 0.01 0.00 0.00 72.50 70.42 2yrq s THR 143 CO 0.11 0.09 0.54 0.00 -0.69 0.00 0.00 174.62 174.67 2yrq s ALA 144 N -1.24 3.63 0.28 7.40 0.00 -1.26 -4.98 121.76 125.58 2yrq s ALA 144 Ca 0.21 -0.49 0.01 0.00 0.00 0.00 0.00 51.96 51.69 2yrq s ALA 144 Cb -0.11 -2.31 0.62 0.00 0.00 0.00 0.00 23.12 21.31 2yrq s ALA 144 CO 0.13 0.35 1.75 0.00 0.00 0.00 0.00 175.76 177.99 2yrq h ALA 145 N 1.99 1.40 -0.09 0.00 0.00 -1.99 0.27 119.26 120.84 2yrq h ALA 145 Ca -0.47 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 2yrq h ALA 145 Cb 1.18 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2yrq h ALA 145 CO 0.67 -0.12 0.05 0.22 0.00 0.00 0.00 179.25 180.07 2yrq h ASP 146 N 0.62 0.11 -0.17 0.00 3.58 -2.01 0.70 116.42 119.24 2yrq h ASP 146 Ca 0.51 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.95 2yrq h ASP 146 Cb 0.78 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.80 2yrq h ASP 146 CO -0.40 0.09 0.00 0.47 -2.88 0.00 0.00 179.24 176.53 2yrq n ASP 147 N -4.51 1.25 0.00 2.28 9.92 0.95 -3.33 116.55 123.11 2yrq n ASP 147 Ca -0.02 -2.05 0.00 0.00 -0.53 0.00 0.00 54.79 52.19 2yrq n ASP 147 Cb 0.09 -0.22 0.00 0.00 -0.64 0.00 0.00 41.12 40.35 2yrq n ASP 147 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2yrq n LYS 148 N 0.06 2.69 -0.24 -1.24 5.02 0.18 -4.69 118.16 119.94 2yrq n LYS 148 Ca 0.06 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.34 2yrq n LYS 148 Cb 0.23 -0.72 0.05 0.00 -0.02 0.00 0.00 35.03 34.58 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 0.00 -0.06 -0.33 1.97 5.75 -1.39 0.39 115.11 121.45 2yrq h GLN 149 Ca 0.00 0.00 -0.15 0.00 -0.15 0.00 0.00 58.65 58.35 2yrq h GLN 149 Cb 0.00 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.56 2yrq h GLN 149 CO 0.00 -0.04 -0.40 -1.00 -2.65 0.00 0.00 178.83 174.74 2yrq h PRO 150 N -0.06 0.80 0.00 -2.39 0.13 -1.87 0.19 132.00 128.80 2yrq h PRO 150 Ca 0.31 -0.42 -0.04 0.00 -0.87 0.00 0.00 66.00 64.98 2yrq h PRO 150 Cb 0.54 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.68 2yrq h PRO 150 CO -0.73 1.05 -0.18 1.88 -0.23 0.00 0.00 178.00 179.79 2yrq h TYR 151 N 0.65 0.00 0.00 1.56 0.05 -1.37 -2.72 116.97 115.15 2yrq h TYR 151 Ca 0.05 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.83 2yrq h TYR 151 Cb 0.96 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.70 2yrq h TYR 151 CO 0.05 0.18 -0.61 0.39 -1.05 0.00 0.00 178.16 177.12 2yrq n GLU 152 N -3.63 0.42 -0.38 4.88 1.02 0.12 -3.54 120.64 119.53 2yrq n GLU 152 Ca -0.01 0.38 0.34 0.00 -0.02 0.00 0.00 57.16 57.85 2yrq n GLU 152 Cb 0.31 -1.48 0.61 0.00 -0.02 0.00 0.00 31.44 30.85 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 -0.88 0.04 -0.06 3.49 1.79 -0.72 0.71 116.57 120.93 2yrq h LYS 153 Ca 0.00 -0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.41 2yrq h LYS 153 Cb 0.61 