#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 0.75 -0.19 1.61 0.15 -1.26 -5.14 113.70 109.62 2yrq s SER 2 Ca 0.00 -0.79 -0.12 0.00 0.70 0.00 0.00 55.95 55.74 2yrq s SER 2 Cb 0.00 0.10 -0.05 0.00 -1.71 0.00 0.00 66.02 64.37 2yrq s SER 2 CO 0.00 -0.39 0.23 -0.44 1.20 0.00 0.00 173.24 173.84 2yrq s SER 3 N -2.33 6.31 0.33 5.45 0.01 -1.26 -5.05 113.70 117.17 2yrq s SER 3 Ca -0.00 0.36 -0.28 0.00 1.31 0.00 0.00 55.95 57.34 2yrq s SER 3 Cb -0.01 -2.15 -0.13 0.00 0.21 0.00 0.00 66.02 63.95 2yrq s SER 3 CO -0.04 0.10 1.19 0.61 0.41 0.00 0.00 173.24 175.51 2yrq n GLY 4 N 3.62 0.28 3.58 3.44 0.00 -1.26 -4.84 105.19 110.01 2yrq n GLY 4 Ca -0.13 0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.42 6.40 0.91 1.61 1.04 -1.26 -4.66 113.70 117.33 2yrq s SER 5 Ca 0.57 -2.14 -0.12 0.00 0.48 0.00 0.00 55.95 54.73 2yrq s SER 5 Cb -0.61 -2.58 0.14 0.00 0.10 0.00 0.00 66.02 63.07 2yrq s SER 5 CO 0.61 -1.63 1.13 -0.55 0.98 0.00 0.00 173.24 173.78 2yrq s SER 6 N 4.86 3.45 0.00 7.02 0.15 -1.26 -4.98 113.70 122.94 2yrq s SER 6 Ca 0.56 1.02 0.00 0.00 0.70 0.00 0.00 55.95 58.24 2yrq s SER 6 Cb 0.02 -1.63 0.00 0.00 -1.71 0.00 0.00 66.02 62.71 2yrq s SER 6 CO 0.07 -2.59 0.00 0.61 1.20 0.00 0.00 173.24 172.53 2yrq n GLY 7 N -2.04 1.45 3.40 9.45 0.00 -1.26 -5.00 105.19 111.19 2yrq n GLY 7 Ca 0.06 -0.01 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 2yrq n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2yrq s MET 8 N 0.00 0.71 0.48 1.61 0.23 -1.26 -5.13 119.30 115.95 2yrq s MET 8 Ca 0.00 0.44 0.00 0.00 -1.03 0.00 0.00 55.69 55.10 2yrq s MET 8 Cb 0.00 0.34 0.00 0.00 -1.53 0.00 0.00 34.83 33.64 2yrq s MET 8 CO 0.00 -0.15 0.00 0.41 -2.03 0.00 0.00 175.02 173.25 2yrq n GLY 9 N 2.11 -4.26 3.83 3.16 0.00 -1.26 -4.93 105.19 103.84 2yrq n GLY 9 Ca -0.16 -0.81 -0.37 0.00 0.00 0.00 0.00 46.02 44.68 2yrq n GLY 9 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2yrq s LYS 10 N -4.44 3.74 0.13 1.61 2.36 -1.26 -4.86 119.74 117.02 2yrq s LYS 10 Ca 0.00 -0.06 0.00 0.00 -2.55 0.00 0.00 55.97 53.36 2yrq s LYS 10 Cb 0.00 -3.27 0.00 0.00 -1.05 0.00 0.00 37.83 33.51 2yrq s LYS 10 CO 0.00 0.61 0.00 0.41 1.55 0.00 0.00 175.35 177.92 2yrq n GLY 11 N 2.42 -1.02 3.71 5.54 0.00 -1.26 -5.14 105.19 109.43 2yrq n GLY 11 Ca -0.18 0.27 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.00 5.15 0.00 1.61 1.11 -1.26 -5.00 116.67 116.28 2yrq s ASP 12 Ca 0.00 -0.13 0.14 0.00 0.18 0.00 0.00 52.55 52.75 2yrq s ASP 12 Cb 0.00 -1.27 0.65 0.00 1.07 0.00 0.00 42.92 43.36 2yrq s ASP 12 CO 0.00 0.18 1.44 -0.81 1.18 0.00 0.00 175.17 177.16 2yrq n PRO 13 N 0.61 0.06 0.11 8.23 -0.04 -1.26 -3.31 135.00 139.40 2yrq n PRO 13 Ca -0.11 0.22 -0.13 0.00 -0.04 0.00 0.00 63.50 63.45 2yrq n PRO 13 Cb 0.52 -1.50 -0.07 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 -0.18 -6.22 0.54 1.57 -2.03 -3.41 116.57 106.84 2yrq h LYS 14 Ca 0.00 0.01 -0.56 0.00 -1.87 0.00 0.00 60.65 58.23 2yrq h LYS 14 Cb 0.21 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.54 2yrq h LYS 14 CO 0.00 -0.11 1.01 0.15 -0.57 0.00 0.00 179.45 179.93 2yrq s LYS 15 N -6.13 4.12 0.11 3.15 1.02 -1.21 -4.97 119.74 115.82 2yrq s LYS 15 Ca -0.14 1.80 -0.31 0.00 0.02 0.00 0.00 55.97 57.34 2yrq s LYS 15 Cb 0.05 -3.89 -0.08 0.00 -0.52 0.00 0.00 37.83 33.40 2yrq s LYS 15 CO 0.65 -0.89 1.37 -1.25 -0.92 0.00 0.00 175.35 174.31 2yrq s PRO 16 N 3.93 4.33 0.58 -1.68 0.04 -1.26 -4.98 135.00 135.96 2yrq s PRO 16 Ca 0.64 2.03 0.06 0.00 0.04 0.00 0.00 61.00 63.78 2yrq s PRO 16 Cb -0.26 -3.27 0.08 0.00 0.04 0.00 0.00 34.50 31.09 2yrq s PRO 16 CO 0.23 -0.42 0.80 1.03 0.04 0.00 0.00 177.00 178.68 2yrq s ARG 17 N 1.13 2.27 0.00 4.56 3.00 -1.26 -4.92 118.95 123.73 2yrq s ARG 17 Ca 0.64 -1.39 0.00 0.00 0.00 0.00 0.00 55.73 54.97 2yrq s ARG 17 Cb -0.36 -2.59 0.00 0.00 0.00 0.00 0.00 34.95 32.01 2yrq s ARG 17 CO 0.30 -0.88 0.00 0.41 0.00 0.00 0.00 175.30 175.13 2yrq n GLY 18 N -2.32 1.36 2.89 -3.53 0.00 -1.26 -5.08 105.19 97.25 2yrq n GLY 18 Ca 0.14 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 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 0.00 -4.25 1.61 5.02 -1.26 -4.97 118.16 114.31 2yrq n LYS 19 Ca 0.00 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.11 2yrq n LYS 19 Cb 0.00 -0.85 -0.13 0.00 -0.02 0.00 0.00 35.03 34.03 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 -0.85 0.76 0.74 1.97 -1.94 -1.26 -5.13 119.30 113.58 2yrq s MET 20 Ca 0.54 -0.68 -0.05 0.00 -1.71 0.00 0.00 55.69 53.78 2yrq s MET 20 Cb -0.75 -0.71 0.11 0.00 2.01 0.00 0.00 34.83 35.49 2yrq s MET 20 CO 0.49 0.17 1.03 -1.12 -0.01 0.00 0.00 175.02 175.58 2yrq s SER 21 N -1.12 4.38 0.15 3.03 0.01 -1.26 -4.78 113.70 114.11 2yrq s SER 21 Ca -0.01 0.05 -0.30 0.00 1.31 0.00 0.00 55.95 57.00 2yrq s SER 21 Cb -0.08 -0.51 -0.04 0.00 0.21 0.00 0.00 66.02 65.60 2yrq s SER 21 CO 0.01 -1.85 1.55 0.28 0.41 0.00 0.00 173.24 173.64 2yrq h SER 22 N -0.68 -1.83 0.55 2.44 0.02 -1.90 -1.59 113.55 110.56 2yrq h SER 22 Ca -0.41 0.27 -0.02 0.00 -0.84 0.00 0.00 61.79 60.79 2yrq h SER 22 Cb 1.28 0.79 -0.00 0.00 0.14 0.00 0.00 62.40 64.61 2yrq h SER 22 CO 0.47 -0.34 -0.35 0.22 -1.14 0.00 0.00 176.83 175.70 2yrq h TYR 23 N -0.23 -0.92 -0.80 3.45 3.20 -1.94 0.13 116.97 119.85 2yrq h TYR 23 Ca 0.14 -0.01 0.31 0.00 3.14 0.00 0.00 58.73 62.30 2yrq h TYR 23 Cb 0.54 0.33 -0.11 0.00 1.54 0.00 0.00 36.73 39.03 2yrq h TYR 23 CO -0.81 -0.51 0.47 0.00 -1.64 0.00 0.00 178.16 175.67 2yrq n ALA 24 N -2.54 0.81 -0.07 1.82 0.00 -0.97 0.37 120.51 119.92 2yrq n ALA 24 Ca -0.10 0.67 -0.10 0.00 0.00 0.00 0.00 53.44 53.90 2yrq n ALA 24 Cb 0.35 -0.72 -0.07 0.00 0.00 0.00 0.00 19.45 19.01 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 -0.87 0.00 0.04 -0.85 -3.33 116.94 111.93 2yrq h PHE 25 Ca 0.60 0.00 0.22 0.00 2.80 0.00 0.00 57.97 61.59 2yrq h PHE 25 Cb 1.73 0.00 -0.13 0.00 2.20 0.00 0.00 35.95 39.75 2yrq h PHE 25 CO -0.01 0.66 0.31 0.35 -0.60 0.00 0.00 178.31 179.03 2yrq h PHE 26 N -1.00 0.49 -0.13 -0.55 3.57 0.27 0.93 116.94 120.52 2yrq h PHE 26 Ca -0.06 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.52 2yrq h PHE 26 Cb 0.69 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 2yrq h PHE 26 CO 0.10 -0.12 0.11 0.28 -2.23 0.00 0.00 178.31 176.45 2yrq h VAL 27 N 0.30 0.75 0.00 1.41 2.07 -0.75 -0.87 116.25 119.17 2yrq h VAL 27 Ca 0.54 0.00 -0.26 0.00 0.82 0.00 0.00 66.70 67.80 2yrq h VAL 27 Cb 1.06 0.