#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f7j n PRO 2 N 0.00 -0.10 0.00 2.12 -0.04 -1.26 -4.94 135.00 130.78 3f7j n PRO 2 Ca 0.00 0.03 0.03 0.00 -0.04 0.00 0.00 63.50 63.52 3f7j n PRO 2 Cb 0.00 -2.00 -0.01 0.00 -0.04 0.00 0.00 33.50 31.45 3f7j n PRO 2 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3f7j n THR 3 N -3.35 0.00 -3.68 0.52 -2.24 -1.26 -4.97 114.28 99.29 3f7j n THR 3 Ca 0.09 -0.41 -0.13 0.00 -2.27 0.00 0.00 64.05 61.34 3f7j n THR 3 Cb 0.52 1.06 -0.07 0.00 -2.10 0.00 0.00 70.33 69.74 3f7j n THR 3 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3f7j s SER 4 N -1.22 -0.27 0.62 3.42 0.15 -1.26 -4.82 113.70 110.33 3f7j s SER 4 Ca 0.05 0.01 0.40 0.00 0.70 0.00 0.00 55.95 57.11 3f7j s SER 4 Cb 0.05 0.41 2.04 0.00 -1.71 0.00 0.00 66.02 66.81 3f7j s SER 4 CO 0.19 -0.63 2.24 -0.07 1.20 0.00 0.00 173.24 176.17 3f7j h LEU 5 N 3.14 0.00 -0.78 3.45 3.38 -1.90 -2.66 115.31 119.94 3f7j h LEU 5 Ca -0.31 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.57 3f7j h LEU 5 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 3f7j h LEU 5 CO 0.43 0.01 -0.45 0.11 0.09 0.00 0.00 178.44 178.63 3f7j h LYS 6 N 0.00 0.00 -7.10 1.13 1.57 -1.96 -3.43 116.57 106.79 3f7j h LYS 6 Ca -0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 3f7j h LYS 6 Cb 0.18 0.00 0.11 0.00 0.08 0.00 0.00 32.23 32.60 3f7j h LYS 6 CO 0.00 0.45 0.48 -0.51 -0.57 0.00 0.00 179.45 179.29 3f7j s ASP 7 N -6.51 5.19 0.15 0.86 1.01 -1.00 -4.86 116.67 111.51 3f7j s ASP 7 Ca 0.00 2.40 0.05 0.00 0.71 0.00 0.00 52.55 55.71 3f7j s ASP 7 Cb 0.11 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.40 3f7j s ASP 7 CO 0.71 -1.59 -0.12 0.42 0.21 0.00 0.00 175.17 174.80 3f7j s THR 8 N -1.58 1.30 -0.09 -1.27 -4.23 -1.26 -1.74 115.64 106.76 3f7j s THR 8 Ca 0.77 -2.02 -0.01 0.00 -1.18 0.00 0.00 61.69 59.26 3f7j s THR 8 Cb -0.31 -1.81 -0.03 0.00 1.34 0.00 0.00 72.50 71.69 3f7j s THR 8 CO 0.33 -0.66 -0.05 0.54 -0.54 0.00 0.00 174.62 174.25 3f7j s VAL 9 N -3.02 3.84 -0.28 2.29 0.11 0.53 -4.80 120.40 119.06 3f7j s VAL 9 Ca 0.16 -0.42 -0.29 0.00 -2.93 0.00 0.00 61.98 58.51 3f7j s VAL 9 Cb 0.00 -2.60 0.01 0.00 -1.53 0.00 0.00 36.38 32.27 3f7j s VAL 9 CO 0.02 0.58 1.04 -0.75 -3.33 0.00 0.00 175.10 172.66 3f7j s LYS 10 N -0.56 4.13 0.93 1.54 2.20 -1.26 -0.65 119.74 126.07 3f7j s LYS 10 Ca 0.09 1.15 -0.12 0.00 -0.36 0.00 0.00 55.97 56.73 3f7j s LYS 10 Cb -0.12 -3.70 0.15 0.00 -1.51 0.00 0.00 37.83 32.65 3f7j s LYS 10 CO 0.02 -0.79 1.11 -0.51 -0.36 0.00 0.00 175.35 174.82 3f7j s LEU 11 N 3.44 1.96 0.23 5.43 1.43 0.55 -4.90 118.68 126.82 3f7j s LEU 11 Ca 0.44 1.17 0.19 0.00 -1.03 0.00 0.00 54.13 54.91 3f7j s LEU 11 Cb -0.13 -3.49 0.92 0.00 0.03 0.00 0.00 46.19 43.51 3f7j s LEU 11 CO 0.12 -2.73 1.58 0.00 0.23 0.00 0.00 176.35 175.55 3f7j n HIS 12 N -3.91 0.61 -0.36 0.29 1.44 -1.26 -1.03 115.22 111.01 3f7j n HIS 12 Ca 0.06 0.28 0.10 0.00 -2.01 0.00 0.00 57.72 56.15 3f7j n HIS 12 Cb 0.57 -0.95 0.28 0.00 0.12 0.00 0.00 29.99 30.02 3f7j n HIS 12 CO 0.00 0.00 0.00 0.27 -2.81 0.00 0.00 176.34 173.80 3f7j n ASN 13 N -2.10 3.79 0.00 4.39 6.94 -1.26 -4.96 115.26 122.06 3f7j n ASN 13 Ca 0.00 -2.06 0.00 0.00 -0.02 0.00 0.00 54.58 52.51 3f7j n ASN 13 Cb 0.11 -0.44 0.00 0.00 -2.36 0.00 0.00 39.78 37.09 3f7j n ASN 13 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3f7j n GLY 14 N 1.29 1.19 3.73 4.83 0.00 -0.20 -5.03 105.19 111.00 3f7j n GLY 14 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 3f7j n GLY 14 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f7j s VAL 15 N -2.53 2.83 -0.37 1.61 1.01 -1.26 -4.72 120.40 116.97 3f7j s VAL 15 Ca 0.00 0.63 -0.18 0.00 0.00 0.00 0.00 61.98 62.43 3f7j s VAL 15 Cb 0.00 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 32.98 3f7j s VAL 15 CO 0.00 0.07 0.52 -0.70 0.00 0.00 0.00 175.10 174.99 3f7j s GLU 16 N 0.61 3.53 -0.19 2.72 2.12 -1.26 -0.33 118.70 125.89 3f7j s GLU 16 Ca 0.65 -0.25 -0.07 0.00 0.36 0.00 0.00 54.97 55.66 3f7j s GLU 16 Cb -0.41 -3.84 -0.04 0.00 0.26 0.00 0.00 34.13 30.10 3f7j s GLU 16 CO 0.35 -0.71 0.05 1.41 -0.54 0.00 0.00 175.26 175.82 3f7j s MET 17 N 2.42 3.88 0.30 4.30 -2.45 0.18 -4.88 119.30 123.05 3f7j s MET 17 Ca 0.18 -0.39 -0.29 0.00 -1.25 0.00 0.00 55.69 53.95 3f7j s MET 17 Cb -0.15 -3.20 -0.13 0.00 1.25 0.00 0.00 34.83 32.60 3f7j s MET 17 CO 0.14 0.19 1.30 -2.30 1.05 0.00 0.00 175.02 175.40 3f7j n PRO 18 N 3.77 2.03 0.26 4.11 -0.02 -1.26 -0.35 135.00 143.54 3f7j n PRO 18 Ca -0.17 0.72 0.10 0.00 -2.02 0.00 0.00 63.50 62.13 3f7j n PRO 18 Cb 0.52 -2.30 0.68 0.00 -0.02 0.00 0.00 33.50 32.38 3f7j n PRO 18 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 3f7j h TRP 19 N 3.02 0.00 -3.43 6.00 4.06 -1.65 -3.43 115.95 120.52 3f7j h TRP 19 Ca -0.45 0.00 -0.46 0.00 2.06 0.00 0.00 58.89 60.04 3f7j h TRP 19 Cb 1.29 0.00 -0.34 0.00 -1.00 0.00 0.00 29.16 29.11 3f7j h TRP 19 CO 0.52 0.11 -0.79 0.12 -3.56 0.00 0.00 178.44 174.84 3f7j s PHE 20 N -4.48 1.11 0.13 0.49 5.36 -1.26 -0.78 117.98 118.55 3f7j s PHE 20 Ca -0.04 -0.38 0.01 0.00 -0.96 0.00 0.00 56.93 55.56 3f7j s PHE 20 Cb 0.15 -0.87 -0.00 0.00 -0.34 0.00 0.00 43.02 41.95 3f7j s PHE 20 CO 0.62 -0.24 0.15 0.41 -1.46 0.00 0.00 175.22 174.71 3f7j n GLY 21 N 3.95 3.11 3.45 13.12 0.00 0.29 -4.32 105.19 124.81 3f7j n GLY 21 Ca -0.24 -1.59 -0.35 0.00 0.00 0.00 0.00 46.02 43.84 3f7j n GLY 21 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3f7j s LEU 22 N 0.00 3.34 -0.08 0.99 2.96 -0.16 -3.36 118.68 122.37 3f7j s LEU 22 Ca 0.13 -0.19 -0.20 0.00 -0.22 0.00 0.00 54.13 53.65 3f7j s LEU 22 Cb 0.00 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.78 3f7j s LEU 22 CO 0.09 0.03 0.55 -0.83 -1.32 0.00 0.00 176.35 174.88 3f7j s GLY 23 N 1.19 2.50 -0.26 7.98 0.00 -0.84 -0.09 107.32 117.80 3f7j s GLY 23 Ca 0.04 -0.07 0.12 0.00 0.00 0.00 0.00 44.72 44.80 3f7j s GLY 23 CO 0.02 0.84 1.50 -0.62 0.00 0.00 0.00 173.10 174.83 3f7j n VAL 24 N 3.42 2.51 -1.17 1.40 0.31 -0.35 -4.07 118.33 120.38 3f7j n VAL 24 Ca -0.06 -2.29 -0.32 0.00 -0.01 0.00 0.00 64.34 61.66 3f7j n VAL 24 Cb 0.51 -0.31 0.11 0.00 -0.91 0.00 0.00 33.84 33.25 3f7j n VAL 24 CO 0.00 0.00 0.00 0.72 -1.32 0.00 0.00 176.83 176.23 3f7j s PHE 25 N -3.07 2.07 -0.74 3.52 -0.71 -1.26 -3.19 117.98 114.59 3f7j s PHE 25 Ca 0.45 1.65 0.00 0.00 -1.04 0.00 0.00 56.93 57.99 3f7j s PHE 25 Cb 0.39 -3.31 0.00 0.00 -1.21 0.00 0.00 43.02 38.89 3f7j s PHE 25 CO 0.05 -2.41 0.00 1.63 -1.34 0.00 0.00 175.22 173.15 3f7j n LYS 26 N -3.39 -2.17 -3.23 1.99 5.02 -1.26 -4.88 118.16 110.23 3f7j n LYS 26 Ca 0.12 0.42 -0.45 0.00 -2.02 0.00 0.00 58.31 56.38 3f7j n LYS 26 Cb 0.52 -4.89 -0.06 0.00 -0.02 0.00 0.00 35.03 30.58 3f7j n LYS 26 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3f7j s VAL 27 N -2.24 5.03 -0.12 -0.18 1.01 -1.19 -4.98 120.40 117.72 3f7j s VAL 27 Ca 0.00 -1.08 -0.20 0.00 0.00 0.00 0.00 61.98 60.69 3f7j s VAL 27 Cb 0.00 -4.34 -0.18 0.00 0.00 0.00 0.00 36.38 31.86 3f7j s VAL 27 CO 0.00 -0.89 0.56 -0.33 0.00 0.00 0.00 175.10 174.44 3f7j h GLU 28 N 8.98 -0.01 -6.68 2.72 3.07 -1.91 -3.45 114.58 117.30 3f7j h GLU 28 Ca -0.29 0.00 -0.51 0.00 -0.50 0.00 0.00 59.36 58.06 3f7j h GLU 28 Cb 1.10 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.01 3f7j h GLU 28 CO 1.02 0.67 0.00 0.54 -1.40 0.00 0.00 179.01 179.84 3f7j s ASN 29 N -5.98 6.51 0.14 1.42 2.20 -1.26 -4.98 114.94 112.98 3f7j s ASN 29 Ca -0.13 0.97 -0.16 0.00 -0.94 0.00 0.00 52.86 52.60 3f7j s ASN 29 Cb -0.02 -2.25 0.00 0.00 -2.00 0.00 0.00 41.25 36.98 3f7j s ASN 29 CO 0.48 -0.29 1.70 1.23 -2.94 0.00 0.00 177.10 177.28 3f7j h GLY 30 N 1.54 0.66 -0.01 0.45 0.00 -1.93 -2.23 103.07 101.55 3f7j h GLY 30 Ca -0.47 -0.34 0.20 0.00 0.00 0.00 0.00 47.33 46.71 3f7j h GLY 30 CO 0.65 0.32 0.49 3.43 0.00 0.00 0.00 176.54 181.43 3f7j h ASN 31 N 0.53 0.55 -0.43 0.19 2.35 -1.95 0.77 115.58 117.58 3f7j h ASN 31 Ca 0.14 0.12 -0.02 0.00 -0.55 0.00 0.00 56.30 55.99 3f7j h ASN 31 Cb 0.15 0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.55 3f7j h ASN 31 CO -0.01 0.14 0.20 -0.33 -1.65 0.00 0.00 177.43 175.77 3f7j h GLU 32 N 0.57 0.63 -0.22 0.81 5.08 -1.89 -0.44 114.58 119.12 3f7j h GLU 32 Ca 0.55 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.78 3f7j h GLU 32 Cb 0.95 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 3f7j h GLU 32 CO -0.44 0.56 -0.01 0.00 -1.00 0.00 0.00 179.01 178.11 3f7j h ALA 33 N 1.04 0.29 -0.13 3.43 0.00 -0.70 -0.99 119.26 122.20 3f7j h ALA 33 Ca 0.15 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.86 3f7j h ALA 33 Cb 0.14 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3f7j h ALA 33 CO -0.02 0.03 -0.01 1.15 0.00 0.00 0.00 179.25 180.40 3f7j h THR 34 N 0.14 0.89 -0.70 0.00 2.02 -0.85 -1.99 112.91 112.42 3f7j h THR 34 Ca 0.06 -0.01 -0.05 0.00 0.77 0.00 0.00 66.41 67.18 3f7j h THR 34 Cb 0.43 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.67 3f7j h THR 34 CO 0.01 0.00 0.24 -0.33 0.37 0.00 0.00 175.52 175.82 3f7j h GLU 35 N 0.03 1.07 -0.58 6.66 4.39 -0.79 -1.16 114.58 124.19 3f7j h GLU 35 Ca 0.06 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.55 3f7j h GLU 35 Cb 0.08 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.54 3f7j h GLU 35 CO -0.12 0.91 0.37 1.03 -1.16 0.00 0.00 179.01 180.05 3f7j h SER 36 N 1.02 0.68 -0.15 1.42 0.87 -1.15 -1.07 113.55 115.17 3f7j h SER 36 Ca 0.23 -0.04 -0.11 0.00 -1.23 0.00 0.00 61.79 60.64 3f7j h SER 36 Cb 0.26 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.06 3f7j h SER 36 CO -0.01 0.51 -0.34 0.58 -0.53 0.00 0.00 176.83 177.05 3f7j h VAL 37 N 0.79 