#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 0.22 -0.00 2.12 -0.01 -1.26 -4.88 135.00 131.19 3f7j n PRO 2 Ca 0.00 0.08 0.06 0.00 -0.01 0.00 0.00 63.50 63.63 3f7j n PRO 2 Cb 0.00 -1.24 -0.07 0.00 -0.01 0.00 0.00 33.50 32.17 3f7j n PRO 2 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 175.50 175.74 3f7j n THR 3 N -1.27 0.00 -3.87 3.45 -2.24 -1.26 -4.94 114.28 104.15 3f7j n THR 3 Ca 0.10 -0.23 -0.08 0.00 -2.27 0.00 0.00 64.05 61.57 3f7j n THR 3 Cb 0.44 0.86 -0.01 0.00 -2.10 0.00 0.00 70.33 69.52 3f7j n THR 3 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3f7j s SER 4 N -2.36 -0.07 0.54 3.42 1.04 -1.26 -4.84 113.70 110.17 3f7j s SER 4 Ca 0.03 -0.91 0.36 0.00 0.48 0.00 0.00 55.95 55.91 3f7j s SER 4 Cb 0.09 0.76 1.70 0.00 0.10 0.00 0.00 66.02 68.67 3f7j s SER 4 CO 0.50 -1.47 2.07 -0.07 0.98 0.00 0.00 173.24 175.25 3f7j h LEU 5 N 2.03 0.00 -0.45 2.42 3.38 -1.91 -2.61 115.31 118.17 3f7j h LEU 5 Ca -0.25 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.66 3f7j h LEU 5 Cb 1.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 3f7j h LEU 5 CO 0.32 0.00 -0.28 0.11 0.09 0.00 0.00 178.44 178.68 3f7j h LYS 6 N 0.00 0.00 -7.03 1.13 1.79 -1.96 -3.42 116.57 107.08 3f7j h LYS 6 Ca 0.00 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.93 3f7j h LYS 6 Cb 0.27 0.00 0.12 0.00 -1.58 0.00 0.00 32.23 31.04 3f7j h LYS 6 CO 0.00 0.28 0.59 -0.51 -1.08 0.00 0.00 179.45 178.74 3f7j s ASP 7 N -6.28 5.58 0.17 0.86 1.01 -0.99 -4.89 116.67 112.14 3f7j s ASP 7 Ca 0.03 2.68 0.04 0.00 0.71 0.00 0.00 52.55 56.02 3f7j s ASP 7 Cb 0.08 -2.63 -0.05 0.00 1.01 0.00 0.00 42.92 41.33 3f7j s ASP 7 CO 0.68 -1.35 -0.06 0.42 0.21 0.00 0.00 175.17 175.07 3f7j s THR 8 N -1.34 1.08 -0.07 -1.27 -4.23 -1.26 -1.67 115.64 106.89 3f7j s THR 8 Ca 0.68 -2.05 0.04 0.00 -1.18 0.00 0.00 61.69 59.18 3f7j s THR 8 Cb -0.38 -2.01 -0.02 0.00 1.34 0.00 0.00 72.50 71.43 3f7j s THR 8 CO 0.46 -0.60 -0.18 0.54 -0.54 0.00 0.00 174.62 174.30 3f7j s VAL 9 N -3.39 2.67 -0.16 2.29 0.11 0.66 -4.83 120.40 117.75 3f7j s VAL 9 Ca 0.21 -0.84 -0.29 0.00 -2.93 0.00 0.00 61.98 58.12 3f7j s VAL 9 Cb 0.04 -2.04 -0.01 0.00 -1.53 0.00 0.00 36.38 32.84 3f7j s VAL 9 CO 0.03 0.57 1.15 -0.75 -3.33 0.00 0.00 175.10 172.76 3f7j s LYS 10 N -0.23 4.28 0.92 1.54 2.20 -1.26 -0.56 119.74 126.63 3f7j s LYS 10 Ca -0.00 1.53 -0.13 0.00 -0.36 0.00 0.00 55.97 57.01 3f7j s LYS 10 Cb -0.13 -3.66 0.14 0.00 -1.51 0.00 0.00 37.83 32.67 3f7j s LYS 10 CO 0.03 -0.60 1.15 -0.51 -0.36 0.00 0.00 175.35 175.07 3f7j s LEU 11 N 3.03 2.04 0.58 5.43 1.43 0.38 -4.91 118.68 126.66 3f7j s LEU 11 Ca 0.50 0.89 0.38 0.00 -1.03 0.00 0.00 54.13 54.88 3f7j s LEU 11 Cb -0.19 -3.19 1.86 0.00 0.03 0.00 0.00 46.19 44.70 3f7j s LEU 11 CO 0.13 -2.57 2.14 1.12 0.23 0.00 0.00 176.35 177.40 3f7j h HIS 12 N -1.51 0.00 -0.33 0.29 2.07 -1.85 -0.54 115.15 113.29 3f7j h HIS 12 Ca -0.50 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.02 3f7j h HIS 12 Cb 1.33 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.31 3f7j h HIS 12 CO 0.11 0.00 0.00 0.27 -3.07 0.00 0.00 177.93 175.24 3f7j n ASN 13 N -3.00 2.56 0.00 3.10 6.94 -1.26 -4.93 115.26 118.68 3f7j n ASN 13 Ca -0.01 -1.88 0.00 0.00 -0.02 0.00 0.00 54.58 52.66 3f7j n ASN 13 Cb 0.17 -0.21 0.00 0.00 -2.36 0.00 0.00 39.78 37.38 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 1.31 0.73 3.73 4.83 0.00 -0.21 -5.05 105.19 110.53 3f7j n GLY 14 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.30 3.22 -0.51 1.61 1.01 -1.26 -4.64 120.40 117.54 3f7j s VAL 15 Ca 0.00 0.98 -0.25 0.00 0.00 0.00 0.00 61.98 62.72 3f7j s VAL 15 Cb 0.00 -3.63 0.03 0.00 0.00 0.00 0.00 36.38 32.79 3f7j s VAL 15 CO 0.00 0.14 0.95 -1.61 0.00 0.00 0.00 175.10 174.57 3f7j s GLU 16 N 0.08 3.42 -0.17 2.72 2.02 -1.26 -0.47 118.70 125.04 3f7j s GLU 16 Ca 0.58 -0.06 -0.12 0.00 0.02 0.00 0.00 54.97 55.39 3f7j s GLU 16 Cb -0.37 -4.00 -0.05 0.00 0.10 0.00 0.00 34.13 29.82 3f7j s GLU 16 CO 0.37 -1.38 0.22 1.41 0.02 0.00 0.00 175.26 175.89 3f7j s MET 17 N 3.91 4.17 0.50 1.61 -2.45 0.28 -4.85 119.30 122.48 3f7j s MET 17 Ca 0.34 -0.04 -0.23 0.00 -1.25 0.00 0.00 55.69 54.50 3f7j s MET 17 Cb -0.11 -3.40 -0.06 0.00 1.25 0.00 0.00 34.83 32.50 3f7j s MET 17 CO 0.22 0.31 1.39 -2.14 1.05 0.00 0.00 175.02 175.85 3f7j s PRO 18 N 0.30 3.37 0.44 4.11 0.02 -1.26 -0.24 135.00 141.74 3f7j s PRO 18 Ca 0.13 2.33 0.24 0.00 0.02 0.00 0.00 61.00 63.71 3f7j s PRO 18 Cb -0.12 -2.43 0.95 0.00 0.02 0.00 0.00 34.50 32.92 3f7j s PRO 18 CO 0.02 -1.03 1.84 -1.49 -0.33 0.00 0.00 177.00 176.01 3f7j h TRP 19 N 1.83 0.00 -3.40 6.54 4.06 -1.63 -3.43 115.95 119.92 3f7j h TRP 19 Ca -0.51 0.00 -0.47 0.00 2.06 0.00 0.00 58.89 59.97 3f7j h TRP 19 Cb 1.29 0.00 -0.34 0.00 -1.00 0.00 0.00 29.16 29.10 3f7j h TRP 19 CO 0.48 0.23 -0.79 0.12 -3.56 0.00 0.00 178.44 174.91 3f7j s PHE 20 N -3.71 1.15 0.15 0.49 5.36 -1.26 -1.09 117.98 119.07 3f7j s PHE 20 Ca 0.00 -0.41 0.02 0.00 -0.96 0.00 0.00 56.93 55.58 3f7j s PHE 20 Cb 0.11 -0.92 -0.01 0.00 -0.34 0.00 0.00 43.02 41.86 3f7j s PHE 20 CO 0.64 -0.27 0.16 0.41 -1.46 0.00 0.00 175.22 174.69 3f7j n GLY 21 N 4.07 3.25 3.43 13.12 0.00 0.23 -4.29 105.19 125.00 3f7j n GLY 21 Ca -0.22 -1.66 -0.38 0.00 0.00 0.00 0.00 46.02 43.75 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 4.00 0.00 0.99 2.96 -0.21 -3.17 118.68 123.25 3f7j s LEU 22 Ca 0.16 -0.51 -0.26 0.00 -0.22 0.00 0.00 54.13 53.30 3f7j s LEU 22 Cb 0.00 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.67 3f7j s LEU 22 CO 0.11 -0.18 0.80 -0.83 -1.32 0.00 0.00 176.35 174.94 3f7j s GLY 23 N 1.60 2.78 -0.33 7.98 0.00 -0.78 -0.66 107.32 117.91 3f7j s GLY 23 Ca 0.04 0.31 0.08 0.00 0.00 0.00 0.00 44.72 45.15 3f7j s GLY 23 CO 0.05 1.27 1.53 3.33 0.00 0.00 0.00 173.10 179.28 3f7j n VAL 24 N 3.35 2.68 -1.90 1.40 0.24 -0.01 -4.06 118.33 120.03 3f7j n VAL 24 Ca 0.00 -2.77 -0.36 0.00 -2.04 0.00 0.00 64.34 59.17 3f7j n VAL 24 Cb 0.51 -0.42 0.05 0.00 -1.47 0.00 0.00 33.84 32.51 3f7j n VAL 24 CO 0.00 0.00 0.00 0.72 -2.14 0.00 0.00 176.83 175.41 3f7j s PHE 25 N -3.31 2.25 -1.28 6.34 -0.71 -1.26 -2.63 117.98 117.39 3f7j s PHE 25 Ca 0.47 1.50 0.00 0.00 -1.04 0.00 0.00 56.93 57.86 3f7j s PHE 25 Cb 0.42 -3.58 0.00 0.00 -1.21 0.00 0.00 43.02 38.65 3f7j s PHE 25 CO 0.01 -2.54 0.00 1.63 -1.34 0.00 0.00 175.22 172.98 3f7j n LYS 26 N -1.72 -1.39 -3.60 1.99 5.02 -1.26 -4.93 118.16 112.27 3f7j n LYS 26 Ca 0.15 0.71 -0.36 0.00 -2.02 0.00 0.00 58.31 56.79 3f7j n LYS 26 Cb 0.49 -4.99 -0.07 0.00 -0.02 0.00 0.00 35.03 30.44 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 -2.12 5.33 0.17 -0.18 1.01 -1.08 -5.08 120.40 118.46 3f7j s VAL 27 Ca 0.00 0.46 -0.30 0.00 0.00 0.00 0.00 61.98 62.13 3f7j s VAL 27 Cb 0.00 -3.58 -0.08 0.00 0.00 0.00 0.00 36.38 32.71 3f7j s VAL 27 CO 0.00 0.42 1.33 -1.61 0.00 0.00 0.00 175.10 175.24 3f7j s GLU 28 N 0.31 4.37 1.11 2.72 0.41 -1.26 -4.60 118.70 121.76 3f7j s GLU 28 Ca 0.15 2.06 -0.19 0.00 -0.41 0.00 0.00 54.97 56.57 3f7j s GLU 28 Cb -0.13 -3.21 0.08 0.00 -1.78 0.00 0.00 34.13 29.09 3f7j s GLU 28 CO 0.03 -0.31 -0.09 -1.71 -0.49 0.00 0.00 175.26 172.68 3f7j n ASN 29 N 3.08 -2.42 0.00 -0.19 5.15 -1.26 -1.56 115.26 118.06 3f7j n ASN 29 Ca 0.08 -0.10 0.00 0.00 -0.60 0.00 0.00 54.58 53.96 3f7j n ASN 29 Cb 0.43 -0.93 0.00 0.00 -0.53 0.00 0.00 39.78 38.74 3f7j n ASN 29 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3f7j n GLY 30 N 2.11 2.09 0.31 8.20 0.00 -1.26 -4.16 105.19 112.49 3f7j n GLY 30 Ca 0.01 -0.56 0.01 0.00 0.00 0.00 0.00 46.02 45.47 3f7j n GLY 30 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3f7j h ASN 31 N 9.55 0.68 -0.20 1.61 4.21 -1.95 -1.62 115.58 127.86 3f7j h ASN 31 Ca 0.00 -0.06 -0.00 0.00 1.21 0.00 0.00 56.30 57.45 3f7j h ASN 31 Cb 0.00 -0.17 -0.01 0.00 -1.12 0.00 0.00 38.32 37.02 3f7j h ASN 31 CO 0.00 0.57 0.12 -0.08 -1.29 0.00 0.00 177.43 176.75 3f7j h GLU 32 N 0.76 0.27 0.13 0.81 4.81 -1.72 0.37 114.58 120.00 3f7j h GLU 32 Ca 0.19 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.39 3f7j h GLU 32 Cb 0.06 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.39 3f7j h GLU 32 CO -0.03 0.23 -0.06 0.00 -0.73 0.00 0.00 179.01 178.42 3f7j h ALA 33 N 1.03 -0.17 -0.91 2.92 0.00 -0.86 -2.14 119.26 119.12 3f7j h ALA 33 Ca 0.07 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3f7j h ALA 33 Cb 0.03 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 3f7j h ALA 33 CO -0.01 -0.59 0.57 1.15 0.00 0.00 0.00 179.25 180.36 3f7j h THR 34 N -0.18 1.25 -0.03 0.00 2.02 -1.00 -1.82 112.91 113.15 3f7j h THR 34 Ca -0.02 -0.51 -0.22 0.00 0.77 0.00 0.00 66.41 66.43 3f7j h THR 34 Cb 0.13 -0.06 0.01 0.00 -1.74 0.00 0.00 68.15 66.49 3f7j h THR 34 CO 0.03 0.25 -0.90 -0.33 0.37 0.00 0.00 175.52 174.94 3f7j h GLU 35 N 1.25 0.51 -0.41 6.66 4.39 -0.27 -1.54 114.58 125.17 3f7j h GLU 35 Ca 0.33 -0.50 -0.11 0.00 0.34 0.00 0.00 59.36 59.41 3f7j h GLU 35 Cb -0.09 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 3f7j h GLU 35 CO -0.07 1.14 -0.19 0.77 -1.16 0.00 0.00 179.01 179.50 3f7j h SER 36 N 0.31 0.87 0.14 1.42 0.02 -1.22 -2.41 113.55 112.68 3f7j h SER 36 Ca -0.08 -0.40 -0.01 0.00 -0.84 0.00 0.00 61.79 60.47 3f7j h SER 36 Cb 1.53 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.83 3f7j h SER 36 CO 0.16 1.08 -0.07 0.58 -1.14 0.00 0.00 176.83 177.44 3f7j