#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hyj s VAL 2 N 0.00 2.81 0.13 1.12 0.11 -1.26 -5.09 120.40 118.22 3hyj s VAL 2 Ca 0.00 -0.79 -0.15 0.00 -2.93 0.00 0.00 61.98 58.12 3hyj s VAL 2 Cb 0.00 -2.11 -0.07 0.00 -1.53 0.00 0.00 36.38 32.67 3hyj s VAL 2 CO 0.00 0.56 0.55 -0.55 -3.33 0.00 0.00 175.10 172.33 3hyj s SER 3 N -0.16 6.85 0.00 3.54 0.15 -1.26 -4.98 113.70 117.84 3hyj s SER 3 Ca -0.01 1.09 0.14 0.00 0.70 0.00 0.00 55.95 57.87 3hyj s SER 3 Cb -0.14 -2.29 0.19 0.00 -1.71 0.00 0.00 66.02 62.07 3hyj s SER 3 CO 0.03 0.13 1.06 0.18 1.20 0.00 0.00 173.24 175.85 3hyj n LEU 4 N 0.94 2.48 -4.42 3.45 4.32 -1.26 -4.94 117.00 117.58 3hyj n LEU 4 Ca -0.06 -1.27 -0.42 0.00 -0.02 0.00 0.00 56.01 54.24 3hyj n LEU 4 Cb 0.52 -0.08 -0.10 0.00 -1.62 0.00 0.00 43.42 42.13 3hyj n LEU 4 CO 0.42 0.51 -0.10 -0.22 -1.22 0.00 0.00 177.39 176.78 3hyj s LEU 5 N -1.15 4.98 -0.20 2.23 2.96 -1.26 -4.71 118.68 121.52 3hyj s LEU 5 Ca 0.21 -0.97 -0.07 0.00 -0.22 0.00 0.00 54.13 53.07 3hyj s LEU 5 Cb 0.13 -2.10 -0.04 0.00 0.50 0.00 0.00 46.19 44.68 3hyj s LEU 5 CO 0.19 -0.43 0.05 -0.13 -1.32 0.00 0.00 176.35 174.71 3hyj s ARG 6 N 1.62 3.85 -1.03 1.98 0.52 -1.26 -5.05 118.95 119.58 3hyj s ARG 6 Ca 0.04 -0.40 -0.11 0.00 -0.52 0.00 0.00 55.73 54.74 3hyj s ARG 6 Cb -0.19 -3.21 0.26 0.00 0.52 0.00 0.00 34.95 32.32 3hyj s ARG 6 CO 0.08 0.13 1.01 1.03 0.02 0.00 0.00 175.30 177.57 3hyj s ARG 7 N 0.74 4.02 0.31 3.54 3.00 -1.26 -4.84 118.95 124.45 3hyj s ARG 7 Ca 0.03 -2.99 0.10 0.00 0.00 0.00 0.00 55.73 52.86 3hyj s ARG 7 Cb -0.13 -4.51 -0.06 0.00 0.00 0.00 0.00 34.95 30.24 3hyj s ARG 7 CO 0.02 -1.26 -0.12 0.95 0.00 0.00 0.00 175.30 174.89 3hyj s THR 8 N -0.83 2.17 0.26 0.02 -4.23 -1.26 -5.04 115.64 106.73 3hyj s THR 8 Ca 0.27 -2.25 -0.04 0.00 -1.18 0.00 0.00 61.69 58.49 3hyj s THR 8 Cb -0.10 -2.49 0.25 0.00 1.34 0.00 0.00 72.50 71.51 3hyj s THR 8 CO -0.08 -0.29 1.88 0.15 -0.54 0.00 0.00 174.62 175.73 3hyj h PHE 9 N 2.16 1.15 -0.41 3.99 3.57 -1.95 -2.40 116.94 123.05 3hyj h PHE 9 Ca -0.41 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.14 3hyj h PHE 9 Cb 1.25 -0.38 -0.03 0.00 2.79 0.00 0.00 35.95 39.58 3hyj h PHE 9 CO 0.76 0.60 0.23 0.77 -2.23 0.00 0.00 178.31 178.45 3hyj h SER 10 N 1.14 0.37 -0.49 0.41 0.02 -1.96 -2.47 113.55 110.57 3hyj h SER 10 Ca 0.41 0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 61.32 3hyj h SER 10 Cb 0.13 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 3hyj h SER 10 CO -0.16 0.27 0.12 -0.33 -1.14 0.00 0.00 176.83 175.58 3hyj h GLU 11 N 0.47 0.78 -0.56 3.45 4.39 -1.78 -1.48 114.58 119.87 3hyj h GLU 11 Ca 0.17 -0.19 0.11 0.00 0.34 0.00 0.00 59.36 59.79 3hyj h GLU 11 Cb 0.03 -0.10 -0.09 0.00 -0.10 0.00 0.00 28.75 28.49 3hyj h GLU 11 CO -0.09 0.76 0.06 0.93 -1.16 0.00 0.00 179.01 179.51 3hyj h GLU 12 N 0.67 0.18 -0.13 2.33 5.08 -1.03 0.50 114.58 122.18 3hyj h GLU 12 Ca 0.15 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.53 3hyj h GLU 12 Cb 0.32 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 3hyj h GLU 12 CO 0.00 0.12 -0.01 0.82 -1.00 0.00 0.00 179.01 178.94 3hyj h ILE 13 N 0.18 0.90 -0.32 3.13 2.04 -1.21 -2.59 117.51 119.65 3hyj h ILE 13 Ca 0.29 -0.01 -0.03 0.00 1.00 0.00 0.00 64.86 66.11 3hyj h ILE 13 Cb 0.43 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 3hyj h ILE 13 CO -0.42 0.01 0.08 0.11 0.00 0.00 0.00 178.15 177.93 3hyj h LYS 14 N 0.03 0.46 -0.37 2.37 1.57 0.33 -2.00 116.57 118.96 3hyj h LYS 14 Ca 0.06 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 3hyj h LYS 14 Cb 0.08 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 3hyj h LYS 14 CO -0.11 0.42 -0.07 0.93 -0.57 0.00 0.00 179.45 180.05 3hyj h GLU 15 N 0.45 0.62 0.00 3.15 5.08 0.04 -2.19 114.58 121.73 3hyj h GLU 15 Ca 0.11 -0.17 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 3hyj h GLU 15 Cb 0.17 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3hyj h GLU 15 CO -0.00 0.69 -0.25 1.49 -1.00 0.00 0.00 179.01 179.94 3hyj h GLU 16 N 0.58 0.00 0.00 2.33 4.81 -0.98 -3.09 114.58 118.22 3hyj h GLU 16 Ca 0.11 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.33 3hyj h GLU 16 Cb 0.47 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.84 3hyj h GLU 16 CO 0.02 0.25 -0.43 -0.07 -0.73 0.00 0.00 179.01 178.05 3hyj h LEU 17 N 0.00 0.00 -1.85 1.64 3.38 -1.05 -3.31 115.31 114.11 3hyj h LEU 17 Ca -0.00 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.09 3hyj h LEU 17 Cb 0.53 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 3hyj h LEU 17 CO 0.03 0.06 0.35 0.58 0.09 0.00 0.00 178.44 179.56 3hyj h VAL 18 N 0.00 0.82 0.00 1.22 2.07 -1.34 -3.06 116.25 115.96 3hyj h VAL 18 Ca -0.01 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.46 3hyj h VAL 18 Cb 1.05 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 3hyj h VAL 18 CO 0.01 0.03 -0.97 0.59 0.02 0.00 0.00 177.57 177.25 3hyj n ASN 19 N -4.43 0.75 -4.68 0.57 3.02 -1.25 -4.87 115.26 104.36 3hyj n ASN 19 Ca 0.09 0.19 -0.56 0.00 -0.03 0.00 0.00 54.58 54.27 3hyj n ASN 19 Cb 0.47 0.50 -0.07 0.00 -0.61 0.00 0.00 39.78 40.07 3hyj n ASN 19 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3hyj n VAL 20 N -2.44 0.24 -0.67 2.41 0.31 -1.16 -4.90 118.33 112.12 3hyj n VAL 20 Ca 0.01 -0.04 -0.31 0.00 -0.01 0.00 0.00 64.34 63.98 3hyj n VAL 20 Cb 0.51 -1.15 0.17 0.00 -0.91 0.00 0.00 33.84 32.46 3hyj n VAL 20 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3hyj n PRO 21 N 4.75 -0.58 -0.05 5.55 -0.02 -1.26 -4.95 135.00 138.44 3hyj n PRO 21 Ca 0.24 -0.11 -0.13 0.00 -2.02 0.00 0.00 63.50 61.49 3hyj n PRO 21 Cb 0.15 -2.29 -0.12 0.00 -0.02 0.00 0.00 33.50 31.22 3hyj n PRO 21 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 3hyj h PHE 22 N -1.91 -0.01 0.00 6.00 0.04 -1.99 -3.50 116.94 115.56 3hyj h PHE 22 Ca -0.44 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.33 3hyj h PHE 22 Cb 1.28 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.43 3hyj h PHE 22 CO 0.47 0.81 0.00 0.41 -0.60 0.00 0.00 178.31 179.40 3hyj n GLY 23 N 1.22 -1.84 3.72 -1.45 0.00 -1.26 -4.40 105.19 101.18 3hyj n GLY 23 Ca -0.09 -2.00 -0.31 0.00 0.00 0.00 0.00 46.02 43.61 3hyj n GLY 23 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hyj s SER 24 N -4.00 3.74 0.30 1.61 1.04 -1.26 -4.79 113.70 110.34 3hyj s SER 24 Ca 0.00 2.05 0.06 0.00 0.48 0.00 0.00 55.95 58.54 3hyj s SER 24 Cb 0.00 -2.55 0.74 0.00 0.10 0.00 0.00 66.02 64.31 3hyj s SER 24 CO 0.00 -2.55 1.77 -0.09 0.98 0.00 