1.36 -0.15 2.23 2.07 -1.12 -1.79 116.25 119.63 3f7j h VAL 37 Ca 0.21 -1.60 -0.03 0.00 0.82 0.00 0.00 66.70 66.10 3f7j h VAL 37 Cb -0.06 1.99 -0.00 0.00 -1.52 0.00 0.00 31.29 31.70 3f7j h VAL 37 CO -0.04 0.48 -0.02 0.11 0.02 0.00 0.00 177.57 178.12 3f7j h LYS 38 N 0.12 0.27 -0.47 1.57 1.57 -1.20 -1.30 116.57 117.13 3f7j h LYS 38 Ca 0.00 -0.10 0.08 0.00 -1.87 0.00 0.00 60.65 58.77 3f7j h LYS 38 Cb 0.94 -0.02 -0.07 0.00 0.08 0.00 0.00 32.23 33.16 3f7j h LYS 38 CO 0.07 0.54 0.06 0.00 -0.57 0.00 0.00 179.45 179.55 3f7j h ALA 39 N 0.73 0.49 -0.23 3.86 0.00 -1.20 0.14 119.26 123.05 3f7j h ALA 39 Ca 0.04 0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.08 3f7j h ALA 39 Cb 0.43 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3f7j h ALA 39 CO 0.01 -0.34 0.08 0.00 0.00 0.00 0.00 179.25 179.00 3f7j h ALA 40 N 1.38 0.25 -0.05 0.00 0.00 -1.22 -1.04 119.26 118.58 3f7j h ALA 40 Ca 0.23 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 3f7j h ALA 40 Cb 0.32 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 3f7j h ALA 40 CO -0.33 -0.34 0.01 0.82 0.00 0.00 0.00 179.25 179.41 3f7j h ILE 41 N 0.18 1.18 -0.04 0.00 2.04 -0.90 0.27 117.51 120.24 3f7j h ILE 41 Ca 0.10 -0.53 0.01 0.00 1.00 0.00 0.00 64.86 65.44 3f7j h ILE 41 Cb 0.07 1.43 -0.00 0.00 -0.74 0.00 0.00 36.82 37.58 3f7j h ILE 41 CO -0.10 0.15 0.05 0.07 0.00 0.00 0.00 178.15 178.32 3f7j h LYS 42 N -0.12 0.00 -0.71 2.37 2.10 -0.67 -1.01 116.57 118.53 3f7j h LYS 42 Ca 0.02 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.62 3f7j h LYS 42 Cb 0.22 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.52 3f7j h LYS 42 CO -0.00 0.00 0.06 0.09 -2.00 0.00 0.00 179.45 177.60 3f7j n ASN 43 N -3.77 4.60 0.00 7.07 3.02 -0.40 -4.94 115.26 120.84 3f7j n ASN 43 Ca -0.02 -2.79 0.00 0.00 -0.03 0.00 0.00 54.58 51.74 3f7j n ASN 43 Cb 0.14 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 38.65 3f7j n ASN 43 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3f7j n GLY 44 N 0.35 0.59 3.77 7.41 0.00 -0.38 -5.01 105.19 111.90 3f7j n GLY 44 Ca 0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.86 3f7j n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3f7j s TYR 45 N -2.29 2.89 0.00 1.61 1.51 0.05 -4.62 117.35 116.50 3f7j s TYR 45 Ca 0.00 1.23 0.00 0.00 -1.01 0.00 0.00 57.07 57.29 3f7j s TYR 45 Cb 0.00 -3.83 0.00 0.00 -0.11 0.00 0.00 41.96 38.02 3f7j s TYR 45 CO 0.00 -2.45 0.71 0.54 -1.11 0.00 0.00 175.55 173.24 3f7j n ARG 46 N 1.11 1.34 -4.61 -0.62 5.12 -1.26 -4.19 116.66 113.55 3f7j n ARG 46 Ca 0.02 -0.96 -0.26 0.00 -1.93 0.00 0.00 57.85 54.73 3f7j n ARG 46 Cb 0.40 -0.82 -0.17 0.00 -1.16 0.00 0.00 32.46 30.72 3f7j n ARG 46 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3f7j s SER 47 N -0.50 1.94 -0.07 0.55 0.15 -1.26 0.15 113.70 114.66 3f7j s SER 47 Ca 0.00 -0.33 0.04 0.00 0.70 0.00 0.00 55.95 56.37 3f7j s SER 47 Cb 0.00 -0.89 -0.00 0.00 -1.71 0.00 0.00 66.02 63.42 3f7j s SER 47 CO 0.00 0.04 -0.21 -0.63 1.20 0.00 0.00 173.24 173.64 3f7j s ILE 48 N 0.69 1.77 -0.18 6.45 -1.09 -0.40 -0.99 121.20 127.45 3f7j s ILE 48 Ca -0.14 -0.88 -0.01 0.00 -2.23 0.00 0.00 60.65 57.40 3f7j s ILE 48 Cb -0.16 -1.52 0.00 0.00 -1.58 0.00 0.00 42.46 39.20 3f7j s ILE 48 CO 0.03 0.50 -0.13 -0.62 -1.23 0.00 0.00 174.94 173.49 3f7j s ASP 49 N 0.18 3.77 0.00 3.58 2.15 0.87 -1.86 116.67 125.36 3f7j s ASP 49 Ca -0.11 -0.47 0.00 0.00 0.43 0.00 0.00 52.55 52.40 3f7j s ASP 49 Cb -0.15 -1.60 0.00 0.00 -0.30 0.00 0.00 42.92 40.87 3f7j s ASP 49 CO 0.05 0.04 0.00 1.07 -0.17 0.00 0.00 175.17 176.16 3f7j n THR 50 N 4.36 0.00 -3.57 1.71 5.66 -0.33 -1.21 114.28 120.90 3f7j n THR 50 Ca -0.19 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.67 3f7j n THR 50 Cb 0.51 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.23 3f7j n THR 50 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3f7j s ALA 51 N -2.00 -1.86 0.23 1.79 0.00 -1.26 -4.04 121.76 114.62 3f7j s ALA 51 Ca 0.00 1.59 -0.07 0.00 0.00 0.00 0.00 51.96 53.49 3f7j s ALA 51 Cb 0.00 -0.63 0.40 0.00 0.00 0.00 0.00 23.12 22.88 3f7j s ALA 51 CO 0.00 -0.32 1.70 0.00 0.00 0.00 0.00 175.76 177.14 3f7j h ALA 52 N 3.27 0.88 0.00 0.00 0.00 -1.93 -1.45 119.26 120.03 3f7j h ALA 52 Ca -0.24 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3f7j h ALA 52 Cb 1.16 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.13 3f7j h ALA 52 CO 0.27 -0.30 0.00 0.97 0.00 0.00 0.00 179.25 180.19 3f7j h ILE 53 N 0.30 0.00 0.00 0.00 6.09 -1.96 -2.20 117.51 119.73 3f7j h ILE 53 Ca 0.38 -0.45 0.00 0.00 -1.37 0.00 0.00 64.86 63.42 3f7j h ILE 53 Cb 0.60 1.40 0.00 0.00 0.47 0.00 0.00 36.82 39.29 3f7j h ILE 53 CO -0.45 0.00 0.00 -1.22 -3.07 0.00 0.00 178.15 173.41 3f7j n TYR 54 N -2.94 0.29 -1.86 2.19 0.53 -0.55 -4.88 117.16 109.94 3f7j n TYR 54 Ca 0.01 0.11 -0.20 0.00 -1.02 0.00 0.00 57.90 56.80 3f7j n TYR 54 Cb 0.28 -0.68 -0.06 0.00 -1.03 0.00 0.00 39.34 37.86 3f7j n TYR 54 CO 0.00 0.00 0.00 1.63 -1.02 0.00 0.00 176.86 177.47 3f7j n LYS 55 N -1.76 -1.44 -0.17 -0.72 5.02 -0.83 -4.81 118.16 113.44 3f7j n LYS 55 Ca 0.03 1.11 0.04 0.00 -2.02 0.00 0.00 58.31 57.47 3f7j n LYS 55 Cb 0.21 -5.54 0.06 0.00 -0.02 0.00 0.00 35.03 29.74 3f7j n LYS 55 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3f7j n ASN 56 N -1.39 1.33 -0.13 4.39 0.23 -1.26 -4.77 115.26 113.67 3f7j n ASN 56 Ca -0.21 -2.34 0.12 0.00 -0.53 0.00 0.00 54.58 51.61 3f7j n ASN 56 Cb 0.66 -0.24 0.47 0.00 -2.08 0.00 0.00 39.78 38.58 3f7j n ASN 56 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3f7j h GLU 57 N 0.00 0.48 -0.12 -3.83 5.08 -1.88 -0.92 114.58 113.38 3f7j h GLU 57 Ca 0.00 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 3f7j h GLU 57 Cb 1.03 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 3f7j h GLU 57 CO 0.00 0.32 0.06 0.93 -1.00 0.00 0.00 179.01 179.31 3f7j h GLU 58 N 0.49 0.18 -0.92 2.33 5.08 -1.86 -0.46 114.58 119.42 3f7j h GLU 58 Ca 0.31 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.64 3f7j h GLU 58 Cb 0.56 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 3f7j h GLU 58 CO -0.10 0.25 0.56 0.78 -1.00 0.00 0.00 179.01 179.51 3f7j h GLY 59 N 0.06 1.33 0.98 -3.84 0.00 -1.63 -2.46 103.07 97.50 3f7j h GLY 59 Ca 0.04 -0.54 0.00 0.00 0.00 0.00 0.00 47.33 46.83 3f7j h GLY 59 CO -0.00 0.53 0.07 -2.08 0.00 0.00 0.00 176.54 175.06 3f7j h VAL 60 N 1.26 1.05 -0.96 4.60 2.07 -0.98 -1.86 116.25 121.43 3f7j h VAL 60 Ca 0.33 -0.11 0.07 0.00 0.82 0.00 0.00 66.70 67.81 3f7j h VAL 60 Cb -0.07 0.91 -0.07 0.00 -1.52 0.00 0.00 31.29 30.54 3f7j h VAL 60 CO -0.06 0.04 0.61 1.23 0.02 0.00 0.00 177.57 179.41 3f7j h GLY 61 N 0.14 1.48 1.48 2.17 0.00 -0.94 -0.86 103.07 106.54 3f7j h GLY 61 Ca 0.04 -0.44 -0.18 0.00 0.00 0.00 0.00 47.33 46.75 3f7j h GLY 61 CO -0.01 0.28 -0.68 -2.22 0.00 0.00 0.00 176.54 173.92 3f7j h ILE 62 N 1.08 1.34 -0.60 2.60 2.04 -1.22 -2.36 117.51 120.39 3f7j h ILE 62 Ca 0.43 -2.00 -0.05 0.00 1.00 0.00 0.00 64.86 64.24 3f7j h ILE 62 Cb 0.23 1.98 -0.03 0.00 -0.74 0.00 0.00 36.82 38.26 3f7j h ILE 62 CO -0.19 0.61 0.16 1.23 0.00 0.00 0.00 178.15 179.96 3f7j h GLY 63 N 1.09 0.99 0.99 5.37 0.00 -0.68 0.33 103.07 111.15 3f7j h GLY 63 Ca -0.02 -0.57 -0.00 0.00 0.00 0.00 0.00 47.33 46.73 3f7j h GLY 63 CO 0.12 0.54 0.26 -2.22 0.00 0.00 0.00 176.54 175.24 3f7j h ILE 64 N 0.89 1.13 -0.11 2.60 2.04 -1.03 0.32 117.51 123.35 3f7j h ILE 64 Ca 0.19 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.73 3f7j h ILE 64 Cb 0.29 0.57 -0.00 0.00 -0.74 0.00 0.00 36.82 36.94 3f7j h ILE 64 CO -0.00 0.14 -0.01 0.11 0.00 0.00 0.00 178.15 178.38 3f7j h LYS 65 N 0.56 0.21 0.00 2.37 1.57 -1.15 -2.89 116.57 117.25 3f7j h LYS 65 Ca 0.15 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3f7j h LYS 65 Cb -0.00 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.29 3f7j h LYS 65 CO -0.03 0.48 0.00 0.93 -0.57 0.00 0.00 179.45 180.26 3f7j h GLU 66 N -0.09 0.00 -0.49 3.15 5.08 -0.81 -3.07 114.58 118.36 3f7j h GLU 66 Ca 0.03 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.30 3f7j h GLU 66 Cb 0.39 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 3f7j h GLU 66 CO 0.01 0.00 -0.07 0.66 -1.00 0.00 0.00 179.01 178.61 3f7j h SER 67 N 0.00 0.86 -4.17 1.42 4.64 -0.14 -3.47 113.55 112.69 3f7j h SER 67 Ca 0.00 -0.25 -0.28 0.00 -0.47 0.00 0.00 61.79 60.80 3f7j h SER 67 Cb 0.40 -0.23 0.09 0.00 -0.31 0.00 0.00 62.40 62.35 3f7j h SER 67 CO 0.00 0.96 -0.46 0.61 -0.87 0.00 0.00 176.83 177.07 3f7j n GLY 68 N -0.45 -0.09 3.58 -0.77 0.00 -1.16 -4.83 105.19 101.48 3f7j n GLY 68 Ca 0.02 -0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 3f7j n GLY 68 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3f7j s VAL 69 N -3.18 3.51 0.18 1.61 -7.23 -1.26 -5.09 120.40 108.93 3f7j s VAL 69 Ca 0.38 -0.94 -0.33 0.00 -1.81 0.00 0.00 61.98 59.27 3f7j s VAL 69 Cb -0.17 -2.56 -0.13 0.00 0.56 0.00 0.00 36.38 34.08 3f7j s VAL 69 CO 0.46 0.31 1.59 0.00 -0.31 0.00 0.00 175.10 177.15 3f7j n ALA 70 N 1.30 1.62 -0.26 1.32 0.00 -1.26 -4.87 120.51 118.37 3f7j n ALA 70 Ca -0.15 0.44 0.06 0.00 0.00 0.00 0.00 53.44 53.79 3f7j n ALA 70 Cb 0.52 -2.38 0.18 0.00 0.00 0.00 0.00 19.45 17.78 3f7j n ALA 70 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3f7j h ARG 71 N 5.93 0.16 -0.02 0.00 9.65 -1.95 -0.48 114.38 127.67 3f7j h ARG 71 Ca -0.45 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.43 3f7j h ARG 71 Cb 1.25 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 29.79 3f7j h ARG 71 CO 0.89 0.10 0.04 1.05 2.80 0.00 0.00 179.97 184.85 3f7j h GLU 72 N 0.16 0.00 -0.00 0.20 9.09 -2.04 -0.35 114.58 