h VAL 37 N 0.66 0.85 -0.18 2.27 2.07 -1.32 -0.71 116.25 119.89 3f7j h VAL 37 Ca 0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.61 3f7j h VAL 37 Cb 0.75 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 3f7j h VAL 37 CO 0.06 0.00 0.12 0.11 0.02 0.00 0.00 177.57 177.87 3f7j h LYS 38 N -0.20 0.24 -0.77 1.57 1.57 -1.30 -1.22 116.57 116.47 3f7j h LYS 38 Ca -0.02 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.77 3f7j h LYS 38 Cb 0.16 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.37 3f7j h LYS 38 CO 0.03 0.18 0.49 0.00 -0.57 0.00 0.00 179.45 179.57 3f7j h ALA 39 N 1.05 1.01 0.23 3.86 0.00 -1.44 -0.11 119.26 123.85 3f7j h ALA 39 Ca 0.07 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3f7j h ALA 39 Cb -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.52 3f7j h ALA 39 CO -0.01 0.30 -0.11 0.00 0.00 0.00 0.00 179.25 179.43 3f7j h ALA 40 N 1.32 -0.32 -0.80 0.00 0.00 -0.67 -2.13 119.26 116.67 3f7j h ALA 40 Ca 0.30 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 3f7j h ALA 40 Cb -0.00 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 3f7j h ALA 40 CO -0.11 -0.66 0.40 0.82 0.00 0.00 0.00 179.25 179.71 3f7j h ILE 41 N -0.35 1.25 -0.60 0.00 2.04 -1.21 -0.21 117.51 118.42 3f7j h ILE 41 Ca -0.03 -0.67 0.02 0.00 1.00 0.00 0.00 64.86 65.17 3f7j h ILE 41 Cb 0.27 0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 3f7j h ILE 41 CO 0.05 0.29 0.40 0.11 0.00 0.00 0.00 178.15 179.00 3f7j h LYS 42 N 1.13 0.75 -0.86 2.37 1.57 -0.94 -2.22 116.57 118.36 3f7j h LYS 42 Ca 0.28 -0.04 -0.27 0.00 -1.87 0.00 0.00 60.65 58.74 3f7j h LYS 42 Cb 0.09 -0.17 -0.16 0.00 0.08 0.00 0.00 32.23 32.07 3f7j h LYS 42 CO -0.04 0.49 0.35 0.09 -0.57 0.00 0.00 179.45 179.77 3f7j n ASN 43 N -4.45 4.24 0.00 0.86 3.02 -0.69 -4.92 115.26 113.32 3f7j n ASN 43 Ca 0.06 -3.16 0.00 0.00 -0.03 0.00 0.00 54.58 51.45 3f7j n ASN 43 Cb 0.08 -0.74 0.00 0.00 -0.61 0.00 0.00 39.78 38.51 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 0.87 3.76 7.41 0.00 -0.84 -5.01 105.19 111.04 3f7j n GLY 44 Ca 0.41 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.38 2.49 0.00 1.61 1.51 -0.18 -4.66 117.35 115.75 3f7j s TYR 45 Ca 0.00 1.33 0.00 0.00 -1.01 0.00 0.00 57.07 57.39 3f7j s TYR 45 Cb 0.00 -3.82 0.00 0.00 -0.11 0.00 0.00 41.96 38.03 3f7j s TYR 45 CO 0.00 -2.72 0.45 0.54 -1.11 0.00 0.00 175.55 172.71 3f7j n ARG 46 N -0.37 -0.26 -4.22 -0.62 5.12 -1.26 -4.29 116.66 110.75 3f7j n ARG 46 Ca 0.06 -0.51 -0.22 0.00 -1.93 0.00 0.00 57.85 55.25 3f7j n ARG 46 Cb 0.43 -0.87 -0.17 0.00 -1.16 0.00 0.00 32.46 30.70 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 -0.12 1.41 -0.02 0.55 0.15 -1.26 0.11 113.70 114.52 3f7j s SER 47 Ca 0.00 -0.20 0.05 0.00 0.70 0.00 0.00 55.95 56.50 3f7j s SER 47 Cb 0.00 -0.61 -0.01 0.00 -1.71 0.00 0.00 66.02 63.69 3f7j s SER 47 CO 0.00 -0.05 -0.17 -0.63 1.20 0.00 0.00 173.24 173.59 3f7j s ILE 48 N 1.04 1.39 -0.13 6.45 -1.09 -0.59 -1.04 121.20 127.23 3f7j s ILE 48 Ca -0.09 -0.74 0.02 0.00 -2.23 0.00 0.00 60.65 57.62 3f7j s ILE 48 Cb -0.14 -1.17 0.01 0.00 -1.58 0.00 0.00 42.46 39.58 3f7j s ILE 48 CO -0.00 0.40 -0.19 -0.62 -1.23 0.00 0.00 174.94 173.29 3f7j s ASP 49 N -0.29 2.82 0.00 3.58 2.15 0.16 -1.95 116.67 123.15 3f7j s ASP 49 Ca 0.04 -0.53 0.00 0.00 0.43 0.00 0.00 52.55 52.49 3f7j s ASP 49 Cb -0.08 -1.29 0.00 0.00 -0.30 0.00 0.00 42.92 41.25 3f7j s ASP 49 CO 0.00 0.05 0.00 1.07 -0.17 0.00 0.00 175.17 176.12 3f7j n THR 50 N 4.16 0.00 -3.60 1.71 5.66 -0.72 -0.83 114.28 120.68 3f7j n THR 50 Ca -0.19 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.69 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 -1.92 0.28 1.79 0.00 -1.26 -3.94 121.76 114.71 3f7j s ALA 51 Ca 0.00 1.69 -0.06 0.00 0.00 0.00 0.00 51.96 53.59 3f7j s ALA 51 Cb 0.00 -0.93 0.51 0.00 0.00 0.00 0.00 23.12 22.70 3f7j s ALA 51 CO 0.00 -0.29 1.54 0.00 0.00 0.00 0.00 175.76 177.01 3f7j n ALA 52 N 1.45 0.29 0.30 0.00 0.00 -1.17 -1.38 120.51 119.99 3f7j n ALA 52 Ca -0.12 1.08 0.19 0.00 0.00 0.00 0.00 53.44 54.58 3f7j n ALA 52 Cb 0.57 -0.67 0.88 0.00 0.00 0.00 0.00 19.45 20.22 3f7j n ALA 52 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 3f7j h ILE 53 N 0.00 0.05 0.00 0.00 6.09 -1.96 -2.50 117.51 119.19 3f7j h ILE 53 Ca 0.50 -0.35 0.00 0.00 -1.37 0.00 0.00 64.86 63.64 3f7j h ILE 53 Cb 0.82 1.33 0.00 0.00 0.47 0.00 0.00 36.82 39.43 3f7j h ILE 53 CO -1.00 0.01 0.00 -1.22 -3.07 0.00 0.00 178.15 172.87 3f7j n TYR 54 N -3.13 0.00 -0.98 2.19 0.53 -0.48 -4.83 117.16 110.46 3f7j n TYR 54 Ca -0.01 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.87 3f7j n TYR 54 Cb 0.22 -0.37 0.00 0.00 -1.03 0.00 0.00 39.34 38.16 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 -1.37 -1.72 -0.27 -0.72 5.02 -0.94 -4.75 118.16 113.41 3f7j n LYS 55 Ca 0.08 0.43 0.07 0.00 -2.02 0.00 0.00 58.31 56.86 3f7j n LYS 55 Cb 0.19 -4.78 0.19 0.00 -0.02 0.00 0.00 35.03 30.61 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 -0.86 3.26 0.01 4.39 0.23 -1.26 -4.38 115.26 116.65 3f7j n ASN 56 Ca 0.00 -2.34 0.09 0.00 -0.53 0.00 0.00 54.58 51.79 3f7j n ASN 56 Cb 0.43 -0.34 0.51 0.00 -2.08 0.00 0.00 39.78 38.30 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 1.95 0.36 -0.18 -3.83 5.08 -1.88 0.55 114.58 116.63 3f7j h GLU 57 Ca 0.00 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 3f7j h GLU 57 Cb 0.98 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 3f7j h GLU 57 CO 0.08 0.24 0.02 0.93 -1.00 0.00 0.00 179.01 179.28 3f7j h GLU 58 N 0.37 0.30 -0.26 2.33 5.08 -1.83 -0.78 114.58 119.79 3f7j h GLU 58 Ca 0.18 -0.08 -0.13 0.00 -1.00 0.00 0.00 59.36 58.33 3f7j h GLU 58 Cb 0.26 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 3f7j h GLU 58 CO -0.04 0.48 -0.39 0.78 -1.00 0.00 0.00 179.01 178.83 3f7j h GLY 59 N 0.08 0.65 0.19 -3.84 0.00 -1.53 -2.48 103.07 96.13 3f7j h GLY 59 Ca 0.05 -0.64 0.10 0.00 0.00 0.00 0.00 47.33 46.84 3f7j h GLY 59 CO 0.00 0.58 0.02 -2.08 0.00 0.00 0.00 176.54 175.06 3f7j h VAL 60 N 0.49 0.62 -0.77 4.60 2.07 -0.82 -1.25 116.25 121.20 3f7j h VAL 60 Ca 0.04 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 3f7j h VAL 60 Cb 0.89 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 3f7j h VAL 60 CO 0.08 0.03 0.40 1.23 0.02 0.00 0.00 177.57 179.33 3f7j h GLY 61 N 0.14 1.16 1.63 2.17 0.00 -0.82 -1.22 103.07 106.12 3f7j h GLY 61 Ca 0.26 -0.54 -0.16 0.00 0.00 0.00 0.00 47.33 46.89 3f7j h GLY 61 CO -0.41 0.52 -0.62 -2.22 0.00 0.00 0.00 176.54 173.81 3f7j h ILE 62 N 1.07 1.36 -0.47 2.60 2.04 -1.26 -1.35 117.51 121.51 3f7j h ILE 62 Ca 0.27 -1.96 -0.14 0.00 1.00 0.00 0.00 64.86 64.03 3f7j h ILE 62 Cb 0.06 1.96 -0.01 0.00 -0.74 0.00 0.00 36.82 38.09 3f7j h ILE 62 CO -0.04 0.59 -0.24 1.23 0.00 0.00 0.00 178.15 179.69 3f7j h GLY 63 N 1.29 1.07 0.58 5.37 0.00 -0.89 0.12 103.07 110.62 3f7j h GLY 63 Ca -0.01 -0.98 0.03 0.00 0.00 0.00 0.00 47.33 46.38 3f7j h GLY 63 CO 0.10 0.89 -0.15 -2.22 0.00 0.00 0.00 176.54 175.16 3f7j h ILE 64 N 0.84 0.63 -0.29 2.60 2.04 -1.09 -1.63 117.51 120.60 3f7j h ILE 64 Ca 0.10 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.98 3f7j h ILE 64 Cb 0.83 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 3f7j h ILE 64 CO 0.07 0.00 0.15 0.11 0.00 0.00 0.00 178.15 178.48 3f7j h LYS 65 N -0.22 0.30 0.00 2.37 1.57 -1.07 -2.58 116.57 116.93 3f7j h LYS 65 Ca 0.07 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3f7j h LYS 65 Cb 0.31 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.55 3f7j h LYS 65 CO -0.18 0.20 0.00 0.39 -0.57 0.00 0.00 179.45 179.29 3f7j n GLU 66 N -4.96 0.01 0.14 3.15 1.02 0.42 -3.70 120.64 116.72 3f7j n GLU 66 Ca -0.01 0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 3f7j n GLU 66 Cb 0.07 -1.51 0.19 0.00 -0.02 0.00 0.00 31.44 30.17 3f7j n GLU 66 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3f7j h SER 67 N 0.00 0.00 -4.52 1.62 4.64 -0.87 -3.47 113.55 110.95 3f7j h SER 67 Ca 0.00 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.03 3f7j h SER 67 Cb 0.42 0.00 0.10 0.00 -0.31 0.00 0.00 62.40 62.62 3f7j h SER 67 CO 0.00 0.58 -0.49 0.61 -0.87 0.00 0.00 176.83 176.66 3f7j n GLY 68 N 0.31 -0.14 3.46 -0.77 0.00 -1.24 -4.85 105.19 101.97 3f7j n GLY 68 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 3f7j n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f7j s VAL 69 N -3.23 2.72 0.26 1.61 1.01 -1.26 -5.12 120.40 116.38 3f7j s VAL 69 Ca 0.42 -1.44 -0.29 0.00 0.00 0.00 0.00 61.98 60.67 3f7j s VAL 69 Cb -0.18 -2.21 -0.09 0.00 0.00 0.00 0.00 36.38 33.90 3f7j s VAL 69 CO 0.53 0.18 1.27 0.00 0.00 0.00 0.00 175.10 177.08 3f7j s ALA 70 N -1.05 3.49 0.30 5.51 0.00 -1.26 -4.94 121.76 123.81 3f7j s ALA 70 Ca 0.16 1.12 0.04 0.00 0.00 0.00 0.00 51.96 53.28 3f7j s ALA 70 Cb -0.10 -3.45 0.79 0.00 0.00 0.00 0.00 23.12 20.36 3f7j s ALA 70 CO 0.08 -0.50 1.50 -2.13 0.00 0.00 0.00 175.76 174.71 3f7j n ARG 71 N 1.72 -0.07 0.10 0.00 3.00 -1.26 -1.73 116.66 118.42 3f7j n ARG 71 Ca 0.03 1.42 0.12 0.00 -0.00 0.00 0.00 57.85 59.41 3f7j n ARG 71 Cb 0.43 -2.28 0.46 0.00 0.00 0.00 0.00 32.46 31.06 3f7j n ARG 71 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 3f7j n GLU 72 N -5.39 0.19 0.00 -0.14 -0.00 -1.26 -1.64 120.64 112.40 3f7j n GLU 72 Ca 0.24 0.31 0.12 0.00 -0.00 0.00 0.00 57.16 57.83 3f7j n GLU 72 Cb 0.79 -1.79 0.27 