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.25 2yrq h LYS 153 CO 0.00 0.02 -0.17 -0.22 -1.08 0.00 0.00 179.45 178.01 2yrq h LYS 154 N 0.04 0.23 -0.07 3.15 1.63 -1.68 -3.10 116.57 116.77 2yrq h LYS 154 Ca 0.85 -0.16 0.00 0.00 -0.85 0.00 0.00 60.65 60.49 2yrq h LYS 154 Cb 2.40 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 34.05 2yrq h LYS 154 CO -0.63 0.77 0.03 0.00 -3.45 0.00 0.00 179.45 176.16 2yrq h ALA 155 N 0.46 0.08 -0.62 5.00 0.00 0.21 -2.84 119.26 121.54 2yrq h ALA 155 Ca -0.00 0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.04 2yrq h ALA 155 Cb 0.77 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.44 2yrq h ALA 155 CO 0.04 -0.44 -0.09 0.00 0.00 0.00 0.00 179.25 178.76 2yrq h ALA 156 N 1.03 0.50 -0.88 0.00 0.00 -0.71 0.11 119.26 119.31 2yrq h ALA 156 Ca 0.03 0.22 0.21 0.00 0.00 0.00 0.00 54.91 55.37 2yrq h ALA 156 Cb 0.00 0.41 -0.12 0.00 0.00 0.00 0.00 17.79 18.09 2yrq h ALA 156 CO -0.02 -0.42 0.39 0.87 0.00 0.00 0.00 179.25 180.07 2yrq h LYS 157 N 0.04 0.41 -0.05 0.00 1.79 -1.42 0.32 116.57 117.66 2yrq h LYS 157 Ca 0.31 -0.02 -0.15 0.00 -2.18 0.00 0.00 60.65 58.61 2yrq h LYS 157 Cb 0.50 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 31.04 2yrq h LYS 157 CO -0.60 0.27 -0.63 -0.07 -1.08 0.00 0.00 179.45 177.35 2yrq h LEU 158 N 0.42 0.23 -0.65 2.94 3.38 -0.82 -3.17 115.31 117.65 2yrq h LEU 158 Ca 0.54 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 58.39 2yrq h LEU 158 Cb 0.99 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.64 2yrq h LEU 158 CO -0.51 0.80 0.42 0.50 0.09 0.00 0.00 178.44 179.74 2yrq h LYS 159 N 0.15 0.81 -0.69 1.13 1.63 0.94 -2.49 116.57 118.04 2yrq h LYS 159 Ca -0.01 -0.05 0.14 0.00 -0.85 0.00 0.00 60.65 59.89 2yrq h LYS 159 Cb 1.14 -0.18 -0.10 0.00 -0.60 0.00 0.00 32.23 32.48 2yrq h LYS 159 CO 0.10 0.53 0.13 0.93 -3.45 0.00 0.00 179.45 177.69 2yrq h GLU 160 N 0.83 0.23 -0.30 1.90 4.39 -1.32 0.30 114.58 120.61 2yrq h GLU 160 Ca 0.25 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.93 2yrq h GLU 160 Cb -0.04 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.54 2yrq h GLU 160 CO -0.08 0.15 0.17 -0.22 -1.16 0.00 0.00 179.01 177.88 2yrq h LYS 161 N 0.24 0.42 0.61 2.33 1.63 -1.57 -2.45 116.57 117.78 2yrq h LYS 161 Ca 0.38 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 60.11 2yrq h LYS 161 Cb 0.63 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 32.16 2yrq h LYS 161 CO -0.49 0.35 -0.40 -0.92 -3.45 0.00 0.00 179.45 174.53 2yrq h TYR 162 N 0.37 -1.08 -1.06 1.91 3.20 -0.87 0.14 116.97 119.58 2yrq h TYR 162 Ca 0.11 -0.01 0.29 0.00 3.14 0.00 0.00 58.73 62.26 2yrq h TYR 162 Cb 0.05 0.39 -0.11 0.00 1.54 0.00 0.00 36.73 38.59 2yrq h TYR 162 CO -0.03 -0.60 0.65 0.93 -1.64 0.00 0.00 178.16 177.47 2yrq h GLU 163 N -0.97 0.39 -0.10 1.82 