0.00 173.24 173.35 3hyj h ARG 25 N -1.37 0.70 -0.11 4.02 2.43 -1.99 -1.78 114.38 116.28 3hyj h ARG 25 Ca -0.44 -0.04 -0.16 0.00 -0.81 0.00 0.00 59.98 58.53 3hyj h ARG 25 Cb 1.25 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.64 3hyj h ARG 25 CO 0.47 0.47 -0.63 1.49 -1.51 0.00 0.00 179.97 180.25 3hyj h GLU 26 N 0.72 0.41 -0.73 0.20 4.81 -1.98 0.60 114.58 118.61 3hyj h GLU 26 Ca 0.58 -0.29 -0.06 0.00 -0.13 0.00 0.00 59.36 59.45 3hyj h GLU 26 Cb 0.92 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.32 3hyj h GLU 26 CO -0.40 0.91 0.20 0.93 -0.73 0.00 0.00 179.01 179.92 3hyj h GLU 27 N 0.30 1.14 -0.47 1.92 5.08 -1.72 -0.61 114.58 120.23 3hyj h GLU 27 Ca -0.01 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.03 3hyj h GLU 27 Cb 1.17 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 3hyj h GLU 27 CO 0.11 0.99 0.08 0.28 -1.00 0.00 0.00 179.01 179.47 3hyj h VAL 28 N 1.09 1.25 -0.43 3.13 2.07 -0.92 -2.51 116.25 119.93 3hyj h VAL 28 Ca 0.23 -0.91 -0.08 0.00 0.82 0.00 0.00 66.70 66.76 3hyj h VAL 28 Cb 0.34 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 3hyj h VAL 28 CO -0.00 0.32 -0.08 0.40 0.02 0.00 0.00 177.57 178.23 3hyj h ILE 29 N 0.64 1.25 -0.67 4.57 2.04 -0.69 -2.33 117.51 122.32 3hyj h ILE 29 Ca 0.14 -1.10 -0.06 0.00 1.00 0.00 0.00 64.86 64.84 3hyj h ILE 29 Cb 0.39 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 3hyj h ILE 29 CO 0.01 0.38 0.20 0.28 0.00 0.00 0.00 178.15 179.02 3hyj h SER 30 N 0.68 0.98 -0.50 1.72 0.02 -1.00 -1.42 113.55 114.04 3hyj h SER 30 Ca 0.12 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 3hyj h SER 30 Cb 0.54 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 3hyj h SER 30 CO 0.03 0.93 0.33 -0.08 -1.14 0.00 0.00 176.83 176.90 3hyj h GLU 31 N 0.98 0.67 -0.98 3.45 4.81 -1.37 -1.54 114.58 120.58 3hyj h GLU 31 Ca 0.21 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.46 3hyj h GLU 31 Cb 0.31 -0.15 -0.06 0.00 0.63 0.00 0.00 28.75 29.48 3hyj h GLU 31 CO -0.00 0.45 0.64 1.25 -0.73 0.00 0.00 179.01 180.61 3hyj h LEU 32 N 0.68 1.02 -1.05 1.64 5.85 -1.12 -0.00 115.31 122.33 3hyj h LEU 32 Ca 0.18 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.85 3hyj h LEU 32 Cb -0.06 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.73 3hyj h LEU 32 CO -0.04 0.65 0.04 0.25 -0.34 0.00 0.00 178.44 179.01 3hyj h LEU 33 N 1.15 0.68 -0.11 2.25 5.85 -0.85 0.70 115.31 124.99 3hyj h LEU 33 Ca 0.42 -0.14 0.04 0.00 0.84 0.00 0.00 57.88 59.04 3hyj h LEU 33 Cb 0.16 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 40.94 3hyj h LEU 33 CO -0.16 0.73 -0.47 1.23 -0.34 0.00 0.00 178.44 179.43 3hyj h GLY 34 N 0.93 -0.85 0.56 3.75 0.00 -0.01 0.32 103.07 107.77 3hyj h GLY 34 Ca 0.14 0.58 0.08 0.00 0.00 0.00 0.00 47.33 48.13 3hyj h GLY 34 CO 0.01 -0.22 0.35 0.74 0.00 0.00 0.00 176.54 177.42 3hyj h PHE 35 N -0.54 0.64 0.10 5.60 0.04 -0.79 -0.68 116.94 121.30 3hyj h PHE 35 Ca 0.06 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.85 3hyj h PHE 35 Cb 0.66 -0.19 0.00 0.00 2.20 0.00 0.00 35.95 38.62 3hyj h PHE 35 CO -0.51 0.26 -0.05 0.82 -0.60 0.00 0.00 178.31 178.24 3hyj h ILE 36 N 0.63 0.99 -0.18 -0.55 2.04 -0.27 0.11 117.51 120.27 3hyj h ILE 36 Ca 0.32 -0.31 -0.12 0.00 1.00 0.00 0.00 64.86 65.76 3hyj h ILE 36 Cb 0.29 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 3hyj h ILE 36 CO -0.23 0.08 -0.39 0.11 0.00 0.00 0.00 178.15 177.72 3hyj h LYS 37 N -0.27 0.40 0.05 2.37 1.79 0.02 0.61 116.57 121.54 3hyj h LYS 37 Ca -0.01 -0.19 -0.28 0.00 -2.18 0.00 0.00 60.65 57.99 3hyj h LYS 37 Cb 0.22 -0.00 0.02 0.00 -1.58 0.00 0.00 32.23 30.89 3hyj h LYS 37 CO 0.02 0.73 -1.12 0.00 -1.08 0.00 0.00 179.45 178.00 3hyj h ALA 38 N 1.25 0.09 0.00 3.86 0.00 -1.03 -3.40 119.26 120.02 3hyj h ALA 38 Ca 0.03 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.21 3hyj h ALA 38 Cb 0.84 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3hyj h ALA 38 CO 0.07 0.70 -0.03 0.54 0.00 0.00 0.00 179.25 180.52 3hyj n ARG 39 N -3.82 0.10 -3.19 0.00 5.12 0.35 -4.75 116.66 110.47 3hyj n ARG 39 Ca -0.12 -0.57 -0.31 0.00 -1.93 0.00 0.00 57.85 54.93 3hyj n ARG 39 Cb 0.92 -0.52 -0.04 0.00 -1.16 0.00 0.00 32.46 31.66 3hyj n ARG 39 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 3hyj s GLY 40 N -0.10 2.08 -0.14 -0.13 0.00 0.21 -2.97 107.32 106.26 3hyj s GLY 40 Ca 0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 44.72 44.40 3hyj s GLY 40 CO 0.00 -0.13 0.09 -0.35 0.00 0.00 0.00 173.10 172.71 3hyj s ASP 41 N -2.80 2.07 0.12 1.64 2.15 -0.51 -4.90 116.67 114.44 3hyj s ASP 41 Ca 0.49 -0.45 -0.25 0.00 0.43 0.00 0.00 52.55 52.76 3hyj s ASP 41 Cb -0.11 -0.20 -0.07 0.00 -0.30 0.00 0.00 42.92 42.24 3hyj s ASP 41 CO 0.26 -0.33 0.76 -0.76 -0.17 0.00 0.00 175.17 174.93 3hyj s LEU 42 N 2.15 4.54 0.00 -1.34 1.43 -1.26 -1.03 118.68 123.17 3hyj s LEU 42 Ca 0.03 1.55 0.00 0.00 -1.03 0.00 0.00 54.13 54.68 3hyj s LEU 42 Cb -0.15 -3.24 0.00 0.00 0.03 0.00 0.00 46.19 42.83 3hyj s LEU 42 CO -0.08 0.15 0.30 0.47 0.23 0.00 0.00 176.35 177.42 3hyj n ASP 43 N 1.99 -0.15 0.00 2.29 8.00 -1.26 -5.02 116.55 122.41 3hyj n ASP 43 Ca -0.05 -0.60 0.00 0.00 0.71 0.00 0.00 54.79 54.85 3hyj n ASP 43 Cb 0.49 0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 3hyj n ASP 43 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 3hyj n ARG 47 N 0.00 0.00 -3.69 -1.24 0.00 -1.26 -4.91 116.66 105.56 3hyj n ARG 47 Ca -0.04 0.00 -0.18 0.00 -0.00 0.00 0.00 57.85 57.63 3hyj n ARG 47 Cb 0.30 0.00 -0.05 0.00 0.00 0.00 0.00 32.46 32.71 3hyj n ARG 47 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 3hyj n HIS 48 N 0.00 0.19 -4.54 -0.14 8.25 -1.26 -5.09 115.22 112.64 3hyj n HIS 48 Ca 0.00 -1.80 -0.34 0.00 -0.26 0.00 0.00 57.72 55.32 3hyj n HIS 48 Cb 0.00 -0.04 -0.12 0.00 1.12 0.00 0.00 29.99 30.96 3hyj n HIS 48 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3hyj s ILE 49 N -2.56 3.78 -0.22 1.59 1.01 -0.28 -4.46 121.20 120.06 3hyj s ILE 49 Ca 0.12 -0.43 -0.07 0.00 0.00 0.00 0.00 60.65 60.27 3hyj s ILE 49 Cb 0.01 -2.59 -0.04 0.00 0.01 0.00 0.00 42.46 39.85 3hyj s ILE 49 CO 0.09 0.56 0.07 -0.69 0.00 0.00 0.00 174.94 174.97 3hyj s VAL 50 N -0.36 4.56 -0.23 2.92 1.01 -0.20 -0.82 120.40 127.28 3hyj s VAL 50 Ca 0.05 -0.10 -0.08 0.00 0.00 0.00 0.00 61.98 61.86 3hyj s VAL 50 Cb -0.12 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.12 3hyj s VAL 50 CO 0.02 0.38 0.08 -0.36 0.00 0.00 0.00 175.10 175.22 3hyj s PHE 51 N 1.11 3.14 -0.46 