0.00 -0.00 0.00 0.00 31.44 30.71 3f7j n GLU 72 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 3f7j n GLU 73 N -2.14 0.10 -3.80 3.44 1.02 -0.71 -4.90 120.64 113.65 3f7j n GLU 73 Ca 0.04 -0.06 -0.36 0.00 -0.02 0.00 0.00 57.16 56.76 3f7j n GLU 73 Cb 0.30 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.17 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 -2.94 4.40 -0.33 -4.62 1.43 -0.65 -4.88 118.68 111.09 3f7j s LEU 74 Ca 0.13 0.55 -0.02 0.00 -1.03 0.00 0.00 54.13 53.76 3f7j s LEU 74 Cb 0.18 -2.32 0.07 0.00 0.03 0.00 0.00 46.19 44.15 3f7j s LEU 74 CO 0.67 0.35 0.06 0.12 0.23 0.00 0.00 176.35 177.79 3f7j s PHE 75 N -1.12 3.39 -0.17 0.29 5.36 0.12 -4.95 117.98 120.90 3f7j s PHE 75 Ca 0.20 -2.10 -0.06 0.00 -0.96 0.00 0.00 56.93 54.01 3f7j s PHE 75 Cb -0.13 -2.48 -0.03 0.00 -0.34 0.00 0.00 43.02 40.03 3f7j s PHE 75 CO 0.09 -0.86 0.02 0.42 -1.46 0.00 0.00 175.22 173.43 3f7j s ILE 76 N 1.20 4.39 -0.07 3.12 -1.09 -1.26 -1.54 121.20 125.95 3f7j s ILE 76 Ca -0.00 -0.18 0.05 0.00 -2.23 0.00 0.00 60.65 58.29 3f7j s ILE 76 Cb -0.21 -2.96 -0.01 0.00 -1.58 0.00 0.00 42.46 37.70 3f7j s ILE 76 CO -0.02 0.47 -0.21 -0.89 -1.23 0.00 0.00 174.94 173.05 3f7j s THR 77 N 0.42 2.38 0.03 2.92 2.01 -0.82 -1.39 115.64 121.18 3f7j s THR 77 Ca 0.00 -0.95 0.00 0.00 0.31 0.00 0.00 61.69 61.06 3f7j s THR 77 Cb -0.13 -1.90 -0.00 0.00 0.01 0.00 0.00 72.50 70.48 3f7j s THR 77 CO 0.01 0.57 0.02 -0.24 -0.69 0.00 0.00 174.62 174.29 3f7j n SER 78 N 2.91 0.54 -3.79 3.53 2.88 -0.82 -1.75 113.62 117.12 3f7j n SER 78 Ca -0.17 -1.17 -0.13 0.00 -1.33 0.00 0.00 58.87 56.06 3f7j n SER 78 Cb 0.52 0.10 -0.10 0.00 -0.75 0.00 0.00 64.21 63.98 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 -2.12 0.48 -0.19 -1.46 1.02 -1.25 -1.67 119.74 114.55 3f7j s LYS 79 Ca 0.02 0.00 -0.29 0.00 0.02 0.00 0.00 55.97 55.73 3f7j s LYS 79 Cb 0.00 0.22 0.00 0.00 -0.52 0.00 0.00 37.83 37.53 3f7j s LYS 79 CO 0.02 -0.11 1.01 0.54 -0.92 0.00 0.00 175.35 175.89 3f7j s VAL 80 N -0.72 4.73 0.59 3.17 0.11 -0.16 -3.03 120.40 125.09 3f7j s VAL 80 Ca -0.08 1.99 -0.18 0.00 -2.93 0.00 0.00 61.98 60.78 3f7j s VAL 80 Cb -0.04 -4.29 -0.04 0.00 -1.53 0.00 0.00 36.38 30.48 3f7j s VAL 80 CO 0.02 -0.11 1.13 0.86 -3.33 0.00 0.00 175.10 173.68 3f7j s TRP 81 N 2.75 2.62 0.24 1.54 -0.00 -1.26 -2.28 118.94 122.55 3f7j s TRP 81 Ca 0.45 1.54 -0.10 0.00 -0.00 0.00 0.00 56.10 57.99 3f7j s TRP 81 Cb -0.16 -3.27 0.35 0.00 -0.00 0.00 0.00 33.47 30.38 3f7j s TRP 81 CO 0.10 -1.68 1.61 -0.91 -0.00 0.00 0.00 176.95 176.07 3f7j h ASN 82 N 0.78 -0.62 0.36 5.86 2.35 -1.95 0.33 115.58 122.69 3f7j h ASN 82 Ca -0.49 0.22 -0.01 0.00 -0.55 0.00 0.00 56.30 55.47 3f7j h ASN 82 Cb 1.26 0.44 -0.00 0.00 0.05 0.00 0.00 38.32 40.07 3f7j h ASN 82 CO 0.56 -0.24 -0.07 -0.08 -1.65 0.00 0.00 177.43 175.95 3f7j h GLU 83 N 0.02 0.00 -0.02 0.81 4.81 -2.01 -2.02 114.58 116.17 3f7j h GLU 83 Ca 0.38 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.61 3f7j h GLU 83 Cb 0.61 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.99 3f7j h GLU 83 CO -0.75 0.07 -0.00 -0.25 -0.73 0.00 0.00 179.01 177.34 3f7j n ASP 84 N -3.47 1.58 -4.71 1.04 8.00 0.10 -4.99 116.55 114.11 3f7j n ASP 84 Ca -0.02 -1.52 -0.34 0.00 0.71 0.00 0.00 54.79 53.62 3f7j n ASP 84 Cb 0.20 0.00 0.12 0.00 -0.02 0.00 0.00 41.12 41.42 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 -2.01 1.78 0.00 -1.24 -0.21 -0.76 -2.83 119.66 114.40 3f7j s GLN 85 Ca 0.37 1.75 0.00 0.00 0.02 0.00 0.00 55.36 57.50 3f7j s GLN 85 Cb 0.21 -1.79 0.00 0.00 1.00 0.00 0.00 33.01 32.43 3f7j s GLN 85 CO 0.34 -2.10 0.00 0.41 -2.12 0.00 0.00 175.29 171.81 3f7j n GLY 86 N 0.43 2.84 0.21 3.09 0.00 -1.25 -4.79 105.19 105.72 3f7j n GLY 86 Ca 0.13 -1.86 -0.08 0.00 0.00 0.00 0.00 46.02 44.22 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 -0.46 -0.99 1.61 3.20 -1.90 -1.90 116.97 116.53 3f7j h TYR 87 Ca 0.00 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.88 3f7j h TYR 87 Cb 0.00 0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.37 3f7j h TYR 87 CO 0.00 -0.29 0.65 0.93 -1.64 0.00 0.00 178.16 177.82 3f7j h GLU 88 N -0.79 1.27 0.00 1.82 4.39 -1.94 -2.61 114.58 116.72 3f7j h GLU 88 Ca -0.05 -0.08 -0.09 0.00 0.34 0.00 0.00 59.36 59.49 3f7j h GLU 88 Cb 0.38 -0.29 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 3f7j h GLU 88 CO 0.08 0.84 -0.41 1.79 -1.16 0.00 0.00 179.01 180.15 3f7j h THR 89 N 1.31 0.96 -0.14 1.13 1.35 -1.79 -1.87 112.91 113.86 3f7j h THR 89 Ca 0.38 -1.60 -0.07 0.00 -0.55 0.00 0.00 66.41 64.56 3f7j h THR 89 Cb -0.09 1.96 -0.00 0.00 -1.73 0.00 0.00 68.15 68.28 3f7j h THR 89 CO -0.10 0.40 -0.19 0.74 -0.25 0.00 0.00 175.52 176.12 3f7j h THR 90 N 0.00 1.36 -0.53 6.82 2.02 -1.12 0.04 112.91 121.50 3f7j h THR 90 Ca -0.00 -1.40 0.07 0.00 0.77 0.00 0.00 66.41 65.85 3f7j h THR 90 Cb 0.92 1.95 -0.06 0.00 -1.74 0.00 0.00 68.15 69.22 3f7j h THR 90 CO 0.05 0.41 0.21 -0.07 0.37 0.00 0.00 175.52 176.50 3f7j h LEU 91 N -0.02 0.24 -0.38 2.58 3.38 -1.24 -0.01 115.31 119.85 3f7j h LEU 91 Ca 0.02 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 3f7j h LEU 91 Cb 0.75 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 3f7j h LEU 91 CO 0.04 0.16 0.20 0.00 0.09 0.00 0.00 178.44 178.94 3f7j h ALA 92 N 1.34 0.49 -0.90 1.53 0.00 -1.26 -2.80 119.26 117.68 3f7j h ALA 92 Ca 0.26 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3f7j h ALA 92 Cb 0.26 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 3f7j h ALA 92 CO -0.24 0.03 0.54 0.00 0.00 0.00 0.00 179.25 179.58 3f7j h ALA 93 N 1.06 1.14 -0.49 0.00 0.00 -0.38 -2.33 119.26 118.26 3f7j h ALA 93 Ca 0.13 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.98 3f7j h ALA 93 Cb 0.08 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 3f7j h ALA 93 CO -0.02 0.61 0.25 0.35 0.00 0.00 0.00 179.25 180.43 3f7j h PHE 94 N 1.24 0.45 -0.48 0.00 3.57 -0.91 -0.95 116.94 119.85 3f7j h PHE 94 Ca 0.32 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.80 3f7j h PHE 94 Cb -0.04 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.54 3f7j h PHE 94 CO 0.00 0.22 0.12 0.93 -2.23 0.00 0.00 178.31 177.35 3f7j h GLU 95 N 0.48 0.73 -0.29 1.11 4.39 -1.22 -0.64 114.58 119.14 3f7j h GLU 95 Ca 0.21 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 3f7j h GLU 95 Cb 0.12 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 3f7j h GLU 95 CO -0.15 0.66 0.14 0.87 -1.16 0.00 0.00 179.01 179.36 3f7j h LYS 96 N 0.71 0.42 -0.67 2.33 1.57 -1.10 -1.27 116.57 118.55 3f7j h LYS 96 Ca 0.16 -0.06 0.07 0.00 -1.87 0.00 0.00 60.65 58.95 3f7j h LYS 96 Cb 0.26 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.43 3f7j h LYS 96 CO -0.00 0.40 0.36 0.77 -0.57 0.00 0.00 179.45 180.41 3f7j h SER 97 N 0.33 0.51 -0.46 0.86 0.02 -0.50 0.63 113.55 114.94 3f7j h SER 97 Ca 0.10 0.04 -0.09 0.00 -0.84 0.00 0.00 61.79 61.00 3f7j h SER 97 Cb 0.12 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 3f7j h SER 97 CO -0.01 0.32 -0.04 -0.07 -1.14 0.00 0.00 176.83 175.88 3f7j h LEU 98 N 0.65 0.88 -0.22 5.07 3.38 -1.01 0.25 115.31 124.31 3f7j h LEU 98 Ca 0.31 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 3f7j h LEU 98 Cb 0.24 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3f7j h LEU 98 CO -0.21 0.97 -0.03 -0.08 0.09 0.00 0.00 178.44 179.18 3f7j h GLU 99 N 0.82 0.41 -0.16 1.13 4.81 -0.25 -1.07 114.58 120.27 3f7j h GLU 99 Ca 0.15 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 3f7j h GLU 99 Cb 0.55 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 3f7j h GLU 99 CO 0.03 0.63 0.05 0.00 -0.73 0.00 0.00 179.01 178.99 3f7j h ARG 100 N 0.16 0.25 0.00 1.92 3.08 -0.74 -2.97 114.38 116.08 3f7j h ARG 100 Ca 0.06 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3f7j h ARG 100 Cb 0.46 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.47 3f7j h ARG 100 CO 0.02 0.37 0.00 1.28 -1.07 0.00 0.00 179.97 180.57 3f7j n LEU 101 N -4.83 0.60 -3.63 3.04 4.77 0.85 -4.18 117.00 113.62 3f7j n LEU 101 Ca -0.05 0.68 -0.21 0.00 -0.03 0.00 0.00 56.01 56.41 3f7j n LEU 101 Cb 0.14 -0.64 0.05 0.00 -2.33 0.00 0.00 43.42 40.64 3f7j n LEU 101 CO 0.35 -0.65 0.01 0.00 -1.33 0.00 0.00 177.39 175.77 3f7j n GLN 102 N -2.20 -5.58 -4.36 3.23 6.02 -0.48 -4.28 117.38 109.73 3f7j n GLN 102 Ca 0.01 0.69 -0.22 0.00 -0.01 0.00 0.00 57.00 57.47 3f7j n GLN 102 Cb 0.17 -5.43 -0.13 0.00 1.02 0.00 0.00 30.24 25.87 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 -6.65 2.24 0.12 1.08 1.43 -0.73 -5.05 118.68 111.11 3f7j s LEU 103 Ca 0.07 -0.59 0.16 0.00 -1.03 0.00 0.00 54.13 52.73 3f7j s LEU 103 Cb -0.03 -0.78 -0.09 0.00 0.03 0.00 0.00 46.19 45.32 3f7j s LEU 103 CO 0.79 0.05 1.00 0.44 0.23 0.00 0.00 176.35 178.86 3f7j h ASP 104 N 4.46 0.00 -5.14 2.29 5.19 -1.96 -3.43 116.42 117.84 3f7j h ASP 104 Ca -0.43 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 55.92 3f7j h ASP 104 Cb 1.18 0.00 -0.12 0.00 0.18 0.00 0.00 39.33 40.56 3f7j h ASP 104 CO 0.41 0.60 -0.16 -0.72 -3.12 0.00 0.00 179.24 176.25 3f7j s TYR 105 N -2.91 0.04 0.23 4.55 -0.85 -1.26 -4.94 117.35 112.20 3f7j s TYR 105 Ca -0.01 -0.39 0.08 0.00 -0.52 0.00 0.00 57.07 56.23 3f7j s TYR 105 Cb 0.08 0.15 -0.04 0.00 0.38 0.00 0.00 41.96 42.54 3f7j s TYR 105 CO 0.80 -0.73 0.02 -0.51 -1.52 0.00 0.00 175.55 173.60 3f7j s LEU 106 N -2.87 3.31 0.05 -3.49 1.43 -0.81 -5.02 118.68 111.27 3f7j s LEU 106 Ca 0.09 -0.50 0.02 0.00 -1.03 0.00 0.00 54.13 52.70 3f7j s LEU 106 Cb 0.02 -1.89 -0.25 0.00 0.03 0.00 0.00 46.19 44.10 3f7j s LEU 106 CO -0.06 0.03 1.02 0.44 0.23 0.00 0.00 176.35 178.01 3f7j h ASP 107 N 2.19 0.23 -3.71 2.29 3.32 -1.56 -1.99 116.42 117.18 3f7j h ASP 107 Ca -0.46 -0.29 -0.11 0.00 0.02 0.00 0.00 57.03 56.19 3f7j h ASP 107 Cb 1.23 -0.08 -0.24 0.00 0.22 0.00 0.00 39.33 40.46 3f7j h ASP 107 CO 0.59 1.24 -0.22 -0.22 -1.72 0.00 0.00 179.24 178.91 3f7j s LEU 108 N -6.82 0.20 -0.03 1.55 2.96 -0.89 -1.11 118.68 114.54 3f7j s LEU 108 Ca -0.04 0.90 0.02 0.00 -0.22 0.00 0.00 54.13 54.78 3f7j s LEU 108 Cb 0.08 1.48 0.01 0.00 0.50 0.00 0.00 46.19 48.26 3f7j s LEU 108 CO 0.85 -0.16 -0.06 -0.47 -1.32 0.00 0.00 176.35 175.18 3f7j s TYR 109 N 0.54 0.73 0.01 5.38 5.04 -1.10 -1.94 117.35 126.01 3f7j s TYR 109 Ca -0.03 -0.18 0.07 0.00 -2.44 0.00 0.00 57.07 54.49 3f7j s TYR 109 Cb -0.04 -0.57 -0.02 0.00 0.35 0.00 0.00 41.96 41.67 3f7j s TYR 109 CO -0.03 -0.11 -0.21 -0.51 -1.34 0.00 0.00 175.55 173.35 3f7j s LEU 110 N 0.42 2.09 -0.01 6.97 1.43 -0.67 -2.25 118.68 126.67 3f7j s LEU 110 Ca -0.06 -0.44 -0.30 0.00 -1.03 0.00 0.00 54.13 52.30 3f7j s LEU 110 Cb -0.10 -1.04 -0.06 0.00 0.03 0.00 0.00 46.19 45.02 3f7j s LEU 110 CO 0.00 0.22 1.51 -0.63 0.23 0.00 0.00 176.35 177.69 3f7j s ILE 111 N -0.62 3.55 0.05 -0.59 1.01 -0.81 -0.98 121.20 122.81 3f7j s ILE 111 Ca 0.08 0.88 -0.22 0.00 0.00 0.00 0.00 60.65 61.39 3f7j s ILE 111 Cb -0.08 -3.57 -0.14 0.00 0.01 0.00 0.00 42.46 38.68 3f7j s ILE 111 CO 0.00 -0.03 1.52 -0.74 0.00 0.00 0.00 174.94 175.70 3f7j h HIS 112 N 8.38 0.16 -3.95 3.97 2.76 -1.73 0.29 115.15 125.04 3f7j h HIS 112 Ca -0.39 -0.02 -0.14 0.00 -2.20 0.00 0.00 60.37 57.62 3f7j h HIS 112 Cb 1.18 -0.05 -0.18 0.00 1.55 0.00 0.00 27.41 29.91 3f7j h HIS 112 CO 0.79 0.36 -0.62 -1.58 -1.30 0.00 0.00 177.93 175.58 3f7j s TRP 113 N -5.18 0.28 0.12 5.26 0.52 -1.25 -4.25 118.94 114.44 3f7j s TRP 113 Ca -0.14 -0.62 -0.06 0.00 0.02 0.00 0.00 56.10 55.31 3f7j s TRP 113 Cb 0.05 -0.21 -0.11 0.00 -1.15 0.00 0.00 33.47 32.05 3f7j s TRP 113 CO 0.69 -0.30 1.29 -1.00 0.02 0.00 0.00 176.95 177.66 3f7j h PRO 114 N 3.96 0.45 0.00 4.98 0.13 -1.78 -3.48 132.00 136.26 3f7j h PRO 114 Ca -0.33 -0.48 0.00 0.00 -0.87 0.00 0.00 66.00 64.32 3f7j h PRO 114 Cb 1.18 0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.45 3f7j h PRO 114 CO 0.50 1.14 0.00 0.41 -0.23 0.00 0.00 178.00 179.81 3f7j n GLY 115 N 0.96 2.15 0.10 1.56 0.00 -1.26 -4.33 105.19 104.36 3f7j n GLY 115 Ca -0.07 -0.40 -0.13 0.00 0.00 0.00 0.00 46.02 45.41 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 10.61 0.53 -0.77 1.61 5.02 -0.82 -4.86 118.16 129.50 3f7j n LYS 116 Ca 0.00 0.29 -0.03 0.00 -2.02 0.00 0.00 58.31 56.55 3f7j n LYS 116 Cb 0.00 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.48 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 -4.44 -0.44 0.00 4.39 5.68 -1.26 -4.87 116.55 115.61 3f7j n ASP 117 Ca -0.22 -1.53 0.00 0.00 -0.50 0.00 0.00 54.79 52.53 3f7j n ASP 117 Cb 0.57 0.12 0.00 0.00 -1.14 0.00 0.00 41.12 40.67 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 0.02 0.01 0.11 0.11 5.02 -1.26 -4.80 118.16 117.37 3f7j n LYS 118 Ca -0.13 -0.71 -0.02 0.00 -2.02 0.00 0.00 58.31 55.43 3f7j n LYS 118 Cb 0.62 -0.97 0.03 0.00 -0.02 0.00 0.00 35.03 34.70 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 -0.40 2.13 -0.00 -1.90 -1.48 116.97 115.32 3f7j h TYR 119 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 58.73 58.62 3f7j h TYR 119 Cb 0.16 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 36.87 3f7j h TYR 119 CO 0.00 0.72 -0.19 0.87 -0.00 0.00 0.00 178.16 179.56 3f7j h LYS 120 N 0.00 0.76 -0.45 0.10 1.57 -1.94 0.27 116.57 116.88 3f7j h LYS 120 Ca -0.01 -0.29 -0.09 0.00 -1.87 0.00 0.00 60.65 58.40 3f7j h LYS 120 Cb 1.43 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.68 3f7j h LYS 120 CO 0.09 0.89 -0.06 -0.44 -0.57 0.00 0.00 179.45 179.37 3f7j h ASP 121 N 0.67 0.84 -0.68 0.86 3.45 -1.89 -2.16 116.42 117.52 3f7j h ASP 121 Ca 0.10 -0.34 -0.06 0.00 0.43 0.00 0.00 57.03 57.16 3f7j h ASP 121 Cb 0.69 -0.23 -0.03 0.00 -0.56 0.00 0.00 39.33 39.20 3f7j h ASP 121 CO 0.05 0.98 0.20 0.74 -1.57 0.00 0.00 179.24 179.64 3f7j h THR 122 N 0.68 1.26 -0.71 0.35 2.02 -1.01 -2.54 112.91 112.96 3f7j h THR 122 Ca 0.12 -0.90 -0.04 0.00 0.77 0.00 0.00 66.41 66.36 3f7j h THR 122 Cb 0.58 0.50 -0.03 0.00 -1.74 0.00 0.00 68.15 67.46 3f7j h THR 122 CO 0.04 0.35 0.28 -0.25 0.37 0.00 0.00 175.52 176.30 3f7j h TRP 123 N 1.04 1.10 -0.85 3.16 2.91 -0.25 -2.11 115.95 120.95 3f7j h TRP 123 Ca 0.23 -0.09 0.11 0.00 1.13 0.00 0.00 58.89 60.27 3f7j h TRP 123 Cb 0.31 -0.33 -0.06 0.00 -0.51 0.00 0.00 29.16 28.57 3f7j h TRP 123 CO 0.02 0.85 0.55 0.00 -1.03 0.00 0.00 178.44 178.84 3f7j h ARG 124 N 1.03 0.73 -0.25 2.65 3.08 -0.99 -0.05 114.38 120.58 3f7j h ARG 124 Ca 0.24 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 60.19 3f7j h ARG 124 Cb 0.23 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 3f7j h ARG 124 CO -0.02 0.48 -0.06 0.00 -1.07 0.00 0.00 179.97 179.31 3f7j h ALA 125 N 1.59 0.35 -0.71 0.04 0.00 -1.08 -1.71 119.26 117.74 3f7j h ALA 125 Ca 0.40 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 3f7j h ALA 125 Cb 0.53 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 3f7j h ALA 125 CO -0.17 0.15 0.33 -0.07 0.00 0.00 0.00 179.25 179.49 3f7j h LEU 126 N 0.23 0.93 -0.65 0.00 4.07 -0.94 -1.18 115.31 117.77 3f7j h LEU 126 Ca 0.06 -0.11 0.06 0.00 0.08 0.00 0.00 57.88 57.98 3f7j h LEU 126 Cb 0.53 -0.24 -0.06 0.00 1.08 0.00 0.00 40.66 41.97 3f7j h LEU 126 CO 0.02 0.80 0.35 -0.33 -1.08 0.00 0.00 178.44 178.20 3f7j h GLU 127 N 1.01 0.63 -0.25 1.13 5.08 -0.81 -0.37 114.58 121.00 3f7j h GLU 127 Ca 0.24 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.54 3f7j h GLU 127 Cb 0.13 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 3f7j h GLU 127 CO -0.03 0.41 0.03 -0.22 -1.00 0.00 0.00 179.01 178.21 3f7j h LYS 128 N 0.64 0.42 -0.64 2.33 3.64 -0.83 -0.74 116.57 121.40 3f7j h LYS 128 Ca 0.29 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.53 3f7j h LYS 128 Cb 0.20 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 3f7j h LYS 128 CO -0.19 0.56 0.28 -0.07 -2.27 0.00 0.00 179.45 177.76 3f7j h LEU 129 N 0.23 0.83 -0.09 5.20 3.38 -1.02 0.38 115.31 124.21 3f7j h LEU 129 Ca 0.08 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3f7j h LEU 129 Cb 0.35 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 3f7j h LEU 129 CO 0.01 0.73 0.03 0.22 0.09 0.00 0.00 178.44 179.51 3f7j h TYR 130 N 0.91 0.15 -0.79 1.13 3.20 -0.83 -1.31 116.97 119.42 3f7j h TYR 130 Ca 0.22 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.14 3f7j h TYR 130 Cb 0.13 -0.04 -0.06 0.00 1.54 0.00 0.00 36.73 38.30 3f7j h TYR 130 CO 0.01 0.29 0.47 0.87 -1.64 0.00 0.00 178.16 178.17 3f7j h LYS 131 N -0.03 0.83 0.00 1.82 6.56 -0.45 -1.25 116.57 124.05 3f7j h LYS 131 Ca 0.03 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 3f7j h LYS 131 Cb 0.21 -0.19 0.00 0.00 -0.57 0.00 0.00 32.23 31.69 3f7j h LYS 131 CO -0.00 0.55 0.00 -0.25 -2.06 0.00 0.00 179.45 177.69 3f7j n ASP 132 N -4.69 0.00 -0.18 0.86 8.00 0.06 -4.87 116.55 115.74 3f7j n ASP 132 Ca 0.11 0.14 -0.02 0.00 0.71 0.00 0.00 54.79 55.73 3f7j n ASP 132 Cb 0.19 -0.29 -0.01 0.00 -0.02 0.00 0.00 41.12 41.00 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 -0.40 0.56 0.09 0.44 0.00 -0.47 -4.94 105.19 100.47 3f7j n GLY 133 Ca 0.05 -0.95 0.12 0.00 0.00 0.00 0.00 46.02 45.24 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 0.03 0.00 -3.64 1.61 1.57 -1.42 -3.45 116.57 111.26 3f7j h LYS 134 Ca -0.05 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.40 3f7j h LYS 134 Cb 0.15 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 32.12 3f7j h LYS 134 CO 0.07 0.00 -0.74 0.42 -0.57 0.00 0.00 179.45 178.63 3f7j s ILE 135 N -3.25 0.10 0.03 1.86 1.01 -1.24 -1.93 121.20 117.79 3f7j s ILE 135 Ca 0.04 0.14 0.21 0.00 0.00 0.00 0.00 60.65 61.03 3f7j s ILE 135 Cb 0.12 -0.22 0.18 0.00 0.01 0.00 0.00 42.46 42.55 3f7j s ILE 135 CO 0.75 0.13 1.70 0.03 0.00 0.00 0.00 174.94 177.55 3f7j h ARG 136 N 7.35 0.00 -2.44 2.79 3.08 -1.33 -3.42 114.38 120.42 3f7j h ARG 136 Ca -0.41 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.55 3f7j h ARG 136 Cb 1.13 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 30.99 3f7j h ARG 136 CO 0.45 0.31 0.00 0.00 -1.07 0.00 0.00 179.97 179.67 3f7j s ALA 137 N -3.44 -1.37 0.04 0.04 0.00 -0.27 -4.91 121.76 111.86 3f7j s ALA 137 Ca 0.02 0.90 0.02 0.00 0.00 0.00 0.00 51.96 52.90 3f7j s ALA 137 Cb 0.09 0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.24 3f7j s ALA 137 CO 0.67 -0.33 -0.08 0.96 0.00 0.00 0.00 175.76 176.98 3f7j s ILE 138 N -1.31 0.60 0.00 0.00 -4.36 -1.26 -2.72 121.20 112.15 3f7j s ILE 138 Ca -0.12 -1.00 0.00 0.00 -0.26 0.00 0.00 60.65 59.27 3f7j s ILE 138 Cb -0.02 -0.64 0.00 0.00 1.25 0.00 0.00 42.46 43.05 3f7j s ILE 138 CO 0.07 -0.30 0.00 0.61 0.24 0.00 0.00 174.94 175.56 3f7j n GLY 139 N 1.63 1.96 3.16 6.27 0.00 -0.95 -0.42 105.19 116.84 3f7j n GLY 139 Ca -0.21 -0.44 -0.10 0.00 0.00 0.00 0.00 46.02 45.26 3f7j n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f7j s VAL 140 N -1.44 0.49 -0.02 1.61 0.11 -0.11 -1.93 120.40 119.11 3f7j s VAL 140 Ca 0.00 -1.91 0.04 0.00 -2.93 0.00 0.00 61.98 57.18 3f7j s VAL 140 Cb 0.00 -1.81 -0.01 0.00 -1.53 0.00 0.00 36.38 33.04 3f7j s VAL 140 CO 0.00 -0.74 -0.13 -0.55 -3.33 0.00 0.00 175.10 170.35 3f7j s SER 141 N -3.05 1.59 -1.41 3.54 0.15 0.10 -1.44 113.70 113.18 3f7j s SER 141 Ca 0.16 -0.25 -0.02 0.00 0.70 0.00 0.00 55.95 56.53 3f7j s SER 141 Cb 0.06 -0.24 0.00 0.00 -1.71 0.00 0.00 66.02 64.14 3f7j s SER 141 CO -0.03 0.15 0.33 0.59 1.20 0.00 0.00 173.24 175.48 3f7j n ASN 142 N 2.87 -5.39 -4.80 5.45 3.02 -0.23 -3.89 115.26 112.29 3f7j n ASN 142 Ca -0.15 -0.16 -0.38 0.00 -0.03 0.00 0.00 54.58 53.85 3f7j n ASN 142 Cb 0.55 -4.32 -0.06 0.00 -0.61 0.00 0.00 39.78 35.34 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 -3.02 3.75 0.69 3.10 2.99 -1.26 -4.47 117.98 119.76 3f7j s PHE 143 Ca 0.16 1.17 -0.02 0.00 0.00 0.00 0.00 56.93 58.25 3f7j s PHE 143 Cb -0.07 -2.47 0.10 0.00 0.00 0.00 0.00 43.02 40.58 3f7j s PHE 143 CO 0.20 0.54 0.96 -0.65 -0.00 0.00 0.00 175.22 176.27 3f7j s GLN 144 N -0.87 1.92 0.18 0.44 -1.52 -1.26 -4.90 119.66 113.64 3f7j s GLN 144 Ca 0.28 -0.89 -0.13 0.00 -1.95 0.00 0.00 55.36 52.67 3f7j s GLN 144 Cb -0.18 -2.33 0.15 0.00 -0.22 0.00 0.00 33.01 30.43 3f7j s GLN 144 CO 0.17 -1.28 1.77 0.28 -0.25 0.00 0.00 175.29 175.98 3f7j h VAL 145 N -0.44 0.90 -0.74 1.09 2.07 -1.96 -1.86 116.25 115.31 3f7j h VAL 145 Ca -0.39 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 3f7j h VAL 145 Cb 1.28 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 3f7j h VAL 145 CO 0.46 0.08 0.38 1.12 0.02 0.00 0.00 177.57 179.62 3f7j h HIS 146 N 0.42 1.02 -0.83 1.57 2.07 -1.99 -1.39 115.15 116.04 3f7j h HIS 146 Ca 0.23 -0.03 -0.02 0.00 -2.85 0.00 0.00 60.37 57.70 3f7j h HIS 146 Cb 0.19 -0.32 -0.04 0.00 2.57 0.00 0.00 27.41 29.81 3f7j h HIS 146 CO -0.13 0.73 0.46 0.45 -3.07 0.00 0.00 177.93 176.37 3f7j h HIS 147 N 1.04 1.13 -0.19 6.12 3.86 -1.82 -1.52 115.15 123.78 3f7j h HIS 147 Ca 0.26 -0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.40 3f7j h HIS 147 Cb 0.07 -0.36 -0.01 0.00 1.06 0.00 0.00 27.41 28.17 3f7j h HIS 147 CO 0.01 0.78 -0.04 -0.07 0.86 0.00 0.00 177.93 179.48 3f7j h LEU 148 N 1.15 0.35 -0.69 2.43 3.38 -1.03 -0.95 115.31 119.94 3f7j h LEU 148 Ca 0.29 -0.36 0.02 0.00 0.09 0.00 0.00 57.88 57.93 3f7j h LEU 148 Cb 0.02 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 3f7j h LEU 148 CO -0.05 0.63 0.44 -0.33 0.09 0.00 0.00 178.44 179.22 3f7j h GLU 149 N 0.07 0.85 0.05 1.13 5.08 -1.17 0.22 114.58 120.82 3f7j h GLU 149 Ca 0.05 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3f7j h GLU 149 Cb 0.47 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3f7j h GLU 149 CO 0.02 0.56 -0.03 1.49 -1.00 0.00 0.00 179.01 180.05 3f7j h GLU 150 N 0.88 -0.07 -0.27 2.33 4.57 -1.23 -2.87 114.58 117.93 3f7j h GLU 150 Ca 0.27 0.00 0.05 0.00 -1.18 0.00 0.00 59.36 58.50 3f7j h GLU 150 Cb -0.02 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.54 3f7j h GLU 150 CO -0.09 0.01 -0.02 1.25 -1.18 0.00 0.00 179.01 178.98 3f7j h LEU 151 N -0.14 -0.15 -2.28 1.64 7.12 -0.76 -2.66 115.31 118.07 3f7j h LEU 151 Ca -0.01 0.07 0.04 0.00 0.13 0.00 0.00 57.88 58.11 3f7j h LEU 151 Cb 0.12 0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 40.37 3f7j h LEU 151 CO 0.01 -0.04 0.14 -0.07 -0.13 0.00 0.00 178.44 178.35 3f7j h LEU 152 N 0.05 0.00 -0.62 2.25 3.38 -0.51 -1.94 115.31 117.92 3f7j h LEU 152 Ca 0.13 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.23 3f7j h LEU 152 Cb 0.18 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.82 3f7j h LEU 152 CO -0.23 0.00 -0.05 0.11 0.09 0.00 0.00 178.44 178.36 3f7j h LYS 153 N 0.00 0.07 -0.00 1.13 1.57 -1.24 -3.30 116.57 114.80 3f7j h LYS 153 Ca 0.06 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3f7j h LYS 153 Cb 0.33 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3f7j h LYS 153 CO -0.00 0.05 -0.00 -0.25 -0.57 0.00 0.00 179.45 178.67 3f7j n ASP 154 N -5.33 1.07 -4.77 0.86 8.00 -1.04 -5.04 116.55 110.30 3f7j n ASP 154 Ca 0.09 -1.04 -0.39 0.00 0.71 0.00 0.00 54.79 54.16 3f7j n ASP 154 Cb 0.35 0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.51 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 -0.19 3.23 -0.03 2.24 0.00 -0.76 -4.93 121.76 121.32 3f7j s ALA 155 Ca 0.02 1.27 -0.05 0.00 0.00 0.00 0.00 51.96 53.20 3f7j s ALA 155 Cb 0.01 -3.51 -0.28 0.00 0.00 0.00 0.00 23.12 19.34 3f7j s ALA 155 CO 0.02 -0.92 0.73 0.93 0.00 0.00 0.00 175.76 176.52 3f7j h GLU 156 N 2.53 0.28 -5.32 0.00 5.08 -1.93 -3.46 114.58 111.76 3f7j h GLU 156 Ca -0.50 -0.48 -0.68 0.00 -1.00 0.00 0.00 59.36 56.71 3f7j h GLU 156 Cb 1.25 0.18 -0.32 0.00 0.50 0.00 0.00 28.75 30.36 3f7j h GLU 156 CO 0.62 1.15 -0.86 0.42 -1.00 0.00 0.00 179.01 179.34 3f7j s ILE 157 N -2.60 2.23 0.28 3.13 1.01 -1.26 -5.12 121.20 118.87 3f7j s ILE 157 Ca -0.12 -0.96 -0.29 0.00 0.00 0.00 0.00 60.65 59.28 3f7j s ILE 157 Cb 0.06 -1.87 -0.10 0.00 0.01 0.00 0.00 42.46 40.57 3f7j s ILE 157 CO 0.84 0.55 1.10 -0.75 0.00 0.00 0.00 174.94 176.68 3f7j s LYS 158 N 0.41 4.64 0.32 2.79 2.20 -1.26 -4.98 119.74 123.85 3f7j s LYS 158 Ca -0.16 1.81 -0.27 0.00 -0.36 0.00 0.00 55.97 56.98 3f7j s LYS 158 Cb -0.17 -3.19 -0.13 0.00 -1.51 0.00 0.00 37.83 32.82 3f7j s LYS 158 CO 0.07 0.21 0.99 -2.30 -0.36 0.00 0.00 175.35 173.96 3f7j n PRO 159 N 1.21 1.34 0.05 4.03 -0.02 -1.26 -4.91 135.00 135.42 3f7j n PRO 159 Ca -0.01 0.47 0.11 0.00 -2.02 0.00 0.00 63.50 62.05 3f7j n PRO 159 Cb 0.45 -1.87 -0.08 0.00 -0.02 0.00 0.00 33.50 31.97 3f7j n PRO 159 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3f7j n MET 160 N 0.61 0.62 -3.85 -0.52 2.81 0.44 -4.62 117.12 112.62 3f7j n MET 160 Ca 0.09 -0.04 -0.12 0.00 -1.81 0.00 0.00 57.70 55.83 3f7j n MET 160 Cb 0.34 -1.67 -0.12 0.00 -0.71 0.00 0.00 33.22 31.06 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 -3.43 0.03 -0.23 2.03 1.01 -1.26 -2.19 120.40 116.36 3f7j s VAL 161 Ca -0.04 -0.28 0.01 0.00 0.00 0.00 0.00 61.98 61.67 3f7j s VAL 161 Cb 0.12 -0.26 0.06 0.00 0.00 0.00 0.00 36.38 36.29 3f7j s VAL 161 CO 0.85 -0.15 -0.07 0.21 0.00 0.00 0.00 175.10 175.94 3f7j s ASN 162 N -0.48 3.83 -0.40 3.32 2.47 0.01 -0.94 114.94 122.75 3f7j s ASN 162 Ca -0.06 -1.15 -0.18 0.00 0.42 0.00 0.00 52.86 51.90 3f7j s ASN 162 Cb -0.04 -1.23 0.01 0.00 -1.45 0.00 0.00 41.25 38.54 3f7j s ASN 162 CO 0.00 -0.21 0.48 -1.58 -3.72 0.00 0.00 177.10 172.08 3f7j s GLN 163 N 1.36 3.31 0.20 0.43 0.74 -0.52 -1.39 119.66 123.79 3f7j s GLN 163 Ca -0.05 -0.51 0.08 0.00 0.05 0.00 0.00 55.36 54.92 3f7j s GLN 163 Cb -0.18 -3.91 -0.05 0.00 1.10 0.00 0.00 33.01 29.97 3f7j s GLN 163 CO -0.06 -0.79 -0.14 0.14 -0.55 0.00 0.00 175.29 173.88 3f7j s VAL 164 N 2.31 1.69 0.14 1.34 -7.23 0.73 -1.06 120.40 118.32 3f7j s VAL 164 Ca 0.15 -2.18 -0.33 0.00 -1.81 0.00 0.00 61.98 57.82 3f7j s VAL 164 Cb -0.16 -2.01 -0.13 0.00 0.56 0.00 0.00 36.38 34.64 3f7j s VAL 164 CO 0.14 -0.59 1.69 1.21 -0.31 0.00 0.00 175.10 177.24 3f7j n GLU 165 N -0.32 2.41 -3.61 4.82 2.13 -1.26 -0.10 120.64 124.71 3f7j n GLU 165 Ca -0.09 0.87 -0.06 0.00 0.66 0.00 0.00 57.16 58.55 3f7j n GLU 165 Cb 0.60 -2.69 -0.08 0.00 0.27 0.00 0.00 31.44 29.55 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 1.64 -0.97 0.26 4.31 2.19 -1.16 -4.86 117.98 119.38 3f7j s PHE 166 Ca 0.80 1.67 -0.20 0.00 0.33 0.00 0.00 56.93 59.53 3f7j s PHE 166 Cb -0.61 0.41 0.06 0.00 -1.31 0.00 0.00 43.02 41.58 3f7j s PHE 166 CO 0.38 -0.57 0.92 -3.38 1.83 0.00 0.00 175.22 174.40 3f7j s HIS 167 N 2.69 0.05 0.62 10.12 -3.43 -0.86 -4.34 115.29 120.14 3f7j s HIS 167 Ca -0.00 -0.55 0.35 0.00 -0.80 0.00 0.00 55.06 54.06 3f7j s HIS 167 Cb -0.12 0.75 2.00 0.00 -1.43 0.00 0.00 32.58 33.77 3f7j s HIS 167 CO -0.15 -1.17 2.24 -1.35 -2.00 0.00 0.00 174.74 172.31 3f7j h PRO 168 N 2.00 0.00 0.00 -0.38 0.11 -1.88 -0.35 132.00 131.50 3f7j h PRO 168 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3f7j h PRO 168 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3f7j h PRO 168 CO 0.36 0.00 -0.14 0.54 -0.21 0.00 0.00 178.00 178.55 3f7j n ARG 169 N -3.50 0.03 -3.23 1.05 5.12 -1.26 -2.05 116.66 112.82 3f7j n ARG 169 Ca -0.02 0.02 -0.21 0.00 -1.93 0.00 0.00 57.85 55.71 3f7j n ARG 169 Cb 0.15 -1.53 -0.07 0.00 -1.16 0.00 0.00 32.46 29.84 3f7j n ARG 169 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 3f7j s LEU 170 N -3.18 0.65 0.00 0.55 0.20 -0.15 -1.33 118.68 115.41 3f7j s LEU 170 Ca 0.13 -2.69 0.28 0.00 0.69 0.00 0.00 54.13 52.53 3f7j s LEU 170 Cb 0.18 0.17 1.00 0.00 -0.43 0.00 0.00 46.19 47.11 3f7j s LEU 170 CO 0.58 -0.14 1.74 0.35 -0.29 0.00 0.00 176.35 178.59 3f7j n THR 171 N 2.92 0.00 -3.93 3.68 -2.24 -1.17 -2.03 114.28 111.51 3f7j n THR 171 Ca 0.26 -0.01 -0.29 0.00 -2.27 0.00 0.00 64.05 61.74 3f7j n THR 171 Cb 0.50 -0.16 0.01 0.00 -2.10 0.00 0.00 70.33 68.58 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 -1.37 -4.79 0.24 -0.78 1.13 -1.26 -4.87 117.38 105.67 3f7j n GLN 172 Ca 0.08 0.55 -0.16 0.00 -1.94 0.00 0.00 57.00 55.53 3f7j n GLN 172 Cb 0.32 -5.26 -0.08 0.00 0.11 0.00 0.00 30.24 25.33 3f7j n GLN 172 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 3f7j h LYS 173 N -1.93 -0.53 -0.59 -1.09 1.63 -1.99 0.16 116.57 112.23 3f7j h LYS 173 Ca -0.59 0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.22 