121.64 3f7j h GLU 72 Ca 0.43 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.84 3f7j h GLU 72 Cb 0.78 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.88 3f7j h GLU 72 CO -0.62 0.00 -0.07 0.39 0.05 0.00 0.00 179.01 178.77 3f7j n GLU 73 N -3.37 0.09 -4.01 1.06 1.02 -0.19 -4.87 120.64 110.36 3f7j n GLU 73 Ca -0.03 -0.01 -0.31 0.00 -0.02 0.00 0.00 57.16 56.80 3f7j n GLU 73 Cb 0.12 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 29.98 3f7j n GLU 73 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3f7j s LEU 74 N -2.92 3.96 -0.34 -4.62 1.43 -0.14 -4.89 118.68 111.16 3f7j s LEU 74 Ca 0.16 0.07 0.03 0.00 -1.03 0.00 0.00 54.13 53.36 3f7j s LEU 74 Cb 0.19 -2.62 0.10 0.00 0.03 0.00 0.00 46.19 43.89 3f7j s LEU 74 CO 0.54 0.17 0.05 0.12 0.23 0.00 0.00 176.35 177.46 3f7j s PHE 75 N -1.43 3.71 -0.23 0.29 5.36 0.12 -4.94 117.98 120.87 3f7j s PHE 75 Ca 0.31 -2.89 -0.10 0.00 -0.96 0.00 0.00 56.93 53.29 3f7j s PHE 75 Cb -0.12 -2.89 -0.05 0.00 -0.34 0.00 0.00 43.02 39.62 3f7j s PHE 75 CO 0.24 -0.95 0.14 0.42 -1.46 0.00 0.00 175.22 173.61 3f7j s ILE 76 N 0.94 5.22 -0.11 3.12 -1.09 -1.26 -1.28 121.20 126.74 3f7j s ILE 76 Ca 0.09 0.13 0.01 0.00 -2.23 0.00 0.00 60.65 58.66 3f7j s ILE 76 Cb -0.19 -3.43 -0.01 0.00 -1.58 0.00 0.00 42.46 37.25 3f7j s ILE 76 CO -0.07 0.36 -0.16 -0.89 -1.23 0.00 0.00 174.94 172.95 3f7j s THR 77 N 1.01 2.82 0.05 2.92 2.01 -0.78 -1.75 115.64 121.93 3f7j s THR 77 Ca 0.07 -0.75 0.00 0.00 0.31 0.00 0.00 61.69 61.32 3f7j s THR 77 Cb -0.13 -2.16 -0.00 0.00 0.01 0.00 0.00 72.50 70.22 3f7j s THR 77 CO 0.04 0.54 0.02 -0.24 -0.69 0.00 0.00 174.62 174.28 3f7j n SER 78 N 3.39 1.13 -3.75 3.53 2.88 -0.90 -1.19 113.62 118.70 3f7j n SER 78 Ca -0.18 -1.26 -0.13 0.00 -1.33 0.00 0.00 58.87 55.96 3f7j n SER 78 Cb 0.53 0.11 -0.10 0.00 -0.75 0.00 0.00 64.21 64.00 3f7j n SER 78 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 3f7j s LYS 79 N -2.19 0.46 -0.17 -1.46 1.02 -1.26 -1.66 119.74 114.48 3f7j s LYS 79 Ca 0.02 0.41 -0.26 0.00 0.02 0.00 0.00 55.97 56.16 3f7j s LYS 79 Cb 0.00 0.22 -0.01 0.00 -0.52 0.00 0.00 37.83 37.52 3f7j s LYS 79 CO 0.02 -0.07 0.88 0.54 -0.92 0.00 0.00 175.35 175.80 3f7j s VAL 80 N -0.02 4.84 0.54 3.17 0.11 0.04 -3.12 120.40 125.96 3f7j s VAL 80 Ca -0.02 1.74 -0.20 0.00 -2.93 0.00 0.00 61.98 60.57 3f7j s VAL 80 Cb -0.03 -4.18 -0.05 0.00 -1.53 0.00 0.00 36.38 30.58 3f7j s VAL 80 CO 0.01 -0.01 1.17 0.86 -3.33 0.00 0.00 175.10 173.80 3f7j s TRP 81 N 2.28 2.62 0.24 1.54 -0.00 -1.26 -2.34 118.94 122.02 3f7j s TRP 81 Ca 0.40 1.53 -0.10 0.00 -0.00 0.00 0.00 56.10 57.93 3f7j s TRP 81 Cb -0.17 -3.38 0.36 0.00 -0.00 0.00 0.00 33.47 30.29 3f7j s TRP 81 CO 0.12 -1.79 1.60 -0.91 -0.00 0.00 0.00 176.95 175.98 3f7j h ASN 82 N 1.28 -0.66 0.68 5.86 -0.26 -1.95 0.60 115.58 121.12 3f7j h ASN 82 Ca -0.50 0.23 0.00 0.00 -0.56 0.00 0.00 56.30 55.47 3f7j h ASN 82 Cb 1.27 0.46 0.00 0.00 -1.06 0.00 0.00 38.32 38.99 3f7j h ASN 82 CO 0.57 -0.25 0.00 -0.08 -1.06 0.00 0.00 177.43 176.61 3f7j h GLU 83 N 0.02 0.00 -0.23 0.81 4.81 -2.00 -2.46 114.58 115.52 3f7j h GLU 83 Ca 0.39 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.62 3f7j h GLU 83 Cb 0.62 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.00 3f7j h GLU 83 CO -0.79 0.00 0.00 -0.25 -0.73 0.00 0.00 179.01 177.24 3f7j n ASP 84 N -2.35 2.57 -4.75 1.04 8.00 0.20 -4.99 116.55 116.26 3f7j n ASP 84 Ca 0.01 -1.85 -0.33 0.00 0.71 0.00 0.00 54.79 53.34 3f7j n ASP 84 Cb 0.22 -0.15 0.07 0.00 -0.02 0.00 0.00 41.12 41.24 3f7j n ASP 84 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 3f7j s GLN 85 N -1.71 2.48 0.00 -1.24 -0.21 -0.93 -2.74 119.66 115.31 3f7j s GLN 85 Ca 0.35 1.44 0.00 0.00 0.02 0.00 0.00 55.36 57.16 3f7j s GLN 85 Cb 0.20 -1.91 0.00 0.00 1.00 0.00 0.00 33.01 32.31 3f7j s GLN 85 CO 0.29 -1.51 0.00 0.41 -2.12 0.00 0.00 175.29 172.37 3f7j n GLY 86 N -0.41 3.06 0.34 3.09 0.00 -1.26 -4.79 105.19 105.22 3f7j n GLY 86 Ca 0.11 -1.85 -0.13 0.00 0.00 0.00 0.00 46.02 44.15 3f7j n GLY 86 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3f7j h TYR 87 N 0.00 -0.81 -0.52 1.61 5.03 -1.90 -1.52 116.97 118.87 3f7j h TYR 87 Ca 0.00 -0.02 -0.08 0.00 2.58 0.00 0.00 58.73 61.21 3f7j h TYR 87 Cb 0.00 0.27 -0.02 0.00 1.55 0.00 0.00 36.73 38.53 3f7j h TYR 87 CO 0.00 -0.50 0.02 1.49 -1.32 0.00 0.00 178.16 177.85 3f7j h GLU 88 N -0.87 0.90 0.00 1.82 4.57 -1.94 -2.68 114.58 116.39 3f7j h GLU 88 Ca -0.09 -0.28 -0.03 0.00 -1.18 0.00 0.00 59.36 57.78 3f7j h GLU 88 Cb 0.66 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.16 3f7j h GLU 88 CO 0.14 0.92 -0.15 1.79 -1.18 0.00 0.00 179.01 180.53 3f7j h THR 89 N 0.77 0.94 -0.28 0.32 1.35 -1.78 -2.75 112.91 111.47 3f7j h THR 89 Ca 0.15 -0.56 -0.15 0.00 -0.55 0.00 0.00 66.41 65.30 3f7j h THR 89 Cb 0.50 1.32 -0.00 0.00 -1.73 0.00 0.00 68.15 68.23 3f7j h THR 89 CO 0.02 0.15 -0.40 0.74 -0.25 0.00 0.00 175.52 175.79 3f7j h THR 90 N 0.00 1.30 -0.83 6.82 2.02 -0.94 -0.82 112.91 120.46 3f7j h THR 90 Ca -0.00 -1.59 0.01 0.00 0.77 0.00 0.00 66.41 65.60 3f7j h THR 90 Cb 0.30 1.64 -0.04 0.00 -1.74 0.00 0.00 68.15 68.31 3f7j h THR 90 CO 0.02 0.51 0.55 -0.07 0.37 0.00 0.00 175.52 176.90 3f7j h LEU 91 N 0.51 0.95 -0.08 2.58 3.38 -1.32 -1.06 115.31 120.28 3f7j h LEU 91 Ca 0.03 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3f7j h LEU 91 Cb 0.99 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 3f7j h LEU 91 CO 0.09 0.69 0.02 0.00 0.09 0.00 0.00 178.44 179.34 3f7j h ALA 92 N 1.30 0.10 -0.82 1.53 0.00 -1.42 -2.58 119.26 117.38 3f7j h ALA 92 Ca 0.30 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3f7j h ALA 92 Cb -0.13 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 3f7j h ALA 92 CO -0.07 -0.29 0.38 0.00 0.00 0.00 0.00 179.25 179.28 3f7j h ALA 93 N 0.83 1.13 -0.45 0.00 0.00 -0.92 -1.98 119.26 117.87 3f7j h ALA 93 Ca 0.03 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.78 3f7j h ALA 93 Cb 0.21 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3f7j h ALA 93 CO -0.00 0.65 0.29 0.35 0.00 0.00 0.00 179.25 180.54 3f7j h PHE 94 N 1.17 0.55 -0.72 0.00 3.57 -1.16 -1.89 116.94 118.45 3f7j h PHE 94 Ca 0.28 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.79 3f7j h PHE 94 Cb 0.13 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.65 3f7j h PHE 94 CO 0.02 0.34 0.43 1.49 -2.23 0.00 0.00 178.31 178.35 3f7j h GLU 95 N 0.59 0.98 -0.49 1.11 4.57 -1.04 -1.84 114.58 118.46 3f7j h GLU 95 Ca 0.17 -0.09 -0.09 0.00 -1.18 0.00 0.00 59.36 58.16 3f7j h GLU 95 Cb -0.05 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 28.31 3f7j h GLU 95 CO -0.04 0.69 -0.07 0.87 -1.18 0.00 0.00 179.01 179.28 3f7j h LYS 96 N 1.00 0.88 -0.55 1.92 1.57 -1.10 -1.45 116.57 118.83 3f7j h LYS 96 Ca 0.26 -0.29 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 3f7j h LYS 96 Cb -0.03 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.18 3f7j h LYS 96 CO -0.05 0.92 0.26 0.77 -0.57 0.00 0.00 179.45 180.79 3f7j h SER 97 N 0.80 0.73 -0.61 0.86 0.02 -0.91 -1.53 113.55 112.90 3f7j h SER 97 Ca 0.14 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 3f7j h SER 97 Cb 0.58 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.90 3f7j h SER 97 CO 0.04 0.66 0.39 -0.07 -1.14 0.00 0.00 176.83 176.70 3f7j h LEU 98 N 0.75 0.72 -0.14 5.07 3.38 -1.15 0.51 115.31 124.45 3f7j h LEU 98 Ca 0.19 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 3f7j h LEU 98 Cb 0.12 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3f7j h LEU 98 CO -0.02 0.55 0.05 -0.08 0.09 0.00 0.00 178.44 179.02 3f7j h GLU 99 N 0.83 0.21 -0.05 1.13 4.81 -1.01 0.13 114.58 120.64 3f7j h GLU 99 Ca 0.22 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.42 3f7j h GLU 99 Cb -0.06 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 3f7j h GLU 99 CO -0.05 0.32 -0.01 0.00 -0.73 0.00 0.00 179.01 178.55 3f7j h ARG 100 N 0.06 0.00 0.00 1.92 3.08 -1.20 -2.76 114.38 115.47 3f7j h ARG 100 Ca 0.05 -0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 3f7j h ARG 100 Cb 0.19 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 3f7j h ARG 100 CO -0.00 0.00 -0.17 -0.07 -1.07 0.00 0.00 179.97 178.65 3f7j h LEU 101 N 0.00 0.00 -0.65 3.04 3.38 -0.76 -3.35 115.31 116.98 3f7j h LEU 101 Ca 0.02 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.78 3f7j h LEU 101 Cb 0.03 0.00 0.06 0.00 0.09 0.00 0.00 40.66 40.85 3f7j h LEU 101 CO -0.05 0.17 -0.34 0.00 0.09 0.00 0.00 178.44 178.31 3f7j n GLN 102 N -3.67 -3.78 -4.47 1.13 6.02 0.40 -4.21 117.38 108.80 3f7j n GLN 102 Ca -0.01 0.44 -0.25 0.00 -0.01 0.00 0.00 57.00 57.17 3f7j n GLN 102 Cb 0.29 -4.30 -0.10 0.00 1.02 0.00 0.00 30.24 27.16 3f7j n GLN 102 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3f7j s LEU 103 N -4.14 2.73 -0.02 1.08 1.43 -0.78 -5.05 118.68 113.94 3f7j s LEU 103 Ca 0.27 -1.06 0.16 0.00 -1.03 0.00 0.00 54.13 52.47 3f7j s LEU 103 Cb -0.12 -1.13 -0.23 0.00 0.03 0.00 0.00 46.19 44.74 3f7j s LEU 103 CO 0.34 -0.08 0.44 0.47 0.23 0.00 0.00 176.35 177.74 3f7j n ASP 104 N -0.74 1.17 -3.51 2.29 8.00 -1.26 -4.62 116.55 117.87 3f7j n ASP 104 Ca -0.05 -0.25 -0.14 0.00 0.71 0.00 0.00 54.79 55.06 3f7j n ASP 104 Cb 0.61 1.52 -0.04 0.00 -0.02 0.00 0.00 41.12 43.19 3f7j n ASP 104 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3f7j s TYR 105 N -2.92 -0.51 0.16 1.24 -0.85 -1.26 -4.89 117.35 108.32 3f7j s TYR 105 Ca -0.02 0.56 0.05 0.00 -0.52 0.00 0.00 57.07 57.14 3f7j s TYR 105 Cb 0.11 0.43 -0.04 0.00 0.38 0.00 0.00 41.96 42.84 3f7j s TYR 105 CO 0.66 -0.71 0.10 -0.51 -1.52 0.00 0.00 175.55 173.57 3f7j s