5.22 0.08 0.15 -1.42 117.98 125.80 3hyj s PHE 51 Ca 0.04 -0.21 -0.13 0.00 0.12 0.00 0.00 56.93 56.75 3hyj s PHE 51 Cb -0.14 -2.20 0.09 0.00 -0.57 0.00 0.00 43.02 40.19 3hyj s PHE 51 CO 0.03 -0.18 0.36 -1.12 -0.10 0.00 0.00 175.22 174.21 3hyj s SER 52 N 1.26 5.95 -0.07 1.36 0.01 -1.16 -1.44 113.70 119.61 3hyj s SER 52 Ca 0.05 -1.50 0.00 0.00 1.31 0.00 0.00 55.95 55.81 3hyj s SER 52 Cb -0.14 -2.11 -0.03 0.00 0.21 0.00 0.00 66.02 63.95 3hyj s SER 52 CO 0.04 -0.65 -0.06 -0.76 0.41 0.00 0.00 173.24 172.22 3hyj s LEU 53 N 1.54 3.21 0.12 2.44 1.43 -0.08 -4.91 118.68 122.44 3hyj s LEU 53 Ca 0.04 -0.01 0.22 0.00 -1.03 0.00 0.00 54.13 53.35 3hyj s LEU 53 Cb -0.25 -1.70 -0.11 0.00 0.03 0.00 0.00 46.19 44.15 3hyj s LEU 53 CO 0.04 0.36 0.85 1.41 0.23 0.00 0.00 176.35 179.24 3hyj n HIS 54 N 2.25 0.67 -3.58 0.29 8.25 -1.26 0.57 115.22 122.40 3hyj n HIS 54 Ca -0.18 0.20 -0.39 0.00 -0.26 0.00 0.00 57.72 57.09 3hyj n HIS 54 Cb 0.53 -0.83 -0.11 0.00 1.12 0.00 0.00 29.99 30.71 3hyj n HIS 54 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3hyj s SER 55 N -5.12 6.01 0.20 0.41 0.15 -1.26 -4.87 113.70 109.22 3hyj s SER 55 Ca -0.03 -0.14 -0.11 0.00 0.70 0.00 0.00 55.95 56.37 3hyj s SER 55 Cb 0.11 -2.12 0.15 0.00 -1.71 0.00 0.00 66.02 62.45 3hyj s SER 55 CO 0.83 -0.11 1.84 0.15 1.20 0.00 0.00 173.24 177.16 3hyj h PHE 56 N 8.40 0.77 -0.20 3.44 3.57 -1.90 -0.79 116.94 130.23 3hyj h PHE 56 Ca -0.34 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.18 3hyj h PHE 56 Cb 1.18 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 3hyj h PHE 56 CO 0.73 0.45 0.13 0.00 -2.23 0.00 0.00 178.31 177.39 3hyj h ALA 57 N 1.27 0.26 -0.97 2.41 0.00 -1.93 0.69 119.26 120.99 3hyj h ALA 57 Ca 0.26 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.18 3hyj h ALA 57 Cb -0.01 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 3hyj h ALA 57 CO -0.09 -0.25 0.63 0.00 0.00 0.00 0.00 179.25 179.54 3hyj h ALA 58 N 1.05 1.29 -0.30 0.00 0.00 -1.75 -1.26 119.26 118.30 3hyj h ALA 58 Ca 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3hyj h ALA 58 Cb -0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 3hyj h ALA 58 CO -0.01 0.49 0.20 1.03 0.00 0.00 0.00 179.25 180.96 3hyj h SER 59 N 1.20 0.34 -0.86 0.00 0.87 -0.66 -0.18 113.55 114.26 3hyj h SER 59 Ca 0.39 -0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.95 3hyj h SER 59 Cb 0.03 -0.09 -0.04 0.00 -0.44 0.00 0.00 62.40 61.86 3hyj h SER 59 CO -0.13 0.25 0.57 0.03 -0.53 0.00 0.00 176.83 177.02 3hyj h ARG 60 N 0.40 1.12 -0.23 2.24 3.08 -0.31 -2.76 114.38 117.93 3hyj h ARG 60 Ca 0.11 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.09 3hyj h ARG 60 Cb -0.05 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 29.74 3hyj h ARG 60 CO -0.02 0.74 0.15 -0.09 -1.07 0.00 0.00 179.97 179.68 3hyj h ARG 61 N 1.15 0.30 -0.52 0.04 9.65 -0.70 -2.62 114.38 121.68 3hyj h ARG 61 Ca 0.32 -0.02 0.10 0.00 -1.10 0.00 0.00 59.98 59.28 3hyj h ARG 61 Cb -0.11 -0.07 -0.08 0.00 -1.39 0.00 0.00 29.97 28.32 3hyj h ARG 61 CO -0.08 0.21 0.05 1.25 2.80 0.00 0.00 179.97 184.20 3hyj h LEU 62 N 0.30 -0.12 -1.62 3.80 5.85 -0.85 0.67 115.31 123.34 3hyj h LEU 62 Ca 0.08 0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 3hyj h LEU 62 Cb -0.02 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 3hyj h LEU 62 CO -0.02 -0.04 -0.07 -0.07 -0.34 0.00 0.00 178.44 177.90 3hyj h LEU 63 N 0.17 0.14 -0.13 2.25 3.38 -1.25 -0.38 115.31 119.49 3hyj h LEU 63 Ca 0.27 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 58.06 3hyj h LEU 63 Cb 0.40 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.12 3hyj h LEU 63 CO -0.40 0.24 -0.53 0.78 0.09 0.00 0.00 178.44 178.62 3hyj h ASN 64 N 0.15 0.69 -0.29 -0.43 2.35 -0.87 -1.53 115.58 115.65 3hyj h ASN 64 Ca 0.03 -0.62 0.07 0.00 -0.55 0.00 0.00 56.30 55.23 3hyj h ASN 64 Cb 0.23 -0.20 -0.08 0.00 0.05 0.00 0.00 38.32 38.32 3hyj h ASN 64 CO 0.01 1.20 -0.28 -0.07 -1.65 0.00 0.00 177.43 176.64 3hyj h LEU 65 N 0.23 -0.91 -1.42 1.61 4.07 0.00 -0.77 115.31 118.12 3hyj h LEU 65 Ca -0.03 0.16 0.00 0.00 0.08 0.00 0.00 57.88 58.09 3hyj h LEU 65 Cb 1.16 0.43 -0.03 0.00 1.08 0.00 0.00 40.66 43.30 3hyj h LEU 65 CO 0.11 -0.30 0.34 0.24 -1.08 0.00 0.00 178.44 177.75 3hyj h MET 66 N -0.27 0.73 0.74 1.13 2.86 -1.10 -1.56 114.93 117.47 3hyj h MET 66 Ca 0.15 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.70 3hyj h MET 66 Cb 0.50 -0.16 0.01 0.00 0.06 0.00 0.00 31.60 32.01 3hyj h MET 66 CO -0.44 0.50 -0.36 0.87 1.06 0.00 0.00 176.91 178.54 3hyj h LYS 67 N 0.75 -0.96 -0.84 1.72 6.56 -0.37 0.19 116.57 123.61 3hyj h LYS 67 Ca 0.20 0.07 0.21 0.00 -1.06 0.00 0.00 60.65 60.06 3hyj h LYS 67 Cb -0.05 0.22 -0.13 0.00 -0.57 0.00 0.00 32.23 31.70 3hyj h LYS 67 CO -0.04 -0.62 0.25 -0.92 -2.06 0.00 0.00 179.45 176.06 3hyj h TYR 68 N -1.19 0.39 0.00 -1.35 5.03 -1.01 0.42 116.97 119.25 3hyj h TYR 68 Ca -0.10 0.05 0.00 0.00 2.58 0.00 0.00 58.73 61.25 3hyj h TYR 68 Cb 0.78 -0.04 0.00 0.00 1.55 0.00 0.00 36.73 39.03 3hyj h TYR 68 CO -0.00 -0.14 0.00 1.28 -1.32 0.00 0.00 178.16 177.98 3hyj n LEU 69 N -5.17 0.00 -3.31 2.82 4.77 -0.60 -4.93 117.00 110.58 3hyj n LEU 69 Ca 0.19 0.03 -0.23 0.00 -0.03 0.00 0.00 56.01 55.97 3hyj n LEU 69 Cb 0.61 -0.03 0.06 0.00 -2.33 0.00 0.00 43.42 41.73 3hyj n LEU 69 CO 0.09 -0.00 0.11 -1.20 -1.33 0.00 0.00 177.39 175.07 3hyj n SER 70 N -1.03 -6.23 -4.44 -1.43 7.64 0.15 -4.98 113.62 103.30 3hyj n SER 70 Ca 0.23 -0.41 -0.38 0.00 1.01 0.00 0.00 58.87 59.31 3hyj n SER 70 Cb 0.12 -4.97 -0.12 0.00 -1.01 0.00 0.00 64.21 58.23 3hyj n SER 70 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3hyj s LYS 71 N -6.01 3.43 0.08 1.43 3.01 0.56 -5.03 119.74 117.22 3hyj s LYS 71 Ca 0.44 -0.65 -0.31 0.00 -1.01 0.00 0.00 55.97 54.44 3hyj s LYS 71 Cb -0.20 -3.50 -0.11 0.00 -1.01 0.00 0.00 37.83 33.02 3hyj s LYS 71 CO 0.55 -0.35 1.86 -2.30 0.51 0.00 0.00 175.35 175.62 3hyj n PRO 72 N 4.96 2.72 -3.21 -1.68 -0.02 -1.26 -4.58 135.00 131.92 3hyj n PRO 72 Ca -0.14 0.99 -0.39 0.00 -2.02 0.00 0.00 63.50 61.93 3hyj n PRO 72 Cb 0.50 -2.89 -0.06 0.00 -0.02 0.00 0.00 33.50 31.03 3hyj n PRO 72 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3hyj s VAL 73 N 3.15 5.10 -0.01 -1.45 1.01 -1.26 -1.21 120.40 125.73 3hyj s VAL 73 Ca 0.84 1.06 0.03 0.00 0.00 0.00 0.00 61.98 63.92 3hyj s VAL 73 Cb -0.50 -3.88 -0.25 0.00 0.00 0.00 0.00 36.38 31.75 3hyj s VAL 73 CO 0.40 0.21 0.81 -1.28 0.00 0.00 0.00 175.10 175.24 3hyj h SER 