3f7j h LYS 173 Cb 1.37 0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 33.09 3f7j h LYS 173 CO 0.66 -0.34 0.29 1.49 -3.45 0.00 0.00 179.45 178.10 3f7j h GLU 174 N -0.56 0.82 -0.28 1.90 4.81 -2.00 -2.30 114.58 116.97 3f7j h GLU 174 Ca -0.06 -0.10 -0.19 0.00 -0.13 0.00 0.00 59.36 58.89 3f7j h GLU 174 Cb 0.42 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.65 3f7j h GLU 174 CO 0.09 0.63 -0.56 1.25 -0.73 0.00 0.00 179.01 179.70 3f7j h LEU 175 N 0.82 0.96 -0.22 1.64 5.85 -1.87 -1.12 115.31 121.38 3f7j h LEU 175 Ca 0.21 -0.52 0.02 0.00 0.84 0.00 0.00 57.88 58.42 3f7j h LEU 175 Cb 0.07 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 3f7j h LEU 175 CO -0.03 1.32 0.08 0.03 -0.34 0.00 0.00 178.44 179.51 3f7j h ARG 176 N 0.66 0.19 -0.73 1.25 3.08 -0.51 -0.32 114.38 118.00 3f7j h ARG 176 Ca 0.01 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 3f7j h ARG 176 Cb 1.16 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 31.14 3f7j h ARG 176 CO 0.12 0.12 0.44 -0.44 -1.07 0.00 0.00 179.97 179.15 3f7j h ASP 177 N 0.19 0.88 0.24 7.04 3.32 -1.39 -0.91 116.42 125.80 3f7j h ASP 177 Ca 0.09 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 3f7j h ASP 177 Cb 0.05 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.38 3f7j h ASP 177 CO -0.08 0.68 -0.12 0.22 -1.72 0.00 0.00 179.24 178.22 3f7j h TYR 178 N 1.00 -0.30 -0.66 4.55 5.03 -0.81 -2.34 116.97 123.43 3f7j h TYR 178 Ca 0.26 -0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.56 3f7j h TYR 178 Cb -0.04 0.10 -0.03 0.00 1.55 0.00 0.00 36.73 38.31 3f7j h TYR 178 CO -0.01 -0.04 0.41 0.00 -1.32 0.00 0.00 178.16 177.20 3f7j h LYS 180 N 0.90 -0.45 -0.25 0.00 1.63 -1.13 -0.53 116.57 116.74 3f7j h LYS 180 Ca 0.24 0.03 0.07 0.00 -0.85 0.00 0.00 60.65 60.14 3f7j h LYS 180 Cb -0.05 0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 31.68 3f7j h LYS 180 CO -0.05 -0.30 0.26 0.78 -3.45 0.00 0.00 179.45 176.69 3f7j h GLY 181 N -0.47 0.00 0.16 5.01 0.00 -1.17 -2.00 103.07 104.60 3f7j h GLY 181 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 3f7j h GLY 181 CO -0.37 0.00 -0.30 -1.06 0.00 0.00 0.00 176.54 174.81 3f7j n GLN 182 N -3.85 0.82 -2.37 4.80 1.13 -0.74 -4.97 117.38 112.20 3f7j n GLN 182 Ca 0.03 -0.51 -0.12 0.00 -1.94 0.00 0.00 57.00 54.47 3f7j n GLN 182 Cb 0.40 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.26 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 1.36 -0.06 3.41 1.08 0.00 -0.40 -5.02 105.19 105.56 3f7j n GLY 183 Ca 0.11 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.68 4.03 -0.17 -0.61 1.01 -0.35 -4.51 121.20 117.93 3f7j s ILE 184 Ca 0.06 -0.27 -0.29 0.00 0.00 0.00 0.00 60.65 60.14 3f7j s ILE 184 Cb -0.02 -2.87 -0.00 0.00 0.01 0.00 0.00 42.46 39.57 3f7j s ILE 184 CO 0.07 0.37 1.07 -1.58 0.00 0.00 0.00 174.94 174.87 3f7j s GLN 185 N 1.54 4.31 0.34 2.79 2.00 -0.93 -4.00 119.66 125.71 3f7j s GLN 185 Ca 0.06 1.44 -0.25 0.00 -2.00 0.00 0.00 55.36 54.60 3f7j s GLN 185 Cb -0.15 -3.62 -0.10 0.00 0.80 0.00 0.00 33.01 29.94 3f7j s GLN 185 CO 0.02 -0.54 0.94 -1.17 -0.50 0.00 0.00 175.29 174.04 3f7j s LEU 186 N 2.84 4.27 0.00 3.68 2.96 -1.26 -0.81 118.68 130.35 3f7j s LEU 186 Ca 0.48 1.81 0.01 0.00 -0.22 0.00 0.00 54.13 56.21 3f7j s LEU 186 Cb -0.18 -4.11 -0.01 0.00 0.50 0.00 0.00 46.19 42.40 3f7j s LEU 186 CO 0.12 -0.12 -0.04 -0.70 -1.32 0.00 0.00 176.35 174.29 3f7j s GLU 187 N -2.26 0.34 -0.46 1.98 2.12 -0.49 -2.19 118.70 117.75 3f7j s GLU 187 Ca 0.52 -0.20 -0.16 0.00 0.36 0.00 0.00 54.97 55.50 3f7j s GLU 187 Cb -0.17 -0.30 0.06 0.00 0.26 0.00 0.00 34.13 33.98 3f7j s GLU 187 CO 0.22 0.08 0.38 0.00 -0.54 0.00 0.00 175.26 175.40 3f7j s ALA 188 N -0.23 3.53 0.29 6.30 0.00 -0.02 -0.19 121.76 131.45 3f7j s ALA 188 Ca 0.00 -1.99 -0.28 0.00 0.00 0.00 0.00 51.96 49.69 3f7j s ALA 188 Cb -0.02 -3.04 -0.09 0.00 0.00 0.00 0.00 23.12 19.96 3f7j s ALA 188 CO -0.00 -1.67 1.01 -0.46 0.00 0.00 0.00 175.76 174.63 3f7j s TRP 189 N 1.70 3.71 -1.31 0.00 -0.00 0.85 -3.19 118.94 120.70 3f7j s TRP 189 Ca 0.05 1.79 -0.10 0.00 -0.00 0.00 0.00 56.10 57.84 3f7j s TRP 189 Cb -0.23 -3.09 0.00 0.00 -0.00 0.00 0.00 33.47 30.15 3f7j s TRP 189 CO 0.08 -0.07 0.54 0.43 -0.00 0.00 0.00 176.95 177.93 3f7j n SER 190 N 1.03 -2.15 0.28 5.86 7.64 -1.26 -3.00 113.62 122.01 3f7j n SER 190 Ca -0.00 -1.05 0.18 0.00 1.01 0.00 0.00 58.87 59.01 3f7j n SER 190 Cb 0.47 -2.98 0.80 0.00 -1.01 0.00 0.00 64.21 61.49 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 -1.93 0.00 -0.27 1.43 0.13 -1.76 -1.62 132.00 127.99 3f7j h PRO 191 Ca -0.65 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.48 3f7j h PRO 191 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 3f7j h PRO 191 CO 0.57 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.62 3f7j n LEU 192 N -3.02 1.56 -3.21 1.56 4.77 -1.26 -4.67 117.00 112.73 3f7j n LEU 192 Ca -0.00 -0.76 -0.22 0.00 -0.03 0.00 0.00 56.01 55.00 3f7j n LEU 192 Cb 0.24 -0.18 0.01 0.00 -2.33 0.00 0.00 43.42 41.16 3f7j n LEU 192 CO 0.25 0.38 -0.03 0.80 -1.33 0.00 0.00 177.39 177.45 3f7j n MET 193 N 0.33 -3.74 -4.14 3.23 0.00 -0.61 -1.35 117.12 110.84 3f7j n MET 193 Ca 0.11 0.60 -0.31 0.00 -0.00 0.00 0.00 57.70 58.11 3f7j n MET 193 Cb 0.26 -5.34 -0.04 0.00 0.00 0.00 0.00 33.22 28.10 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 -3.75 -2.64 -0.91 2.12 6.02 -1.26 -1.78 117.38 115.18 3f7j n GLN 194 Ca -0.05 0.32 0.00 0.00 -0.01 0.00 0.00 57.00 57.26 3f7j n GLN 194 Cb 0.57 -4.51 0.00 0.00 1.02 0.00 0.00 30.24 27.31 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 -1.89 0.91 0.00 1.08 0.00 -0.46 -4.90 105.19 99.93 3f7j n GLY 195 Ca -0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.10 0.28 -0.11 1.61 6.02 -0.73 -2.59 117.38 119.75 3f7j n GLN 196 Ca 0.00 0.07 0.07 0.00 -0.01 0.00 0.00 57.00 57.13 3f7j n GLN 196 Cb 0.00 -1.50 0.13 0.00 1.02 0.00 0.00 30.24 29.89 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 2.67 -0.32 1.08 4.77 -1.26 -4.75 117.00 117.86 3f7j n LEU 197 Ca 0.10 -1.49 0.19 0.00 -0.03 0.00 0.00 56.01 54.78 3f7j n LEU 197 Cb 0.21 -0.15 0.40 0.00 -2.33 0.00 0.00 43.42 41.55 3f7j n LEU 197 CO 0.19 0.59 1.08 0.25 -1.33 0.00 0.00 177.39 178.17 3f7j h LEU 198 N 2.69 0.41 -2.97 2.23 5.85 -1.84 -0.77 115.31 120.90 3f7j h LEU 198 Ca 0.00 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.90 3f7j h LEU 198 Cb 0.69 0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.87 3f7j h LEU 198 CO 0.00 -0.08 0.00 0.47 -0.34 0.00 0.00 178.44 178.49 3f7j n ASP 199 N -5.06 3.65 -4.69 1.25 8.00 -1.26 -4.83 116.55 113.60 3f7j n ASP 199 Ca 0.27 -2.24 -0.42 0.00 0.71 0.00 0.00 54.79 53.11 3f7j n ASP 199 Cb 0.84 -0.40 -0.03 0.00 -0.02 0.00 0.00 41.12 41.51 3f7j n ASP 199 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3f7j s ASN 200 N -1.12 6.50 0.21 -2.24 3.84 -0.30 -4.90 114.94 116.93 3f7j s ASN 200 Ca 0.37 2.65 -0.07 0.00 0.21 0.00 0.00 52.86 56.02 3f7j s ASN 200 Cb 0.22 -2.57 0.15 0.00 -0.55 0.00 0.00 41.25 38.51 3f7j s ASN 200 CO 0.20 -0.94 1.69 -0.33 -2.79 0.00 0.00 177.10 174.92 3f7j h GLU 201 N 8.21 1.01 0.24 0.43 5.08 -1.94 -0.15 114.58 127.46 3f7j h GLU 201 Ca -0.44 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 57.62 3f7j h GLU 201 Cb 1.21 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.35 3f7j h GLU 201 CO 0.94 0.97 -0.15 0.28 -1.00 0.00 0.00 179.01 180.05 3f7j h VAL 202 N 0.93 0.69 -0.37 3.13 2.07 -1.98 -2.56 116.25 118.15 3f7j h VAL 202 Ca 0.17 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.62 3f7j h VAL 202 Cb 0.50 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 3f7j h VAL 202 CO 0.02 0.00 -0.07 -0.07 0.02 0.00 0.00 177.57 177.48 3f7j h LEU 203 N -0.38 0.60 -0.89 2.57 3.38 -1.89 -2.88 115.31 115.82 3f7j h LEU 203 Ca -0.02 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.72 3f7j h LEU 203 Cb 0.31 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3f7j h LEU 203 CO 0.03 0.71 -0.00 0.71 0.09 0.00 0.00 178.44 179.97 3f7j h THR 204 N 0.58 1.25 -0.63 0.22 1.35 -0.96 0.02 112.91 114.73 3f7j h THR 204 Ca 0.11 -1.02 -0.08 0.00 -0.55 0.00 0.00 66.41 64.87 3f7j h THR 204 Cb 0.47 0.88 -0.02 0.00 -1.73 0.00 0.00 68.15 67.74 3f7j h THR 204 CO 0.02 0.36 0.08 0.06 -0.25 0.00 0.00 175.52 175.80 3f7j h GLN 205 N 0.76 1.06 -0.05 4.72 3.07 -1.31 0.16 115.11 123.52 3f7j h GLN 205 Ca 0.15 -0.29 -0.01 0.00 0.09 0.00 0.00 58.65 58.59 3f7j h GLN 205 Cb 0.47 -0.12 -0.00 0.00 0.08 0.00 0.00 27.48 27.91 3f7j h GLN 205 CO 0.02 0.99 0.01 0.82 0.09 0.00 0.00 178.83 180.76 3f7j h ILE 206 N 0.97 1.20 -0.32 1.86 2.04 -1.30 -1.78 117.51 120.18 3f7j h ILE 206 Ca 0.19 -0.59 0.07 0.00 1.00 0.00 0.00 64.86 65.53 3f7j h ILE 206 Cb 0.46 1.50 -0.08 0.00 -0.74 0.00 0.00 36.82 37.96 3f7j h ILE 206 CO 0.02 0.16 -0.25 0.00 0.00 0.00 0.00 178.15 178.07 3f7j h ALA 207 N 0.78 -0.09 -0.18 1.87 0.00 -0.87 -1.95 119.26 118.82 3f7j h ALA 207 Ca 0.02 0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.08 3f7j h ALA 207 Cb 0.25 0.55 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 3f7j h ALA 207 CO 0.00 -0.66 -0.23 0.93 0.00 0.00 0.00 179.25 179.29 3f7j h GLU 208 N -0.22 -0.26 -0.49 0.00 5.08 -0.59 0.52 114.58 118.62 3f7j h GLU 208 Ca 0.16 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.64 3f7j h GLU 208 Cb 0.48 