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.70 2yrq h VAL 27 CO -0.58 0.00 -1.76 1.67 0.02 0.00 0.00 177.57 176.92 2yrq n GLN 28 N -4.23 0.64 -0.11 1.57 7.27 0.28 -3.23 117.38 119.57 2yrq n GLN 28 Ca 0.00 0.20 -0.11 0.00 0.07 0.00 0.00 57.00 57.17 2yrq n GLN 28 Cb 0.23 -1.74 0.03 0.00 2.41 0.00 0.00 30.24 31.17 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 1.27 0.03 1.69 2.02 0.62 -2.71 112.91 115.83 2yrq h THR 29 Ca -0.29 -1.44 -0.00 0.00 0.77 0.00 0.00 66.41 65.44 2yrq h THR 29 Cb 1.90 1.26 0.00 0.00 -1.74 0.00 0.00 68.15 69.58 2yrq h THR 29 CO 0.06 0.49 -0.01 0.00 0.37 0.00 0.00 175.52 176.42 2yrq h ARG 31 N -0.87 0.46 -0.64 0.00 0.11 -1.62 0.39 114.38 112.21 2yrq h ARG 31 Ca -0.00 -0.03 -0.05 0.00 0.10 0.00 0.00 59.98 60.00 2yrq h ARG 31 Cb 0.71 -0.10 -0.03 0.00 1.11 0.00 0.00 29.97 31.66 2yrq h ARG 31 CO 0.01 0.31 0.21 0.93 0.10 0.00 0.00 179.97 181.53 2yrq h GLU 32 N 0.48 0.97 -0.97 0.08 5.08 -1.56 -2.52 114.58 116.14 2yrq h GLU 32 Ca 0.62 -0.18 0.08 0.00 -1.00 0.00 0.00 59.36 58.89 2yrq h GLU 32 Cb 1.22 -0.15 -0.07 0.00 0.50 0.00 0.00 28.75 30.25 2yrq h GLU 32 CO -0.52 0.82 0.62 0.93 -1.00 0.00 0.00 179.01 179.87 2yrq h GLU 33 N 0.94 1.03 0.47 2.33 5.08 -0.21 -2.46 114.58 121.76 2yrq h GLU 33 Ca 0.21 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 2yrq h GLU 33 Cb 0.25 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2yrq h GLU 33 CO -0.01 0.68 -0.23 1.25 -1.00 0.00 0.00 179.01 179.70 2yrq h HIS 34 N 1.06 -0.59 -1.42 4.33 2.76 -1.22 -2.45 115.15 117.62 2yrq h HIS 34 Ca 0.44 -0.01 0.41 0.00 -2.20 0.00 0.00 60.37 59.01 2yrq h HIS 34 Cb 0.29 0.19 -0.06 0.00 1.55 0.00 0.00 27.41 29.39 2yrq h HIS 34 CO -0.00 -0.28 1.10 0.87 -1.30 0.00 0.00 177.93 178.32 2yrq h LYS 35 N -1.05 0.00 0.07 5.26 6.56 -1.27 0.61 116.57 126.75 2yrq h LYS 35 Ca -0.06 0.00 -0.13 0.00 -1.06 0.00 0.00 60.65 59.39 2yrq h LYS 35 Cb 0.57 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.25 2yrq h LYS 35 CO 0.11 0.00 -0.56 0.87 -2.06 0.00 0.00 179.45 177.80 2yrq h LYS 36 N 0.00 0.25 -0.44 3.15 1.57 -1.33 -2.99 116.57 116.79 2yrq h LYS 36 Ca 0.67 -0.37 -0.05 0.00 -1.87 0.00 0.00 60.65 59.04 2yrq h LYS 36 Cb 2.86 0.13 -0.02 0.00 0.08 0.00 0.00 32.23 35.28 2yrq h LYS 36 CO -0.01 1.13 0.08 0.87 -0.57 0.00 0.00 179.45 180.96 2yrq h LYS 37 N -0.44 0.71 -3.02 3.15 1.57 0.54 -3.39 116.57 115.69 2yrq h LYS 37 Ca -0.09 -0.18 -0.58 0.00 -1.87 0.00 0.00 60.65 57.92 2yrq h LYS 37 Cb 1.39 -0.09 -0.40 0.00 0.08 0.00 0.00 32.23 33.22 2yrq h LYS 37 CO 0.11 0.73 -0.78 -1.01 -0.57 0.00 0.00 179.45 177.93 2yrq s HIS 38 N -5.23 1.32 0.22 -1.35 3.76 0.63 -4.99 115.29 109.66 2yrq s HIS 38 Ca -0.13 -1.78 -0.01 0.00 -0.15 0.00 0.00 55.06 52.98 2yrq s HIS 38 Cb 0.11 -1.44 0.21 0.00 1.11 0.00 0.00 32.58 32.57 2yrq s HIS 38 CO 0.78 -0.83 1.58 -1.00 -0.85 0.00 0.00 174.74 174.42 2yrq h PRO 39 N 7.46 0.54 -0.22 8.40 0.13 -1.73 -3.13 132.00 143.44 2yrq h PRO 39 Ca -0.06 -0.29 -0.16 0.00 -0.87 0.00 0.00 66.00 64.62 2yrq h PRO 39 Cb 0.98 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.11 2yrq h PRO 39 CO 0.41 0.87 -0.53 0.38 -0.23 0.00 0.00 178.00 178.91 2yrq h ASP 40 N 0.44 0.72 -1.85 1.44 2.03 -1.94 -3.40 116.42 113.85 2yrq h ASP 40 Ca 0.03 -0.37 -0.65 0.00 -0.73 0.00 0.00 57.03 55.31 2yrq h ASP 40 Cb 0.93 -0.20 0.01 0.00 -0.83 0.00 0.00 39.33 39.24 2yrq h ASP 40 CO 0.08 1.11 1.09 0.00 -1.03 0.00 0.00 179.24 180.49 2yrq n ALA 41 N -2.53 0.67 -2.95 4.15 0.00 -1.18 -4.90 120.51 113.77 2yrq n ALA 41 Ca -0.03 0.27 -0.44 0.00 0.00 0.00 0.00 53.44 53.24 2yrq n ALA 41 Cb 0.60 -2.45 -0.04 0.00 0.00 0.00 0.00 19.45 17.56 2yrq n ALA 41 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2yrq s SER 42 N 4.32 6.21 -0.15 0.00 0.15 -1.26 -4.82 113.70 118.15 2yrq s SER 42 Ca 0.96 -1.22 -0.07 0.00 0.70 0.00 0.00 55.95 56.31 2yrq s SER 42 Cb -0.78 -2.38 -0.04 0.00 -1.71 0.00 0.00 66.02 61.11 2yrq s SER 42 CO 0.54 -1.30 0.11 0.54 1.20 0.00 0.00 173.24 174.33 2yrq s VAL 43 N 3.48 5.22 0.73 4.45 0.11 -1.26 -5.10 120.40 128.02 2yrq s VAL 43 Ca 0.19 0.11 -0.08 0.00 -2.93 0.00 0.00 61.98 59.27 2yrq s VAL 43 Cb -0.19 -3.31 0.06 0.00 -1.53 0.00 0.00 36.38 31.42 2yrq s VAL 43 CO 0.07 0.55 1.06 0.20 -3.33 0.00 0.00 175.10 173.65 2yrq s ASN 44 N -0.45 4.80 -0.18 3.54 0.01 -1.26 -4.93 114.94 116.48 2yrq s ASN 44 Ca 0.11 0.59 -0.14 0.00 -0.71 0.00 0.00 52.86 52.71 2yrq s ASN 44 Cb -0.12 -1.22 -0.22 0.00 0.41 0.00 0.00 41.25 40.10 2yrq s ASN 44 CO 0.02 -1.64 0.23 0.33 -1.51 0.00 0.00 177.10 174.52 2yrq n PHE 45 N -3.02 1.03 0.26 2.20 7.35 -1.26 -3.06 117.46 120.96 2yrq n PHE 45 Ca 0.08 0.33 0.14 0.00 -0.76 0.00 0.00 57.45 57.23 2yrq n PHE 45 Cb 0.60 -1.12 0.68 0.00 0.35 0.00 0.00 39.48 39.99 2yrq n PHE 45 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 2yrq h SER 46 N -0.51 0.00 0.10 -2.13 0.87 -1.96 -2.52 113.55 107.39 2yrq h SER 46 Ca -0.41 0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 59.95 2yrq h SER 46 Cb 1.65 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.62 2yrq h SER 46 CO -0.09 0.12 -0.99 1.05 -0.53 0.00 0.00 176.83 176.39 2yrq h GLU 47 N 0.00 0.21 0.00 2.24 -0.00 -1.98 -3.31 114.58 111.73 2yrq h GLU 