74 N 7.18 0.20 -3.42 3.32 0.87 -0.45 -3.48 113.55 117.76 3hyj h SER 74 Ca -0.36 -0.32 0.07 0.00 -1.23 0.00 0.00 61.79 59.96 3hyj h SER 74 Cb 1.16 -0.06 -0.26 0.00 -0.44 0.00 0.00 62.40 62.80 3hyj h SER 74 CO 0.75 1.27 0.50 -0.70 -0.53 0.00 0.00 176.83 178.13 3hyj s GLU 75 N -2.62 0.51 -0.29 2.24 2.56 -1.19 -4.99 118.70 114.92 3hyj s GLU 75 Ca -0.07 0.44 -0.02 0.00 0.00 0.00 0.00 54.97 55.31 3hyj s GLU 75 Cb 0.08 0.25 0.10 0.00 2.00 0.00 0.00 34.13 36.55 3hyj s GLU 75 CO 0.83 -0.09 0.10 0.42 -0.56 0.00 0.00 175.26 175.96 3hyj s ILE 76 N -0.18 0.51 -0.05 -3.70 1.01 -1.26 -1.36 121.20 116.18 3hyj s ILE 76 Ca 0.02 -1.10 0.04 0.00 0.00 0.00 0.00 60.65 59.60 3hyj s ILE 76 Cb -0.04 -1.37 -0.03 0.00 0.01 0.00 0.00 42.46 41.04 3hyj s ILE 76 CO -0.04 -0.65 -0.14 0.27 0.00 0.00 0.00 174.94 174.37 3hyj s ILE 77 N 1.81 3.05 -0.26 2.92 -0.00 -0.75 -4.99 121.20 122.98 3hyj s ILE 77 Ca 0.09 -0.73 -0.11 0.00 -0.00 0.00 0.00 60.65 59.90 3hyj s ILE 77 Cb -0.17 -2.19 -0.05 0.00 -0.00 0.00 0.00 42.46 40.05 3hyj s ILE 77 CO -0.28 0.59 0.17 -0.69 -0.00 0.00 0.00 174.94 174.74 3hyj s VAL 78 N -0.71 5.34 -0.18 8.37 1.01 -1.26 -1.06 120.40 131.90 3hyj s VAL 78 Ca 0.11 0.18 -0.19 0.00 0.00 0.00 0.00 61.98 62.07 3hyj s VAL 78 Cb -0.11 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 3hyj s VAL 78 CO 0.01 0.30 0.54 -0.70 0.00 0.00 0.00 175.10 175.24 3hyj s GLU 79 N 1.38 4.22 0.45 2.72 2.56 -0.69 -5.01 118.70 124.34 3hyj s GLU 79 Ca 0.07 0.47 -0.22 0.00 0.00 0.00 0.00 54.97 55.29 3hyj s GLU 79 Cb -0.15 -3.54 -0.09 0.00 2.00 0.00 0.00 34.13 32.35 3hyj s GLU 79 CO 0.07 -0.11 1.03 -1.59 -0.56 0.00 0.00 175.26 174.11 3hyj s LYS 80 N 1.50 3.99 0.15 4.30 -2.85 -1.26 -3.21 119.74 122.36 3hyj s LYS 80 Ca 0.26 1.39 -0.01 0.00 -1.00 0.00 0.00 55.97 56.61 3hyj s LYS 80 Cb -0.16 -2.28 -0.04 0.00 -2.06 0.00 0.00 37.83 33.29 3hyj s LYS 80 CO 0.10 -0.27 1.35 0.77 0.10 0.00 0.00 175.35 177.40 3hyj h SER 81 N 1.97 0.41 -2.41 0.03 0.02 -1.98 -3.42 113.55 108.17 3hyj h SER 81 Ca -0.49 -0.32 -0.75 0.00 -0.84 0.00 0.00 61.79 59.39 3hyj h SER 81 Cb 1.21 -0.13 -0.20 0.00 0.14 0.00 0.00 62.40 63.43 3hyj h SER 81 CO 0.61 1.12 1.21 1.41 -1.14 0.00 0.00 176.83 180.03 3hyj n HIS 82 N -3.72 4.99 -3.59 3.45 8.25 -1.26 -5.20 115.22 118.14 3hyj n HIS 82 Ca -0.05 -3.45 -0.06 0.00 -0.26 0.00 0.00 57.72 53.90 3hyj n HIS 82 Cb 0.81 -2.10 -0.03 0.00 1.12 0.00 0.00 29.99 29.79 3hyj n HIS 82 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 3hyj s ARG 87 N 1.00 0.36 0.33 -0.41 3.52 -1.26 -5.02 118.95 117.47 3hyj s ARG 87 Ca 0.41 -0.04 -0.11 0.00 -0.13 0.00 0.00 55.73 55.86 3hyj s ARG 87 Cb -0.04 0.17 0.02 0.00 -1.56 0.00 0.00 34.95 33.54 3hyj s ARG 87 CO -0.01 -0.14 0.61 1.52 -0.81 0.00 0.00 175.30 176.47 3hyj s TYR 88 N -1.84 0.47 -0.15 5.12 -0.85 -1.20 -4.86 117.35 114.05 3hyj s TYR 88 Ca 0.06 -0.91 0.02 0.00 -0.52 0.00 0.00 57.07 55.73 3hyj s TYR 88 Cb -0.01 0.37 0.01 0.00 0.38 0.00 0.00 41.96 42.71 3hyj s TYR 88 CO -0.04 -1.27 -0.21 0.42 -1.52 0.00 0.00 175.55 172.93 3hyj s ILE 89 N -3.08 2.03 -0.41 -3.49 1.01 0.19 -1.70 121.20 115.76 3hyj s ILE 89 Ca 0.22 -0.95 -0.17 0.00 0.00 0.00 0.00 60.65 59.75 3hyj s ILE 89 Cb -0.03 -1.81 0.02 0.00 0.01 0.00 0.00 42.46 40.65 3hyj s ILE 89 CO 0.14 0.54 0.41 -1.59 0.00 0.00 0.00 174.94 174.44 3hyj s LYS 90 N 0.94 3.13 -0.23 2.79 0.00 -0.23 -0.90 119.74 125.24 3hyj s LYS 90 Ca -0.04 -0.76 -0.10 0.00 0.00 0.00 0.00 55.97 55.07 3hyj s LYS 90 Cb -0.15 -3.95 -0.05 0.00 0.00 0.00 0.00 37.83 33.68 3hyj s LYS 90 CO -0.05 -0.80 0.14 0.42 0.00 0.00 0.00 175.35 175.06 3hyj s ILE 91 N 2.06 5.24 -0.20 3.79 1.01 -0.52 -1.81 121.20 130.76 3hyj s ILE 91 Ca 0.11 0.13 -0.05 0.00 0.00 0.00 0.00 60.65 60.85 3hyj s ILE 91 Cb -0.17 -3.42 -0.02 0.00 0.01 0.00 0.00 42.46 38.85 3hyj s ILE 91 CO 0.13 0.38 -0.01 -0.89 0.00 0.00 0.00 174.94 174.54 3hyj s THR 92 N 0.87 3.83 -0.01 2.92 2.01 -0.46 0.33 115.64 125.12 3hyj s THR 92 Ca 0.07 -0.36 0.01 0.00 0.31 0.00 0.00 61.69 61.72 3hyj s THR 92 Cb -0.13 -2.72 0.01 0.00 0.01 0.00 0.00 72.50 69.67 3hyj s THR 92 CO 0.03 0.44 -0.02 0.00 -0.69 0.00 0.00 174.62 174.38 3hyj s ALA 93 N 0.98 0.28 0.90 7.40 0.00 -0.00 0.38 121.76 131.69 3hyj s ALA 93 Ca 0.01 0.01 -0.11 0.00 0.00 0.00 0.00 51.96 51.87 3hyj s ALA 93 Cb -0.14 -0.18 0.14 0.00 0.00 0.00 0.00 23.12 22.93 3hyj s ALA 93 CO 0.01 0.00 1.16 -1.21 0.00 0.00 0.00 175.76 175.72 3hyj s GLU 94 N 0.43 1.12 0.20 0.00 2.02 -0.35 -1.13 118.70 120.98 3hyj s GLU 94 Ca -0.04 1.59 -0.14 0.00 0.02 0.00 0.00 54.97 56.40 3hyj s GLU 94 Cb -0.07 -1.73 0.01 0.00 0.10 0.00 0.00 34.13 32.44 3hyj s GLU 94 CO -0.01 -2.57 0.45 1.52 0.02 0.00 0.00 175.26 174.67 3hyj s TYR 95 N -2.56 0.10 0.02 1.61 1.13 -1.26 -4.76 117.35 111.64 3hyj s TYR 95 Ca 0.68 -0.46 0.09 0.00 -1.41 0.00 0.00 57.07 55.97 3hyj s TYR 95 Cb -0.24 0.24 -0.02 0.00 -1.10 0.00 0.00 41.96 40.84 3hyj s TYR 95 CO 0.57 -0.88 -0.26 -1.54 -2.51 0.00 0.00 175.55 170.93 3hyj s SER 96 N -2.92 3.07 0.53 -0.18 1.04 -1.26 -4.89 113.70 109.09 3hyj s SER 96 Ca 0.13 -0.53 0.24 0.00 0.48 0.00 0.00 55.95 56.27 3hyj s SER 96 Cb 0.00 -0.30 1.39 0.00 0.10 0.00 0.00 66.02 67.20 3hyj s SER 96 CO 0.00 0.28 2.03 -0.33 0.98 0.00 0.00 173.24 176.20 3hyj h GLU 97 N 5.10 0.00 -0.13 4.02 5.08 -2.02 -0.71 114.58 125.92 3hyj h GLU 97 Ca -0.45 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 57.95 3hyj h GLU 97 Cb 1.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 3hyj h GLU 97 CO 0.45 0.00 0.13 0.66 -1.00 0.00 0.00 179.01 179.25 3hyj h SER 98 N 0.00 0.00 -0.34 1.42 4.64 -1.99 -1.08 113.55 116.20 3hyj h SER 98 Ca 0.19 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.51 3hyj h SER 98 Cb 0.79 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.86 3hyj h SER 98 CO -0.00 0.00 0.20 -0.26 -0.87 0.00 0.00 176.83 175.89 3hyj h PHE 99 N 0.00 0.48 0.00 4.77 0.05 -1.54 -3.00 116.94 117.70 3hyj h PHE 99 Ca 0.06 -0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.85 3hyj h PHE 99 Cb 0.31 -0.16 0.00 0.00 2.00 0.00 0.00 35.95 38.10 3hyj h PHE 99 CO 0.00 0.34 0.00 0.52 -0.18 0.00 0.00 178.31 178.99 3hyj h MET 100 N 0.50 0.00 0.00 1.51 2.86 -1.35 -3.30 114.93 115.15 3hyj h MET 100 Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3hyj h MET 100 Cb 0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.68 3hyj h MET 100 CO -0.02 0.00 0.00 1.55 1.06 0.00 0.00 176.91 179.50 3hyj n VAL 101 N -2.36 0.34 -2.04 -2.22 3.14 -1.14 -5.00 118.33 109.06 