LEU 106 N -2.08 3.69 0.13 -3.49 1.43 -0.71 -5.00 118.68 112.64 3f7j s LEU 106 Ca -0.04 -0.19 -0.03 0.00 -1.03 0.00 0.00 54.13 52.84 3f7j s LEU 106 Cb -0.01 -2.31 -0.09 0.00 0.03 0.00 0.00 46.19 43.81 3f7j s LEU 106 CO -0.03 0.08 1.30 0.44 0.23 0.00 0.00 176.35 178.37 3f7j h ASP 107 N 2.52 0.47 -3.72 2.29 3.32 -1.68 -0.65 116.42 118.98 3f7j h ASP 107 Ca -0.47 -0.39 -0.17 0.00 0.02 0.00 0.00 57.03 56.02 3f7j h ASP 107 Cb 1.20 -0.14 -0.26 0.00 0.22 0.00 0.00 39.33 40.34 3f7j h ASP 107 CO 0.62 1.19 -0.42 -0.22 -1.72 0.00 0.00 179.24 178.69 3f7j s LEU 108 N -7.62 0.85 -0.05 1.55 2.96 -1.05 -0.82 118.68 114.50 3f7j s LEU 108 Ca -0.05 0.54 0.02 0.00 -0.22 0.00 0.00 54.13 54.42 3f7j s LEU 108 Cb 0.09 0.88 0.01 0.00 0.50 0.00 0.00 46.19 47.67 3f7j s LEU 108 CO 0.86 -0.11 -0.10 -0.47 -1.32 0.00 0.00 176.35 175.21 3f7j s TYR 109 N 0.40 1.17 0.14 5.38 5.04 -1.01 -2.13 117.35 126.34 3f7j s TYR 109 Ca -0.02 -0.37 0.11 0.00 -2.44 0.00 0.00 57.07 54.35 3f7j s TYR 109 Cb -0.04 -0.87 -0.04 0.00 0.35 0.00 0.00 41.96 41.37 3f7j s TYR 109 CO -0.02 -0.19 -0.27 -0.51 -1.34 0.00 0.00 175.55 173.22 3f7j s LEU 110 N 0.51 2.33 -0.18 6.97 1.43 -0.67 -1.58 118.68 127.49 3f7j s LEU 110 Ca -0.09 -0.76 -0.29 0.00 -1.03 0.00 0.00 54.13 51.95 3f7j s LEU 110 Cb -0.13 -1.21 -0.01 0.00 0.03 0.00 0.00 46.19 44.87 3f7j s LEU 110 CO 0.02 0.17 1.19 -0.63 0.23 0.00 0.00 176.35 177.33 3f7j s ILE 111 N -1.12 4.41 0.14 -0.59 1.01 -0.88 -0.78 121.20 123.39 3f7j s ILE 111 Ca 0.15 1.70 -0.15 0.00 0.00 0.00 0.00 60.65 62.34 3f7j s ILE 111 Cb -0.10 -4.10 0.01 0.00 0.01 0.00 0.00 42.46 38.28 3f7j s ILE 111 CO 0.06 -0.14 1.70 -0.74 0.00 0.00 0.00 174.94 175.82 3f7j h HIS 112 N 7.95 0.63 -3.90 3.97 2.76 -1.73 0.53 115.15 125.36 3f7j h HIS 112 Ca -0.24 -0.04 -0.16 0.00 -2.20 0.00 0.00 60.37 57.73 3f7j h HIS 112 Cb 1.09 -0.19 -0.20 0.00 1.55 0.00 0.00 27.41 29.66 3f7j h HIS 112 CO 0.78 0.53 -0.65 -1.58 -1.30 0.00 0.00 177.93 175.72 3f7j s TRP 113 N -5.63 0.23 0.09 5.26 0.52 -1.25 -4.22 118.94 113.95 3f7j s TRP 113 Ca -0.13 -0.49 -0.14 0.00 0.02 0.00 0.00 56.10 55.36 3f7j s TRP 113 Cb 0.11 -0.17 -0.14 0.00 -1.15 0.00 0.00 33.47 32.11 3f7j s TRP 113 CO 0.75 -0.23 1.32 -1.00 0.02 0.00 0.00 176.95 177.81 3f7j h PRO 114 N 4.42 0.72 0.00 4.98 0.13 -1.76 -3.48 132.00 137.01 3f7j h PRO 114 Ca -0.32 -0.52 0.00 0.00 -0.87 0.00 0.00 66.00 64.29 3f7j h PRO 114 Cb 1.20 0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.42 3f7j h PRO 114 CO 0.43 1.14 0.00 0.41 -0.23 0.00 0.00 178.00 179.75 3f7j n GLY 115 N 0.54 2.04 0.05 1.56 0.00 -1.26 -4.34 105.19 103.78 3f7j n GLY 115 Ca -0.06 -0.49 -0.04 0.00 0.00 0.00 0.00 46.02 45.43 3f7j n GLY 115 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3f7j n LYS 116 N 7.53 0.30 -1.09 1.61 5.02 -1.26 -4.86 118.16 125.40 3f7j n LYS 116 Ca 0.00 0.30 -0.02 0.00 -2.02 0.00 0.00 58.31 56.58 3f7j n LYS 116 Cb 0.00 -1.23 -0.03 0.00 -0.02 0.00 0.00 35.03 33.75 3f7j n LYS 116 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3f7j n ASP 117 N -3.73 -0.11 0.00 4.39 5.68 -1.26 -4.87 116.55 116.66 3f7j n ASP 117 Ca -0.06 -1.90 0.00 0.00 -0.50 0.00 0.00 54.79 52.33 3f7j n ASP 117 Cb 0.23 0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.23 3f7j n ASP 117 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3f7j n LYS 118 N 0.18 2.98 0.16 0.11 5.02 -1.26 -4.83 118.16 120.52 3f7j n LYS 118 Ca -0.11 -0.21 0.02 0.00 -2.02 0.00 0.00 58.31 55.99 3f7j n LYS 118 Cb 0.84 -0.68 0.26 0.00 -0.02 0.00 0.00 35.03 35.43 3f7j n LYS 118 CO 0.00 0.00 0.00 0.10 -0.52 0.00 0.00 177.40 176.98 3f7j h TYR 119 N 0.00 0.00 -0.52 2.13 -0.00 -1.90 -1.41 116.97 115.27 3f7j h TYR 119 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 58.73 58.67 3f7j h TYR 119 Cb 0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 36.73 3f7j h TYR 119 CO 0.00 0.49 0.09 0.87 -0.00 0.00 0.00 178.16 179.62 3f7j h LYS 120 N 0.00 0.86 -0.53 0.10 1.57 -1.94 0.32 116.57 116.95 3f7j h LYS 120 Ca -0.00 -0.22 -0.05 0.00 -1.87 0.00 0.00 60.65 58.50 3f7j h LYS 120 Cb 0.96 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.15 3f7j h LYS 120 CO 0.06 0.84 0.12 -0.44 -0.57 0.00 0.00 179.45 179.46 3f7j h ASP 121 N 0.74 0.80 -0.51 0.86 3.45 -1.88 -1.79 116.42 118.10 3f7j h ASP 121 Ca 0.16 -0.24 0.02 0.00 0.43 0.00 0.00 57.03 57.40 3f7j h ASP 121 Cb 0.39 -0.21 -0.03 0.00 -0.56 0.00 0.00 39.33 38.91 3f7j h ASP 121 CO 0.01 0.83 0.31 0.74 -1.57 0.00 0.00 179.24 179.56 3f7j h THR 122 N 0.74 1.07 -0.64 0.35 2.02 -1.10 -2.52 112.91 112.83 3f7j h THR 122 Ca 0.16 -0.21 0.06 0.00 0.77 0.00 0.00 66.41 67.19 3f7j h THR 122 Cb 0.35 0.39 -0.04 0.00 -1.74 0.00 0.00 68.15 67.11 3f7j h THR 122 CO 0.00 0.11 0.42 -0.25 0.37 0.00 0.00 175.52 176.18 3f7j h TRP 123 N 0.63 0.66 -0.75 3.16 2.91 0.25 -1.69 115.95 121.12 3f7j h TRP 123 Ca 0.20 0.02 -0.03 0.00 1.13 0.00 0.00 58.89 60.21 3f7j h TRP 123 Cb -0.01 -0.22 -0.03 0.00 -0.51 0.00 0.00 29.16 28.39 3f7j h TRP 123 CO -0.06 0.36 0.34 0.00 -1.03 0.00 0.00 178.44 178.05 3f7j h ARG 124 N 0.66 1.08 -0.40 2.65 3.08 -0.91 0.11 114.38 120.65 3f7j h ARG 124 Ca 0.27 -0.16 -0.05 0.00 0.07 0.00 0.00 59.98 60.12 3f7j h ARG 124 Cb 0.24 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 3f7j h ARG 124 CO -0.08 0.84 0.06 0.00 -1.07 0.00 0.00 179.97 179.72 3f7j h ALA 125 N 1.31 0.53 -0.50 0.04 0.00 -1.14 -0.76 119.26 118.74 3f7j h ALA 125 Ca 0.26 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 55.00 3f7j h ALA 125 Cb 0.13 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 3f7j h ALA 125 CO -0.03 0.24 0.24 -0.07 0.00 0.00 0.00 179.25 179.63 3f7j h LEU 126 N 0.51 0.33 -0.60 0.00 -0.00 -0.69 0.07 115.31 114.93 3f7j h LEU 126 Ca 0.12 0.03 -0.01 0.00 -0.00 0.00 0.00 57.88 58.03 3f7j h LEU 126 Cb 0.37 -0.03 -0.03 0.00 -0.00 0.00 0.00 40.66 40.97 3f7j h LEU 126 CO 0.01 0.23 0.35 -0.33 -0.00 0.00 0.00 178.44 178.70 3f7j h GLU 127 N 0.47 0.82 0.03 1.13 5.08 -0.55 -0.33 114.58 121.23 3f7j h GLU 127 Ca 0.22 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3f7j h GLU 127 Cb 0.15 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.23 3f7j h GLU 127 CO -0.17 0.60 -0.01 -0.22 -1.00 0.00 0.00 179.01 178.21 3f7j h LYS 128 N 0.81 -0.04 -1.00 2.33 3.64 -0.66 -0.64 116.57 121.01 3f7j h LYS 128 Ca 0.21 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.65 3f7j h LYS 128 Cb 0.01 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.77 3f7j h LYS 128 CO -0.04 -0.03 0.65 -0.07 -2.27 0.00 0.00 179.45 177.70 3f7j h LEU 129 N -0.04 1.07 0.60 5.20 3.38 -0.75 0.11 115.31 124.87 3f7j h LEU 129 Ca -0.00 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3f7j h LEU 129 Cb 0.03 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 3f7j h LEU 129 CO 0.01 0.71 -0.49 0.22 0.09 0.00 0.00 178.44 178.97 3f7j h TYR 130 N 1.22 -1.34 -0.88 1.13 5.03 -0.91 -1.93 116.97 119.29 3f7j h TYR 130 Ca 0.41 0.00 0.18 0.00 2.58 0.00 0.00 58.73 61.91 3f7j h TYR 130 Cb 0.08 0.51 -0.07 0.00 1.55 0.00 0.00 36.73 38.80 3f7j h TYR 130 CO -0.00 -0.68 0.58 0.87 -1.32 0.00 0.00 178.16 177.61 3f7j h LYS 131 N -1.06 0.46 0.00 1.82 1.57 -0.51 0.20 116.57 119.06 3f7j h LYS 131 Ca -0.08 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 3f7j h LYS 131 Cb 0.89 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.10 3f7j h LYS 131 CO 0.00 0.31 0.00 -0.25 -0.57 0.00 0.00 179.45 178.94 3f7j n ASP 132 N -4.53 0.00 0.00 0.86 8.00 0.31 -4.89 116.55 116.30 3f7j n ASP 132 Ca 0.18 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.76 3f7j n ASP 132 Cb 0.62 -0.32 0.00 0.00 -0.02 0.00 0.00 41.12 41.40 3f7j n ASP 132 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3f7j n GLY 133 N 0.47 0.74 0.12 0.44 0.00 0.71 -4.94 105.19 102.73 3f7j n GLY 133 Ca 0.09 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.23 3f7j n GLY 133 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3f7j h LYS 134 N 2.93 0.00 -3.76 1.61 1.57 -1.52 -3.45 116.57 113.96 3f7j h LYS 134 Ca 0.00 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.43 3f7j h LYS 134 Cb 0.00 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 31.97 3f7j h LYS 134 CO 0.00 0.00 -0.75 0.42 -0.57 0.00 0.00 179.45 178.55 3f7j s ILE 135 N -3.23 0.23 0.31 1.86 1.01 -1.23 -1.74 121.20 118.41 3f7j s ILE 135 Ca 0.05 0.06 0.11 0.00 0.00 0.00 0.00 60.65 60.87 3f7j s ILE 135 Cb 0.10 -0.31 0.02 0.00 0.01 0.00 0.00 42.46 42.28 3f7j s ILE 135 CO 0.71 0.16 1.70 0.03 0.00 0.00 0.00 174.94 177.54 3f7j h ARG 136 N 7.27 0.01 -3.11 2.79 3.08 -1.11 -3.42 114.38 119.90 3f7j h ARG 136 Ca -0.41 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 59.53 3f7j h ARG 136 Cb 1.14 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 31.00 3f7j h ARG 136 CO 0.47 0.53 -0.25 0.00 -1.07 0.00 0.00 179.97 179.65 3f7j s ALA 137 N -3.85 -0.78 0.03 0.04 0.00 0.00 -4.91 121.76 112.30 3f7j s ALA 137 Ca -0.02 0.23 0.03 0.00 0.00 0.00 0.00 51.96 52.20 3f7j s ALA 137 Cb 0.13 0.17 -0.02 0.00 0.00 0.00 0.00 23.12 23.41 3f7j s ALA 137 CO 0.75 -0.32 -0.10 0.96 0.00 0.00 0.00 175.76 177.05 3f7j s ILE 138 N -1.80 0.75 0.00 0.00 -4.36 -1.26 -2.40 121.20 112.12 3f7j s ILE 138 Ca -0.10 -0.88 0.00 0.00 -0.26 0.00 0.00 60.65 59.41 3f7j s ILE 138 Cb -0.03 -0.72 0.00 0.00 1.25 0.00 0.00 42.46 42.96 3f7j s ILE 138 CO 0.01 -0.13 0.00 0.61 0.24 0.00 0.00 174.94 175.68 3f7j n GLY 139 N 1.93 2.25 3.21 6.27 0.00 -0.62 -0.62 105.19 117.61 3f7j n GLY 139 Ca -0.19 -0.79 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 3f7j n GLY 139 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3f7j s VAL 140 