47 Ca -0.00 -0.36 -0.00 0.00 -0.00 0.00 0.00 59.36 59.00 2yrq h GLU 47 Cb 0.47 0.13 -0.00 0.00 -0.00 0.00 0.00 28.75 29.36 2yrq h GLU 47 CO 0.02 1.17 -0.01 0.35 -0.00 0.00 0.00 179.01 180.54 2yrq h PHE 48 N -0.49 0.00 -0.15 2.06 3.57 -1.45 -2.64 116.94 117.85 2yrq h PHE 48 Ca -0.21 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.27 2yrq h PHE 48 Cb 1.57 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.31 2yrq h PHE 48 CO 0.17 0.01 0.01 1.03 -2.23 0.00 0.00 178.31 177.30 2yrq h SER 49 N 0.00 0.24 -0.02 0.41 0.87 -1.54 -1.54 113.55 111.98 2yrq h SER 49 Ca -0.00 -0.29 0.01 0.00 -1.23 0.00 0.00 61.79 60.28 2yrq h SER 49 Cb 0.17 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.06 2yrq h SER 49 CO 0.00 0.47 0.13 0.07 -0.53 0.00 0.00 176.83 176.97 2yrq h LYS 50 N 0.01 0.00 0.00 2.24 2.10 -1.60 -1.57 116.57 117.75 2yrq h LYS 50 Ca 0.04 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.54 2yrq h LYS 50 Cb 0.34 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.65 2yrq h LYS 50 CO 0.01 0.00 -0.84 0.87 -2.00 0.00 0.00 179.45 177.49 2yrq h LYS 51 N 0.00 0.00 -0.73 0.07 1.57 -1.52 -3.33 116.57 112.62 2yrq h LYS 51 Ca 0.01 0.00 0.11 0.00 -1.87 0.00 0.00 60.65 58.90 2yrq h LYS 51 Cb 0.26 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.52 2yrq h LYS 51 CO -0.00 1.00 0.48 0.00 -0.57 0.00 0.00 179.45 180.36 2yrq n SER 53 N -4.49 0.00 0.33 0.00 3.41 -0.65 -0.00 113.62 112.22 2yrq n SER 53 Ca 0.13 0.92 0.21 0.00 -0.26 0.00 0.00 58.87 59.87 2yrq n SER 53 Cb 0.40 -0.42 1.13 0.00 -0.26 0.00 0.00 64.21 65.06 2yrq n SER 53 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2yrq h GLU 54 N 0.00 0.00 0.00 4.33 4.11 -1.65 0.14 114.58 121.51 2yrq h GLU 54 Ca 0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.34 2yrq h GLU 54 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2yrq h GLU 54 CO 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 179.01 178.56 2yrq h ARG 55 N 0.00 0.00 0.01 1.06 3.08 -0.61 -2.89 114.38 115.03 2yrq h ARG 55 Ca 0.00 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.78 2yrq h ARG 55 Cb 0.09 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.10 2yrq h ARG 55 CO 0.00 0.37 -1.49 2.35 -1.07 0.00 0.00 179.97 180.13 2yrq h TRP 56 N 0.00 0.06 0.00 3.04 2.91 0.24 -3.15 115.95 119.05 2yrq h TRP 56 Ca -0.02 -0.04 -0.17 0.00 1.13 0.00 0.00 58.89 59.79 2yrq h TRP 56 Cb 1.32 -0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.94 2yrq h TRP 56 CO 0.00 1.06 -0.81 1.57 -1.03 0.00 0.00 178.44 179.23 2yrq h LYS 57 N 0.01 0.00 0.01 2.65 2.10 -1.47 -3.24 116.57 116.64 2yrq h LYS 57 Ca -0.20 0.00 -0.23 0.00 -2.00 0.00 0.00 60.65 58.22 2yrq h LYS 57 Cb 1.94 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.27 2yrq h LYS 57 CO 0.10 0.81 -0.96 0.00 -2.00 0.00 0.00 179.45 177.41 2yrq h THR 58 N 0.00 1.42 -4.04 0.07 1.03 -1.63 -3.45 112.91 106.31 2yrq h THR 58 Ca -0.01 -2.52 -0.54 0.00 -0.01 0.00 0.00 66.41 63.33 2yrq h THR 58 Cb 1.45 2.47 0.13 0.00 -1.07 0.00 0.00 68.15 71.13 2yrq h THR 58 CO 0.11 0.75 0.59 -0.04 -0.01 0.00 0.00 175.52 176.92 2yrq s MET 59 N -3.21 3.23 0.57 0.00 -1.94 -1.19 -5.03 119.30 111.73 2yrq s MET 59 Ca -0.05 2.17 0.08 0.00 -1.71 0.00 0.00 55.69 56.18 2yrq s MET 59 Cb 0.09 -2.28 0.07 0.00 2.01 0.00 0.00 34.83 34.72 2yrq s MET 59 CO 0.86 -1.10 0.65 0.45 -0.01 0.00 0.00 175.02 175.88 2yrq s SER 60 N -1.00 4.89 0.59 3.03 0.15 -1.26 -4.85 113.70 115.25 2yrq s SER 60 Ca 0.70 -1.03 0.29 0.00 0.70 0.00 0.00 55.95 56.61 2yrq s SER 60 Cb -0.39 0.40 1.49 0.00 -1.71 0.00 0.00 66.02 65.81 2yrq s SER 60 CO 0.46 -1.28 1.91 0.00 1.20 0.00 0.00 173.24 175.52 2yrq h ALA 61 N 0.37 2.15 -0.74 5.45 0.00 -1.96 0.77 119.26 125.30 2yrq h ALA 61 Ca -0.32 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2yrq h ALA 61 Cb 1.30 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.08 2yrq h ALA 61 CO 0.47 -0.69 0.44 0.87 0.00 0.00 0.00 179.25 180.34 2yrq h LYS 62 N 0.00 1.01 0.00 0.00 6.56 -2.00 0.81 116.57 122.96 2yrq h LYS 62 Ca 0.21 -0.10 -0.13 0.00 -1.06 0.00 0.00 60.65 59.57 2yrq h LYS 62 Cb 1.14 -0.21 -0.02 0.00 -0.57 0.00 0.00 32.23 32.57 2yrq h LYS 62 CO -0.00 0.72 -0.81 0.93 -2.06 0.00 0.00 179.45 178.22 2yrq h GLU 63 N 1.01 0.00 -0.93 3.15 4.39 -1.29 -3.37 114.58 117.54 2yrq h GLU 63 Ca 0.27 0.00 0.19 0.00 0.34 0.00 0.00 59.36 60.16 2yrq h GLU 63 Cb -0.02 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 28.55 2yrq h GLU 63 CO -0.05 0.69 0.60 0.87 -1.16 0.00 0.00 179.01 179.96 2yrq h LYS 64 N -1.00 0.53 0.00 2.33 1.57 -1.20 -3.04 116.57 115.76 2yrq h LYS 64 Ca -0.19 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 2yrq h LYS 64 Cb 0.98 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.17 2yrq h LYS 64 CO -0.12 0.35 0.00 0.41 -0.57 0.00 0.00 179.45 179.52 2yrq n GLY 65 N -1.46 -3.30 0.39 3.86 0.00 0.28 0.82 105.19 105.78 2yrq n GLY 65 Ca 0.20 0.63 0.24 0.00 0.00 0.00 0.00 46.02 47.10 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 0.35 -0.02 1.61 2.10 -1.75 0.99 116.57 119.86 2yrq h LYS 66 Ca 0.00 -0.02 -0.09 0.00 -2.00 0.00 0.00 60.65 58.54 2yrq h LYS 66 Cb 0.00 -0.08 -0.01 0.00 -0.90 0.00 0.00 32.23 31.24 2yrq h LYS 66 CO 0.00 0.23 -0.39 0.74 -2.00 0.00 0.00 179.45 178.03 2yrq h PHE 67 N 0.36 0.05 0.02 0.07 0.04 -0.74 -1.29 116.94 115.45 2yrq h PHE 67 Ca 0.67 -0.01 -0.00 0.00 2.80 0.00 0.00 57.97 61.43 2yrq h PHE 67 Cb 1.67 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.81 2yrq h PHE 67 CO -0.00 0.43 -0.01 0.93 -0.60 0.00 0.00 178.31 179.06 2yrq h GLU 68 N 0.04 -0.03 0.15 1.51 4.39 0.74 -2.42 114.58 118.96 2yrq h GLU 68 Ca 0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 2yrq h GLU 68 Cb 0.71 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.37 2yrq h GLU 68 CO 0.05 0.57 -0.07 0.22 -1.16 0.00 