3hyj n VAL 101 Ca 0.03 -0.51 -0.38 0.00 -2.96 0.00 0.00 64.34 60.53 3hyj n VAL 101 Cb 0.31 0.99 0.01 0.00 -1.06 0.00 0.00 33.84 34.10 3hyj n VAL 101 CO 0.00 0.00 0.00 -0.51 -6.46 0.00 0.00 176.83 169.86 3hyj s ILE 102 N -0.34 2.64 -0.37 1.55 2.07 -1.21 -5.01 121.20 120.53 3hyj s ILE 102 Ca 0.00 0.48 0.02 0.00 -1.41 0.00 0.00 60.65 59.74 3hyj s ILE 102 Cb 0.00 -3.24 0.11 0.00 0.13 0.00 0.00 42.46 39.46 3hyj s ILE 102 CO 0.00 -0.01 0.13 -1.61 -1.91 0.00 0.00 174.94 171.54 3hyj s GLU 103 N -2.80 1.26 -0.27 3.50 2.02 -1.26 -5.00 118.70 116.15 3hyj s GLU 103 Ca 0.67 -1.73 0.10 0.00 0.02 0.00 0.00 54.97 54.03 3hyj s GLU 103 Cb -0.34 -2.67 0.71 0.00 0.10 0.00 0.00 34.13 31.93 3hyj s GLU 103 CO 0.40 -1.02 1.69 -0.35 0.02 0.00 0.00 175.26 176.01 3hyj n PRO 104 N 4.17 3.93 0.03 0.39 -0.04 -1.26 -4.44 135.00 137.79 3hyj n PRO 104 Ca 0.03 -2.83 0.12 0.00 -0.04 0.00 0.00 63.50 60.78 3hyj n PRO 104 Cb 0.39 -2.17 0.11 0.00 -0.04 0.00 0.00 33.50 31.79 3hyj n PRO 104 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3hyj n PHE 105 N 0.16 0.32 0.10 0.54 3.72 -1.26 -1.32 117.46 119.73 3hyj n PHE 105 Ca 0.33 0.09 0.04 0.00 -0.05 0.00 0.00 57.45 57.87 3hyj n PHE 105 Cb 1.23 -0.48 0.08 0.00 -0.94 0.00 0.00 39.48 39.38 3hyj n PHE 105 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 3hyj n PHE 106 N -1.93 0.19 -3.83 1.38 3.01 -1.26 -4.84 117.46 110.18 3hyj n PHE 106 Ca 0.03 -0.26 -0.26 0.00 1.01 0.00 0.00 57.45 57.96 3hyj n PHE 106 Cb 0.42 -0.02 -0.17 0.00 -0.01 0.00 0.00 39.48 39.71 3hyj n PHE 106 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 3hyj s ASP 107 N -0.88 2.43 0.27 4.37 3.68 -1.26 -5.05 116.67 120.24 3hyj s ASP 107 Ca 0.15 -0.50 -0.00 0.00 2.13 0.00 0.00 52.55 54.32 3hyj s ASP 107 Cb 0.09 -0.71 0.49 0.00 -1.45 0.00 0.00 42.92 41.34 3hyj s ASP 107 CO 0.12 -0.21 1.84 1.62 0.13 0.00 0.00 175.17 178.68 3hyj h VAL 108 N 6.37 0.96 -0.78 1.11 3.04 -1.89 0.54 116.25 125.60 3hyj h VAL 108 Ca -0.22 -0.35 -0.02 0.00 -1.01 0.00 0.00 66.70 65.11 3hyj h VAL 108 Cb 1.12 -0.14 -0.04 0.00 -2.01 0.00 0.00 31.29 30.22 3hyj h VAL 108 CO 0.35 0.18 0.41 0.00 -1.01 0.00 0.00 177.57 177.50 3hyj h ALA 109 N 1.51 1.00 -0.12 3.17 0.00 -1.96 0.26 119.26 123.11 3hyj h ALA 109 Ca 0.47 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 55.07 3hyj h ALA 109 Cb 0.39 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 3hyj h ALA 109 CO -0.24 0.52 -0.68 -0.07 0.00 0.00 0.00 179.25 178.78 3hyj h LEU 110 N 1.08 0.59 0.06 0.00 3.38 -1.48 -2.29 115.31 116.65 3hyj h LEU 110 Ca 0.27 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 3hyj h LEU 110 Cb 0.06 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3hyj h LEU 110 CO -0.04 1.10 -0.03 0.15 0.09 0.00 0.00 178.44 179.71 3hyj h PHE 111 N 0.36 -0.07 -0.64 1.13 3.57 0.38 -0.18 116.94 121.49 3hyj h PHE 111 Ca -0.02 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.61 3hyj h PHE 111 Cb 1.25 0.02 -0.10 0.00 2.79 0.00 0.00 35.95 39.92 3hyj h PHE 111 CO 0.05 0.19 0.09 0.28 -2.23 0.00 0.00 178.31 176.69 3hyj h VAL 112 N -0.32 0.55 -0.56 1.41 2.07 -0.51 0.21 116.25 119.10 3hyj h VAL 112 Ca -0.01 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 3hyj h VAL 112 Cb 0.29 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.35 3hyj h VAL 112 CO 0.01 0.04 0.34 0.28 0.02 0.00 0.00 177.57 178.26 3hyj h SER 113 N 0.21 0.66 -0.25 0.57 0.02 -0.98 -1.32 113.55 112.46 3hyj h SER 113 Ca 0.34 -0.03 -0.19 0.00 -0.84 0.00 0.00 61.79 61.07 3hyj h SER 113 Cb 0.55 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.93 3hyj h SER 113 CO -0.48 0.51 -0.58 0.15 -1.14 0.00 0.00 176.83 175.29 3hyj h PHE 114 N 0.77 1.09 -0.76 3.45 3.57 0.85 -2.72 116.94 123.19 3hyj h PHE 114 Ca 0.20 -0.40 -0.03 0.00 3.53 0.00 0.00 57.97 61.28 3hyj h PHE 114 Cb -0.03 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 38.47 3hyj h PHE 114 CO 0.00 1.23 0.38 -0.07 -2.23 0.00 0.00 178.31 177.62 3hyj h LEU 115 N 0.65 0.99 -0.99 0.59 3.38 -0.11 -1.59 115.31 118.23 3hyj h LEU 115 Ca 0.01 -0.13 0.07 0.00 0.09 0.00 0.00 57.88 57.92 3hyj h LEU 115 Cb 1.19 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 41.62 3hyj h LEU 115 CO 0.13 0.84 0.64 -0.09 0.09 0.00 0.00 178.44 180.04 3hyj h ARG 116 N 1.07 1.11 -0.31 1.13 2.43 -1.14 -1.32 114.38 117.34 3hyj h ARG 116 Ca 0.26 -0.07 -0.13 0.00 -0.81 0.00 0.00 59.98 59.24 3hyj h ARG 116 Cb 0.10 -0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 29.40 3hyj h ARG 116 CO -0.04 0.73 -0.30 0.78 -1.51 0.00 0.00 179.97 179.63 3hyj h GLY 117 N 1.14 0.82 0.63 2.80 0.00 -1.12 -2.41 103.07 104.94 3hyj h GLY 117 Ca 0.44 -0.84 0.06 0.00 0.00 0.00 0.00 47.33 46.99 3hyj h GLY 117 CO -0.18 0.75 0.30 1.41 0.00 0.00 0.00 176.54 178.82 3hyj h LEU 118 N 0.51 0.42 -0.01 3.11 3.38 -0.90 -2.55 115.31 119.27 3hyj h LEU 118 Ca 0.05 0.04 -0.19 0.00 0.09 0.00 0.00 57.88 57.86 3hyj h LEU 118 Cb 0.88 -0.04 0.02 0.00 0.09 0.00 0.00 40.66 41.61 3hyj h LEU 118 CO 0.08 0.27 -0.76 0.15 0.09 0.00 0.00 178.44 178.27 3hyj h PHE 119 N 0.56 0.77 -0.02 1.13 3.04 -1.17 0.19 116.94 121.44 3hyj h PHE 119 Ca 0.28 -0.42 0.03 0.00 3.98 0.00 0.00 57.97 61.84 3hyj h PHE 119 Cb 0.21 -0.09 -0.04 0.00 2.56 0.00 0.00 35.95 38.59 3hyj h PHE 119 CO -0.10 1.24 -0.20 -0.07 -2.02 0.00 0.00 178.31 177.16 3hyj h LEU 120 N 0.09 -0.59 0.11 0.59 3.38 -1.49 0.00 115.31 117.40 3hyj h LEU 120 Ca -0.09 0.09 -0.27 0.00 0.09 0.00 0.00 57.88 57.69 3hyj h LEU 120 Cb 1.44 0.25 -0.00 0.00 0.09 0.00 0.00 40.66 42.44 3hyj h LEU 120 CO 0.15 -0.26 -1.29 0.77 0.09 0.00 0.00 178.44 177.90 3hyj h SER 121 N -0.31 0.36 0.00 -0.43 4.64 -1.41 -3.40 113.55 113.01 3hyj h SER 121 Ca 0.07 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 3hyj h SER 121 Cb 0.40 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 3hyj h SER 121 CO -0.20 1.33 0.00 0.61 -0.87 0.00 0.00 176.83 177.70 3hyj n GLY 122 N 1.54 -0.63 3.92 -0.77 0.00 0.62 -4.68 105.19 105.20 3hyj n GLY 122 Ca -0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.64 3hyj n GLY 122 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hyj s GLY 123 N -0.24 1.91 0.13 -0.02 0.00 -0.01 -0.80 107.32 108.30 3hyj s GLY 123 Ca 0.00 -0.80 -0.16 0.00 0.00 0.00 0.00 44.72 43.76 3hyj s GLY 123 CO 0.00 -0.75 0.41 -1.35 0.00 0.00 0.00 173.10 171.41 3hyj s SER 124 N -2.96 -0.23 -0.08 1.64 1.04 -0.33 -4.82 113.70 107.96 3hyj s SER 124 Ca 0.38 -0.35 -0.06 0.00 0.48 0.00 0.00 55.95 56.40 3hyj s SER 124 Cb -0.11 0.48 