N -2.77 0.05 -0.05 1.61 -7.23 -0.28 -2.07 120.40 109.65 3f7j s VAL 140 Ca 0.00 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.14 3f7j s VAL 140 Cb 0.00 -2.51 0.02 0.00 0.56 0.00 0.00 36.38 34.45 3f7j s VAL 140 CO 0.00 0.00 0.12 -0.55 -0.31 0.00 0.00 175.10 174.36 3f7j s SER 141 N -3.18 -0.10 -1.11 4.85 0.15 0.17 -1.20 113.70 113.29 3f7j s SER 141 Ca 0.39 0.25 0.00 0.00 0.70 0.00 0.00 55.95 57.28 3f7j s SER 141 Cb 0.07 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.57 3f7j s SER 141 CO 0.12 -0.10 0.00 0.59 1.20 0.00 0.00 173.24 175.06 3f7j n ASN 142 N 3.64 -4.06 -4.77 5.45 3.02 0.01 -3.74 115.26 114.81 3f7j n ASN 142 Ca -0.20 -0.01 -0.38 0.00 -0.03 0.00 0.00 54.58 53.96 3f7j n ASN 142 Cb 0.55 -3.24 -0.06 0.00 -0.61 0.00 0.00 39.78 36.42 3f7j n ASN 142 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3f7j s PHE 143 N -2.64 3.67 0.68 3.10 2.99 -1.26 -4.36 117.98 120.16 3f7j s PHE 143 Ca 0.00 1.11 -0.03 0.00 0.00 0.00 0.00 56.93 58.00 3f7j s PHE 143 Cb 0.00 -2.53 0.08 0.00 0.00 0.00 0.00 43.02 40.57 3f7j s PHE 143 CO 0.00 0.39 0.96 -0.65 -0.00 0.00 0.00 175.22 175.92 3f7j s GLN 144 N -0.28 2.03 0.15 0.44 -1.52 -1.26 -4.91 119.66 114.31 3f7j s GLN 144 Ca 0.28 -0.67 -0.25 0.00 -1.95 0.00 0.00 55.36 52.78 3f7j s GLN 144 Cb -0.17 -2.28 0.01 0.00 -0.22 0.00 0.00 33.01 30.35 3f7j s GLN 144 CO 0.15 -1.24 1.60 0.28 -0.25 0.00 0.00 175.29 175.84 3f7j h VAL 145 N -0.46 0.26 -0.56 1.09 2.07 -1.96 -1.62 116.25 115.07 3f7j h VAL 145 Ca -0.41 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.17 3f7j h VAL 145 Cb 1.29 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 3f7j h VAL 145 CO 0.50 0.00 0.37 1.12 0.02 0.00 0.00 177.57 179.59 3f7j h HIS 146 N -0.33 0.52 -0.26 1.57 2.07 -1.99 -0.35 115.15 116.39 3f7j h HIS 146 Ca 0.13 0.01 -0.01 0.00 -2.85 0.00 0.00 60.37 57.65 3f7j h HIS 146 Cb 0.54 -0.17 -0.01 0.00 2.57 0.00 0.00 27.41 30.33 3f7j h HIS 146 CO -0.47 0.28 0.11 0.45 -3.07 0.00 0.00 177.93 175.23 3f7j h HIS 147 N 0.52 0.38 -0.48 6.12 3.86 -1.74 -1.65 115.15 122.17 3f7j h HIS 147 Ca 0.24 -0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.41 3f7j h HIS 147 Cb 0.30 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.63 3f7j h HIS 147 CO -0.00 0.39 0.24 -0.07 0.86 0.00 0.00 177.93 179.35 3f7j h LEU 148 N 0.27 0.62 -0.74 2.43 3.38 -0.38 -1.33 115.31 119.55 3f7j h LEU 148 Ca 0.09 -0.12 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 3f7j h LEU 148 Cb 0.16 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 3f7j h LEU 148 CO -0.01 0.56 0.00 -0.33 0.09 0.00 0.00 178.44 178.76 3f7j h GLU 149 N 0.63 0.97 -0.12 1.13 5.08 -1.04 0.20 114.58 121.42 3f7j h GLU 149 Ca 0.17 -0.29 0.03 0.00 -1.00 0.00 0.00 59.36 58.26 3f7j h GLU 149 Cb 0.10 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 3f7j h GLU 149 CO -0.02 0.95 -0.05 0.93 -1.00 0.00 0.00 179.01 179.82 3f7j h GLU 150 N 0.89 -0.04 -0.88 2.33 4.39 -1.11 -2.94 114.58 117.22 3f7j h GLU 150 Ca 0.16 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.86 3f7j h GLU 150 Cb 0.52 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.13 3f7j h GLU 150 CO 0.03 -0.02 0.52 1.25 -1.16 0.00 0.00 179.01 179.62 3f7j h LEU 151 N -0.04 1.07 -1.36 1.33 5.85 -0.96 -2.94 115.31 118.27 3f7j h LEU 151 Ca 0.07 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 3f7j h LEU 151 Cb 0.14 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 3f7j h LEU 151 CO -0.15 0.83 -0.21 -0.07 -0.34 0.00 0.00 178.44 178.51 3f7j h LEU 152 N 1.21 0.00 -0.76 2.25 3.38 -0.85 -1.96 115.31 118.59 3f7j h LEU 152 Ca 0.31 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.43 3f7j h LEU 152 Cb -0.03 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.63 3f7j h LEU 152 CO -0.06 0.21 0.30 0.11 0.09 0.00 0.00 178.44 179.09 3f7j h LYS 153 N 0.00 0.43 -0.00 1.13 1.57 -1.34 -3.21 116.57 115.14 3f7j h LYS 153 Ca -0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3f7j h LYS 153 Cb 0.63 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.84 3f7j h LYS 153 CO 0.03 0.28 -0.01 -0.25 -0.57 0.00 0.00 179.45 178.93 3f7j n ASP 154 N -5.01 1.03 -4.76 0.86 8.00 -1.12 -5.03 116.55 110.53 3f7j n ASP 154 Ca 0.15 -1.02 -0.40 0.00 0.71 0.00 0.00 54.79 54.23 3f7j n ASP 154 Cb 0.43 0.12 -0.04 0.00 -0.02 0.00 0.00 41.12 41.60 3f7j n ASP 154 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3f7j s ALA 155 N -0.28 3.42 -0.09 2.24 0.00 -0.75 -4.93 121.76 121.38 3f7j s ALA 155 Ca 0.02 0.96 -0.22 0.00 0.00 0.00 0.00 51.96 52.72 3f7j s ALA 155 Cb 0.02 -3.35 -0.29 0.00 0.00 0.00 0.00 23.12 19.50 3f7j s ALA 155 CO 0.03 -0.24 0.75 0.93 0.00 0.00 0.00 175.76 177.23 3f7j h GLU 156 N 3.79 0.21 -5.25 0.00 5.08 -1.91 -3.46 114.58 113.04 3f7j h GLU 156 Ca -0.47 -0.37 -0.64 0.00 -1.00 0.00 0.00 59.36 56.88 3f7j h GLU 156 Cb 1.21 0.14 -0.22 0.00 0.50 0.00 0.00 28.75 30.38 3f7j h GLU 156 CO 0.67 1.18 -0.67 0.42 -1.00 0.00 0.00 179.01 179.60 3f7j s ILE 157 N -2.40 3.83 0.30 3.13 1.01 -1.26 -5.10 121.20 120.71 3f7j s ILE 157 Ca -0.17 -0.37 -0.29 0.00 0.00 0.00 0.00 60.65 59.82 3f7j s ILE 157 Cb 0.01 -2.69 -0.09 0.00 0.01 0.00 0.00 42.46 39.70 3f7j s ILE 157 CO 0.78 0.48 1.10 -0.75 0.00 0.00 0.00 174.94 176.54 3f7j s LYS 158 N 0.55 4.57 0.52 2.79 2.20 -1.26 -4.99 119.74 124.12 3f7j s LYS 158 Ca -0.03 1.78 -0.22 0.00 -0.36 0.00 0.00 55.97 57.15 3f7j s LYS 158 Cb -0.14 -3.11 -0.05 0.00 -1.51 0.00 0.00 37.83 33.02 3f7j s LYS 158 CO 0.03 0.15 1.28 -1.25 -0.36 0.00 0.00 175.35 175.20 3f7j s PRO 159 N -1.58 3.32 -0.07 4.03 0.04 -1.26 -4.92 135.00 134.55 3f7j s PRO 159 Ca 0.46 2.05 0.18 0.00 0.04 0.00 0.00 61.00 63.74 3f7j s PRO 159 Cb -0.31 -2.28 -0.23 0.00 0.04 0.00 0.00 34.50 31.72 3f7j s PRO 159 CO 0.40 -0.99 0.43 -1.33 0.04 0.00 0.00 177.00 175.55 3f7j n MET 160 N -0.90 0.66 -4.09 4.56 2.81 0.20 -4.66 117.12 115.70 3f7j n MET 160 Ca 0.10 0.04 -0.14 0.00 -1.81 0.00 0.00 57.70 55.89 3f7j n MET 160 Cb 0.46 -1.63 -0.14 0.00 -0.71 0.00 0.00 33.22 31.21 3f7j n MET 160 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3f7j s VAL 161 N -2.85 0.36 -0.24 2.03 1.01 -1.26 -0.90 120.40 118.57 3f7j s VAL 161 Ca -0.07 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.50 3f7j s VAL 161 Cb 0.09 -0.35 0.06 0.00 0.00 0.00 0.00 36.38 36.18 3f7j s VAL 161 CO 0.84 -0.04 -0.03 0.21 0.00 0.00 0.00 175.10 176.08 3f7j s ASN 162 N -0.49 3.77 -0.32 3.32 2.47 -0.21 -1.13 114.94 122.36 3f7j s ASN 162 Ca -0.02 -1.18 -0.17 0.00 0.42 0.00 0.00 52.86 51.91 3f7j s ASN 162 Cb -0.04 -1.11 -0.01 0.00 -1.45 0.00 0.00 41.25 38.64 3f7j s ASN 162 CO -0.00 -0.26 0.47 -1.58 -3.72 0.00 0.00 177.10 172.02 3f7j s GLN 163 N 1.45 3.74 0.07 0.43 0.74 -0.34 -1.49 119.66 124.26 3f7j s GLN 163 Ca -0.04 -0.09 0.03 0.00 0.05 0.00 0.00 55.36 55.31 3f7j s GLN 163 Cb -0.19 -3.76 -0.03 0.00 1.10 0.00 0.00 33.01 30.13 3f7j s GLN 163 CO -0.07 -0.53 -0.09 0.14 -0.55 0.00 0.00 175.29 174.19 3f7j s VAL 164 N 2.28 0.72 0.23 1.34 -7.23 0.92 -0.81 120.40 117.85 3f7j s VAL 164 Ca 0.18 -1.39 -0.32 0.00 -1.81 0.00 0.00 61.98 58.63 3f7j s VAL 164 Cb -0.16 -1.03 -0.12 0.00 0.56 0.00 0.00 36.38 35.63 3f7j s VAL 164 CO 0.12 -0.50 1.66 1.21 -0.31 0.00 0.00 175.10 177.28 3f7j n GLU 165 N 0.95 2.66 -3.66 4.82 2.13 -1.26 -0.23 120.64 126.05 3f7j n GLU 165 Ca -0.19 0.95 -0.07 0.00 0.66 0.00 0.00 57.16 58.51 3f7j n GLU 165 Cb 0.56 -2.77 -0.08 0.00 0.27 0.00 0.00 31.44 29.42 3f7j n GLU 165 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 3f7j s PHE 166 N 0.79 -0.93 0.03 4.31 2.19 -1.08 -4.84 117.98 118.46 3f7j s PHE 166 Ca 0.72 1.82 -0.29 0.00 0.33 0.00 0.00 56.93 59.52 3f7j s PHE 166 Cb -0.53 0.50 0.10 0.00 -1.31 0.00 0.00 43.02 41.79 3f7j s PHE 166 CO 0.38 -0.49 1.16 -3.38 1.83 0.00 0.00 175.22 174.72 3f7j s HIS 167 N 1.91 -0.08 0.66 10.12 -3.43 -1.06 -4.16 115.29 119.24 3f7j s HIS 167 Ca -0.08 -0.09 0.31 0.00 -0.80 0.00 0.00 55.06 54.40 3f7j s HIS 167 Cb -0.08 0.58 1.66 0.00 -1.43 0.00 0.00 32.58 33.31 3f7j s HIS 167 CO -0.17 -0.47 1.95 -1.35 -2.00 0.00 0.00 174.74 172.70 3f7j h PRO 168 N 2.00 0.00 -0.01 -0.38 0.11 -1.88 -1.25 132.00 130.59 3f7j h PRO 168 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3f7j h PRO 168 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3f7j h PRO 168 CO 0.27 0.00 -0.23 0.54 -0.21 0.00 0.00 178.00 178.37 3f7j n ARG 169 N -2.98 1.06 -3.16 1.05 5.12 -1.26 -1.57 116.66 114.92 3f7j n ARG 169 Ca -0.01 -0.67 -0.19 0.00 -1.93 0.00 0.00 57.85 55.05 3f7j n ARG 169 Cb 0.38 -1.49 -0.06 0.00 -1.16 0.00 0.00 32.46 30.14 3f7j n ARG 169 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 3f7j n LEU 170 N -0.38 -1.54 -0.26 0.55 0.00 -0.47 -1.08 117.00 113.81 3f7j n LEU 170 Ca 0.13 -3.86 0.14 0.00 0.00 0.00 0.00 56.01 52.42 3f7j n LEU 170 Cb 0.37 0.63 0.55 0.00 0.00 0.00 0.00 43.42 44.96 3f7j n LEU 170 CO 0.24 1.89 0.83 0.35 0.00 0.00 0.00 177.39 180.70 3f7j n THR 171 N 2.85 0.00 -4.04 1.96 -2.24 -1.23 -2.56 114.28 109.02 3f7j n THR 171 Ca 0.26 -0.14 -0.33 0.00 -2.27 0.00 0.00 64.05 61.57 3f7j n THR 171 Cb 0.51 0.20 -0.01 0.00 -2.10 0.00 0.00 70.33 68.93 3f7j n THR 171 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3f7j n GLN 172 N -0.51 -3.74 0.09 -0.78 1.13 -1.26 -4.86 117.38 107.45 3f7j n GLN 172 Ca 0.16 0.43 -0.12 0.00 -1.94 0.00 0.00 57.00 55.53 3f7j n GLN 172 Cb 0.31 -5.21 -0.07 0.00 0.11 0.00 0.00 30.24 25.38 3f7j n GLN 172 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 3f7j h LYS 173 N -1.56 -0.55 -0.63 -1.09 1.57 -1.99 0.14 116.57 112.46 3f7j h LYS 173 Ca -0.56 0.04 0.09 0.00 -1.87 0.00 0.00 60.65 58.34 3f7j