0.00 179.01 178.62 2yrq h ASP 69 N -0.64 -0.17 -0.86 1.42 3.58 -1.28 -2.48 116.42 115.98 2yrq h ASP 69 Ca -0.00 -0.09 0.13 0.00 0.42 0.00 0.00 57.03 57.48 2yrq h ASP 69 Cb 0.61 0.04 -0.06 0.00 1.72 0.00 0.00 39.33 41.64 2yrq h ASP 69 CO 0.00 -0.02 0.56 0.00 -2.88 0.00 0.00 179.24 176.90 2yrq h MET 70 N -0.32 0.69 -0.32 0.28 -0.00 -1.34 0.30 114.93 114.21 2yrq h MET 70 Ca -0.02 -0.04 -0.06 0.00 -0.00 0.00 0.00 59.70 59.58 2yrq h MET 70 Cb 0.25 -0.16 -0.02 0.00 -0.00 0.00 0.00 31.60 31.68 2yrq h MET 70 CO 0.03 0.46 -0.06 0.00 -0.00 0.00 0.00 176.91 177.34 2yrq h ALA 71 N 1.59 1.30 -0.01 -3.00 0.00 -1.13 -2.51 119.26 115.50 2yrq h ALA 71 Ca 0.42 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 2yrq h ALA 71 Cb 0.61 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2yrq h ALA 71 CO -0.18 0.47 -0.70 0.87 0.00 0.00 0.00 179.25 179.71 2yrq h LYS 72 N 0.49 0.03 -0.67 0.00 1.57 -0.53 -3.21 116.57 114.26 2yrq h LYS 72 Ca 0.10 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.87 2yrq h LYS 72 Cb 0.42 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.69 2yrq h LYS 72 CO 0.02 0.72 0.43 0.00 -0.57 0.00 0.00 179.45 180.05 2yrq h ALA 73 N 1.27 0.87 -0.18 3.86 0.00 -0.87 -1.16 119.26 123.05 2yrq h ALA 73 Ca -0.01 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.92 2yrq h ALA 73 Cb 1.24 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2yrq h ALA 73 CO 0.09 0.21 0.20 0.22 0.00 0.00 0.00 179.25 179.98 2yrq h ASP 74 N 0.85 0.00 -0.61 0.00 1.82 -1.54 -0.89 116.42 116.06 2yrq h ASP 74 Ca 0.26 0.00 0.18 0.00 -0.39 0.00 0.00 57.03 57.08 2yrq h ASP 74 Cb -0.02 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 39.97 2yrq h ASP 74 CO -0.09 0.00 0.48 0.50 -1.61 0.00 0.00 179.24 178.52 2yrq h LYS 75 N 0.00 0.00 0.00 0.28 1.63 -1.33 0.80 116.57 117.96 2yrq h LYS 75 Ca 0.08 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 2yrq h LYS 75 Cb 0.49 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.12 2yrq h LYS 75 CO -0.00 0.00 -0.42 0.00 -3.45 0.00 0.00 179.45 175.57 2yrq h ALA 76 N 1.62 0.00 -0.60 5.00 0.00 -1.31 -3.23 119.26 120.74 2yrq h ALA 76 Ca 0.29 -0.43 0.17 0.00 0.00 0.00 0.00 54.91 54.95 2yrq h ALA 76 Cb 1.24 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 19.43 2yrq h ALA 76 CO -0.00 0.42 0.66 0.07 0.00 0.00 0.00 179.25 180.41 2yrq h ARG 77 N -0.99 0.00 0.05 0.00 -0.00 -1.52 0.20 114.38 112.11 2yrq h ARG 77 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 59.98 59.83 2yrq h ARG 77 Cb 0.42 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 30.41 2yrq h ARG 77 CO 0.00 0.00 -0.62 -0.92 -0.00 0.00 0.00 179.97 178.43 2yrq h TYR 78 N 0.00 0.54 -1.07 4.08 5.03 -1.00 -3.26 116.97 121.29 2yrq h TYR 78 Ca 0.29 -0.33 0.29 0.00 2.58 0.00 0.00 58.73 61.56 2yrq h TYR 78 Cb 1.61 -0.05 -0.08 0.00 1.55 0.00 0.00 36.73 39.76 2yrq h TYR 78 CO 0.00 1.18 0.71 0.93 -1.32 0.00 0.00 178.16 179.66 2yrq h GLU 79 N -0.25 0.26 -0.82 1.82 4.39 -0.62 -1.51 114.58 117.84 2yrq h GLU 79 Ca -0.09 -0.02 0.13 0.00 0.34 0.00 0.00 59.36 59.72 2yrq h GLU 79 Cb 1.39 -0.06 -0.14 0.00 -0.10 0.00 0.00 28.75 29.84 2yrq h GLU 79 CO 0.12 0.17 -0.38 0.00 -1.16 0.00 0.00 179.01 177.76 2yrq h ARG 80 N 0.27 -0.07 0.29 2.33 2.47 -1.57 1.00 114.38 119.09 2yrq h ARG 80 Ca 0.58 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 59.30 2yrq h ARG 80 Cb 1.72 0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 30.04 2yrq h ARG 80 CO -0.21 -0.05 -0.24 0.93 0.56 0.00 0.00 179.97 180.97 2yrq h GLU 81 N -0.08 -0.52 -1.02 0.04 4.39 -1.48 -1.93 114.58 113.99 2yrq h GLU 81 Ca 0.29 0.04 0.27 0.00 0.34 0.00 0.00 59.36 60.29 2yrq h GLU 81 Cb 0.57 0.12 -0.06 0.00 -0.10 0.00 0.00 28.75 29.28 2yrq h GLU 81 CO -0.86 -0.35 0.70 1.98 -1.16 0.00 0.00 179.01 179.32 2yrq h MET 82 N -0.54 0.19 -0.97 2.33 4.05 -1.15 -0.88 114.93 117.97 2yrq h MET 82 Ca -0.02 -0.01 0.32 0.00 -0.28 0.00 0.00 59.70 59.71 2yrq h MET 82 Cb 0.48 -0.04 -0.17 0.00 -0.80 0.00 0.00 31.60 31.06 2yrq h MET 82 CO -0.02 0.13 0.29 -0.22 0.23 0.00 0.00 176.91 177.32 2yrq h LYS 83 N 0.20 0.07 -0.03 0.39 3.64 -0.04 1.62 116.57 122.41 2yrq h LYS 83 Ca 0.52 -0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.78 2yrq h LYS 83 Cb 1.69 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.48 2yrq h LYS 83 CO -0.13 0.04 -0.51 1.79 -2.27 0.00 0.00 179.45 178.37 2yrq h THR 84 N 0.07 1.37 -3.95 1.00 1.35 -1.29 -3.44 112.91 108.01 2yrq h THR 84 Ca 0.69 -1.77 -0.52 0.00 -0.55 0.00 0.00 66.41 64.25 2yrq h THR 84 Cb 1.60 1.92 0.08 0.00 -1.73 0.00 0.00 68.15 70.02 2yrq h THR 84 CO -0.80 0.51 0.59 -0.47 -0.25 0.00 0.00 175.52 175.11 2yrq s TYR 85 N -3.88 2.83 -0.16 4.73 6.14 0.55 -5.03 117.35 122.53 2yrq s TYR 85 Ca -0.03 1.43 -0.01 0.00 0.64 0.00 0.00 57.07 59.10 2yrq s TYR 85 Cb 0.13 -3.63 0.05 0.00 0.42 0.00 0.00 41.96 38.93 2yrq s TYR 85 CO 0.76 -2.01 -0.01 0.42 0.64 0.00 0.00 175.55 175.35 2yrq s ILE 86 N -1.29 0.82 0.98 3.14 1.01 -1.26 -4.97 121.20 119.62 2yrq s ILE 86 Ca 0.58 -0.51 -0.12 0.00 0.00 0.00 0.00 60.65 60.60 2yrq s ILE 86 Cb -0.37 -1.10 0.18 0.00 0.01 0.00 0.00 42.46 41.17 2yrq s ILE 86 CO 0.47 0.03 1.09 -2.16 0.00 0.00 0.00 174.94 174.37 2yrq s PRO 87 N 1.75 0.61 0.58 2.79 0.04 -1.26 -5.05 135.00 134.45 2yrq s PRO 87 Ca 0.01 0.59 -0.10 0.00 0.04 0.00 0.00 61.00 61.54 2yrq s PRO 87 Cb -0.16 -1.75 0.14 0.00 0.04 0.00 0.00 34.50 32.78 2yrq s PRO 87 CO -0.07 -2.63 0.51 -0.35 0.04 0.00 0.00 177.00 174.50 2yrq n PRO 88 N -4.11 -2.03 -0.52 0.56 -0.04 -1.26 -4.79 135.00 122.80 2yrq n PRO 88 Ca 0.06 -0.82 0.44 0.00 -0.04 0.00 0.00 63.50 63.14 2yrq n PRO 88 Cb 0.57 -0.77 0.71 0.00 -0.04 0.00 0.00 33.50 33.97 2yrq n PRO 88 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2yrq h LYS 89 N 0.00 0.00 -6.36 0.54 1.63 -2.05 -3.40 116.57 106.94 2yrq