0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.70 3f7j h GLU 208 CO -0.45 -0.17 -0.02 -0.22 -1.00 0.00 0.00 179.01 177.15 3f7j h LYS 209 N -0.27 0.09 -0.02 2.33 3.64 -1.05 -1.59 116.57 119.71 3f7j h LYS 209 Ca 0.12 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 3f7j h LYS 209 Cb 0.44 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 3f7j h LYS 209 CO -0.33 0.06 0.00 0.72 -2.27 0.00 0.00 179.45 177.63 3f7j n HIS 210 N -5.25 0.02 -3.89 1.91 8.25 -0.76 -4.91 115.22 110.59 3f7j n HIS 210 Ca 0.05 -0.01 -0.28 0.00 -0.26 0.00 0.00 57.72 57.22 3f7j n HIS 210 Cb 0.27 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.40 3f7j n HIS 210 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3f7j n ASN 211 N -0.47 -3.61 -4.52 0.41 2.85 -0.08 -5.01 115.26 104.84 3f7j n ASN 211 Ca 0.21 -0.82 -0.27 0.00 -0.11 0.00 0.00 54.58 53.59 3f7j n ASN 211 Cb 0.21 -3.80 -0.09 0.00 1.24 0.00 0.00 39.78 37.33 3f7j n ASN 211 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 3f7j s LYS 212 N -6.49 1.95 0.47 1.20 -0.14 -0.02 -5.02 119.74 111.68 3f7j s LYS 212 Ca 0.48 -2.16 -0.04 0.00 -1.36 0.00 0.00 55.97 52.89 3f7j s LYS 212 Cb -0.24 -1.22 -0.03 0.00 -1.68 0.00 0.00 37.83 34.66 3f7j s LYS 212 CO 0.84 -0.26 0.75 -1.54 -0.76 0.00 0.00 175.35 174.38 3f7j s SER 213 N -3.68 6.16 0.26 2.83 1.04 -1.26 -4.28 113.70 114.77 3f7j s SER 213 Ca 0.25 0.77 -0.03 0.00 0.48 0.00 0.00 55.95 57.42 3f7j s SER 213 Cb 0.06 -2.10 0.40 0.00 0.10 0.00 0.00 66.02 64.48 3f7j s SER 213 CO 0.12 -0.59 1.88 0.58 0.98 0.00 0.00 173.24 176.21 3f7j h VAL 214 N 0.28 1.08 -0.76 5.02 2.07 -1.88 -1.33 116.25 120.74 3f7j h VAL 214 Ca -0.47 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 66.63 3f7j h VAL 214 Cb 1.22 -0.18 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 3f7j h VAL 214 CO 0.61 0.21 0.40 0.00 0.02 0.00 0.00 177.57 178.81 3f7j h ALA 215 N 1.45 0.97 -0.56 1.67 0.00 -1.94 -1.29 119.26 119.55 3f7j h ALA 215 Ca 0.43 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.23 3f7j h ALA 215 Cb 0.17 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3f7j h ALA 215 CO -0.17 0.50 0.36 1.96 0.00 0.00 0.00 179.25 181.89 3f7j h GLN 216 N 1.05 0.70 0.07 0.00 4.20 -1.71 -1.93 115.11 117.50 3f7j h GLN 216 Ca 0.26 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.94 3f7j h GLN 216 Cb 0.06 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 3f7j h GLN 216 CO -0.04 0.46 -0.13 0.28 -0.67 0.00 0.00 178.83 178.74 3f7j h VAL 217 N 0.72 0.70 -0.38 -0.54 2.07 -0.89 -1.38 116.25 116.55 3f7j h VAL 217 Ca 0.22 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.78 3f7j h VAL 217 Cb -0.03 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 30.40 3f7j h VAL 217 CO -0.07 0.00 0.12 0.40 0.02 0.00 0.00 177.57 178.04 3f7j h ILE 218 N -0.25 0.87 -0.52 4.57 2.04 -1.14 -0.49 117.51 122.60 3f7j h ILE 218 Ca 0.02 -0.09 -0.05 0.00 1.00 0.00 0.00 64.86 65.73 3f7j h ILE 218 Cb 0.27 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 3f7j h ILE 218 CO -0.07 0.05 0.12 -0.07 0.00 0.00 0.00 178.15 178.17 3f7j h LEU 219 N 0.27 0.79 -1.05 1.44 -0.00 -1.32 -0.12 115.31 115.32 3f7j h LEU 219 Ca 0.18 -0.24 0.02 0.00 -0.00 0.00 0.00 57.88 57.84 3f7j h LEU 219 Cb 0.16 -0.21 -0.05 0.00 -0.00 0.00 0.00 40.66 40.56 3f7j h LEU 219 CO -0.19 0.82 0.64 -0.09 -0.00 0.00 0.00 178.44 179.63 3f7j h ARG 220 N 0.72 1.23 -0.73 1.13 9.65 -1.02 -1.50 114.38 123.85 3f7j h ARG 220 Ca 0.16 -0.07 0.02 0.00 -1.10 0.00 0.00 59.98 58.99 3f7j h ARG 220 Cb 0.35 -0.28 -0.04 0.00 -1.39 0.00 0.00 29.97 28.61 3f7j h ARG 220 CO 0.00 0.82 0.47 2.35 2.80 0.00 0.00 179.97 186.41 3f7j h TRP 221 N 1.27 0.89 0.06 2.20 7.01 -0.54 0.18 115.95 127.02 3f7j h TRP 221 Ca 0.37 0.02 0.02 0.00 2.11 0.00 0.00 58.89 61.42 3f7j h TRP 221 Cb -0.07 -0.30 -0.04 0.00 -2.10 0.00 0.00 29.16 26.66 3f7j h TRP 221 CO -0.00 0.53 -0.23 -0.44 -2.79 0.00 0.00 178.44 175.51 3f7j h ASP 222 N 0.94 -0.67 -0.54 2.65 3.32 -0.28 -0.96 116.42 120.89 3f7j h ASP 222 Ca 0.28 0.08 0.02 0.00 0.02 0.00 0.00 57.03 57.44 3f7j h ASP 222 Cb -0.04 0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 3f7j h ASP 222 CO -0.09 -0.31 0.34 -0.07 -1.72 0.00 0.00 179.24 177.39 3f7j h LEU 223 N -0.40 0.56 -1.81 1.55 3.38 -0.93 -1.91 115.31 115.75 3f7j h LEU 223 Ca 0.04 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 3f7j h LEU 223 Cb 0.45 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 3f7j h LEU 223 CO -0.17 0.40 -0.14 1.56 0.09 0.00 0.00 178.44 180.18 3f7j h GLN 224 N 0.68 0.00 -0.00 1.13 4.20 -0.85 -1.23 115.11 119.03 3f7j h GLN 224 Ca 0.21 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.92 3f7j h GLN 224 Cb -0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.77 3f7j h GLN 224 CO -0.08 0.14 -0.01 0.72 -0.67 0.00 0.00 178.83 178.94 3f7j n HIS 225 N -3.73 0.00 -2.19 2.96 8.25 -0.37 -4.94 115.22 115.20 3f7j n HIS 225 Ca -0.02 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.35 3f7j n HIS 225 Cb 0.26 -0.02 -0.00 0.00 1.12 0.00 0.00 29.99 31.34 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 1.07 0.02 3.40 -1.41 0.00 -0.46 -5.03 105.19 102.78 3f7j n GLY 226 Ca 0.22 -0.51 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.46 3.67 0.43 1.61 1.01 -0.77 -4.72 120.40 119.17 3f7j s VAL 227 Ca 0.01 -0.41 -0.25 0.00 0.00 0.00 0.00 61.98 61.32 3f7j s VAL 227 Cb -0.00 -2.65 -0.08 0.00 0.00 0.00 0.00 36.38 33.65 3f7j s VAL 227 CO 0.01 0.44 1.34 -0.69 0.00 0.00 0.00 175.10 176.20 3f7j s VAL 228 N 0.99 2.43 -0.00 2.92 1.01 -0.93 -4.09 120.40 122.73 3f7j s VAL 228 Ca 0.01 0.38 0.02 0.00 0.00 0.00 0.00 61.98 62.38 3f7j s VAL 228 Cb -0.15 -3.22 -0.01 0.00 0.00 0.00 0.00 36.38 33.01 3f7j s VAL 228 CO 0.01 0.05 -0.06 0.28 0.00 0.00 0.00 175.10 175.37 3f7j s THR 229 N -1.26 0.50 -0.48 3.92 -1.32 -0.25 -0.84 115.64 115.92 3f7j s THR 229 Ca 0.59 -0.33 0.08 0.00 -1.21 0.00 0.00 61.69 60.83 3f7j s THR 229 Cb -0.40 -0.44 0.29 0.00 -1.51 0.00 0.00 72.50 70.45 3f7j s THR 229 CO 0.51 0.11 0.71 2.30 -2.21 0.00 0.00 174.62 176.03 3f7j n ILE 230 N 2.82 0.91 -1.87 5.08 -5.35 -1.19 -0.60 119.36 119.16 3f7j n ILE 230 Ca -0.14 -4.76 -0.39 0.00 -0.27 0.00 0.00 62.75 57.20 3f7j n ILE 230 Cb 0.58 -1.45 0.02 0.00 -1.74 0.00 0.00 39.64 37.05 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 -2.26 3.46 0.08 6.28 0.04 -1.19 -2.79 135.00 138.62 3f7j s PRO 231 Ca 0.40 2.23 -0.20 0.00 0.04 0.00 0.00 61.00 63.47 3f7j s PRO 231 Cb 0.23 -2.44 -0.07 0.00 0.04 0.00 0.00 34.50 32.26 3f7j s PRO 231 CO -0.08 -0.93 0.59 0.21 0.04 0.00 0.00 177.00 176.82 3f7j s LYS 232 N -2.68 4.24 -0.28 4.56 2.20 -1.26 -1.86 119.74 124.66 3f7j s LYS 232 Ca 0.66 0.78 -0.23 0.00 -0.36 0.00 0.00 55.97 56.82 3f7j s LYS 232 Cb -0.40 -3.24 0.11 0.00 -1.51 0.00 0.00 37.83 32.79 3f7j s LYS 232 CO 0.49 0.62 0.94 0.45 -0.36 0.00 0.00 175.35 177.49 3f7j s SER 233 N -1.07 -0.55 -0.25 1.43 0.15 -1.26 -5.00 113.70 107.15 3f7j s SER 233 Ca 0.30 1.01 0.01 0.00 0.70 0.00 0.00 55.95 57.97 3f7j s SER 233 Cb -0.20 1.08 -0.16 0.00 -1.71 0.00 0.00 66.02 65.03 3f7j s SER 233 CO 0.20 -0.17 -0.22 -0.38 1.20 0.00 0.00 173.24 173.86 3f7j n ILE 234 N 2.74 1.41 -2.74 6.45 2.08 -1.26 -4.83 119.36 123.21 3f7j n ILE 234 Ca -0.14 -0.54 -0.41 0.00 0.56 0.00 0.00 62.75 62.22 3f7j n ILE 234 Cb 0.56 -1.39 -0.05 0.00 -0.75 0.00 0.00 39.64 38.02 3f7j n ILE 234 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 3f7j s LYS 235 N -2.49 4.70 0.25 0.38 1.02 -1.26 -4.53 119.74 117.81 3f7j s LYS 235 Ca -0.33 1.44 -0.03 0.00 0.02 0.00 0.00 55.97 57.06 3f7j s LYS 235 Cb 0.09 -3.37 0.43 0.00 -0.52 0.00 0.00 37.83 34.45 3f7j s LYS 235 CO 0.57 0.24 1.81 1.49 -0.92 0.00 0.00 175.35 178.54 3f7j h GLU 236 N 5.48 0.80 -0.90 1.68 4.81 -1.95 0.35 114.58 124.86 3f7j h GLU 236 Ca -0.43 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 58.79 3f7j h GLU 236 Cb 1.21 -0.18 -0.05 0.00 0.63 0.00 0.00 28.75 30.36 3f7j h GLU 236 CO 0.71 0.53 0.59 1.12 -0.73 0.00 0.00 179.01 181.24 3f7j h HIS 237 N 0.83 1.09 -0.06 0.92 2.07 -1.99 -0.11 115.15 117.89 3f7j h HIS 237 Ca 0.42 0.03 -0.16 0.00 -2.85 0.00 0.00 60.37 57.81 3f7j h HIS 237 Cb 0.39 -0.36 0.01 0.00 2.57 0.00 0.00 27.41 30.01 3f7j h HIS 237 CO -0.05 0.63 -0.57 0.00 -3.07 0.00 0.00 177.93 174.86 3f7j h ARG 238 N 1.12 0.50 -0.57 5.12 2.47 -1.60 -1.60 114.38 119.81 3f7j h ARG 238 Ca 0.36 -0.45 0.12 0.00 -1.26 0.00 0.00 59.98 58.74 3f7j h ARG 238 Cb 0.03 0.11 -0.11 0.00 -1.65 0.00 0.00 29.97 28.36 3f7j h ARG 238 CO -0.11 1.09 -0.10 0.82 0.56 0.00 0.00 179.97 182.23 3f7j h ILE 239 N 0.06 0.45 -0.38 2.04 2.04 -0.82 -0.34 117.51 120.56 3f7j h ILE 239 Ca -0.05 -0.01 -0.06 0.00 1.00 0.00 0.00 64.86 65.73 3f7j h ILE 239 Cb 1.24 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 3f7j h ILE 239 CO 0.12 0.01 -0.01 0.40 0.00 0.00 0.00 178.15 178.66 3f7j h ILE 240 N 0.03 1.26 -0.31 -0.67 2.04 -1.05 -3.28 117.51 115.54 3f7j h ILE 240 Ca 0.28 -1.