0.03 0.00 0.10 0.00 0.00 66.02 66.51 3hyj s SER 124 CO 0.28 -0.87 0.20 -0.32 0.98 0.00 0.00 173.24 173.50 3hyj s MET 125 N -3.82 0.21 0.43 4.02 0.00 -1.26 -1.37 119.30 117.51 3hyj s MET 125 Ca 0.04 0.33 -0.23 0.00 0.00 0.00 0.00 55.69 55.83 3hyj s MET 125 Cb 0.02 0.04 -0.09 0.00 0.00 0.00 0.00 34.83 34.80 3hyj s MET 125 CO -0.11 -0.07 1.05 0.99 0.00 0.00 0.00 175.02 176.89 3hyj s THR 126 N 0.43 3.70 -0.26 10.11 2.01 -0.52 -4.24 115.64 126.87 3hyj s THR 126 Ca -0.03 1.22 -0.37 0.00 0.31 0.00 0.00 61.69 62.83 3hyj s THR 126 Cb -0.04 -3.59 -0.13 0.00 0.01 0.00 0.00 72.50 68.75 3hyj s THR 126 CO -0.02 -0.07 1.96 -3.20 -0.69 0.00 0.00 174.62 172.60 3hyj n ASN 127 N -0.38 2.55 0.20 3.53 2.85 -1.26 -4.68 115.26 118.07 3hyj n ASN 127 Ca 0.06 0.78 0.14 0.00 -0.11 0.00 0.00 54.58 55.46 3hyj n ASN 127 Cb 0.50 -1.25 0.55 0.00 1.24 0.00 0.00 39.78 40.83 3hyj n ASN 127 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3hyj h PRO 128 N 9.81 0.00 -0.16 1.20 0.13 -1.93 -0.65 132.00 140.40 3hyj h PRO 128 Ca -0.39 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.71 3hyj h PRO 128 Cb 1.31 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.43 3hyj h PRO 128 CO 0.98 0.00 -0.02 0.00 -0.23 0.00 0.00 178.00 178.74 3hyj h ARG 129 N 0.00 0.23 0.08 0.86 2.47 -2.00 -3.28 114.38 112.75 3hyj h ARG 129 Ca 0.00 -0.03 -0.35 0.00 -1.26 0.00 0.00 59.98 58.34 3hyj h ARG 129 Cb 0.50 -0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 28.75 3hyj h ARG 129 CO 0.00 0.27 -1.95 0.66 0.56 0.00 0.00 179.97 179.51 3hyj n TYR 130 N -4.38 1.12 -3.64 3.04 0.53 -0.28 -5.04 117.16 108.50 3hyj n TYR 130 Ca -0.01 0.28 -0.05 0.00 -1.02 0.00 0.00 57.90 57.10 3hyj n TYR 130 Cb 0.18 -1.16 -0.07 0.00 -1.03 0.00 0.00 39.34 37.26 3hyj n TYR 130 CO 0.00 0.00 0.00 -1.58 -1.02 0.00 0.00 176.86 174.26 3hyj s HIS 131 N -2.57 -0.30 -0.49 -0.72 5.04 -1.04 -5.11 115.29 110.11 3hyj s HIS 131 Ca -0.18 0.70 -0.20 0.00 -1.54 0.00 0.00 55.06 53.84 3hyj s HIS 131 Cb 0.07 0.38 0.05 0.00 0.04 0.00 0.00 32.58 33.12 3hyj s HIS 131 CO 0.78 -0.15 0.66 0.71 -2.34 0.00 0.00 174.74 174.40 3hyj s TYR 132 N 0.35 3.03 -0.30 3.88 2.02 -1.26 -3.96 117.35 121.10 3hyj s TYR 132 Ca 0.02 -0.35 -0.10 0.00 -0.37 0.00 0.00 57.07 56.27 3hyj s TYR 132 Cb -0.05 -3.53 0.15 0.00 -0.40 0.00 0.00 41.96 38.13 3hyj s TYR 132 CO -0.11 -1.02 0.74 -1.58 -1.57 0.00 0.00 175.55 172.01 3hyj s HIS 133 N 2.82 -1.18 -0.06 2.71 2.46 -1.26 -4.63 115.29 116.15 3hyj s HIS 133 Ca 0.19 1.89 0.01 0.00 0.47 0.00 0.00 55.06 57.61 3hyj s HIS 133 Cb -0.17 0.65 0.02 0.00 -0.13 0.00 0.00 32.58 32.95 3hyj s HIS 133 CO 0.14 -0.60 -0.06 -1.17 -2.47 0.00 0.00 174.74 170.59 3hyj s LEU 134 N 2.78 1.29 0.10 8.88 0.20 -0.37 -1.44 118.68 130.12 3hyj s LEU 134 Ca -0.01 -0.17 0.03 0.00 0.69 0.00 0.00 54.13 54.67 3hyj s LEU 134 Cb -0.11 -0.55 -0.04 0.00 -0.43 0.00 0.00 46.19 45.06 3hyj s LEU 134 CO -0.19 -0.06 -0.09 -1.83 -0.29 0.00 0.00 176.35 173.90 3hyj s GLU 135 N 1.06 0.85 -0.08 1.98 -1.05 -0.47 -0.40 118.70 120.59 3hyj s GLU 135 Ca -0.09 -1.23 -0.01 0.00 -0.15 0.00 0.00 54.97 53.49 3hyj s GLU 135 Cb -0.14 -0.43 0.03 0.00 -0.44 0.00 0.00 34.13 33.15 3hyj s GLU 135 CO -0.01 0.05 -0.00 0.42 0.95 0.00 0.00 175.26 176.67 3hyj s ILE 136 N -2.86 0.44 -0.08 1.83 1.01 0.20 -1.19 121.20 120.55 3hyj s ILE 136 Ca 0.08 0.03 -0.33 0.00 0.00 0.00 0.00 60.65 60.44 3hyj s ILE 136 Cb -0.00 -0.61 -0.10 0.00 0.01 0.00 0.00 42.46 41.75 3hyj s ILE 136 CO -0.01 0.23 1.95 -3.20 0.00 0.00 0.00 174.94 173.91 3hyj n ASN 137 N 5.12 3.58 -3.28 3.58 5.15 0.02 -1.25 115.26 128.19 3hyj n ASN 137 Ca -0.08 0.87 -0.03 0.00 -0.60 0.00 0.00 54.58 54.74 3hyj n ASN 137 Cb 0.50 -1.42 -0.05 0.00 -0.53 0.00 0.00 39.78 38.28 3hyj n ASN 137 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3hyj s LEU 138 N 4.67 -0.99 -0.11 1.20 2.96 -0.65 -4.53 118.68 121.23 3hyj s LEU 138 Ca 0.93 0.58 -0.14 0.00 -0.22 0.00 0.00 54.13 55.29 3hyj s LEU 138 Cb -0.60 1.63 -0.26 0.00 0.50 0.00 0.00 46.19 47.45 3hyj s LEU 138 CO 0.48 -0.28 0.48 0.15 -1.32 0.00 0.00 176.35 175.86 3hyj h PHE 139 N 8.10 0.43 -2.81 5.38 3.57 -1.77 -3.40 116.94 126.43 3hyj h PHE 139 Ca -0.21 -0.32 -0.54 0.00 3.53 0.00 0.00 57.97 60.43 3hyj h PHE 139 Cb 1.15 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.88 3hyj h PHE 139 CO 0.12 1.62 0.91 -2.00 -2.23 0.00 0.00 178.31 176.73 3hyj s GLU 140 N -2.49 4.25 0.16 1.11 2.12 -1.26 -4.85 118.70 117.73 3hyj s GLU 140 Ca -0.21 2.09 -0.12 0.00 0.36 0.00 0.00 54.97 57.09 3hyj s GLU 140 Cb 0.05 -3.62 0.05 0.00 0.26 0.00 0.00 34.13 30.87 3hyj s GLU 140 CO 0.76 -0.65 1.68 0.93 -0.54 0.00 0.00 175.26 177.44 3hyj h GLU 141 N 8.15 0.88 -0.28 4.30 5.08 -1.99 -1.63 114.58 129.09 3hyj h GLU 141 Ca -0.39 -0.20 0.06 0.00 -1.00 0.00 0.00 59.36 57.83 3hyj h GLU 141 Cb 1.18 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 30.26 3hyj h GLU 141 CO 0.92 0.81 -0.08 0.93 -1.00 0.00 0.00 179.01 180.59 3hyj h GLU 142 N 0.79 -0.02 -0.57 2.33 5.08 -2.00 -0.37 114.58 119.83 3hyj h GLU 142 Ca 0.18 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.51 3hyj h GLU 142 Cb 0.31 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 3hyj h GLU 142 CO -0.00 -0.01 0.22 1.15 -1.00 0.00 0.00 179.01 179.37 3hyj h THR 143 N -0.02 1.22 -0.52 1.13 2.02 -1.91 -1.24 112.91 113.60 3hyj h THR 143 Ca 0.14 -0.71 0.07 0.00 0.77 0.00 0.00 66.41 66.68 3hyj h THR 143 Cb 0.22 0.63 -0.06 0.00 -1.74 0.00 0.00 68.15 67.20 3hyj h THR 143 CO -0.29 0.27 0.21 0.25 0.37 0.00 0.00 175.52 176.33 3hyj h LEU 144 N 0.78 0.24 -0.33 2.58 5.85 -0.95 -1.10 115.31 122.38 3hyj h LEU 144 Ca 0.19 0.06 -0.18 0.00 0.84 0.00 0.00 57.88 58.78 3hyj h LEU 144 Cb 0.21 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.26 3hyj h LEU 144 CO -0.01 0.17 -0.54 0.00 -0.34 0.00 0.00 178.44 177.71 3hyj h ALA 145 N 1.33 0.50 -0.61 1.25 0.00 -0.63 -2.29 119.26 118.83 3hyj h ALA 145 Ca 0.25 -0.51 -0.07 0.00 0.00 0.00 0.00 54.91 54.58 3hyj h ALA 145 Cb 0.25 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3hyj h ALA 145 CO -0.23 0.68 0.12 -0.07 0.00 0.00 0.00 179.25 179.75 3hyj h LEU 146 N 0.65 0.92 -0.45 0.00 3.38 -1.05 -1.76 115.31 117.00 3hyj h LEU 146 Ca 0.02 -0.19 -0.15 0.00 0.09 0.00 0.00 57.88 57.64 3hyj h LEU 146 Cb 1.14 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 3hyj h LEU 146 CO 0.12 0.91 -0.35 0.74 0.09 0.00 0.00 178.44 179.94 3hyj h THR 147 N 0.92 1.27 -0.28 0.22 2.02 -1.08 -1.16 112.91 114.82 3hyj h THR 147 