h LYS 173 Cb 1.37 0.12 -0.07 0.00 0.08 0.00 0.00 32.23 33.73 3f7j h LYS 173 CO 0.72 -0.37 0.25 0.93 -0.57 0.00 0.00 179.45 180.42 3f7j h GLU 174 N -0.57 0.44 -0.65 3.15 5.08 -1.99 -0.95 114.58 119.08 3f7j h GLU 174 Ca -0.01 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.25 3f7j h GLU 174 Cb 0.57 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 3f7j h GLU 174 CO -0.20 0.29 0.09 1.25 -1.00 0.00 0.00 179.01 179.44 3f7j h LEU 175 N 0.45 1.04 -0.28 1.33 5.85 -1.91 -1.15 115.31 120.64 3f7j h LEU 175 Ca 0.31 -0.25 0.03 0.00 0.84 0.00 0.00 57.88 58.81 3f7j h LEU 175 Cb 0.37 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 3f7j h LEU 175 CO -0.29 1.04 0.10 0.03 -0.34 0.00 0.00 178.44 178.97 3f7j h ARG 176 N 1.01 0.22 -0.73 1.25 3.08 0.32 -1.04 114.38 118.50 3f7j h ARG 176 Ca 0.20 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 3f7j h ARG 176 Cb 0.45 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 3f7j h ARG 176 CO 0.01 0.15 0.42 -0.44 -1.07 0.00 0.00 179.97 179.04 3f7j h ASP 177 N 0.23 0.90 0.01 7.04 3.32 -1.11 -0.87 116.42 125.94 3f7j h ASP 177 Ca 0.12 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 3f7j h ASP 177 Cb 0.08 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.41 3f7j h ASP 177 CO -0.12 0.72 -0.01 0.22 -1.72 0.00 0.00 179.24 178.33 3f7j h TYR 178 N 1.01 -0.02 -0.48 4.55 3.20 -1.05 -2.47 116.97 121.71 3f7j h TYR 178 Ca 0.26 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.15 3f7j h TYR 178 Cb 0.01 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.25 3f7j h TYR 178 CO -0.01 0.44 0.29 0.00 -1.64 0.00 0.00 178.16 177.24 3f7j h LYS 180 N 0.57 0.14 -0.19 0.00 1.63 -1.19 -0.73 116.57 116.81 3f7j h LYS 180 Ca 0.19 -0.01 0.06 0.00 -0.85 0.00 0.00 60.65 60.04 3f7j h LYS 180 Cb 0.01 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.60 3f7j h LYS 180 CO -0.09 0.09 0.20 0.78 -3.45 0.00 0.00 179.45 176.99 3f7j h GLY 181 N 0.15 0.00 -0.20 5.01 0.00 -0.96 -2.63 103.07 104.43 3f7j h GLY 181 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 3f7j h GLY 181 CO -0.26 0.00 -0.78 -1.06 0.00 0.00 0.00 176.54 174.44 3f7j n GLN 182 N -3.89 0.39 -1.41 4.80 1.13 -0.72 -4.97 117.38 112.70 3f7j n GLN 182 Ca 0.02 -0.31 -0.05 0.00 -1.94 0.00 0.00 57.00 54.71 3f7j n GLN 182 Cb 0.32 -1.49 -0.02 0.00 0.11 0.00 0.00 30.24 29.16 3f7j n GLN 182 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3f7j n GLY 183 N 1.47 0.60 3.59 1.08 0.00 -0.66 -5.02 105.19 106.25 3f7j n GLY 183 Ca 0.06 -0.79 -0.37 0.00 0.00 0.00 0.00 46.02 44.91 3f7j n GLY 183 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f7j s ILE 184 N -2.21 5.18 -0.18 -0.61 1.01 -0.37 -4.46 121.20 119.57 3f7j s ILE 184 Ca 0.00 0.12 -0.29 0.00 0.00 0.00 0.00 60.65 60.48 3f7j s ILE 184 Cb 0.00 -3.45 -0.00 0.00 0.01 0.00 0.00 42.46 39.02 3f7j s ILE 184 CO 0.00 0.29 1.10 -1.58 0.00 0.00 0.00 174.94 174.75 3f7j s GLN 185 N 1.55 4.29 0.35 2.79 2.00 -0.07 -4.14 119.66 126.43 3f7j s GLN 185 Ca 0.07 1.46 -0.26 0.00 -2.00 0.00 0.00 55.36 54.63 3f7j s GLN 185 Cb -0.15 -3.65 -0.09 0.00 0.80 0.00 0.00 33.01 29.92 3f7j s GLN 185 CO 0.08 -0.58 1.04 -1.17 -0.50 0.00 0.00 175.29 174.16 3f7j s LEU 186 N 3.00 4.28 -0.01 3.68 2.96 -1.26 -1.04 118.68 130.29 3f7j s LEU 186 Ca 0.48 2.05 0.02 0.00 -0.22 0.00 0.00 54.13 56.46 3f7j s LEU 186 Cb -0.18 -4.01 -0.00 0.00 0.50 0.00 0.00 46.19 42.50 3f7j s LEU 186 CO 0.11 -0.32 -0.06 -0.70 -1.32 0.00 0.00 176.35 174.06 3f7j s GLU 187 N -2.14 0.56 -0.44 1.98 2.12 -0.55 -2.34 118.70 117.88 3f7j s GLU 187 Ca 0.53 -0.21 -0.21 0.00 0.36 0.00 0.00 54.97 55.44 3f7j s GLU 187 Cb -0.24 -0.55 0.02 0.00 0.26 0.00 0.00 34.13 33.63 3f7j s GLU 187 CO 0.30 0.11 0.67 0.00 -0.54 0.00 0.00 175.26 175.79 3f7j s ALA 188 N 0.00 3.34 0.28 6.30 0.00 0.35 -0.05 121.76 131.98 3f7j s ALA 188 Ca 0.00 -1.19 -0.27 0.00 0.00 0.00 0.00 51.96 50.50 3f7j s ALA 188 Cb -0.04 -3.33 -0.09 0.00 0.00 0.00 0.00 23.12 19.65 3f7j s ALA 188 CO -0.00 -1.82 0.92 -0.46 0.00 0.00 0.00 175.76 174.40 3f7j s TRP 189 N 2.89 3.82 -1.35 0.00 -0.00 0.69 -3.28 118.94 121.71 3f7j s TRP 189 Ca 0.24 1.81 -0.12 0.00 -0.00 0.00 0.00 56.10 58.03 3f7j s TRP 189 Cb -0.14 -2.92 0.01 0.00 -0.00 0.00 0.00 33.47 30.42 3f7j s TRP 189 CO 0.19 0.33 0.44 0.43 -0.00 0.00 0.00 176.95 178.34 3f7j n SER 190 N 0.99 -1.77 0.31 5.86 7.64 -1.26 -2.65 113.62 122.74 3f7j n SER 190 Ca -0.00 -1.15 0.20 0.00 1.01 0.00 0.00 58.87 58.92 3f7j n SER 190 Cb 0.49 -2.40 0.95 0.00 -1.01 0.00 0.00 64.21 62.25 3f7j n SER 190 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3f7j h PRO 191 N -2.03 0.00 -0.44 1.43 0.13 -1.74 -0.46 132.00 128.89 3f7j h PRO 191 Ca -0.67 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 3f7j h PRO 191 Cb 1.39 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.52 3f7j h PRO 191 CO 0.60 0.01 0.00 1.28 -0.23 0.00 0.00 178.00 179.65 3f7j n LEU 192 N -3.12 2.90 -2.87 1.56 4.77 -1.26 -4.66 117.00 114.32 3f7j n LEU 192 Ca -0.01 -1.35 -0.21 0.00 -0.03 0.00 0.00 56.01 54.40 3f7j n LEU 192 Cb 0.19 -0.29 0.02 0.00 -2.33 0.00 0.00 43.42 41.01 3f7j n LEU 192 CO 0.24 0.68 -0.08 0.80 -1.33 0.00 0.00 177.39 177.69 3f7j n MET 193 N 1.10 -3.76 -4.05 3.23 0.00 -0.18 -1.81 117.12 111.65 3f7j n MET 193 Ca 0.19 0.86 -0.31 0.00 -0.00 0.00 0.00 57.70 58.43 3f7j n MET 193 Cb 0.49 -5.64 -0.01 0.00 0.00 0.00 0.00 33.22 28.06 3f7j n MET 193 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 3f7j n GLN 194 N -3.66 -3.97 -0.69 2.12 6.02 -1.26 -1.94 117.38 113.99 3f7j n GLN 194 Ca -0.14 0.46 0.00 0.00 -0.01 0.00 0.00 57.00 57.31 3f7j n GLN 194 Cb 0.63 -5.09 0.00 0.00 1.02 0.00 0.00 30.24 26.79 3f7j n GLN 194 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3f7j n GLY 195 N -1.62 1.11 0.00 1.08 0.00 -0.75 -4.91 105.19 100.10 3f7j n GLY 195 Ca -0.04 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.08 3f7j n GLY 195 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3f7j n GLN 196 N -2.00 0.22 -0.16 1.61 6.02 -0.82 -2.42 117.38 119.84 3f7j n GLN 196 Ca 0.00 0.11 0.06 0.00 -0.01 0.00 0.00 57.00 57.17 3f7j n GLN 196 Cb 0.00 -1.50 0.15 0.00 1.02 0.00 0.00 30.24 29.91 3f7j n GLN 196 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3f7j n LEU 197 N -1.33 2.85 -0.17 1.08 4.77 -1.26 -4.74 117.00 118.19 3f7j n LEU 197 Ca 0.08 -1.79 0.14 0.00 -0.03 0.00 0.00 56.01 54.41 3f7j n LEU 197 Cb 0.17 -0.21 0.47 0.00 -2.33 0.00 0.00 43.42 41.52 3f7j n LEU 197 CO 0.16 0.68 1.21 0.25 -1.33 0.00 0.00 177.39 178.36 3f7j h LEU 198 N 2.34 0.45 -2.77 2.23 5.85 -1.82 -0.98 115.31 120.61 3f7j h LEU 198 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3f7j h LEU 198 Cb 0.71 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.68 3f7j h LEU 198 CO 0.00 0.24 0.00 0.47 -0.34 0.00 0.00 178.44 178.81 3f7j n ASP 199 N -4.49 3.18 -4.71 1.25 8.00 -1.26 -4.86 116.55 113.66 3f7j n ASP 199 Ca 0.14 -1.98 -0.43 0.00 0.71 0.00 0.00 54.79 53.23 3f7j n ASP 199 Cb 0.48 -0.29 -0.03 0.00 -0.02 0.00 0.00 41.12 41.26 3f7j n ASP 199 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3f7j n ASN 200 N 0.86 3.71 -0.21 -2.24 2.85 -0.38 -4.89 115.26 114.96 3f7j n ASN 200 Ca 0.15 1.08 -0.07 0.00 -0.11 0.00 0.00 54.58 55.63 3f7j n ASN 200 Cb 0.48 -1.53 0.03 0.00 1.24 0.00 0.00 39.78 40.00 3f7j n ASN 200 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 3f7j h GLU 201 N 6.29 0.84 -0.15 1.20 5.08 -1.96 -0.46 114.58 125.42 3f7j h GLU 201 Ca -0.44 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 57.81 3f7j h GLU 201 Cb 1.22 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 3f7j h GLU 201 CO 0.92 0.64 0.03 0.28 -1.00 0.00 0.00 179.01 179.88 3f7j h VAL 202 N 0.81 1.20 -0.61 3.13 2.07 -1.98 -2.34 116.25 118.53 3f7j h VAL 202 Ca 0.21 -0.65 -0.09 0.00 0.82 0.00 0.00 66.70 66.99 3f7j h VAL 202 Cb 0.05 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 3f7j h VAL 202 CO -0.03 0.19 0.04 -0.07 0.02 0.00 0.00 177.57 177.72 3f7j h LEU 203 N 0.03 1.03 -0.81 2.57 3.38 -1.92 -2.85 115.31 116.75 3f7j h LEU 203 Ca 0.05 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.74 3f7j h LEU 203 Cb 0.27 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 3f7j h LEU 203 CO 0.00 1.07 0.54 0.74 0.09 0.00 0.00 178.44 180.88 3f7j h THR 204 N 0.96 1.20 -0.60 0.22 2.02 -1.01 0.82 112.91 116.52 3f7j h THR 204 Ca 0.18 -0.37 -0.06 0.00 0.77 0.00 0.00 66.41 66.93 3f7j h THR 204 Cb 0.52 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 3f7j h THR 204 CO 0.02 0.20 0.16 1.56 0.37 0.00 0.00 175.52 177.83 3f7j h GLN 205 N 1.09 0.96 -0.16 6.66 1.08 -1.37 0.57 115.11 123.94 3f7j h GLN 205 Ca 0.30 -0.22 -0.01 0.00 -1.45 0.00 0.00 58.65 57.27 3f7j h GLN 205 Cb -0.11 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.18 3f7j h GLN 205 CO -0.07 0.87 0.07 0.82 -0.95 0.00 0.00 178.83 179.57 3f7j h ILE 206 N 0.87 1.15 -0.07 2.54 2.04 -1.26 -2.09 117.51 120.70 3f7j h ILE 206 Ca 0.19 -0.45 0.03 0.00 1.00 0.00 0.00 64.86 65.63 3f7j h ILE 206 Cb 0.34 1.15 -0.04 0.00 -0.74 0.00 0.00 36.82 37.53 3f7j h ILE 206 CO 0.00 0.14 -0.17 0.00 0.00 0.00 0.00 178.15 178.13 3f7j h ALA 207 N 0.91 -0.15 -0.42 1.87 0.00 -0.57 -2.29 119.26 118.62 3f7j h ALA 207 Ca 0.05 0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.08 3f7j h ALA 207 Cb 0.16 0.31 -0.09 0.00 0.00 0.00 0.00 17.79 18.17 3f7j h ALA 207 CO -0.00 -0.64 -0.31 0.93 0.00 0.00 0.00 179.25 179.23 3f7j h GLU 208 N -0.24 -0.21 -0.43 0.00 5.08 -0.86 1.00 114.58 118.92 3f7j h GLU 208 Ca 0.07 0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.53 3f7j h GLU 208 Cb 0.34 