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.09 3f7j h ILE 240 Cb 0.44 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 3f7j h ILE 240 CO -0.56 0.34 0.07 -0.08 0.00 0.00 0.00 178.15 177.92 3f7j h GLU 241 N 0.51 0.49 -0.43 2.37 4.81 -0.82 -2.87 114.58 118.63 3f7j h GLU 241 Ca 0.11 -0.12 0.10 0.00 -0.13 0.00 0.00 59.36 59.32 3f7j h GLU 241 Cb 0.49 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 3f7j h GLU 241 CO 0.02 0.57 0.30 -0.91 -0.73 0.00 0.00 179.01 178.26 3f7j h ASN 242 N 0.33 0.12 0.30 1.04 2.35 -1.15 -1.21 115.58 117.37 3f7j h ASN 242 Ca 0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 3f7j h ASN 242 Cb 0.29 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.64 3f7j h ASN 242 CO 0.00 0.07 -0.44 0.00 -1.65 0.00 0.00 177.43 175.41 3f7j n ALA 243 N -2.58 3.45 -2.13 -0.83 0.00 -1.10 -4.58 120.51 112.74 3f7j n ALA 243 Ca 0.07 -0.42 -0.42 0.00 0.00 0.00 0.00 53.44 52.67 3f7j n ALA 243 Cb 0.42 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.80 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 -1.02 5.33 0.00 0.00 2.03 -0.46 -4.42 116.55 118.01 3f7j n ASP 244 Ca 0.09 -3.04 0.00 0.00 0.52 0.00 0.00 54.79 52.35 3f7j n ASP 244 Cb 0.35 -1.50 0.00 0.00 -0.72 0.00 0.00 41.12 39.25 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 3.49 0.51 -0.48 5.18 -5.35 -1.26 -4.78 119.36 116.67 3f7j n ILE 245 Ca 0.46 -0.51 0.10 0.00 -0.27 0.00 0.00 62.75 62.53 3f7j n ILE 245 Cb 0.35 0.76 0.32 0.00 -1.74 0.00 0.00 39.64 39.33 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 -0.25 1.16 -0.99 4.28 3.01 -1.26 -4.26 117.46 119.15 3f7j n PHE 246 Ca 0.00 -0.56 0.05 0.00 1.01 0.00 0.00 57.45 57.95 3f7j n PHE 246 Cb 0.36 -0.12 0.07 0.00 -0.01 0.00 0.00 39.48 39.79 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 1.27 1.67 -3.82 4.37 5.75 -1.26 -4.92 116.55 119.61 3f7j n ASP 247 Ca 0.24 -2.49 -0.10 0.00 -0.01 0.00 0.00 54.79 52.44 3f7j n ASP 247 Cb 0.73 -0.26 -0.06 0.00 -1.03 0.00 0.00 41.12 40.50 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 -1.72 0.11 -0.00 2.11 -0.12 -1.26 -5.17 117.98 111.93 3f7j s PHE 248 Ca 0.17 -0.47 0.00 0.00 -0.05 0.00 0.00 56.93 56.58 3f7j s PHE 248 Cb 0.15 0.11 -0.00 0.00 -0.63 0.00 0.00 43.02 42.64 3f7j s PHE 248 CO 0.02 -0.73 -0.01 -1.83 -0.05 0.00 0.00 175.22 172.62 3f7j s GLU 249 N -3.89 0.05 -0.10 1.99 -1.05 -1.26 -5.04 118.70 109.39 3f7j s GLU 249 Ca 0.10 -0.03 -0.24 0.00 -0.15 0.00 0.00 54.97 54.65 3f7j s GLU 249 Cb 0.02 -0.04 -0.03 0.00 -0.44 0.00 0.00 34.13 33.64 3f7j s GLU 249 CO -0.05 0.01 0.74 -0.51 0.95 0.00 0.00 175.26 176.40 3f7j s LEU 250 N -0.04 4.26 1.07 1.83 1.43 -1.26 -5.07 118.68 120.91 3f7j s LEU 250 Ca -0.00 1.17 -0.12 0.00 -1.03 0.00 0.00 54.13 54.15 3f7j s LEU 250 Cb -0.00 -3.12 0.23 0.00 0.03 0.00 0.00 46.19 43.32 3f7j s LEU 250 CO -0.00 -0.21 1.06 -0.94 0.23 0.00 0.00 176.35 176.49 3f7j s SER 251 N 0.95 1.80 0.25 2.29 1.04 -1.26 -4.78 113.70 113.98 3f7j s SER 251 Ca 0.37 1.55 -0.02 0.00 0.48 0.00 0.00 55.95 58.33 3f7j s SER 251 Cb -0.17 -2.25 0.30 0.00 0.10 0.00 0.00 66.02 64.00 3f7j s SER 251 CO 0.16 -3.69 1.72 -0.61 0.98 0.00 0.00 173.24 171.80 3f7j h GLN 252 N -2.28 0.75 -0.52 4.02 5.75 -1.99 -1.50 115.11 119.34 3f7j h GLN 252 Ca -0.56 -0.24 -0.02 0.00 -0.15 0.00 0.00 58.65 57.68 3f7j h GLN 252 Cb 1.32 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.78 3f7j h GLN 252 CO 0.51 0.82 0.24 1.49 -2.65 0.00 0.00 178.83 179.24 3f7j h GLU 253 N 0.68 0.76 -0.16 1.69 4.81 -1.99 -1.09 114.58 119.28 3f7j h GLU 253 Ca 0.12 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3f7j h GLU 253 Cb 0.56 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 3f7j h GLU 253 CO 0.03 0.65 0.11 -0.44 -0.73 0.00 0.00 179.01 178.63 3f7j h ASP 254 N 0.70 0.19 -0.64 1.04 3.45 -1.85 -1.30 116.42 118.02 3f7j h ASP 254 Ca 0.18 -0.01 0.10 0.00 0.43 0.00 0.00 57.03 57.73 3f7j h ASP 254 Cb 0.14 -0.05 -0.08 0.00 -0.56 0.00 0.00 39.33 38.79 3f7j h ASP 254 CO -0.02 0.15 0.24 0.24 -1.57 0.00 0.00 179.24 178.28 3f7j h MET 255 N 0.22 0.40 -0.52 3.56 2.86 -1.08 -1.15 114.93 119.22 3f7j h MET 255 Ca 0.06 -0.02 -0.12 0.00 -2.06 0.00 0.00 59.70 57.55 3f7j h MET 255 Cb -0.02 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.54 3f7j h MET 255 CO -0.01 0.27 -0.16 -0.44 1.06 0.00 0.00 176.91 177.63 3f7j h ASP 256 N 0.41 1.04 -0.59 1.22 3.32 -0.99 -1.52 116.42 119.32 3f7j h ASP 256 Ca 0.33 -0.37 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 3f7j h ASP 256 Cb 0.42 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 3f7j h ASP 256 CO -0.33 1.18 0.20 0.11 -1.72 0.00 0.00 179.24 178.68 3f7j h LYS 257 N 0.90 0.94 -0.30 3.56 1.57 -0.78 -2.02 116.57 120.45 3f7j h LYS 257 Ca 0.13 -0.18 -0.10 0.00 -1.87 0.00 0.00 60.65 58.63 3f7j h LYS 257 Cb 0.74 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 3f7j h LYS 257 CO 0.06 0.81 -0.21 0.82 -0.57 0.00 0.00 179.45 180.35 3f7j h ILE 258 N 0.92 1.30 0.00 1.86 2.04 -1.00 -2.83 117.51 119.79 3f7j h ILE 258 Ca 0.21 -1.35 -0.01 0.00 1.00 0.00 0.00 64.86 64.70 3f7j h ILE 258 Cb 0.25 1.52 -0.00 0.00 -0.74 0.00 0.00 36.82 37.85 3f7j h ILE 258 CO -0.01 0.43 -0.07 0.44 0.00 0.00 0.00 178.15 178.95 3f7j h ASP 259 N 0.42 0.00 0.73 1.72 3.32 -0.87 -1.40 116.42 120.34 3f7j h ASP 259 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 3f7j h ASP 259 Cb 0.76 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.31 3f7j h ASP 259 CO 0.06 0.07 0.00 0.00 -1.72 0.00 0.00 179.24 177.64 3f7j n ALA 260 N -2.35 1.77 1.01 3.45 0.00 -0.80 -2.56 120.51 121.03 3f7j n ALA 260 Ca -0.02 0.01 0.10 0.00 0.00 0.00 0.00 53.44 53.52 3f7j n ALA 260 Cb 0.16 -1.35 0.52 0.00 0.00 0.00 0.00 19.45 18.78 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 -1.92 0.00 -4.74 0.00 4.77 -0.53 -4.90 117.00 109.69 3f7j n LEU 261 Ca 0.03 0.21 -0.42 0.00 -0.03 0.00 0.00 56.01 55.81 3f7j n LEU 261 Cb 0.23 -0.21 -0.02 0.00 -2.33 0.00 0.00 43.42 41.09 3f7j n LEU 261 CO 0.19 -0.08 1.21 0.21 -1.33 0.00 0.00 177.39 177.59 3f7j s ASN 262 N -2.42 6.50 -0.00 -1.43 2.47 -0.87 -4.26 114.94 114.93 3f7j s ASN 262 Ca 0.21 2.79 0.00 0.00 0.42 0.00 0.00 52.86 56.29 3f7j s ASN 262 Cb 0.13 -2.62 0.01 0.00 -1.45 0.00 0.00 41.25 37.32 3f7j s ASN 262 CO 0.28 -0.83 0.77 0.29 -3.72 0.00 0.00 177.10 173.88 3f7j n LYS 263 N 2.68 0.09 -4.08 0.43 5.02 -0.55 -4.99 118.16 116.76 3f7j n LYS 263 Ca 0.09 -0.81 -0.37 0.00 -2.02 0.00 0.00 58.31 55.21 3f7j n LYS 263 Cb 0.38 -0.53 -0.02 0.00 -0.02 0.00 0.00 35.03 34.84 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 -0.04 -2.14 -4.21 4.39 8.00 -0.45 -4.94 116.55 117.16 3f7j n ASP 264 Ca 0.00 -1.21 -0.34 0.00 0.71 0.00 0.00 54.79 53.95 3f7j n ASP 264 Cb 0.60 -2.10 -0.15 0.00 -0.02 0.00 0.00 41.12 39.45 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 -7.09 3.07 -0.11 -1.24 2.12 -0.45 -4.99 118.70 110.01 3f7j s GLU 265 Ca 0.27 -0.81 -0.04 0.00 0.36 0.00 0.00 54.97 54.75 3f7j s GLU 265 Cb -0.13 -2.85 -0.04 0.00 0.26 0.00 0.00 34.13 31.37 3f7j s GLU 265 CO 0.95 -0.27 0.05 1.03 -0.54 0.00 0.00 175.26 176.48 3f7j s ARG 266 N 1.36 3.23 0.05 4.30 0.52 -1.26 -4.32 118.95 122.83 3f7j s ARG 266 Ca 0.04 -0.32 0.22 0.00 -0.52 0.00 0.00 55.73 55.15 3f7j s ARG 266 Cb -0.15 -2.95 -0.10 0.00 0.52 0.00 0.00 34.95 32.28 3f7j s ARG 266 CO -0.07 0.67 0.86 1.33 0.02 0.00 0.00 175.30 178.11 3f7j n VAL 267 N 2.27 0.19 -3.32 3.52 0.24 -1.26 -4.94 118.33 115.02 3f7j n VAL 267 Ca -0.19 -0.36 -0.20 0.00 -2.04 0.00 0.00 64.34 61.56 3f7j n VAL 267 Cb 0.54 0.11 0.00 0.00 -1.47 0.00 0.00 33.84 33.02 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 -3.99 2.03 0.79 7.63 0.00 -1.26 -5.09 107.32 107.43 3f7j s GLY 268 Ca -0.00 -1.80 -0.14 0.00 0.00 0.00 0.00 44.72 42.79 3f7j s GLY 268 CO 0.84 -1.65 1.22 -1.05 0.00 0.00 0.00 173.10 172.46 3f7j n PRO 269 N -1.79 0.29 -2.82 2.90 -0.02 -1.26 -4.99 135.00 127.31 3f7j n PRO 269 Ca 0.07 0.17 -0.41 0.00 -2.02 0.00 0.00 63.50 61.30 3f7j n PRO 269 Cb 0.61 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.60 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 -2.04 7.19 0.49 2.55 3.84 -1.26 -4.95 114.94 120.76 3f7j s ASN 270 Ca 0.75 1.44 0.32 0.00 0.21 0.00 0.00 52.86 55.58 3f7j s ASN 270 Cb -0.30 -2.51 1.41 0.00 -0.55 0.00 0.00 41.25 39.30 3f7j s ASN 270 CO 0.49 -0.28 1.96 1.55 -2.79 0.00 0.00 177.10 178.03 3f7j h PRO 271 N 6.93 0.00 0.00 0.43 0.13 -1.93 0.25 132.00 137.81 3f7j h PRO 271 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 3f7j h PRO 271 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3f7j h PRO 271 CO 0.78 0.00 -0.08 -0.25 -0.23 0.00 0.00 178.00 178.22 3f7j n ASP 272 N -2.85 0.34 -0.06 1.44 8.00 -1.26 -3.81 116.55 118.35 3f7j n ASP 272 Ca 0.00 0.44 -0.05 0.00 0.71 0.00 0.00 54.79 55.89 3f7j n ASP 272 Cb 0.24 -0.49 -0.11 0.00 -0.02 0.00 0.00 41.12 40.75 3f7j n ASP 272 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3f7j n GLU 273 N -1.77 1.68 -2.71 -1.24 1.02 0.76 -4.78 120.64 113.59 3f7j n GLU 273 Ca 0.06 -0.02 -0.43 0.00 -0.02 0.00 0.00 57.16 56.75 3f7j n GLU 273 Cb 0.37 -1.34 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 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 -2.45 5.05 -4.50 -4.62 7.94 -0.40 -4.94 117.00 113.08 3f7j n LEU 274 Ca -0.20 -4.12 -0.41 0.00 -1.11 0.00 0.00 56.01 50.17 3f7j n LEU 274 Cb 0.88 -1.70 -0.10 0.00 0.53 0.00 0.00 43.42 43.03 3f7j n LEU 274 CO 0.29 0.36 -0.10 -0.76 -1.11 0.00 0.00 177.39 176.07 3f7j s LEU 275 N 3.25 4.74 0.00 -1.96 1.43 -1.26 -4.21 118.68 120.66 3f7j s LEU 275 Ca 0.50 -0.60 0.00 0.00 -1.03 0.00 0.00 54.13 53.00 3f7j s LEU 275 Cb 0.02 -2.15 0.00 0.00 0.03 0.00 0.00 46.19 44.09 3f7j s LEU 275 CO 0.05 -0.31 0.41 2.22 0.23 0.00 0.00 176.35 178.95