Ca 0.19 -1.52 -0.02 0.00 0.77 0.00 0.00 66.41 65.83 3hyj h THR 147 Cb 0.37 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.11 3hyj h THR 147 CO 0.01 0.51 0.09 0.03 0.37 0.00 0.00 175.52 176.52 3hyj h ARG 148 N 0.75 0.44 -0.25 6.66 3.08 -1.29 0.93 114.38 124.70 3hyj h ARG 148 Ca 0.07 -0.09 0.05 0.00 0.07 0.00 0.00 59.98 60.08 3hyj h ARG 148 Cb 0.93 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.87 3hyj h ARG 148 CO 0.09 0.49 -0.05 -0.22 -1.07 0.00 0.00 179.97 179.21 3hyj h LYS 149 N 0.29 0.02 -0.15 0.04 3.64 -1.17 -0.79 116.57 118.44 3hyj h LYS 149 Ca 0.09 -0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.35 3hyj h LYS 149 Cb 0.24 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 3hyj h LYS 149 CO -0.00 0.01 -0.42 0.77 -2.27 0.00 0.00 179.45 177.54 3hyj h SER 150 N 0.02 0.37 -0.27 4.20 0.02 -0.95 0.76 113.55 117.70 3hyj h SER 150 Ca 0.12 -0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 3hyj h SER 150 Cb 0.18 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 3hyj h SER 150 CO -0.24 0.75 0.14 -0.07 -1.14 0.00 0.00 176.83 176.27 3hyj h LEU 151 N 0.29 0.35 0.69 5.07 3.38 -0.41 -0.18 115.31 124.50 3hyj h LEU 151 Ca 0.02 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 3hyj h LEU 151 Cb 0.87 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.53 3hyj h LEU 151 CO 0.07 0.35 -0.33 0.50 0.09 0.00 0.00 178.44 179.12 3hyj h LYS 152 N 0.32 -0.90 -0.94 1.13 1.63 -0.57 -0.30 116.57 116.94 3hyj h LYS 152 Ca 0.09 0.06 0.08 0.00 -0.85 0.00 0.00 60.65 60.04 3hyj h LYS 152 Cb 0.09 0.20 -0.11 0.00 -0.60 0.00 0.00 32.23 31.81 3hyj h LYS 152 CO -0.01 -0.58 -0.55 -0.25 -3.45 0.00 0.00 179.45 174.61 3hyj n ASP 153 N -5.41 -0.99 0.07 4.20 10.43 0.21 0.18 116.55 125.23 3hyj n ASP 153 Ca -0.12 1.68 -0.15 0.00 2.57 0.00 0.00 54.79 58.76 3hyj n ASP 153 Cb 0.38 -0.22 -0.14 0.00 1.84 0.00 0.00 41.12 42.98 3hyj n ASP 153 CO 0.00 0.00 0.00 -0.26 -1.07 0.00 0.00 177.20 175.87 3hyj h PHE 154 N 0.00 0.40 -0.00 1.24 0.04 -1.09 -3.40 116.94 114.13 3hyj h PHE 154 Ca 0.15 -0.29 0.00 0.00 2.80 0.00 0.00 57.97 60.63 3hyj h PHE 154 Cb 0.38 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.52 3hyj h PHE 154 CO -0.97 1.29 -0.01 1.19 -0.60 0.00 0.00 178.31 179.21 3hyj n PHE 155 N -3.45 0.00 -1.68 -0.55 3.72 -0.16 -4.98 117.46 110.36 3hyj n PHE 155 Ca -0.12 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.11 3hyj n PHE 155 Cb 1.03 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 39.51 3hyj n PHE 155 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3hyj n ASN 156 N -0.43 -4.96 -4.66 4.37 5.15 0.47 -4.95 115.26 110.25 3hyj n ASN 156 Ca 0.00 0.31 -0.40 0.00 -0.60 0.00 0.00 54.58 53.89 3hyj n ASN 156 Cb 0.01 -3.95 -0.06 0.00 -0.53 0.00 0.00 39.78 35.25 3hyj n ASN 156 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3hyj s ILE 157 N -2.66 5.02 -0.53 -1.44 1.01 -0.98 -4.89 121.20 116.72 3hyj s ILE 157 Ca 0.00 1.16 -0.24 0.00 0.00 0.00 0.00 60.65 61.58 3hyj s ILE 157 Cb 0.00 -3.94 0.04 0.00 0.01 0.00 0.00 42.46 38.57 3hyj s ILE 157 CO 0.00 0.10 0.90 0.20 0.00 0.00 0.00 174.94 176.14 3hyj s ASN 158 N 1.23 6.35 -0.08 3.58 0.01 -1.26 -2.94 114.94 121.83 3hyj s ASN 158 Ca 0.28 -0.35 -0.03 0.00 -0.71 0.00 0.00 52.86 52.05 3hyj s ASN 158 Cb -0.16 -2.42 -0.04 0.00 0.41 0.00 0.00 41.25 39.05 3hyj s ASN 158 CO 0.10 -1.15 0.06 0.00 -1.51 0.00 0.00 177.10 174.59 3hyj s ALA 159 N 3.75 3.51 0.37 0.60 0.00 -1.26 -4.70 121.76 124.02 3hyj s ALA 159 Ca 0.29 -0.78 0.03 0.00 0.00 0.00 0.00 51.96 51.51 3hyj s ALA 159 Cb -0.13 -1.63 0.03 0.00 0.00 0.00 0.00 23.12 21.39 3hyj s ALA 159 CO 0.19 0.62 0.26 0.41 0.00 0.00 0.00 175.76 177.25 3hyj n GLY 160 N 1.88 2.88 3.01 0.00 0.00 0.17 -4.90 105.19 108.24 3hyj n GLY 160 Ca -0.18 -2.26 -0.27 0.00 0.00 0.00 0.00 46.02 43.31 3hyj n GLY 160 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hyj s ILE 161 N -1.85 1.33 -0.16 -0.61 1.09 -1.26 -0.83 121.20 118.91 3hyj s ILE 161 Ca 0.20 -0.53 -0.14 0.00 -1.10 0.00 0.00 60.65 59.07 3hyj s ILE 161 Cb -0.02 -1.24 -0.05 0.00 -1.06 0.00 0.00 42.46 40.10 3hyj s ILE 161 CO 0.13 0.41 0.31 -0.63 -0.10 0.00 0.00 174.94 175.06 3hyj s ILE 162 N 1.12 5.29 -0.15 2.92 1.01 0.76 -4.95 121.20 127.20 3hyj s ILE 162 Ca -0.05 0.59 0.01 0.00 0.00 0.00 0.00 60.65 61.20 3hyj s ILE 162 Cb -0.14 -3.65 0.02 0.00 0.01 0.00 0.00 42.46 38.69 3hyj s ILE 162 CO -0.03 0.37 -0.15 -0.70 0.00 0.00 0.00 174.94 174.43 3hyj s GLU 163 N 0.55 2.38 -0.27 2.79 2.12 -1.26 -1.10 118.70 123.90 3hyj s GLU 163 Ca 0.17 -0.59 -0.04 0.00 0.36 0.00 0.00 54.97 54.87 3hyj s GLU 163 Cb -0.13 -2.13 0.15 0.00 0.26 0.00 0.00 34.13 32.28 3hyj s GLU 163 CO 0.05 -0.21 0.52 -1.17 -0.54 0.00 0.00 175.26 173.91 3hyj s LEU 164 N 1.39 -1.03 -1.01 2.70 2.96 -0.99 -5.02 118.68 117.67 3hyj s LEU 164 Ca 0.03 0.83 -0.08 0.00 -0.22 0.00 0.00 54.13 54.69 3hyj s LEU 164 Cb -0.13 1.78 -0.05 0.00 0.50 0.00 0.00 46.19 48.29 3hyj s LEU 164 CO -0.10 -0.26 0.86 0.54 -1.32 0.00 0.00 176.35 176.07 3hyj n ARG 165 N 5.41 -1.91 -1.96 1.98 1.74 -1.26 -2.25 116.66 118.40 3hyj n ARG 165 Ca -0.05 0.89 -0.12 0.00 -0.77 0.00 0.00 57.85 57.81 3hyj n ARG 165 Cb 0.50 -5.46 -0.03 0.00 -1.02 0.00 0.00 32.46 26.45 3hyj n ARG 165 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3hyj n ASN 166 N -2.90 -3.51 -4.39 0.55 0.23 -1.26 -4.96 115.26 99.02 3hyj n ASN 166 Ca -0.07 0.24 -0.22 0.00 -0.53 0.00 0.00 54.58 54.00 3hyj n ASN 166 Cb 0.60 -3.13 -0.11 0.00 -2.08 0.00 0.00 39.78 35.06 3hyj n ASN 166 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 3hyj s THR 167 N -2.34 2.07 -0.02 5.53 -4.23 -0.96 -5.14 115.64 110.56 3hyj s THR 167 Ca 0.00 -2.16 0.01 0.00 -1.18 0.00 0.00 61.69 58.36 3hyj s THR 167 Cb 0.00 -2.07 0.02 0.00 1.34 0.00 0.00 72.50 71.78 3hyj s THR 167 CO 0.00 -0.38 -0.01 -0.13 -0.54 0.00 0.00 174.62 173.56 3hyj s ARG 168 N -3.21 0.31 0.01 3.99 0.52 -1.26 -2.35 118.95 116.95 3hyj s ARG 168 Ca 0.22 0.01 0.06 0.00 -0.52 0.00 0.00 55.73 55.51 3hyj s ARG 168 Cb -0.05 -0.42 -0.02 0.00 0.52 0.00 0.00 34.95 34.98 3hyj s ARG 168 CO 0.10 -0.07 -0.20 0.15 0.02 0.00 0.00 175.30 175.30 3hyj s LYS 169 N 0.69 1.51 0.17 3.54 -0.14 -0.26 -1.64 119.74 123.61 3hyj s LYS 169 Ca -0.07 -0.78 -0.30 0.00 -1.36 0.00 0.00 55.97 53.46 3hyj s LYS 169 Cb -0.10 -1.51 -0.07 0.00 -1.68 0.00 0.00 37.83 34.47 3hyj s LYS 169 CO -0.01 0.40 0.98 -1.17 -0.76 0.00 0.00 175.35 174.79 3hyj s LEU 170 N -0.71 4.55 -0.03 3.17 2.96 -0.38 -0.17 118.68 