5.08 -0.97 0.18 114.58 120.01 2yrq h GLU 163 Ca -0.07 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.21 2yrq h GLU 163 Cb 0.80 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.96 2yrq h GLU 163 CO 0.06 0.26 -0.16 0.87 -1.00 0.00 0.00 179.01 179.04 2yrq h LYS 164 N 0.40 0.28 0.32 2.33 1.79 -0.93 0.42 116.57 121.19 2yrq h LYS 164 Ca 0.66 -0.17 -0.01 0.00 -2.18 0.00 0.00 60.65 58.94 2yrq h LYS 164 Cb 1.57 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 32.24 2yrq h LYS 164 CO -0.41 0.75 -0.17 -0.44 -1.08 0.00 0.00 179.45 178.10 2yrq h ASP 165 N -0.16 -0.42 -0.55 0.86 3.32 0.12 -2.99 116.42 116.59 2yrq h ASP 165 Ca 0.01 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.03 2yrq h ASP 165 Cb 0.73 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.37 2yrq h ASP 165 CO 0.04 -0.29 0.14 -0.29 -1.72 0.00 0.00 179.24 177.12 2yrq h ILE 166 N -0.46 1.24 -1.21 0.35 2.10 -0.86 -2.87 117.51 115.80 2yrq h ILE 166 Ca -0.04 -0.86 0.44 0.00 1.08 0.00 0.00 64.86 65.48 2yrq h ILE 166 Cb 0.37 0.75 -0.14 0.00 -1.09 0.00 0.00 36.82 36.71 2yrq h ILE 166 CO 0.05 0.32 0.76 0.00 -1.08 0.00 0.00 178.15 178.20 2yrq n ALA 167 N -2.39 1.21 0.04 0.18 0.00 0.14 0.13 120.51 119.81 2yrq n ALA 167 Ca 0.02 0.85 -0.19 0.00 0.00 0.00 0.00 53.44 54.11 2yrq n ALA 167 Cb 0.22 -0.99 -0.13 0.00 0.00 0.00 0.00 19.45 18.56 2yrq n ALA 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yrq h ALA 168 N 1.58 -0.02 -0.38 0.00 0.00 -1.51 -2.88 119.26 116.05 2yrq h ALA 168 Ca 0.82 -0.66 0.08 0.00 0.00 0.00 0.00 54.91 55.15 2yrq h ALA 168 Cb 2.54 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 20.32 2yrq h ALA 168 CO -0.50 0.41 -0.21 -0.92 0.00 0.00 0.00 179.25 178.03 2yrq h TYR 169 N -0.17 -0.55 -0.64 0.00 5.03 0.11 -1.08 116.97 119.67 2yrq h TYR 169 Ca -0.13 0.05 -0.07 0.00 2.58 0.00 0.00 58.73 61.16 2yrq h TYR 169 Cb 1.56 0.30 -0.03 0.00 1.55 0.00 0.00 36.73 40.12 2yrq h TYR 169 CO 0.17 -0.29 0.12 0.07 -1.32 0.00 0.00 178.16 176.90 2yrq h ARG 170 N -0.15 1.05 -0.72 1.82 0.11 -1.46 -3.43 114.38 111.59 2yrq h ARG 170 Ca 0.19 -0.27 0.16 0.00 0.10 0.00 0.00 59.98 60.15 2yrq h ARG 170 Cb 0.44 -0.13 -0.21 0.00 1.11 0.00 0.00 29.97 31.18 2yrq h ARG 170 CO -0.47 0.96 -0.06 0.00 0.10 0.00 0.00 179.97 180.49 2yrq s ALA 171 N -5.24 -2.81 -0.87 0.08 0.00 -0.50 -5.09 121.76 107.33 2yrq s ALA 171 Ca -0.12 1.68 -0.25 0.00 0.00 0.00 0.00 51.96 53.27 2yrq s ALA 171 Cb 0.14 -2.31 -0.09 0.00 0.00 0.00 0.00 23.12 20.86 2yrq s ALA 171 CO 0.84 -1.36 2.15 0.15 0.00 0.00 0.00 175.76 177.53 2yrq s LYS 172 N 2.89 2.10 0.00 0.00 1.02 -0.64 -4.17 119.74 120.94 2yrq s LYS 172 Ca 0.09 -0.00 0.00 0.00 0.02 0.00 0.00 55.97 56.08 2yrq s LYS 172 Cb -0.12 -4.95 0.00 0.00 -0.52 0.00 0.00 37.83 32.24 2yrq s LYS 172 CO -0.16 -3.93 0.00 0.41 -0.92 0.00 0.00 175.35 170.74