h LYS 89 Ca -0.19 0.00 -0.62 0.00 -0.85 0.00 0.00 60.65 58.99 2yrq h LYS 89 Cb 0.59 0.00 0.04 0.00 -0.60 0.00 0.00 32.23 32.26 2yrq h LYS 89 CO 0.13 0.00 0.92 0.41 -3.45 0.00 0.00 179.45 177.46 2yrq n GLY 90 N -1.85 1.22 3.59 5.01 0.00 -1.26 -4.97 105.19 106.92 2yrq n GLY 90 Ca 0.36 0.77 -0.30 0.00 0.00 0.00 0.00 46.02 46.86 2yrq n GLY 90 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2yrq s GLU 91 N 2.55 2.18 -0.12 1.61 -1.05 -1.26 -4.83 118.70 117.77 2yrq s GLU 91 Ca 0.87 -1.00 -0.16 0.00 -0.15 0.00 0.00 54.97 54.54 2yrq s GLU 91 Cb -0.73 -2.33 0.04 0.00 -0.44 0.00 0.00 34.13 30.66 2yrq s GLU 91 CO 0.47 0.51 0.41 0.99 0.95 0.00 0.00 175.26 178.59 2yrq s THR 92 N -1.22 0.01 -0.22 1.83 2.01 -1.26 -5.03 115.64 111.77 2yrq s THR 92 Ca 0.22 -0.10 -0.21 0.00 0.31 0.00 0.00 61.69 61.91 2yrq s THR 92 Cb -0.11 -0.62 -0.02 0.00 0.01 0.00 0.00 72.50 71.76 2yrq s THR 92 CO 0.14 -0.06 0.64 -1.59 -0.69 0.00 0.00 174.62 173.06 2yrq s LYS 93 N -0.19 4.17 -0.03 4.92 -2.85 -1.26 -4.17 119.74 120.34 2yrq s LYS 93 Ca -0.04 0.61 -0.05 0.00 -1.00 0.00 0.00 55.97 55.49 2yrq s LYS 93 Cb -0.03 -3.61 0.01 0.00 -2.06 0.00 0.00 37.83 32.13 2yrq s LYS 93 CO 0.02 -0.32 0.12 0.21 0.10 0.00 0.00 175.35 175.48 2yrq s LYS 94 N 2.19 0.28 0.98 1.78 2.36 -1.26 -5.04 119.74 121.03 2yrq s LYS 94 Ca 0.28 -0.08 -0.17 0.00 -2.55 0.00 0.00 55.97 53.45 2yrq s LYS 94 Cb -0.16 0.12 0.05 0.00 -1.05 0.00 0.00 37.83 36.79 2yrq s LYS 94 CO 0.09 -0.05 -0.25 0.36 1.55 0.00 0.00 175.35 177.05 2yrq n LYS 95 N 2.36 -1.29 -4.12 4.03 2.85 -1.26 -4.90 118.16 115.84 2yrq n LYS 95 Ca -0.17 -0.38 -0.14 0.00 -1.05 0.00 0.00 58.31 56.57 2yrq n LYS 95 Cb 0.58 -1.37 -0.11 0.00 -0.65 0.00 0.00 35.03 33.48 2yrq n LYS 95 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 177.40 177.47 2yrq s PHE 96 N -2.09 0.88 0.12 5.58 5.36 -1.26 -4.96 117.98 121.61 2yrq s PHE 96 Ca 0.37 -0.56 0.07 0.00 -0.96 0.00 0.00 56.93 55.85 2yrq s PHE 96 Cb -0.03 -0.50 -0.04 0.00 -0.34 0.00 0.00 43.02 42.11 2yrq s PHE 96 CO 0.46 -0.04 -0.16 0.21 -1.46 0.00 0.00 175.22 174.22 2yrq s LYS 97 N -2.05 1.09 -0.34 10.12 2.47 -1.26 -5.11 119.74 124.66 2yrq s LYS 97 Ca -0.03 -1.24 -0.28 0.00 -1.56 0.00 0.00 55.97 52.85 2yrq s LYS 97 Cb -0.07 -1.09 0.02 0.00 -1.46 0.00 0.00 37.83 35.22 2yrq s LYS 97 CO 0.00 0.23 1.05 -0.51 0.16 0.00 0.00 175.35 176.27 2yrq s ASP 98 N -2.34 6.86 0.23 1.43 1.01 -1.26 -4.92 116.67 117.68 2yrq s ASP 98 Ca 0.09 0.91 0.00 0.00 0.71 0.00 0.00 52.55 54.27 2yrq s ASP 98 Cb -0.07 -2.53 0.25 0.00 1.01 0.00 0.00 42.92 41.59 2yrq s ASP 98 CO 0.04 -0.90 1.60 1.55 0.21 0.00 0.00 175.17 177.67 2yrq h PRO 99 N 8.25 0.47 -0.47 8.23 0.13 -2.01 -3.30 132.00 143.31 2yrq h PRO 99 Ca -0.21 -0.25 0.05 0.00 -0.87 0.00 0.00 66.00 64.72 2yrq h PRO 99 Cb 1.06 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 32.13 2yrq h PRO 99 CO 1.03 0.82 -0.44 -0.91 -0.23 0.00 0.00 178.00 178.27 2yrq h ASN 100 N 0.39 -1.54 -0.95 1.44 4.21 -2.08 -3.42 115.58 113.64 2yrq h ASN 100 Ca 0.03 0.21 -0.53 0.00 1.21 0.00 0.00 56.30 57.23 2yrq h ASN 100 Cb 0.92 0.65 0.10 0.00 -1.12 0.00 0.00 38.32 38.87 2yrq h ASN 100 CO 0.08 -0.27 -0.51 0.00 -1.29 0.00 0.00 177.43 175.43 2yrq n ALA 101 N -3.06 -2.55 -1.21 -0.83 0.00 -1.24 -4.89 120.51 106.72 2yrq n ALA 101 Ca -0.01 0.28 -0.30 0.00 0.00 0.00 0.00 53.44 53.41 2yrq n ALA 101 Cb 0.25 -1.26 0.13 0.00 0.00 0.00 0.00 19.45 18.57 2yrq n ALA 101 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2yrq s PRO 102 N -0.80 1.43 0.34 0.00 0.04 -1.26 -5.08 135.00 129.67 2yrq s PRO 102 Ca 0.50 0.88 0.03 0.00 0.04 0.00 0.00 61.00 62.46 2yrq s PRO 102 Cb -0.68 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.00 2yrq s PRO 102 CO 0.46 -2.14 0.13 -1.59 0.04 0.00 0.00 177.00 173.91 2yrq s LYS 103 N -4.93 1.72 0.34 4.56 0.00 -1.26 -5.03 119.74 115.14 2yrq s LYS 103 Ca 0.63 -2.01 -0.27 0.00 0.00 0.00 0.00 55.97 54.33 2yrq s LYS 103 Cb -0.18 -0.41 -0.09 0.00 0.00 0.00 0.00 37.83 37.15 2yrq s LYS 103 CO 0.57 -0.41 1.10 1.03 0.00 0.00 0.00 175.35 177.63 2yrq s ARG 104 N -3.79 4.38 1.01 1.78 3.00 -1.26 -4.94 118.95 119.14 2yrq s ARG 104 Ca 0.32 1.72 -0.12 0.00 0.00 0.00 0.00 55.73 57.64 2yrq s ARG 104 Cb 0.05 -2.89 0.20 0.00 0.00 0.00 0.00 34.95 32.30 2yrq s ARG 104 CO 0.16 0.01 1.09 -1.25 0.00 0.00 0.00 175.30 175.31 2yrq s PRO 105 N -1.94 0.32 0.63 3.54 0.04 -1.26 -5.02 135.00 131.32 2yrq s PRO 105 Ca 0.51 0.49 -0.16 0.00 0.04 0.00 0.00 61.00 61.88 2yrq s PRO 105 Cb -0.29 -1.73 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 2yrq s PRO 105 CO 0.36 -2.80 1.12 -1.25 0.04 0.00 0.00 177.00 174.47 2yrq s PRO 106 N -4.97 2.92 0.32 0.56 0.04 -1.26 -5.05 135.00 127.57 2yrq s PRO 106 Ca 0.66 1.44 0.00 0.00 0.04 0.00 0.00 61.00 63.14 2yrq s PRO 106 Cb -0.19 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 2yrq s PRO 106 CO 0.58 -1.17 0.52 -1.54 0.04 0.00 0.00 177.00 175.43 2yrq s SER 107 N -2.40 6.31 0.50 6.66 1.04 -1.26 -4.84 113.70 119.71 2yrq s SER 107 Ca 0.68 0.43 0.39 0.00 0.48 0.00 0.00 55.95 57.94 2yrq s SER 107 Cb -0.21 -2.02 1.57 0.00 0.10 0.00 0.00 66.02 65.46 2yrq s SER 107 CO 0.38 -0.25 1.62 0.00 0.98 0.00 0.00 173.24 175.97 2yrq h ALA 108 N 0.95 3.25 -0.05 5.32 0.00 -1.93 0.63 119.26 127.43 2yrq h ALA 108 Ca -0.50 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 2yrq h ALA 108 Cb 1.22 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.18 2yrq h ALA 108 CO 0.62 -1.83 -0.01 0.35 0.00 0.00 0.00 179.25 178.38 2yrq h PHE 109 N 0.03 0.10 -0.01 0.00 3.57 -1.92 -1.75 116.94 116.96 2yrq h PHE 109 Ca 0.85 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 62.33 2yrq h PHE 109 Cb 3.06 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 41.78 2yrq h PHE 109 CO -0.00 0.42 0.03 0.35 -2.23 0.00 0.00 178.31 176.88 2yrq h PHE 