128.07 3hyj s LEU 170 Ca 0.07 1.91 0.01 0.00 -0.22 0.00 0.00 54.13 55.91 3hyj s LEU 170 Cb -0.08 -3.60 0.01 0.00 0.50 0.00 0.00 46.19 43.03 3hyj s LEU 170 CO 0.00 -0.02 -0.05 -0.47 -1.32 0.00 0.00 176.35 174.49 3hyj s TYR 171 N -0.46 0.65 -0.04 5.38 5.04 -0.01 -0.63 117.35 127.28 3hyj s TYR 171 Ca 0.45 -0.15 0.03 0.00 -2.44 0.00 0.00 57.07 54.96 3hyj s TYR 171 Cb -0.25 -0.55 0.01 0.00 0.35 0.00 0.00 41.96 41.51 3hyj s TYR 171 CO 0.32 -0.13 -0.12 0.42 -1.34 0.00 0.00 175.55 174.70 3hyj s ILE 172 N 0.60 1.07 -0.05 3.14 1.01 0.46 0.42 121.20 127.85 3hyj s ILE 172 Ca -0.08 -0.49 0.03 0.00 0.00 0.00 0.00 60.65 60.12 3hyj s ILE 172 Cb -0.11 -0.95 -0.05 0.00 0.01 0.00 0.00 42.46 41.35 3hyj s ILE 172 CO -0.00 0.33 -0.00 1.17 0.00 0.00 0.00 174.94 176.43 3hyj n LYS 173 N 3.45 2.29 -2.96 2.79 4.81 -1.26 -1.24 118.16 126.03 3hyj n LYS 173 Ca -0.20 0.01 -0.41 0.00 -0.87 0.00 0.00 58.31 56.84 3hyj n LYS 173 Cb 0.53 -1.12 -0.04 0.00 0.02 0.00 0.00 35.03 34.41 3hyj n LYS 173 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 3hyj s SER 174 N -3.90 6.99 0.29 3.14 0.15 -1.26 -4.52 113.70 114.58 3hyj s SER 174 Ca -0.04 1.20 0.01 0.00 0.70 0.00 0.00 55.95 57.81 3hyj s SER 174 Cb 0.02 -2.44 0.42 0.00 -1.71 0.00 0.00 66.02 62.32 3hyj s SER 174 CO 0.18 -0.24 1.78 -0.29 1.20 0.00 0.00 173.24 175.87 3hyj h ILE 175 N 4.95 1.23 -0.94 6.45 6.09 -1.94 0.92 117.51 134.27 3hyj h ILE 175 Ca -0.36 -0.99 0.00 0.00 -1.37 0.00 0.00 64.86 62.14 3hyj h ILE 175 Cb 1.17 0.99 -0.05 0.00 0.47 0.00 0.00 36.82 39.41 3hyj h ILE 175 CO 0.78 0.34 0.60 0.11 -3.07 0.00 0.00 178.15 176.91 3hyj h LYS 176 N 0.61 1.26 -0.31 2.19 6.56 -1.99 0.02 116.57 124.91 3hyj h LYS 176 Ca 0.12 -0.10 -0.04 0.00 -1.06 0.00 0.00 60.65 59.57 3hyj h LYS 176 Cb 0.46 -0.27 -0.01 0.00 -0.57 0.00 0.00 32.23 31.83 3hyj h LYS 176 CO 0.02 0.86 0.02 -0.44 -2.06 0.00 0.00 179.45 177.85 3hyj h ASP 177 N 1.29 0.52 -0.33 0.86 3.32 -1.70 -1.47 116.42 118.91 3hyj h ASP 177 Ca 0.34 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 57.10 3hyj h ASP 177 Cb -0.10 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.29 3hyj h ASP 177 CO -0.07 0.69 0.21 0.40 -1.72 0.00 0.00 179.24 178.75 3hyj h ILE 178 N 0.35 1.09 -0.39 0.35 2.04 -0.64 -1.45 117.51 118.86 3hyj h ILE 178 Ca 0.09 -0.18 0.06 0.00 1.00 0.00 0.00 64.86 65.84 3hyj h ILE 178 Cb 0.40 0.63 -0.06 0.00 -0.74 0.00 0.00 36.82 37.06 3hyj h ILE 178 CO 0.01 0.09 0.04 -0.07 0.00 0.00 0.00 178.15 178.22 3hyj h LEU 179 N 0.44 -0.06 -0.40 1.44 3.38 -0.90 0.28 115.31 119.48 3hyj h LEU 179 Ca 0.12 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 3hyj h LEU 179 Cb -0.04 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3hyj h LEU 179 CO -0.02 0.00 0.23 0.58 0.09 0.00 0.00 178.44 179.32 3hyj h VAL 180 N 0.16 1.14 -0.17 1.22 2.07 -0.99 -1.74 116.25 117.94 3hyj h VAL 180 Ca 0.19 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 67.39 3hyj h VAL 180 Cb 0.24 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 3hyj h VAL 180 CO -0.27 0.14 0.08 0.15 0.02 0.00 0.00 177.57 177.69 3hyj h PHE 181 N 0.52 0.16 -0.34 1.57 3.57 -0.83 -1.62 116.94 119.97 3hyj h PHE 181 Ca 0.14 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 3hyj h PHE 181 Cb 0.02 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 3hyj h PHE 181 CO -0.03 0.09 -0.12 -0.07 -2.23 0.00 0.00 178.31 175.95 3hyj h LEU 182 N 0.18 0.57 -0.81 0.59 3.38 -0.76 -1.91 115.31 116.54 3hyj h LEU 182 Ca 0.07 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 3hyj h LEU 182 Cb 0.01 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 3hyj h LEU 182 CO -0.04 0.72 -0.14 -0.08 0.09 0.00 0.00 178.44 178.99 3hyj h GLU 183 N 0.53 0.75 -0.17 1.13 4.81 -1.09 0.13 114.58 120.66 3hyj h GLU 183 Ca 0.10 -0.26 -0.16 0.00 -0.13 0.00 0.00 59.36 58.91 3hyj h GLU 183 Cb 0.52 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 3hyj h GLU 183 CO 0.03 0.85 -0.56 0.00 -0.73 0.00 0.00 179.01 178.60 3hyj h ALA 184 N 1.17 0.70 -0.00 2.92 0.00 -0.55 -2.78 119.26 120.72 3hyj h ALA 184 Ca 0.11 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3hyj h ALA 184 Cb 0.62 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3hyj h ALA 184 CO 0.04 0.69 -0.06 0.44 0.00 0.00 0.00 179.25 180.36 3hyj n ILE 185 N -3.95 0.00 0.00 0.00 -5.35 -0.84 -4.91 119.36 104.30 3hyj n ILE 185 Ca -0.03 -0.01 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 3hyj n ILE 185 Cb 0.61 -0.35 0.00 0.00 -1.74 0.00 0.00 39.64 38.16 3hyj n ILE 185 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3hyj n GLY 186 N 1.36 0.83 3.70 3.28 0.00 -1.05 -4.87 105.19 108.44 3hyj n GLY 186 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 3hyj n GLY 186 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hyj s VAL 187 N -1.74 3.78 -0.16 1.61 1.01 0.02 -4.91 120.40 120.01 3hyj s VAL 187 Ca 0.00 1.21 -0.13 0.00 0.00 0.00 0.00 61.98 63.06 3hyj s VAL 187 Cb 0.00 -3.78 -0.07 0.00 0.00 0.00 0.00 36.38 32.54 3hyj s VAL 187 CO 0.00 0.03 -0.28 0.00 0.00 0.00 0.00 175.10 174.85 3hyj n GLN 188 N 4.81 0.44 -0.70 2.72 3.00 -1.26 -4.39 117.38 122.00 3hyj n GLN 188 Ca 0.12 0.18 -0.20 0.00 -0.01 0.00 0.00 57.00 57.09 3hyj n GLN 188 Cb 0.44 -1.26 -0.02 0.00 0.00 0.00 0.00 30.24 29.40 3hyj n GLN 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 3hyj n ARG 189 N -4.16 1.95 -0.24 -1.09 3.00 -1.26 -3.56 116.66 111.30 3hyj n ARG 189 Ca -0.24 -1.36 0.06 0.00 -0.01 0.00 0.00 57.85 56.30 3hyj n ARG 189 Cb 0.57 -2.39 0.17 0.00 0.00 0.00 0.00 32.46 30.81 3hyj n ARG 189 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 3hyj n LYS 190 N 4.13 2.77 0.24 5.56 2.85 -1.26 -4.52 118.16 127.93 3hyj n LYS 190 Ca 0.42 -2.30 0.13 0.00 -1.05 0.00 0.00 58.31 55.51 3hyj n LYS 190 Cb 0.15 -1.45 0.70 0.00 -0.65 0.00 0.00 35.03 33.78 3hyj n LYS 190 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 177.40 177.28 3hyj h LEU 191 N 1.51 0.00 -8.09 -5.58 4.07 -1.96 -3.27 115.31 101.99 3hyj h LEU 191 Ca 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.96 3hyj h LEU 191 Cb 0.97 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.71 3hyj h LEU 191 CO 0.08 0.00 0.09 -1.84 -1.08 0.00 0.00 178.44 175.69 3hyj n GLU 192 N -2.50 0.12 0.00 1.13 0.28 -1.26 -5.28 120.64 113.12 3hyj n GLU 192 Ca -0.02 -1.51 0.00 0.00 -0.16 0.00 0.00 57.16 55.48 3hyj n GLU 192 Cb 0.20 -3.70 0.00 0.00 1.43 0.00 0.00 31.44 29.37 3hyj n GLU 192 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36