0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.56 3f7j h GLU 208 CO -0.21 -0.14 -0.10 -0.22 -1.00 0.00 0.00 179.01 177.34 3f7j h LYS 209 N -0.22 0.01 -0.00 2.33 3.64 -0.99 -1.66 116.57 119.67 3f7j h LYS 209 Ca 0.19 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3f7j h LYS 209 Cb 0.53 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 3f7j h LYS 209 CO -0.55 0.01 -0.01 0.72 -2.27 0.00 0.00 179.45 177.35 3f7j n HIS 210 N -5.31 0.00 -3.67 1.91 8.25 -0.90 -4.93 115.22 110.57 3f7j n HIS 210 Ca 0.03 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.25 3f7j n HIS 210 Cb 0.23 -0.07 0.06 0.00 1.12 0.00 0.00 29.99 31.33 3f7j n HIS 210 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3f7j n ASN 211 N -0.95 -4.20 -4.41 0.41 5.03 0.17 -5.00 115.26 106.31 3f7j n ASN 211 Ca 0.21 -0.67 -0.22 0.00 0.87 0.00 0.00 54.58 54.78 3f7j n ASN 211 Cb 0.17 -4.59 -0.10 0.00 -1.02 0.00 0.00 39.78 34.24 3f7j n ASN 211 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 3f7j s LYS 212 N -6.14 1.66 0.69 3.52 -0.14 -0.17 -5.03 119.74 114.13 3f7j s LYS 212 Ca 0.39 -1.93 -0.08 0.00 -1.36 0.00 0.00 55.97 52.98 3f7j s LYS 212 Cb -0.18 -0.78 0.04 0.00 -1.68 0.00 0.00 37.83 35.23 3f7j s LYS 212 CO 0.77 -0.23 1.03 -1.54 -0.76 0.00 0.00 175.35 174.62 3f7j s SER 213 N -3.49 5.11 0.23 2.83 1.04 -1.26 -4.31 113.70 113.86 3f7j s SER 213 Ca 0.35 0.74 -0.06 0.00 0.48 0.00 0.00 55.95 57.46 3f7j s SER 213 Cb 0.08 -1.48 0.21 0.00 0.10 0.00 0.00 66.02 64.93 3f7j s SER 213 CO 0.15 -1.45 1.79 0.58 0.98 0.00 0.00 173.24 175.29 3f7j h VAL 214 N -0.58 1.25 -0.65 5.02 2.07 -1.89 -1.53 116.25 119.94 3f7j h VAL 214 Ca -0.45 -0.83 0.01 0.00 0.82 0.00 0.00 66.70 66.25 3f7j h VAL 214 Cb 1.29 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 3f7j h VAL 214 CO 0.62 0.33 0.43 0.00 0.02 0.00 0.00 177.57 178.97 3f7j h ALA 215 N 1.21 0.82 -0.33 1.67 0.00 -1.94 -1.44 119.26 119.25 3f7j h ALA 215 Ca 0.25 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.12 3f7j h ALA 215 Cb 0.24 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3f7j h ALA 215 CO -0.02 0.26 0.21 1.96 0.00 0.00 0.00 179.25 181.66 3f7j h GLN 216 N 0.88 0.41 0.05 0.00 4.20 -1.77 -1.02 115.11 117.85 3f7j h GLN 216 Ca 0.24 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.95 3f7j h GLN 216 Cb -0.10 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.56 3f7j h GLN 216 CO -0.05 0.27 -0.21 0.28 -0.67 0.00 0.00 178.83 178.45 3f7j h VAL 217 N 0.42 0.51 -0.58 -0.54 2.07 -0.91 -0.57 116.25 116.65 3f7j h VAL 217 Ca 0.13 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.73 3f7j h VAL 217 Cb -0.02 0.51 -0.07 0.00 -1.52 0.00 0.00 31.29 30.18 3f7j h VAL 217 CO -0.04 0.00 0.21 0.40 0.02 0.00 0.00 177.57 178.16 3f7j h ILE 218 N -0.37 0.79 -0.24 4.57 2.04 -1.02 0.05 117.51 123.33 3f7j h ILE 218 Ca 0.05 -0.14 -0.16 0.00 1.00 0.00 0.00 64.86 65.61 3f7j h ILE 218 Cb 0.42 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 36.85 3f7j h ILE 218 CO -0.16 0.07 -0.52 -0.07 0.00 0.00 0.00 178.15 177.47 3f7j h LEU 219 N 0.40 0.74 -0.95 1.44 3.38 -1.05 -0.31 115.31 118.96 3f7j h LEU 219 Ca 0.29 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3f7j h LEU 219 Cb 0.34 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 3f7j h LEU 219 CO -0.29 1.12 0.52 -0.09 0.09 0.00 0.00 178.44 179.79 3f7j h ARG 220 N 0.52 1.26 -0.47 1.13 9.65 -0.84 -2.33 114.38 123.31 3f7j h ARG 220 Ca 0.02 -0.13 0.01 0.00 -1.10 0.00 0.00 59.98 58.78 3f7j h ARG 220 Cb 1.08 -0.25 -0.03 0.00 -1.39 0.00 0.00 29.97 29.37 3f7j h ARG 220 CO 0.10 0.90 0.29 2.35 2.80 0.00 0.00 179.97 186.42 3f7j h TRP 221 N 1.27 0.55 -0.40 2.20 7.01 -0.26 -0.82 115.95 125.49 3f7j h TRP 221 Ca 0.32 0.02 0.08 0.00 2.11 0.00 0.00 58.89 61.42 3f7j h TRP 221 Cb -0.01 -0.18 -0.09 0.00 -2.10 0.00 0.00 29.16 26.78 3f7j h TRP 221 CO 0.01 0.33 -0.28 -0.44 -2.79 0.00 0.00 178.44 175.26 3f7j h ASP 222 N 0.59 -0.95 -0.42 2.65 3.32 -0.92 -1.51 116.42 119.18 3f7j h ASP 222 Ca 0.18 0.18 -0.07 0.00 0.02 0.00 0.00 57.03 57.34 3f7j h ASP 222 Cb -0.02 0.46 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 3f7j h ASP 222 CO -0.06 -0.29 0.04 -0.07 -1.72 0.00 0.00 179.24 177.13 3f7j h LEU 223 N -0.21 0.75 -0.42 1.55 3.38 -0.89 -1.41 115.31 118.06 3f7j h LEU 223 Ca 0.18 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3f7j h LEU 223 Cb 0.51 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 3f7j h LEU 223 CO -0.53 0.80 -0.04 1.56 0.09 0.00 0.00 178.44 180.32 3f7j h GLN 224 N 0.75 0.00 -0.00 1.13 4.20 -0.99 0.01 115.11 120.21 3f7j h GLN 224 Ca 0.15 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.86 3f7j h GLN 224 Cb 0.40 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 3f7j h GLN 224 CO 0.01 0.04 -0.02 0.72 -0.67 0.00 0.00 178.83 178.91 3f7j n HIS 225 N -3.12 0.00 -2.56 2.96 8.25 -0.58 -4.95 115.22 115.21 3f7j n HIS 225 Ca 0.03 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.38 3f7j n HIS 225 Cb 0.48 -0.06 0.01 0.00 1.12 0.00 0.00 29.99 31.54 3f7j n HIS 225 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3f7j n GLY 226 N 1.11 0.07 3.37 -1.41 0.00 -0.01 -5.01 105.19 103.31 3f7j n GLY 226 Ca 0.20 -0.35 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 3f7j n GLY 226 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f7j s VAL 227 N -2.80 3.57 0.45 1.61 1.01 -0.60 -4.74 120.40 118.91 3f7j s VAL 227 Ca 0.13 -0.44 -0.24 0.00 0.00 0.00 0.00 61.98 61.42 3f7j s VAL 227 Cb -0.06 -2.61 -0.07 0.00 0.00 0.00 0.00 36.38 33.64 3f7j s VAL 227 CO 0.16 0.43 1.29 -0.69 0.00 0.00 0.00 175.10 176.29 3f7j s VAL 228 N 1.19 2.59 -0.00 2.92 1.01 -0.99 -4.13 120.40 122.99 3f7j s VAL 228 Ca 0.02 0.49 0.01 0.00 0.00 0.00 0.00 61.98 62.50 3f7j s VAL 228 Cb -0.14 -3.27 -0.00 0.00 0.00 0.00 0.00 36.38 32.96 3f7j s VAL 228 CO -0.00 0.04 -0.03 0.28 0.00 0.00 0.00 175.10 175.39 3f7j s THR 229 N -1.34 0.24 -0.45 3.92 -1.32 0.04 -0.49 115.64 116.24 3f7j s THR 229 Ca 0.62 -0.12 0.07 0.00 -1.21 0.00 0.00 61.69 61.05 3f7j s THR 229 Cb -0.36 -0.22 0.23 0.00 -1.51 0.00 0.00 72.50 70.64 3f7j s THR 229 CO 0.45 0.08 0.53 2.30 -2.21 0.00 0.00 174.62 175.77 3f7j n ILE 230 N 3.08 -0.16 -2.00 5.08 -5.35 -1.21 -0.55 119.36 118.27 3f7j n ILE 230 Ca -0.14 -4.16 -0.39 0.00 -0.27 0.00 0.00 62.75 57.79 3f7j n ILE 230 Cb 0.58 -1.94 0.00 0.00 -1.74 0.00 0.00 39.64 36.54 3f7j n ILE 230 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 3f7j s PRO 231 N -1.20 3.88 -0.03 6.28 0.04 -1.21 -3.09 135.00 139.67 3f7j s PRO 231 Ca 0.35 2.20 -0.24 0.00 0.04 0.00 0.00 61.00 63.35 3f7j s PRO 231 Cb 0.13 -2.71 -0.04 0.00 0.04 0.00 0.00 34.50 31.92 3f7j s PRO 231 CO -0.11 -0.58 0.73 0.21 0.04 0.00 0.00 177.00 177.29 3f7j s LYS 232 N -2.32 4.45 -0.17 4.56 2.20 -1.26 -1.98 119.74 125.22 3f7j s LYS 232 Ca 0.58 0.96 -0.16 0.00 -0.36 0.00 0.00 55.97 56.99 3f7j s LYS 232 Cb -0.39 -3.42 0.05 0.00 -1.51 0.00 0.00 37.83 32.56 3f7j s LYS 232 CO 0.50 0.14 0.46 -1.12 -0.36 0.00 0.00 175.35 174.97 3f7j s SER 233 N 0.51 -0.48 -0.25 1.43 0.01 -1.26 -4.99 113.70 108.66 3f7j s SER 233 Ca 0.38 0.92 -0.08 0.00 1.31 0.00 0.00 55.95 58.49 3f7j s SER 233 Cb -0.19 0.94 -0.16 0.00 0.21 0.00 0.00 66.02 66.82 3f7j s SER 233 CO 0.20 -0.17 -0.20 2.30 0.41 0.00 0.00 173.24 175.79 3f7j n ILE 234 N 2.79 1.54 -2.88 1.44 -5.35 -1.26 -4.81 119.36 110.83 3f7j n ILE 234 Ca -0.13 -0.45 -0.40 0.00 -0.27 0.00 0.00 62.75 61.50 3f7j n ILE 234 Cb 0.57 -1.70 -0.06 0.00 -1.74 0.00 0.00 39.64 36.71 3f7j n ILE 234 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 3f7j s LYS 235 N -2.51 4.67 0.41 6.28 1.02 -1.26 -4.53 119.74 123.82 3f7j s LYS 235 Ca -0.35 1.29 0.14 0.00 0.02 0.00 0.00 55.97 57.07 3f7j s LYS 235 Cb 0.11 -3.29 1.00 0.00 -0.52 0.00 0.00 37.83 35.13 3f7j s LYS 235 CO 0.57 0.50 1.90 1.49 -0.92 0.00 0.00 175.35 178.89 3f7j h GLU 236 N 4.48 0.47 -0.12 1.68 4.81 -1.94 -0.87 114.58 123.08 3f7j h GLU 236 Ca -0.46 -0.03 -0.13 0.00 -0.13 0.00 0.00 59.36 58.62 3f7j h GLU 236 Cb 1.20 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.47 3f7j h GLU 236 CO 0.68 0.31 -0.48 1.12 -0.73 0.00 0.00 179.01 179.91 3f7j h HIS 237 N 0.48 0.38 0.23 0.92 2.07 -1.99 -1.21 115.15 116.03 3f7j h HIS 237 Ca 0.40 -0.12 -0.32 0.00 -2.85 0.00 0.00 60.37 57.48 3f7j h HIS 237 Cb 0.86 -0.08 0.03 0.00 2.57 0.00 0.00 27.41 30.79 3f7j h HIS 237 CO -0.00 0.74 -1.45 -0.09 -3.07 0.00 0.00 177.93 174.06 3f7j h ARG 238 N 0.25 0.49 -0.65 5.12 9.65 -1.74 -1.59 114.38 125.91 3f7j h ARG 238 Ca 0.01 -0.83 0.14 0.00 -1.10 0.00 0.00 59.98 58.20 3f7j h ARG 238 Cb 0.94 0.31 -0.10 0.00 -1.39 0.00 0.00 29.97 29.73 3f7j h ARG 238 CO 0.08 1.40 0.08 0.82 2.80 0.00 0.00 179.97 185.15 3f7j h ILE 239 N 0.06 0.53 -0.02 1.20 2.04 -1.00 0.36 117.51 120.69 3f7j h ILE 239 Ca -0.26 -0.07 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 3f7j h ILE 239 Cb 2.09 0.32 -0.00 0.00 -0.74 0.00 0.00 36.82 38.48 3f7j h ILE 239 CO 0.24 0.04 0.01 0.40 0.00 0.00 0.00 178.15 178.83 3f7j h ILE 240 N 0.20 1.17 -0.50 -0.67 2.04 -1.23 -3.20 117.51 115.32 3f7j h ILE 240 Ca 0.35 -0.52 0.01 0.00 1.00 0.00 0.00 64.86 65.70 3f7j h ILE 240 Cb 0.57 1.49 -0.03 0.00 -0.74 0.00 0.00 36.82 38.12 3f7j h ILE 240 CO -0.50 0.14 0.33 -0.08 0.00 0.00 0.00 178.15 178.04 3f7j h GLU 241 N -0.18 0.65 -0.21 2.37 4.81 -1.05 -2.56 114.58 118.41 3f7j h GLU 241 Ca 0.01 -0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.25 3f7j h GLU 241 Cb 0.22 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 3f7j h GLU 241 CO -0.00 0.43 0.15 -0.91 -0.73 0.00 0.00 179.01 177.95 3f7j h ASN 242 N 0.67 0.04 