110 N -0.25 0.00 0.03 0.41 3.57 -0.11 0.24 116.94 120.83 2yrq h PHE 110 Ca 0.01 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.42 2yrq h PHE 110 Cb 0.39 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.12 2yrq h PHE 110 CO 0.05 0.00 -0.46 -0.07 -2.23 0.00 0.00 178.31 175.60 2yrq h LEU 111 N 0.00 0.11 -0.06 0.59 3.38 -1.13 -2.87 115.31 115.33 2yrq h LEU 111 Ca 0.01 -0.90 -0.02 0.00 0.09 0.00 0.00 57.88 57.06 2yrq h LEU 111 Cb 0.06 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2yrq h LEU 111 CO -0.00 1.20 -0.04 0.15 0.09 0.00 0.00 178.44 179.84 2yrq h PHE 112 N -0.84 0.16 0.00 1.13 3.04 -0.79 -2.14 116.94 117.50 2yrq h PHE 112 Ca -0.11 -0.04 -0.02 0.00 3.98 0.00 0.00 57.97 61.78 2yrq h PHE 112 Cb 1.22 -0.03 -0.00 0.00 2.56 0.00 0.00 35.95 39.69 2yrq h PHE 112 CO 0.22 0.54 -0.08 0.00 -2.02 0.00 0.00 178.31 176.97 2yrq n SER 114 N -4.35 0.54 -0.08 0.00 2.88 -1.08 -1.83 113.62 109.70 2yrq n SER 114 Ca -0.03 0.38 -0.15 0.00 -1.33 0.00 0.00 58.87 57.75 2yrq n SER 114 Cb 0.16 -0.43 -0.14 0.00 -0.75 0.00 0.00 64.21 63.06 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 -1.95 0.68 0.10 -1.46 4.07 -0.17 -4.36 120.64 117.55 2yrq n GLU 115 Ca 0.06 0.14 0.01 0.00 -0.06 0.00 0.00 57.16 57.31 2yrq n GLU 115 Cb 0.40 -1.59 -0.02 0.00 -0.06 0.00 0.00 31.44 30.17 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 0.01 0.00 -1.00 4.31 -1.99 -0.98 -3.36 116.97 113.96 2yrq h TYR 116 Ca -0.51 0.00 0.18 0.00 2.00 0.00 0.00 58.73 60.40 2yrq h TYR 116 Cb 2.04 0.00 -0.18 0.00 2.00 0.00 0.00 36.73 40.59 2yrq h TYR 116 CO 0.03 0.54 -0.32 -0.09 -0.00 0.00 0.00 178.16 178.32 2yrq h ARG 117 N 0.00 -0.00 -0.24 4.88 2.43 -1.56 0.93 114.38 120.82 2yrq h ARG 117 Ca -0.06 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 58.97 2yrq h ARG 117 Cb 1.47 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.01 2yrq h ARG 117 CO 0.06 -0.00 -0.42 -1.00 -1.51 0.00 0.00 179.97 177.10 2yrq h PRO 118 N -0.00 0.58 0.00 0.20 0.13 -1.83 0.42 132.00 131.50 2yrq h PRO 118 Ca 0.41 -0.31 -0.05 0.00 -0.87 0.00 0.00 66.00 65.19 2yrq h PRO 118 Cb 0.66 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.80 2yrq h PRO 118 CO -1.01 0.90 -0.22 1.57 -0.23 0.00 0.00 178.00 179.01 2yrq h LYS 119 N 0.47 0.00 0.04 0.86 2.10 -0.33 -3.10 116.57 116.61 2yrq h LYS 119 Ca 0.04 0.00 -0.37 0.00 -2.00 0.00 0.00 60.65 58.32 2yrq h LYS 119 Cb 0.93 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.21 2yrq h LYS 119 CO 0.08 0.22 -2.23 0.44 -2.00 0.00 0.00 179.45 175.96 2yrq n ILE 120 N -3.36 1.58 -0.26 0.07 -5.35 0.28 -3.75 119.36 108.57 2yrq n ILE 120 Ca 0.00 -0.67 0.04 0.00 -0.27 0.00 0.00 62.75 61.85 2yrq n ILE 120 Cb 0.44 -1.32 0.17 0.00 -1.74 0.00 0.00 39.64 37.19 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 0.02 0.53 -0.06 6.28 3.11 -0.18 0.38 116.57 126.65 2yrq h LYS 121 Ca -0.49 -0.03 -0.05 0.00 -2.81 0.00 0.00 60.65 57.27 2yrq h LYS 121 Cb 2.01 -0.12 0.00 0.00 -1.00 0.00 0.00 32.23 33.12 2yrq h LYS 121 CO 0.00 0.35 -0.14 0.78 -2.81 0.00 0.00 179.45 177.63 2yrq h GLY 122 N 0.54 0.22 0.51 5.01 0.00 -1.74 -3.26 103.07 104.36 2yrq h GLY 122 Ca 0.39 -0.27 0.09 0.00 0.00 0.00 0.00 47.33 47.54 2yrq h GLY 122 CO -0.34 0.24 0.45 0.83 0.00 0.00 0.00 176.54 177.72 2yrq h GLU 123 N -0.31 0.73 -3.81 4.80 3.07 -1.54 -3.32 114.58 114.20 2yrq h GLU 123 Ca -0.00 -0.04 -0.67 0.00 -0.50 0.00 0.00 59.36 58.14 2yrq h GLU 123 Cb 0.74 -0.16 -0.38 0.00 -0.84 0.00 0.00 28.75 28.11 2yrq h GLU 123 CO 0.03 0.48 -0.54 -1.01 -1.40 0.00 0.00 179.01 176.57 2yrq s HIS 124 N -6.04 3.41 0.16 4.33 3.76 0.08 -4.93 115.29 116.06 2yrq s HIS 124 Ca -0.12 -2.88 0.31 0.00 -0.15 0.00 0.00 55.06 52.21 2yrq s HIS 124 Cb 0.19 -3.03 1.28 0.00 1.11 0.00 0.00 32.58 32.13 2yrq s HIS 124 CO 0.78 -0.84 1.96 -1.00 -0.85 0.00 0.00 174.74 174.79 2yrq h PRO 125 N 7.08 0.00 0.02 8.40 0.13 -1.66 -3.14 132.00 142.82 2yrq h PRO 125 Ca -0.06 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.88 2yrq h PRO 125 Cb 0.95 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.10 2yrq h PRO 125 CO 0.67 0.08 -0.77 0.78 -0.23 0.00 0.00 178.00 178.53 2yrq h GLY 126 N 1.88 0.54 -5.57 1.56 0.00 -1.91 -3.45 103.07 96.12 2yrq h GLY 126 Ca -0.00 -0.99 -0.65 0.00 0.00 0.00 0.00 47.33 45.69 2yrq h GLY 126 CO 0.01 0.87 0.76 1.04 0.00 0.00 0.00 176.54 179.22 2yrq n LEU 127 N -4.10 2.52 -4.97 3.11 4.77 -1.19 -4.96 117.00 112.18 2yrq n LEU 127 Ca -0.11 1.07 -0.21 0.00 -0.03 0.00 0.00 56.01 56.74 2yrq n LEU 127 Cb 0.76 -1.28 -0.01 0.00 -2.33 0.00 0.00 43.42 40.57 2yrq n LEU 127 CO 0.50 -0.53 0.09 -0.94 -1.33 0.00 0.00 177.39 175.18 2yrq s SER 128 N 1.92 6.06 0.33 -1.43 1.04 -1.26 -4.57 113.70 115.80 2yrq s SER 128 Ca 0.87 0.02 0.24 0.00 0.48 0.00 0.00 55.95 57.57 2yrq s SER 128 Cb -0.86 -1.52 1.14 0.00 0.10 0.00 0.00 66.02 64.88 2yrq s SER 128 CO 0.49 -0.38 1.19 -0.38 0.98 0.00 0.00 173.24 175.15 2yrq n ILE 129 N -1.68 -0.20 0.08 -1.02 5.41 -1.26 0.51 119.36 121.20 2yrq n ILE 129 Ca -0.03 1.39 -0.08 0.00 1.00 0.00 0.00 62.75 65.04 2yrq n ILE 129 Cb 0.58 -2.28 -0.05 0.00 -0.71 0.00 0.00 39.64 37.18 2yrq n ILE 129 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2yrq h GLY 130 N 0.00 -0.31 0.85 7.39 0.00 -1.96 -3.29 103.07 105.76 2yrq h GLY 130 Ca 0.67 0.11 -0.02 0.00 0.00 0.00 0.00 47.33 48.10 2yrq h GLY 130 CO -0.37 -0.11 -0.15 -0.55 0.00 0.00 0.00 176.54 175.36 2yrq h ASP 131 N -1.01 -0.36 -0.71 0.19 5.19 -0.67 -3.13 116.42 115.91 2yrq h ASP 131 Ca -0.03 -0.08 0.12 0.00 -0.62 0.00 0.00 57.03 56.42 2yrq h ASP 131 Cb 0.39 0.09 -0.12 0.00 0.18 0.00 0.00 39.33 39.87 2yrq h ASP 131 CO 0.05 -0.13 -0.24 0.52 -3.12 0.00 0.00 179.24 176.31 2yrq n VAL 132 N -5.21 -0.35 -0.15 -1.35 0.31 0.18 0.17 118.33 111.93 2yrq n VAL 132 Ca -0.10 1.65 -0.03 0.00 -0.01 0.00 0.00 64.34 65.85 2yrq n VAL 132 Cb 0.23 -2.22 0.06 0.00 -0.91 0.00 0.00 33.84 31.00 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 1.14 0.57 -0.25 3.52 0.00 -1.60 0.75 119.26 123.38 2yrq h ALA 133 Ca 0.28 0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.35 2yrq h ALA 133 Cb 0.46 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2yrq h ALA 133 CO -0.72 -0.27 0.37 -0.22 0.00 0.00 0.00 179.25 178.41 2yrq h LYS 134 N 0.28 0.00 -0.17 0.00 1.63 0.18 0.14 116.57 118.63 2yrq h LYS 134 Ca 0.24 0.00 -0.22 0.00 -0.85 0.00 0.00 60.65 59.82 2yrq h LYS 134 Cb 0.29 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 31.93 2yrq h LYS 134 CO -0.28 0.00 -0.76 -0.22 -3.45 0.00 0.00 179.45 174.73 2yrq h LYS 135 N 0.00 0.81 0.00 1.90 3.11 -0.41 -3.15 116.57 118.83 2yrq h LYS 135 Ca 0.12 -0.65 -0.09 0.00 -2.81 0.00 0.00 60.65 57.22 2yrq h LYS 135 Cb 0.86 0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 32.21 2yrq h LYS 135 CO -0.00 1.26 -0.42 -0.07 -2.81 0.00 0.00 179.45 177.41 2yrq h LEU 136 N 0.56 0.00 0.29 5.20 3.38 -0.71 -3.15 115.31 120.87 2yrq h LEU 136 Ca -0.05 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2yrq h LEU 136 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 2yrq h LEU 136 CO 0.16 0.42 -0.14 1.23 0.09 0.00 0.00 178.44 180.20 2yrq h GLY 137 N 3.26 -0.40 0.87 0.83 0.00 -1.12 -2.10 103.07 104.41 2yrq h GLY 137 Ca -0.00 0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.46 2yrq h GLY 137 CO 0.05 -0.15 0.06 1.05 0.00 0.00 0.00 176.54 177.56 2yrq h GLU 138 N -0.53 0.26 -0.50 4.80 4.11 -1.65 -2.80 114.58 118.28 2yrq h GLU 138 Ca -0.04 -0.05 0.10 0.00 0.07 0.00 0.00 59.36 59.44 2yrq h GLU 138 Cb 0.39 -0.04 -0.10 0.00 0.50 0.00 0.00 28.75 29.50 2yrq h GLU 138 CO 0.06 0.36 -0.16 0.52 0.07 0.00 0.00 179.01 179.86 2yrq h MET 139 N 0.11 -0.05 -0.10 1.06 2.86 -1.55 0.44 114.93 117.71 2yrq h MET 139 Ca 0.06 0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.73 2yrq h MET 139 Cb 0.20 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.87 2yrq h MET 139 CO -0.00 -0.03 0.07 2.35 1.06 0.00 0.00 176.91 180.36 2yrq h TRP 140 N -0.05 0.00 0.00 -0.22 -0.00 -1.28 -0.23 115.95 114.17 2yrq h TRP 140 Ca 0.24 0.00 -0.13 0.00 -0.00 0.00 0.00 58.89 59.00 2yrq h TRP 140 Cb 0.41 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 29.55 2yrq h TRP 140 CO -0.45 0.00 -0.78 -0.91 -0.00 0.00 0.00 178.44 176.29 2yrq h ASN 141 N 0.00 0.00 -0.64 2.65 2.35 -0.16 -3.28 115.58 116.50 2yrq h ASN 141 Ca 0.05 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 55.48 2yrq h ASN 141 Cb 0.18 0.00 -0.19 0.00 0.05 0.00 0.00 38.32 38.36 2yrq h ASN 141 CO -0.00 0.55 0.25 -0.46 -1.65 0.00 0.00 177.43 176.12 2yrq n ASN 142 N -3.14 3.21 -4.38 5.81 0.23 0.12 -4.28 115.26 112.82 2yrq n ASN 142 Ca -0.01 -3.65 -0.33 0.00 -0.53 0.00 0.00 54.58 50.06 2yrq n ASN 142 Cb 0.78 -0.73 -0.14 0.00 -2.08 0.00 0.00 39.78 37.61 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 -3.24 2.90 0.75 5.53 2.01 -0.37 -4.96 115.64 118.26 2yrq s THR 143 Ca 0.50 -0.74 -0.14 0.00 0.31 0.00 0.00 61.69 61.63 2yrq s THR 143 Cb 0.44 -2.18 0.05 0.00 0.01 0.00 0.00 72.50 70.82 2yrq s THR 143 CO 0.06 0.55 1.18 0.00 -0.69 0.00 0.00 174.62 175.72 2yrq s ALA 144 N -0.00 2.09 0.47 7.40 0.00 -1.26 -4.90 121.76 125.56 2yrq s ALA 144 Ca -0.05 0.78 0.23 0.00 0.00 0.00 0.00 51.96 52.92 2yrq s ALA 144 Cb -0.14 -3.44 1.39 0.00 0.00 0.00 0.00 23.12 20.93 2yrq s ALA 144 CO 0.04 -1.91 2.10 0.00 0.00 0.00 0.00 175.76 175.99 2yrq h ALA 145 N -0.49 1.52 -0.96 0.00 0.00 -1.88 -2.39 119.26 115.06 2yrq h ALA 145 Ca -0.47 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2yrq h ALA 145 Cb 1.28 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 19.01 2yrq h ALA 145 CO 0.49 0.13 0.61 -0.44 0.00 0.00 0.00 179.25 180.04 2yrq h ASP 146 N 0.00 1.13 0.89 0.00 3.32 -1.91 -0.84 116.42 119.02 2yrq h ASP 146 Ca -0.00 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.00 2yrq h ASP 146 Cb 0.23 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.49 2yrq h ASP 146 CO 0.01 0.84 0.00 -0.78 -1.72 0.00 0.00 179.24 177.60 2yrq h ASP 147 N 1.32 0.00 -0.31 6.45 1.82 -1.79 -2.03 116.42 121.87 2yrq h ASP 147 Ca 0.35 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.99 2yrq h ASP 147 Cb -0.10 0.00 0.00 0.00 0.68 0.00 0.00 39.33 39.91 2yrq h ASP 147 CO -0.07 0.00 0.00 0.29 -1.61 0.00 0.00 179.24 177.85 2yrq n LYS 148 N -2.79 2.07 0.13 0.28 5.02 -0.34 -4.44 118.16 118.09 2yrq n LYS 148 Ca 0.01 -1.62 -0.16 0.00 -2.02 0.00 0.00 58.31 54.52 2yrq n LYS 148 Cb 0.27 -1.43 -0.09 0.00 -0.02 0.00 0.00 35.03 33.76 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 3.07 -0.73 -0.27 1.97 4.15 -1.11 0.57 115.11 122.75 2yrq h GLN 149 Ca 0.00 0.05 -0.14 0.00 0.77 0.00 0.00 58.65 59.33 2yrq h GLN 149 Cb 0.68 0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.53 2yrq h GLN 149 CO 0.00 -0.49 -0.42 -1.00 -1.93 0.00 0.00 178.83 175.00 2yrq h PRO 150 N -0.76 0.65 -0.18 -2.39 0.13 -1.82 0.10 132.00 127.73 2yrq h PRO 150 Ca -0.00 -0.34 -0.07 0.00 -0.87 0.00 0.00 66.00 64.71 2yrq h PRO 150 Cb 0.76 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.88 2yrq h PRO 150 CO -0.26 0.94 -0.22 1.88 -0.23 0.00 0.00 178.00 180.12 2yrq h TYR 151 N 0.53 0.35 0.00 1.56 0.05 -1.72 -2.15 116.97 115.58 2yrq h TYR 151 Ca 0.04 -0.06 -0.08 0.00 0.05 0.00 0.00 58.73 58.68 2yrq h TYR 151 Cb 0.94 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 38.58 2yrq h TYR 151 CO 0.04 0.53 -0.56 0.93 -1.05 0.00 0.00 178.16 178.05 2yrq h GLU 152 N 0.30 0.00 -0.51 4.88 4.39 0.24 -3.23 114.58 120.65 2yrq h GLU 152 Ca 0.05 0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.85 2yrq h GLU 152 Cb 0.55 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.10 2yrq h GLU 152 CO 0.04 0.62 -0.28 0.87 -1.16 0.00 0.00 179.01 179.10 2yrq h LYS 153 N -1.00 -0.15 0.03 2.33 1.57 -0.85 -1.40 116.57 117.11 2yrq h LYS 153 Ca -0.12 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.69 2yrq h LYS 153 Cb 0.83 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 33.14 2yrq h LYS 153 CO -0.08 -0.10 -0.22 -0.22 -0.57 0.00 0.00 179.45 178.27 2yrq h LYS 154 N -0.15 -0.35 -0.56 3.15 3.11 -1.57 -2.75 116.57 117.44 2yrq h LYS 154 Ca 0.22 0.02 0.09 0.00 -2.81 0.00 0.00 60.65 58.18 2yrq h LYS 154 Cb 0.52 0.08 -0.11 0.00 -1.00 0.00 0.00 32.23 31.72 2yrq h LYS 154 CO -0.60 -0.24 -0.38 0.00 -2.81 0.00 0.00 179.45 175.42 2yrq h ALA 155 N 0.48 -0.20 -0.90 5.00 0.00 -1.30 -1.36 119.26 120.98 2yrq h ALA 155 Ca 0.05 0.13 0.12 0.00 0.00 0.00 0.00 54.91 55.21 2yrq h ALA 155 Cb 0.43 0.86 -0.13 0.00 0.00 0.00 0.00 17.79 18.95 2yrq h ALA 155 CO -0.18 -0.76 -0.46 0.00 0.00 0.00 0.00 179.25 177.85 2yrq h ALA 156 N 0.78 -0.18 -0.25 0.00 0.00 -1.01 -0.30 119.26 118.30 2yrq h ALA 156 Ca 0.20 0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.34 2yrq h ALA 156 Cb 0.56 1.12 -0.07 0.00 0.00 0.00 0.00 17.79 19.39 2yrq h ALA 156 CO -0.67 -0.78 -0.50 0.87 0.00 0.00 0.00 179.25 178.17 2yrq h LYS 157 N -0.05 -0.45 -0.67 0.00 1.57 -1.18 -1.41 116.57 114.38 2yrq h LYS 157 Ca 0.25 0.03 0.13 0.00 -1.87 0.00 0.00 60.65 59.19 2yrq h LYS 157 Cb 0.53 0.10 -0.13 0.00 0.08 0.00 0.00 32.23 32.82 2yrq h LYS 157 CO -0.90 -0.30 -0.18 -0.07 -0.57 0.00 0.00 179.45 177.42 2yrq h LEU 158 N -0.47 -0.67 -0.88 2.94 3.38 -0.83 -0.85 115.31 117.93 2yrq h LEU 158 Ca 0.07 0.20 0.14 0.00 0.09 0.00 0.00 57.88 58.39 2yrq h LEU 158 Cb 0.63 0.43 -0.15 0.00 0.09 0.00 0.00 40.66 41.67 2yrq h LEU 158 CO -0.50 -0.23 -0.39 0.50 0.09 0.00 0.00 178.44 177.92 2yrq h LYS 159 N -0.01 -0.05 -0.10 1.13 3.64 -0.20 -0.31 116.57 120.68 2yrq h LYS 159 Ca 0.32 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.73 2yrq h LYS 159 Cb 0.50 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.27 2yrq h LYS 159 CO -0.69 -0.03 -0.51 0.93 -2.27 0.00 0.00 179.45 176.87 2yrq h GLU 160 N -0.05 -0.57 -0.85 1.90 4.39 -0.99 -0.84 114.58 117.57 2yrq h GLU 160 Ca 0.31 0.04 0.22 0.00 0.34 0.00 0.00 59.36 60.26 2yrq h GLU 160 Cb 0.58 0.13 -0.14 0.00 -0.10 0.00 0.00 28.75 29.22 2yrq h GLU 160 CO -0.90 -0.38 0.21 0.87 -1.16 0.00 0.00 179.01 177.65 2yrq h LYS 161 N -0.59 0.20 0.79 2.33 1.79 -1.00 -0.10 116.57 120.00 2yrq h LYS 161 Ca 0.04 -0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.46 2yrq h LYS 161 Cb 0.68 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 2yrq h LYS 161 CO -0.41 0.14 -0.43 -0.92 -1.08 0.00 0.00 179.45 176.74 2yrq h TYR 162 N 0.21 -1.14 -0.89 -1.35 3.20 -0.21 0.16 116.97 116.95 2yrq h TYR 162 Ca 0.52 -0.02 0.22 0.00 3.14 0.00 0.00 58.73 62.59 2yrq h TYR 162 Cb 1.02 0.39 -0.06 0.00 1.54 0.00 0.00 36.73 39.63 2yrq h TYR 162 CO -0.28 -0.67 0.60 0.93 -1.64 0.00 0.00 178.16 177.10 2yrq h GLU 163 N -1.13 0.31 -0.08 1.82 5.08 -0.08 0.81 114.58 121.30 2yrq h GLU 163 Ca -0.11 -0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.13 2yrq h GLU 163 Cb 0.89 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.08 2yrq h GLU 163 CO 0.14 0.20 -0.35 0.87 -1.00 0.00 0.00 179.01 178.87 2yrq h LYS 164 N 0.31 0.38 -0.38 2.33 1.57 -0.58 -1.15 116.57 119.06 2yrq h LYS 164 Ca 0.46 -0.30 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 2yrq h LYS 164 Cb 1.28 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.63 2yrq h LYS 164 CO -0.14 0.94 0.21 -0.44 -0.57 0.00 0.00 179.45 179.44 2yrq h ASP 165 N -0.09 0.48 0.98 0.86 3.32 0.96 -2.32 116.42 120.61 2yrq h ASP 165 Ca -0.02 -0.09 -0.05 0.00 0.02 0.00 0.00 57.03 56.89 2yrq h ASP 165 Cb 1.00 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.42 2yrq h ASP 165 CO 0.07 0.43 -0.22 -0.29 -1.72 0.00 0.00 179.24 177.51 2yrq h ILE 166 N 0.49 0.53 -0.08 0.35 2.10 -0.99 -2.95 117.51 116.97 2yrq h ILE 166 Ca 0.14 -1.14 -0.01 0.00 1.08 0.00 0.00 64.86 64.92 2yrq h ILE 166 Cb 0.06 1.79 -0.01 0.00 -1.09 0.00 0.00 36.82 37.57 2yrq h ILE 166 CO -0.02 0.22 -0.02 0.00 -1.08 0.00 0.00 178.15 177.25 2yrq h ALA 167 N 1.78 1.82 0.00 0.18 0.00 -0.62 -1.59 119.26 120.83 2yrq h ALA 167 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2yrq h ALA 167 Cb 0.77 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2yrq h ALA 167 CO 0.03 0.14 -0.87 0.00 0.00 0.00 0.00 179.25 178.55 2yrq h ALA 168 N 1.87 0.56 -0.24 0.00 0.00 -1.46 -1.54 119.26 118.45 2yrq h ALA 168 Ca 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 2yrq h ALA 168 Cb 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2yrq h ALA 168 CO 0.00 0.00 -0.17 -0.92 0.00 0.00 0.00 179.25 178.17 2yrq h TYR 169 N 0.00 0.62 0.02 0.00 3.20 -1.25 -3.30 116.97 116.27 2yrq h TYR 169 Ca 0.00 -0.17 -0.39 0.00 3.14 0.00 0.00 58.73 61.31 2yrq h TYR 169 Cb 0.98 -0.14 -0.06 0.00 1.54 0.00 0.00 36.73 39.06 2yrq h TYR 169 CO 0.00 0.83 -2.26 2.89 -1.64 0.00 0.00 178.16 177.98 2yrq n ARG 170 N -4.44 0.64 -3.41 1.82 1.85 -1.04 -4.73 116.66 107.35 2yrq n ARG 170 Ca -0.04 0.26 -0.44 0.00 -1.00 0.00 0.00 57.85 56.63 2yrq n ARG 170 Cb 0.38 -1.57 -0.02 0.00 -1.05 0.00 0.00 32.46 30.20 2yrq n ARG 170 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2yrq s ALA 171 N -2.50 4.33 -0.23 2.89 0.00 -0.58 -5.03 121.76 120.64 2yrq s ALA 171 Ca -0.33 -3.60 -0.40 0.00 0.00 0.00 0.00 51.96 47.63 2yrq s ALA 171 Cb 0.10 -3.37 -0.16 0.00 0.00 0.00 0.00 23.12 19.69 2yrq s ALA 171 CO 0.59 -2.22 1.68 1.63 0.00 0.00 0.00 175.76 177.44 2yrq n LYS 172 N 3.19 1.13 0.00 0.00 5.02 -1.24 -4.04 118.16 122.22 2yrq n LYS 172 Ca 0.18 0.41 0.00 0.00 -2.02 0.00 0.00 58.31 56.89 2yrq n LYS 172 Cb 0.42 -2.09 0.00 0.00 -0.02 0.00 0.00 35.03 33.34 2yrq n LYS 172 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29