0.26 1.04 2.35 -0.98 -1.38 115.58 117.58 3f7j h ASN 242 Ca 0.19 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 3f7j h ASN 242 Cb -0.07 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.29 3f7j h ASN 242 CO -0.05 0.03 -0.25 0.00 -1.65 0.00 0.00 177.43 175.51 3f7j n ALA 243 N -2.57 3.06 -2.46 -0.83 0.00 -0.98 -4.52 120.51 112.22 3f7j n ALA 243 Ca 0.02 -0.39 -0.42 0.00 0.00 0.00 0.00 53.44 52.65 3f7j n ALA 243 Cb 0.26 -1.15 0.01 0.00 0.00 0.00 0.00 19.45 18.56 3f7j n ALA 243 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3f7j n ASP 244 N -0.71 5.65 -0.17 0.00 2.03 -0.52 -4.46 116.55 118.37 3f7j n ASP 244 Ca 0.12 -3.19 0.04 0.00 0.52 0.00 0.00 54.79 52.27 3f7j n ASP 244 Cb 0.34 -1.42 0.05 0.00 -0.72 0.00 0.00 41.12 39.38 3f7j n ASP 244 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 3f7j n ILE 245 N 2.69 0.89 -0.32 5.18 -5.35 -1.26 -4.79 119.36 116.40 3f7j n ILE 245 Ca 0.38 -1.03 0.09 0.00 -0.27 0.00 0.00 62.75 61.92 3f7j n ILE 245 Cb 0.34 0.30 0.24 0.00 -1.74 0.00 0.00 39.64 38.79 3f7j n ILE 245 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3f7j n PHE 246 N -0.63 0.76 -1.24 4.28 3.01 -1.26 -4.28 117.46 118.11 3f7j n PHE 246 Ca 0.06 -0.52 0.06 0.00 1.01 0.00 0.00 57.45 58.06 3f7j n PHE 246 Cb 0.56 -0.04 0.09 0.00 -0.01 0.00 0.00 39.48 40.08 3f7j n PHE 246 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 3f7j n ASP 247 N 0.99 1.64 -3.85 4.37 5.75 -1.26 -4.92 116.55 119.27 3f7j n ASP 247 Ca 0.18 -2.67 -0.09 0.00 -0.01 0.00 0.00 54.79 52.20 3f7j n ASP 247 Cb 0.56 -0.33 -0.05 0.00 -1.03 0.00 0.00 41.12 40.27 3f7j n ASP 247 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 3f7j s PHE 248 N -1.91 0.12 0.02 2.11 -0.12 -1.26 -5.18 117.98 111.77 3f7j s PHE 248 Ca 0.20 -0.48 0.00 0.00 -0.05 0.00 0.00 56.93 56.61 3f7j s PHE 248 Cb 0.18 0.22 -0.02 0.00 -0.63 0.00 0.00 43.02 42.77 3f7j s PHE 248 CO 0.02 -0.86 -0.03 -1.83 -0.05 0.00 0.00 175.22 172.46 3f7j s GLU 249 N -3.93 0.32 -0.00 1.99 -1.05 -1.26 -5.05 118.70 109.72 3f7j s GLU 249 Ca 0.14 -0.57 -0.24 0.00 -0.15 0.00 0.00 54.97 54.14 3f7j s GLU 249 Cb 0.00 0.03 -0.05 0.00 -0.44 0.00 0.00 34.13 33.68 3f7j s GLU 249 CO -0.00 -0.03 0.72 -0.51 0.95 0.00 0.00 175.26 176.39 3f7j s LEU 250 N -1.33 4.39 1.08 1.83 1.43 -1.26 -5.09 118.68 119.73 3f7j s LEU 250 Ca -0.13 1.32 -0.13 0.00 -1.03 0.00 0.00 54.13 54.15 3f7j s LEU 250 Cb -0.09 -3.14 0.23 0.00 0.03 0.00 0.00 46.19 43.22 3f7j s LEU 250 CO -0.01 -0.03 1.07 -0.94 0.23 0.00 0.00 176.35 176.68 3f7j s SER 251 N 0.27 1.89 0.20 2.29 1.04 -1.26 -4.82 113.70 113.31 3f7j s SER 251 Ca 0.37 1.21 -0.11 0.00 0.48 0.00 0.00 55.95 57.91 3f7j s SER 251 Cb -0.19 -1.89 0.21 0.00 0.10 0.00 0.00 66.02 64.25 3f7j s SER 251 CO 0.20 -3.59 1.79 -0.61 0.98 0.00 0.00 173.24 172.01 3f7j h GLN 252 N -2.21 0.56 -0.14 4.02 5.75 -1.99 -1.31 115.11 119.79 3f7j h GLN 252 Ca -0.57 -0.03 0.05 0.00 -0.15 0.00 0.00 58.65 57.95 3f7j h GLN 252 Cb 1.33 -0.13 -0.06 0.00 1.07 0.00 0.00 27.48 29.70 3f7j h GLN 252 CO 0.54 0.37 -0.22 0.93 -2.65 0.00 0.00 178.83 177.81 3f7j h GLU 253 N 0.58 -0.26 -0.80 1.69 5.08 -1.99 -0.38 114.58 118.50 3f7j h GLU 253 Ca 0.27 0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.77 3f7j h GLU 253 Cb 0.19 0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.42 3f7j h GLU 253 CO -0.19 -0.17 0.42 -0.44 -1.00 0.00 0.00 179.01 177.63 3f7j h ASP 254 N -0.27 0.54 -0.36 1.42 3.45 -1.83 -0.95 116.42 118.42 3f7j h ASP 254 Ca 0.10 0.07 -0.06 0.00 0.43 0.00 0.00 57.03 57.57 3f7j h ASP 254 Cb 0.42 -0.02 -0.01 0.00 -0.56 0.00 0.00 39.33 39.16 3f7j h ASP 254 CO -0.30 0.27 -0.02 0.24 -1.57 0.00 0.00 179.24 177.87 3f7j h MET 255 N 0.66 0.64 -0.47 3.56 2.86 -0.66 -1.57 114.93 119.95 3f7j h MET 255 Ca 0.41 -0.22 -0.10 0.00 -2.06 0.00 0.00 59.70 57.73 3f7j h MET 255 Cb 0.49 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.08 3f7j h MET 255 CO -0.31 0.77 -0.11 -0.44 1.06 0.00 0.00 176.91 177.88 3f7j h ASP 256 N 0.45 0.91 -0.64 1.22 3.32 -0.94 -0.65 116.42 120.09 3f7j h ASP 256 Ca 0.10 -0.36 0.04 0.00 0.02 0.00 0.00 57.03 56.83 3f7j h ASP 256 Cb 0.49 -0.25 -0.05 0.00 0.22 0.00 0.00 39.33 39.75 3f7j h ASP 256 CO 0.02 1.06 0.37 0.11 -1.72 0.00 0.00 179.24 179.09 3f7j h LYS 257 N 0.75 0.69 -0.19 3.56 1.57 -1.04 -2.45 116.57 119.47 3f7j h LYS 257 Ca 0.12 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 3f7j h LYS 257 Cb 0.66 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 3f7j h LYS 257 CO 0.05 0.46 0.05 0.82 -0.57 0.00 0.00 179.45 180.26 3f7j h ILE 258 N 0.72 1.20 -0.88 1.86 2.04 -0.94 -3.07 117.51 118.44 3f7j h ILE 258 Ca 0.27 -0.64 0.13 0.00 1.00 0.00 0.00 64.86 65.63 3f7j h ILE 258 Cb 0.10 1.26 -0.07 0.00 -0.74 0.00 0.00 36.82 37.37 3f7j h ILE 258 CO -0.14 0.20 0.57 0.44 0.00 0.00 0.00 178.15 179.22 3f7j h ASP 259 N 0.12 0.67 0.37 1.72 5.19 -0.96 -1.53 116.42 122.01 3f7j h ASP 259 Ca 0.06 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 3f7j h ASP 259 Cb 0.26 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.67 3f7j h ASP 259 CO -0.00 0.35 0.00 0.00 -3.12 0.00 0.00 179.24 176.47 3f7j n ALA 260 N -2.43 1.72 0.98 3.45 0.00 -0.94 -1.98 120.51 121.31 3f7j n ALA 260 Ca 0.17 -0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.67 3f7j n ALA 260 Cb 0.44 -1.23 0.58 0.00 0.00 0.00 0.00 19.45 19.24 3f7j n ALA 260 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3f7j n LEU 261 N -1.39 0.00 -4.60 0.00 4.77 -0.57 -4.91 117.00 110.29 3f7j n LEU 261 Ca 0.05 0.44 -0.49 0.00 -0.03 0.00 0.00 56.01 55.97 3f7j n LEU 261 Cb 0.14 -0.44 -0.05 0.00 -2.33 0.00 0.00 43.42 40.75 3f7j n LEU 261 CO 0.12 -0.06 0.86 -3.20 -1.33 0.00 0.00 177.39 173.79 3f7j n ASN 262 N -1.44 1.80 -0.11 -1.43 5.15 -0.61 -4.41 115.26 114.21 3f7j n ASN 262 Ca 0.08 1.13 0.01 0.00 -0.60 0.00 0.00 54.58 55.20 3f7j n ASN 262 Cb 0.27 -1.25 0.02 0.00 -0.53 0.00 0.00 39.78 38.28 3f7j n ASN 262 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3f7j n LYS 263 N 2.21 0.85 -3.95 1.20 5.02 -0.26 -4.98 118.16 118.27 3f7j n LYS 263 Ca 0.16 -1.08 -0.30 0.00 -2.02 0.00 0.00 58.31 55.07 3f7j n LYS 263 Cb 0.24 -0.73 -0.03 0.00 -0.02 0.00 0.00 35.03 34.49 3f7j n LYS 263 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3f7j n ASP 264 N -0.28 -1.37 -4.23 4.39 8.00 -0.60 -4.92 116.55 117.53 3f7j n ASP 264 Ca 0.02 -0.98 -0.34 0.00 0.71 0.00 0.00 54.79 54.20 3f7j n ASP 264 Cb 0.50 -1.19 -0.15 0.00 -0.02 0.00 0.00 41.12 40.25 3f7j n ASP 264 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3f7j s GLU 265 N -6.64 3.19 -0.09 -1.24 2.12 -0.24 -4.97 118.70 110.83 3f7j s GLU 265 Ca 0.21 -0.74 -0.03 0.00 0.36 0.00 0.00 54.97 54.77 3f7j s GLU 265 Cb -0.12 -2.73 -0.03 0.00 0.26 0.00 0.00 34.13 31.51 3f7j s GLU 265 CO 0.74 -0.13 0.02 1.03 -0.54 0.00 0.00 175.26 176.38 3f7j s ARG 266 N 1.19 3.07 0.10 4.30 0.52 -1.26 -4.31 118.95 122.56 3f7j s ARG 266 Ca 0.02 -0.38 0.22 0.00 -0.52 0.00 0.00 55.73 55.08 3f7j s ARG 266 Cb -0.14 -2.85 -0.09 0.00 0.52 0.00 0.00 34.95 32.39 3f7j s ARG 266 CO -0.06 0.69 0.87 1.33 0.02 0.00 0.00 175.30 178.15 3f7j n VAL 267 N 2.18 0.33 -3.38 3.52 0.24 -1.26 -4.95 118.33 115.01 3f7j n VAL 267 Ca -0.19 -0.47 -0.21 0.00 -2.04 0.00 0.00 64.34 61.43 3f7j n VAL 267 Cb 0.54 -0.12 0.01 0.00 -1.47 0.00 0.00 33.84 32.80 3f7j n VAL 267 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3f7j s GLY 268 N -4.26 2.03 0.75 7.63 0.00 -1.26 -5.11 107.32 107.11 3f7j s GLY 268 Ca -0.02 -1.78 -0.15 0.00 0.00 0.00 0.00 44.72 42.77 3f7j s GLY 268 CO 0.83 -1.73 0.96 -1.05 0.00 0.00 0.00 173.10 172.11 3f7j n PRO 269 N -1.88 0.39 -2.97 2.90 -0.02 -1.26 -4.99 135.00 127.17 3f7j n PRO 269 Ca 0.07 0.19 -0.41 0.00 -2.02 0.00 0.00 63.50 61.33 3f7j n PRO 269 Cb 0.62 -2.22 -0.05 0.00 -0.02 0.00 0.00 33.50 31.83 3f7j n PRO 269 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3f7j s ASN 270 N -1.74 6.92 0.59 2.55 3.84 -1.26 -4.96 114.94 120.88 3f7j s ASN 270 Ca 0.72 1.13 0.38 0.00 0.21 0.00 0.00 52.86 55.30 3f7j s ASN 270 Cb -0.33 -2.43 1.86 0.00 -0.55 0.00 0.00 41.25 39.81 3f7j s ASN 270 CO 0.52 -0.30 2.15 1.55 -2.79 0.00 0.00 177.10 178.23 3f7j h PRO 271 N 7.20 0.00 0.00 0.43 0.13 -1.93 -0.39 132.00 137.44 3f7j h PRO 271 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 3f7j h PRO 271 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3f7j h PRO 271 CO 0.80 0.00 0.00 -0.44 -0.23 0.00 0.00 178.00 178.13 3f7j h ASP 272 N 0.00 0.00 0.00 1.44 3.32 -1.93 -3.31 116.42 115.94 3f7j h ASP 272 Ca 0.00 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.70 3f7j h ASP 272 Cb 0.25 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.74 3f7j h ASP 272 CO 0.00 0.00 -2.30 -0.62 -1.72 0.00 0.00 179.24 174.60 3f7j n GLU 273 N -2.62 0.91 -2.69 3.56 1.02 -0.25 -4.79 120.64 115.76 3f7j n GLU 273 Ca 0.03 -0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.73 3f7j n GLU 273 Cb 0.35 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 3f7j n GLU 273 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 3f7j n LEU 274 N -2.72 5.10 -4.42 -4.62 7.94 -0.64 -4.94 117.00 112.70 3f7j n LEU 274 Ca -0.31 -4.13 -0.41 0.00 -1.11 0.00 0.00 56.01 50.04 3f7j n LEU 274 Cb 1.11 -1.70 -0.11 0.00 0.53 0.00 0.00 43.42 43.25 3f7j n LEU 274 CO 0.39 0.40 -0.12 -0.76 -1.11 0.00 0.00 177.39 176.18 3f7j s LEU 275 N 3.16 4.84 0.00 -1.96 1.43 -1.26 -4.21 118.68 120.68 3f7j s LEU 275 Ca 0.50 -0.92 0.02 0.00 -1.03 0.00 0.00 54.13 52.70 3f7j s LEU 275 Cb 0.02 -2.08 0.01 0.00 0.03 0.00 0.00 46.19 44.17 3f7j s LEU 275 CO 0.05 -0.40 0.56 2.22 0.23 0.00 0.00 176.35 179.01